NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
603146 | 2n94 | 26691 | cing | 4-filtered-FRED | STAR | entry | full | 884 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2n94 # This FRED archive file contains, for PDB entry <2n94>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2n94 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2n94 _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 5471.04 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 $Box_C_D_snoRNA_protein_1 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_Box_C_D_snoRNA_protein_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Box C D snoRNA protein 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GPHMAVLCGVCGIKEFKYKCPRCLVQTCSLECSKKHKTRDNCSGQTHD _Entity.Number_of_monomers 48 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 PRO . 1 1 3 HIS . 1 1 4 MET . 1 1 5 ALA . 1 1 6 VAL . 1 1 7 LEU . 1 1 8 CYS . 1 1 9 GLY . 1 1 10 VAL . 1 1 11 CYS . 1 1 12 GLY . 1 1 13 ILE . 1 1 14 LYS . 1 1 15 GLU . 1 1 16 PHE . 1 1 17 LYS . 1 1 18 TYR . 1 1 19 LYS . 1 1 20 CYS . 1 1 21 PRO . 1 1 22 ARG . 1 1 23 CYS . 1 1 24 LEU . 1 1 25 VAL . 1 1 26 GLN . 1 1 27 THR . 1 1 28 CYS . 1 1 29 SER . 1 1 30 LEU . 1 1 31 GLU . 1 1 32 CYS . 1 1 33 SER . 1 1 34 LYS . 1 1 35 LYS . 1 1 36 HIS . 1 1 37 LYS . 1 1 38 THR . 1 1 39 ARG . 1 1 40 ASP . 1 1 41 ASN . 1 1 42 CYS . 1 1 43 SER . 1 1 44 GLY . 1 1 45 GLN . 1 1 46 THR . 1 1 47 HIS . 1 1 48 ASP . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 PRO 2 2 1 1 HIS 3 3 1 1 MET 4 4 1 1 ALA 5 5 1 1 VAL 6 6 1 1 LEU 7 7 1 1 CYS 8 8 1 1 GLY 9 9 1 1 VAL 10 10 1 1 CYS 11 11 1 1 GLY 12 12 1 1 ILE 13 13 1 1 LYS 14 14 1 1 GLU 15 15 1 1 PHE 16 16 1 1 LYS 17 17 1 1 TYR 18 18 1 1 LYS 19 19 1 1 CYS 20 20 1 1 PRO 21 21 1 1 ARG 22 22 1 1 CYS 23 23 1 1 LEU 24 24 1 1 VAL 25 25 1 1 GLN 26 26 1 1 THR 27 27 1 1 CYS 28 28 1 1 SER 29 29 1 1 LEU 30 30 1 1 GLU 31 31 1 1 CYS 32 32 1 1 SER 33 33 1 1 LYS 34 34 1 1 LYS 35 35 1 1 HIS 36 36 1 1 LYS 37 37 1 1 THR 38 38 1 1 ARG 39 39 1 1 ASP 40 40 1 1 ASN 41 41 1 1 CYS 42 42 1 1 SER 43 43 1 1 GLY 44 44 1 1 GLN 45 45 1 1 THR 46 46 1 1 HIS 47 47 1 1 ASP 48 48 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_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 1 . . . 1 1 673 1 . . . 1 1 674 1 . . . 1 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 725 1 . . . 1 1 726 1 . . . 1 1 727 1 . . . 1 1 728 1 . . . 1 1 729 1 . . . 1 1 730 1 . . . 1 1 731 1 . . . 1 1 732 1 . . . 1 1 733 1 . . . 1 1 734 1 . . . 1 1 735 1 . . . 1 1 736 1 . . . 1 1 737 1 . . . 1 1 738 1 . . . 1 1 739 1 . . . 1 1 740 1 . . . 1 1 741 1 . . . 1 1 742 1 . . . 1 1 743 1 . . . 1 1 744 1 . . . 1 1 745 1 . . . 1 1 746 1 . . . 1 1 747 1 . . . 1 1 748 1 . . . 1 1 749 1 . . . 1 1 750 1 . . . 1 1 751 1 . . . 1 1 752 1 . . . 1 1 753 1 . . . 1 1 754 1 . . . 1 1 755 1 . . . 1 1 756 1 . . . 1 1 757 1 . . . 1 1 758 1 . . . 1 1 759 1 . . . 1 1 760 1 . . . 1 1 761 1 . . . 1 1 762 1 . . . 1 1 763 1 . . . 1 1 764 1 . . . 1 1 765 1 . . . 1 1 766 1 . . . 1 1 767 1 . . . 1 1 768 1 . . . 1 1 769 1 . . . 1 1 770 1 . . . 1 1 771 1 . . . 1 1 772 1 . . . 1 1 773 1 . . . 1 1 774 1 . . . 1 1 775 1 . . . 1 1 776 1 . . . 1 1 777 1 . . . 1 1 778 1 . . . 1 1 779 1 . . . 1 1 780 1 . . . 1 1 781 1 . . . 1 1 782 1 . . . 1 1 783 1 . . . 1 1 784 1 . . . 1 1 785 1 . . . 1 1 786 1 . . . 1 1 787 1 . . . 1 1 788 1 . . . 1 1 789 1 . . . 1 1 790 1 . . . 1 1 791 1 . . . 1 1 792 1 . . . 1 1 793 1 . . . 1 1 794 1 . . . 1 1 795 1 . . . 1 1 796 1 . . . 1 1 797 1 . . . 1 1 798 1 . . . 1 1 799 1 . . . 1 1 800 1 . . . 1 1 801 1 . . . 1 1 802 1 . . . 1 1 803 1 . . . 1 1 804 1 . . . 1 1 805 1 . . . 1 1 806 1 . . . 1 1 807 1 . . . 1 1 808 1 . . . 1 1 809 1 . . . 1 1 810 1 . . . 1 1 811 1 . . . 1 1 812 1 . . . 1 1 813 1 . . . 1 1 814 1 . . . 1 1 815 1 . . . 1 1 816 1 . . . 1 1 817 1 . . . 1 1 818 1 . . . 1 1 819 1 . . . 1 1 820 1 . . . 1 1 821 1 . . . 1 1 822 1 . . . 1 1 823 1 . . . 1 1 824 1 . . . 1 1 825 1 . . . 1 1 826 1 . . . 1 1 827 1 . . . 1 1 828 1 . . . 1 1 829 1 . . . 1 1 830 1 . . . 1 1 831 1 . . . 1 1 832 1 . . . 1 1 833 1 . . . 1 1 834 1 . . . 1 1 835 1 . . . 1 1 836 1 . . . 1 1 837 1 . . . 1 1 838 1 . . . 1 1 839 1 . . . 1 1 840 1 . . . 1 1 841 1 . . . 1 1 842 1 . . . 1 1 843 1 . . . 1 1 844 1 . . . 1 1 845 1 . . . 1 1 846 1 . . . 1 1 847 1 . . . 1 1 848 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 15 GLU HA . 12 . HA 1 1 1 1 2 1 1 16 PHE H . 13 . HN 1 1 2 1 1 1 1 10 VAL H . 7 . HN 1 1 2 1 2 1 1 27 THR MG . 24 . HG2* 1 1 3 1 1 1 1 4 MET QB . 1 . HB* 1 1 3 1 2 1 1 5 ALA H . 2 . HN 1 1 4 1 1 1 1 5 ALA H . 2 . HN 1 1 4 1 2 1 1 5 ALA MB . 2 . HB* 1 1 5 1 1 1 1 39 ARG HG2 . 36 . HG2 1 1 5 1 2 1 1 40 ASP H . 37 . HN 1 1 6 1 1 1 1 39 ARG HG3 . 36 . HG1 1 1 6 1 2 1 1 40 ASP H . 37 . HN 1 1 7 1 1 1 1 30 LEU HA . 27 . HA 1 1 7 1 2 1 1 33 SER H . 30 . HN 1 1 8 1 1 1 1 11 CYS H . 8 . HN 1 1 8 1 2 1 1 12 GLY QA . 9 . HA* 1 1 9 1 1 1 1 11 CYS H . 8 . HN 1 1 9 1 2 1 1 11 CYS HB2 . 8 . HB2 1 1 10 1 1 1 1 17 LYS H . 14 . HN 1 1 10 1 2 1 1 17 LYS QB . 14 . HB* 1 1 11 1 1 1 1 27 THR MG . 24 . HG2* 1 1 11 1 2 1 1 33 SER H . 30 . HN 1 1 12 1 1 1 1 27 THR MG . 24 . HG2* 1 1 12 1 2 1 1 36 HIS H . 33 . HN 1 1 13 1 1 1 1 6 VAL QG . 3 . HG1* 1 1 13 1 2 1 1 16 PHE QD . 13 . HD* 1 1 14 1 1 1 1 17 LYS QB . 14 . HB* 1 1 14 1 2 1 1 18 TYR QD . 15 . HD* 1 1 15 1 1 1 1 17 LYS QB . 14 . HB* 1 1 15 1 2 1 1 18 TYR QE . 15 . HE* 1 1 16 1 1 1 1 17 LYS QD . 14 . HD* 1 1 16 1 2 1 1 18 TYR QE . 15 . HE* 1 1 17 1 1 1 1 6 VAL HB . 3 . HB 1 1 17 1 2 1 1 16 PHE QD . 13 . HD* 1 1 18 1 1 1 1 18 TYR HA . 15 . HA 1 1 18 1 2 1 1 18 TYR QD . 15 . HD* 1 1 19 1 1 1 1 18 TYR QE . 15 . HE* 1 1 19 1 2 1 1 29 SER HA . 26 . HA 1 1 20 1 1 1 1 46 THR HA . 43 . HA 1 1 20 1 2 1 1 46 THR MG . 43 . HG2* 1 1 21 1 1 1 1 19 LYS HG3 . 16 . HG1 1 1 21 1 2 1 1 24 LEU HA . 21 . HA 1 1 22 1 1 1 1 13 ILE HA . 10 . HA 1 1 22 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 23 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 23 1 2 1 1 32 CYS HA . 29 . HA 1 1 24 1 1 1 1 10 VAL HA . 7 . HA 1 1 24 1 2 1 1 10 VAL MG1 . 7 . HG1* 1 1 25 1 1 1 1 10 VAL HA . 7 . HA 1 1 25 1 2 1 1 10 VAL MG2 . 7 . HG2* 1 1 26 1 1 1 1 24 LEU HA . 21 . HA 1 1 26 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 27 1 1 1 1 30 LEU HA . 27 . HA 1 1 27 1 2 1 1 30 LEU MD2 . 27 . HD2* 1 1 28 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 28 1 2 1 1 11 CYS HB3 . 8 . HB1 1 1 29 1 1 1 1 27 THR MG . 24 . HG2* 1 1 29 1 2 1 1 32 CYS QB . 29 . HB1 1 1 30 1 1 1 1 13 ILE HB . 10 . HB 1 1 30 1 2 1 1 13 ILE MD . 10 . HD1* 1 1 31 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 31 1 2 1 1 35 LYS HB2 . 32 . HB2 1 1 32 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 32 1 2 1 1 35 LYS HB3 . 32 . HB1 1 1 33 1 1 1 1 7 LEU HB2 . 4 . HB2 1 1 33 1 2 1 1 7 LEU QD . 4 . HD1* 1 1 34 1 1 1 1 24 LEU HB2 . 21 . HB2 1 1 34 1 2 1 1 24 LEU QD . 21 . HD1* 1 1 35 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 35 1 2 1 1 22 ARG HD3 . 19 . HD1 1 1 36 1 1 1 1 20 CYS HA . 17 . HA 1 1 36 1 2 1 1 21 PRO QD . 18 . HD* 1 1 37 1 1 1 1 27 THR HB . 24 . HB 1 1 37 1 2 1 1 32 CYS QB . 29 . HB1 1 1 38 1 1 1 1 19 LYS QB . 16 . HB* 1 1 38 1 2 1 1 19 LYS QE . 16 . HE* 1 1 39 1 1 1 1 39 ARG QB . 36 . HB* 1 1 39 1 2 1 1 39 ARG HD2 . 36 . HD2 1 1 40 1 1 1 1 35 LYS HB3 . 32 . HB1 1 1 40 1 2 1 1 36 HIS QB . 33 . HB* 1 1 41 1 1 1 1 37 LYS QE . 34 . HE* 1 1 41 1 2 1 1 37 LYS QG . 34 . HG* 1 1 42 1 1 1 1 14 LYS HA . 11 . HA 1 1 42 1 2 1 1 14 LYS HG2 . 11 . HG2 1 1 43 1 1 1 1 16 PHE QD . 13 . HD* 1 1 43 1 2 1 1 17 LYS H . 14 . HN 1 1 44 1 1 1 1 17 LYS H . 14 . HN 1 1 44 1 2 1 1 18 TYR QD . 15 . HD* 1 1 45 1 1 1 1 16 PHE H . 13 . HN 1 1 45 1 2 1 1 16 PHE QD . 13 . HD* 1 1 46 1 1 1 1 21 PRO HG2 . 18 . HG2 1 1 46 1 2 1 1 44 GLY HA2 . 41 . HA2 1 1 47 1 1 1 1 31 GLU QB . 28 . HB1 1 1 47 1 2 1 1 32 CYS QB . 29 . HB2 1 1 48 1 1 1 1 10 VAL HB . 7 . HB 1 1 48 1 2 1 1 32 CYS QB . 29 . HB2 1 1 49 1 1 1 1 4 MET HA . 1 . HA 1 1 49 1 2 1 1 4 MET HG2 . 1 . HG2 1 1 50 1 1 1 1 4 MET HA . 1 . HA 1 1 50 1 2 1 1 4 MET HG3 . 1 . HG1 1 1 51 1 1 1 1 18 TYR HA . 15 . HA 1 1 51 1 2 1 1 19 LYS QB . 16 . HB* 1 1 52 1 1 1 1 17 LYS HA . 14 . HA 1 1 52 1 2 1 1 17 LYS QD . 14 . HD* 1 1 53 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 53 1 2 1 1 22 ARG HD2 . 19 . HD2 1 1 54 1 1 1 1 30 LEU HA . 27 . HA 1 1 54 1 2 1 1 30 LEU MD1 . 27 . HD1* 1 1 55 1 1 1 1 13 ILE HA . 10 . HA 1 1 55 1 2 1 1 13 ILE MD . 10 . HD1* 1 1 56 1 1 1 1 16 PHE QD . 13 . HD* 1 1 56 1 2 1 1 17 LYS QB . 14 . HB* 1 1 57 1 1 1 1 36 HIS HD2 . 33 . HD2 1 1 57 1 2 1 1 37 LYS QG . 34 . HG* 1 1 58 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 58 1 2 1 1 27 THR HA . 24 . HA 1 1 59 1 1 1 1 18 TYR QD . 15 . HD* 1 1 59 1 2 1 1 29 SER H . 26 . HN 1 1 60 1 1 1 1 22 ARG HD3 . 19 . HD1 1 1 60 1 2 1 1 45 GLN H . 42 . HN 1 1 61 1 1 1 1 29 SER HA . 26 . HA 1 1 61 1 2 1 1 31 GLU H . 28 . HN 1 1 62 1 1 1 1 8 CYS H . 5 . HN 1 1 62 1 2 1 1 16 PHE HB3 . 13 . HB1 1 1 63 1 1 1 1 33 SER H . 30 . HN 1 1 63 1 2 1 1 34 LYS QB . 31 . HB* 1 1 64 1 1 1 1 13 ILE H . 10 . HN 1 1 64 1 2 1 1 13 ILE HG12 . 10 . HG12 1 1 65 1 1 1 1 5 ALA MB . 2 . HB* 1 1 65 1 2 1 1 6 VAL H . 3 . HN 1 1 66 1 1 1 1 5 ALA MB . 2 . HB* 1 1 66 1 2 1 1 16 PHE QD . 13 . HD* 1 1 67 1 1 1 1 5 ALA MB . 2 . HB* 1 1 67 1 2 1 1 16 PHE QE . 13 . HE* 1 1 68 1 1 1 1 18 TYR QE . 15 . HE* 1 1 68 1 2 1 1 30 LEU MD2 . 27 . HD2* 1 1 69 1 1 1 1 18 TYR QD . 15 . HD* 1 1 69 1 2 1 1 30 LEU MD2 . 27 . HD2* 1 1 70 1 1 1 1 18 TYR QE . 15 . HE* 1 1 70 1 2 1 1 30 LEU MD1 . 27 . HD1* 1 1 71 1 1 1 1 16 PHE QD . 13 . HD* 1 1 71 1 2 1 1 17 LYS HA . 14 . HA 1 1 72 1 1 1 1 18 TYR QD . 15 . HD* 1 1 72 1 2 1 1 29 SER HA . 26 . HA 1 1 73 1 1 1 1 21 PRO HB3 . 18 . HB1 1 1 73 1 2 1 1 46 THR MG . 43 . HG2* 1 1 74 1 1 1 1 5 ALA MB . 2 . HB* 1 1 74 1 2 1 1 7 LEU QD . 4 . HD2* 1 1 75 1 1 1 1 20 CYS QB . 17 . HB* 1 1 75 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 76 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 76 1 2 1 1 26 GLN HA . 23 . HA 1 1 77 1 1 1 1 15 GLU H . 12 . HN 1 1 77 1 2 1 1 15 GLU QG . 12 . HG* 1 1 78 1 1 1 1 34 LYS QB . 31 . HB* 1 1 78 1 2 1 1 35 LYS H . 32 . HN 1 1 79 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 79 1 2 1 1 28 CYS H . 25 . HN 1 1 80 1 1 1 1 16 PHE H . 13 . HN 1 1 80 1 2 1 1 16 PHE HB2 . 13 . HB2 1 1 81 1 1 1 1 18 TYR H . 15 . HN 1 1 81 1 2 1 1 18 TYR HB2 . 15 . HB2 1 1 82 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 82 1 2 1 1 26 GLN HA . 23 . HA 1 1 83 1 1 1 1 18 TYR HB2 . 15 . HB2 1 1 83 1 2 1 1 26 GLN HA . 23 . HA 1 1 84 1 1 1 1 19 LYS QE . 16 . HE* 1 1 84 1 2 1 1 26 GLN HA . 23 . HA 1 1 85 1 1 1 1 20 CYS QB . 17 . HB* 1 1 85 1 2 1 1 21 PRO QD . 18 . HD* 1 1 86 1 1 1 1 6 VAL H . 3 . HN 1 1 86 1 2 1 1 6 VAL QG . 3 . HG1* 1 1 87 1 1 1 1 21 PRO HG2 . 18 . HG2 1 1 87 1 2 1 1 46 THR H . 43 . HN 1 1 88 1 1 1 1 6 VAL H . 3 . HN 1 1 88 1 2 1 1 16 PHE QD . 13 . HD* 1 1 89 1 1 1 1 6 VAL H . 3 . HN 1 1 89 1 2 1 1 16 PHE QE . 13 . HE* 1 1 90 1 1 1 1 16 PHE QD . 13 . HD* 1 1 90 1 2 1 1 26 GLN HA . 23 . HA 1 1 91 1 1 1 1 16 PHE QE . 13 . HE* 1 1 91 1 2 1 1 18 TYR HA . 15 . HA 1 1 92 1 1 1 1 5 ALA HA . 2 . HA 1 1 92 1 2 1 1 16 PHE QE . 13 . HE* 1 1 93 1 1 1 1 40 ASP H . 37 . HN 1 1 93 1 2 1 1 41 ASN HB2 . 38 . HB2 1 1 94 1 1 1 1 17 LYS HG3 . 14 . HG1 1 1 94 1 2 1 1 18 TYR QE . 15 . HE* 1 1 95 1 1 1 1 17 LYS QD . 14 . HD* 1 1 95 1 2 1 1 18 TYR QD . 15 . HD* 1 1 96 1 1 1 1 18 TYR QE . 15 . HE* 1 1 96 1 2 1 1 30 LEU HA . 27 . HA 1 1 97 1 1 1 1 45 GLN H . 42 . HN 1 1 97 1 2 1 1 46 THR HA . 43 . HA 1 1 98 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 98 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 99 1 1 1 1 17 LYS QB . 14 . HB* 1 1 99 1 2 1 1 17 LYS QE . 14 . HE* 1 1 100 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 100 1 2 1 1 32 CYS QB . 29 . HB1 1 1 101 1 1 1 1 37 LYS QB . 34 . HB* 1 1 101 1 2 1 1 37 LYS QE . 34 . HE* 1 1 102 1 1 1 1 34 LYS QB . 31 . HB* 1 1 102 1 2 1 1 37 LYS QE . 34 . HE* 1 1 103 1 1 1 1 22 ARG HA . 19 . HA 1 1 103 1 2 1 1 22 ARG HD3 . 19 . HD1 1 1 104 1 1 1 1 34 LYS HA . 31 . HA 1 1 104 1 2 1 1 37 LYS QE . 34 . HE* 1 1 105 1 1 1 1 5 ALA MB . 2 . HB* 1 1 105 1 2 1 1 15 GLU QB . 12 . HB* 1 1 106 1 1 1 1 9 GLY H . 6 . HN 1 1 106 1 2 1 1 27 THR MG . 24 . HG2* 1 1 107 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 107 1 2 1 1 16 PHE H . 13 . HN 1 1 108 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 108 1 2 1 1 11 CYS H . 8 . HN 1 1 109 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 109 1 2 1 1 36 HIS H . 33 . HN 1 1 110 1 1 1 1 17 LYS HG3 . 14 . HG1 1 1 110 1 2 1 1 18 TYR HA . 15 . HA 1 1 111 1 1 1 1 23 CYS HA . 20 . HA 1 1 111 1 2 1 1 24 LEU QD . 21 . HD1* 1 1 112 1 1 1 1 24 LEU HB3 . 21 . HB1 1 1 112 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 113 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 113 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 114 1 1 1 1 6 VAL QG . 3 . HG1* 1 1 114 1 2 1 1 8 CYS H . 5 . HN 1 1 115 1 1 1 1 7 LEU HB3 . 4 . HB1 1 1 115 1 2 1 1 8 CYS H . 5 . HN 1 1 116 1 1 1 1 46 THR H . 43 . HN 1 1 116 1 2 1 1 46 THR MG . 43 . HG2* 1 1 117 1 1 1 1 7 LEU HB3 . 4 . HB1 1 1 117 1 2 1 1 14 LYS H . 11 . HN 1 1 118 1 1 1 1 18 TYR QD . 15 . HD* 1 1 118 1 2 1 1 30 LEU HA . 27 . HA 1 1 119 1 1 1 1 17 LYS HG3 . 14 . HG1 1 1 119 1 2 1 1 18 TYR QD . 15 . HD* 1 1 120 1 1 1 1 18 TYR HB2 . 15 . HB2 1 1 120 1 2 1 1 19 LYS H . 16 . HN 1 1 121 1 1 1 1 11 CYS HB2 . 8 . HB2 1 1 121 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 122 1 1 1 1 29 SER HB2 . 26 . HB2 1 1 122 1 2 1 1 32 CYS H . 29 . HN 1 1 123 1 1 1 1 19 LYS H . 16 . HN 1 1 123 1 2 1 1 20 CYS HA . 17 . HA 1 1 124 1 1 1 1 43 SER HB2 . 40 . HB2 1 1 124 1 2 1 1 45 GLN QB . 42 . HB* 1 1 125 1 1 1 1 44 GLY HA3 . 41 . HA1 1 1 125 1 2 1 1 45 GLN QB . 42 . HB* 1 1 126 1 1 1 1 23 CYS HA . 20 . HA 1 1 126 1 2 1 1 24 LEU HG . 21 . HG 1 1 127 1 1 1 1 19 LYS H . 16 . HN 1 1 127 1 2 1 1 19 LYS HG3 . 16 . HG1 1 1 128 1 1 1 1 18 TYR QE . 15 . HE* 1 1 128 1 2 1 1 29 SER H . 26 . HN 1 1 129 1 1 1 1 19 LYS HG2 . 16 . HG2 1 1 129 1 2 1 1 24 LEU HB3 . 21 . HB1 1 1 130 1 1 1 1 20 CYS QB . 17 . HB* 1 1 130 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 131 1 1 1 1 35 LYS HA . 32 . HA 1 1 131 1 2 1 1 35 LYS QE . 32 . HE* 1 1 132 1 1 1 1 37 LYS QE . 34 . HE* 1 1 132 1 2 1 1 44 GLY HA2 . 41 . HA2 1 1 133 1 1 1 1 32 CYS QB . 29 . HB1 1 1 133 1 2 1 1 35 LYS HB2 . 32 . HB2 1 1 134 1 1 1 1 16 PHE QE . 13 . HE* 1 1 134 1 2 1 1 19 LYS QE . 16 . HE* 1 1 135 1 1 1 1 13 ILE H . 10 . HN 1 1 135 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 136 1 1 1 1 7 LEU QD . 4 . HD1* 1 1 136 1 2 1 1 13 ILE H . 10 . HN 1 1 137 1 1 1 1 10 VAL HB . 7 . HB 1 1 137 1 2 1 1 12 GLY H . 9 . HN 1 1 138 1 1 1 1 15 GLU QG . 12 . HG* 1 1 138 1 2 1 1 16 PHE QD . 13 . HD* 1 1 139 1 1 1 1 18 TYR QD . 15 . HD* 1 1 139 1 2 1 1 29 SER HB3 . 26 . HB1 1 1 140 1 1 1 1 18 TYR QE . 15 . HE* 1 1 140 1 2 1 1 30 LEU HB3 . 27 . HB1 1 1 141 1 1 1 1 10 VAL HB . 7 . HB 1 1 141 1 2 1 1 32 CYS HA . 29 . HA 1 1 142 1 1 1 1 31 GLU QB . 28 . HB1 1 1 142 1 2 1 1 32 CYS HA . 29 . HA 1 1 143 1 1 1 1 15 GLU HA . 12 . HA 1 1 143 1 2 1 1 16 PHE HB3 . 13 . HB1 1 1 144 1 1 1 1 6 VAL HB . 3 . HB 1 1 144 1 2 1 1 16 PHE HB3 . 13 . HB1 1 1 145 1 1 1 1 7 LEU HB2 . 4 . HB2 1 1 145 1 2 1 1 12 GLY QA . 9 . HA* 1 1 146 1 1 1 1 21 PRO QD . 18 . HD* 1 1 146 1 2 1 1 22 ARG HB2 . 19 . HB2 1 1 147 1 1 1 1 27 THR MG . 24 . HG2* 1 1 147 1 2 1 1 30 LEU HA . 27 . HA 1 1 148 1 1 1 1 11 CYS HB2 . 8 . HB2 1 1 148 1 2 1 1 13 ILE MD . 10 . HD1* 1 1 149 1 1 1 1 6 VAL QG . 3 . HG1* 1 1 149 1 2 1 1 16 PHE HB2 . 13 . HB2 1 1 150 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 150 1 2 1 1 13 ILE HG13 . 10 . HG11 1 1 151 1 1 1 1 6 VAL QG . 3 . HG1* 1 1 151 1 2 1 1 16 PHE HB3 . 13 . HB1 1 1 152 1 1 1 1 21 PRO HG2 . 18 . HG2 1 1 152 1 2 1 1 46 THR MG . 43 . HG2* 1 1 153 1 1 1 1 21 PRO HB2 . 18 . HB2 1 1 153 1 2 1 1 46 THR MG . 43 . HG2* 1 1 154 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 154 1 2 1 1 35 LYS HB2 . 32 . HB2 1 1 155 1 1 1 1 34 LYS HA . 31 . HA 1 1 155 1 2 1 1 37 LYS QG . 34 . HG* 1 1 156 1 1 1 1 31 GLU HA . 28 . HA 1 1 156 1 2 1 1 31 GLU HG3 . 28 . HG1 1 1 157 1 1 1 1 35 LYS QE . 32 . HE* 1 1 157 1 2 1 1 38 THR MG . 35 . HG2* 1 1 158 1 1 1 1 17 LYS QD . 14 . HD* 1 1 158 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 159 1 1 1 1 34 LYS HA . 31 . HA 1 1 159 1 2 1 1 36 HIS H . 33 . HN 1 1 160 1 1 1 1 18 TYR H . 15 . HN 1 1 160 1 2 1 1 27 THR HB . 24 . HB 1 1 161 1 1 1 1 10 VAL H . 7 . HN 1 1 161 1 2 1 1 32 CYS QB . 29 . HB2 1 1 162 1 1 1 1 21 PRO HG2 . 18 . HG2 1 1 162 1 2 1 1 45 GLN H . 42 . HN 1 1 163 1 1 1 1 5 ALA MB . 2 . HB* 1 1 163 1 2 1 1 15 GLU QG . 12 . HG* 1 1 164 1 1 1 1 2 PRO HB2 . -1 . HB2 1 1 164 1 2 1 1 4 MET HG2 . 1 . HG2 1 1 165 1 1 1 1 2 PRO HB2 . -1 . HB2 1 1 165 1 2 1 1 4 MET HG3 . 1 . HG1 1 1 166 1 1 1 1 7 LEU HA . 4 . HA 1 1 166 1 2 1 1 8 CYS HB2 . 5 . HB2 1 1 167 1 1 1 1 11 CYS H . 8 . HN 1 1 167 1 2 1 1 13 ILE H . 10 . HN 1 1 168 1 1 1 1 11 CYS H . 8 . HN 1 1 168 1 2 1 1 28 CYS H . 25 . HN 1 1 169 1 1 1 1 18 TYR H . 15 . HN 1 1 169 1 2 1 1 28 CYS H . 25 . HN 1 1 170 1 1 1 1 10 VAL H . 7 . HN 1 1 170 1 2 1 1 28 CYS H . 25 . HN 1 1 171 1 1 1 1 17 LYS QB . 14 . HB* 1 1 171 1 2 1 1 29 SER H . 26 . HN 1 1 172 1 1 1 1 30 LEU MD2 . 27 . HD2* 1 1 172 1 2 1 1 31 GLU H . 28 . HN 1 1 173 1 1 1 1 8 CYS HA . 5 . HA 1 1 173 1 2 1 1 28 CYS H . 25 . HN 1 1 174 1 1 1 1 46 THR HB . 43 . HB 1 1 174 1 2 1 1 48 ASP H . 45 . HN 1 1 175 1 1 1 1 17 LYS HA . 14 . HA 1 1 175 1 2 1 1 18 TYR QE . 15 . HE* 1 1 176 1 1 1 1 26 GLN HA . 23 . HA 1 1 176 1 2 1 1 27 THR HA . 24 . HA 1 1 177 1 1 1 1 18 TYR QD . 15 . HD* 1 1 177 1 2 1 1 26 GLN HA . 23 . HA 1 1 178 1 1 1 1 7 LEU HB3 . 4 . HB1 1 1 178 1 2 1 1 8 CYS HB3 . 5 . HB1 1 1 179 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 179 1 2 1 1 10 VAL MG2 . 7 . HG2* 1 1 180 1 1 1 1 26 GLN HA . 23 . HA 1 1 180 1 2 1 1 27 THR HB . 24 . HB 1 1 181 1 1 1 1 7 LEU H . 4 . HN 1 1 181 1 2 1 1 7 LEU QD . 4 . HD1* 1 1 182 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 182 1 2 1 1 15 GLU H . 12 . HN 1 1 183 1 1 1 1 17 LYS QB . 14 . HB* 1 1 183 1 2 1 1 29 SER HA . 26 . HA 1 1 184 1 1 1 1 17 LYS QD . 14 . HD* 1 1 184 1 2 1 1 29 SER HA . 26 . HA 1 1 185 1 1 1 1 43 SER HB3 . 40 . HB1 1 1 185 1 2 1 1 45 GLN QB . 42 . HB* 1 1 186 1 1 1 1 21 PRO HA . 18 . HA 1 1 186 1 2 1 1 46 THR MG . 43 . HG2* 1 1 187 1 1 1 1 9 GLY HA3 . 6 . HA1 1 1 187 1 2 1 1 10 VAL MG2 . 7 . HG2* 1 1 188 1 1 1 1 34 LYS QB . 31 . HB* 1 1 188 1 2 1 1 34 LYS QD . 31 . HD* 1 1 189 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 189 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 190 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 190 1 2 1 1 13 ILE MD . 10 . HD1* 1 1 191 1 1 1 1 16 PHE HA . 13 . HA 1 1 191 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 192 1 1 1 1 16 PHE HB3 . 13 . HB1 1 1 192 1 2 1 1 26 GLN HA . 23 . HA 1 1 193 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 193 1 2 1 1 8 CYS HB3 . 5 . HB1 1 1 194 1 1 1 1 17 LYS QB . 14 . HB* 1 1 194 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 195 1 1 1 1 20 CYS HA . 17 . HA 1 1 195 1 2 1 1 21 PRO HG3 . 18 . HG1 1 1 196 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 196 1 2 1 1 35 LYS HB3 . 32 . HB1 1 1 197 1 1 1 1 18 TYR QE . 15 . HE* 1 1 197 1 2 1 1 30 LEU HB2 . 27 . HB2 1 1 198 1 1 1 1 19 LYS HG2 . 16 . HG2 1 1 198 1 2 1 1 25 VAL H . 22 . HN 1 1 199 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 199 1 2 1 1 12 GLY H . 9 . HN 1 1 200 1 1 1 1 18 TYR H . 15 . HN 1 1 200 1 2 1 1 18 TYR QE . 15 . HE* 1 1 201 1 1 1 1 8 CYS H . 5 . HN 1 1 201 1 2 1 1 12 GLY H . 9 . HN 1 1 202 1 1 1 1 17 LYS H . 14 . HN 1 1 202 1 2 1 1 29 SER H . 26 . HN 1 1 203 1 1 1 1 8 CYS H . 5 . HN 1 1 203 1 2 1 1 27 THR HA . 24 . HA 1 1 204 1 1 1 1 31 GLU H . 28 . HN 1 1 204 1 2 1 1 32 CYS QB . 29 . HB2 1 1 205 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 205 1 2 1 1 36 HIS HD2 . 33 . HD2 1 1 206 1 1 1 1 18 TYR QD . 15 . HD* 1 1 206 1 2 1 1 19 LYS QB . 16 . HB* 1 1 207 1 1 1 1 37 LYS QB . 34 . HB* 1 1 207 1 2 1 1 41 ASN H . 38 . HN 1 1 208 1 1 1 1 39 ARG QB . 36 . HB* 1 1 208 1 2 1 1 41 ASN H . 38 . HN 1 1 209 1 1 1 1 17 LYS HA . 14 . HA 1 1 209 1 2 1 1 17 LYS QE . 14 . HE* 1 1 210 1 1 1 1 29 SER H . 26 . HN 1 1 210 1 2 1 1 32 CYS HA . 29 . HA 1 1 211 1 1 1 1 43 SER H . 40 . HN 1 1 211 1 2 1 1 44 GLY HA2 . 41 . HA2 1 1 212 1 1 1 1 6 VAL H . 3 . HN 1 1 212 1 2 1 1 6 VAL HB . 3 . HB 1 1 213 1 1 1 1 10 VAL H . 7 . HN 1 1 213 1 2 1 1 12 GLY H . 9 . HN 1 1 214 1 1 1 1 10 VAL H . 7 . HN 1 1 214 1 2 1 1 27 THR HA . 24 . HA 1 1 215 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 215 1 2 1 1 10 VAL H . 7 . HN 1 1 216 1 1 1 1 10 VAL H . 7 . HN 1 1 216 1 2 1 1 10 VAL MG2 . 7 . HG2* 1 1 217 1 1 1 1 10 VAL H . 7 . HN 1 1 217 1 2 1 1 10 VAL HB . 7 . HB 1 1 218 1 1 1 1 11 CYS H . 8 . HN 1 1 218 1 2 1 1 12 GLY H . 9 . HN 1 1 219 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 219 1 2 1 1 11 CYS H . 8 . HN 1 1 220 1 1 1 1 10 VAL HB . 7 . HB 1 1 220 1 2 1 1 11 CYS H . 8 . HN 1 1 221 1 1 1 1 11 CYS H . 8 . HN 1 1 221 1 2 1 1 11 CYS HB3 . 8 . HB1 1 1 222 1 1 1 1 11 CYS H . 8 . HN 1 1 222 1 2 1 1 32 CYS QB . 29 . HB1 1 1 223 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 223 1 2 1 1 11 CYS H . 8 . HN 1 1 224 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 224 1 2 1 1 12 GLY H . 9 . HN 1 1 225 1 1 1 1 6 VAL QG . 3 . HG1* 1 1 225 1 2 1 1 16 PHE H . 13 . HN 1 1 226 1 1 1 1 16 PHE HB3 . 13 . HB1 1 1 226 1 2 1 1 17 LYS H . 14 . HN 1 1 227 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 227 1 2 1 1 17 LYS H . 14 . HN 1 1 228 1 1 1 1 17 LYS H . 14 . HN 1 1 228 1 2 1 1 17 LYS HG2 . 14 . HG2 1 1 229 1 1 1 1 18 TYR QD . 15 . HD* 1 1 229 1 2 1 1 19 LYS H . 16 . HN 1 1 230 1 1 1 1 18 TYR HA . 15 . HA 1 1 230 1 2 1 1 19 LYS H . 16 . HN 1 1 231 1 1 1 1 18 TYR HB3 . 15 . HB1 1 1 231 1 2 1 1 19 LYS H . 16 . HN 1 1 232 1 1 1 1 19 LYS H . 16 . HN 1 1 232 1 2 1 1 19 LYS QB . 16 . HB* 1 1 233 1 1 1 1 25 VAL H . 22 . HN 1 1 233 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 234 1 1 1 1 24 LEU HG . 21 . HG 1 1 234 1 2 1 1 25 VAL H . 22 . HN 1 1 235 1 1 1 1 24 LEU HB2 . 21 . HB2 1 1 235 1 2 1 1 25 VAL H . 22 . HN 1 1 236 1 1 1 1 19 LYS H . 16 . HN 1 1 236 1 2 1 1 27 THR H . 24 . HN 1 1 237 1 1 1 1 27 THR H . 24 . HN 1 1 237 1 2 1 1 28 CYS H . 25 . HN 1 1 238 1 1 1 1 16 PHE HA . 13 . HA 1 1 238 1 2 1 1 28 CYS H . 25 . HN 1 1 239 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 239 1 2 1 1 28 CYS H . 25 . HN 1 1 240 1 1 1 1 27 THR MG . 24 . HG2* 1 1 240 1 2 1 1 28 CYS H . 25 . HN 1 1 241 1 1 1 1 10 VAL HB . 7 . HB 1 1 241 1 2 1 1 28 CYS H . 25 . HN 1 1 242 1 1 1 1 29 SER H . 26 . HN 1 1 242 1 2 1 1 32 CYS H . 29 . HN 1 1 243 1 1 1 1 27 THR HA . 24 . HA 1 1 243 1 2 1 1 29 SER H . 26 . HN 1 1 244 1 1 1 1 27 THR HB . 24 . HB 1 1 244 1 2 1 1 29 SER H . 26 . HN 1 1 245 1 1 1 1 28 CYS HB3 . 25 . HB1 1 1 245 1 2 1 1 29 SER H . 26 . HN 1 1 246 1 1 1 1 29 SER H . 26 . HN 1 1 246 1 2 1 1 32 CYS QB . 29 . HB1 1 1 247 1 1 1 1 28 CYS HB2 . 25 . HB2 1 1 247 1 2 1 1 29 SER H . 26 . HN 1 1 248 1 1 1 1 31 GLU H . 28 . HN 1 1 248 1 2 1 1 33 SER H . 30 . HN 1 1 249 1 1 1 1 31 GLU H . 28 . HN 1 1 249 1 2 1 1 32 CYS H . 29 . HN 1 1 250 1 1 1 1 29 SER H . 26 . HN 1 1 250 1 2 1 1 31 GLU H . 28 . HN 1 1 251 1 1 1 1 29 SER HB3 . 26 . HB1 1 1 251 1 2 1 1 31 GLU H . 28 . HN 1 1 252 1 1 1 1 29 SER HB2 . 26 . HB2 1 1 252 1 2 1 1 31 GLU H . 28 . HN 1 1 253 1 1 1 1 30 LEU HB3 . 27 . HB1 1 1 253 1 2 1 1 31 GLU H . 28 . HN 1 1 254 1 1 1 1 30 LEU HB2 . 27 . HB2 1 1 254 1 2 1 1 31 GLU H . 28 . HN 1 1 255 1 1 1 1 31 GLU H . 28 . HN 1 1 255 1 2 1 1 31 GLU QB . 28 . HB2 1 1 256 1 1 1 1 30 LEU MD1 . 27 . HD1* 1 1 256 1 2 1 1 31 GLU H . 28 . HN 1 1 257 1 1 1 1 28 CYS H . 25 . HN 1 1 257 1 2 1 1 32 CYS H . 29 . HN 1 1 258 1 1 1 1 27 THR MG . 24 . HG2* 1 1 258 1 2 1 1 32 CYS H . 29 . HN 1 1 259 1 1 1 1 31 GLU QB . 28 . HB1 1 1 259 1 2 1 1 32 CYS H . 29 . HN 1 1 260 1 1 1 1 33 SER H . 30 . HN 1 1 260 1 2 1 1 34 LYS H . 31 . HN 1 1 261 1 1 1 1 40 ASP H . 37 . HN 1 1 261 1 2 1 1 41 ASN H . 38 . HN 1 1 262 1 1 1 1 36 HIS HA . 33 . HA 1 1 262 1 2 1 1 40 ASP H . 37 . HN 1 1 263 1 1 1 1 39 ARG QB . 36 . HB* 1 1 263 1 2 1 1 40 ASP H . 37 . HN 1 1 264 1 1 1 1 41 ASN HB2 . 38 . HB2 1 1 264 1 2 1 1 41 ASN HD22 . 38 . HD22 1 1 265 1 1 1 1 43 SER H . 40 . HN 1 1 265 1 2 1 1 43 SER HB3 . 40 . HB1 1 1 266 1 1 1 1 42 CYS HA . 39 . HA 1 1 266 1 2 1 1 43 SER H . 40 . HN 1 1 267 1 1 1 1 22 ARG HD3 . 19 . HD1 1 1 267 1 2 1 1 43 SER H . 40 . HN 1 1 268 1 1 1 1 22 ARG HD2 . 19 . HD2 1 1 268 1 2 1 1 43 SER H . 40 . HN 1 1 269 1 1 1 1 43 SER H . 40 . HN 1 1 269 1 2 1 1 43 SER HB2 . 40 . HB2 1 1 270 1 1 1 1 22 ARG HD2 . 19 . HD2 1 1 270 1 2 1 1 45 GLN H . 42 . HN 1 1 271 1 1 1 1 22 ARG QG . 19 . HG* 1 1 271 1 2 1 1 45 GLN H . 42 . HN 1 1 272 1 1 1 1 21 PRO HB2 . 18 . HB2 1 1 272 1 2 1 1 45 GLN H . 42 . HN 1 1 273 1 1 1 1 45 GLN QB . 42 . HB* 1 1 273 1 2 1 1 45 GLN HE22 . 42 . HE22 1 1 274 1 1 1 1 21 PRO HB2 . 18 . HB2 1 1 274 1 2 1 1 46 THR H . 43 . HN 1 1 275 1 1 1 1 15 GLU QG . 12 . HG* 1 1 275 1 2 1 1 16 PHE H . 13 . HN 1 1 276 1 1 1 1 5 ALA H . 2 . HN 1 1 276 1 2 1 1 6 VAL H . 3 . HN 1 1 277 1 1 1 1 46 THR HA . 43 . HA 1 1 277 1 2 1 1 48 ASP H . 45 . HN 1 1 278 1 1 1 1 5 ALA HA . 2 . HA 1 1 278 1 2 1 1 6 VAL H . 3 . HN 1 1 279 1 1 1 1 5 ALA HA . 2 . HA 1 1 279 1 2 1 1 6 VAL HB . 3 . HB 1 1 280 1 1 1 1 6 VAL QG . 3 . HG1* 1 1 280 1 2 1 1 7 LEU HA . 4 . HA 1 1 281 1 1 1 1 9 GLY HA2 . 6 . HA2 1 1 281 1 2 1 1 27 THR MG . 24 . HG2* 1 1 282 1 1 1 1 9 GLY HA3 . 6 . HA1 1 1 282 1 2 1 1 27 THR MG . 24 . HG2* 1 1 283 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 283 1 2 1 1 35 LYS QD . 32 . HD* 1 1 284 1 1 1 1 10 VAL H . 7 . HN 1 1 284 1 2 1 1 10 VAL MG1 . 7 . HG1* 1 1 285 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 285 1 2 1 1 11 CYS HB2 . 8 . HB2 1 1 286 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 286 1 2 1 1 35 LYS QE . 32 . HE* 1 1 287 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 287 1 2 1 1 32 CYS QB . 29 . HB1 1 1 288 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 288 1 2 1 1 36 HIS HA . 33 . HA 1 1 289 1 1 1 1 11 CYS HB2 . 8 . HB2 1 1 289 1 2 1 1 13 ILE H . 10 . HN 1 1 290 1 1 1 1 11 CYS HB3 . 8 . HB1 1 1 290 1 2 1 1 13 ILE H . 10 . HN 1 1 291 1 1 1 1 7 LEU HB3 . 4 . HB1 1 1 291 1 2 1 1 12 GLY QA . 9 . HA* 1 1 292 1 1 1 1 7 LEU QD . 4 . HD1* 1 1 292 1 2 1 1 12 GLY QA . 9 . HA* 1 1 293 1 1 1 1 11 CYS HB2 . 8 . HB2 1 1 293 1 2 1 1 12 GLY QA . 9 . HA* 1 1 294 1 1 1 1 13 ILE HA . 10 . HA 1 1 294 1 2 1 1 13 ILE HG13 . 10 . HG11 1 1 295 1 1 1 1 7 LEU QD . 4 . HD1* 1 1 295 1 2 1 1 13 ILE HA . 10 . HA 1 1 296 1 1 1 1 12 GLY QA . 9 . HA* 1 1 296 1 2 1 1 13 ILE HG12 . 10 . HG12 1 1 297 1 1 1 1 13 ILE HG12 . 10 . HG12 1 1 297 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 298 1 1 1 1 12 GLY QA . 9 . HA* 1 1 298 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 299 1 1 1 1 14 LYS HA . 11 . HA 1 1 299 1 2 1 1 14 LYS HG3 . 11 . HG1 1 1 300 1 1 1 1 15 GLU HA . 12 . HA 1 1 300 1 2 1 1 15 GLU QG . 12 . HG* 1 1 301 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 301 1 2 1 1 15 GLU HA . 12 . HA 1 1 302 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 302 1 2 1 1 15 GLU QB . 12 . HB* 1 1 303 1 1 1 1 16 PHE HA . 13 . HA 1 1 303 1 2 1 1 17 LYS QB . 14 . HB* 1 1 304 1 1 1 1 17 LYS HA . 14 . HA 1 1 304 1 2 1 1 17 LYS HG2 . 14 . HG2 1 1 305 1 1 1 1 17 LYS HA . 14 . HA 1 1 305 1 2 1 1 17 LYS HG3 . 14 . HG1 1 1 306 1 1 1 1 19 LYS HG2 . 16 . HG2 1 1 306 1 2 1 1 24 LEU QD . 21 . HD1* 1 1 307 1 1 1 1 21 PRO HA . 18 . HA 1 1 307 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 308 1 1 1 1 21 PRO HA . 18 . HA 1 1 308 1 2 1 1 24 LEU H . 21 . HN 1 1 309 1 1 1 1 21 PRO HB3 . 18 . HB1 1 1 309 1 2 1 1 46 THR HA . 43 . HA 1 1 310 1 1 1 1 21 PRO HB3 . 18 . HB1 1 1 310 1 2 1 1 46 THR HB . 43 . HB 1 1 311 1 1 1 1 21 PRO HG3 . 18 . HG1 1 1 311 1 2 1 1 22 ARG QG . 19 . HG* 1 1 312 1 1 1 1 22 ARG HA . 19 . HA 1 1 312 1 2 1 1 22 ARG QG . 19 . HG* 1 1 313 1 1 1 1 22 ARG HA . 19 . HA 1 1 313 1 2 1 1 46 THR MG . 43 . HG2* 1 1 314 1 1 1 1 22 ARG HA . 19 . HA 1 1 314 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 315 1 1 1 1 22 ARG HA . 19 . HA 1 1 315 1 2 1 1 22 ARG HD2 . 19 . HD2 1 1 316 1 1 1 1 22 ARG HB3 . 19 . HB1 1 1 316 1 2 1 1 23 CYS HB2 . 20 . HB2 1 1 317 1 1 1 1 23 CYS HB2 . 20 . HB2 1 1 317 1 2 1 1 24 LEU HB2 . 21 . HB2 1 1 318 1 1 1 1 24 LEU HA . 21 . HA 1 1 318 1 2 1 1 25 VAL HA . 22 . HA 1 1 319 1 1 1 1 25 VAL HA . 22 . HA 1 1 319 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 320 1 1 1 1 19 LYS HG3 . 16 . HG1 1 1 320 1 2 1 1 26 GLN HG3 . 23 . HG1 1 1 321 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 321 1 2 1 1 26 GLN HG2 . 23 . HG2 1 1 322 1 1 1 1 25 VAL MG2 . 22 . HG2* 1 1 322 1 2 1 1 27 THR MG . 24 . HG2* 1 1 323 1 1 1 1 27 THR MG . 24 . HG2* 1 1 323 1 2 1 1 32 CYS HA . 29 . HA 1 1 324 1 1 1 1 31 GLU HA . 28 . HA 1 1 324 1 2 1 1 32 CYS HA . 29 . HA 1 1 325 1 1 1 1 31 GLU HA . 28 . HA 1 1 325 1 2 1 1 34 LYS HG2 . 31 . HG2 1 1 326 1 1 1 1 31 GLU HA . 28 . HA 1 1 326 1 2 1 1 31 GLU QB . 28 . HB2 1 1 327 1 1 1 1 31 GLU HA . 28 . HA 1 1 327 1 2 1 1 34 LYS QD . 31 . HD* 1 1 328 1 1 1 1 31 GLU HA . 28 . HA 1 1 328 1 2 1 1 31 GLU HG2 . 28 . HG2 1 1 329 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 329 1 2 1 1 32 CYS HA . 29 . HA 1 1 330 1 1 1 1 32 CYS HA . 29 . HA 1 1 330 1 2 1 1 35 LYS QD . 32 . HD* 1 1 331 1 1 1 1 32 CYS HA . 29 . HA 1 1 331 1 2 1 1 35 LYS HB3 . 32 . HB1 1 1 332 1 1 1 1 32 CYS HA . 29 . HA 1 1 332 1 2 1 1 35 LYS HB2 . 32 . HB2 1 1 333 1 1 1 1 28 CYS HB3 . 25 . HB1 1 1 333 1 2 1 1 32 CYS QB . 29 . HB2 1 1 334 1 1 1 1 34 LYS HA . 31 . HA 1 1 334 1 2 1 1 34 LYS HG2 . 31 . HG2 1 1 335 1 1 1 1 35 LYS HA . 32 . HA 1 1 335 1 2 1 1 35 LYS HB2 . 32 . HB2 1 1 336 1 1 1 1 35 LYS HA . 32 . HA 1 1 336 1 2 1 1 38 THR MG . 35 . HG2* 1 1 337 1 1 1 1 35 LYS HA . 32 . HA 1 1 337 1 2 1 1 35 LYS QD . 32 . HD* 1 1 338 1 1 1 1 37 LYS QB . 34 . HB* 1 1 338 1 2 1 1 41 ASN HA . 38 . HA 1 1 339 1 1 1 1 37 LYS QB . 34 . HB* 1 1 339 1 2 1 1 38 THR HA . 35 . HA 1 1 340 1 1 1 1 38 THR HA . 35 . HA 1 1 340 1 2 1 1 38 THR MG . 35 . HG2* 1 1 341 1 1 1 1 38 THR MG . 35 . HG2* 1 1 341 1 2 1 1 39 ARG HA . 36 . HA 1 1 342 1 1 1 1 39 ARG HA . 36 . HA 1 1 342 1 2 1 1 39 ARG HG3 . 36 . HG1 1 1 343 1 1 1 1 37 LYS QB . 34 . HB* 1 1 343 1 2 1 1 38 THR MG . 35 . HG2* 1 1 344 1 1 1 1 36 HIS HA . 33 . HA 1 1 344 1 2 1 1 39 ARG QB . 36 . HB* 1 1 345 1 1 1 1 40 ASP H . 37 . HN 1 1 345 1 2 1 1 41 ASN HA . 38 . HA 1 1 346 1 1 1 1 37 LYS QE . 34 . HE* 1 1 346 1 2 1 1 43 SER HA . 40 . HA 1 1 347 1 1 1 1 37 LYS QD . 34 . HD* 1 1 347 1 2 1 1 43 SER HA . 40 . HA 1 1 348 1 1 1 1 37 LYS QB . 34 . HB* 1 1 348 1 2 1 1 43 SER HA . 40 . HA 1 1 349 1 1 1 1 22 ARG QG . 19 . HG* 1 1 349 1 2 1 1 46 THR HA . 43 . HA 1 1 350 1 1 1 1 22 ARG QG . 19 . HG* 1 1 350 1 2 1 1 44 GLY HA3 . 41 . HA1 1 1 351 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 351 1 2 1 1 44 GLY HA3 . 41 . HA1 1 1 352 1 1 1 1 42 CYS HA . 39 . HA 1 1 352 1 2 1 1 43 SER HA . 40 . HA 1 1 353 1 1 1 1 17 LYS HA . 14 . HA 1 1 353 1 2 1 1 18 TYR QD . 15 . HD* 1 1 354 1 1 1 1 15 GLU HA . 12 . HA 1 1 354 1 2 1 1 16 PHE QD . 13 . HD* 1 1 355 1 1 1 1 16 PHE QD . 13 . HD* 1 1 355 1 2 1 1 26 GLN HB2 . 23 . HB2 1 1 356 1 1 1 1 20 CYS HA . 17 . HA 1 1 356 1 2 1 1 36 HIS HE1 . 33 . HE1 1 1 357 1 1 1 1 7 LEU H . 4 . HN 1 1 357 1 2 1 1 7 LEU HG . 4 . HG 1 1 358 1 1 1 1 6 VAL HB . 3 . HB 1 1 358 1 2 1 1 7 LEU H . 4 . HN 1 1 359 1 1 1 1 9 GLY H . 6 . HN 1 1 359 1 2 1 1 27 THR HA . 24 . HA 1 1 360 1 1 1 1 9 GLY H . 6 . HN 1 1 360 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 361 1 1 1 1 9 GLY H . 6 . HN 1 1 361 1 2 1 1 26 GLN HB2 . 23 . HB2 1 1 362 1 1 1 1 9 GLY H . 6 . HN 1 1 362 1 2 1 1 10 VAL HB . 7 . HB 1 1 363 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 363 1 2 1 1 9 GLY H . 6 . HN 1 1 364 1 1 1 1 8 CYS HA . 5 . HA 1 1 364 1 2 1 1 9 GLY H . 6 . HN 1 1 365 1 1 1 1 9 GLY H . 6 . HN 1 1 365 1 2 1 1 10 VAL H . 7 . HN 1 1 366 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 366 1 2 1 1 10 VAL H . 7 . HN 1 1 367 1 1 1 1 10 VAL H . 7 . HN 1 1 367 1 2 1 1 11 CYS HA . 8 . HA 1 1 368 1 1 1 1 9 GLY H . 6 . HN 1 1 368 1 2 1 1 11 CYS H . 8 . HN 1 1 369 1 1 1 1 22 ARG H . 19 . HN 1 1 369 1 2 1 1 23 CYS H . 20 . HN 1 1 370 1 1 1 1 22 ARG H . 19 . HN 1 1 370 1 2 1 1 22 ARG HB3 . 19 . HB1 1 1 371 1 1 1 1 22 ARG H . 19 . HN 1 1 371 1 2 1 1 22 ARG QG . 19 . HG* 1 1 372 1 1 1 1 20 CYS QB . 17 . HB* 1 1 372 1 2 1 1 22 ARG H . 19 . HN 1 1 373 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 373 1 2 1 1 13 ILE H . 10 . HN 1 1 374 1 1 1 1 8 CYS H . 5 . HN 1 1 374 1 2 1 1 16 PHE H . 13 . HN 1 1 375 1 1 1 1 16 PHE H . 13 . HN 1 1 375 1 2 1 1 17 LYS H . 14 . HN 1 1 376 1 1 1 1 16 PHE H . 13 . HN 1 1 376 1 2 1 1 16 PHE HB3 . 13 . HB1 1 1 377 1 1 1 1 15 GLU QB . 12 . HB* 1 1 377 1 2 1 1 16 PHE H . 13 . HN 1 1 378 1 1 1 1 17 LYS H . 14 . HN 1 1 378 1 2 1 1 27 THR H . 24 . HN 1 1 379 1 1 1 1 17 LYS H . 14 . HN 1 1 379 1 2 1 1 18 TYR H . 15 . HN 1 1 380 1 1 1 1 16 PHE HA . 13 . HA 1 1 380 1 2 1 1 17 LYS H . 14 . HN 1 1 381 1 1 1 1 17 LYS H . 14 . HN 1 1 381 1 2 1 1 18 TYR HB2 . 15 . HB2 1 1 382 1 1 1 1 17 LYS H . 14 . HN 1 1 382 1 2 1 1 17 LYS HG3 . 14 . HG1 1 1 383 1 1 1 1 18 TYR QD . 15 . HD* 1 1 383 1 2 1 1 20 CYS H . 17 . HN 1 1 384 1 1 1 1 20 CYS H . 17 . HN 1 1 384 1 2 1 1 26 GLN HA . 23 . HA 1 1 385 1 1 1 1 20 CYS H . 17 . HN 1 1 385 1 2 1 1 21 PRO QD . 18 . HD* 1 1 386 1 1 1 1 20 CYS H . 17 . HN 1 1 386 1 2 1 1 24 LEU HA . 21 . HA 1 1 387 1 1 1 1 19 LYS QB . 16 . HB* 1 1 387 1 2 1 1 20 CYS H . 17 . HN 1 1 388 1 1 1 1 23 CYS H . 20 . HN 1 1 388 1 2 1 1 25 VAL H . 22 . HN 1 1 389 1 1 1 1 20 CYS QB . 17 . HB* 1 1 389 1 2 1 1 23 CYS H . 20 . HN 1 1 390 1 1 1 1 22 ARG HB3 . 19 . HB1 1 1 390 1 2 1 1 23 CYS H . 20 . HN 1 1 391 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 391 1 2 1 1 23 CYS H . 20 . HN 1 1 392 1 1 1 1 22 ARG H . 19 . HN 1 1 392 1 2 1 1 24 LEU H . 21 . HN 1 1 393 1 1 1 1 24 LEU H . 21 . HN 1 1 393 1 2 1 1 24 LEU HA . 21 . HA 1 1 394 1 1 1 1 24 LEU H . 21 . HN 1 1 394 1 2 1 1 24 LEU HB3 . 21 . HB1 1 1 395 1 1 1 1 23 CYS HB3 . 20 . HB1 1 1 395 1 2 1 1 24 LEU H . 21 . HN 1 1 396 1 1 1 1 20 CYS QB . 17 . HB* 1 1 396 1 2 1 1 24 LEU H . 21 . HN 1 1 397 1 1 1 1 24 LEU H . 21 . HN 1 1 397 1 2 1 1 24 LEU HG . 21 . HG 1 1 398 1 1 1 1 24 LEU H . 21 . HN 1 1 398 1 2 1 1 25 VAL H . 22 . HN 1 1 399 1 1 1 1 25 VAL H . 22 . HN 1 1 399 1 2 1 1 26 GLN H . 23 . HN 1 1 400 1 1 1 1 25 VAL H . 22 . HN 1 1 400 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 401 1 1 1 1 25 VAL H . 22 . HN 1 1 401 1 2 1 1 25 VAL HB . 22 . HB 1 1 402 1 1 1 1 20 CYS QB . 17 . HB* 1 1 402 1 2 1 1 25 VAL H . 22 . HN 1 1 403 1 1 1 1 23 CYS HB2 . 20 . HB2 1 1 403 1 2 1 1 25 VAL H . 22 . HN 1 1 404 1 1 1 1 26 GLN H . 23 . HN 1 1 404 1 2 1 1 26 GLN HB3 . 23 . HB1 1 1 405 1 1 1 1 26 GLN H . 23 . HN 1 1 405 1 2 1 1 26 GLN HB2 . 23 . HB2 1 1 406 1 1 1 1 18 TYR H . 15 . HN 1 1 406 1 2 1 1 27 THR H . 24 . HN 1 1 407 1 1 1 1 20 CYS H . 17 . HN 1 1 407 1 2 1 1 27 THR H . 24 . HN 1 1 408 1 1 1 1 8 CYS HA . 5 . HA 1 1 408 1 2 1 1 27 THR H . 24 . HN 1 1 409 1 1 1 1 16 PHE HA . 13 . HA 1 1 409 1 2 1 1 27 THR H . 24 . HN 1 1 410 1 1 1 1 19 LYS HA . 16 . HA 1 1 410 1 2 1 1 27 THR H . 24 . HN 1 1 411 1 1 1 1 26 GLN HA . 23 . HA 1 1 411 1 2 1 1 27 THR H . 24 . HN 1 1 412 1 1 1 1 26 GLN HB3 . 23 . HB1 1 1 412 1 2 1 1 27 THR H . 24 . HN 1 1 413 1 1 1 1 26 GLN HG3 . 23 . HG1 1 1 413 1 2 1 1 27 THR H . 24 . HN 1 1 414 1 1 1 1 16 PHE HB3 . 13 . HB1 1 1 414 1 2 1 1 27 THR H . 24 . HN 1 1 415 1 1 1 1 18 TYR HB2 . 15 . HB2 1 1 415 1 2 1 1 27 THR H . 24 . HN 1 1 416 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 416 1 2 1 1 27 THR H . 24 . HN 1 1 417 1 1 1 1 17 LYS H . 14 . HN 1 1 417 1 2 1 1 28 CYS H . 25 . HN 1 1 418 1 1 1 1 27 THR HA . 24 . HA 1 1 418 1 2 1 1 28 CYS H . 25 . HN 1 1 419 1 1 1 1 28 CYS H . 25 . HN 1 1 419 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 420 1 1 1 1 29 SER H . 26 . HN 1 1 420 1 2 1 1 33 SER H . 30 . HN 1 1 421 1 1 1 1 28 CYS H . 25 . HN 1 1 421 1 2 1 1 29 SER H . 26 . HN 1 1 422 1 1 1 1 27 THR MG . 24 . HG2* 1 1 422 1 2 1 1 29 SER H . 26 . HN 1 1 423 1 1 1 1 32 CYS H . 29 . HN 1 1 423 1 2 1 1 34 LYS H . 31 . HN 1 1 424 1 1 1 1 32 CYS H . 29 . HN 1 1 424 1 2 1 1 33 SER H . 30 . HN 1 1 425 1 1 1 1 32 CYS H . 29 . HN 1 1 425 1 2 1 1 32 CYS QB . 29 . HB1 1 1 426 1 1 1 1 33 SER H . 30 . HN 1 1 426 1 2 1 1 35 LYS H . 32 . HN 1 1 427 1 1 1 1 31 GLU QB . 28 . HB1 1 1 427 1 2 1 1 33 SER H . 30 . HN 1 1 428 1 1 1 1 34 LYS H . 31 . HN 1 1 428 1 2 1 1 35 LYS H . 32 . HN 1 1 429 1 1 1 1 32 CYS HA . 29 . HA 1 1 429 1 2 1 1 35 LYS H . 32 . HN 1 1 430 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 430 1 2 1 1 35 LYS H . 32 . HN 1 1 431 1 1 1 1 27 THR MG . 24 . HG2* 1 1 431 1 2 1 1 35 LYS H . 32 . HN 1 1 432 1 1 1 1 36 HIS H . 33 . HN 1 1 432 1 2 1 1 37 LYS H . 34 . HN 1 1 433 1 1 1 1 36 HIS H . 33 . HN 1 1 433 1 2 1 1 36 HIS HB3 . 33 . HB1 1 1 434 1 1 1 1 36 HIS H . 33 . HN 1 1 434 1 2 1 1 36 HIS HB2 . 33 . HB2 1 1 435 1 1 1 1 35 LYS QD . 32 . HD* 1 1 435 1 2 1 1 36 HIS H . 33 . HN 1 1 436 1 1 1 1 35 LYS HB3 . 32 . HB1 1 1 436 1 2 1 1 36 HIS H . 33 . HN 1 1 437 1 1 1 1 35 LYS HB2 . 32 . HB2 1 1 437 1 2 1 1 36 HIS H . 33 . HN 1 1 438 1 1 1 1 40 ASP H . 37 . HN 1 1 438 1 2 1 1 40 ASP HB3 . 37 . HB1 1 1 439 1 1 1 1 40 ASP H . 37 . HN 1 1 439 1 2 1 1 40 ASP HB2 . 37 . HB2 1 1 440 1 1 1 1 41 ASN H . 38 . HN 1 1 440 1 2 1 1 41 ASN HB3 . 38 . HB1 1 1 441 1 1 1 1 40 ASP HB2 . 37 . HB2 1 1 441 1 2 1 1 41 ASN H . 38 . HN 1 1 442 1 1 1 1 37 LYS HA . 34 . HA 1 1 442 1 2 1 1 42 CYS H . 39 . HN 1 1 443 1 1 1 1 42 CYS H . 39 . HN 1 1 443 1 2 1 1 42 CYS HB3 . 39 . HB1 1 1 444 1 1 1 1 42 CYS H . 39 . HN 1 1 444 1 2 1 1 42 CYS HB2 . 39 . HB2 1 1 445 1 1 1 1 22 ARG H . 19 . HN 1 1 445 1 2 1 1 22 ARG HB2 . 19 . HB2 1 1 446 1 1 1 1 21 PRO QD . 18 . HD* 1 1 446 1 2 1 1 22 ARG H . 19 . HN 1 1 447 1 1 1 1 21 PRO HG2 . 18 . HG2 1 1 447 1 2 1 1 22 ARG H . 19 . HN 1 1 448 1 1 1 1 21 PRO HG3 . 18 . HG1 1 1 448 1 2 1 1 22 ARG H . 19 . HN 1 1 449 1 1 1 1 37 LYS QB . 34 . HB* 1 1 449 1 2 1 1 42 CYS H . 39 . HN 1 1 450 1 1 1 1 6 VAL HA . 3 . HA 1 1 450 1 2 1 1 7 LEU HG . 4 . HG 1 1 451 1 1 1 1 6 VAL HA . 3 . HA 1 1 451 1 2 1 1 16 PHE QD . 13 . HD* 1 1 452 1 1 1 1 6 VAL HA . 3 . HA 1 1 452 1 2 1 1 7 LEU H . 4 . HN 1 1 453 1 1 1 1 7 LEU HA . 4 . HA 1 1 453 1 2 1 1 7 LEU HG . 4 . HG 1 1 454 1 1 1 1 10 VAL HA . 7 . HA 1 1 454 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 455 1 1 1 1 10 VAL HB . 7 . HB 1 1 455 1 2 1 1 11 CYS HB3 . 8 . HB1 1 1 456 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 456 1 2 1 1 36 HIS HB2 . 33 . HB2 1 1 457 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 457 1 2 1 1 36 HIS HB2 . 33 . HB2 1 1 458 1 1 1 1 11 CYS HA . 8 . HA 1 1 458 1 2 1 1 11 CYS HB2 . 8 . HB2 1 1 459 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 459 1 2 1 1 11 CYS HA . 8 . HA 1 1 460 1 1 1 1 13 ILE MD . 10 . HD1* 1 1 460 1 2 1 1 14 LYS QE . 11 . HE* 1 1 461 1 1 1 1 8 CYS H . 5 . HN 1 1 461 1 2 1 1 15 GLU HA . 12 . HA 1 1 462 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 462 1 2 1 1 26 GLN HB2 . 23 . HB2 1 1 463 1 1 1 1 18 TYR HA . 15 . HA 1 1 463 1 2 1 1 18 TYR QE . 15 . HE* 1 1 464 1 1 1 1 19 LYS HA . 16 . HA 1 1 464 1 2 1 1 26 GLN HA . 23 . HA 1 1 465 1 1 1 1 19 LYS HA . 16 . HA 1 1 465 1 2 1 1 26 GLN HG2 . 23 . HG2 1 1 466 1 1 1 1 19 LYS HA . 16 . HA 1 1 466 1 2 1 1 19 LYS HG2 . 16 . HG2 1 1 467 1 1 1 1 19 LYS HA . 16 . HA 1 1 467 1 2 1 1 19 LYS HG3 . 16 . HG1 1 1 468 1 1 1 1 19 LYS HA . 16 . HA 1 1 468 1 2 1 1 20 CYS H . 17 . HN 1 1 469 1 1 1 1 19 LYS QB . 16 . HB* 1 1 469 1 2 1 1 21 PRO QD . 18 . HD* 1 1 470 1 1 1 1 19 LYS QB . 16 . HB* 1 1 470 1 2 1 1 24 LEU HA . 21 . HA 1 1 471 1 1 1 1 16 PHE QD . 13 . HD* 1 1 471 1 2 1 1 19 LYS QB . 16 . HB* 1 1 472 1 1 1 1 19 LYS QD . 16 . HD* 1 1 472 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 473 1 1 1 1 16 PHE QE . 13 . HE* 1 1 473 1 2 1 1 19 LYS QD . 16 . HD* 1 1 474 1 1 1 1 20 CYS HA . 17 . HA 1 1 474 1 2 1 1 21 PRO HA . 18 . HA 1 1 475 1 1 1 1 22 ARG QG . 19 . HG* 1 1 475 1 2 1 1 23 CYS H . 20 . HN 1 1 476 1 1 1 1 22 ARG HB3 . 19 . HB1 1 1 476 1 2 1 1 23 CYS HA . 20 . HA 1 1 477 1 1 1 1 22 ARG HB3 . 19 . HB1 1 1 477 1 2 1 1 23 CYS HB3 . 20 . HB1 1 1 478 1 1 1 1 23 CYS HB3 . 20 . HB1 1 1 478 1 2 1 1 24 LEU HB2 . 21 . HB2 1 1 479 1 1 1 1 19 LYS QE . 16 . HE* 1 1 479 1 2 1 1 24 LEU HA . 21 . HA 1 1 480 1 1 1 1 23 CYS HB3 . 20 . HB1 1 1 480 1 2 1 1 24 LEU HA . 21 . HA 1 1 481 1 1 1 1 20 CYS QB . 17 . HB* 1 1 481 1 2 1 1 24 LEU HA . 21 . HA 1 1 482 1 1 1 1 24 LEU HA . 21 . HA 1 1 482 1 2 1 1 24 LEU HG . 21 . HG 1 1 483 1 1 1 1 25 VAL HA . 22 . HA 1 1 483 1 2 1 1 26 GLN HG3 . 23 . HG1 1 1 484 1 1 1 1 25 VAL HA . 22 . HA 1 1 484 1 2 1 1 26 GLN H . 23 . HN 1 1 485 1 1 1 1 19 LYS HG2 . 16 . HG2 1 1 485 1 2 1 1 26 GLN HA . 23 . HA 1 1 486 1 1 1 1 19 LYS HG3 . 16 . HG1 1 1 486 1 2 1 1 26 GLN HA . 23 . HA 1 1 487 1 1 1 1 26 GLN HA . 23 . HA 1 1 487 1 2 1 1 26 GLN HG2 . 23 . HG2 1 1 488 1 1 1 1 26 GLN HA . 23 . HA 1 1 488 1 2 1 1 26 GLN HG3 . 23 . HG1 1 1 489 1 1 1 1 26 GLN H . 23 . HN 1 1 489 1 2 1 1 26 GLN HG2 . 23 . HG2 1 1 490 1 1 1 1 18 TYR QD . 15 . HD* 1 1 490 1 2 1 1 27 THR HA . 24 . HA 1 1 491 1 1 1 1 17 LYS H . 14 . HN 1 1 491 1 2 1 1 27 THR HA . 24 . HA 1 1 492 1 1 1 1 27 THR HB . 24 . HB 1 1 492 1 2 1 1 29 SER HA . 26 . HA 1 1 493 1 1 1 1 14 LYS QD . 11 . HD* 1 1 493 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 494 1 1 1 1 29 SER HA . 26 . HA 1 1 494 1 2 1 1 30 LEU HA . 27 . HA 1 1 495 1 1 1 1 31 GLU HA . 28 . HA 1 1 495 1 2 1 1 34 LYS HG3 . 31 . HG1 1 1 496 1 1 1 1 31 GLU HA . 28 . HA 1 1 496 1 2 1 1 34 LYS H . 31 . HN 1 1 497 1 1 1 1 32 CYS HA . 29 . HA 1 1 497 1 2 1 1 36 HIS H . 33 . HN 1 1 498 1 1 1 1 33 SER HA . 30 . HA 1 1 498 1 2 1 1 36 HIS H . 33 . HN 1 1 499 1 1 1 1 34 LYS HA . 31 . HA 1 1 499 1 2 1 1 34 LYS HG3 . 31 . HG1 1 1 500 1 1 1 1 34 LYS HA . 31 . HA 1 1 500 1 2 1 1 37 LYS QD . 34 . HD* 1 1 501 1 1 1 1 34 LYS QB . 31 . HB* 1 1 501 1 2 1 1 37 LYS QD . 34 . HD* 1 1 502 1 1 1 1 31 GLU HA . 28 . HA 1 1 502 1 2 1 1 34 LYS QE . 31 . HE* 1 1 503 1 1 1 1 37 LYS HA . 34 . HA 1 1 503 1 2 1 1 37 LYS HG3 . 34 . HG1 1 1 504 1 1 1 1 37 LYS HA . 34 . HA 1 1 504 1 2 1 1 37 LYS HG2 . 34 . HG2 1 1 505 1 1 1 1 37 LYS H . 34 . HN 1 1 505 1 2 1 1 38 THR HA . 35 . HA 1 1 506 1 1 1 1 38 THR MG . 35 . HG2* 1 1 506 1 2 1 1 39 ARG QB . 36 . HB* 1 1 507 1 1 1 1 37 LYS QD . 34 . HD* 1 1 507 1 2 1 1 44 GLY HA3 . 41 . HA1 1 1 508 1 1 1 1 45 GLN HA . 42 . HA 1 1 508 1 2 1 1 45 GLN QG . 42 . HG* 1 1 509 1 1 1 1 21 PRO QD . 18 . HD* 1 1 509 1 2 1 1 22 ARG QG . 19 . HG* 1 1 510 1 1 1 1 18 TYR QD . 15 . HD* 1 1 510 1 2 1 1 21 PRO QD . 18 . HD* 1 1 511 1 1 1 1 23 CYS HB2 . 20 . HB2 1 1 511 1 2 1 1 24 LEU HA . 21 . HA 1 1 512 1 1 1 1 18 TYR H . 15 . HN 1 1 512 1 2 1 1 18 TYR QD . 15 . HD* 1 1 513 1 1 1 1 17 LYS H . 14 . HN 1 1 513 1 2 1 1 18 TYR QE . 15 . HE* 1 1 514 1 1 1 1 17 LYS QE . 14 . HE* 1 1 514 1 2 1 1 18 TYR QE . 15 . HE* 1 1 515 1 1 1 1 18 TYR QE . 15 . HE* 1 1 515 1 2 1 1 30 LEU HG . 27 . HG 1 1 516 1 1 1 1 6 VAL HA . 3 . HA 1 1 516 1 2 1 1 16 PHE QE . 13 . HE* 1 1 517 1 1 1 1 16 PHE QE . 13 . HE* 1 1 517 1 2 1 1 17 LYS HA . 14 . HA 1 1 518 1 1 1 1 16 PHE QE . 13 . HE* 1 1 518 1 2 1 1 19 LYS QB . 16 . HB* 1 1 519 1 1 1 1 16 PHE QE . 13 . HE* 1 1 519 1 2 1 1 26 GLN HB3 . 23 . HB1 1 1 520 1 1 1 1 6 VAL HB . 3 . HB 1 1 520 1 2 1 1 16 PHE QE . 13 . HE* 1 1 521 1 1 1 1 16 PHE HA . 13 . HA 1 1 521 1 2 1 1 16 PHE QD . 13 . HD* 1 1 522 1 1 1 1 16 PHE QD . 13 . HD* 1 1 522 1 2 1 1 26 GLN HG2 . 23 . HG2 1 1 523 1 1 1 1 16 PHE QD . 13 . HD* 1 1 523 1 2 1 1 18 TYR HB2 . 15 . HB2 1 1 524 1 1 1 1 36 HIS HE1 . 33 . HE1 1 1 524 1 2 1 1 37 LYS QE . 34 . HE* 1 1 525 1 1 1 1 27 THR MG . 24 . HG2* 1 1 525 1 2 1 1 36 HIS HE1 . 33 . HE1 1 1 526 1 1 1 1 36 HIS HD2 . 33 . HD2 1 1 526 1 2 1 1 37 LYS QE . 34 . HE* 1 1 527 1 1 1 1 18 TYR QD . 15 . HD* 1 1 527 1 2 1 1 29 SER HB2 . 26 . HB2 1 1 528 1 1 1 1 18 TYR QD . 15 . HD* 1 1 528 1 2 1 1 30 LEU MD1 . 27 . HD1* 1 1 529 1 1 1 1 33 SER H . 30 . HN 1 1 529 1 2 1 1 33 SER HB3 . 30 . HB1 1 1 530 1 1 1 1 20 CYS QB . 17 . HB* 1 1 530 1 2 1 1 36 HIS HE1 . 33 . HE1 1 1 531 1 1 1 1 10 VAL H . 7 . HN 1 1 531 1 2 1 1 11 CYS H . 8 . HN 1 1 532 1 1 1 1 16 PHE QD . 13 . HD* 1 1 532 1 2 1 1 27 THR H . 24 . HN 1 1 533 1 1 1 1 35 LYS H . 32 . HN 1 1 533 1 2 1 1 36 HIS H . 33 . HN 1 1 534 1 1 1 1 20 CYS H . 17 . HN 1 1 534 1 2 1 1 25 VAL H . 22 . HN 1 1 535 1 1 1 1 12 GLY H . 9 . HN 1 1 535 1 2 1 1 13 ILE H . 10 . HN 1 1 536 1 1 1 1 28 CYS H . 25 . HN 1 1 536 1 2 1 1 33 SER H . 30 . HN 1 1 537 1 1 1 1 8 CYS HA . 5 . HA 1 1 537 1 2 1 1 27 THR HA . 24 . HA 1 1 538 1 1 1 1 27 THR HA . 24 . HA 1 1 538 1 2 1 1 32 CYS QB . 29 . HB1 1 1 539 1 1 1 1 27 THR HA . 24 . HA 1 1 539 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 540 1 1 1 1 27 THR HA . 24 . HA 1 1 540 1 2 1 1 27 THR MG . 24 . HG2* 1 1 541 1 1 1 1 27 THR HB . 24 . HB 1 1 541 1 2 1 1 28 CYS H . 25 . HN 1 1 542 1 1 1 1 8 CYS H . 5 . HN 1 1 542 1 2 1 1 8 CYS HB3 . 5 . HB1 1 1 543 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 543 1 2 1 1 13 ILE H . 10 . HN 1 1 544 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 544 1 2 1 1 12 GLY H . 9 . HN 1 1 545 1 1 1 1 28 CYS H . 25 . HN 1 1 545 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 546 1 1 1 1 28 CYS H . 25 . HN 1 1 546 1 2 1 1 32 CYS QB . 29 . HB1 1 1 547 1 1 1 1 18 TYR HB3 . 15 . HB1 1 1 547 1 2 1 1 27 THR H . 24 . HN 1 1 548 1 1 1 1 10 VAL H . 7 . HN 1 1 548 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 549 1 1 1 1 9 GLY H . 6 . HN 1 1 549 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 550 1 1 1 1 10 VAL H . 7 . HN 1 1 550 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 551 1 1 1 1 20 CYS H . 17 . HN 1 1 551 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 552 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 552 1 2 1 1 36 HIS HE1 . 33 . HE1 1 1 553 1 1 1 1 26 GLN H . 23 . HN 1 1 553 1 2 1 1 26 GLN HG3 . 23 . HG1 1 1 554 1 1 1 1 17 LYS H . 14 . HN 1 1 554 1 2 1 1 28 CYS HA . 25 . HA 1 1 555 1 1 1 1 7 LEU HA . 4 . HA 1 1 555 1 2 1 1 8 CYS H . 5 . HN 1 1 556 1 1 1 1 21 PRO QD . 18 . HD* 1 1 556 1 2 1 1 23 CYS H . 20 . HN 1 1 557 1 1 1 1 23 CYS H . 20 . HN 1 1 557 1 2 1 1 24 LEU HA . 21 . HA 1 1 558 1 1 1 1 33 SER H . 30 . HN 1 1 558 1 2 1 1 33 SER HB2 . 30 . HB2 1 1 559 1 1 1 1 37 LYS H . 34 . HN 1 1 559 1 2 1 1 37 LYS QB . 34 . HB* 1 1 560 1 1 1 1 37 LYS H . 34 . HN 1 1 560 1 2 1 1 37 LYS QD . 34 . HD* 1 1 561 1 1 1 1 37 LYS H . 34 . HN 1 1 561 1 2 1 1 38 THR MG . 35 . HG2* 1 1 562 1 1 1 1 23 CYS HB2 . 20 . HB2 1 1 562 1 2 1 1 24 LEU H . 21 . HN 1 1 563 1 1 1 1 13 ILE H . 10 . HN 1 1 563 1 2 1 1 13 ILE HB . 10 . HB 1 1 564 1 1 1 1 6 VAL H . 3 . HN 1 1 564 1 2 1 1 15 GLU QG . 12 . HG* 1 1 565 1 1 1 1 34 LYS H . 31 . HN 1 1 565 1 2 1 1 34 LYS QB . 31 . HB* 1 1 566 1 1 1 1 13 ILE H . 10 . HN 1 1 566 1 2 1 1 13 ILE HG13 . 10 . HG11 1 1 567 1 1 1 1 17 LYS QB . 14 . HB* 1 1 567 1 2 1 1 18 TYR H . 15 . HN 1 1 568 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 568 1 2 1 1 36 HIS H . 33 . HN 1 1 569 1 1 1 1 25 VAL MG2 . 22 . HG2* 1 1 569 1 2 1 1 26 GLN H . 23 . HN 1 1 570 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 570 1 2 1 1 8 CYS H . 5 . HN 1 1 571 1 1 1 1 7 LEU H . 4 . HN 1 1 571 1 2 1 1 7 LEU HB2 . 4 . HB2 1 1 572 1 1 1 1 32 CYS QB . 29 . HB1 1 1 572 1 2 1 1 33 SER H . 30 . HN 1 1 573 1 1 1 1 8 CYS H . 5 . HN 1 1 573 1 2 1 1 8 CYS HB2 . 5 . HB2 1 1 574 1 1 1 1 24 LEU H . 21 . HN 1 1 574 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 575 1 1 1 1 23 CYS H . 20 . HN 1 1 575 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 576 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 576 1 2 1 1 27 THR MG . 24 . HG2* 1 1 577 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 577 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 578 1 1 1 1 37 LYS HA . 34 . HA 1 1 578 1 2 1 1 42 CYS HB2 . 39 . HB2 1 1 579 1 1 1 1 16 PHE QD . 13 . HD* 1 1 579 1 2 1 1 18 TYR HA . 15 . HA 1 1 580 1 1 1 1 6 VAL QG . 3 . HG2* 1 1 580 1 2 1 1 16 PHE QE . 13 . HE* 1 1 581 1 1 1 1 16 PHE QE . 13 . HE* 1 1 581 1 2 1 1 26 GLN HG2 . 23 . HG2 1 1 582 1 1 1 1 16 PHE QD . 13 . HD* 1 1 582 1 2 1 1 26 GLN HB3 . 23 . HB1 1 1 583 1 1 1 1 17 LYS HG2 . 14 . HG2 1 1 583 1 2 1 1 18 TYR QD . 15 . HD* 1 1 584 1 1 1 1 8 CYS H . 5 . HN 1 1 584 1 2 1 1 28 CYS H . 25 . HN 1 1 585 1 1 1 1 27 THR HB . 24 . HB 1 1 585 1 2 1 1 33 SER H . 30 . HN 1 1 586 1 1 1 1 7 LEU HA . 4 . HA 1 1 586 1 2 1 1 16 PHE H . 13 . HN 1 1 587 1 1 1 1 20 CYS H . 17 . HN 1 1 587 1 2 1 1 20 CYS QB . 17 . HB* 1 1 588 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 588 1 2 1 1 18 TYR H . 15 . HN 1 1 589 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 589 1 2 1 1 26 GLN H . 23 . HN 1 1 590 1 1 1 1 7 LEU HA . 4 . HA 1 1 590 1 2 1 1 7 LEU QD . 4 . HD2* 1 1 591 1 1 1 1 27 THR MG . 24 . HG2* 1 1 591 1 2 1 1 33 SER HA . 30 . HA 1 1 592 1 1 1 1 22 ARG QG . 19 . HG* 1 1 592 1 2 1 1 44 GLY HA2 . 41 . HA2 1 1 593 1 1 1 1 25 VAL HA . 22 . HA 1 1 593 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 594 1 1 1 1 7 LEU HB3 . 4 . HB1 1 1 594 1 2 1 1 7 LEU QD . 4 . HD2* 1 1 595 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 595 1 2 1 1 26 GLN HB3 . 23 . HB1 1 1 596 1 1 1 1 37 LYS HA . 34 . HA 1 1 596 1 2 1 1 42 CYS HB3 . 39 . HB1 1 1 597 1 1 1 1 16 PHE HB3 . 13 . HB1 1 1 597 1 2 1 1 26 GLN HB2 . 23 . HB2 1 1 598 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 598 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 599 1 1 1 1 1 GLY QA . -2 . HA* 1 1 599 1 2 1 1 2 PRO QD . -1 . HD* 1 1 600 1 1 1 1 16 PHE HA . 13 . HA 1 1 600 1 2 1 1 18 TYR H . 15 . HN 1 1 601 1 1 1 1 39 ARG HA . 36 . HA 1 1 601 1 2 1 1 39 ARG HG2 . 36 . HG2 1 1 602 1 1 1 1 35 LYS H . 32 . HN 1 1 602 1 2 1 1 35 LYS HB2 . 32 . HB2 1 1 603 1 1 1 1 13 ILE H . 10 . HN 1 1 603 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 604 1 1 1 1 13 ILE H . 10 . HN 1 1 604 1 2 1 1 13 ILE MD . 10 . HD1* 1 1 605 1 1 1 1 40 ASP HB3 . 37 . HB1 1 1 605 1 2 1 1 41 ASN H . 38 . HN 1 1 606 1 1 1 1 19 LYS HG2 . 16 . HG2 1 1 606 1 2 1 1 24 LEU HA . 21 . HA 1 1 607 1 1 1 1 9 GLY HA3 . 6 . HA1 1 1 607 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 608 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 608 1 2 1 1 36 HIS HB3 . 33 . HB1 1 1 609 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 609 1 2 1 1 36 HIS HB3 . 33 . HB1 1 1 610 1 1 1 1 20 CYS QB . 17 . HB* 1 1 610 1 2 1 1 27 THR MG . 24 . HG2* 1 1 611 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 611 1 2 1 1 27 THR HB . 24 . HB 1 1 612 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 612 1 2 1 1 12 GLY QA . 9 . HA* 1 1 613 1 1 1 1 25 VAL MG2 . 22 . HG2* 1 1 613 1 2 1 1 26 GLN HA . 23 . HA 1 1 614 1 1 1 1 26 GLN HA . 23 . HA 1 1 614 1 2 1 1 27 THR MG . 24 . HG2* 1 1 615 1 1 1 1 16 PHE HB2 . 13 . HB2 1 1 615 1 2 1 1 27 THR HA . 24 . HA 1 1 616 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 616 1 2 1 1 27 THR HA . 24 . HA 1 1 617 1 1 1 1 16 PHE QD . 13 . HD* 1 1 617 1 2 1 1 19 LYS HG3 . 16 . HG1 1 1 618 1 1 1 1 16 PHE QE . 13 . HE* 1 1 618 1 2 1 1 19 LYS HG3 . 16 . HG1 1 1 619 1 1 1 1 5 ALA HA . 2 . HA 1 1 619 1 2 1 1 6 VAL QG . 3 . HG2* 1 1 620 1 1 1 1 26 GLN HB2 . 23 . HB2 1 1 620 1 2 1 1 27 THR H . 24 . HN 1 1 621 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 621 1 2 1 1 15 GLU QG . 12 . HG* 1 1 622 1 1 1 1 17 LYS HG2 . 14 . HG2 1 1 622 1 2 1 1 29 SER HA . 26 . HA 1 1 623 1 1 1 1 6 VAL QG . 3 . HG2* 1 1 623 1 2 1 1 7 LEU H . 4 . HN 1 1 624 1 1 1 1 25 VAL HB . 22 . HB 1 1 624 1 2 1 1 36 HIS HE1 . 33 . HE1 1 1 625 1 1 1 1 35 LYS H . 32 . HN 1 1 625 1 2 1 1 35 LYS HB3 . 32 . HB1 1 1 626 1 1 1 1 19 LYS QE . 16 . HE* 1 1 626 1 2 1 1 24 LEU QD . 21 . HD2* 1 1 627 1 1 1 1 17 LYS H . 14 . HN 1 1 627 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 628 1 1 1 1 17 LYS HG2 . 14 . HG2 1 1 628 1 2 1 1 18 TYR QE . 15 . HE* 1 1 629 1 1 1 1 36 HIS HB2 . 33 . HB2 1 1 629 1 2 1 1 40 ASP H . 37 . HN 1 1 630 1 1 1 1 18 TYR QD . 15 . HD* 1 1 630 1 2 1 1 30 LEU HG . 27 . HG 1 1 631 1 1 1 1 35 LYS HB3 . 32 . HB1 1 1 631 1 2 1 1 35 LYS QE . 32 . HE* 1 1 632 1 1 1 1 13 ILE MD . 10 . HD1* 1 1 632 1 2 1 1 14 LYS HG3 . 11 . HG1 1 1 633 1 1 1 1 14 LYS QB . 11 . HB* 1 1 633 1 2 1 1 14 LYS QE . 11 . HE* 1 1 634 1 1 1 1 37 LYS HA . 34 . HA 1 1 634 1 2 1 1 40 ASP H . 37 . HN 1 1 635 1 1 1 1 27 THR HB . 24 . HB 1 1 635 1 2 1 1 32 CYS H . 29 . HN 1 1 636 1 1 1 1 29 SER HB3 . 26 . HB1 1 1 636 1 2 1 1 32 CYS H . 29 . HN 1 1 637 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 637 1 2 1 1 9 GLY H . 6 . HN 1 1 638 1 1 1 1 7 LEU HB2 . 4 . HB2 1 1 638 1 2 1 1 8 CYS H . 5 . HN 1 1 639 1 1 1 1 25 VAL HA . 22 . HA 1 1 639 1 2 1 1 26 GLN HB2 . 23 . HB2 1 1 640 1 1 1 1 16 PHE HA . 13 . HA 1 1 640 1 2 1 1 28 CYS HA . 25 . HA 1 1 641 1 1 1 1 18 TYR HB2 . 15 . HB2 1 1 641 1 2 1 1 29 SER HA . 26 . HA 1 1 642 1 1 1 1 27 THR H . 24 . HN 1 1 642 1 2 1 1 27 THR MG . 24 . HG2* 1 1 643 1 1 1 1 17 LYS QB . 14 . HB* 1 1 643 1 2 1 1 28 CYS HA . 25 . HA 1 1 644 1 1 1 1 16 PHE HB3 . 13 . HB1 1 1 644 1 2 1 1 26 GLN HB3 . 23 . HB1 1 1 645 1 1 1 1 17 LYS QB . 14 . HB* 1 1 645 1 2 1 1 17 LYS HG2 . 14 . HG2 1 1 646 1 1 1 1 13 ILE HG13 . 10 . HG11 1 1 646 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 647 1 1 1 1 14 LYS QD . 11 . HD* 1 1 647 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 648 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 648 1 2 1 1 12 GLY H . 9 . HN 1 1 649 1 1 1 1 11 CYS HB3 . 8 . HB1 1 1 649 1 2 1 1 12 GLY H . 9 . HN 1 1 650 1 1 1 1 11 CYS HB2 . 8 . HB2 1 1 650 1 2 1 1 13 ILE HG13 . 10 . HG11 1 1 651 1 1 1 1 8 CYS HA . 5 . HA 1 1 651 1 2 1 1 27 THR MG . 24 . HG2* 1 1 652 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 652 1 2 1 1 24 LEU H . 21 . HN 1 1 653 1 1 1 1 37 LYS H . 34 . HN 1 1 653 1 2 1 1 38 THR HB . 35 . HB 1 1 654 1 1 1 1 34 LYS HA . 31 . HA 1 1 654 1 2 1 1 37 LYS H . 34 . HN 1 1 655 1 1 1 1 8 CYS H . 5 . HN 1 1 655 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 656 1 1 1 1 21 PRO HB2 . 18 . HB2 1 1 656 1 2 1 1 22 ARG H . 19 . HN 1 1 657 1 1 1 1 24 LEU H . 21 . HN 1 1 657 1 2 1 1 24 LEU HB2 . 21 . HB2 1 1 658 1 1 1 1 35 LYS H . 32 . HN 1 1 658 1 2 1 1 35 LYS QD . 32 . HD* 1 1 659 1 1 1 1 16 PHE QD . 13 . HD* 1 1 659 1 2 1 1 19 LYS HA . 16 . HA 1 1 660 1 1 1 1 16 PHE QD . 13 . HD* 1 1 660 1 2 1 1 18 TYR H . 15 . HN 1 1 661 1 1 1 1 19 LYS QB . 16 . HB* 1 1 661 1 2 1 1 21 PRO HA . 18 . HA 1 1 662 1 1 1 1 21 PRO HA . 18 . HA 1 1 662 1 2 1 1 22 ARG QG . 19 . HG* 1 1 663 1 1 1 1 23 CYS H . 20 . HN 1 1 663 1 2 1 1 24 LEU H . 21 . HN 1 1 664 1 1 1 1 6 VAL H . 3 . HN 1 1 664 1 2 1 1 7 LEU H . 4 . HN 1 1 665 1 1 1 1 41 ASN H . 38 . HN 1 1 665 1 2 1 1 42 CYS H . 39 . HN 1 1 666 1 1 1 1 18 TYR QD . 15 . HD* 1 1 666 1 2 1 1 28 CYS H . 25 . HN 1 1 667 1 1 1 1 18 TYR QD . 15 . HD* 1 1 667 1 2 1 1 27 THR H . 24 . HN 1 1 668 1 1 1 1 25 VAL H . 22 . HN 1 1 668 1 2 1 1 36 HIS HE1 . 33 . HE1 1 1 669 1 1 1 1 9 GLY H . 6 . HN 1 1 669 1 2 1 1 26 GLN H . 23 . HN 1 1 670 1 1 1 1 19 LYS HG3 . 16 . HG1 1 1 670 1 2 1 1 26 GLN H . 23 . HN 1 1 671 1 1 1 1 38 THR MG . 35 . HG2* 1 1 671 1 2 1 1 40 ASP H . 37 . HN 1 1 672 1 1 1 1 18 TYR QD . 15 . HD* 1 1 672 1 2 1 1 27 THR HB . 24 . HB 1 1 673 1 1 1 1 15 GLU QB . 12 . HB* 1 1 673 1 2 1 1 16 PHE QD . 13 . HD* 1 1 674 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 674 1 2 1 1 27 THR HA . 24 . HA 1 1 675 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 675 1 2 1 1 27 THR HA . 24 . HA 1 1 676 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 676 1 2 1 1 27 THR H . 24 . HN 1 1 677 1 1 1 1 7 LEU HG . 4 . HG 1 1 677 1 2 1 1 8 CYS H . 5 . HN 1 1 678 1 1 1 1 25 VAL HB . 22 . HB 1 1 678 1 2 1 1 26 GLN H . 23 . HN 1 1 679 1 1 1 1 13 ILE H . 10 . HN 1 1 679 1 2 1 1 14 LYS QD . 11 . HD* 1 1 680 1 1 1 1 32 CYS H . 29 . HN 1 1 680 1 2 1 1 35 LYS HB3 . 32 . HB1 1 1 681 1 1 1 1 17 LYS H . 14 . HN 1 1 681 1 2 1 1 18 TYR HA . 15 . HA 1 1 682 1 1 1 1 26 GLN H . 23 . HN 1 1 682 1 2 1 1 27 THR H . 24 . HN 1 1 683 1 1 1 1 11 CYS HA . 8 . HA 1 1 683 1 2 1 1 13 ILE H . 10 . HN 1 1 684 1 1 1 1 24 LEU HB3 . 21 . HB1 1 1 684 1 2 1 1 25 VAL H . 22 . HN 1 1 685 1 1 1 1 10 VAL HB . 7 . HB 1 1 685 1 2 1 1 33 SER H . 30 . HN 1 1 686 1 1 1 1 8 CYS H . 5 . HN 1 1 686 1 2 1 1 15 GLU QG . 12 . HG* 1 1 687 1 1 1 1 16 PHE HB3 . 13 . HB1 1 1 687 1 2 1 1 27 THR HA . 24 . HA 1 1 688 1 1 1 1 36 HIS H . 33 . HN 1 1 688 1 2 1 1 36 HIS HE1 . 33 . HE1 1 1 689 1 1 1 1 25 VAL HA . 22 . HA 1 1 689 1 2 1 1 26 GLN HA . 23 . HA 1 1 690 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 690 1 2 1 1 14 LYS QD . 11 . HD* 1 1 691 1 1 1 1 36 HIS HA . 33 . HA 1 1 691 1 2 1 1 37 LYS HA . 34 . HA 1 1 692 1 1 1 1 7 LEU HA . 4 . HA 1 1 692 1 2 1 1 8 CYS HB3 . 5 . HB1 1 1 693 1 1 1 1 36 HIS H . 33 . HN 1 1 693 1 2 1 1 37 LYS QE . 34 . HE* 1 1 694 1 1 1 1 12 GLY H . 9 . HN 1 1 694 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 695 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 695 1 2 1 1 35 LYS H . 32 . HN 1 1 696 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 696 1 2 1 1 27 THR HB . 24 . HB 1 1 697 1 1 1 1 34 LYS HA . 31 . HA 1 1 697 1 2 1 1 37 LYS QB . 34 . HB* 1 1 698 1 1 1 1 30 LEU HA . 27 . HA 1 1 698 1 2 1 1 30 LEU HG . 27 . HG 1 1 699 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 699 1 2 1 1 44 GLY HA2 . 41 . HA2 1 1 700 1 1 1 1 9 GLY HA3 . 6 . HA1 1 1 700 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 701 1 1 1 1 39 ARG QB . 36 . HB* 1 1 701 1 2 1 1 39 ARG HD3 . 36 . HD1 1 1 702 1 1 1 1 10 VAL HB . 7 . HB 1 1 702 1 2 1 1 11 CYS HB2 . 8 . HB2 1 1 703 1 1 1 1 37 LYS QB . 34 . HB* 1 1 703 1 2 1 1 37 LYS QD . 34 . HD* 1 1 704 1 1 1 1 37 LYS HA . 34 . HA 1 1 704 1 2 1 1 38 THR HA . 35 . HA 1 1 705 1 1 1 1 19 LYS HG3 . 16 . HG1 1 1 705 1 2 1 1 24 LEU QD . 21 . HD1* 1 1 706 1 1 1 1 29 SER HA . 26 . HA 1 1 706 1 2 1 1 32 CYS H . 29 . HN 1 1 707 1 1 1 1 23 CYS HA . 20 . HA 1 1 707 1 2 1 1 25 VAL H . 22 . HN 1 1 708 1 1 1 1 16 PHE QD . 13 . HD* 1 1 708 1 2 1 1 17 LYS HG2 . 14 . HG2 1 1 709 1 1 1 1 28 CYS H . 25 . HN 1 1 709 1 2 1 1 29 SER HA . 26 . HA 1 1 710 1 1 1 1 8 CYS HA . 5 . HA 1 1 710 1 2 1 1 10 VAL H . 7 . HN 1 1 711 1 1 1 1 24 LEU QD . 21 . HD2* 1 1 711 1 2 1 1 25 VAL H . 22 . HN 1 1 712 1 1 1 1 11 CYS HB2 . 8 . HB2 1 1 712 1 2 1 1 12 GLY H . 9 . HN 1 1 713 1 1 1 1 36 HIS HB3 . 33 . HB1 1 1 713 1 2 1 1 37 LYS H . 34 . HN 1 1 714 1 1 1 1 12 GLY QA . 9 . HA* 1 1 714 1 2 1 1 13 ILE HA . 10 . HA 1 1 715 1 1 1 1 44 GLY HA2 . 41 . HA2 1 1 715 1 2 1 1 45 GLN HA . 42 . HA 1 1 716 1 1 1 1 9 GLY HA2 . 6 . HA2 1 1 716 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 717 1 1 1 1 6 VAL HA . 3 . HA 1 1 717 1 2 1 1 7 LEU QD . 4 . HD2* 1 1 718 1 1 1 1 21 PRO HG2 . 18 . HG2 1 1 718 1 2 1 1 22 ARG HA . 19 . HA 1 1 719 1 1 1 1 20 CYS QB . 17 . HB* 1 1 719 1 2 1 1 25 VAL HB . 22 . HB 1 1 720 1 1 1 1 11 CYS HB2 . 8 . HB2 1 1 720 1 2 1 1 13 ILE HG12 . 10 . HG12 1 1 721 1 1 1 1 19 LYS QE . 16 . HE* 1 1 721 1 2 1 1 26 GLN HG2 . 23 . HG2 1 1 722 1 1 1 1 11 CYS HB3 . 8 . HB1 1 1 722 1 2 1 1 13 ILE MD . 10 . HD1* 1 1 723 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 723 1 2 1 1 14 LYS QB . 11 . HB* 1 1 724 1 1 1 1 25 VAL MG1 . 22 . HG1* 1 1 724 1 2 1 1 26 GLN HB2 . 23 . HB2 1 1 725 1 1 1 1 13 ILE MD . 10 . HD1* 1 1 725 1 2 1 1 14 LYS QD . 11 . HD* 1 1 726 1 1 1 1 19 LYS HA . 16 . HA 1 1 726 1 2 1 1 26 GLN HG3 . 23 . HG1 1 1 727 1 1 1 1 29 SER HA . 26 . HA 1 1 727 1 2 1 1 32 CYS QB . 29 . HB2 1 1 728 1 1 1 1 37 LYS H . 34 . HN 1 1 728 1 2 1 1 40 ASP H . 37 . HN 1 1 729 1 1 1 1 35 LYS H . 32 . HN 1 1 729 1 2 1 1 37 LYS H . 34 . HN 1 1 730 1 1 1 1 8 CYS H . 5 . HN 1 1 730 1 2 1 1 9 GLY H . 6 . HN 1 1 731 1 1 1 1 29 SER HA . 26 . HA 1 1 731 1 2 1 1 33 SER H . 30 . HN 1 1 732 1 1 1 1 7 LEU HA . 4 . HA 1 1 732 1 2 1 1 16 PHE QD . 13 . HD* 1 1 733 1 1 1 1 9 GLY HA3 . 6 . HA1 1 1 733 1 2 1 1 26 GLN H . 23 . HN 1 1 734 1 1 1 1 23 CYS HB3 . 20 . HB1 1 1 734 1 2 1 1 25 VAL H . 22 . HN 1 1 735 1 1 1 1 19 LYS HG3 . 16 . HG1 1 1 735 1 2 1 1 20 CYS H . 17 . HN 1 1 736 1 1 1 1 8 CYS HA . 5 . HA 1 1 736 1 2 1 1 28 CYS HB3 . 25 . HB1 1 1 737 1 1 1 1 44 GLY HA3 . 41 . HA1 1 1 737 1 2 1 1 45 GLN QG . 42 . HG* 1 1 738 1 1 1 1 34 LYS QB . 31 . HB* 1 1 738 1 2 1 1 34 LYS QE . 31 . HE* 1 1 739 1 1 1 1 11 CYS HB3 . 8 . HB1 1 1 739 1 2 1 1 13 ILE HG12 . 10 . HG12 1 1 740 1 1 1 1 13 ILE MD . 10 . HD1* 1 1 740 1 2 1 1 14 LYS HG2 . 11 . HG2 1 1 741 1 1 1 1 5 ALA MB . 2 . HB* 1 1 741 1 2 1 1 6 VAL QG . 3 . HG2* 1 1 742 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 742 1 2 1 1 13 ILE MD . 10 . HD1* 1 1 743 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 743 1 2 1 1 13 ILE MG . 10 . HG2* 1 1 744 1 1 1 1 35 LYS HB3 . 32 . HB1 1 1 744 1 2 1 1 38 THR MG . 35 . HG2* 1 1 745 1 1 1 1 8 CYS HB3 . 5 . HB1 1 1 745 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 746 1 1 1 1 8 CYS HB2 . 5 . HB2 1 1 746 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 747 1 1 1 1 5 ALA H . 2 . HN 1 1 747 1 2 1 1 6 VAL QG . 3 . HG2* 1 1 748 1 1 1 1 9 GLY H . 6 . HN 1 1 748 1 2 1 1 10 VAL MG2 . 7 . HG2* 1 1 749 1 1 1 1 10 VAL MG2 . 7 . HG2* 1 1 749 1 2 1 1 28 CYS H . 25 . HN 1 1 750 1 1 1 1 37 LYS HA . 34 . HA 1 1 750 1 2 1 1 41 ASN H . 38 . HN 1 1 751 1 1 1 1 38 THR HA . 35 . HA 1 1 751 1 2 1 1 41 ASN H . 38 . HN 1 1 752 1 1 1 1 2 PRO HB2 . -1 . HB2 1 1 752 1 2 1 1 4 MET QG . 1 . HG* 1 1 753 1 1 1 1 4 MET HA . 1 . HA 1 1 753 1 2 1 1 4 MET QG . 1 . HG* 1 1 754 1 1 1 1 5 ALA MB . 2 . HB* 1 1 754 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 755 1 1 1 1 6 VAL HA . 3 . HA 1 1 755 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 756 1 1 1 1 6 VAL HB . 3 . HB 1 1 756 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 757 1 1 1 1 6 VAL QG . 3 . HG1* 1 1 757 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 758 1 1 1 1 7 LEU QD . 4 . HD2* 1 1 758 1 2 1 1 14 LYS QG . 11 . HG* 1 1 759 1 1 1 1 10 VAL MG1 . 7 . HG1* 1 1 759 1 2 1 1 35 LYS QG . 32 . HG* 1 1 760 1 1 1 1 13 ILE H . 10 . HN 1 1 760 1 2 1 1 14 LYS QG . 11 . HG* 1 1 761 1 1 1 1 13 ILE HB . 10 . HB 1 1 761 1 2 1 1 14 LYS QG . 11 . HG* 1 1 762 1 1 1 1 14 LYS HA . 11 . HA 1 1 762 1 2 1 1 14 LYS QG . 11 . HG* 1 1 763 1 1 1 1 14 LYS QG . 11 . HG* 1 1 763 1 2 1 1 15 GLU H . 12 . HN 1 1 764 1 1 1 1 14 LYS QG . 11 . HG* 1 1 764 1 2 1 1 15 GLU QB . 12 . HB* 1 1 765 1 1 1 1 14 LYS QG . 11 . HG* 1 1 765 1 2 1 1 28 CYS HB2 . 25 . HB2 1 1 766 1 1 1 1 16 PHE QD . 13 . HD* 1 1 766 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 767 1 1 1 1 16 PHE QE . 13 . HE* 1 1 767 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 768 1 1 1 1 17 LYS QD . 14 . HD* 1 1 768 1 2 1 1 30 LEU QD . 27 . HD* 1 1 769 1 1 1 1 18 TYR QD . 15 . HD* 1 1 769 1 2 1 1 30 LEU QB . 27 . HB* 1 1 770 1 1 1 1 18 TYR QD . 15 . HD* 1 1 770 1 2 1 1 30 LEU QD . 27 . HD* 1 1 771 1 1 1 1 18 TYR QD . 15 . HD* 1 1 771 1 2 1 1 33 SER QB . 30 . HB* 1 1 772 1 1 1 1 18 TYR QE . 15 . HE* 1 1 772 1 2 1 1 29 SER QB . 26 . HB* 1 1 773 1 1 1 1 18 TYR QE . 15 . HE* 1 1 773 1 2 1 1 30 LEU QD . 27 . HD* 1 1 774 1 1 1 1 19 LYS H . 16 . HN 1 1 774 1 2 1 1 30 LEU QD . 27 . HD* 1 1 775 1 1 1 1 20 CYS QB . 17 . HB* 1 1 775 1 2 1 1 23 CYS QB . 20 . HB* 1 1 776 1 1 1 1 21 PRO QD . 18 . HD* 1 1 776 1 2 1 1 30 LEU QD . 27 . HD* 1 1 777 1 1 1 1 22 ARG HA . 19 . HA 1 1 777 1 2 1 1 22 ARG QD . 19 . HD* 1 1 778 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 778 1 2 1 1 22 ARG QD . 19 . HD* 1 1 779 1 1 1 1 22 ARG HB2 . 19 . HB2 1 1 779 1 2 1 1 23 CYS QB . 20 . HB* 1 1 780 1 1 1 1 22 ARG HB3 . 19 . HB1 1 1 780 1 2 1 1 22 ARG QD . 19 . HD* 1 1 781 1 1 1 1 22 ARG HB3 . 19 . HB1 1 1 781 1 2 1 1 23 CYS QB . 20 . HB* 1 1 782 1 1 1 1 22 ARG QD . 19 . HD* 1 1 782 1 2 1 1 43 SER H . 40 . HN 1 1 783 1 1 1 1 22 ARG QD . 19 . HD* 1 1 783 1 2 1 1 45 GLN H . 42 . HN 1 1 784 1 1 1 1 22 ARG QD . 19 . HD* 1 1 784 1 2 1 1 45 GLN QB . 42 . HB* 1 1 785 1 1 1 1 23 CYS H . 20 . HN 1 1 785 1 2 1 1 23 CYS QB . 20 . HB* 1 1 786 1 1 1 1 23 CYS HA . 20 . HA 1 1 786 1 2 1 1 23 CYS QB . 20 . HB* 1 1 787 1 1 1 1 23 CYS QB . 20 . HB* 1 1 787 1 2 1 1 24 LEU HA . 21 . HA 1 1 788 1 1 1 1 23 CYS QB . 20 . HB* 1 1 788 1 2 1 1 25 VAL H . 22 . HN 1 1 789 1 1 1 1 23 CYS QB . 20 . HB* 1 1 789 1 2 1 1 25 VAL HA . 22 . HA 1 1 790 1 1 1 1 23 CYS QB . 20 . HB* 1 1 790 1 2 1 1 25 VAL MG1 . 22 . HG1* 1 1 791 1 1 1 1 23 CYS QB . 20 . HB* 1 1 791 1 2 1 1 25 VAL MG2 . 22 . HG2* 1 1 792 1 1 1 1 26 GLN HB2 . 23 . HB2 1 1 792 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 793 1 1 1 1 26 GLN HB3 . 23 . HB1 1 1 793 1 2 1 1 26 GLN QE . 23 . HE2* 1 1 794 1 1 1 1 27 THR MG . 24 . HG2* 1 1 794 1 2 1 1 33 SER QB . 30 . HB* 1 1 795 1 1 1 1 29 SER H . 26 . HN 1 1 795 1 2 1 1 29 SER QB . 26 . HB* 1 1 796 1 1 1 1 29 SER HA . 26 . HA 1 1 796 1 2 1 1 30 LEU QD . 27 . HD* 1 1 797 1 1 1 1 29 SER QB . 26 . HB* 1 1 797 1 2 1 1 31 GLU H . 28 . HN 1 1 798 1 1 1 1 29 SER QB . 26 . HB* 1 1 798 1 2 1 1 31 GLU QB . 28 . HB2 1 1 799 1 1 1 1 29 SER QB . 26 . HB* 1 1 799 1 2 1 1 31 GLU QG . 28 . HG* 1 1 800 1 1 1 1 30 LEU HA . 27 . HA 1 1 800 1 2 1 1 30 LEU QD . 27 . HD* 1 1 801 1 1 1 1 30 LEU QB . 27 . HB* 1 1 801 1 2 1 1 30 LEU QD . 27 . HD* 1 1 802 1 1 1 1 30 LEU QB . 27 . HB* 1 1 802 1 2 1 1 31 GLU QB . 28 . HB2 1 1 803 1 1 1 1 30 LEU QD . 27 . HD* 1 1 803 1 2 1 1 31 GLU H . 28 . HN 1 1 804 1 1 1 1 30 LEU QD . 27 . HD* 1 1 804 1 2 1 1 33 SER QB . 30 . HB* 1 1 805 1 1 1 1 30 LEU QD . 27 . HD* 1 1 805 1 2 1 1 34 LYS H . 31 . HN 1 1 806 1 1 1 1 30 LEU QD . 27 . HD* 1 1 806 1 2 1 1 34 LYS QB . 31 . HB* 1 1 807 1 1 1 1 30 LEU QD . 27 . HD* 1 1 807 1 2 1 1 37 LYS QE . 34 . HE* 1 1 808 1 1 1 1 31 GLU H . 28 . HN 1 1 808 1 2 1 1 31 GLU QG . 28 . HG* 1 1 809 1 1 1 1 31 GLU HA . 28 . HA 1 1 809 1 2 1 1 31 GLU QG . 28 . HG* 1 1 810 1 1 1 1 31 GLU HA . 28 . HA 1 1 810 1 2 1 1 34 LYS QG . 31 . HG* 1 1 811 1 1 1 1 31 GLU QG . 28 . HG* 1 1 811 1 2 1 1 32 CYS H . 29 . HN 1 1 812 1 1 1 1 31 GLU QG . 28 . HG* 1 1 812 1 2 1 1 34 LYS QE . 31 . HE* 1 1 813 1 1 1 1 33 SER H . 30 . HN 1 1 813 1 2 1 1 33 SER QB . 30 . HB* 1 1 814 1 1 1 1 33 SER H . 30 . HN 1 1 814 1 2 1 1 34 LYS QG . 31 . HG* 1 1 815 1 1 1 1 33 SER QB . 30 . HB* 1 1 815 1 2 1 1 34 LYS H . 31 . HN 1 1 816 1 1 1 1 34 LYS H . 31 . HN 1 1 816 1 2 1 1 34 LYS QG . 31 . HG* 1 1 817 1 1 1 1 34 LYS HA . 31 . HA 1 1 817 1 2 1 1 34 LYS QG . 31 . HG* 1 1 818 1 1 1 1 34 LYS QG . 31 . HG* 1 1 818 1 2 1 1 35 LYS H . 32 . HN 1 1 819 1 1 1 1 35 LYS HA . 32 . HA 1 1 819 1 2 1 1 35 LYS QG . 32 . HG* 1 1 820 1 1 1 1 35 LYS QE . 32 . HE* 1 1 820 1 2 1 1 35 LYS QG . 32 . HG* 1 1 821 1 1 1 1 35 LYS QG . 32 . HG* 1 1 821 1 2 1 1 38 THR MG . 35 . HG2* 1 1 822 1 1 1 1 36 HIS H . 33 . HN 1 1 822 1 2 1 1 37 LYS QG . 34 . HG* 1 1 823 1 1 1 1 36 HIS HA . 33 . HA 1 1 823 1 2 1 1 39 ARG QG . 36 . HG* 1 1 824 1 1 1 1 36 HIS HA . 33 . HA 1 1 824 1 2 1 1 39 ARG QD . 36 . HD* 1 1 825 1 1 1 1 36 HIS HE1 . 33 . HE1 1 1 825 1 2 1 1 37 LYS QG . 34 . HG* 1 1 826 1 1 1 1 36 HIS HE1 . 33 . HE1 1 1 826 1 2 1 1 42 CYS QB . 39 . HB* 1 1 827 1 1 1 1 37 LYS H . 34 . HN 1 1 827 1 2 1 1 37 LYS QG . 34 . HG* 1 1 828 1 1 1 1 37 LYS HA . 34 . HA 1 1 828 1 2 1 1 42 CYS QB . 39 . HB* 1 1 829 1 1 1 1 37 LYS QD . 34 . HD* 1 1 829 1 2 1 1 42 CYS QB . 39 . HB* 1 1 830 1 1 1 1 37 LYS QE . 34 . HE* 1 1 830 1 2 1 1 42 CYS QB . 39 . HB* 1 1 831 1 1 1 1 38 THR HB . 35 . HB 1 1 831 1 2 1 1 39 ARG QG . 36 . HG* 1 1 832 1 1 1 1 38 THR MG . 35 . HG2* 1 1 832 1 2 1 1 39 ARG QG . 36 . HG* 1 1 833 1 1 1 1 39 ARG HA . 36 . HA 1 1 833 1 2 1 1 39 ARG QG . 36 . HG* 1 1 834 1 1 1 1 39 ARG HA . 36 . HA 1 1 834 1 2 1 1 39 ARG QD . 36 . HD* 1 1 835 1 1 1 1 39 ARG QB . 36 . HB* 1 1 835 1 2 1 1 39 ARG QD . 36 . HD* 1 1 836 1 1 1 1 39 ARG QG . 36 . HG* 1 1 836 1 2 1 1 40 ASP H . 37 . HN 1 1 837 1 1 1 1 40 ASP H . 37 . HN 1 1 837 1 2 1 1 40 ASP QB . 37 . HB* 1 1 838 1 1 1 1 40 ASP H . 37 . HN 1 1 838 1 2 1 1 42 CYS QB . 39 . HB* 1 1 839 1 1 1 1 40 ASP QB . 37 . HB* 1 1 839 1 2 1 1 42 CYS QB . 39 . HB* 1 1 840 1 1 1 1 41 ASN HB2 . 38 . HB2 1 1 840 1 2 1 1 41 ASN QD . 38 . HD2* 1 1 841 1 1 1 1 41 ASN HB3 . 38 . HB1 1 1 841 1 2 1 1 42 CYS QB . 39 . HB* 1 1 842 1 1 1 1 42 CYS H . 39 . HN 1 1 842 1 2 1 1 42 CYS QB . 39 . HB* 1 1 843 1 1 1 1 43 SER H . 40 . HN 1 1 843 1 2 1 1 43 SER QB . 40 . HB* 1 1 844 1 1 1 1 43 SER HA . 40 . HA 1 1 844 1 2 1 1 43 SER QB . 40 . HB* 1 1 845 1 1 1 1 43 SER QB . 40 . HB* 1 1 845 1 2 1 1 45 GLN H . 42 . HN 1 1 846 1 1 1 1 43 SER QB . 40 . HB* 1 1 846 1 2 1 1 45 GLN QB . 42 . HB* 1 1 847 1 1 1 1 43 SER QB . 40 . HB* 1 1 847 1 2 1 1 45 GLN QG . 42 . HG* 1 1 848 1 1 1 1 45 GLN QB . 42 . HB* 1 1 848 1 2 1 1 45 GLN QE . 42 . HE2* 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 . . . . . 2.68 0.0 2.68 1 1 2 1 . . . . . 3.4 0.0 3.4 1 1 3 1 . . . . . 3.85 0.0 3.85 1 1 4 1 . . . . . 3.23 0.0 3.23 1 1 5 1 . . . . . 3.59 0.0 3.59 1 1 6 1 . . . . . 3.59 0.0 3.59 1 1 7 1 . . . . . 3.25 0.0 3.25 1 1 8 1 . . . . . 4.27 0.0 4.27 1 1 9 1 . . . . . 3.68 0.0 3.68 1 1 10 1 . . . . . 3.45 0.0 3.45 1 1 11 1 . . . . . 3.73 0.0 3.73 1 1 12 1 . . . . . 5.34 0.0 5.34 1 1 13 1 . . . . . 3.33 0.0 3.33 1 1 14 1 . . . . . 3.33 0.0 3.33 1 1 15 1 . . . . . 3.44 0.0 3.44 1 1 16 1 . . . . . 3.62 0.0 3.62 1 1 17 1 . . . . . 3.21 0.0 3.21 1 1 18 1 . . . . . 3.26 0.0 3.26 1 1 19 1 . . . . . 2.99 0.0 2.99 1 1 20 1 . . . . . 2.96 0.0 2.96 1 1 21 1 . . . . . 3.56 0.0 3.56 1 1 22 1 . . . . . 3.11 0.0 3.11 1 1 23 1 . . . . . 3.17 0.0 3.17 1 1 24 1 . . . . . 2.89 0.0 2.89 1 1 25 1 . . . . . 2.91 0.0 2.91 1 1 26 1 . . . . . 2.93 0.0 2.93 1 1 27 1 . . . . . 3.92 0.0 3.92 1 1 28 1 . . . . . 3.54 0.0 3.54 1 1 29 1 . . . . . 3.02 0.0 3.02 1 1 30 1 . . . . . 3.11 0.0 3.11 1 1 31 1 . . . . . 3.49 0.0 3.49 1 1 32 1 . . . . . 3.13 0.0 3.13 1 1 33 1 . . . . . 3.07 0.0 3.07 1 1 34 1 . . . . . 3.02 0.0 3.02 1 1 35 1 . . . . . 4.04 0.0 4.04 1 1 36 1 . . . . . 2.96 0.0 2.96 1 1 37 1 . . . . . . 0.0 3.27 1 1 38 1 . . . . . 3.67 0.0 3.67 1 1 39 1 . . . . . 3.79 0.0 3.79 1 1 40 1 . . . . . 3.92 0.0 3.92 1 1 41 1 . . . . . 3.38 0.0 3.38 1 1 42 1 . . . . . 4.18 0.0 4.18 1 1 43 1 . . . . . 3.5 0.0 3.5 1 1 44 1 . . . . . 3.81 0.0 3.81 1 1 45 1 . . . . . 3.05 0.0 3.05 1 1 46 1 . . . . . 3.7 0.0 3.7 1 1 47 1 . . . . . 4.92 0.0 4.92 1 1 48 1 . . . . . . 0.0 3.24 1 1 49 1 . . . . . 3.87 0.0 3.87 1 1 50 1 . . . . . 3.87 0.0 3.87 1 1 51 1 . . . . . 4.54 0.0 4.54 1 1 52 1 . . . . . 4.22 0.0 4.22 1 1 53 1 . . . . . 4.04 0.0 4.04 1 1 54 1 . . . . . 3.92 0.0 3.92 1 1 55 1 . . . . . 3.81 0.0 3.81 1 1 56 1 . . . . . 4.61 0.0 4.61 1 1 57 1 . . . . . 3.8 0.0 3.8 1 1 58 1 . . . . . 4.73 0.0 4.73 1 1 59 1 . . . . . 3.77 0.0 3.77 1 1 60 1 . . . . . 5.19 0.0 5.19 1 1 61 1 . . . . . 4.66 0.0 4.66 1 1 62 1 . . . . . 4.48 0.0 4.48 1 1 63 1 . . . . . 4.79 0.0 4.79 1 1 64 1 . . . . . 3.96 0.0 3.96 1 1 65 1 . . . . . 3.85 0.0 3.85 1 1 66 1 . . . . . 4.63 0.0 4.63 1 1 67 1 . . . . . 4.94 0.0 4.94 1 1 68 1 . . . . . 4.76 0.0 4.76 1 1 69 1 . . . . . 5.64 0.0 5.64 1 1 70 1 . . . . . 4.76 0.0 4.76 1 1 71 1 . . . . . 3.51 0.0 3.51 1 1 72 1 . . . . . 3.8 0.0 3.8 1 1 73 1 . . . . . 4.23 0.0 4.23 1 1 74 1 . . . . . 4.61 0.0 4.61 1 1 75 1 . . . . . 3.95 0.0 3.95 1 1 76 1 . . . . . 5.03 0.0 5.03 1 1 77 1 . . . . . 4.51 0.0 4.51 1 1 78 1 . . . . . 3.9 0.0 3.9 1 1 79 1 . . . . . 4.51 0.0 4.51 1 1 80 1 . . . . . 3.66 0.0 3.66 1 1 81 1 . . . . . 3.67 0.0 3.67 1 1 82 1 . . . . . 4.25 0.0 4.25 1 1 83 1 . . . . . 4.94 0.0 4.94 1 1 84 1 . . . . . 5.47 0.0 5.47 1 1 85 1 . . . . . 4.29 0.0 4.29 1 1 86 1 . . . . . 4.25 0.0 4.25 1 1 87 1 . . . . . 4.13 0.0 4.13 1 1 88 1 . . . . . 4.59 0.0 4.59 1 1 89 1 . . . . . 5.19 0.0 5.19 1 1 90 1 . . . . . 4.05 0.0 4.05 1 1 91 1 . . . . . 5.5 0.0 5.5 1 1 92 1 . . . . . 3.78 0.0 3.78 1 1 93 1 . . . . . 5.12 0.0 5.12 1 1 94 1 . . . . . 4.52 0.0 4.52 1 1 95 1 . . . . . 4.46 0.0 4.46 1 1 96 1 . . . . . 4.37 0.0 4.37 1 1 97 1 . . . . . 4.42 0.0 4.42 1 1 98 1 . . . . . 3.82 0.0 3.82 1 1 99 1 . . . . . 4.36 0.0 4.36 1 1 100 1 . . . . . 3.55 0.0 3.55 1 1 101 1 . . . . . 3.62 0.0 3.62 1 1 102 1 . . . . . 3.91 0.0 3.91 1 1 103 1 . . . . . 4.78 0.0 4.78 1 1 104 1 . . . . . 3.57 0.0 3.57 1 1 105 1 . . . . . 3.99 0.0 3.99 1 1 106 1 . . . . . 4.38 0.0 4.38 1 1 107 1 . . . . . 4.64 0.0 4.64 1 1 108 1 . . . . . 3.75 0.0 3.75 1 1 109 1 . . . . . 4.47 0.0 4.47 1 1 110 1 . . . . . 5.86 0.0 5.86 1 1 111 1 . . . . . . 0.0 4.33 1 1 112 1 . . . . . . 0.0 3.14 1 1 113 1 . . . . . 3.78 0.0 3.78 1 1 114 1 . . . . . 5.46 0.0 5.46 1 1 115 1 . . . . . 3.98 0.0 3.98 1 1 116 1 . . . . . 4.32 0.0 4.32 1 1 117 1 . . . . . 4.61 0.0 4.61 1 1 118 1 . . . . . 4.48 0.0 4.48 1 1 119 1 . . . . . 4.75 0.0 4.75 1 1 120 1 . . . . . 3.73 0.0 3.73 1 1 121 1 . . . . . 3.97 0.0 3.97 1 1 122 1 . . . . . 4.51 0.0 4.51 1 1 123 1 . . . . . 4.53 0.0 4.53 1 1 124 1 . . . . . 5.18 0.0 5.18 1 1 125 1 . . . . . 5.77 0.0 5.77 1 1 126 1 . . . . . 4.68 0.0 4.68 1 1 127 1 . . . . . 4.96 0.0 4.96 1 1 128 1 . . . . . 4.7 0.0 4.7 1 1 129 1 . . . . . 4.97 0.0 4.97 1 1 130 1 . . . . . 5.01 0.0 5.01 1 1 131 1 . . . . . 5.13 0.0 5.13 1 1 132 1 . . . . . 5.59 0.0 5.59 1 1 133 1 . . . . . 4.8 0.0 4.8 1 1 134 1 . . . . . 4.76 0.0 4.76 1 1 135 1 . . . . . 5.87 0.0 5.87 1 1 136 1 . . . . . 5.2 0.0 5.2 1 1 137 1 . . . . . 4.82 0.0 4.82 1 1 138 1 . . . . . 5.06 0.0 5.06 1 1 139 1 . . . . . 5.45 0.0 5.45 1 1 140 1 . . . . . 5.22 0.0 5.22 1 1 141 1 . . . . . 4.46 0.0 4.46 1 1 142 1 . . . . . 4.8 0.0 4.8 1 1 143 1 . . . . . 4.47 0.0 4.47 1 1 144 1 . . . . . 3.96 0.0 3.96 1 1 145 1 . . . . . 4.68 0.0 4.68 1 1 146 1 . . . . . 5.03 0.0 5.03 1 1 147 1 . . . . . 5.21 0.0 5.21 1 1 148 1 . . . . . 4.06 0.0 4.06 1 1 149 1 . . . . . 4.78 0.0 4.78 1 1 150 1 . . . . . 5.27 0.0 5.27 1 1 151 1 . . . . . 4.71 0.0 4.71 1 1 152 1 . . . . . 4.42 0.0 4.42 1 1 153 1 . . . . . 3.64 0.0 3.64 1 1 154 1 . . . . . 4.29 0.0 4.29 1 1 155 1 . . . . . 3.57 0.0 3.57 1 1 156 1 . . . . . 3.81 0.0 3.81 1 1 157 1 . . . . . 5.47 0.0 5.47 1 1 158 1 . . . . . 5.93 0.0 5.93 1 1 159 1 . . . . . 4.27 0.0 4.27 1 1 160 1 . . . . . 5.37 0.0 5.37 1 1 161 1 . . . . . . 0.0 4.05 1 1 162 1 . . . . . 4.12 0.0 4.12 1 1 163 1 . . . . . 4.1 0.0 4.1 1 1 164 1 . . . . . 3.33 0.0 3.33 1 1 165 1 . . . . . 3.33 0.0 3.33 1 1 166 1 . . . . . 4.75 0.0 4.75 1 1 167 1 . . . . . 5.32 0.0 5.32 1 1 168 1 . . . . . 5.63 0.0 5.63 1 1 169 1 . . . . . 6.0 0.0 6.0 1 1 170 1 . . . . . 4.89 0.0 4.89 1 1 171 1 . . . . . 5.07 0.0 5.07 1 1 172 1 . . . . . 5.34 0.0 5.34 1 1 173 1 . . . . . 4.5 0.0 4.5 1 1 174 1 . . . . . 5.82 0.0 5.82 1 1 175 1 . . . . . 5.54 0.0 5.54 1 1 176 1 . . . . . 5.51 0.0 5.51 1 1 177 1 . . . . . 6.0 0.0 6.0 1 1 178 1 . . . . . 4.86 0.0 4.86 1 1 179 1 . . . . . 6.0 0.0 6.0 1 1 180 1 . . . . . 5.8 0.0 5.8 1 1 181 1 . . . . . 4.28 0.0 4.28 1 1 182 1 . . . . . 5.45 0.0 5.45 1 1 183 1 . . . . . 5.09 0.0 5.09 1 1 184 1 . . . . . 5.22 0.0 5.22 1 1 185 1 . . . . . 5.18 0.0 5.18 1 1 186 1 . . . . . 4.82 0.0 4.82 1 1 187 1 . . . . . 4.82 0.0 4.82 1 1 188 1 . . . . . 3.25 0.0 3.25 1 1 189 1 . . . . . 5.51 0.0 5.51 1 1 190 1 . . . . . 4.37 0.0 4.37 1 1 191 1 . . . . . 4.91 0.0 4.91 1 1 192 1 . . . . . 5.29 0.0 5.29 1 1 193 1 . . . . . 5.53 0.0 5.53 1 1 194 1 . . . . . 5.32 0.0 5.32 1 1 195 1 . . . . . 4.51 0.0 4.51 1 1 196 1 . . . . . 3.96 0.0 3.96 1 1 197 1 . . . . . 5.22 0.0 5.22 1 1 198 1 . . . . . 5.29 0.0 5.29 1 1 199 1 . . . . . 5.58 0.0 5.58 1 1 200 1 . . . . . 5.47 0.0 5.47 1 1 201 1 . . . . . 5.23 0.0 5.23 1 1 202 1 . . . . . 5.83 0.0 5.83 1 1 203 1 . . . . . 6.0 0.0 6.0 1 1 204 1 . . . . . 5.53 0.0 5.53 1 1 205 1 . . . . . 4.89 0.0 4.89 1 1 206 1 . . . . . 6.0 0.0 6.0 1 1 207 1 . . . . . 5.24 0.0 5.24 1 1 208 1 . . . . . 5.69 0.0 5.69 1 1 209 1 . . . . . 5.36 0.0 5.36 1 1 210 1 . . . . . 5.49 0.0 5.49 1 1 211 1 . . . . . 5.05 0.0 5.05 1 1 212 1 . . . . . 4.04 0.0 4.04 1 1 213 1 . . . . . 3.95 0.0 3.95 1 1 214 1 . . . . . 4.52 0.0 4.52 1 1 215 1 . . . . . 4.43 0.0 4.43 1 1 216 1 . . . . . 3.02 0.0 3.02 1 1 217 1 . . . . . 3.01 0.0 3.01 1 1 218 1 . . . . . 3.05 0.0 3.05 1 1 219 1 . . . . . 3.73 0.0 3.73 1 1 220 1 . . . . . 2.76 0.0 2.76 1 1 221 1 . . . . . 3.14 0.0 3.14 1 1 222 1 . . . . . 4.48 0.0 4.48 1 1 223 1 . . . . . 2.99 0.0 2.99 1 1 224 1 . . . . . 4.61 0.0 4.61 1 1 225 1 . . . . . 4.66 0.0 4.66 1 1 226 1 . . . . . 4.18 0.0 4.18 1 1 227 1 . . . . . 3.75 0.0 3.75 1 1 228 1 . . . . . 4.75 0.0 4.75 1 1 229 1 . . . . . 4.29 0.0 4.29 1 1 230 1 . . . . . 3.0 0.0 3.0 1 1 231 1 . . . . . 3.47 0.0 3.47 1 1 232 1 . . . . . 3.31 0.0 3.31 1 1 233 1 . . . . . 3.62 0.0 3.62 1 1 234 1 . . . . . 5.26 0.0 5.26 1 1 235 1 . . . . . 4.28 0.0 4.28 1 1 236 1 . . . . . 5.04 0.0 5.04 1 1 237 1 . . . . . 4.56 0.0 4.56 1 1 238 1 . . . . . 4.93 0.0 4.93 1 1 239 1 . . . . . 3.38 0.0 3.38 1 1 240 1 . . . . . 3.52 0.0 3.52 1 1 241 1 . . . . . 4.92 0.0 4.92 1 1 242 1 . . . . . 3.77 0.0 3.77 1 1 243 1 . . . . . 4.26 0.0 4.26 1 1 244 1 . . . . . 3.01 0.0 3.01 1 1 245 1 . . . . . 4.41 0.0 4.41 1 1 246 1 . . . . . . 0.0 3.06 1 1 247 1 . . . . . 4.28 0.0 4.28 1 1 248 1 . . . . . 4.78 0.0 4.78 1 1 249 1 . . . . . 3.77 0.0 3.77 1 1 250 1 . . . . . 5.2 0.0 5.2 1 1 251 1 . . . . . 3.8 0.0 3.8 1 1 252 1 . . . . . 3.8 0.0 3.8 1 1 253 1 . . . . . 3.83 0.0 3.83 1 1 254 1 . . . . . 3.83 0.0 3.83 1 1 255 1 . . . . . . 0.0 3.22 1 1 256 1 . . . . . 5.34 0.0 5.34 1 1 257 1 . . . . . 5.02 0.0 5.02 1 1 258 1 . . . . . 4.22 0.0 4.22 1 1 259 1 . . . . . 3.38 0.0 3.38 1 1 260 1 . . . . . 3.77 0.0 3.77 1 1 261 1 . . . . . 3.17 0.0 3.17 1 1 262 1 . . . . . 4.83 0.0 4.83 1 1 263 1 . . . . . 3.85 0.0 3.85 1 1 264 1 . . . . . 3.95 0.0 3.95 1 1 265 1 . . . . . 3.75 0.0 3.75 1 1 266 1 . . . . . 2.89 0.0 2.89 1 1 267 1 . . . . . 4.59 0.0 4.59 1 1 268 1 . . . . . 4.59 0.0 4.59 1 1 269 1 . . . . . 3.75 0.0 3.75 1 1 270 1 . . . . . 5.19 0.0 5.19 1 1 271 1 . . . . . 4.35 0.0 4.35 1 1 272 1 . . . . . 4.84 0.0 4.84 1 1 273 1 . . . . . 4.37 0.0 4.37 1 1 274 1 . . . . . 5.32 0.0 5.32 1 1 275 1 . . . . . 3.52 0.0 3.52 1 1 276 1 . . . . . 4.42 0.0 4.42 1 1 277 1 . . . . . 6.0 0.0 6.0 1 1 278 1 . . . . . 2.98 0.0 2.98 1 1 279 1 . . . . . 4.68 0.0 4.68 1 1 280 1 . . . . . 4.63 0.0 4.63 1 1 281 1 . . . . . 5.58 0.0 5.58 1 1 282 1 . . . . . 5.36 0.0 5.36 1 1 283 1 . . . . . 3.61 0.0 3.61 1 1 284 1 . . . . . 3.81 0.0 3.81 1 1 285 1 . . . . . 4.58 0.0 4.58 1 1 286 1 . . . . . 4.06 0.0 4.06 1 1 287 1 . . . . . 3.9 0.0 3.9 1 1 288 1 . . . . . 4.62 0.0 4.62 1 1 289 1 . . . . . 4.92 0.0 4.92 1 1 290 1 . . . . . 6.0 0.0 6.0 1 1 291 1 . . . . . 4.12 0.0 4.12 1 1 292 1 . . . . . 4.2 0.0 4.2 1 1 293 1 . . . . . 5.03 0.0 5.03 1 1 294 1 . . . . . 3.78 0.0 3.78 1 1 295 1 . . . . . 3.97 0.0 3.97 1 1 296 1 . . . . . 5.6 0.0 5.6 1 1 297 1 . . . . . 3.6 0.0 3.6 1 1 298 1 . . . . . 4.3 0.0 4.3 1 1 299 1 . . . . . 4.18 0.0 4.18 1 1 300 1 . . . . . 3.05 0.0 3.05 1 1 301 1 . . . . . 3.34 0.0 3.34 1 1 302 1 . . . . . 4.4 0.0 4.4 1 1 303 1 . . . . . 4.3 0.0 4.3 1 1 304 1 . . . . . 3.73 0.0 3.73 1 1 305 1 . . . . . 3.57 0.0 3.57 1 1 306 1 . . . . . 4.68 0.0 4.68 1 1 307 1 . . . . . 3.66 0.0 3.66 1 1 308 1 . . . . . 4.88 0.0 4.88 1 1 309 1 . . . . . 6.0 0.0 6.0 1 1 310 1 . . . . . 6.0 0.0 6.0 1 1 311 1 . . . . . 5.3 0.0 5.3 1 1 312 1 . . . . . 2.97 0.0 2.97 1 1 313 1 . . . . . 4.01 0.0 4.01 1 1 314 1 . . . . . 4.46 0.0 4.46 1 1 315 1 . . . . . 4.78 0.0 4.78 1 1 316 1 . . . . . 5.8 0.0 5.8 1 1 317 1 . . . . . 6.0 0.0 6.0 1 1 318 1 . . . . . 4.8 0.0 4.8 1 1 319 1 . . . . . 3.34 0.0 3.34 1 1 320 1 . . . . . 5.22 0.0 5.22 1 1 321 1 . . . . . 5.19 0.0 5.19 1 1 322 1 . . . . . 3.61 0.0 3.61 1 1 323 1 . . . . . 4.07 0.0 4.07 1 1 324 1 . . . . . 4.75 0.0 4.75 1 1 325 1 . . . . . 4.59 0.0 4.59 1 1 326 1 . . . . . 2.78 0.0 2.78 1 1 327 1 . . . . . 3.61 0.0 3.61 1 1 328 1 . . . . . 3.81 0.0 3.81 1 1 329 1 . . . . . 4.01 0.0 4.01 1 1 330 1 . . . . . 3.82 0.0 3.82 1 1 331 1 . . . . . 3.41 0.0 3.41 1 1 332 1 . . . . . 3.27 0.0 3.27 1 1 333 1 . . . . . 5.47 0.0 5.47 1 1 334 1 . . . . . 4.16 0.0 4.16 1 1 335 1 . . . . . 2.99 0.0 2.99 1 1 336 1 . . . . . 4.01 0.0 4.01 1 1 337 1 . . . . . 3.73 0.0 3.73 1 1 338 1 . . . . . 4.67 0.0 4.67 1 1 339 1 . . . . . 4.56 0.0 4.56 1 1 340 1 . . . . . 3.27 0.0 3.27 1 1 341 1 . . . . . 4.27 0.0 4.27 1 1 342 1 . . . . . 3.85 0.0 3.85 1 1 343 1 . . . . . 4.83 0.0 4.83 1 1 344 1 . . . . . 4.89 0.0 4.89 1 1 345 1 . . . . . 4.39 0.0 4.39 1 1 346 1 . . . . . 4.46 0.0 4.46 1 1 347 1 . . . . . 4.0 0.0 4.0 1 1 348 1 . . . . . 4.5 0.0 4.5 1 1 349 1 . . . . . 4.3 0.0 4.3 1 1 350 1 . . . . . 4.86 0.0 4.86 1 1 351 1 . . . . . 6.0 0.0 6.0 1 1 352 1 . . . . . 4.44 0.0 4.44 1 1 353 1 . . . . . 4.3 0.0 4.3 1 1 354 1 . . . . . 4.26 0.0 4.26 1 1 355 1 . . . . . 4.46 0.0 4.46 1 1 356 1 . . . . . 4.86 0.0 4.86 1 1 357 1 . . . . . 3.75 0.0 3.75 1 1 358 1 . . . . . 5.24 0.0 5.24 1 1 359 1 . . . . . 3.95 0.0 3.95 1 1 360 1 . . . . . 5.0 0.0 5.0 1 1 361 1 . . . . . 4.49 0.0 4.49 1 1 362 1 . . . . . 5.14 0.0 5.14 1 1 363 1 . . . . . 4.67 0.0 4.67 1 1 364 1 . . . . . 3.09 0.0 3.09 1 1 365 1 . . . . . 3.46 0.0 3.46 1 1 366 1 . . . . . 4.86 0.0 4.86 1 1 367 1 . . . . . 5.58 0.0 5.58 1 1 368 1 . . . . . 4.91 0.0 4.91 1 1 369 1 . . . . . 3.3 0.0 3.3 1 1 370 1 . . . . . 3.96 0.0 3.96 1 1 371 1 . . . . . 4.21 0.0 4.21 1 1 372 1 . . . . . 3.51 0.0 3.51 1 1 373 1 . . . . . 4.57 0.0 4.57 1 1 374 1 . . . . . 5.18 0.0 5.18 1 1 375 1 . . . . . 5.54 0.0 5.54 1 1 376 1 . . . . . 3.12 0.0 3.12 1 1 377 1 . . . . . 3.63 0.0 3.63 1 1 378 1 . . . . . 4.65 0.0 4.65 1 1 379 1 . . . . . 2.88 0.0 2.88 1 1 380 1 . . . . . 3.26 0.0 3.26 1 1 381 1 . . . . . 4.36 0.0 4.36 1 1 382 1 . . . . . 4.8 0.0 4.8 1 1 383 1 . . . . . 6.0 0.0 6.0 1 1 384 1 . . . . . 4.63 0.0 4.63 1 1 385 1 . . . . . 5.16 0.0 5.16 1 1 386 1 . . . . . 5.39 0.0 5.39 1 1 387 1 . . . . . 4.59 0.0 4.59 1 1 388 1 . . . . . 4.56 0.0 4.56 1 1 389 1 . . . . . 3.98 0.0 3.98 1 1 390 1 . . . . . 3.65 0.0 3.65 1 1 391 1 . . . . . 3.64 0.0 3.64 1 1 392 1 . . . . . 4.13 0.0 4.13 1 1 393 1 . . . . . 2.87 0.0 2.87 1 1 394 1 . . . . . 4.07 0.0 4.07 1 1 395 1 . . . . . 4.3 0.0 4.3 1 1 396 1 . . . . . 3.6 0.0 3.6 1 1 397 1 . . . . . 3.93 0.0 3.93 1 1 398 1 . . . . . 3.66 0.0 3.66 1 1 399 1 . . . . . 4.29 0.0 4.29 1 1 400 1 . . . . . 3.84 0.0 3.84 1 1 401 1 . . . . . 3.29 0.0 3.29 1 1 402 1 . . . . . 3.34 0.0 3.34 1 1 403 1 . . . . . 5.18 0.0 5.18 1 1 404 1 . . . . . 3.96 0.0 3.96 1 1 405 1 . . . . . 3.46 0.0 3.46 1 1 406 1 . . . . . 3.95 0.0 3.95 1 1 407 1 . . . . . 4.1 0.0 4.1 1 1 408 1 . . . . . 5.5 0.0 5.5 1 1 409 1 . . . . . 6.0 0.0 6.0 1 1 410 1 . . . . . 3.94 0.0 3.94 1 1 411 1 . . . . . 2.87 0.0 2.87 1 1 412 1 . . . . . 4.04 0.0 4.04 1 1 413 1 . . . . . 5.13 0.0 5.13 1 1 414 1 . . . . . 5.12 0.0 5.12 1 1 415 1 . . . . . 4.09 0.0 4.09 1 1 416 1 . . . . . 3.73 0.0 3.73 1 1 417 1 . . . . . 4.54 0.0 4.54 1 1 418 1 . . . . . 2.89 0.0 2.89 1 1 419 1 . . . . . 3.27 0.0 3.27 1 1 420 1 . . . . . 4.15 0.0 4.15 1 1 421 1 . . . . . 3.15 0.0 3.15 1 1 422 1 . . . . . 3.98 0.0 3.98 1 1 423 1 . . . . . 4.45 0.0 4.45 1 1 424 1 . . . . . 3.22 0.0 3.22 1 1 425 1 . . . . . . 0.0 3.04 1 1 426 1 . . . . . 4.67 0.0 4.67 1 1 427 1 . . . . . 5.11 0.0 5.11 1 1 428 1 . . . . . 3.59 0.0 3.59 1 1 429 1 . . . . . 3.59 0.0 3.59 1 1 430 1 . . . . . 4.99 0.0 4.99 1 1 431 1 . . . . . 5.32 0.0 5.32 1 1 432 1 . . . . . 3.72 0.0 3.72 1 1 433 1 . . . . . 3.34 0.0 3.34 1 1 434 1 . . . . . 3.82 0.0 3.82 1 1 435 1 . . . . . 5.87 0.0 5.87 1 1 436 1 . . . . . 3.64 0.0 3.64 1 1 437 1 . . . . . 3.75 0.0 3.75 1 1 438 1 . . . . . 3.79 0.0 3.79 1 1 439 1 . . . . . 3.79 0.0 3.79 1 1 440 1 . . . . . 4.01 0.0 4.01 1 1 441 1 . . . . . 4.71 0.0 4.71 1 1 442 1 . . . . . 3.99 0.0 3.99 1 1 443 1 . . . . . 4.2 0.0 4.2 1 1 444 1 . . . . . 4.2 0.0 4.2 1 1 445 1 . . . . . 3.41 0.0 3.41 1 1 446 1 . . . . . 3.32 0.0 3.32 1 1 447 1 . . . . . 4.22 0.0 4.22 1 1 448 1 . . . . . 4.75 0.0 4.75 1 1 449 1 . . . . . 5.52 0.0 5.52 1 1 450 1 . . . . . 4.38 0.0 4.38 1 1 451 1 . . . . . 4.22 0.0 4.22 1 1 452 1 . . . . . 3.42 0.0 3.42 1 1 453 1 . . . . . 4.07 0.0 4.07 1 1 454 1 . . . . . 3.98 0.0 3.98 1 1 455 1 . . . . . 4.56 0.0 4.56 1 1 456 1 . . . . . 5.83 0.0 5.83 1 1 457 1 . . . . . 4.75 0.0 4.75 1 1 458 1 . . . . . 2.95 0.0 2.95 1 1 459 1 . . . . . 3.89 0.0 3.89 1 1 460 1 . . . . . 5.43 0.0 5.43 1 1 461 1 . . . . . 4.5 0.0 4.5 1 1 462 1 . . . . . 4.62 0.0 4.62 1 1 463 1 . . . . . 4.82 0.0 4.82 1 1 464 1 . . . . . 3.18 0.0 3.18 1 1 465 1 . . . . . 4.11 0.0 4.11 1 1 466 1 . . . . . 4.0 0.0 4.0 1 1 467 1 . . . . . 3.94 0.0 3.94 1 1 468 1 . . . . . 3.14 0.0 3.14 1 1 469 1 . . . . . 5.53 0.0 5.53 1 1 470 1 . . . . . 5.76 0.0 5.76 1 1 471 1 . . . . . 5.48 0.0 5.48 1 1 472 1 . . . . . 4.39 0.0 4.39 1 1 473 1 . . . . . 4.42 0.0 4.42 1 1 474 1 . . . . . 4.64 0.0 4.64 1 1 475 1 . . . . . 4.7 0.0 4.7 1 1 476 1 . . . . . 4.21 0.0 4.21 1 1 477 1 . . . . . 5.8 0.0 5.8 1 1 478 1 . . . . . 6.0 0.0 6.0 1 1 479 1 . . . . . 5.06 0.0 5.06 1 1 480 1 . . . . . 6.0 0.0 6.0 1 1 481 1 . . . . . 4.29 0.0 4.29 1 1 482 1 . . . . . 3.74 0.0 3.74 1 1 483 1 . . . . . 4.61 0.0 4.61 1 1 484 1 . . . . . 2.77 0.0 2.77 1 1 485 1 . . . . . 4.91 0.0 4.91 1 1 486 1 . . . . . 4.71 0.0 4.71 1 1 487 1 . . . . . 3.73 0.0 3.73 1 1 488 1 . . . . . 3.87 0.0 3.87 1 1 489 1 . . . . . 4.5 0.0 4.5 1 1 490 1 . . . . . 6.0 0.0 6.0 1 1 491 1 . . . . . 5.16 0.0 5.16 1 1 492 1 . . . . . 5.01 0.0 5.01 1 1 493 1 . . . . . 4.26 0.0 4.26 1 1 494 1 . . . . . 4.58 0.0 4.58 1 1 495 1 . . . . . 4.59 0.0 4.59 1 1 496 1 . . . . . 4.14 0.0 4.14 1 1 497 1 . . . . . 4.9 0.0 4.9 1 1 498 1 . . . . . 4.61 0.0 4.61 1 1 499 1 . . . . . 4.16 0.0 4.16 1 1 500 1 . . . . . 3.35 0.0 3.35 1 1 501 1 . . . . . 3.53 0.0 3.53 1 1 502 1 . . . . . 4.6 0.0 4.6 1 1 503 1 . . . . . 4.04 0.0 4.04 1 1 504 1 . . . . . 4.04 0.0 4.04 1 1 505 1 . . . . . 5.1 0.0 5.1 1 1 506 1 . . . . . 4.4 0.0 4.4 1 1 507 1 . . . . . 5.79 0.0 5.79 1 1 508 1 . . . . . 3.72 0.0 3.72 1 1 509 1 . . . . . 5.78 0.0 5.78 1 1 510 1 . . . . . 6.0 0.0 6.0 1 1 511 1 . . . . . 6.0 0.0 6.0 1 1 512 1 . . . . . 3.7 0.0 3.7 1 1 513 1 . . . . . 5.07 0.0 5.07 1 1 514 1 . . . . . 4.78 0.0 4.78 1 1 515 1 . . . . . 4.37 0.0 4.37 1 1 516 1 . . . . . 5.13 0.0 5.13 1 1 517 1 . . . . . 4.8 0.0 4.8 1 1 518 1 . . . . . 4.24 0.0 4.24 1 1 519 1 . . . . . 4.8 0.0 4.8 1 1 520 1 . . . . . 3.96 0.0 3.96 1 1 521 1 . . . . . 4.32 0.0 4.32 1 1 522 1 . . . . . 3.82 0.0 3.82 1 1 523 1 . . . . . 5.1 0.0 5.1 1 1 524 1 . . . . . 4.03 0.0 4.03 1 1 525 1 . . . . . 3.41 0.0 3.41 1 1 526 1 . . . . . 4.56 0.0 4.56 1 1 527 1 . . . . . 5.45 0.0 5.45 1 1 528 1 . . . . . 5.64 0.0 5.64 1 1 529 1 . . . . . 3.74 0.0 3.74 1 1 530 1 . . . . . 4.43 0.0 4.43 1 1 531 1 . . . . . 3.09 0.0 3.09 1 1 532 1 . . . . . 4.39 0.0 4.39 1 1 533 1 . . . . . 3.37 0.0 3.37 1 1 534 1 . . . . . 4.46 0.0 4.46 1 1 535 1 . . . . . 3.93 0.0 3.93 1 1 536 1 . . . . . 5.35 0.0 5.35 1 1 537 1 . . . . . 3.95 0.0 3.95 1 1 538 1 . . . . . 4.52 0.0 4.52 1 1 539 1 . . . . . 4.86 0.0 4.86 1 1 540 1 . . . . . 3.05 0.0 3.05 1 1 541 1 . . . . . 3.08 0.0 3.08 1 1 542 1 . . . . . 3.44 0.0 3.44 1 1 543 1 . . . . . 4.12 0.0 4.12 1 1 544 1 . . . . . 3.75 0.0 3.75 1 1 545 1 . . . . . 3.68 0.0 3.68 1 1 546 1 . . . . . . 0.0 3.63 1 1 547 1 . . . . . 4.56 0.0 4.56 1 1 548 1 . . . . . 3.93 0.0 3.93 1 1 549 1 . . . . . 4.11 0.0 4.11 1 1 550 1 . . . . . 4.92 0.0 4.92 1 1 551 1 . . . . . 3.69 0.0 3.69 1 1 552 1 . . . . . 4.02 0.0 4.02 1 1 553 1 . . . . . 3.9 0.0 3.9 1 1 554 1 . . . . . 3.4 0.0 3.4 1 1 555 1 . . . . . 3.14 0.0 3.14 1 1 556 1 . . . . . 5.24 0.0 5.24 1 1 557 1 . . . . . 5.65 0.0 5.65 1 1 558 1 . . . . . 3.74 0.0 3.74 1 1 559 1 . . . . . 3.58 0.0 3.58 1 1 560 1 . . . . . 4.76 0.0 4.76 1 1 561 1 . . . . . 4.03 0.0 4.03 1 1 562 1 . . . . . 4.3 0.0 4.3 1 1 563 1 . . . . . 3.84 0.0 3.84 1 1 564 1 . . . . . 4.72 0.0 4.72 1 1 565 1 . . . . . 3.2 0.0 3.2 1 1 566 1 . . . . . 3.79 0.0 3.79 1 1 567 1 . . . . . 4.07 0.0 4.07 1 1 568 1 . . . . . 3.53 0.0 3.53 1 1 569 1 . . . . . 3.85 0.0 3.85 1 1 570 1 . . . . . 4.13 0.0 4.13 1 1 571 1 . . . . . 3.57 0.0 3.57 1 1 572 1 . . . . . . 0.0 3.6 1 1 573 1 . . . . . 3.43 0.0 3.43 1 1 574 1 . . . . . 3.7 0.0 3.7 1 1 575 1 . . . . . 5.12 0.0 5.12 1 1 576 1 . . . . . 3.34 0.0 3.34 1 1 577 1 . . . . . 3.55 0.0 3.55 1 1 578 1 . . . . . 4.48 0.0 4.48 1 1 579 1 . . . . . 4.5 0.0 4.5 1 1 580 1 . . . . . 3.76 0.0 3.76 1 1 581 1 . . . . . 4.38 0.0 4.38 1 1 582 1 . . . . . 3.39 0.0 3.39 1 1 583 1 . . . . . 3.72 0.0 3.72 1 1 584 1 . . . . . 6.0 0.0 6.0 1 1 585 1 . . . . . 3.69 0.0 3.69 1 1 586 1 . . . . . 4.02 0.0 4.02 1 1 587 1 . . . . . 3.49 0.0 3.49 1 1 588 1 . . . . . 4.05 0.0 4.05 1 1 589 1 . . . . . 4.2 0.0 4.2 1 1 590 1 . . . . . 3.09 0.0 3.09 1 1 591 1 . . . . . 2.81 0.0 2.81 1 1 592 1 . . . . . 3.59 0.0 3.59 1 1 593 1 . . . . . 3.19 0.0 3.19 1 1 594 1 . . . . . . 0.0 3.27 1 1 595 1 . . . . . 3.81 0.0 3.81 1 1 596 1 . . . . . 4.48 0.0 4.48 1 1 597 1 . . . . . 4.06 0.0 4.06 1 1 598 1 . . . . . 3.2 0.0 3.2 1 1 599 1 . . . . . 3.31 0.0 3.31 1 1 600 1 . . . . . 4.53 0.0 4.53 1 1 601 1 . . . . . 3.85 0.0 3.85 1 1 602 1 . . . . . 3.16 0.0 3.16 1 1 603 1 . . . . . 3.8 0.0 3.8 1 1 604 1 . . . . . 3.6 0.0 3.6 1 1 605 1 . . . . . 4.71 0.0 4.71 1 1 606 1 . . . . . 4.43 0.0 4.43 1 1 607 1 . . . . . 4.59 0.0 4.59 1 1 608 1 . . . . . 3.68 0.0 3.68 1 1 609 1 . . . . . 4.54 0.0 4.54 1 1 610 1 . . . . . 4.85 0.0 4.85 1 1 611 1 . . . . . 4.71 0.0 4.71 1 1 612 1 . . . . . 4.27 0.0 4.27 1 1 613 1 . . . . . 4.81 0.0 4.81 1 1 614 1 . . . . . 5.11 0.0 5.11 1 1 615 1 . . . . . 4.71 0.0 4.71 1 1 616 1 . . . . . 4.36 0.0 4.36 1 1 617 1 . . . . . 5.87 0.0 5.87 1 1 618 1 . . . . . 6.0 0.0 6.0 1 1 619 1 . . . . . 3.53 0.0 3.53 1 1 620 1 . . . . . 4.42 0.0 4.42 1 1 621 1 . . . . . 4.33 0.0 4.33 1 1 622 1 . . . . . 4.77 0.0 4.77 1 1 623 1 . . . . . . 0.0 4.23 1 1 624 1 . . . . . 5.66 0.0 5.66 1 1 625 1 . . . . . 3.53 0.0 3.53 1 1 626 1 . . . . . 4.26 0.0 4.26 1 1 627 1 . . . . . 5.12 0.0 5.12 1 1 628 1 . . . . . 4.21 0.0 4.21 1 1 629 1 . . . . . 5.05 0.0 5.05 1 1 630 1 . . . . . 5.65 0.0 5.65 1 1 631 1 . . . . . 4.45 0.0 4.45 1 1 632 1 . . . . . 3.77 0.0 3.77 1 1 633 1 . . . . . 3.43 0.0 3.43 1 1 634 1 . . . . . 4.9 0.0 4.9 1 1 635 1 . . . . . 4.25 0.0 4.25 1 1 636 1 . . . . . 4.51 0.0 4.51 1 1 637 1 . . . . . 4.53 0.0 4.53 1 1 638 1 . . . . . 4.43 0.0 4.43 1 1 639 1 . . . . . 4.76 0.0 4.76 1 1 640 1 . . . . . 4.5 0.0 4.5 1 1 641 1 . . . . . 4.79 0.0 4.79 1 1 642 1 . . . . . 3.72 0.0 3.72 1 1 643 1 . . . . . 4.68 0.0 4.68 1 1 644 1 . . . . . 4.14 0.0 4.14 1 1 645 1 . . . . . 2.55 0.0 2.55 1 1 646 1 . . . . . 3.55 0.0 3.55 1 1 647 1 . . . . . 3.58 0.0 3.58 1 1 648 1 . . . . . 4.78 0.0 4.78 1 1 649 1 . . . . . 5.45 0.0 5.45 1 1 650 1 . . . . . 4.34 0.0 4.34 1 1 651 1 . . . . . 5.46 0.0 5.46 1 1 652 1 . . . . . 4.71 0.0 4.71 1 1 653 1 . . . . . 4.6 0.0 4.6 1 1 654 1 . . . . . 4.56 0.0 4.56 1 1 655 1 . . . . . 4.59 0.0 4.59 1 1 656 1 . . . . . 4.17 0.0 4.17 1 1 657 1 . . . . . 3.85 0.0 3.85 1 1 658 1 . . . . . 4.27 0.0 4.27 1 1 659 1 . . . . . 5.05 0.0 5.05 1 1 660 1 . . . . . 3.63 0.0 3.63 1 1 661 1 . . . . . 5.66 0.0 5.66 1 1 662 1 . . . . . 6.0 0.0 6.0 1 1 663 1 . . . . . 3.0 0.0 3.0 1 1 664 1 . . . . . 4.47 0.0 4.47 1 1 665 1 . . . . . 4.13 0.0 4.13 1 1 666 1 . . . . . 5.1 0.0 5.1 1 1 667 1 . . . . . 4.99 0.0 4.99 1 1 668 1 . . . . . 5.03 0.0 5.03 1 1 669 1 . . . . . 5.0 0.0 5.0 1 1 670 1 . . . . . 4.95 0.0 4.95 1 1 671 1 . . . . . 4.56 0.0 4.56 1 1 672 1 . . . . . 4.61 0.0 4.61 1 1 673 1 . . . . . 5.15 0.0 5.15 1 1 674 1 . . . . . 4.51 0.0 4.51 1 1 675 1 . . . . . 5.36 0.0 5.36 1 1 676 1 . . . . . 5.38 0.0 5.38 1 1 677 1 . . . . . 5.25 0.0 5.25 1 1 678 1 . . . . . 4.77 0.0 4.77 1 1 679 1 . . . . . 6.0 0.0 6.0 1 1 680 1 . . . . . 6.0 0.0 6.0 1 1 681 1 . . . . . 4.82 0.0 4.82 1 1 682 1 . . . . . 5.52 0.0 5.52 1 1 683 1 . . . . . 6.0 0.0 6.0 1 1 684 1 . . . . . 4.94 0.0 4.94 1 1 685 1 . . . . . 6.0 0.0 6.0 1 1 686 1 . . . . . 6.0 0.0 6.0 1 1 687 1 . . . . . 5.36 0.0 5.36 1 1 688 1 . . . . . 4.9 0.0 4.9 1 1 689 1 . . . . . 5.22 0.0 5.22 1 1 690 1 . . . . . 6.0 0.0 6.0 1 1 691 1 . . . . . 4.87 0.0 4.87 1 1 692 1 . . . . . 4.96 0.0 4.96 1 1 693 1 . . . . . 5.23 0.0 5.23 1 1 694 1 . . . . . 4.86 0.0 4.86 1 1 695 1 . . . . . 5.18 0.0 5.18 1 1 696 1 . . . . . 5.61 0.0 5.61 1 1 697 1 . . . . . 3.82 0.0 3.82 1 1 698 1 . . . . . 3.88 0.0 3.88 1 1 699 1 . . . . . 4.41 0.0 4.41 1 1 700 1 . . . . . 4.61 0.0 4.61 1 1 701 1 . . . . . 3.79 0.0 3.79 1 1 702 1 . . . . . 5.43 0.0 5.43 1 1 703 1 . . . . . 3.16 0.0 3.16 1 1 704 1 . . . . . 4.72 0.0 4.72 1 1 705 1 . . . . . . 0.0 4.68 1 1 706 1 . . . . . 5.14 0.0 5.14 1 1 707 1 . . . . . 5.19 0.0 5.19 1 1 708 1 . . . . . 5.99 0.0 5.99 1 1 709 1 . . . . . 5.39 0.0 5.39 1 1 710 1 . . . . . 4.95 0.0 4.95 1 1 711 1 . . . . . 5.16 0.0 5.16 1 1 712 1 . . . . . 5.2 0.0 5.2 1 1 713 1 . . . . . 5.94 0.0 5.94 1 1 714 1 . . . . . 5.1 0.0 5.1 1 1 715 1 . . . . . 5.66 0.0 5.66 1 1 716 1 . . . . . 5.88 0.0 5.88 1 1 717 1 . . . . . 5.32 0.0 5.32 1 1 718 1 . . . . . 5.58 0.0 5.58 1 1 719 1 . . . . . 4.61 0.0 4.61 1 1 720 1 . . . . . 4.37 0.0 4.37 1 1 721 1 . . . . . 5.02 0.0 5.02 1 1 722 1 . . . . . 4.76 0.0 4.76 1 1 723 1 . . . . . 4.77 0.0 4.77 1 1 724 1 . . . . . 5.86 0.0 5.86 1 1 725 1 . . . . . 4.68 0.0 4.68 1 1 726 1 . . . . . 5.01 0.0 5.01 1 1 727 1 . . . . . 5.13 0.0 5.13 1 1 728 1 . . . . . 5.26 0.0 5.26 1 1 729 1 . . . . . 5.28 0.0 5.28 1 1 730 1 . . . . . 5.16 0.0 5.16 1 1 731 1 . . . . . 5.53 0.0 5.53 1 1 732 1 . . . . . 4.92 0.0 4.92 1 1 733 1 . . . . . 5.24 0.0 5.24 1 1 734 1 . . . . . 5.18 0.0 5.18 1 1 735 1 . . . . . 5.6 0.0 5.6 1 1 736 1 . . . . . 5.05 0.0 5.05 1 1 737 1 . . . . . 6.0 0.0 6.0 1 1 738 1 . . . . . 4.5 0.0 4.5 1 1 739 1 . . . . . 4.83 0.0 4.83 1 1 740 1 . . . . . 3.77 0.0 3.77 1 1 741 1 . . . . . 4.24 0.0 4.24 1 1 742 1 . . . . . 4.25 0.0 4.25 1 1 743 1 . . . . . 5.05 0.0 5.05 1 1 744 1 . . . . . 5.28 0.0 5.28 1 1 745 1 . . . . . 5.17 0.0 5.17 1 1 746 1 . . . . . 3.87 0.0 3.87 1 1 747 1 . . . . . 4.7 0.0 4.7 1 1 748 1 . . . . . 4.62 0.0 4.62 1 1 749 1 . . . . . 4.87 0.0 4.87 1 1 750 1 . . . . . 4.85 0.0 4.85 1 1 751 1 . . . . . 4.23 0.0 4.23 1 1 752 1 . . . . . 2.86 0.0 2.86 1 1 753 1 . . . . . 3.36 0.0 3.36 1 1 754 1 . . . . . 5.81 0.0 5.81 1 1 755 1 . . . . . 4.91 0.0 4.91 1 1 756 1 . . . . . 4.64 0.0 4.64 1 1 757 1 . . . . . 4.07 0.0 4.07 1 1 758 1 . . . . . 4.63 0.0 4.63 1 1 759 1 . . . . . 4.05 0.0 4.05 1 1 760 1 . . . . . 4.38 0.0 4.38 1 1 761 1 . . . . . 4.99 0.0 4.99 1 1 762 1 . . . . . 3.53 0.0 3.53 1 1 763 1 . . . . . 4.2 0.0 4.2 1 1 764 1 . . . . . 5.34 0.0 5.34 1 1 765 1 . . . . . 4.74 0.0 4.74 1 1 766 1 . . . . . 4.32 0.0 4.32 1 1 767 1 . . . . . 4.54 0.0 4.54 1 1 768 1 . . . . . 5.92 0.0 5.92 1 1 769 1 . . . . . 5.81 0.0 5.81 1 1 770 1 . . . . . 4.2 0.0 4.2 1 1 771 1 . . . . . 4.63 0.0 4.63 1 1 772 1 . . . . . 4.82 0.0 4.82 1 1 773 1 . . . . . 3.56 0.0 3.56 1 1 774 1 . . . . . 5.8 0.0 5.8 1 1 775 1 . . . . . 4.38 0.0 4.38 1 1 776 1 . . . . . 5.92 0.0 5.92 1 1 777 1 . . . . . 4.16 0.0 4.16 1 1 778 1 . . . . . 3.38 0.0 3.38 1 1 779 1 . . . . . 5.69 0.0 5.69 1 1 780 1 . . . . . 3.39 0.0 3.39 1 1 781 1 . . . . . 5.06 0.0 5.06 1 1 782 1 . . . . . 3.94 0.0 3.94 1 1 783 1 . . . . . 4.4 0.0 4.4 1 1 784 1 . . . . . 5.61 0.0 5.61 1 1 785 1 . . . . . 3.64 0.0 3.64 1 1 786 1 . . . . . 2.55 0.0 2.55 1 1 787 1 . . . . . 5.16 0.0 5.16 1 1 788 1 . . . . . 4.54 0.0 4.54 1 1 789 1 . . . . . 5.01 0.0 5.01 1 1 790 1 . . . . . 4.55 0.0 4.55 1 1 791 1 . . . . . 5.02 0.0 5.02 1 1 792 1 . . . . . 4.05 0.0 4.05 1 1 793 1 . . . . . 4.19 0.0 4.19 1 1 794 1 . . . . . 4.22 0.0 4.22 1 1 795 1 . . . . . 3.63 0.0 3.63 1 1 796 1 . . . . . 5.27 0.0 5.27 1 1 797 1 . . . . . 3.29 0.0 3.29 1 1 798 1 . . . . . 5.58 0.0 5.58 1 1 799 1 . . . . . 5.62 0.0 5.62 1 1 800 1 . . . . . 3.14 0.0 3.14 1 1 801 1 . . . . . 2.73 0.0 2.73 1 1 802 1 . . . . . 4.53 0.0 4.53 1 1 803 1 . . . . . 4.53 0.0 4.53 1 1 804 1 . . . . . 4.77 0.0 4.77 1 1 805 1 . . . . . 5.92 0.0 5.92 1 1 806 1 . . . . . 5.03 0.0 5.03 1 1 807 1 . . . . . 5.17 0.0 5.17 1 1 808 1 . . . . . 4.65 0.0 4.65 1 1 809 1 . . . . . 3.12 0.0 3.12 1 1 810 1 . . . . . 3.77 0.0 3.77 1 1 811 1 . . . . . 4.49 0.0 4.49 1 1 812 1 . . . . . 4.67 0.0 4.67 1 1 813 1 . . . . . 3.01 0.0 3.01 1 1 814 1 . . . . . 5.33 0.0 5.33 1 1 815 1 . . . . . 3.83 0.0 3.83 1 1 816 1 . . . . . 3.77 0.0 3.77 1 1 817 1 . . . . . 3.48 0.0 3.48 1 1 818 1 . . . . . 3.58 0.0 3.58 1 1 819 1 . . . . . 3.26 0.0 3.26 1 1 820 1 . . . . . 3.34 0.0 3.34 1 1 821 1 . . . . . 3.87 0.0 3.87 1 1 822 1 . . . . . 5.81 0.0 5.81 1 1 823 1 . . . . . 3.44 0.0 3.44 1 1 824 1 . . . . . 5.04 0.0 5.04 1 1 825 1 . . . . . 4.4 0.0 4.4 1 1 826 1 . . . . . 5.81 0.0 5.81 1 1 827 1 . . . . . 4.13 0.0 4.13 1 1 828 1 . . . . . 3.62 0.0 3.62 1 1 829 1 . . . . . 5.09 0.0 5.09 1 1 830 1 . . . . . 4.84 0.0 4.84 1 1 831 1 . . . . . 5.05 0.0 5.05 1 1 832 1 . . . . . 5.04 0.0 5.04 1 1 833 1 . . . . . 3.37 0.0 3.37 1 1 834 1 . . . . . 4.77 0.0 4.77 1 1 835 1 . . . . . 3.09 0.0 3.09 1 1 836 1 . . . . . 3.07 0.0 3.07 1 1 837 1 . . . . . 3.11 0.0 3.11 1 1 838 1 . . . . . 4.99 0.0 4.99 1 1 839 1 . . . . . 4.09 0.0 4.09 1 1 840 1 . . . . . 3.26 0.0 3.26 1 1 841 1 . . . . . 5.81 0.0 5.81 1 1 842 1 . . . . . 3.66 0.0 3.66 1 1 843 1 . . . . . 3.11 0.0 3.11 1 1 844 1 . . . . . 2.5 0.0 2.5 1 1 845 1 . . . . . 5.34 0.0 5.34 1 1 846 1 . . . . . 4.39 0.0 4.39 1 1 847 1 . . . . . 5.72 0.0 5.72 1 1 848 1 . . . . . 3.64 0.0 3.64 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "general distance" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 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 8 CYS CB . 5 . CB 1 2 1 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 2 1 1 1 1 11 CYS CB . 8 . CB 1 2 2 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 3 1 1 1 1 28 CYS CB . 25 . CB 1 2 3 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 4 1 1 1 1 32 CYS CB . 29 . CB 1 2 4 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 5 1 1 1 1 8 CYS SG . 5 . SG 1 2 5 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 6 1 1 1 1 11 CYS SG . 8 . SG 1 2 6 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 7 1 1 1 1 28 CYS SG . 25 . SG 1 2 7 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 8 1 1 1 1 32 CYS SG . 29 . SG 1 2 8 1 2 2 2 1 ZN ZN . 150 . ZN 1 2 9 1 1 1 1 20 CYS CB . 17 . CB 1 2 9 1 2 3 2 1 ZN ZN . 170 . ZN 1 2 10 1 1 1 1 23 CYS CB . 20 . CB 1 2 10 1 2 3 2 1 ZN ZN . 170 . ZN 1 2 11 1 1 1 1 42 CYS CB . 39 . CB 1 2 11 1 2 3 2 1 ZN ZN . 170 . ZN 1 2 12 1 1 1 1 20 CYS SG . 17 . SG 1 2 12 1 2 3 2 1 ZN ZN . 170 . ZN 1 2 13 1 1 1 1 23 CYS SG . 20 . SG 1 2 13 1 2 3 2 1 ZN ZN . 170 . ZN 1 2 14 1 1 1 1 42 CYS SG . 39 . SG 1 2 14 1 2 3 2 1 ZN ZN . 170 . ZN 1 2 15 1 1 1 1 36 HIS NE2 . 33 . NE2 1 2 15 1 2 3 2 1 ZN ZN . 170 . ZN 1 2 16 1 1 1 1 8 CYS SG . 5 . SG 1 2 16 1 2 1 1 11 CYS SG . 8 . SG 1 2 17 1 1 1 1 8 CYS SG . 5 . SG 1 2 17 1 2 1 1 28 CYS SG . 25 . SG 1 2 18 1 1 1 1 8 CYS SG . 5 . SG 1 2 18 1 2 1 1 32 CYS SG . 29 . SG 1 2 19 1 1 1 1 11 CYS SG . 8 . SG 1 2 19 1 2 1 1 28 CYS SG . 25 . SG 1 2 20 1 1 1 1 11 CYS SG . 8 . SG 1 2 20 1 2 1 1 32 CYS SG . 29 . SG 1 2 21 1 1 1 1 28 CYS SG . 25 . SG 1 2 21 1 2 1 1 32 CYS SG . 29 . SG 1 2 22 1 1 1 1 20 CYS SG . 17 . SG 1 2 22 1 2 1 1 23 CYS SG . 20 . SG 1 2 23 1 1 1 1 20 CYS SG . 17 . SG 1 2 23 1 2 1 1 42 CYS SG . 39 . SG 1 2 24 1 1 1 1 23 CYS SG . 20 . SG 1 2 24 1 2 1 1 42 CYS SG . 39 . SG 1 2 25 1 1 1 1 20 CYS SG . 17 . SG 1 2 25 1 2 1 1 36 HIS NE2 . 33 . NE2 1 2 26 1 1 1 1 23 CYS SG . 20 . SG 1 2 26 1 2 1 1 36 HIS NE2 . 33 . NE2 1 2 27 1 1 1 1 36 HIS NE2 . 33 . NE2 1 2 27 1 2 1 1 42 CYS SG . 39 . SG 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.6 0.0 3.6 1 2 2 1 . . . . . 3.6 0.0 3.6 1 2 3 1 . . . . . 3.6 0.0 3.6 1 2 4 1 . . . . . 3.6 0.0 3.6 1 2 5 1 . . . . . 2.4 0.0 2.4 1 2 6 1 . . . . . 2.4 0.0 2.4 1 2 7 1 . . . . . 2.4 0.0 2.4 1 2 8 1 . . . . . 2.4 0.0 2.4 1 2 9 1 . . . . . 3.6 0.0 3.6 1 2 10 1 . . . . . 3.6 0.0 3.6 1 2 11 1 . . . . . 3.6 0.0 3.6 1 2 12 1 . . . . . 2.4 0.0 2.4 1 2 13 1 . . . . . 2.4 0.0 2.4 1 2 14 1 . . . . . 2.4 0.0 2.4 1 2 15 1 . . . . . 2.1 0.0 2.1 1 2 16 1 . . . . . 3.95 0.0 3.95 1 2 17 1 . . . . . 3.95 0.0 3.95 1 2 18 1 . . . . . 3.95 0.0 3.95 1 2 19 1 . . . . . 3.95 0.0 3.95 1 2 20 1 . . . . . 3.95 0.0 3.95 1 2 21 1 . . . . . 3.95 0.0 3.95 1 2 22 1 . . . . . 3.95 0.0 3.95 1 2 23 1 . . . . . 3.95 0.0 3.95 1 2 24 1 . . . . . 3.95 0.0 3.95 1 2 25 1 . . . . . 3.95 0.0 3.95 1 2 26 1 . . . . . 3.95 0.0 3.95 1 2 27 1 . . . . . 3.95 0.0 3.95 1 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 8 CYS N 1 1 8 CYS CA 1 1 8 CYS CB 1 1 8 CYS SG -198.7 -157.5 . 5 . N . 5 . CA . 5 . CB . 5 . SG 1 1 2 . 1 1 11 CYS N 1 1 11 CYS CA 1 1 11 CYS CB 1 1 11 CYS SG 36.3 76.9 . 8 . N . 8 . CA . 8 . CB . 8 . SG 1 1 3 . 1 1 20 CYS N 1 1 20 CYS CA 1 1 20 CYS CB 1 1 20 CYS SG -180.7 -121.09999 . 17 . N . 17 . CA . 17 . CB . 17 . SG 1 1 4 . 1 1 23 CYS N 1 1 23 CYS CA 1 1 23 CYS CB 1 1 23 CYS SG -68.899994 -27.3 . 20 . N . 20 . CA . 20 . CB . 20 . SG 1 1 5 . 1 1 28 CYS N 1 1 28 CYS CA 1 1 28 CYS CB 1 1 28 CYS SG 40.0 81.6 . 25 . N . 25 . CA . 25 . CB . 25 . SG 1 1 6 . 1 1 32 CYS N 1 1 32 CYS CA 1 1 32 CYS CB 1 1 32 CYS SG -113.3 -70.7 . 29 . N . 29 . CA . 29 . CB . 29 . SG 1 1 7 . 1 1 42 CYS N 1 1 42 CYS CA 1 1 42 CYS CB 1 1 42 CYS SG 151.2 193.0 . 39 . N . 39 . CA . 39 . CB . 39 . SG 1 1 8 . 1 1 36 HIS N 1 1 36 HIS CA 1 1 36 HIS CB 1 1 36 HIS CG 49.2 94.4 . 33 . N . 33 . CA . 33 . CB . 33 . CG 1 1 9 . 1 1 36 HIS CA 1 1 36 HIS CB 1 1 36 HIS CG 1 1 36 HIS ND1 -129.5 -84.1 . 33 . CA . 33 . CB . 33 . CG . 33 . ND1 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C -22.626 4.181 0.391 1.00 . A A . -2 GLY C 1 1 1 2 1 1 1 GLY CA C -22.387 4.064 1.882 1.00 . A A . -2 GLY CA 1 1 1 3 1 1 1 GLY H1 H -23.190 2.157 2.110 1.00 . A A . -2 GLY H1 1 1 1 4 1 1 1 GLY H2 H -24.305 3.405 2.356 1.00 . A A . -2 GLY H2 1 1 1 5 1 1 1 GLY H3 H -23.146 3.060 3.538 1.00 . A A . -2 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -22.521 5.035 2.334 1.00 . A A . -2 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -21.374 3.733 2.052 1.00 . A A . -2 GLY HA3 1 1 1 8 1 1 1 GLY N N -23.321 3.105 2.516 1.00 . A A . -2 GLY N 1 1 1 9 1 1 1 GLY O O -23.181 3.268 -0.223 1.00 . A A . -2 GLY O 1 1 1 10 1 1 2 PRO C C -21.388 4.783 -2.527 1.00 . A A . -1 PRO C 1 1 1 11 1 1 2 PRO CA C -22.406 5.529 -1.662 1.00 . A A . -1 PRO CA 1 1 1 12 1 1 2 PRO CB C -22.216 7.038 -1.796 1.00 . A A . -1 PRO CB 1 1 1 13 1 1 2 PRO CD C -21.552 6.442 0.433 1.00 . A A . -1 PRO CD 1 1 1 14 1 1 2 PRO CG C -21.276 7.400 -0.697 1.00 . A A . -1 PRO CG 1 1 1 15 1 1 2 PRO HA H -23.404 5.263 -1.975 1.00 . A A . -1 PRO HA 1 1 1 16 1 1 2 PRO HB2 H -21.799 7.266 -2.766 1.00 . A A . -1 PRO HB2 1 1 1 17 1 1 2 PRO HB3 H -23.167 7.535 -1.681 1.00 . A A . -1 PRO HB3 1 1 1 18 1 1 2 PRO HD2 H -20.628 6.132 0.897 1.00 . A A . -1 PRO HD2 1 1 1 19 1 1 2 PRO HD3 H -22.206 6.897 1.162 1.00 . A A . -1 PRO HD3 1 1 1 20 1 1 2 PRO HG2 H -20.257 7.294 -1.036 1.00 . A A . -1 PRO HG2 1 1 1 21 1 1 2 PRO HG3 H -21.461 8.415 -0.378 1.00 . A A . -1 PRO HG3 1 1 1 22 1 1 2 PRO N N -22.217 5.300 -0.226 1.00 . A A . -1 PRO N 1 1 1 23 1 1 2 PRO O O -21.265 5.045 -3.723 1.00 . A A . -1 PRO O 1 1 1 24 1 1 3 HIS C C -18.566 3.891 -3.211 1.00 . A A . 0 HIS C 1 1 1 25 1 1 3 HIS CA C -19.661 3.033 -2.590 1.00 . A A . 0 HIS CA 1 1 1 26 1 1 3 HIS CB C -20.319 2.146 -3.655 1.00 . A A . 0 HIS CB 1 1 1 27 1 1 3 HIS CD2 C -22.385 1.039 -2.539 1.00 . A A . 0 HIS CD2 1 1 1 28 1 1 3 HIS CE1 C -21.642 -1.018 -2.467 1.00 . A A . 0 HIS CE1 1 1 1 29 1 1 3 HIS CG C -21.144 1.035 -3.081 1.00 . A A . 0 HIS CG 1 1 1 30 1 1 3 HIS H H -20.783 3.734 -0.937 1.00 . A A . 0 HIS H 1 1 1 31 1 1 3 HIS HA H -19.207 2.395 -1.846 1.00 . A A . 0 HIS HA 1 1 1 32 1 1 3 HIS HB2 H -20.963 2.753 -4.271 1.00 . A A . 0 HIS HB2 1 1 1 33 1 1 3 HIS HB3 H -19.549 1.706 -4.271 1.00 . A A . 0 HIS HB3 1 1 1 34 1 1 3 HIS HD1 H -19.838 -0.599 -3.333 1.00 . A A . 0 HIS HD1 1 1 1 35 1 1 3 HIS HD2 H -23.029 1.899 -2.420 1.00 . A A . 0 HIS HD2 1 1 1 36 1 1 3 HIS HE1 H -21.576 -2.082 -2.293 1.00 . A A . 0 HIS HE1 1 1 1 37 1 1 3 HIS HE2 H -23.423 -0.521 -1.591 1.00 . A A . 0 HIS HE2 1 1 1 38 1 1 3 HIS N N -20.656 3.859 -1.902 1.00 . A A . 0 HIS N 1 1 1 39 1 1 3 HIS ND1 N -20.708 -0.268 -3.019 1.00 . A A . 0 HIS ND1 1 1 1 40 1 1 3 HIS NE2 N -22.670 -0.250 -2.165 1.00 . A A . 0 HIS NE2 1 1 1 41 1 1 3 HIS O O -18.087 3.616 -4.309 1.00 . A A . 0 HIS O 1 1 1 42 1 1 4 MET C C -15.818 5.431 -2.227 1.00 . A A . 1 MET C 1 1 1 43 1 1 4 MET CA C -17.106 5.811 -2.941 1.00 . A A . 1 MET CA 1 1 1 44 1 1 4 MET CB C -17.450 7.277 -2.659 1.00 . A A . 1 MET CB 1 1 1 45 1 1 4 MET CE C -20.156 8.362 -5.646 1.00 . A A . 1 MET CE 1 1 1 46 1 1 4 MET CG C -18.701 7.767 -3.370 1.00 . A A . 1 MET CG 1 1 1 47 1 1 4 MET H H -18.612 5.108 -1.633 1.00 . A A . 1 MET H 1 1 1 48 1 1 4 MET HA H -16.976 5.671 -4.003 1.00 . A A . 1 MET HA 1 1 1 49 1 1 4 MET HB2 H -17.597 7.401 -1.596 1.00 . A A . 1 MET HB2 1 1 1 50 1 1 4 MET HB3 H -16.620 7.894 -2.971 1.00 . A A . 1 MET HB3 1 1 1 51 1 1 4 MET HE1 H -20.226 8.387 -6.723 1.00 . A A . 1 MET HE1 1 1 1 52 1 1 4 MET HE2 H -20.276 9.361 -5.254 1.00 . A A . 1 MET HE2 1 1 1 53 1 1 4 MET HE3 H -20.933 7.724 -5.250 1.00 . A A . 1 MET HE3 1 1 1 54 1 1 4 MET HG2 H -19.531 7.142 -3.077 1.00 . A A . 1 MET HG2 1 1 1 55 1 1 4 MET HG3 H -18.896 8.785 -3.066 1.00 . A A . 1 MET HG3 1 1 1 56 1 1 4 MET N N -18.178 4.934 -2.496 1.00 . A A . 1 MET N 1 1 1 57 1 1 4 MET O O -15.372 6.126 -1.313 1.00 . A A . 1 MET O 1 1 1 58 1 1 4 MET SD S -18.554 7.719 -5.165 1.00 . A A . 1 MET SD 1 1 1 59 1 1 5 ALA C C -13.049 3.255 -2.976 1.00 . A A . 2 ALA C 1 1 1 60 1 1 5 ALA CA C -14.052 3.797 -1.970 1.00 . A A . 2 ALA CA 1 1 1 61 1 1 5 ALA CB C -14.440 2.712 -0.978 1.00 . A A . 2 ALA CB 1 1 1 62 1 1 5 ALA H H -15.606 3.830 -3.400 1.00 . A A . 2 ALA H 1 1 1 63 1 1 5 ALA HA H -13.596 4.606 -1.420 1.00 . A A . 2 ALA HA 1 1 1 64 1 1 5 ALA HB1 H -13.559 2.367 -0.459 1.00 . A A . 2 ALA HB1 1 1 1 65 1 1 5 ALA HB2 H -14.893 1.887 -1.507 1.00 . A A . 2 ALA HB2 1 1 1 66 1 1 5 ALA HB3 H -15.146 3.112 -0.265 1.00 . A A . 2 ALA HB3 1 1 1 67 1 1 5 ALA N N -15.235 4.315 -2.632 1.00 . A A . 2 ALA N 1 1 1 68 1 1 5 ALA O O -13.421 2.775 -4.048 1.00 . A A . 2 ALA O 1 1 1 69 1 1 6 VAL C C -10.249 1.475 -2.957 1.00 . A A . 3 VAL C 1 1 1 70 1 1 6 VAL CA C -10.710 2.836 -3.464 1.00 . A A . 3 VAL CA 1 1 1 71 1 1 6 VAL CB C -9.511 3.811 -3.495 1.00 . A A . 3 VAL CB 1 1 1 72 1 1 6 VAL CG1 C -8.412 3.295 -4.411 1.00 . A A . 3 VAL CG1 1 1 1 73 1 1 6 VAL CG2 C -9.960 5.198 -3.925 1.00 . A A . 3 VAL CG2 1 1 1 74 1 1 6 VAL H H -11.552 3.738 -1.755 1.00 . A A . 3 VAL H 1 1 1 75 1 1 6 VAL HA H -11.094 2.729 -4.468 1.00 . A A . 3 VAL HA 1 1 1 76 1 1 6 VAL HB H -9.108 3.883 -2.495 1.00 . A A . 3 VAL HB 1 1 1 77 1 1 6 VAL HG11 H -8.075 2.331 -4.059 1.00 . A A . 3 VAL HG11 1 1 1 78 1 1 6 VAL HG12 H -7.584 3.989 -4.407 1.00 . A A . 3 VAL HG12 1 1 1 79 1 1 6 VAL HG13 H -8.795 3.198 -5.416 1.00 . A A . 3 VAL HG13 1 1 1 80 1 1 6 VAL HG21 H -10.698 5.568 -3.230 1.00 . A A . 3 VAL HG21 1 1 1 81 1 1 6 VAL HG22 H -10.391 5.146 -4.913 1.00 . A A . 3 VAL HG22 1 1 1 82 1 1 6 VAL HG23 H -9.110 5.864 -3.938 1.00 . A A . 3 VAL HG23 1 1 1 83 1 1 6 VAL N N -11.778 3.338 -2.621 1.00 . A A . 3 VAL N 1 1 1 84 1 1 6 VAL O O -10.160 1.248 -1.749 1.00 . A A . 3 VAL O 1 1 1 85 1 1 7 LEU C C -8.027 -0.754 -3.239 1.00 . A A . 4 LEU C 1 1 1 86 1 1 7 LEU CA C -9.517 -0.760 -3.533 1.00 . A A . 4 LEU CA 1 1 1 87 1 1 7 LEU CB C -9.817 -1.748 -4.661 1.00 . A A . 4 LEU CB 1 1 1 88 1 1 7 LEU CD1 C -11.476 -3.070 -5.993 1.00 . A A . 4 LEU CD1 1 1 1 89 1 1 7 LEU CD2 C -11.721 -2.900 -3.513 1.00 . A A . 4 LEU CD2 1 1 1 90 1 1 7 LEU CG C -11.279 -2.178 -4.778 1.00 . A A . 4 LEU CG 1 1 1 91 1 1 7 LEU H H -10.096 0.803 -4.827 1.00 . A A . 4 LEU H 1 1 1 92 1 1 7 LEU HA H -10.044 -1.073 -2.645 1.00 . A A . 4 LEU HA 1 1 1 93 1 1 7 LEU HB2 H -9.520 -1.294 -5.595 1.00 . A A . 4 LEU HB2 1 1 1 94 1 1 7 LEU HB3 H -9.217 -2.633 -4.504 1.00 . A A . 4 LEU HB3 1 1 1 95 1 1 7 LEU HD11 H -12.518 -3.341 -6.074 1.00 . A A . 4 LEU HD11 1 1 1 96 1 1 7 LEU HD12 H -10.879 -3.963 -5.884 1.00 . A A . 4 LEU HD12 1 1 1 97 1 1 7 LEU HD13 H -11.172 -2.539 -6.883 1.00 . A A . 4 LEU HD13 1 1 1 98 1 1 7 LEU HD21 H -12.740 -3.239 -3.628 1.00 . A A . 4 LEU HD21 1 1 1 99 1 1 7 LEU HD22 H -11.660 -2.225 -2.671 1.00 . A A . 4 LEU HD22 1 1 1 100 1 1 7 LEU HD23 H -11.077 -3.752 -3.337 1.00 . A A . 4 LEU HD23 1 1 1 101 1 1 7 LEU HG H -11.899 -1.302 -4.899 1.00 . A A . 4 LEU HG 1 1 1 102 1 1 7 LEU N N -9.984 0.568 -3.881 1.00 . A A . 4 LEU N 1 1 1 103 1 1 7 LEU O O -7.290 0.115 -3.705 1.00 . A A . 4 LEU O 1 1 1 104 1 1 8 CYS C C -5.385 -2.085 -3.396 1.00 . A A . 5 CYS C 1 1 1 105 1 1 8 CYS CA C -6.203 -1.923 -2.122 1.00 . A A . 5 CYS CA 1 1 1 106 1 1 8 CYS CB C -6.063 -3.166 -1.245 1.00 . A A . 5 CYS CB 1 1 1 107 1 1 8 CYS H H -8.267 -2.334 -2.059 1.00 . A A . 5 CYS H 1 1 1 108 1 1 8 CYS HA H -5.854 -1.058 -1.578 1.00 . A A . 5 CYS HA 1 1 1 109 1 1 8 CYS HB2 H -6.668 -3.042 -0.363 1.00 . A A . 5 CYS HB2 1 1 1 110 1 1 8 CYS HB3 H -6.426 -4.019 -1.797 1.00 . A A . 5 CYS HB3 1 1 1 111 1 1 8 CYS N N -7.606 -1.727 -2.445 1.00 . A A . 5 CYS N 1 1 1 112 1 1 8 CYS O O -5.668 -2.952 -4.217 1.00 . A A . 5 CYS O 1 1 1 113 1 1 8 CYS SG S -4.379 -3.543 -0.705 1.00 . A A . 5 CYS SG 1 1 1 114 1 1 9 GLY C C -2.797 -2.589 -4.909 1.00 . A A . 6 GLY C 1 1 1 115 1 1 9 GLY CA C -3.548 -1.283 -4.741 1.00 . A A . 6 GLY CA 1 1 1 116 1 1 9 GLY H H -4.190 -0.581 -2.848 1.00 . A A . 6 GLY H 1 1 1 117 1 1 9 GLY HA2 H -4.180 -1.134 -5.604 1.00 . A A . 6 GLY HA2 1 1 1 118 1 1 9 GLY HA3 H -2.835 -0.475 -4.691 1.00 . A A . 6 GLY HA3 1 1 1 119 1 1 9 GLY N N -4.373 -1.249 -3.550 1.00 . A A . 6 GLY N 1 1 1 120 1 1 9 GLY O O -2.385 -2.929 -6.013 1.00 . A A . 6 GLY O 1 1 1 121 1 1 10 VAL C C -2.850 -5.766 -4.133 1.00 . A A . 7 VAL C 1 1 1 122 1 1 10 VAL CA C -1.904 -4.592 -3.869 1.00 . A A . 7 VAL CA 1 1 1 123 1 1 10 VAL CB C -1.110 -4.851 -2.569 1.00 . A A . 7 VAL CB 1 1 1 124 1 1 10 VAL CG1 C -0.510 -6.247 -2.572 1.00 . A A . 7 VAL CG1 1 1 1 125 1 1 10 VAL CG2 C -0.016 -3.809 -2.392 1.00 . A A . 7 VAL CG2 1 1 1 126 1 1 10 VAL H H -2.974 -3.002 -2.963 1.00 . A A . 7 VAL H 1 1 1 127 1 1 10 VAL HA H -1.198 -4.532 -4.684 1.00 . A A . 7 VAL HA 1 1 1 128 1 1 10 VAL HB H -1.790 -4.776 -1.733 1.00 . A A . 7 VAL HB 1 1 1 129 1 1 10 VAL HG11 H 0.165 -6.348 -3.409 1.00 . A A . 7 VAL HG11 1 1 1 130 1 1 10 VAL HG12 H -1.303 -6.977 -2.659 1.00 . A A . 7 VAL HG12 1 1 1 131 1 1 10 VAL HG13 H 0.029 -6.408 -1.651 1.00 . A A . 7 VAL HG13 1 1 1 132 1 1 10 VAL HG21 H 0.540 -4.019 -1.488 1.00 . A A . 7 VAL HG21 1 1 1 133 1 1 10 VAL HG22 H -0.463 -2.829 -2.322 1.00 . A A . 7 VAL HG22 1 1 1 134 1 1 10 VAL HG23 H 0.651 -3.840 -3.240 1.00 . A A . 7 VAL HG23 1 1 1 135 1 1 10 VAL N N -2.620 -3.323 -3.818 1.00 . A A . 7 VAL N 1 1 1 136 1 1 10 VAL O O -2.746 -6.431 -5.161 1.00 . A A . 7 VAL O 1 1 1 137 1 1 11 CYS C C -6.007 -6.832 -3.880 1.00 . A A . 8 CYS C 1 1 1 138 1 1 11 CYS CA C -4.632 -7.193 -3.307 1.00 . A A . 8 CYS CA 1 1 1 139 1 1 11 CYS CB C -4.771 -7.864 -1.933 1.00 . A A . 8 CYS CB 1 1 1 140 1 1 11 CYS H H -3.867 -5.408 -2.455 1.00 . A A . 8 CYS H 1 1 1 141 1 1 11 CYS HA H -4.154 -7.887 -3.982 1.00 . A A . 8 CYS HA 1 1 1 142 1 1 11 CYS HB2 H -5.234 -8.828 -2.062 1.00 . A A . 8 CYS HB2 1 1 1 143 1 1 11 CYS HB3 H -3.786 -8.000 -1.510 1.00 . A A . 8 CYS HB3 1 1 1 144 1 1 11 CYS N N -3.770 -6.017 -3.208 1.00 . A A . 8 CYS N 1 1 1 145 1 1 11 CYS O O -6.633 -7.648 -4.560 1.00 . A A . 8 CYS O 1 1 1 146 1 1 11 CYS SG S -5.761 -6.944 -0.731 1.00 . A A . 8 CYS SG 1 1 1 147 1 1 12 GLY C C -8.886 -6.038 -4.029 1.00 . A A . 9 GLY C 1 1 1 148 1 1 12 GLY CA C -7.704 -5.094 -4.167 1.00 . A A . 9 GLY CA 1 1 1 149 1 1 12 GLY H H -5.904 -5.027 -3.054 1.00 . A A . 9 GLY H 1 1 1 150 1 1 12 GLY HA2 H -7.946 -4.171 -3.663 1.00 . A A . 9 GLY HA2 1 1 1 151 1 1 12 GLY HA3 H -7.553 -4.882 -5.215 1.00 . A A . 9 GLY HA3 1 1 1 152 1 1 12 GLY N N -6.451 -5.607 -3.614 1.00 . A A . 9 GLY N 1 1 1 153 1 1 12 GLY O O -9.436 -6.492 -5.033 1.00 . A A . 9 GLY O 1 1 1 154 1 1 13 ILE C C -11.369 -6.706 -1.476 1.00 . A A . 10 ILE C 1 1 1 155 1 1 13 ILE CA C -10.415 -7.225 -2.558 1.00 . A A . 10 ILE CA 1 1 1 156 1 1 13 ILE CB C -9.942 -8.654 -2.187 1.00 . A A . 10 ILE CB 1 1 1 157 1 1 13 ILE CD1 C -8.954 -8.059 0.098 1.00 . A A . 10 ILE CD1 1 1 1 158 1 1 13 ILE CG1 C -8.700 -8.619 -1.284 1.00 . A A . 10 ILE CG1 1 1 1 159 1 1 13 ILE CG2 C -9.663 -9.466 -3.442 1.00 . A A . 10 ILE CG2 1 1 1 160 1 1 13 ILE H H -8.802 -5.955 -2.032 1.00 . A A . 10 ILE H 1 1 1 161 1 1 13 ILE HA H -10.966 -7.295 -3.485 1.00 . A A . 10 ILE HA 1 1 1 162 1 1 13 ILE HB H -10.746 -9.139 -1.654 1.00 . A A . 10 ILE HB 1 1 1 163 1 1 13 ILE HD11 H -9.677 -8.676 0.610 1.00 . A A . 10 ILE HD11 1 1 1 164 1 1 13 ILE HD12 H -9.337 -7.052 0.007 1.00 . A A . 10 ILE HD12 1 1 1 165 1 1 13 ILE HD13 H -8.030 -8.045 0.657 1.00 . A A . 10 ILE HD13 1 1 1 166 1 1 13 ILE HG12 H -8.320 -9.622 -1.167 1.00 . A A . 10 ILE HG12 1 1 1 167 1 1 13 ILE HG13 H -7.942 -8.006 -1.754 1.00 . A A . 10 ILE HG13 1 1 1 168 1 1 13 ILE HG21 H -10.567 -9.547 -4.027 1.00 . A A . 10 ILE HG21 1 1 1 169 1 1 13 ILE HG22 H -9.324 -10.454 -3.164 1.00 . A A . 10 ILE HG22 1 1 1 170 1 1 13 ILE HG23 H -8.899 -8.975 -4.026 1.00 . A A . 10 ILE HG23 1 1 1 171 1 1 13 ILE N N -9.286 -6.328 -2.794 1.00 . A A . 10 ILE N 1 1 1 172 1 1 13 ILE O O -12.261 -7.429 -1.034 1.00 . A A . 10 ILE O 1 1 1 173 1 1 14 LYS C C -12.042 -3.348 -0.066 1.00 . A A . 11 LYS C 1 1 1 174 1 1 14 LYS CA C -12.074 -4.878 -0.036 1.00 . A A . 11 LYS CA 1 1 1 175 1 1 14 LYS CB C -11.737 -5.418 1.373 1.00 . A A . 11 LYS CB 1 1 1 176 1 1 14 LYS CD C -9.978 -5.967 3.099 1.00 . A A . 11 LYS CD 1 1 1 177 1 1 14 LYS CE C -10.784 -5.484 4.298 1.00 . A A . 11 LYS CE 1 1 1 178 1 1 14 LYS CG C -10.302 -5.181 1.835 1.00 . A A . 11 LYS CG 1 1 1 179 1 1 14 LYS H H -10.480 -4.913 -1.438 1.00 . A A . 11 LYS H 1 1 1 180 1 1 14 LYS HA H -13.078 -5.190 -0.283 1.00 . A A . 11 LYS HA 1 1 1 181 1 1 14 LYS HB2 H -12.396 -4.948 2.086 1.00 . A A . 11 LYS HB2 1 1 1 182 1 1 14 LYS HB3 H -11.921 -6.483 1.383 1.00 . A A . 11 LYS HB3 1 1 1 183 1 1 14 LYS HD2 H -10.202 -7.009 2.929 1.00 . A A . 11 LYS HD2 1 1 1 184 1 1 14 LYS HD3 H -8.926 -5.856 3.317 1.00 . A A . 11 LYS HD3 1 1 1 185 1 1 14 LYS HE2 H -11.829 -5.460 4.026 1.00 . A A . 11 LYS HE2 1 1 1 186 1 1 14 LYS HE3 H -10.643 -6.179 5.112 1.00 . A A . 11 LYS HE3 1 1 1 187 1 1 14 LYS HG2 H -9.626 -5.484 1.052 1.00 . A A . 11 LYS HG2 1 1 1 188 1 1 14 LYS HG3 H -10.172 -4.128 2.036 1.00 . A A . 11 LYS HG3 1 1 1 189 1 1 14 LYS HZ1 H -10.954 -3.826 5.549 1.00 . A A . 11 LYS HZ1 1 1 1 190 1 1 14 LYS HZ2 H -10.489 -3.440 3.974 1.00 . A A . 11 LYS HZ2 1 1 1 191 1 1 14 LYS HZ3 H -9.373 -4.134 5.040 1.00 . A A . 11 LYS HZ3 1 1 1 192 1 1 14 LYS N N -11.191 -5.457 -1.050 1.00 . A A . 11 LYS N 1 1 1 193 1 1 14 LYS NZ N -10.371 -4.127 4.744 1.00 . A A . 11 LYS NZ 1 1 1 194 1 1 14 LYS O O -13.028 -2.712 -0.438 1.00 . A A . 11 LYS O 1 1 1 195 1 1 15 GLU C C -9.298 -1.029 0.759 1.00 . A A . 12 GLU C 1 1 1 196 1 1 15 GLU CA C -10.752 -1.326 0.405 1.00 . A A . 12 GLU CA 1 1 1 197 1 1 15 GLU CB C -11.699 -0.799 1.496 1.00 . A A . 12 GLU CB 1 1 1 198 1 1 15 GLU CD C -12.810 1.176 2.605 1.00 . A A . 12 GLU CD 1 1 1 199 1 1 15 GLU CG C -11.821 0.716 1.554 1.00 . A A . 12 GLU CG 1 1 1 200 1 1 15 GLU H H -10.126 -3.336 0.486 1.00 . A A . 12 GLU H 1 1 1 201 1 1 15 GLU HA H -10.996 -0.874 -0.545 1.00 . A A . 12 GLU HA 1 1 1 202 1 1 15 GLU HB2 H -12.684 -1.207 1.325 1.00 . A A . 12 GLU HB2 1 1 1 203 1 1 15 GLU HB3 H -11.344 -1.144 2.456 1.00 . A A . 12 GLU HB3 1 1 1 204 1 1 15 GLU HG2 H -10.853 1.134 1.785 1.00 . A A . 12 GLU HG2 1 1 1 205 1 1 15 GLU HG3 H -12.148 1.075 0.589 1.00 . A A . 12 GLU HG3 1 1 1 206 1 1 15 GLU N N -10.900 -2.771 0.286 1.00 . A A . 12 GLU N 1 1 1 207 1 1 15 GLU O O -8.510 -1.960 0.934 1.00 . A A . 12 GLU O 1 1 1 208 1 1 15 GLU OE1 O -12.405 1.350 3.775 1.00 . A A . 12 GLU OE1 1 1 1 209 1 1 15 GLU OE2 O -13.997 1.367 2.266 1.00 . A A . 12 GLU OE2 1 1 1 210 1 1 16 PHE C C -7.678 1.251 2.661 1.00 . A A . 13 PHE C 1 1 1 211 1 1 16 PHE CA C -7.604 0.623 1.273 1.00 . A A . 13 PHE CA 1 1 1 212 1 1 16 PHE CB C -6.962 1.612 0.298 1.00 . A A . 13 PHE CB 1 1 1 213 1 1 16 PHE CD1 C -8.649 3.434 -0.109 1.00 . A A . 13 PHE CD1 1 1 1 214 1 1 16 PHE CD2 C -6.688 3.962 1.139 1.00 . A A . 13 PHE CD2 1 1 1 215 1 1 16 PHE CE1 C -9.086 4.738 0.025 1.00 . A A . 13 PHE CE1 1 1 1 216 1 1 16 PHE CE2 C -7.119 5.267 1.276 1.00 . A A . 13 PHE CE2 1 1 1 217 1 1 16 PHE CG C -7.447 3.030 0.446 1.00 . A A . 13 PHE CG 1 1 1 218 1 1 16 PHE CZ C -8.319 5.656 0.716 1.00 . A A . 13 PHE CZ 1 1 1 219 1 1 16 PHE H H -9.559 0.937 0.536 1.00 . A A . 13 PHE H 1 1 1 220 1 1 16 PHE HA H -6.998 -0.268 1.323 1.00 . A A . 13 PHE HA 1 1 1 221 1 1 16 PHE HB2 H -5.896 1.612 0.457 1.00 . A A . 13 PHE HB2 1 1 1 222 1 1 16 PHE HB3 H -7.166 1.293 -0.713 1.00 . A A . 13 PHE HB3 1 1 1 223 1 1 16 PHE HD1 H -9.249 2.717 -0.651 1.00 . A A . 13 PHE HD1 1 1 1 224 1 1 16 PHE HD2 H -5.750 3.658 1.581 1.00 . A A . 13 PHE HD2 1 1 1 225 1 1 16 PHE HE1 H -10.024 5.040 -0.414 1.00 . A A . 13 PHE HE1 1 1 1 226 1 1 16 PHE HE2 H -6.515 5.983 1.817 1.00 . A A . 13 PHE HE2 1 1 1 227 1 1 16 PHE HZ H -8.659 6.674 0.821 1.00 . A A . 13 PHE HZ 1 1 1 228 1 1 16 PHE N N -8.930 0.240 0.819 1.00 . A A . 13 PHE N 1 1 1 229 1 1 16 PHE O O -8.756 1.619 3.130 1.00 . A A . 13 PHE O 1 1 1 230 1 1 17 LYS C C -5.109 2.786 4.708 1.00 . A A . 14 LYS C 1 1 1 231 1 1 17 LYS CA C -6.426 2.013 4.603 1.00 . A A . 14 LYS CA 1 1 1 232 1 1 17 LYS CB C -6.534 0.962 5.715 1.00 . A A . 14 LYS CB 1 1 1 233 1 1 17 LYS CD C -6.649 0.451 8.174 1.00 . A A . 14 LYS CD 1 1 1 234 1 1 17 LYS CE C -6.507 1.004 9.585 1.00 . A A . 14 LYS CE 1 1 1 235 1 1 17 LYS CG C -6.420 1.525 7.123 1.00 . A A . 14 LYS CG 1 1 1 236 1 1 17 LYS H H -5.717 0.993 2.900 1.00 . A A . 14 LYS H 1 1 1 237 1 1 17 LYS HA H -7.244 2.708 4.692 1.00 . A A . 14 LYS HA 1 1 1 238 1 1 17 LYS HB2 H -7.488 0.466 5.627 1.00 . A A . 14 LYS HB2 1 1 1 239 1 1 17 LYS HB3 H -5.749 0.233 5.578 1.00 . A A . 14 LYS HB3 1 1 1 240 1 1 17 LYS HD2 H -7.644 0.051 8.055 1.00 . A A . 14 LYS HD2 1 1 1 241 1 1 17 LYS HD3 H -5.924 -0.337 8.033 1.00 . A A . 14 LYS HD3 1 1 1 242 1 1 17 LYS HE2 H -7.144 1.871 9.681 1.00 . A A . 14 LYS HE2 1 1 1 243 1 1 17 LYS HE3 H -6.825 0.247 10.287 1.00 . A A . 14 LYS HE3 1 1 1 244 1 1 17 LYS HG2 H -5.430 1.934 7.254 1.00 . A A . 14 LYS HG2 1 1 1 245 1 1 17 LYS HG3 H -7.155 2.306 7.251 1.00 . A A . 14 LYS HG3 1 1 1 246 1 1 17 LYS HZ1 H -4.776 2.125 9.231 1.00 . A A . 14 LYS HZ1 1 1 1 247 1 1 17 LYS HZ2 H -4.475 0.572 9.833 1.00 . A A . 14 LYS HZ2 1 1 1 248 1 1 17 LYS HZ3 H -5.049 1.781 10.864 1.00 . A A . 14 LYS HZ3 1 1 1 249 1 1 17 LYS N N -6.528 1.368 3.306 1.00 . A A . 14 LYS N 1 1 1 250 1 1 17 LYS NZ N -5.104 1.398 9.898 1.00 . A A . 14 LYS NZ 1 1 1 251 1 1 17 LYS O O -4.964 3.682 5.541 1.00 . A A . 14 LYS O 1 1 1 252 1 1 18 TYR C C -2.502 3.619 2.485 1.00 . A A . 15 TYR C 1 1 1 253 1 1 18 TYR CA C -2.840 3.064 3.859 1.00 . A A . 15 TYR CA 1 1 1 254 1 1 18 TYR CB C -1.766 2.047 4.257 1.00 . A A . 15 TYR CB 1 1 1 255 1 1 18 TYR CD1 C -2.919 0.603 5.970 1.00 . A A . 15 TYR CD1 1 1 1 256 1 1 18 TYR CD2 C -1.043 1.893 6.662 1.00 . A A . 15 TYR CD2 1 1 1 257 1 1 18 TYR CE1 C -3.059 0.109 7.247 1.00 . A A . 15 TYR CE1 1 1 1 258 1 1 18 TYR CE2 C -1.177 1.404 7.945 1.00 . A A . 15 TYR CE2 1 1 1 259 1 1 18 TYR CG C -1.912 1.503 5.656 1.00 . A A . 15 TYR CG 1 1 1 260 1 1 18 TYR CZ C -2.187 0.512 8.232 1.00 . A A . 15 TYR CZ 1 1 1 261 1 1 18 TYR H H -4.346 1.753 3.177 1.00 . A A . 15 TYR H 1 1 1 262 1 1 18 TYR HA H -2.850 3.871 4.575 1.00 . A A . 15 TYR HA 1 1 1 263 1 1 18 TYR HB2 H -1.806 1.210 3.576 1.00 . A A . 15 TYR HB2 1 1 1 264 1 1 18 TYR HB3 H -0.795 2.515 4.183 1.00 . A A . 15 TYR HB3 1 1 1 265 1 1 18 TYR HD1 H -3.603 0.289 5.194 1.00 . A A . 15 TYR HD1 1 1 1 266 1 1 18 TYR HD2 H -0.250 2.590 6.429 1.00 . A A . 15 TYR HD2 1 1 1 267 1 1 18 TYR HE1 H -3.849 -0.590 7.470 1.00 . A A . 15 TYR HE1 1 1 1 268 1 1 18 TYR HE2 H -0.489 1.716 8.716 1.00 . A A . 15 TYR HE2 1 1 1 269 1 1 18 TYR HH H -2.398 -0.937 9.481 1.00 . A A . 15 TYR HH 1 1 1 270 1 1 18 TYR N N -4.158 2.443 3.848 1.00 . A A . 15 TYR N 1 1 1 271 1 1 18 TYR O O -3.278 3.479 1.542 1.00 . A A . 15 TYR O 1 1 1 272 1 1 18 TYR OH O -2.330 0.027 9.510 1.00 . A A . 15 TYR OH 1 1 1 273 1 1 19 LYS C C 0.674 4.950 1.232 1.00 . A A . 16 LYS C 1 1 1 274 1 1 19 LYS CA C -0.829 4.737 1.117 1.00 . A A . 16 LYS CA 1 1 1 275 1 1 19 LYS CB C -1.538 6.040 0.723 1.00 . A A . 16 LYS CB 1 1 1 276 1 1 19 LYS CD C -2.198 7.601 -1.142 1.00 . A A . 16 LYS CD 1 1 1 277 1 1 19 LYS CE C -2.147 8.823 -0.238 1.00 . A A . 16 LYS CE 1 1 1 278 1 1 19 LYS CG C -1.228 6.517 -0.691 1.00 . A A . 16 LYS CG 1 1 1 279 1 1 19 LYS H H -0.804 4.386 3.198 1.00 . A A . 16 LYS H 1 1 1 280 1 1 19 LYS HA H -1.020 3.985 0.366 1.00 . A A . 16 LYS HA 1 1 1 281 1 1 19 LYS HB2 H -2.604 5.891 0.801 1.00 . A A . 16 LYS HB2 1 1 1 282 1 1 19 LYS HB3 H -1.243 6.816 1.413 1.00 . A A . 16 LYS HB3 1 1 1 283 1 1 19 LYS HD2 H -1.945 7.901 -2.147 1.00 . A A . 16 LYS HD2 1 1 1 284 1 1 19 LYS HD3 H -3.201 7.199 -1.128 1.00 . A A . 16 LYS HD3 1 1 1 285 1 1 19 LYS HE2 H -2.410 8.523 0.765 1.00 . A A . 16 LYS HE2 1 1 1 286 1 1 19 LYS HE3 H -1.141 9.218 -0.243 1.00 . A A . 16 LYS HE3 1 1 1 287 1 1 19 LYS HG2 H -0.222 6.916 -0.722 1.00 . A A . 16 LYS HG2 1 1 1 288 1 1 19 LYS HG3 H -1.303 5.677 -1.367 1.00 . A A . 16 LYS HG3 1 1 1 289 1 1 19 LYS HZ1 H -2.987 10.730 -0.092 1.00 . A A . 16 LYS HZ1 1 1 1 290 1 1 19 LYS HZ2 H -4.069 9.547 -0.623 1.00 . A A . 16 LYS HZ2 1 1 1 291 1 1 19 LYS HZ3 H -2.889 10.145 -1.674 1.00 . A A . 16 LYS HZ3 1 1 1 292 1 1 19 LYS N N -1.339 4.244 2.385 1.00 . A A . 16 LYS N 1 1 1 293 1 1 19 LYS NZ N -3.088 9.884 -0.688 1.00 . A A . 16 LYS NZ 1 1 1 294 1 1 19 LYS O O 1.122 5.894 1.880 1.00 . A A . 16 LYS O 1 1 1 295 1 1 20 CYS C C 3.413 5.463 0.209 1.00 . A A . 17 CYS C 1 1 1 296 1 1 20 CYS CA C 2.904 4.107 0.702 1.00 . A A . 17 CYS CA 1 1 1 297 1 1 20 CYS CB C 3.542 2.989 -0.134 1.00 . A A . 17 CYS CB 1 1 1 298 1 1 20 CYS H H 1.017 3.284 0.183 1.00 . A A . 17 CYS H 1 1 1 299 1 1 20 CYS HA H 3.199 3.982 1.732 1.00 . A A . 17 CYS HA 1 1 1 300 1 1 20 CYS HB2 H 3.253 2.034 0.275 1.00 . A A . 17 CYS HB2 1 1 1 301 1 1 20 CYS HB3 H 3.196 3.064 -1.153 1.00 . A A . 17 CYS HB3 1 1 1 302 1 1 20 CYS N N 1.445 4.034 0.649 1.00 . A A . 17 CYS N 1 1 1 303 1 1 20 CYS O O 3.025 5.927 -0.858 1.00 . A A . 17 CYS O 1 1 1 304 1 1 20 CYS SG S 5.351 3.066 -0.153 1.00 . A A . 17 CYS SG 1 1 1 305 1 1 21 PRO C C 5.702 7.388 -0.639 1.00 . A A . 18 PRO C 1 1 1 306 1 1 21 PRO CA C 4.877 7.415 0.646 1.00 . A A . 18 PRO CA 1 1 1 307 1 1 21 PRO CB C 5.778 7.741 1.843 1.00 . A A . 18 PRO CB 1 1 1 308 1 1 21 PRO CD C 4.833 5.593 2.265 1.00 . A A . 18 PRO CD 1 1 1 309 1 1 21 PRO CG C 6.055 6.433 2.491 1.00 . A A . 18 PRO CG 1 1 1 310 1 1 21 PRO HA H 4.105 8.165 0.559 1.00 . A A . 18 PRO HA 1 1 1 311 1 1 21 PRO HB2 H 6.691 8.203 1.494 1.00 . A A . 18 PRO HB2 1 1 1 312 1 1 21 PRO HB3 H 5.262 8.411 2.514 1.00 . A A . 18 PRO HB3 1 1 1 313 1 1 21 PRO HD2 H 5.101 4.550 2.187 1.00 . A A . 18 PRO HD2 1 1 1 314 1 1 21 PRO HD3 H 4.118 5.743 3.060 1.00 . A A . 18 PRO HD3 1 1 1 315 1 1 21 PRO HG2 H 6.917 5.974 2.030 1.00 . A A . 18 PRO HG2 1 1 1 316 1 1 21 PRO HG3 H 6.223 6.574 3.547 1.00 . A A . 18 PRO HG3 1 1 1 317 1 1 21 PRO N N 4.310 6.100 0.985 1.00 . A A . 18 PRO N 1 1 1 318 1 1 21 PRO O O 5.960 8.426 -1.246 1.00 . A A . 18 PRO O 1 1 1 319 1 1 22 ARG C C 6.019 5.528 -3.402 1.00 . A A . 19 ARG C 1 1 1 320 1 1 22 ARG CA C 6.890 6.028 -2.266 1.00 . A A . 19 ARG CA 1 1 1 321 1 1 22 ARG CB C 8.028 5.034 -2.064 1.00 . A A . 19 ARG CB 1 1 1 322 1 1 22 ARG CD C 10.441 4.669 -1.563 1.00 . A A . 19 ARG CD 1 1 1 323 1 1 22 ARG CG C 9.280 5.639 -1.472 1.00 . A A . 19 ARG CG 1 1 1 324 1 1 22 ARG CZ C 11.313 3.006 -3.153 1.00 . A A . 19 ARG CZ 1 1 1 325 1 1 22 ARG H H 5.904 5.408 -0.496 1.00 . A A . 19 ARG H 1 1 1 326 1 1 22 ARG HA H 7.305 6.987 -2.534 1.00 . A A . 19 ARG HA 1 1 1 327 1 1 22 ARG HB2 H 7.689 4.250 -1.402 1.00 . A A . 19 ARG HB2 1 1 1 328 1 1 22 ARG HB3 H 8.281 4.598 -3.019 1.00 . A A . 19 ARG HB3 1 1 1 329 1 1 22 ARG HD2 H 11.351 5.196 -1.316 1.00 . A A . 19 ARG HD2 1 1 1 330 1 1 22 ARG HD3 H 10.284 3.874 -0.849 1.00 . A A . 19 ARG HD3 1 1 1 331 1 1 22 ARG HE H 10.087 4.517 -3.634 1.00 . A A . 19 ARG HE 1 1 1 332 1 1 22 ARG HG2 H 9.527 6.541 -2.011 1.00 . A A . 19 ARG HG2 1 1 1 333 1 1 22 ARG HG3 H 9.097 5.871 -0.430 1.00 . A A . 19 ARG HG3 1 1 1 334 1 1 22 ARG HH11 H 12.003 2.825 -1.250 1.00 . A A . 19 ARG HH11 1 1 1 335 1 1 22 ARG HH12 H 12.574 1.620 -2.372 1.00 . A A . 19 ARG HH12 1 1 1 336 1 1 22 ARG HH21 H 10.830 2.934 -5.120 1.00 . A A . 19 ARG HH21 1 1 1 337 1 1 22 ARG HH22 H 11.902 1.685 -4.571 1.00 . A A . 19 ARG HH22 1 1 1 338 1 1 22 ARG N N 6.121 6.195 -1.040 1.00 . A A . 19 ARG N 1 1 1 339 1 1 22 ARG NE N 10.580 4.087 -2.897 1.00 . A A . 19 ARG NE 1 1 1 340 1 1 22 ARG NH1 N 12.019 2.438 -2.184 1.00 . A A . 19 ARG NH1 1 1 1 341 1 1 22 ARG NH2 N 11.354 2.503 -4.378 1.00 . A A . 19 ARG NH2 1 1 1 342 1 1 22 ARG O O 5.938 6.145 -4.462 1.00 . A A . 19 ARG O 1 1 1 343 1 1 23 CYS C C 3.279 4.348 -4.457 1.00 . A A . 20 CYS C 1 1 1 344 1 1 23 CYS CA C 4.641 3.713 -4.221 1.00 . A A . 20 CYS CA 1 1 1 345 1 1 23 CYS CB C 4.476 2.237 -3.855 1.00 . A A . 20 CYS CB 1 1 1 346 1 1 23 CYS H H 5.371 4.026 -2.266 1.00 . A A . 20 CYS H 1 1 1 347 1 1 23 CYS HA H 5.221 3.790 -5.126 1.00 . A A . 20 CYS HA 1 1 1 348 1 1 23 CYS HB2 H 3.837 2.159 -2.990 1.00 . A A . 20 CYS HB2 1 1 1 349 1 1 23 CYS HB3 H 4.018 1.716 -4.683 1.00 . A A . 20 CYS HB3 1 1 1 350 1 1 23 CYS N N 5.368 4.401 -3.169 1.00 . A A . 20 CYS N 1 1 1 351 1 1 23 CYS O O 2.653 4.135 -5.495 1.00 . A A . 20 CYS O 1 1 1 352 1 1 23 CYS SG S 6.027 1.392 -3.465 1.00 . A A . 20 CYS SG 1 1 1 353 1 1 24 LEU C C 0.410 4.720 -3.555 1.00 . A A . 21 LEU C 1 1 1 354 1 1 24 LEU CA C 1.517 5.760 -3.475 1.00 . A A . 21 LEU CA 1 1 1 355 1 1 24 LEU CB C 1.385 6.766 -4.623 1.00 . A A . 21 LEU CB 1 1 1 356 1 1 24 LEU CD1 C 1.984 9.026 -5.502 1.00 . A A . 21 LEU CD1 1 1 1 357 1 1 24 LEU CD2 C 2.909 8.283 -3.304 1.00 . A A . 21 LEU CD2 1 1 1 358 1 1 24 LEU CG C 2.475 7.841 -4.694 1.00 . A A . 21 LEU CG 1 1 1 359 1 1 24 LEU H H 3.416 5.276 -2.695 1.00 . A A . 21 LEU H 1 1 1 360 1 1 24 LEU HA H 1.414 6.290 -2.540 1.00 . A A . 21 LEU HA 1 1 1 361 1 1 24 LEU HB2 H 1.393 6.217 -5.554 1.00 . A A . 21 LEU HB2 1 1 1 362 1 1 24 LEU HB3 H 0.431 7.261 -4.528 1.00 . A A . 21 LEU HB3 1 1 1 363 1 1 24 LEU HD11 H 2.760 9.775 -5.549 1.00 . A A . 21 LEU HD11 1 1 1 364 1 1 24 LEU HD12 H 1.108 9.442 -5.026 1.00 . A A . 21 LEU HD12 1 1 1 365 1 1 24 LEU HD13 H 1.733 8.702 -6.501 1.00 . A A . 21 LEU HD13 1 1 1 366 1 1 24 LEU HD21 H 3.638 9.074 -3.389 1.00 . A A . 21 LEU HD21 1 1 1 367 1 1 24 LEU HD22 H 3.350 7.442 -2.784 1.00 . A A . 21 LEU HD22 1 1 1 368 1 1 24 LEU HD23 H 2.050 8.638 -2.753 1.00 . A A . 21 LEU HD23 1 1 1 369 1 1 24 LEU HG H 3.338 7.431 -5.200 1.00 . A A . 21 LEU HG 1 1 1 370 1 1 24 LEU N N 2.832 5.118 -3.467 1.00 . A A . 21 LEU N 1 1 1 371 1 1 24 LEU O O -0.752 5.045 -3.800 1.00 . A A . 21 LEU O 1 1 1 372 1 1 25 VAL C C -1.011 2.373 -2.141 1.00 . A A . 22 VAL C 1 1 1 373 1 1 25 VAL CA C -0.145 2.371 -3.389 1.00 . A A . 22 VAL CA 1 1 1 374 1 1 25 VAL CB C 0.584 1.012 -3.559 1.00 . A A . 22 VAL CB 1 1 1 375 1 1 25 VAL CG1 C 1.490 0.709 -2.376 1.00 . A A . 22 VAL CG1 1 1 1 376 1 1 25 VAL CG2 C -0.412 -0.114 -3.771 1.00 . A A . 22 VAL CG2 1 1 1 377 1 1 25 VAL H H 1.714 3.287 -3.119 1.00 . A A . 22 VAL H 1 1 1 378 1 1 25 VAL HA H -0.780 2.524 -4.251 1.00 . A A . 22 VAL HA 1 1 1 379 1 1 25 VAL HB H 1.205 1.076 -4.441 1.00 . A A . 22 VAL HB 1 1 1 380 1 1 25 VAL HG11 H 2.033 -0.206 -2.563 1.00 . A A . 22 VAL HG11 1 1 1 381 1 1 25 VAL HG12 H 0.891 0.597 -1.486 1.00 . A A . 22 VAL HG12 1 1 1 382 1 1 25 VAL HG13 H 2.186 1.521 -2.240 1.00 . A A . 22 VAL HG13 1 1 1 383 1 1 25 VAL HG21 H -1.117 -0.131 -2.953 1.00 . A A . 22 VAL HG21 1 1 1 384 1 1 25 VAL HG22 H 0.113 -1.057 -3.813 1.00 . A A . 22 VAL HG22 1 1 1 385 1 1 25 VAL HG23 H -0.940 0.044 -4.700 1.00 . A A . 22 VAL HG23 1 1 1 386 1 1 25 VAL N N 0.785 3.469 -3.332 1.00 . A A . 22 VAL N 1 1 1 387 1 1 25 VAL O O -0.514 2.356 -1.010 1.00 . A A . 22 VAL O 1 1 1 388 1 1 26 GLN C C -3.547 1.069 -0.812 1.00 . A A . 23 GLN C 1 1 1 389 1 1 26 GLN CA C -3.260 2.485 -1.283 1.00 . A A . 23 GLN CA 1 1 1 390 1 1 26 GLN CB C -4.531 3.196 -1.746 1.00 . A A . 23 GLN CB 1 1 1 391 1 1 26 GLN CD C -5.501 5.331 -2.731 1.00 . A A . 23 GLN CD 1 1 1 392 1 1 26 GLN CG C -4.266 4.622 -2.210 1.00 . A A . 23 GLN CG 1 1 1 393 1 1 26 GLN H H -2.620 2.504 -3.287 1.00 . A A . 23 GLN H 1 1 1 394 1 1 26 GLN HA H -2.824 3.041 -0.466 1.00 . A A . 23 GLN HA 1 1 1 395 1 1 26 GLN HB2 H -4.962 2.642 -2.566 1.00 . A A . 23 GLN HB2 1 1 1 396 1 1 26 GLN HB3 H -5.235 3.228 -0.929 1.00 . A A . 23 GLN HB3 1 1 1 397 1 1 26 GLN HE21 H -6.662 4.305 -1.498 1.00 . A A . 23 GLN HE21 1 1 1 398 1 1 26 GLN HE22 H -7.467 5.438 -2.523 1.00 . A A . 23 GLN HE22 1 1 1 399 1 1 26 GLN HG2 H -3.877 5.187 -1.377 1.00 . A A . 23 GLN HG2 1 1 1 400 1 1 26 GLN HG3 H -3.527 4.596 -2.997 1.00 . A A . 23 GLN HG3 1 1 1 401 1 1 26 GLN N N -2.300 2.457 -2.362 1.00 . A A . 23 GLN N 1 1 1 402 1 1 26 GLN NE2 N -6.659 4.991 -2.197 1.00 . A A . 23 GLN NE2 1 1 1 403 1 1 26 GLN O O -4.396 0.369 -1.362 1.00 . A A . 23 GLN O 1 1 1 404 1 1 26 GLN OE1 O -5.409 6.191 -3.605 1.00 . A A . 23 GLN OE1 1 1 1 405 1 1 27 THR C C -4.006 -0.818 1.749 1.00 . A A . 24 THR C 1 1 1 406 1 1 27 THR CA C -2.900 -0.708 0.712 1.00 . A A . 24 THR CA 1 1 1 407 1 1 27 THR CB C -1.566 -1.139 1.345 1.00 . A A . 24 THR CB 1 1 1 408 1 1 27 THR CG2 C -0.515 -1.395 0.281 1.00 . A A . 24 THR CG2 1 1 1 409 1 1 27 THR H H -2.176 1.267 0.613 1.00 . A A . 24 THR H 1 1 1 410 1 1 27 THR HA H -3.118 -1.371 -0.112 1.00 . A A . 24 THR HA 1 1 1 411 1 1 27 THR HB H -1.726 -2.053 1.899 1.00 . A A . 24 THR HB 1 1 1 412 1 1 27 THR HG1 H -0.322 -0.447 2.716 1.00 . A A . 24 THR HG1 1 1 1 413 1 1 27 THR HG21 H -0.850 -2.190 -0.367 1.00 . A A . 24 THR HG21 1 1 1 414 1 1 27 THR HG22 H 0.412 -1.683 0.755 1.00 . A A . 24 THR HG22 1 1 1 415 1 1 27 THR HG23 H -0.361 -0.497 -0.298 1.00 . A A . 24 THR HG23 1 1 1 416 1 1 27 THR N N -2.805 0.643 0.194 1.00 . A A . 24 THR N 1 1 1 417 1 1 27 THR O O -4.401 0.171 2.357 1.00 . A A . 24 THR O 1 1 1 418 1 1 27 THR OG1 O -1.104 -0.127 2.238 1.00 . A A . 24 THR OG1 1 1 1 419 1 1 28 CYS C C -5.036 -2.448 4.288 1.00 . A A . 25 CYS C 1 1 1 420 1 1 28 CYS CA C -5.583 -2.279 2.880 1.00 . A A . 25 CYS CA 1 1 1 421 1 1 28 CYS CB C -6.362 -3.534 2.478 1.00 . A A . 25 CYS CB 1 1 1 422 1 1 28 CYS H H -4.130 -2.776 1.433 1.00 . A A . 25 CYS H 1 1 1 423 1 1 28 CYS HA H -6.247 -1.429 2.861 1.00 . A A . 25 CYS HA 1 1 1 424 1 1 28 CYS HB2 H -7.204 -3.654 3.142 1.00 . A A . 25 CYS HB2 1 1 1 425 1 1 28 CYS HB3 H -6.722 -3.416 1.469 1.00 . A A . 25 CYS HB3 1 1 1 426 1 1 28 CYS N N -4.501 -2.031 1.940 1.00 . A A . 25 CYS N 1 1 1 427 1 1 28 CYS O O -5.740 -2.232 5.272 1.00 . A A . 25 CYS O 1 1 1 428 1 1 28 CYS SG S -5.392 -5.059 2.543 1.00 . A A . 25 CYS SG 1 1 1 429 1 1 29 SER C C -1.629 -3.027 5.511 1.00 . A A . 26 SER C 1 1 1 430 1 1 29 SER CA C -3.141 -3.102 5.655 1.00 . A A . 26 SER CA 1 1 1 431 1 1 29 SER CB C -3.544 -4.484 6.187 1.00 . A A . 26 SER CB 1 1 1 432 1 1 29 SER H H -3.248 -2.952 3.553 1.00 . A A . 26 SER H 1 1 1 433 1 1 29 SER HA H -3.468 -2.343 6.350 1.00 . A A . 26 SER HA 1 1 1 434 1 1 29 SER HB2 H -3.235 -5.239 5.481 1.00 . A A . 26 SER HB2 1 1 1 435 1 1 29 SER HB3 H -3.057 -4.657 7.133 1.00 . A A . 26 SER HB3 1 1 1 436 1 1 29 SER HG H -5.375 -3.816 5.963 1.00 . A A . 26 SER HG 1 1 1 437 1 1 29 SER N N -3.775 -2.843 4.374 1.00 . A A . 26 SER N 1 1 1 438 1 1 29 SER O O -1.115 -2.988 4.388 1.00 . A A . 26 SER O 1 1 1 439 1 1 29 SER OG O -4.946 -4.582 6.370 1.00 . A A . 26 SER OG 1 1 1 440 1 1 30 LEU C C 1.078 -4.246 5.933 1.00 . A A . 27 LEU C 1 1 1 441 1 1 30 LEU CA C 0.530 -3.010 6.637 1.00 . A A . 27 LEU CA 1 1 1 442 1 1 30 LEU CB C 1.063 -2.945 8.070 1.00 . A A . 27 LEU CB 1 1 1 443 1 1 30 LEU CD1 C 1.168 -1.757 10.271 1.00 . A A . 27 LEU CD1 1 1 1 444 1 1 30 LEU CD2 C 1.644 -0.511 8.162 1.00 . A A . 27 LEU CD2 1 1 1 445 1 1 30 LEU CG C 0.822 -1.622 8.798 1.00 . A A . 27 LEU CG 1 1 1 446 1 1 30 LEU H H -1.401 -3.045 7.498 1.00 . A A . 27 LEU H 1 1 1 447 1 1 30 LEU HA H 0.849 -2.129 6.101 1.00 . A A . 27 LEU HA 1 1 1 448 1 1 30 LEU HB2 H 0.598 -3.734 8.640 1.00 . A A . 27 LEU HB2 1 1 1 449 1 1 30 LEU HB3 H 2.126 -3.123 8.043 1.00 . A A . 27 LEU HB3 1 1 1 450 1 1 30 LEU HD11 H 0.525 -2.496 10.727 1.00 . A A . 27 LEU HD11 1 1 1 451 1 1 30 LEU HD12 H 1.028 -0.805 10.763 1.00 . A A . 27 LEU HD12 1 1 1 452 1 1 30 LEU HD13 H 2.197 -2.065 10.371 1.00 . A A . 27 LEU HD13 1 1 1 453 1 1 30 LEU HD21 H 2.692 -0.766 8.210 1.00 . A A . 27 LEU HD21 1 1 1 454 1 1 30 LEU HD22 H 1.475 0.412 8.696 1.00 . A A . 27 LEU HD22 1 1 1 455 1 1 30 LEU HD23 H 1.350 -0.389 7.131 1.00 . A A . 27 LEU HD23 1 1 1 456 1 1 30 LEU HG H -0.222 -1.357 8.720 1.00 . A A . 27 LEU HG 1 1 1 457 1 1 30 LEU N N -0.926 -3.028 6.637 1.00 . A A . 27 LEU N 1 1 1 458 1 1 30 LEU O O 2.157 -4.209 5.344 1.00 . A A . 27 LEU O 1 1 1 459 1 1 31 GLU C C 0.883 -6.393 3.831 1.00 . A A . 28 GLU C 1 1 1 460 1 1 31 GLU CA C 0.706 -6.580 5.338 1.00 . A A . 28 GLU CA 1 1 1 461 1 1 31 GLU CB C -0.327 -7.670 5.618 1.00 . A A . 28 GLU CB 1 1 1 462 1 1 31 GLU CD C -0.927 -10.113 5.432 1.00 . A A . 28 GLU CD 1 1 1 463 1 1 31 GLU CG C 0.084 -9.039 5.102 1.00 . A A . 28 GLU CG 1 1 1 464 1 1 31 GLU H H -0.524 -5.302 6.491 1.00 . A A . 28 GLU H 1 1 1 465 1 1 31 GLU HA H 1.651 -6.880 5.759 1.00 . A A . 28 GLU HA 1 1 1 466 1 1 31 GLU HB2 H -0.480 -7.741 6.685 1.00 . A A . 28 GLU HB2 1 1 1 467 1 1 31 GLU HB3 H -1.259 -7.396 5.146 1.00 . A A . 28 GLU HB3 1 1 1 468 1 1 31 GLU HG2 H 0.194 -8.987 4.030 1.00 . A A . 28 GLU HG2 1 1 1 469 1 1 31 GLU HG3 H 1.030 -9.307 5.548 1.00 . A A . 28 GLU HG3 1 1 1 470 1 1 31 GLU N N 0.316 -5.334 5.984 1.00 . A A . 28 GLU N 1 1 1 471 1 1 31 GLU O O 1.796 -6.958 3.230 1.00 . A A . 28 GLU O 1 1 1 472 1 1 31 GLU OE1 O -0.895 -10.638 6.564 1.00 . A A . 28 GLU OE1 1 1 1 473 1 1 31 GLU OE2 O -1.752 -10.446 4.559 1.00 . A A . 28 GLU OE2 1 1 1 474 1 1 32 CYS C C 1.180 -4.223 1.556 1.00 . A A . 29 CYS C 1 1 1 475 1 1 32 CYS CA C 0.126 -5.299 1.806 1.00 . A A . 29 CYS CA 1 1 1 476 1 1 32 CYS CB C -1.231 -4.878 1.239 1.00 . A A . 29 CYS CB 1 1 1 477 1 1 32 CYS H H -0.701 -5.177 3.745 1.00 . A A . 29 CYS H 1 1 1 478 1 1 32 CYS HA H 0.441 -6.207 1.313 1.00 . A A . 29 CYS HA 1 1 1 479 1 1 32 CYS HB2 H -1.764 -4.317 1.992 1.00 . A A . 29 CYS HB2 1 1 1 480 1 1 32 CYS HB3 H -1.076 -4.251 0.376 1.00 . A A . 29 CYS HB3 1 1 1 481 1 1 32 CYS N N 0.019 -5.589 3.225 1.00 . A A . 29 CYS N 1 1 1 482 1 1 32 CYS O O 1.776 -4.164 0.481 1.00 . A A . 29 CYS O 1 1 1 483 1 1 32 CYS SG S -2.289 -6.261 0.739 1.00 . A A . 29 CYS SG 1 1 1 484 1 1 33 SER C C 3.836 -3.032 2.470 1.00 . A A . 30 SER C 1 1 1 485 1 1 33 SER CA C 2.460 -2.371 2.470 1.00 . A A . 30 SER CA 1 1 1 486 1 1 33 SER CB C 2.344 -1.385 3.637 1.00 . A A . 30 SER CB 1 1 1 487 1 1 33 SER H H 0.869 -3.434 3.367 1.00 . A A . 30 SER H 1 1 1 488 1 1 33 SER HA H 2.331 -1.836 1.542 1.00 . A A . 30 SER HA 1 1 1 489 1 1 33 SER HB2 H 2.443 -1.919 4.569 1.00 . A A . 30 SER HB2 1 1 1 490 1 1 33 SER HB3 H 3.127 -0.646 3.561 1.00 . A A . 30 SER HB3 1 1 1 491 1 1 33 SER HG H 1.232 0.219 3.784 1.00 . A A . 30 SER HG 1 1 1 492 1 1 33 SER N N 1.414 -3.381 2.555 1.00 . A A . 30 SER N 1 1 1 493 1 1 33 SER O O 4.714 -2.661 1.699 1.00 . A A . 30 SER O 1 1 1 494 1 1 33 SER OG O 1.091 -0.724 3.625 1.00 . A A . 30 SER OG 1 1 1 495 1 1 34 LYS C C 5.396 -5.786 2.302 1.00 . A A . 31 LYS C 1 1 1 496 1 1 34 LYS CA C 5.281 -4.741 3.408 1.00 . A A . 31 LYS CA 1 1 1 497 1 1 34 LYS CB C 5.440 -5.401 4.785 1.00 . A A . 31 LYS CB 1 1 1 498 1 1 34 LYS CD C 4.666 -7.138 6.434 1.00 . A A . 31 LYS CD 1 1 1 499 1 1 34 LYS CE C 3.838 -8.397 6.651 1.00 . A A . 31 LYS CE 1 1 1 500 1 1 34 LYS CG C 4.532 -6.603 5.014 1.00 . A A . 31 LYS CG 1 1 1 501 1 1 34 LYS H H 3.270 -4.298 3.914 1.00 . A A . 31 LYS H 1 1 1 502 1 1 34 LYS HA H 6.067 -4.015 3.276 1.00 . A A . 31 LYS HA 1 1 1 503 1 1 34 LYS HB2 H 6.463 -5.726 4.897 1.00 . A A . 31 LYS HB2 1 1 1 504 1 1 34 LYS HB3 H 5.222 -4.666 5.544 1.00 . A A . 31 LYS HB3 1 1 1 505 1 1 34 LYS HD2 H 5.704 -7.368 6.623 1.00 . A A . 31 LYS HD2 1 1 1 506 1 1 34 LYS HD3 H 4.335 -6.377 7.126 1.00 . A A . 31 LYS HD3 1 1 1 507 1 1 34 LYS HE2 H 3.860 -8.650 7.700 1.00 . A A . 31 LYS HE2 1 1 1 508 1 1 34 LYS HE3 H 2.821 -8.199 6.354 1.00 . A A . 31 LYS HE3 1 1 1 509 1 1 34 LYS HG2 H 3.507 -6.306 4.847 1.00 . A A . 31 LYS HG2 1 1 1 510 1 1 34 LYS HG3 H 4.801 -7.383 4.317 1.00 . A A . 31 LYS HG3 1 1 1 511 1 1 34 LYS HZ1 H 3.736 -10.379 6.001 1.00 . A A . 31 LYS HZ1 1 1 1 512 1 1 34 LYS HZ2 H 5.312 -9.800 6.180 1.00 . A A . 31 LYS HZ2 1 1 1 513 1 1 34 LYS HZ3 H 4.381 -9.318 4.854 1.00 . A A . 31 LYS HZ3 1 1 1 514 1 1 34 LYS N N 4.010 -4.035 3.320 1.00 . A A . 31 LYS N 1 1 1 515 1 1 34 LYS NZ N 4.352 -9.552 5.867 1.00 . A A . 31 LYS NZ 1 1 1 516 1 1 34 LYS O O 6.451 -6.392 2.113 1.00 . A A . 31 LYS O 1 1 1 517 1 1 35 LYS C C 5.032 -6.493 -0.722 1.00 . A A . 32 LYS C 1 1 1 518 1 1 35 LYS CA C 4.276 -6.978 0.510 1.00 . A A . 32 LYS CA 1 1 1 519 1 1 35 LYS CB C 2.836 -7.307 0.146 1.00 . A A . 32 LYS CB 1 1 1 520 1 1 35 LYS CD C 1.227 -8.976 -0.763 1.00 . A A . 32 LYS CD 1 1 1 521 1 1 35 LYS CE C 1.044 -10.370 -1.344 1.00 . A A . 32 LYS CE 1 1 1 522 1 1 35 LYS CG C 2.687 -8.616 -0.604 1.00 . A A . 32 LYS CG 1 1 1 523 1 1 35 LYS H H 3.512 -5.442 1.737 1.00 . A A . 32 LYS H 1 1 1 524 1 1 35 LYS HA H 4.749 -7.873 0.881 1.00 . A A . 32 LYS HA 1 1 1 525 1 1 35 LYS HB2 H 2.252 -7.367 1.052 1.00 . A A . 32 LYS HB2 1 1 1 526 1 1 35 LYS HB3 H 2.442 -6.515 -0.474 1.00 . A A . 32 LYS HB3 1 1 1 527 1 1 35 LYS HD2 H 0.759 -8.935 0.208 1.00 . A A . 32 LYS HD2 1 1 1 528 1 1 35 LYS HD3 H 0.763 -8.256 -1.418 1.00 . A A . 32 LYS HD3 1 1 1 529 1 1 35 LYS HE2 H 1.452 -11.090 -0.651 1.00 . A A . 32 LYS HE2 1 1 1 530 1 1 35 LYS HE3 H -0.012 -10.556 -1.473 1.00 . A A . 32 LYS HE3 1 1 1 531 1 1 35 LYS HG2 H 3.135 -8.515 -1.582 1.00 . A A . 32 LYS HG2 1 1 1 532 1 1 35 LYS HG3 H 3.187 -9.398 -0.052 1.00 . A A . 32 LYS HG3 1 1 1 533 1 1 35 LYS HZ1 H 1.539 -11.470 -3.048 1.00 . A A . 32 LYS HZ1 1 1 1 534 1 1 35 LYS HZ2 H 2.752 -10.409 -2.545 1.00 . A A . 32 LYS HZ2 1 1 1 535 1 1 35 LYS HZ3 H 1.381 -9.811 -3.328 1.00 . A A . 32 LYS HZ3 1 1 1 536 1 1 35 LYS N N 4.311 -5.981 1.565 1.00 . A A . 32 LYS N 1 1 1 537 1 1 35 LYS NZ N 1.726 -10.525 -2.658 1.00 . A A . 32 LYS NZ 1 1 1 538 1 1 35 LYS O O 5.792 -7.249 -1.329 1.00 . A A . 32 LYS O 1 1 1 539 1 1 36 HIS C C 6.984 -4.435 -2.008 1.00 . A A . 33 HIS C 1 1 1 540 1 1 36 HIS CA C 5.497 -4.677 -2.265 1.00 . A A . 33 HIS CA 1 1 1 541 1 1 36 HIS CB C 4.806 -3.377 -2.734 1.00 . A A . 33 HIS CB 1 1 1 542 1 1 36 HIS CD2 C 6.010 -1.605 -1.259 1.00 . A A . 33 HIS CD2 1 1 1 543 1 1 36 HIS CE1 C 4.310 -0.475 -0.574 1.00 . A A . 33 HIS CE1 1 1 1 544 1 1 36 HIS CG C 4.917 -2.202 -1.793 1.00 . A A . 33 HIS CG 1 1 1 545 1 1 36 HIS H H 4.241 -4.654 -0.550 1.00 . A A . 33 HIS H 1 1 1 546 1 1 36 HIS HA H 5.408 -5.414 -3.051 1.00 . A A . 33 HIS HA 1 1 1 547 1 1 36 HIS HB2 H 5.239 -3.077 -3.676 1.00 . A A . 33 HIS HB2 1 1 1 548 1 1 36 HIS HB3 H 3.755 -3.581 -2.884 1.00 . A A . 33 HIS HB3 1 1 1 549 1 1 36 HIS HD1 H 2.896 -1.665 -1.530 1.00 . A A . 33 HIS HD1 1 1 1 550 1 1 36 HIS HD2 H 7.030 -1.928 -1.399 1.00 . A A . 33 HIS HD2 1 1 1 551 1 1 36 HIS HE1 H 3.684 0.236 -0.061 1.00 . A A . 33 HIS HE1 1 1 1 552 1 1 36 HIS N N 4.841 -5.226 -1.082 1.00 . A A . 33 HIS N 1 1 1 553 1 1 36 HIS ND1 N 3.841 -1.476 -1.340 1.00 . A A . 33 HIS ND1 1 1 1 554 1 1 36 HIS NE2 N 5.630 -0.501 -0.497 1.00 . A A . 33 HIS NE2 1 1 1 555 1 1 36 HIS O O 7.782 -4.357 -2.937 1.00 . A A . 33 HIS O 1 1 1 556 1 1 37 LYS C C 9.719 -5.043 -0.737 1.00 . A A . 34 LYS C 1 1 1 557 1 1 37 LYS CA C 8.712 -3.963 -0.376 1.00 . A A . 34 LYS CA 1 1 1 558 1 1 37 LYS CB C 8.791 -3.658 1.119 1.00 . A A . 34 LYS CB 1 1 1 559 1 1 37 LYS CD C 8.125 -2.132 2.997 1.00 . A A . 34 LYS CD 1 1 1 560 1 1 37 LYS CE C 7.155 -1.058 3.456 1.00 . A A . 34 LYS CE 1 1 1 561 1 1 37 LYS CG C 7.867 -2.536 1.557 1.00 . A A . 34 LYS CG 1 1 1 562 1 1 37 LYS H H 6.715 -4.570 -0.036 1.00 . A A . 34 LYS H 1 1 1 563 1 1 37 LYS HA H 8.956 -3.068 -0.926 1.00 . A A . 34 LYS HA 1 1 1 564 1 1 37 LYS HB2 H 8.528 -4.548 1.671 1.00 . A A . 34 LYS HB2 1 1 1 565 1 1 37 LYS HB3 H 9.805 -3.377 1.365 1.00 . A A . 34 LYS HB3 1 1 1 566 1 1 37 LYS HD2 H 8.010 -2.999 3.630 1.00 . A A . 34 LYS HD2 1 1 1 567 1 1 37 LYS HD3 H 9.134 -1.754 3.080 1.00 . A A . 34 LYS HD3 1 1 1 568 1 1 37 LYS HE2 H 7.182 -0.240 2.750 1.00 . A A . 34 LYS HE2 1 1 1 569 1 1 37 LYS HE3 H 6.160 -1.477 3.479 1.00 . A A . 34 LYS HE3 1 1 1 570 1 1 37 LYS HG2 H 8.026 -1.680 0.919 1.00 . A A . 34 LYS HG2 1 1 1 571 1 1 37 LYS HG3 H 6.844 -2.871 1.465 1.00 . A A . 34 LYS HG3 1 1 1 572 1 1 37 LYS HZ1 H 8.346 0.058 4.762 1.00 . A A . 34 LYS HZ1 1 1 1 573 1 1 37 LYS HZ2 H 7.681 -1.333 5.458 1.00 . A A . 34 LYS HZ2 1 1 1 574 1 1 37 LYS HZ3 H 6.706 0.021 5.185 1.00 . A A . 34 LYS HZ3 1 1 1 575 1 1 37 LYS N N 7.359 -4.353 -0.741 1.00 . A A . 34 LYS N 1 1 1 576 1 1 37 LYS NZ N 7.495 -0.542 4.808 1.00 . A A . 34 LYS NZ 1 1 1 577 1 1 37 LYS O O 10.854 -4.746 -1.108 1.00 . A A . 34 LYS O 1 1 1 578 1 1 38 THR C C 10.417 -7.733 -2.317 1.00 . A A . 35 THR C 1 1 1 579 1 1 38 THR CA C 10.179 -7.418 -0.840 1.00 . A A . 35 THR CA 1 1 1 580 1 1 38 THR CB C 9.615 -8.662 -0.117 1.00 . A A . 35 THR CB 1 1 1 581 1 1 38 THR CG2 C 8.443 -9.261 -0.884 1.00 . A A . 35 THR CG2 1 1 1 582 1 1 38 THR H H 8.330 -6.455 -0.505 1.00 . A A . 35 THR H 1 1 1 583 1 1 38 THR HA H 11.122 -7.157 -0.386 1.00 . A A . 35 THR HA 1 1 1 584 1 1 38 THR HB H 9.260 -8.352 0.854 1.00 . A A . 35 THR HB 1 1 1 585 1 1 38 THR HG1 H 10.698 -10.193 -0.750 1.00 . A A . 35 THR HG1 1 1 1 586 1 1 38 THR HG21 H 7.649 -8.533 -0.957 1.00 . A A . 35 THR HG21 1 1 1 587 1 1 38 THR HG22 H 8.082 -10.135 -0.363 1.00 . A A . 35 THR HG22 1 1 1 588 1 1 38 THR HG23 H 8.767 -9.542 -1.875 1.00 . A A . 35 THR HG23 1 1 1 589 1 1 38 THR N N 9.283 -6.289 -0.673 1.00 . A A . 35 THR N 1 1 1 590 1 1 38 THR O O 11.240 -8.583 -2.658 1.00 . A A . 35 THR O 1 1 1 591 1 1 38 THR OG1 O 10.636 -9.656 0.051 1.00 . A A . 35 THR OG1 1 1 1 592 1 1 39 ARG C C 10.116 -6.013 -5.390 1.00 . A A . 36 ARG C 1 1 1 593 1 1 39 ARG CA C 9.806 -7.292 -4.618 1.00 . A A . 36 ARG CA 1 1 1 594 1 1 39 ARG CB C 8.503 -7.906 -5.132 1.00 . A A . 36 ARG CB 1 1 1 595 1 1 39 ARG CD C 6.058 -7.530 -5.584 1.00 . A A . 36 ARG CD 1 1 1 596 1 1 39 ARG CG C 7.297 -7.024 -4.874 1.00 . A A . 36 ARG CG 1 1 1 597 1 1 39 ARG CZ C 3.721 -6.749 -5.741 1.00 . A A . 36 ARG CZ 1 1 1 598 1 1 39 ARG H H 9.102 -6.334 -2.865 1.00 . A A . 36 ARG H 1 1 1 599 1 1 39 ARG HA H 10.609 -7.996 -4.773 1.00 . A A . 36 ARG HA 1 1 1 600 1 1 39 ARG HB2 H 8.587 -8.067 -6.197 1.00 . A A . 36 ARG HB2 1 1 1 601 1 1 39 ARG HB3 H 8.343 -8.855 -4.642 1.00 . A A . 36 ARG HB3 1 1 1 602 1 1 39 ARG HD2 H 6.325 -7.823 -6.588 1.00 . A A . 36 ARG HD2 1 1 1 603 1 1 39 ARG HD3 H 5.672 -8.385 -5.049 1.00 . A A . 36 ARG HD3 1 1 1 604 1 1 39 ARG HE H 5.334 -5.555 -5.622 1.00 . A A . 36 ARG HE 1 1 1 605 1 1 39 ARG HG2 H 7.106 -7.004 -3.810 1.00 . A A . 36 ARG HG2 1 1 1 606 1 1 39 ARG HG3 H 7.517 -6.025 -5.219 1.00 . A A . 36 ARG HG3 1 1 1 607 1 1 39 ARG HH11 H 3.925 -8.769 -5.713 1.00 . A A . 36 ARG HH11 1 1 1 608 1 1 39 ARG HH12 H 2.295 -8.188 -5.836 1.00 . A A . 36 ARG HH12 1 1 1 609 1 1 39 ARG HH21 H 3.190 -4.796 -5.799 1.00 . A A . 36 ARG HH21 1 1 1 610 1 1 39 ARG HH22 H 1.876 -5.927 -5.900 1.00 . A A . 36 ARG HH22 1 1 1 611 1 1 39 ARG N N 9.706 -7.036 -3.189 1.00 . A A . 36 ARG N 1 1 1 612 1 1 39 ARG NE N 5.026 -6.499 -5.644 1.00 . A A . 36 ARG NE 1 1 1 613 1 1 39 ARG NH1 N 3.278 -8.002 -5.767 1.00 . A A . 36 ARG NH1 1 1 1 614 1 1 39 ARG NH2 N 2.860 -5.745 -5.817 1.00 . A A . 36 ARG NH2 1 1 1 615 1 1 39 ARG O O 10.765 -6.050 -6.432 1.00 . A A . 36 ARG O 1 1 1 616 1 1 40 ASP C C 10.944 -2.801 -4.930 1.00 . A A . 37 ASP C 1 1 1 617 1 1 40 ASP CA C 9.823 -3.609 -5.558 1.00 . A A . 37 ASP CA 1 1 1 618 1 1 40 ASP CB C 8.522 -2.794 -5.535 1.00 . A A . 37 ASP CB 1 1 1 619 1 1 40 ASP CG C 7.407 -3.432 -6.341 1.00 . A A . 37 ASP CG 1 1 1 620 1 1 40 ASP H H 9.200 -4.893 -4.007 1.00 . A A . 37 ASP H 1 1 1 621 1 1 40 ASP HA H 10.083 -3.822 -6.584 1.00 . A A . 37 ASP HA 1 1 1 622 1 1 40 ASP HB2 H 8.188 -2.696 -4.513 1.00 . A A . 37 ASP HB2 1 1 1 623 1 1 40 ASP HB3 H 8.716 -1.811 -5.939 1.00 . A A . 37 ASP HB3 1 1 1 624 1 1 40 ASP N N 9.660 -4.880 -4.870 1.00 . A A . 37 ASP N 1 1 1 625 1 1 40 ASP O O 11.249 -1.697 -5.378 1.00 . A A . 37 ASP O 1 1 1 626 1 1 40 ASP OD1 O 7.418 -3.300 -7.583 1.00 . A A . 37 ASP OD1 1 1 1 627 1 1 40 ASP OD2 O 6.509 -4.065 -5.740 1.00 . A A . 37 ASP OD2 1 1 1 628 1 1 41 ASN C C 12.235 -1.412 -2.564 1.00 . A A . 38 ASN C 1 1 1 629 1 1 41 ASN CA C 12.659 -2.743 -3.171 1.00 . A A . 38 ASN CA 1 1 1 630 1 1 41 ASN CB C 13.854 -2.556 -4.103 1.00 . A A . 38 ASN CB 1 1 1 631 1 1 41 ASN CG C 14.522 -3.869 -4.459 1.00 . A A . 38 ASN CG 1 1 1 632 1 1 41 ASN H H 11.232 -4.248 -3.571 1.00 . A A . 38 ASN H 1 1 1 633 1 1 41 ASN HA H 12.946 -3.406 -2.367 1.00 . A A . 38 ASN HA 1 1 1 634 1 1 41 ASN HB2 H 13.510 -2.094 -5.015 1.00 . A A . 38 ASN HB2 1 1 1 635 1 1 41 ASN HB3 H 14.580 -1.917 -3.627 1.00 . A A . 38 ASN HB3 1 1 1 636 1 1 41 ASN HD21 H 13.431 -4.007 -6.112 1.00 . A A . 38 ASN HD21 1 1 1 637 1 1 41 ASN HD22 H 14.535 -5.306 -5.827 1.00 . A A . 38 ASN HD22 1 1 1 638 1 1 41 ASN N N 11.547 -3.373 -3.879 1.00 . A A . 38 ASN N 1 1 1 639 1 1 41 ASN ND2 N 14.123 -4.452 -5.579 1.00 . A A . 38 ASN ND2 1 1 1 640 1 1 41 ASN O O 12.655 -0.339 -3.001 1.00 . A A . 38 ASN O 1 1 1 641 1 1 41 ASN OD1 O 15.395 -4.351 -3.739 1.00 . A A . 38 ASN OD1 1 1 1 642 1 1 42 CYS C C 10.988 -0.437 0.607 1.00 . A A . 39 CYS C 1 1 1 643 1 1 42 CYS CA C 10.851 -0.313 -0.906 1.00 . A A . 39 CYS CA 1 1 1 644 1 1 42 CYS CB C 9.378 -0.162 -1.312 1.00 . A A . 39 CYS CB 1 1 1 645 1 1 42 CYS H H 11.163 -2.379 -1.193 1.00 . A A . 39 CYS H 1 1 1 646 1 1 42 CYS HA H 11.407 0.548 -1.246 1.00 . A A . 39 CYS HA 1 1 1 647 1 1 42 CYS HB2 H 9.308 -0.179 -2.389 1.00 . A A . 39 CYS HB2 1 1 1 648 1 1 42 CYS HB3 H 8.819 -0.993 -0.911 1.00 . A A . 39 CYS HB3 1 1 1 649 1 1 42 CYS N N 11.404 -1.494 -1.542 1.00 . A A . 39 CYS N 1 1 1 650 1 1 42 CYS O O 10.975 -1.541 1.146 1.00 . A A . 39 CYS O 1 1 1 651 1 1 42 CYS SG S 8.581 1.359 -0.744 1.00 . A A . 39 CYS SG 1 1 1 652 1 1 43 SER C C 10.037 1.529 3.270 1.00 . A A . 40 SER C 1 1 1 653 1 1 43 SER CA C 11.199 0.700 2.735 1.00 . A A . 40 SER CA 1 1 1 654 1 1 43 SER CB C 12.533 1.252 3.243 1.00 . A A . 40 SER CB 1 1 1 655 1 1 43 SER H H 11.308 1.529 0.792 1.00 . A A . 40 SER H 1 1 1 656 1 1 43 SER HA H 11.086 -0.318 3.078 1.00 . A A . 40 SER HA 1 1 1 657 1 1 43 SER HB2 H 12.623 2.289 2.957 1.00 . A A . 40 SER HB2 1 1 1 658 1 1 43 SER HB3 H 12.569 1.170 4.318 1.00 . A A . 40 SER HB3 1 1 1 659 1 1 43 SER HG H 13.808 0.860 1.803 1.00 . A A . 40 SER HG 1 1 1 660 1 1 43 SER N N 11.171 0.685 1.283 1.00 . A A . 40 SER N 1 1 1 661 1 1 43 SER O O 9.496 1.252 4.340 1.00 . A A . 40 SER O 1 1 1 662 1 1 43 SER OG O 13.623 0.529 2.691 1.00 . A A . 40 SER OG 1 1 1 663 1 1 44 GLY C C 8.849 4.515 3.733 1.00 . A A . 41 GLY C 1 1 1 664 1 1 44 GLY CA C 8.495 3.346 2.841 1.00 . A A . 41 GLY CA 1 1 1 665 1 1 44 GLY H H 10.161 2.745 1.684 1.00 . A A . 41 GLY H 1 1 1 666 1 1 44 GLY HA2 H 8.052 3.725 1.932 1.00 . A A . 41 GLY HA2 1 1 1 667 1 1 44 GLY HA3 H 7.775 2.727 3.345 1.00 . A A . 41 GLY HA3 1 1 1 668 1 1 44 GLY N N 9.648 2.539 2.497 1.00 . A A . 41 GLY N 1 1 1 669 1 1 44 GLY O O 8.220 4.734 4.764 1.00 . A A . 41 GLY O 1 1 1 670 1 1 45 GLN C C 10.276 7.649 3.145 1.00 . A A . 42 GLN C 1 1 1 671 1 1 45 GLN CA C 10.290 6.442 4.069 1.00 . A A . 42 GLN CA 1 1 1 672 1 1 45 GLN CB C 11.697 6.237 4.635 1.00 . A A . 42 GLN CB 1 1 1 673 1 1 45 GLN CD C 13.246 4.807 6.018 1.00 . A A . 42 GLN CD 1 1 1 674 1 1 45 GLN CG C 11.840 4.987 5.486 1.00 . A A . 42 GLN CG 1 1 1 675 1 1 45 GLN H H 10.321 5.040 2.487 1.00 . A A . 42 GLN H 1 1 1 676 1 1 45 GLN HA H 9.596 6.608 4.879 1.00 . A A . 42 GLN HA 1 1 1 677 1 1 45 GLN HB2 H 12.396 6.171 3.816 1.00 . A A . 42 GLN HB2 1 1 1 678 1 1 45 GLN HB3 H 11.951 7.090 5.245 1.00 . A A . 42 GLN HB3 1 1 1 679 1 1 45 GLN HE21 H 12.776 5.818 7.659 1.00 . A A . 42 GLN HE21 1 1 1 680 1 1 45 GLN HE22 H 14.403 5.239 7.571 1.00 . A A . 42 GLN HE22 1 1 1 681 1 1 45 GLN HG2 H 11.162 5.056 6.323 1.00 . A A . 42 GLN HG2 1 1 1 682 1 1 45 GLN HG3 H 11.584 4.126 4.886 1.00 . A A . 42 GLN HG3 1 1 1 683 1 1 45 GLN N N 9.854 5.270 3.328 1.00 . A A . 42 GLN N 1 1 1 684 1 1 45 GLN NE2 N 13.502 5.341 7.199 1.00 . A A . 42 GLN NE2 1 1 1 685 1 1 45 GLN O O 10.898 8.671 3.422 1.00 . A A . 42 GLN O 1 1 1 686 1 1 45 GLN OE1 O 14.093 4.187 5.373 1.00 . A A . 42 GLN OE1 1 1 1 687 1 1 46 THR C C 10.641 8.649 0.131 1.00 . A A . 43 THR C 1 1 1 688 1 1 46 THR CA C 9.398 8.534 1.020 1.00 . A A . 43 THR CA 1 1 1 689 1 1 46 THR CB C 9.065 9.909 1.635 1.00 . A A . 43 THR CB 1 1 1 690 1 1 46 THR CG2 C 8.443 10.820 0.590 1.00 . A A . 43 THR CG2 1 1 1 691 1 1 46 THR H H 9.118 6.635 1.890 1.00 . A A . 43 THR H 1 1 1 692 1 1 46 THR HA H 8.566 8.241 0.395 1.00 . A A . 43 THR HA 1 1 1 693 1 1 46 THR HB H 9.977 10.362 1.994 1.00 . A A . 43 THR HB 1 1 1 694 1 1 46 THR HG1 H 8.641 9.472 3.516 1.00 . A A . 43 THR HG1 1 1 1 695 1 1 46 THR HG21 H 7.550 10.356 0.196 1.00 . A A . 43 THR HG21 1 1 1 696 1 1 46 THR HG22 H 9.147 10.984 -0.212 1.00 . A A . 43 THR HG22 1 1 1 697 1 1 46 THR HG23 H 8.186 11.766 1.042 1.00 . A A . 43 THR HG23 1 1 1 698 1 1 46 THR N N 9.558 7.494 2.035 1.00 . A A . 43 THR N 1 1 1 699 1 1 46 THR O O 10.550 8.524 -1.088 1.00 . A A . 43 THR O 1 1 1 700 1 1 46 THR OG1 O 8.150 9.750 2.730 1.00 . A A . 43 THR OG1 1 1 1 701 1 1 47 HIS C C 14.027 7.900 0.354 1.00 . A A . 44 HIS C 1 1 1 702 1 1 47 HIS CA C 13.042 8.997 -0.027 1.00 . A A . 44 HIS CA 1 1 1 703 1 1 47 HIS CB C 13.681 10.375 0.175 1.00 . A A . 44 HIS CB 1 1 1 704 1 1 47 HIS CD2 C 12.817 11.864 -1.765 1.00 . A A . 44 HIS CD2 1 1 1 705 1 1 47 HIS CE1 C 11.591 13.243 -0.589 1.00 . A A . 44 HIS CE1 1 1 1 706 1 1 47 HIS CG C 12.916 11.490 -0.467 1.00 . A A . 44 HIS CG 1 1 1 707 1 1 47 HIS H H 11.826 8.964 1.717 1.00 . A A . 44 HIS H 1 1 1 708 1 1 47 HIS HA H 12.791 8.883 -1.071 1.00 . A A . 44 HIS HA 1 1 1 709 1 1 47 HIS HB2 H 13.747 10.583 1.231 1.00 . A A . 44 HIS HB2 1 1 1 710 1 1 47 HIS HB3 H 14.675 10.366 -0.248 1.00 . A A . 44 HIS HB3 1 1 1 711 1 1 47 HIS HD1 H 11.997 12.367 1.217 1.00 . A A . 44 HIS HD1 1 1 1 712 1 1 47 HIS HD2 H 13.302 11.389 -2.607 1.00 . A A . 44 HIS HD2 1 1 1 713 1 1 47 HIS HE1 H 10.932 14.053 -0.314 1.00 . A A . 44 HIS HE1 1 1 1 714 1 1 47 HIS HE2 H 11.850 13.530 -2.600 1.00 . A A . 44 HIS HE2 1 1 1 715 1 1 47 HIS N N 11.801 8.877 0.735 1.00 . A A . 44 HIS N 1 1 1 716 1 1 47 HIS ND1 N 12.135 12.375 0.242 1.00 . A A . 44 HIS ND1 1 1 1 717 1 1 47 HIS NE2 N 11.988 12.956 -1.814 1.00 . A A . 44 HIS NE2 1 1 1 718 1 1 47 HIS O O 15.229 8.138 0.470 1.00 . A A . 44 HIS O 1 1 1 719 1 1 48 ASP C C 14.834 4.900 -0.437 1.00 . A A . 45 ASP C 1 1 1 720 1 1 48 ASP CA C 14.343 5.544 0.854 1.00 . A A . 45 ASP CA 1 1 1 721 1 1 48 ASP CB C 13.581 4.525 1.706 1.00 . A A . 45 ASP CB 1 1 1 722 1 1 48 ASP CG C 12.229 4.169 1.124 1.00 . A A . 45 ASP CG 1 1 1 723 1 1 48 ASP H H 12.537 6.582 0.500 1.00 . A A . 45 ASP H 1 1 1 724 1 1 48 ASP HA H 15.200 5.895 1.410 1.00 . A A . 45 ASP HA 1 1 1 725 1 1 48 ASP HB2 H 14.166 3.621 1.781 1.00 . A A . 45 ASP HB2 1 1 1 726 1 1 48 ASP HB3 H 13.432 4.932 2.694 1.00 . A A . 45 ASP HB3 1 1 1 727 1 1 48 ASP N N 13.510 6.700 0.556 1.00 . A A . 45 ASP N 1 1 1 728 1 1 48 ASP O O 14.008 4.356 -1.193 1.00 . A A . 45 ASP O 1 1 1 729 1 1 48 ASP OXT O 16.049 4.955 -0.703 1.00 . A A . 45 ASP OXT 1 1 1 730 1 1 48 ASP OD1 O 11.303 4.996 1.223 1.00 . A A . 45 ASP OD1 1 1 1 731 1 1 48 ASP OD2 O 12.079 3.060 0.567 1.00 . A A . 45 ASP OD2 1 1 1 732 2 2 1 ZN ZN ZN -4.446 -5.502 0.489 1.00 . B A . 101 ZN ZN 1 1 1 733 3 2 1 ZN ZN ZN 6.326 1.251 -1.187 1.00 . C A . 102 ZN ZN 1 1 2 734 1 1 1 GLY C C -21.188 2.668 -3.266 1.00 . A A . -2 GLY C 1 1 2 735 1 1 1 GLY CA C -22.094 1.456 -3.193 1.00 . A A . -2 GLY CA 1 1 2 736 1 1 1 GLY H1 H -23.173 0.199 -4.455 1.00 . A A . -2 GLY H1 1 1 2 737 1 1 1 GLY H2 H -21.744 0.795 -5.134 1.00 . A A . -2 GLY H2 1 1 2 738 1 1 1 GLY H3 H -23.091 1.802 -4.984 1.00 . A A . -2 GLY H3 1 1 2 739 1 1 1 GLY HA2 H -22.951 1.696 -2.583 1.00 . A A . -2 GLY HA2 1 1 2 740 1 1 1 GLY HA3 H -21.553 0.640 -2.734 1.00 . A A . -2 GLY HA3 1 1 2 741 1 1 1 GLY N N -22.558 1.032 -4.534 1.00 . A A . -2 GLY N 1 1 2 742 1 1 1 GLY O O -21.204 3.394 -4.263 1.00 . A A . -2 GLY O 1 1 2 743 1 1 2 PRO C C -18.274 3.869 -3.134 1.00 . A A . -1 PRO C 1 1 2 744 1 1 2 PRO CA C -19.469 4.063 -2.201 1.00 . A A . -1 PRO CA 1 1 2 745 1 1 2 PRO CB C -19.019 4.130 -0.741 1.00 . A A . -1 PRO CB 1 1 2 746 1 1 2 PRO CD C -20.285 2.105 -1.000 1.00 . A A . -1 PRO CD 1 1 2 747 1 1 2 PRO CG C -19.151 2.734 -0.234 1.00 . A A . -1 PRO CG 1 1 2 748 1 1 2 PRO HA H -19.981 4.978 -2.465 1.00 . A A . -1 PRO HA 1 1 2 749 1 1 2 PRO HB2 H -17.997 4.473 -0.692 1.00 . A A . -1 PRO HB2 1 1 2 750 1 1 2 PRO HB3 H -19.658 4.808 -0.196 1.00 . A A . -1 PRO HB3 1 1 2 751 1 1 2 PRO HD2 H -20.053 1.077 -1.237 1.00 . A A . -1 PRO HD2 1 1 2 752 1 1 2 PRO HD3 H -21.201 2.162 -0.430 1.00 . A A . -1 PRO HD3 1 1 2 753 1 1 2 PRO HG2 H -18.235 2.192 -0.413 1.00 . A A . -1 PRO HG2 1 1 2 754 1 1 2 PRO HG3 H -19.377 2.749 0.822 1.00 . A A . -1 PRO HG3 1 1 2 755 1 1 2 PRO N N -20.378 2.918 -2.228 1.00 . A A . -1 PRO N 1 1 2 756 1 1 2 PRO O O -17.223 3.370 -2.729 1.00 . A A . -1 PRO O 1 1 2 757 1 1 3 HIS C C -16.294 5.197 -5.161 1.00 . A A . 0 HIS C 1 1 2 758 1 1 3 HIS CA C -17.386 4.153 -5.389 1.00 . A A . 0 HIS CA 1 1 2 759 1 1 3 HIS CB C -17.957 4.266 -6.811 1.00 . A A . 0 HIS CB 1 1 2 760 1 1 3 HIS CD2 C -20.071 5.771 -6.816 1.00 . A A . 0 HIS CD2 1 1 2 761 1 1 3 HIS CE1 C -19.202 7.551 -7.746 1.00 . A A . 0 HIS CE1 1 1 2 762 1 1 3 HIS CG C -18.766 5.504 -7.065 1.00 . A A . 0 HIS CG 1 1 2 763 1 1 3 HIS H H -19.307 4.660 -4.643 1.00 . A A . 0 HIS H 1 1 2 764 1 1 3 HIS HA H -16.945 3.174 -5.271 1.00 . A A . 0 HIS HA 1 1 2 765 1 1 3 HIS HB2 H -17.140 4.261 -7.517 1.00 . A A . 0 HIS HB2 1 1 2 766 1 1 3 HIS HB3 H -18.590 3.412 -7.002 1.00 . A A . 0 HIS HB3 1 1 2 767 1 1 3 HIS HD1 H -17.328 6.756 -7.969 1.00 . A A . 0 HIS HD1 1 1 2 768 1 1 3 HIS HD2 H -20.786 5.100 -6.361 1.00 . A A . 0 HIS HD2 1 1 2 769 1 1 3 HIS HE1 H -19.091 8.540 -8.161 1.00 . A A . 0 HIS HE1 1 1 2 770 1 1 3 HIS HE2 H -21.202 7.467 -7.312 1.00 . A A . 0 HIS HE2 1 1 2 771 1 1 3 HIS N N -18.443 4.273 -4.386 1.00 . A A . 0 HIS N 1 1 2 772 1 1 3 HIS ND1 N -18.251 6.641 -7.651 1.00 . A A . 0 HIS ND1 1 1 2 773 1 1 3 HIS NE2 N -20.313 7.048 -7.248 1.00 . A A . 0 HIS NE2 1 1 2 774 1 1 3 HIS O O -15.291 5.227 -5.871 1.00 . A A . 0 HIS O 1 1 2 775 1 1 4 MET C C -14.347 6.336 -3.041 1.00 . A A . 1 MET C 1 1 2 776 1 1 4 MET CA C -15.505 7.027 -3.752 1.00 . A A . 1 MET CA 1 1 2 777 1 1 4 MET CB C -16.131 8.072 -2.819 1.00 . A A . 1 MET CB 1 1 2 778 1 1 4 MET CE C -18.803 9.264 -1.429 1.00 . A A . 1 MET CE 1 1 2 779 1 1 4 MET CG C -16.668 7.489 -1.518 1.00 . A A . 1 MET CG 1 1 2 780 1 1 4 MET H H -17.369 6.029 -3.701 1.00 . A A . 1 MET H 1 1 2 781 1 1 4 MET HA H -15.133 7.521 -4.637 1.00 . A A . 1 MET HA 1 1 2 782 1 1 4 MET HB2 H -15.383 8.812 -2.574 1.00 . A A . 1 MET HB2 1 1 2 783 1 1 4 MET HB3 H -16.946 8.555 -3.335 1.00 . A A . 1 MET HB3 1 1 2 784 1 1 4 MET HE1 H -19.356 10.020 -0.892 1.00 . A A . 1 MET HE1 1 1 2 785 1 1 4 MET HE2 H -19.446 8.421 -1.628 1.00 . A A . 1 MET HE2 1 1 2 786 1 1 4 MET HE3 H -18.449 9.674 -2.362 1.00 . A A . 1 MET HE3 1 1 2 787 1 1 4 MET HG2 H -17.419 6.750 -1.753 1.00 . A A . 1 MET HG2 1 1 2 788 1 1 4 MET HG3 H -15.853 7.014 -0.990 1.00 . A A . 1 MET HG3 1 1 2 789 1 1 4 MET N N -16.504 6.049 -4.163 1.00 . A A . 1 MET N 1 1 2 790 1 1 4 MET O O -13.288 6.928 -2.834 1.00 . A A . 1 MET O 1 1 2 791 1 1 4 MET SD S -17.406 8.733 -0.439 1.00 . A A . 1 MET SD 1 1 2 792 1 1 5 ALA C C -12.699 3.576 -3.026 1.00 . A A . 2 ALA C 1 1 2 793 1 1 5 ALA CA C -13.544 4.300 -1.999 1.00 . A A . 2 ALA CA 1 1 2 794 1 1 5 ALA CB C -14.170 3.305 -1.034 1.00 . A A . 2 ALA CB 1 1 2 795 1 1 5 ALA H H -15.420 4.665 -2.863 1.00 . A A . 2 ALA H 1 1 2 796 1 1 5 ALA HA H -12.916 4.974 -1.436 1.00 . A A . 2 ALA HA 1 1 2 797 1 1 5 ALA HB1 H -13.388 2.761 -0.523 1.00 . A A . 2 ALA HB1 1 1 2 798 1 1 5 ALA HB2 H -14.790 2.612 -1.583 1.00 . A A . 2 ALA HB2 1 1 2 799 1 1 5 ALA HB3 H -14.772 3.835 -0.310 1.00 . A A . 2 ALA HB3 1 1 2 800 1 1 5 ALA N N -14.562 5.082 -2.665 1.00 . A A . 2 ALA N 1 1 2 801 1 1 5 ALA O O -13.184 3.187 -4.090 1.00 . A A . 2 ALA O 1 1 2 802 1 1 6 VAL C C -10.086 1.402 -3.041 1.00 . A A . 3 VAL C 1 1 2 803 1 1 6 VAL CA C -10.499 2.758 -3.599 1.00 . A A . 3 VAL CA 1 1 2 804 1 1 6 VAL CB C -9.256 3.644 -3.810 1.00 . A A . 3 VAL CB 1 1 2 805 1 1 6 VAL CG1 C -8.222 2.937 -4.671 1.00 . A A . 3 VAL CG1 1 1 2 806 1 1 6 VAL CG2 C -9.661 4.970 -4.435 1.00 . A A . 3 VAL CG2 1 1 2 807 1 1 6 VAL H H -11.128 3.716 -1.832 1.00 . A A . 3 VAL H 1 1 2 808 1 1 6 VAL HA H -10.985 2.615 -4.552 1.00 . A A . 3 VAL HA 1 1 2 809 1 1 6 VAL HB H -8.814 3.845 -2.845 1.00 . A A . 3 VAL HB 1 1 2 810 1 1 6 VAL HG11 H -8.659 2.686 -5.626 1.00 . A A . 3 VAL HG11 1 1 2 811 1 1 6 VAL HG12 H -7.900 2.035 -4.173 1.00 . A A . 3 VAL HG12 1 1 2 812 1 1 6 VAL HG13 H -7.374 3.588 -4.822 1.00 . A A . 3 VAL HG13 1 1 2 813 1 1 6 VAL HG21 H -10.395 5.455 -3.805 1.00 . A A . 3 VAL HG21 1 1 2 814 1 1 6 VAL HG22 H -10.089 4.792 -5.411 1.00 . A A . 3 VAL HG22 1 1 2 815 1 1 6 VAL HG23 H -8.793 5.604 -4.532 1.00 . A A . 3 VAL HG23 1 1 2 816 1 1 6 VAL N N -11.439 3.404 -2.704 1.00 . A A . 3 VAL N 1 1 2 817 1 1 6 VAL O O -9.964 1.232 -1.830 1.00 . A A . 3 VAL O 1 1 2 818 1 1 7 LEU C C -7.968 -0.936 -3.311 1.00 . A A . 4 LEU C 1 1 2 819 1 1 7 LEU CA C -9.472 -0.894 -3.536 1.00 . A A . 4 LEU CA 1 1 2 820 1 1 7 LEU CB C -9.880 -1.923 -4.592 1.00 . A A . 4 LEU CB 1 1 2 821 1 1 7 LEU CD1 C -11.683 -3.230 -5.739 1.00 . A A . 4 LEU CD1 1 1 2 822 1 1 7 LEU CD2 C -11.693 -3.015 -3.254 1.00 . A A . 4 LEU CD2 1 1 2 823 1 1 7 LEU CG C -11.355 -2.324 -4.567 1.00 . A A . 4 LEU CG 1 1 2 824 1 1 7 LEU H H -10.059 0.625 -4.878 1.00 . A A . 4 LEU H 1 1 2 825 1 1 7 LEU HA H -9.963 -1.136 -2.609 1.00 . A A . 4 LEU HA 1 1 2 826 1 1 7 LEU HB2 H -9.656 -1.515 -5.566 1.00 . A A . 4 LEU HB2 1 1 2 827 1 1 7 LEU HB3 H -9.286 -2.812 -4.448 1.00 . A A . 4 LEU HB3 1 1 2 828 1 1 7 LEU HD11 H -11.060 -4.111 -5.697 1.00 . A A . 4 LEU HD11 1 1 2 829 1 1 7 LEU HD12 H -11.501 -2.702 -6.663 1.00 . A A . 4 LEU HD12 1 1 2 830 1 1 7 LEU HD13 H -12.721 -3.521 -5.688 1.00 . A A . 4 LEU HD13 1 1 2 831 1 1 7 LEU HD21 H -11.002 -3.829 -3.082 1.00 . A A . 4 LEU HD21 1 1 2 832 1 1 7 LEU HD22 H -12.699 -3.402 -3.302 1.00 . A A . 4 LEU HD22 1 1 2 833 1 1 7 LEU HD23 H -11.623 -2.304 -2.444 1.00 . A A . 4 LEU HD23 1 1 2 834 1 1 7 LEU HG H -11.965 -1.438 -4.646 1.00 . A A . 4 LEU HG 1 1 2 835 1 1 7 LEU N N -9.904 0.435 -3.929 1.00 . A A . 4 LEU N 1 1 2 836 1 1 7 LEU O O -7.222 -0.118 -3.847 1.00 . A A . 4 LEU O 1 1 2 837 1 1 8 CYS C C -5.341 -2.328 -3.470 1.00 . A A . 5 CYS C 1 1 2 838 1 1 8 CYS CA C -6.142 -2.099 -2.190 1.00 . A A . 5 CYS CA 1 1 2 839 1 1 8 CYS CB C -6.006 -3.306 -1.260 1.00 . A A . 5 CYS CB 1 1 2 840 1 1 8 CYS H H -8.212 -2.460 -2.064 1.00 . A A . 5 CYS H 1 1 2 841 1 1 8 CYS HA H -5.766 -1.220 -1.688 1.00 . A A . 5 CYS HA 1 1 2 842 1 1 8 CYS HB2 H -6.568 -3.119 -0.360 1.00 . A A . 5 CYS HB2 1 1 2 843 1 1 8 CYS HB3 H -6.419 -4.176 -1.750 1.00 . A A . 5 CYS HB3 1 1 2 844 1 1 8 CYS N N -7.547 -1.886 -2.491 1.00 . A A . 5 CYS N 1 1 2 845 1 1 8 CYS O O -5.669 -3.201 -4.264 1.00 . A A . 5 CYS O 1 1 2 846 1 1 8 CYS SG S -4.313 -3.707 -0.772 1.00 . A A . 5 CYS SG 1 1 2 847 1 1 9 GLY C C -2.723 -2.977 -4.936 1.00 . A A . 6 GLY C 1 1 2 848 1 1 9 GLY CA C -3.479 -1.664 -4.855 1.00 . A A . 6 GLY CA 1 1 2 849 1 1 9 GLY H H -4.074 -0.862 -2.981 1.00 . A A . 6 GLY H 1 1 2 850 1 1 9 GLY HA2 H -4.122 -1.582 -5.718 1.00 . A A . 6 GLY HA2 1 1 2 851 1 1 9 GLY HA3 H -2.770 -0.851 -4.873 1.00 . A A . 6 GLY HA3 1 1 2 852 1 1 9 GLY N N -4.291 -1.546 -3.657 1.00 . A A . 6 GLY N 1 1 2 853 1 1 9 GLY O O -2.241 -3.356 -6.002 1.00 . A A . 6 GLY O 1 1 2 854 1 1 10 VAL C C -2.844 -6.130 -3.988 1.00 . A A . 7 VAL C 1 1 2 855 1 1 10 VAL CA C -1.900 -4.944 -3.780 1.00 . A A . 7 VAL CA 1 1 2 856 1 1 10 VAL CB C -1.134 -5.126 -2.455 1.00 . A A . 7 VAL CB 1 1 2 857 1 1 10 VAL CG1 C -0.518 -6.513 -2.371 1.00 . A A . 7 VAL CG1 1 1 2 858 1 1 10 VAL CG2 C -0.064 -4.057 -2.311 1.00 . A A . 7 VAL CG2 1 1 2 859 1 1 10 VAL H H -2.995 -3.311 -2.990 1.00 . A A . 7 VAL H 1 1 2 860 1 1 10 VAL HA H -1.178 -4.935 -4.584 1.00 . A A . 7 VAL HA 1 1 2 861 1 1 10 VAL HB H -1.834 -5.017 -1.639 1.00 . A A . 7 VAL HB 1 1 2 862 1 1 10 VAL HG11 H 0.186 -6.645 -3.179 1.00 . A A . 7 VAL HG11 1 1 2 863 1 1 10 VAL HG12 H -1.300 -7.255 -2.450 1.00 . A A . 7 VAL HG12 1 1 2 864 1 1 10 VAL HG13 H -0.008 -6.626 -1.426 1.00 . A A . 7 VAL HG13 1 1 2 865 1 1 10 VAL HG21 H 0.634 -4.131 -3.132 1.00 . A A . 7 VAL HG21 1 1 2 866 1 1 10 VAL HG22 H 0.461 -4.196 -1.377 1.00 . A A . 7 VAL HG22 1 1 2 867 1 1 10 VAL HG23 H -0.529 -3.082 -2.322 1.00 . A A . 7 VAL HG23 1 1 2 868 1 1 10 VAL N N -2.608 -3.671 -3.813 1.00 . A A . 7 VAL N 1 1 2 869 1 1 10 VAL O O -2.667 -6.911 -4.922 1.00 . A A . 7 VAL O 1 1 2 870 1 1 11 CYS C C -6.112 -7.074 -3.687 1.00 . A A . 8 CYS C 1 1 2 871 1 1 11 CYS CA C -4.718 -7.437 -3.159 1.00 . A A . 8 CYS CA 1 1 2 872 1 1 11 CYS CB C -4.822 -8.071 -1.769 1.00 . A A . 8 CYS CB 1 1 2 873 1 1 11 CYS H H -3.974 -5.588 -2.435 1.00 . A A . 8 CYS H 1 1 2 874 1 1 11 CYS HA H -4.274 -8.152 -3.832 1.00 . A A . 8 CYS HA 1 1 2 875 1 1 11 CYS HB2 H -5.316 -9.024 -1.859 1.00 . A A . 8 CYS HB2 1 1 2 876 1 1 11 CYS HB3 H -3.828 -8.224 -1.376 1.00 . A A . 8 CYS HB3 1 1 2 877 1 1 11 CYS N N -3.836 -6.270 -3.115 1.00 . A A . 8 CYS N 1 1 2 878 1 1 11 CYS O O -6.847 -7.948 -4.147 1.00 . A A . 8 CYS O 1 1 2 879 1 1 11 CYS SG S -5.748 -7.092 -0.562 1.00 . A A . 8 CYS SG 1 1 2 880 1 1 12 GLY C C -8.931 -6.106 -3.877 1.00 . A A . 9 GLY C 1 1 2 881 1 1 12 GLY CA C -7.700 -5.273 -4.186 1.00 . A A . 9 GLY CA 1 1 2 882 1 1 12 GLY H H -5.817 -5.161 -3.222 1.00 . A A . 9 GLY H 1 1 2 883 1 1 12 GLY HA2 H -7.860 -4.277 -3.800 1.00 . A A . 9 GLY HA2 1 1 2 884 1 1 12 GLY HA3 H -7.589 -5.208 -5.259 1.00 . A A . 9 GLY HA3 1 1 2 885 1 1 12 GLY N N -6.448 -5.787 -3.625 1.00 . A A . 9 GLY N 1 1 2 886 1 1 12 GLY O O -9.594 -6.591 -4.796 1.00 . A A . 9 GLY O 1 1 2 887 1 1 13 ILE C C -11.172 -6.470 -0.998 1.00 . A A . 10 ILE C 1 1 2 888 1 1 13 ILE CA C -10.423 -7.055 -2.205 1.00 . A A . 10 ILE CA 1 1 2 889 1 1 13 ILE CB C -10.056 -8.535 -1.912 1.00 . A A . 10 ILE CB 1 1 2 890 1 1 13 ILE CD1 C -8.815 -8.160 0.284 1.00 . A A . 10 ILE CD1 1 1 2 891 1 1 13 ILE CG1 C -8.735 -8.648 -1.141 1.00 . A A . 10 ILE CG1 1 1 2 892 1 1 13 ILE CG2 C -9.982 -9.338 -3.200 1.00 . A A . 10 ILE CG2 1 1 2 893 1 1 13 ILE H H -8.674 -5.893 -1.904 1.00 . A A . 10 ILE H 1 1 2 894 1 1 13 ILE HA H -11.098 -7.050 -3.050 1.00 . A A . 10 ILE HA 1 1 2 895 1 1 13 ILE HB H -10.845 -8.958 -1.310 1.00 . A A . 10 ILE HB 1 1 2 896 1 1 13 ILE HD11 H -7.842 -8.225 0.744 1.00 . A A . 10 ILE HD11 1 1 2 897 1 1 13 ILE HD12 H -9.518 -8.768 0.835 1.00 . A A . 10 ILE HD12 1 1 2 898 1 1 13 ILE HD13 H -9.148 -7.130 0.287 1.00 . A A . 10 ILE HD13 1 1 2 899 1 1 13 ILE HG12 H -8.426 -9.682 -1.119 1.00 . A A . 10 ILE HG12 1 1 2 900 1 1 13 ILE HG13 H -7.980 -8.063 -1.650 1.00 . A A . 10 ILE HG13 1 1 2 901 1 1 13 ILE HG21 H -9.718 -10.360 -2.974 1.00 . A A . 10 ILE HG21 1 1 2 902 1 1 13 ILE HG22 H -9.233 -8.908 -3.849 1.00 . A A . 10 ILE HG22 1 1 2 903 1 1 13 ILE HG23 H -10.942 -9.314 -3.693 1.00 . A A . 10 ILE HG23 1 1 2 904 1 1 13 ILE N N -9.248 -6.274 -2.594 1.00 . A A . 10 ILE N 1 1 2 905 1 1 13 ILE O O -12.251 -6.952 -0.656 1.00 . A A . 10 ILE O 1 1 2 906 1 1 14 LYS C C -10.916 -3.410 1.061 1.00 . A A . 11 LYS C 1 1 2 907 1 1 14 LYS CA C -11.248 -4.891 0.855 1.00 . A A . 11 LYS CA 1 1 2 908 1 1 14 LYS CB C -10.828 -5.703 2.089 1.00 . A A . 11 LYS CB 1 1 2 909 1 1 14 LYS CD C -9.009 -6.510 3.605 1.00 . A A . 11 LYS CD 1 1 2 910 1 1 14 LYS CE C -7.675 -6.181 4.246 1.00 . A A . 11 LYS CE 1 1 2 911 1 1 14 LYS CG C -9.366 -5.546 2.492 1.00 . A A . 11 LYS CG 1 1 2 912 1 1 14 LYS H H -9.795 -5.039 -0.690 1.00 . A A . 11 LYS H 1 1 2 913 1 1 14 LYS HA H -12.316 -4.984 0.732 1.00 . A A . 11 LYS HA 1 1 2 914 1 1 14 LYS HB2 H -11.436 -5.399 2.927 1.00 . A A . 11 LYS HB2 1 1 2 915 1 1 14 LYS HB3 H -11.010 -6.750 1.891 1.00 . A A . 11 LYS HB3 1 1 2 916 1 1 14 LYS HD2 H -9.776 -6.468 4.359 1.00 . A A . 11 LYS HD2 1 1 2 917 1 1 14 LYS HD3 H -8.961 -7.503 3.191 1.00 . A A . 11 LYS HD3 1 1 2 918 1 1 14 LYS HE2 H -6.915 -6.186 3.480 1.00 . A A . 11 LYS HE2 1 1 2 919 1 1 14 LYS HE3 H -7.738 -5.197 4.684 1.00 . A A . 11 LYS HE3 1 1 2 920 1 1 14 LYS HG2 H -8.739 -5.747 1.636 1.00 . A A . 11 LYS HG2 1 1 2 921 1 1 14 LYS HG3 H -9.203 -4.535 2.834 1.00 . A A . 11 LYS HG3 1 1 2 922 1 1 14 LYS HZ1 H -7.995 -7.132 6.078 1.00 . A A . 11 LYS HZ1 1 1 2 923 1 1 14 LYS HZ2 H -6.364 -6.932 5.686 1.00 . A A . 11 LYS HZ2 1 1 2 924 1 1 14 LYS HZ3 H -7.277 -8.121 4.909 1.00 . A A . 11 LYS HZ3 1 1 2 925 1 1 14 LYS N N -10.619 -5.438 -0.352 1.00 . A A . 11 LYS N 1 1 2 926 1 1 14 LYS NZ N -7.303 -7.159 5.302 1.00 . A A . 11 LYS NZ 1 1 2 927 1 1 14 LYS O O -10.622 -2.978 2.180 1.00 . A A . 11 LYS O 1 1 2 928 1 1 15 GLU C C -9.233 -0.964 0.447 1.00 . A A . 12 GLU C 1 1 2 929 1 1 15 GLU CA C -10.683 -1.199 0.025 1.00 . A A . 12 GLU CA 1 1 2 930 1 1 15 GLU CB C -11.629 -0.444 0.975 1.00 . A A . 12 GLU CB 1 1 2 931 1 1 15 GLU CD C -13.793 -1.543 0.249 1.00 . A A . 12 GLU CD 1 1 2 932 1 1 15 GLU CG C -13.039 -0.246 0.434 1.00 . A A . 12 GLU CG 1 1 2 933 1 1 15 GLU H H -11.301 -3.027 -0.860 1.00 . A A . 12 GLU H 1 1 2 934 1 1 15 GLU HA H -10.815 -0.810 -0.972 1.00 . A A . 12 GLU HA 1 1 2 935 1 1 15 GLU HB2 H -11.700 -0.994 1.901 1.00 . A A . 12 GLU HB2 1 1 2 936 1 1 15 GLU HB3 H -11.206 0.529 1.180 1.00 . A A . 12 GLU HB3 1 1 2 937 1 1 15 GLU HG2 H -13.590 0.373 1.126 1.00 . A A . 12 GLU HG2 1 1 2 938 1 1 15 GLU HG3 H -12.976 0.256 -0.521 1.00 . A A . 12 GLU HG3 1 1 2 939 1 1 15 GLU N N -10.999 -2.633 -0.016 1.00 . A A . 12 GLU N 1 1 2 940 1 1 15 GLU O O -8.432 -1.902 0.525 1.00 . A A . 12 GLU O 1 1 2 941 1 1 15 GLU OE1 O -14.324 -2.075 1.247 1.00 . A A . 12 GLU OE1 1 1 2 942 1 1 15 GLU OE2 O -13.860 -2.039 -0.895 1.00 . A A . 12 GLU OE2 1 1 2 943 1 1 16 PHE C C -7.676 1.296 2.536 1.00 . A A . 13 PHE C 1 1 2 944 1 1 16 PHE CA C -7.576 0.663 1.153 1.00 . A A . 13 PHE CA 1 1 2 945 1 1 16 PHE CB C -6.912 1.644 0.183 1.00 . A A . 13 PHE CB 1 1 2 946 1 1 16 PHE CD1 C -8.576 3.474 -0.282 1.00 . A A . 13 PHE CD1 1 1 2 947 1 1 16 PHE CD2 C -6.658 3.994 1.037 1.00 . A A . 13 PHE CD2 1 1 2 948 1 1 16 PHE CE1 C -9.018 4.778 -0.157 1.00 . A A . 13 PHE CE1 1 1 2 949 1 1 16 PHE CE2 C -7.094 5.298 1.165 1.00 . A A . 13 PHE CE2 1 1 2 950 1 1 16 PHE CG C -7.394 3.067 0.313 1.00 . A A . 13 PHE CG 1 1 2 951 1 1 16 PHE CZ C -8.276 5.691 0.568 1.00 . A A . 13 PHE CZ 1 1 2 952 1 1 16 PHE H H -9.540 1.007 0.487 1.00 . A A . 13 PHE H 1 1 2 953 1 1 16 PHE HA H -6.979 -0.233 1.215 1.00 . A A . 13 PHE HA 1 1 2 954 1 1 16 PHE HB2 H -5.851 1.640 0.359 1.00 . A A . 13 PHE HB2 1 1 2 955 1 1 16 PHE HB3 H -7.104 1.321 -0.830 1.00 . A A . 13 PHE HB3 1 1 2 956 1 1 16 PHE HD1 H -9.156 2.762 -0.851 1.00 . A A . 13 PHE HD1 1 1 2 957 1 1 16 PHE HD2 H -5.735 3.686 1.507 1.00 . A A . 13 PHE HD2 1 1 2 958 1 1 16 PHE HE1 H -9.942 5.082 -0.625 1.00 . A A . 13 PHE HE1 1 1 2 959 1 1 16 PHE HE2 H -6.511 6.010 1.732 1.00 . A A . 13 PHE HE2 1 1 2 960 1 1 16 PHE HZ H -8.619 6.709 0.667 1.00 . A A . 13 PHE HZ 1 1 2 961 1 1 16 PHE N N -8.893 0.297 0.672 1.00 . A A . 13 PHE N 1 1 2 962 1 1 16 PHE O O -8.758 1.701 2.968 1.00 . A A . 13 PHE O 1 1 2 963 1 1 17 LYS C C -5.139 2.803 4.606 1.00 . A A . 14 LYS C 1 1 2 964 1 1 17 LYS CA C -6.464 2.046 4.504 1.00 . A A . 14 LYS CA 1 1 2 965 1 1 17 LYS CB C -6.594 1.024 5.638 1.00 . A A . 14 LYS CB 1 1 2 966 1 1 17 LYS CD C -6.751 0.587 8.110 1.00 . A A . 14 LYS CD 1 1 2 967 1 1 17 LYS CE C -6.844 1.225 9.486 1.00 . A A . 14 LYS CE 1 1 2 968 1 1 17 LYS CG C -6.590 1.639 7.025 1.00 . A A . 14 LYS CG 1 1 2 969 1 1 17 LYS H H -5.737 0.958 2.848 1.00 . A A . 14 LYS H 1 1 2 970 1 1 17 LYS HA H -7.277 2.754 4.566 1.00 . A A . 14 LYS HA 1 1 2 971 1 1 17 LYS HB2 H -7.520 0.484 5.511 1.00 . A A . 14 LYS HB2 1 1 2 972 1 1 17 LYS HB3 H -5.772 0.328 5.573 1.00 . A A . 14 LYS HB3 1 1 2 973 1 1 17 LYS HD2 H -7.652 0.024 7.923 1.00 . A A . 14 LYS HD2 1 1 2 974 1 1 17 LYS HD3 H -5.897 -0.074 8.087 1.00 . A A . 14 LYS HD3 1 1 2 975 1 1 17 LYS HE2 H -6.893 0.444 10.229 1.00 . A A . 14 LYS HE2 1 1 2 976 1 1 17 LYS HE3 H -5.960 1.822 9.651 1.00 . A A . 14 LYS HE3 1 1 2 977 1 1 17 LYS HG2 H -5.652 2.152 7.175 1.00 . A A . 14 LYS HG2 1 1 2 978 1 1 17 LYS HG3 H -7.404 2.343 7.096 1.00 . A A . 14 LYS HG3 1 1 2 979 1 1 17 LYS HZ1 H -8.084 2.512 10.566 1.00 . A A . 14 LYS HZ1 1 1 2 980 1 1 17 LYS HZ2 H -8.909 1.535 9.460 1.00 . A A . 14 LYS HZ2 1 1 2 981 1 1 17 LYS HZ3 H -8.012 2.859 8.914 1.00 . A A . 14 LYS HZ3 1 1 2 982 1 1 17 LYS N N -6.546 1.376 3.218 1.00 . A A . 14 LYS N 1 1 2 983 1 1 17 LYS NZ N -8.045 2.094 9.615 1.00 . A A . 14 LYS NZ 1 1 2 984 1 1 17 LYS O O -4.988 3.724 5.410 1.00 . A A . 14 LYS O 1 1 2 985 1 1 18 TYR C C -2.563 3.583 2.373 1.00 . A A . 15 TYR C 1 1 2 986 1 1 18 TYR CA C -2.870 3.033 3.759 1.00 . A A . 15 TYR CA 1 1 2 987 1 1 18 TYR CB C -1.786 2.019 4.139 1.00 . A A . 15 TYR CB 1 1 2 988 1 1 18 TYR CD1 C -2.940 0.634 5.903 1.00 . A A . 15 TYR CD1 1 1 2 989 1 1 18 TYR CD2 C -0.932 1.764 6.497 1.00 . A A . 15 TYR CD2 1 1 2 990 1 1 18 TYR CE1 C -3.035 0.119 7.179 1.00 . A A . 15 TYR CE1 1 1 2 991 1 1 18 TYR CE2 C -1.016 1.251 7.777 1.00 . A A . 15 TYR CE2 1 1 2 992 1 1 18 TYR CG C -1.891 1.464 5.542 1.00 . A A . 15 TYR CG 1 1 2 993 1 1 18 TYR CZ C -2.071 0.430 8.112 1.00 . A A . 15 TYR CZ 1 1 2 994 1 1 18 TYR H H -4.370 1.688 3.140 1.00 . A A . 15 TYR H 1 1 2 995 1 1 18 TYR HA H -2.869 3.842 4.472 1.00 . A A . 15 TYR HA 1 1 2 996 1 1 18 TYR HB2 H -1.836 1.185 3.457 1.00 . A A . 15 TYR HB2 1 1 2 997 1 1 18 TYR HB3 H -0.820 2.491 4.043 1.00 . A A . 15 TYR HB3 1 1 2 998 1 1 18 TYR HD1 H -3.693 0.391 5.167 1.00 . A A . 15 TYR HD1 1 1 2 999 1 1 18 TYR HD2 H -0.109 2.410 6.231 1.00 . A A . 15 TYR HD2 1 1 2 1000 1 1 18 TYR HE1 H -3.863 -0.522 7.441 1.00 . A A . 15 TYR HE1 1 1 2 1001 1 1 18 TYR HE2 H -0.258 1.494 8.507 1.00 . A A . 15 TYR HE2 1 1 2 1002 1 1 18 TYR HH H -2.344 -1.034 9.335 1.00 . A A . 15 TYR HH 1 1 2 1003 1 1 18 TYR N N -4.186 2.414 3.773 1.00 . A A . 15 TYR N 1 1 2 1004 1 1 18 TYR O O -3.369 3.458 1.451 1.00 . A A . 15 TYR O 1 1 2 1005 1 1 18 TYR OH O -2.159 -0.086 9.385 1.00 . A A . 15 TYR OH 1 1 2 1006 1 1 19 LYS C C 0.584 4.952 1.089 1.00 . A A . 16 LYS C 1 1 2 1007 1 1 19 LYS CA C -0.906 4.681 0.967 1.00 . A A . 16 LYS CA 1 1 2 1008 1 1 19 LYS CB C -1.651 5.956 0.552 1.00 . A A . 16 LYS CB 1 1 2 1009 1 1 19 LYS CD C -2.200 7.607 -1.271 1.00 . A A . 16 LYS CD 1 1 2 1010 1 1 19 LYS CE C -1.991 8.841 -0.405 1.00 . A A . 16 LYS CE 1 1 2 1011 1 1 19 LYS CG C -1.302 6.453 -0.848 1.00 . A A . 16 LYS CG 1 1 2 1012 1 1 19 LYS H H -0.825 4.295 3.037 1.00 . A A . 16 LYS H 1 1 2 1013 1 1 19 LYS HA H -1.065 3.912 0.224 1.00 . A A . 16 LYS HA 1 1 2 1014 1 1 19 LYS HB2 H -2.713 5.764 0.584 1.00 . A A . 16 LYS HB2 1 1 2 1015 1 1 19 LYS HB3 H -1.417 6.739 1.256 1.00 . A A . 16 LYS HB3 1 1 2 1016 1 1 19 LYS HD2 H -1.983 7.859 -2.298 1.00 . A A . 16 LYS HD2 1 1 2 1017 1 1 19 LYS HD3 H -3.230 7.293 -1.189 1.00 . A A . 16 LYS HD3 1 1 2 1018 1 1 19 LYS HE2 H -2.738 9.574 -0.665 1.00 . A A . 16 LYS HE2 1 1 2 1019 1 1 19 LYS HE3 H -2.105 8.561 0.631 1.00 . A A . 16 LYS HE3 1 1 2 1020 1 1 19 LYS HG2 H -0.273 6.789 -0.861 1.00 . A A . 16 LYS HG2 1 1 2 1021 1 1 19 LYS HG3 H -1.424 5.639 -1.547 1.00 . A A . 16 LYS HG3 1 1 2 1022 1 1 19 LYS HZ1 H -0.540 10.282 0.006 1.00 . A A . 16 LYS HZ1 1 1 2 1023 1 1 19 LYS HZ2 H -0.517 9.730 -1.588 1.00 . A A . 16 LYS HZ2 1 1 2 1024 1 1 19 LYS HZ3 H 0.097 8.759 -0.348 1.00 . A A . 16 LYS HZ3 1 1 2 1025 1 1 19 LYS N N -1.392 4.183 2.242 1.00 . A A . 16 LYS N 1 1 2 1026 1 1 19 LYS NZ N -0.645 9.442 -0.597 1.00 . A A . 16 LYS NZ 1 1 2 1027 1 1 19 LYS O O 0.985 6.010 1.574 1.00 . A A . 16 LYS O 1 1 2 1028 1 1 20 CYS C C 3.360 5.413 0.292 1.00 . A A . 17 CYS C 1 1 2 1029 1 1 20 CYS CA C 2.849 4.066 0.798 1.00 . A A . 17 CYS CA 1 1 2 1030 1 1 20 CYS CB C 3.532 2.934 0.018 1.00 . A A . 17 CYS CB 1 1 2 1031 1 1 20 CYS H H 0.997 3.165 0.289 1.00 . A A . 17 CYS H 1 1 2 1032 1 1 20 CYS HA H 3.099 3.970 1.843 1.00 . A A . 17 CYS HA 1 1 2 1033 1 1 20 CYS HB2 H 3.227 1.987 0.432 1.00 . A A . 17 CYS HB2 1 1 2 1034 1 1 20 CYS HB3 H 3.235 2.986 -1.018 1.00 . A A . 17 CYS HB3 1 1 2 1035 1 1 20 CYS N N 1.393 3.974 0.679 1.00 . A A . 17 CYS N 1 1 2 1036 1 1 20 CYS O O 3.064 5.809 -0.830 1.00 . A A . 17 CYS O 1 1 2 1037 1 1 20 CYS SG S 5.338 3.018 0.084 1.00 . A A . 17 CYS SG 1 1 2 1038 1 1 21 PRO C C 5.571 7.423 -0.450 1.00 . A A . 18 PRO C 1 1 2 1039 1 1 21 PRO CA C 4.668 7.452 0.777 1.00 . A A . 18 PRO CA 1 1 2 1040 1 1 21 PRO CB C 5.466 7.873 2.018 1.00 . A A . 18 PRO CB 1 1 2 1041 1 1 21 PRO CD C 4.572 5.698 2.462 1.00 . A A . 18 PRO CD 1 1 2 1042 1 1 21 PRO CG C 5.713 6.624 2.780 1.00 . A A . 18 PRO CG 1 1 2 1043 1 1 21 PRO HA H 3.867 8.155 0.610 1.00 . A A . 18 PRO HA 1 1 2 1044 1 1 21 PRO HB2 H 6.400 8.318 1.707 1.00 . A A . 18 PRO HB2 1 1 2 1045 1 1 21 PRO HB3 H 4.896 8.584 2.595 1.00 . A A . 18 PRO HB3 1 1 2 1046 1 1 21 PRO HD2 H 4.911 4.672 2.451 1.00 . A A . 18 PRO HD2 1 1 2 1047 1 1 21 PRO HD3 H 3.773 5.825 3.178 1.00 . A A . 18 PRO HD3 1 1 2 1048 1 1 21 PRO HG2 H 6.653 6.193 2.463 1.00 . A A . 18 PRO HG2 1 1 2 1049 1 1 21 PRO HG3 H 5.737 6.840 3.838 1.00 . A A . 18 PRO HG3 1 1 2 1050 1 1 21 PRO N N 4.145 6.125 1.120 1.00 . A A . 18 PRO N 1 1 2 1051 1 1 21 PRO O O 5.826 8.454 -1.073 1.00 . A A . 18 PRO O 1 1 2 1052 1 1 22 ARG C C 6.117 5.566 -3.146 1.00 . A A . 19 ARG C 1 1 2 1053 1 1 22 ARG CA C 6.911 6.083 -1.959 1.00 . A A . 19 ARG CA 1 1 2 1054 1 1 22 ARG CB C 8.056 5.116 -1.670 1.00 . A A . 19 ARG CB 1 1 2 1055 1 1 22 ARG CD C 10.338 4.886 -0.674 1.00 . A A . 19 ARG CD 1 1 2 1056 1 1 22 ARG CG C 8.990 5.574 -0.570 1.00 . A A . 19 ARG CG 1 1 2 1057 1 1 22 ARG CZ C 12.154 4.610 -2.322 1.00 . A A . 19 ARG CZ 1 1 2 1058 1 1 22 ARG H H 5.836 5.458 -0.247 1.00 . A A . 19 ARG H 1 1 2 1059 1 1 22 ARG HA H 7.321 7.050 -2.205 1.00 . A A . 19 ARG HA 1 1 2 1060 1 1 22 ARG HB2 H 7.639 4.162 -1.380 1.00 . A A . 19 ARG HB2 1 1 2 1061 1 1 22 ARG HB3 H 8.633 4.982 -2.573 1.00 . A A . 19 ARG HB3 1 1 2 1062 1 1 22 ARG HD2 H 10.967 5.232 0.132 1.00 . A A . 19 ARG HD2 1 1 2 1063 1 1 22 ARG HD3 H 10.192 3.819 -0.583 1.00 . A A . 19 ARG HD3 1 1 2 1064 1 1 22 ARG HE H 10.568 5.812 -2.550 1.00 . A A . 19 ARG HE 1 1 2 1065 1 1 22 ARG HG2 H 9.131 6.642 -0.647 1.00 . A A . 19 ARG HG2 1 1 2 1066 1 1 22 ARG HG3 H 8.547 5.331 0.389 1.00 . A A . 19 ARG HG3 1 1 2 1067 1 1 22 ARG HH11 H 12.366 3.498 -0.638 1.00 . A A . 19 ARG HH11 1 1 2 1068 1 1 22 ARG HH12 H 13.632 3.316 -1.808 1.00 . A A . 19 ARG HH12 1 1 2 1069 1 1 22 ARG HH21 H 12.225 5.578 -4.101 1.00 . A A . 19 ARG HH21 1 1 2 1070 1 1 22 ARG HH22 H 13.552 4.507 -3.785 1.00 . A A . 19 ARG HH22 1 1 2 1071 1 1 22 ARG N N 6.058 6.240 -0.793 1.00 . A A . 19 ARG N 1 1 2 1072 1 1 22 ARG NE N 11.005 5.168 -1.944 1.00 . A A . 19 ARG NE 1 1 2 1073 1 1 22 ARG NH1 N 12.768 3.738 -1.526 1.00 . A A . 19 ARG NH1 1 1 2 1074 1 1 22 ARG NH2 N 12.687 4.923 -3.496 1.00 . A A . 19 ARG NH2 1 1 2 1075 1 1 22 ARG O O 6.113 6.165 -4.217 1.00 . A A . 19 ARG O 1 1 2 1076 1 1 23 CYS C C 3.417 4.369 -4.358 1.00 . A A . 20 CYS C 1 1 2 1077 1 1 23 CYS CA C 4.773 3.757 -4.032 1.00 . A A . 20 CYS CA 1 1 2 1078 1 1 23 CYS CB C 4.604 2.280 -3.678 1.00 . A A . 20 CYS CB 1 1 2 1079 1 1 23 CYS H H 5.370 4.095 -2.034 1.00 . A A . 20 CYS H 1 1 2 1080 1 1 23 CYS HA H 5.402 3.841 -4.899 1.00 . A A . 20 CYS HA 1 1 2 1081 1 1 23 CYS HB2 H 3.945 2.194 -2.829 1.00 . A A . 20 CYS HB2 1 1 2 1082 1 1 23 CYS HB3 H 4.169 1.766 -4.519 1.00 . A A . 20 CYS HB3 1 1 2 1083 1 1 23 CYS N N 5.432 4.453 -2.940 1.00 . A A . 20 CYS N 1 1 2 1084 1 1 23 CYS O O 2.891 4.198 -5.459 1.00 . A A . 20 CYS O 1 1 2 1085 1 1 23 CYS SG S 6.147 1.441 -3.257 1.00 . A A . 20 CYS SG 1 1 2 1086 1 1 24 LEU C C 0.459 4.667 -3.683 1.00 . A A . 21 LEU C 1 1 2 1087 1 1 24 LEU CA C 1.548 5.709 -3.484 1.00 . A A . 21 LEU CA 1 1 2 1088 1 1 24 LEU CB C 1.513 6.748 -4.607 1.00 . A A . 21 LEU CB 1 1 2 1089 1 1 24 LEU CD1 C 2.217 9.018 -5.380 1.00 . A A . 21 LEU CD1 1 1 2 1090 1 1 24 LEU CD2 C 2.851 8.245 -3.092 1.00 . A A . 21 LEU CD2 1 1 2 1091 1 1 24 LEU CG C 2.599 7.824 -4.532 1.00 . A A . 21 LEU CG 1 1 2 1092 1 1 24 LEU H H 3.368 5.199 -2.546 1.00 . A A . 21 LEU H 1 1 2 1093 1 1 24 LEU HA H 1.362 6.213 -2.546 1.00 . A A . 21 LEU HA 1 1 2 1094 1 1 24 LEU HB2 H 1.613 6.231 -5.551 1.00 . A A . 21 LEU HB2 1 1 2 1095 1 1 24 LEU HB3 H 0.552 7.238 -4.584 1.00 . A A . 21 LEU HB3 1 1 2 1096 1 1 24 LEU HD11 H 2.999 9.760 -5.332 1.00 . A A . 21 LEU HD11 1 1 2 1097 1 1 24 LEU HD12 H 1.296 9.440 -5.003 1.00 . A A . 21 LEU HD12 1 1 2 1098 1 1 24 LEU HD13 H 2.078 8.705 -6.403 1.00 . A A . 21 LEU HD13 1 1 2 1099 1 1 24 LEU HD21 H 3.549 9.068 -3.075 1.00 . A A . 21 LEU HD21 1 1 2 1100 1 1 24 LEU HD22 H 3.267 7.410 -2.546 1.00 . A A . 21 LEU HD22 1 1 2 1101 1 1 24 LEU HD23 H 1.919 8.549 -2.636 1.00 . A A . 21 LEU HD23 1 1 2 1102 1 1 24 LEU HG H 3.521 7.420 -4.927 1.00 . A A . 21 LEU HG 1 1 2 1103 1 1 24 LEU N N 2.864 5.078 -3.380 1.00 . A A . 21 LEU N 1 1 2 1104 1 1 24 LEU O O -0.666 4.988 -4.065 1.00 . A A . 21 LEU O 1 1 2 1105 1 1 25 VAL C C -1.032 2.309 -2.288 1.00 . A A . 22 VAL C 1 1 2 1106 1 1 25 VAL CA C -0.137 2.332 -3.515 1.00 . A A . 22 VAL CA 1 1 2 1107 1 1 25 VAL CB C 0.574 0.966 -3.705 1.00 . A A . 22 VAL CB 1 1 2 1108 1 1 25 VAL CG1 C 1.465 0.622 -2.521 1.00 . A A . 22 VAL CG1 1 1 2 1109 1 1 25 VAL CG2 C -0.440 -0.139 -3.951 1.00 . A A . 22 VAL CG2 1 1 2 1110 1 1 25 VAL H H 1.707 3.231 -3.110 1.00 . A A . 22 VAL H 1 1 2 1111 1 1 25 VAL HA H -0.750 2.517 -4.386 1.00 . A A . 22 VAL HA 1 1 2 1112 1 1 25 VAL HB H 1.202 1.039 -4.579 1.00 . A A . 22 VAL HB 1 1 2 1113 1 1 25 VAL HG11 H 1.976 -0.310 -2.715 1.00 . A A . 22 VAL HG11 1 1 2 1114 1 1 25 VAL HG12 H 0.858 0.520 -1.633 1.00 . A A . 22 VAL HG12 1 1 2 1115 1 1 25 VAL HG13 H 2.189 1.408 -2.374 1.00 . A A . 22 VAL HG13 1 1 2 1116 1 1 25 VAL HG21 H -0.978 0.065 -4.864 1.00 . A A . 22 VAL HG21 1 1 2 1117 1 1 25 VAL HG22 H -1.136 -0.181 -3.124 1.00 . A A . 22 VAL HG22 1 1 2 1118 1 1 25 VAL HG23 H 0.073 -1.086 -4.038 1.00 . A A . 22 VAL HG23 1 1 2 1119 1 1 25 VAL N N 0.802 3.418 -3.404 1.00 . A A . 22 VAL N 1 1 2 1120 1 1 25 VAL O O -0.561 2.261 -1.147 1.00 . A A . 22 VAL O 1 1 2 1121 1 1 26 GLN C C -3.537 0.969 -0.996 1.00 . A A . 23 GLN C 1 1 2 1122 1 1 26 GLN CA C -3.309 2.393 -1.479 1.00 . A A . 23 GLN CA 1 1 2 1123 1 1 26 GLN CB C -4.606 3.016 -1.990 1.00 . A A . 23 GLN CB 1 1 2 1124 1 1 26 GLN CD C -5.661 5.014 -3.129 1.00 . A A . 23 GLN CD 1 1 2 1125 1 1 26 GLN CG C -4.449 4.473 -2.397 1.00 . A A . 23 GLN CG 1 1 2 1126 1 1 26 GLN H H -2.612 2.494 -3.467 1.00 . A A . 23 GLN H 1 1 2 1127 1 1 26 GLN HA H -2.930 2.984 -0.655 1.00 . A A . 23 GLN HA 1 1 2 1128 1 1 26 GLN HB2 H -4.947 2.456 -2.847 1.00 . A A . 23 GLN HB2 1 1 2 1129 1 1 26 GLN HB3 H -5.352 2.959 -1.212 1.00 . A A . 23 GLN HB3 1 1 2 1130 1 1 26 GLN HE21 H -6.487 5.576 -1.415 1.00 . A A . 23 GLN HE21 1 1 2 1131 1 1 26 GLN HE22 H -7.405 5.916 -2.839 1.00 . A A . 23 GLN HE22 1 1 2 1132 1 1 26 GLN HG2 H -4.292 5.066 -1.508 1.00 . A A . 23 GLN HG2 1 1 2 1133 1 1 26 GLN HG3 H -3.587 4.561 -3.042 1.00 . A A . 23 GLN HG3 1 1 2 1134 1 1 26 GLN N N -2.317 2.407 -2.536 1.00 . A A . 23 GLN N 1 1 2 1135 1 1 26 GLN NE2 N -6.613 5.556 -2.386 1.00 . A A . 23 GLN NE2 1 1 2 1136 1 1 26 GLN O O -4.335 0.223 -1.561 1.00 . A A . 23 GLN O 1 1 2 1137 1 1 26 GLN OE1 O -5.738 4.949 -4.353 1.00 . A A . 23 GLN OE1 1 1 2 1138 1 1 27 THR C C -4.005 -0.840 1.616 1.00 . A A . 24 THR C 1 1 2 1139 1 1 27 THR CA C -2.884 -0.744 0.590 1.00 . A A . 24 THR CA 1 1 2 1140 1 1 27 THR CB C -1.548 -1.132 1.246 1.00 . A A . 24 THR CB 1 1 2 1141 1 1 27 THR CG2 C -0.508 -1.479 0.199 1.00 . A A . 24 THR CG2 1 1 2 1142 1 1 27 THR H H -2.192 1.239 0.442 1.00 . A A . 24 THR H 1 1 2 1143 1 1 27 THR HA H -3.083 -1.434 -0.217 1.00 . A A . 24 THR HA 1 1 2 1144 1 1 27 THR HB H -1.709 -1.997 1.874 1.00 . A A . 24 THR HB 1 1 2 1145 1 1 27 THR HG1 H -0.336 -0.363 2.602 1.00 . A A . 24 THR HG1 1 1 2 1146 1 1 27 THR HG21 H -0.375 -0.641 -0.469 1.00 . A A . 24 THR HG21 1 1 2 1147 1 1 27 THR HG22 H -0.838 -2.341 -0.361 1.00 . A A . 24 THR HG22 1 1 2 1148 1 1 27 THR HG23 H 0.430 -1.704 0.686 1.00 . A A . 24 THR HG23 1 1 2 1149 1 1 27 THR N N -2.806 0.592 0.034 1.00 . A A . 24 THR N 1 1 2 1150 1 1 27 THR O O -4.390 0.153 2.228 1.00 . A A . 24 THR O 1 1 2 1151 1 1 27 THR OG1 O -1.073 -0.054 2.049 1.00 . A A . 24 THR OG1 1 1 2 1152 1 1 28 CYS C C -5.071 -2.288 4.153 1.00 . A A . 25 CYS C 1 1 2 1153 1 1 28 CYS CA C -5.613 -2.276 2.736 1.00 . A A . 25 CYS CA 1 1 2 1154 1 1 28 CYS CB C -6.312 -3.609 2.453 1.00 . A A . 25 CYS CB 1 1 2 1155 1 1 28 CYS H H -4.181 -2.792 1.271 1.00 . A A . 25 CYS H 1 1 2 1156 1 1 28 CYS HA H -6.326 -1.472 2.637 1.00 . A A . 25 CYS HA 1 1 2 1157 1 1 28 CYS HB2 H -7.111 -3.747 3.169 1.00 . A A . 25 CYS HB2 1 1 2 1158 1 1 28 CYS HB3 H -6.731 -3.598 1.461 1.00 . A A . 25 CYS HB3 1 1 2 1159 1 1 28 CYS N N -4.532 -2.044 1.789 1.00 . A A . 25 CYS N 1 1 2 1160 1 1 28 CYS O O -5.750 -1.896 5.097 1.00 . A A . 25 CYS O 1 1 2 1161 1 1 28 CYS SG S -5.222 -5.045 2.578 1.00 . A A . 25 CYS SG 1 1 2 1162 1 1 29 SER C C -1.705 -2.960 5.452 1.00 . A A . 26 SER C 1 1 2 1163 1 1 29 SER CA C -3.219 -2.892 5.594 1.00 . A A . 26 SER CA 1 1 2 1164 1 1 29 SER CB C -3.747 -4.141 6.309 1.00 . A A . 26 SER CB 1 1 2 1165 1 1 29 SER H H -3.319 -2.987 3.491 1.00 . A A . 26 SER H 1 1 2 1166 1 1 29 SER HA H -3.474 -2.018 6.176 1.00 . A A . 26 SER HA 1 1 2 1167 1 1 29 SER HB2 H -3.502 -5.017 5.726 1.00 . A A . 26 SER HB2 1 1 2 1168 1 1 29 SER HB3 H -3.285 -4.217 7.281 1.00 . A A . 26 SER HB3 1 1 2 1169 1 1 29 SER HG H -5.477 -3.218 6.176 1.00 . A A . 26 SER HG 1 1 2 1170 1 1 29 SER N N -3.836 -2.750 4.292 1.00 . A A . 26 SER N 1 1 2 1171 1 1 29 SER O O -1.188 -3.012 4.329 1.00 . A A . 26 SER O 1 1 2 1172 1 1 29 SER OG O -5.155 -4.083 6.477 1.00 . A A . 26 SER OG 1 1 2 1173 1 1 30 LEU C C 0.987 -4.265 5.917 1.00 . A A . 27 LEU C 1 1 2 1174 1 1 30 LEU CA C 0.455 -2.985 6.566 1.00 . A A . 27 LEU CA 1 1 2 1175 1 1 30 LEU CB C 0.985 -2.837 7.999 1.00 . A A . 27 LEU CB 1 1 2 1176 1 1 30 LEU CD1 C 3.442 -2.582 7.483 1.00 . A A . 27 LEU CD1 1 1 2 1177 1 1 30 LEU CD2 C 1.989 -0.560 7.638 1.00 . A A . 27 LEU CD2 1 1 2 1178 1 1 30 LEU CG C 2.238 -1.963 8.170 1.00 . A A . 27 LEU CG 1 1 2 1179 1 1 30 LEU H H -1.474 -3.008 7.436 1.00 . A A . 27 LEU H 1 1 2 1180 1 1 30 LEU HA H 0.779 -2.140 5.981 1.00 . A A . 27 LEU HA 1 1 2 1181 1 1 30 LEU HB2 H 0.197 -2.415 8.604 1.00 . A A . 27 LEU HB2 1 1 2 1182 1 1 30 LEU HB3 H 1.212 -3.823 8.376 1.00 . A A . 27 LEU HB3 1 1 2 1183 1 1 30 LEU HD11 H 3.650 -3.546 7.922 1.00 . A A . 27 LEU HD11 1 1 2 1184 1 1 30 LEU HD12 H 4.297 -1.937 7.609 1.00 . A A . 27 LEU HD12 1 1 2 1185 1 1 30 LEU HD13 H 3.232 -2.701 6.432 1.00 . A A . 27 LEU HD13 1 1 2 1186 1 1 30 LEU HD21 H 2.855 0.056 7.826 1.00 . A A . 27 LEU HD21 1 1 2 1187 1 1 30 LEU HD22 H 1.129 -0.134 8.134 1.00 . A A . 27 LEU HD22 1 1 2 1188 1 1 30 LEU HD23 H 1.805 -0.605 6.575 1.00 . A A . 27 LEU HD23 1 1 2 1189 1 1 30 LEU HG H 2.465 -1.880 9.223 1.00 . A A . 27 LEU HG 1 1 2 1190 1 1 30 LEU N N -1.002 -2.986 6.574 1.00 . A A . 27 LEU N 1 1 2 1191 1 1 30 LEU O O 2.052 -4.262 5.299 1.00 . A A . 27 LEU O 1 1 2 1192 1 1 31 GLU C C 0.782 -6.495 3.915 1.00 . A A . 28 GLU C 1 1 2 1193 1 1 31 GLU CA C 0.614 -6.625 5.432 1.00 . A A . 28 GLU CA 1 1 2 1194 1 1 31 GLU CB C -0.418 -7.703 5.763 1.00 . A A . 28 GLU CB 1 1 2 1195 1 1 31 GLU CD C -0.927 -10.166 5.900 1.00 . A A . 28 GLU CD 1 1 2 1196 1 1 31 GLU CG C 0.029 -9.107 5.397 1.00 . A A . 28 GLU CG 1 1 2 1197 1 1 31 GLU H H -0.615 -5.294 6.535 1.00 . A A . 28 GLU H 1 1 2 1198 1 1 31 GLU HA H 1.564 -6.907 5.861 1.00 . A A . 28 GLU HA 1 1 2 1199 1 1 31 GLU HB2 H -0.618 -7.677 6.823 1.00 . A A . 28 GLU HB2 1 1 2 1200 1 1 31 GLU HB3 H -1.330 -7.486 5.228 1.00 . A A . 28 GLU HB3 1 1 2 1201 1 1 31 GLU HG2 H 0.093 -9.183 4.321 1.00 . A A . 28 GLU HG2 1 1 2 1202 1 1 31 GLU HG3 H 1.003 -9.287 5.829 1.00 . A A . 28 GLU HG3 1 1 2 1203 1 1 31 GLU N N 0.223 -5.349 6.027 1.00 . A A . 28 GLU N 1 1 2 1204 1 1 31 GLU O O 1.607 -7.179 3.311 1.00 . A A . 28 GLU O 1 1 2 1205 1 1 31 GLU OE1 O -0.948 -10.417 7.125 1.00 . A A . 28 GLU OE1 1 1 2 1206 1 1 31 GLU OE2 O -1.663 -10.750 5.079 1.00 . A A . 28 GLU OE2 1 1 2 1207 1 1 32 CYS C C 1.171 -4.253 1.624 1.00 . A A . 29 CYS C 1 1 2 1208 1 1 32 CYS CA C 0.138 -5.342 1.883 1.00 . A A . 29 CYS CA 1 1 2 1209 1 1 32 CYS CB C -1.207 -4.956 1.281 1.00 . A A . 29 CYS CB 1 1 2 1210 1 1 32 CYS H H -0.653 -5.104 3.828 1.00 . A A . 29 CYS H 1 1 2 1211 1 1 32 CYS HA H 0.476 -6.253 1.418 1.00 . A A . 29 CYS HA 1 1 2 1212 1 1 32 CYS HB2 H -1.773 -4.403 2.016 1.00 . A A . 29 CYS HB2 1 1 2 1213 1 1 32 CYS HB3 H -1.042 -4.328 0.420 1.00 . A A . 29 CYS HB3 1 1 2 1214 1 1 32 CYS N N 0.010 -5.603 3.307 1.00 . A A . 29 CYS N 1 1 2 1215 1 1 32 CYS O O 1.795 -4.218 0.566 1.00 . A A . 29 CYS O 1 1 2 1216 1 1 32 CYS SG S -2.221 -6.357 0.757 1.00 . A A . 29 CYS SG 1 1 2 1217 1 1 33 SER C C 3.764 -3.000 2.485 1.00 . A A . 30 SER C 1 1 2 1218 1 1 33 SER CA C 2.386 -2.346 2.494 1.00 . A A . 30 SER CA 1 1 2 1219 1 1 33 SER CB C 2.276 -1.351 3.651 1.00 . A A . 30 SER CB 1 1 2 1220 1 1 33 SER H H 0.777 -3.390 3.385 1.00 . A A . 30 SER H 1 1 2 1221 1 1 33 SER HA H 2.247 -1.820 1.561 1.00 . A A . 30 SER HA 1 1 2 1222 1 1 33 SER HB2 H 2.381 -1.878 4.587 1.00 . A A . 30 SER HB2 1 1 2 1223 1 1 33 SER HB3 H 3.059 -0.613 3.565 1.00 . A A . 30 SER HB3 1 1 2 1224 1 1 33 SER HG H 1.153 0.246 3.854 1.00 . A A . 30 SER HG 1 1 2 1225 1 1 33 SER N N 1.353 -3.365 2.592 1.00 . A A . 30 SER N 1 1 2 1226 1 1 33 SER O O 4.668 -2.553 1.793 1.00 . A A . 30 SER O 1 1 2 1227 1 1 33 SER OG O 1.021 -0.689 3.639 1.00 . A A . 30 SER OG 1 1 2 1228 1 1 34 LYS C C 5.248 -5.812 2.138 1.00 . A A . 31 LYS C 1 1 2 1229 1 1 34 LYS CA C 5.169 -4.808 3.286 1.00 . A A . 31 LYS CA 1 1 2 1230 1 1 34 LYS CB C 5.333 -5.526 4.628 1.00 . A A . 31 LYS CB 1 1 2 1231 1 1 34 LYS CD C 4.621 -7.411 6.142 1.00 . A A . 31 LYS CD 1 1 2 1232 1 1 34 LYS CE C 5.974 -8.107 6.122 1.00 . A A . 31 LYS CE 1 1 2 1233 1 1 34 LYS CG C 4.353 -6.666 4.842 1.00 . A A . 31 LYS CG 1 1 2 1234 1 1 34 LYS H H 3.160 -4.379 3.805 1.00 . A A . 31 LYS H 1 1 2 1235 1 1 34 LYS HA H 5.967 -4.091 3.173 1.00 . A A . 31 LYS HA 1 1 2 1236 1 1 34 LYS HB2 H 6.334 -5.922 4.690 1.00 . A A . 31 LYS HB2 1 1 2 1237 1 1 34 LYS HB3 H 5.190 -4.806 5.421 1.00 . A A . 31 LYS HB3 1 1 2 1238 1 1 34 LYS HD2 H 4.603 -6.706 6.957 1.00 . A A . 31 LYS HD2 1 1 2 1239 1 1 34 LYS HD3 H 3.848 -8.151 6.288 1.00 . A A . 31 LYS HD3 1 1 2 1240 1 1 34 LYS HE2 H 5.981 -8.827 5.320 1.00 . A A . 31 LYS HE2 1 1 2 1241 1 1 34 LYS HE3 H 6.742 -7.368 5.949 1.00 . A A . 31 LYS HE3 1 1 2 1242 1 1 34 LYS HG2 H 3.351 -6.265 4.870 1.00 . A A . 31 LYS HG2 1 1 2 1243 1 1 34 LYS HG3 H 4.441 -7.358 4.017 1.00 . A A . 31 LYS HG3 1 1 2 1244 1 1 34 LYS HZ1 H 7.183 -9.286 7.347 1.00 . A A . 31 LYS HZ1 1 1 2 1245 1 1 34 LYS HZ2 H 5.527 -9.518 7.594 1.00 . A A . 31 LYS HZ2 1 1 2 1246 1 1 34 LYS HZ3 H 6.281 -8.126 8.186 1.00 . A A . 31 LYS HZ3 1 1 2 1247 1 1 34 LYS N N 3.911 -4.077 3.246 1.00 . A A . 31 LYS N 1 1 2 1248 1 1 34 LYS NZ N 6.260 -8.809 7.401 1.00 . A A . 31 LYS NZ 1 1 2 1249 1 1 34 LYS O O 6.307 -6.380 1.867 1.00 . A A . 31 LYS O 1 1 2 1250 1 1 35 LYS C C 4.852 -6.492 -0.836 1.00 . A A . 32 LYS C 1 1 2 1251 1 1 35 LYS CA C 4.048 -6.977 0.366 1.00 . A A . 32 LYS CA 1 1 2 1252 1 1 35 LYS CB C 2.588 -7.191 -0.041 1.00 . A A . 32 LYS CB 1 1 2 1253 1 1 35 LYS CD C 2.373 -9.690 0.004 1.00 . A A . 32 LYS CD 1 1 2 1254 1 1 35 LYS CE C 1.831 -10.910 -0.723 1.00 . A A . 32 LYS CE 1 1 2 1255 1 1 35 LYS CG C 2.339 -8.446 -0.866 1.00 . A A . 32 LYS CG 1 1 2 1256 1 1 35 LYS H H 3.330 -5.492 1.689 1.00 . A A . 32 LYS H 1 1 2 1257 1 1 35 LYS HA H 4.461 -7.912 0.714 1.00 . A A . 32 LYS HA 1 1 2 1258 1 1 35 LYS HB2 H 1.989 -7.258 0.853 1.00 . A A . 32 LYS HB2 1 1 2 1259 1 1 35 LYS HB3 H 2.260 -6.338 -0.616 1.00 . A A . 32 LYS HB3 1 1 2 1260 1 1 35 LYS HD2 H 3.393 -9.884 0.297 1.00 . A A . 32 LYS HD2 1 1 2 1261 1 1 35 LYS HD3 H 1.772 -9.513 0.885 1.00 . A A . 32 LYS HD3 1 1 2 1262 1 1 35 LYS HE2 H 1.833 -11.747 -0.042 1.00 . A A . 32 LYS HE2 1 1 2 1263 1 1 35 LYS HE3 H 0.816 -10.705 -1.033 1.00 . A A . 32 LYS HE3 1 1 2 1264 1 1 35 LYS HG2 H 1.370 -8.372 -1.338 1.00 . A A . 32 LYS HG2 1 1 2 1265 1 1 35 LYS HG3 H 3.107 -8.524 -1.622 1.00 . A A . 32 LYS HG3 1 1 2 1266 1 1 35 LYS HZ1 H 2.617 -10.490 -2.611 1.00 . A A . 32 LYS HZ1 1 1 2 1267 1 1 35 LYS HZ2 H 2.255 -12.122 -2.365 1.00 . A A . 32 LYS HZ2 1 1 2 1268 1 1 35 LYS HZ3 H 3.626 -11.443 -1.646 1.00 . A A . 32 LYS HZ3 1 1 2 1269 1 1 35 LYS N N 4.127 -6.011 1.455 1.00 . A A . 32 LYS N 1 1 2 1270 1 1 35 LYS NZ N 2.638 -11.264 -1.919 1.00 . A A . 32 LYS NZ 1 1 2 1271 1 1 35 LYS O O 5.554 -7.269 -1.482 1.00 . A A . 32 LYS O 1 1 2 1272 1 1 36 HIS C C 6.937 -4.421 -1.977 1.00 . A A . 33 HIS C 1 1 2 1273 1 1 36 HIS CA C 5.451 -4.626 -2.274 1.00 . A A . 33 HIS CA 1 1 2 1274 1 1 36 HIS CB C 4.800 -3.296 -2.714 1.00 . A A . 33 HIS CB 1 1 2 1275 1 1 36 HIS CD2 C 6.013 -1.602 -1.160 1.00 . A A . 33 HIS CD2 1 1 2 1276 1 1 36 HIS CE1 C 4.323 -0.470 -0.452 1.00 . A A . 33 HIS CE1 1 1 2 1277 1 1 36 HIS CG C 4.916 -2.158 -1.730 1.00 . A A . 33 HIS CG 1 1 2 1278 1 1 36 HIS H H 4.195 -4.617 -0.563 1.00 . A A . 33 HIS H 1 1 2 1279 1 1 36 HIS HA H 5.364 -5.334 -3.085 1.00 . A A . 33 HIS HA 1 1 2 1280 1 1 36 HIS HB2 H 5.260 -2.974 -3.634 1.00 . A A . 33 HIS HB2 1 1 2 1281 1 1 36 HIS HB3 H 3.748 -3.470 -2.893 1.00 . A A . 33 HIS HB3 1 1 2 1282 1 1 36 HIS HD1 H 2.902 -1.591 -1.478 1.00 . A A . 33 HIS HD1 1 1 2 1283 1 1 36 HIS HD2 H 7.028 -1.937 -1.299 1.00 . A A . 33 HIS HD2 1 1 2 1284 1 1 36 HIS HE1 H 3.705 0.222 0.093 1.00 . A A . 33 HIS HE1 1 1 2 1285 1 1 36 HIS N N 4.755 -5.198 -1.126 1.00 . A A . 33 HIS N 1 1 2 1286 1 1 36 HIS ND1 N 3.847 -1.430 -1.263 1.00 . A A . 33 HIS ND1 1 1 2 1287 1 1 36 HIS NE2 N 5.642 -0.523 -0.359 1.00 . A A . 33 HIS NE2 1 1 2 1288 1 1 36 HIS O O 7.746 -4.254 -2.887 1.00 . A A . 33 HIS O 1 1 2 1289 1 1 37 LYS C C 9.659 -5.169 -0.694 1.00 . A A . 34 LYS C 1 1 2 1290 1 1 37 LYS CA C 8.644 -4.115 -0.276 1.00 . A A . 34 LYS CA 1 1 2 1291 1 1 37 LYS CB C 8.686 -3.915 1.239 1.00 . A A . 34 LYS CB 1 1 2 1292 1 1 37 LYS CD C 7.935 -2.551 3.216 1.00 . A A . 34 LYS CD 1 1 2 1293 1 1 37 LYS CE C 6.928 -1.529 3.722 1.00 . A A . 34 LYS CE 1 1 2 1294 1 1 37 LYS CG C 7.771 -2.803 1.727 1.00 . A A . 34 LYS CG 1 1 2 1295 1 1 37 LYS H H 6.652 -4.784 -0.033 1.00 . A A . 34 LYS H 1 1 2 1296 1 1 37 LYS HA H 8.900 -3.182 -0.757 1.00 . A A . 34 LYS HA 1 1 2 1297 1 1 37 LYS HB2 H 8.388 -4.835 1.721 1.00 . A A . 34 LYS HB2 1 1 2 1298 1 1 37 LYS HB3 H 9.696 -3.675 1.532 1.00 . A A . 34 LYS HB3 1 1 2 1299 1 1 37 LYS HD2 H 7.791 -3.479 3.749 1.00 . A A . 34 LYS HD2 1 1 2 1300 1 1 37 LYS HD3 H 8.933 -2.180 3.399 1.00 . A A . 34 LYS HD3 1 1 2 1301 1 1 37 LYS HE2 H 7.039 -0.619 3.150 1.00 . A A . 34 LYS HE2 1 1 2 1302 1 1 37 LYS HE3 H 5.931 -1.920 3.577 1.00 . A A . 34 LYS HE3 1 1 2 1303 1 1 37 LYS HG2 H 8.009 -1.895 1.193 1.00 . A A . 34 LYS HG2 1 1 2 1304 1 1 37 LYS HG3 H 6.746 -3.081 1.528 1.00 . A A . 34 LYS HG3 1 1 2 1305 1 1 37 LYS HZ1 H 8.051 -0.765 5.308 1.00 . A A . 34 LYS HZ1 1 1 2 1306 1 1 37 LYS HZ2 H 7.101 -2.099 5.723 1.00 . A A . 34 LYS HZ2 1 1 2 1307 1 1 37 LYS HZ3 H 6.381 -0.588 5.505 1.00 . A A . 34 LYS HZ3 1 1 2 1308 1 1 37 LYS N N 7.298 -4.476 -0.703 1.00 . A A . 34 LYS N 1 1 2 1309 1 1 37 LYS NZ N 7.128 -1.224 5.164 1.00 . A A . 34 LYS NZ 1 1 2 1310 1 1 37 LYS O O 10.853 -4.891 -0.783 1.00 . A A . 34 LYS O 1 1 2 1311 1 1 38 THR C C 10.128 -7.672 -2.827 1.00 . A A . 35 THR C 1 1 2 1312 1 1 38 THR CA C 10.041 -7.476 -1.313 1.00 . A A . 35 THR CA 1 1 2 1313 1 1 38 THR CB C 9.543 -8.772 -0.640 1.00 . A A . 35 THR CB 1 1 2 1314 1 1 38 THR CG2 C 8.223 -9.231 -1.244 1.00 . A A . 35 THR CG2 1 1 2 1315 1 1 38 THR H H 8.203 -6.504 -0.951 1.00 . A A . 35 THR H 1 1 2 1316 1 1 38 THR HA H 11.027 -7.254 -0.932 1.00 . A A . 35 THR HA 1 1 2 1317 1 1 38 THR HB H 9.382 -8.565 0.407 1.00 . A A . 35 THR HB 1 1 2 1318 1 1 38 THR HG1 H 10.992 -9.703 -1.612 1.00 . A A . 35 THR HG1 1 1 2 1319 1 1 38 THR HG21 H 7.908 -10.147 -0.765 1.00 . A A . 35 THR HG21 1 1 2 1320 1 1 38 THR HG22 H 8.351 -9.403 -2.302 1.00 . A A . 35 THR HG22 1 1 2 1321 1 1 38 THR HG23 H 7.471 -8.470 -1.091 1.00 . A A . 35 THR HG23 1 1 2 1322 1 1 38 THR N N 9.173 -6.364 -0.976 1.00 . A A . 35 THR N 1 1 2 1323 1 1 38 THR O O 10.745 -8.623 -3.308 1.00 . A A . 35 THR O 1 1 2 1324 1 1 38 THR OG1 O 10.519 -9.813 -0.773 1.00 . A A . 35 THR OG1 1 1 2 1325 1 1 39 ARG C C 9.796 -5.527 -5.697 1.00 . A A . 36 ARG C 1 1 2 1326 1 1 39 ARG CA C 9.514 -6.874 -5.035 1.00 . A A . 36 ARG CA 1 1 2 1327 1 1 39 ARG CB C 8.184 -7.453 -5.528 1.00 . A A . 36 ARG CB 1 1 2 1328 1 1 39 ARG CD C 5.674 -7.401 -5.460 1.00 . A A . 36 ARG CD 1 1 2 1329 1 1 39 ARG CG C 6.958 -6.736 -4.988 1.00 . A A . 36 ARG CG 1 1 2 1330 1 1 39 ARG CZ C 4.801 -9.710 -5.550 1.00 . A A . 36 ARG CZ 1 1 2 1331 1 1 39 ARG H H 9.055 -6.016 -3.149 1.00 . A A . 36 ARG H 1 1 2 1332 1 1 39 ARG HA H 10.307 -7.556 -5.305 1.00 . A A . 36 ARG HA 1 1 2 1333 1 1 39 ARG HB2 H 8.160 -7.396 -6.606 1.00 . A A . 36 ARG HB2 1 1 2 1334 1 1 39 ARG HB3 H 8.127 -8.489 -5.232 1.00 . A A . 36 ARG HB3 1 1 2 1335 1 1 39 ARG HD2 H 4.833 -6.827 -5.103 1.00 . A A . 36 ARG HD2 1 1 2 1336 1 1 39 ARG HD3 H 5.669 -7.414 -6.540 1.00 . A A . 36 ARG HD3 1 1 2 1337 1 1 39 ARG HE H 6.058 -9.011 -4.160 1.00 . A A . 36 ARG HE 1 1 2 1338 1 1 39 ARG HG2 H 6.988 -6.758 -3.908 1.00 . A A . 36 ARG HG2 1 1 2 1339 1 1 39 ARG HG3 H 6.971 -5.712 -5.331 1.00 . A A . 36 ARG HG3 1 1 2 1340 1 1 39 ARG HH11 H 4.132 -8.506 -7.038 1.00 . A A . 36 ARG HH11 1 1 2 1341 1 1 39 ARG HH12 H 3.534 -10.134 -7.077 1.00 . A A . 36 ARG HH12 1 1 2 1342 1 1 39 ARG HH21 H 5.268 -11.148 -4.199 1.00 . A A . 36 ARG HH21 1 1 2 1343 1 1 39 ARG HH22 H 4.192 -11.643 -5.468 1.00 . A A . 36 ARG HH22 1 1 2 1344 1 1 39 ARG N N 9.513 -6.767 -3.580 1.00 . A A . 36 ARG N 1 1 2 1345 1 1 39 ARG NE N 5.552 -8.774 -4.970 1.00 . A A . 36 ARG NE 1 1 2 1346 1 1 39 ARG NH1 N 4.101 -9.427 -6.643 1.00 . A A . 36 ARG NH1 1 1 2 1347 1 1 39 ARG NH2 N 4.747 -10.930 -5.030 1.00 . A A . 36 ARG NH2 1 1 2 1348 1 1 39 ARG O O 10.322 -5.471 -6.810 1.00 . A A . 36 ARG O 1 1 2 1349 1 1 40 ASP C C 10.893 -2.464 -4.821 1.00 . A A . 37 ASP C 1 1 2 1350 1 1 40 ASP CA C 9.714 -3.107 -5.541 1.00 . A A . 37 ASP CA 1 1 2 1351 1 1 40 ASP CB C 8.475 -2.214 -5.409 1.00 . A A . 37 ASP CB 1 1 2 1352 1 1 40 ASP CG C 7.333 -2.653 -6.303 1.00 . A A . 37 ASP CG 1 1 2 1353 1 1 40 ASP H H 8.998 -4.537 -4.152 1.00 . A A . 37 ASP H 1 1 2 1354 1 1 40 ASP HA H 9.962 -3.208 -6.588 1.00 . A A . 37 ASP HA 1 1 2 1355 1 1 40 ASP HB2 H 8.133 -2.236 -4.385 1.00 . A A . 37 ASP HB2 1 1 2 1356 1 1 40 ASP HB3 H 8.743 -1.200 -5.671 1.00 . A A . 37 ASP HB3 1 1 2 1357 1 1 40 ASP N N 9.453 -4.443 -5.017 1.00 . A A . 37 ASP N 1 1 2 1358 1 1 40 ASP O O 11.320 -1.364 -5.173 1.00 . A A . 37 ASP O 1 1 2 1359 1 1 40 ASP OD1 O 7.309 -2.250 -7.485 1.00 . A A . 37 ASP OD1 1 1 2 1360 1 1 40 ASP OD2 O 6.450 -3.402 -5.833 1.00 . A A . 37 ASP OD2 1 1 2 1361 1 1 41 ASN C C 12.115 -1.382 -2.297 1.00 . A A . 38 ASN C 1 1 2 1362 1 1 41 ASN CA C 12.506 -2.693 -2.971 1.00 . A A . 38 ASN CA 1 1 2 1363 1 1 41 ASN CB C 13.801 -2.525 -3.774 1.00 . A A . 38 ASN CB 1 1 2 1364 1 1 41 ASN CG C 14.994 -2.209 -2.894 1.00 . A A . 38 ASN CG 1 1 2 1365 1 1 41 ASN H H 11.056 -4.074 -3.651 1.00 . A A . 38 ASN H 1 1 2 1366 1 1 41 ASN HA H 12.668 -3.434 -2.202 1.00 . A A . 38 ASN HA 1 1 2 1367 1 1 41 ASN HB2 H 14.009 -3.438 -4.306 1.00 . A A . 38 ASN HB2 1 1 2 1368 1 1 41 ASN HB3 H 13.676 -1.720 -4.483 1.00 . A A . 38 ASN HB3 1 1 2 1369 1 1 41 ASN HD21 H 14.774 -0.267 -3.230 1.00 . A A . 38 ASN HD21 1 1 2 1370 1 1 41 ASN HD22 H 16.083 -0.712 -2.194 1.00 . A A . 38 ASN HD22 1 1 2 1371 1 1 41 ASN N N 11.415 -3.179 -3.821 1.00 . A A . 38 ASN N 1 1 2 1372 1 1 41 ASN ND2 N 15.316 -0.937 -2.760 1.00 . A A . 38 ASN ND2 1 1 2 1373 1 1 41 ASN O O 12.433 -0.294 -2.778 1.00 . A A . 38 ASN O 1 1 2 1374 1 1 41 ASN OD1 O 15.634 -3.110 -2.351 1.00 . A A . 38 ASN OD1 1 1 2 1375 1 1 42 CYS C C 10.812 -0.571 0.997 1.00 . A A . 39 CYS C 1 1 2 1376 1 1 42 CYS CA C 10.852 -0.340 -0.511 1.00 . A A . 39 CYS CA 1 1 2 1377 1 1 42 CYS CB C 9.439 -0.108 -1.062 1.00 . A A . 39 CYS CB 1 1 2 1378 1 1 42 CYS H H 11.313 -2.383 -0.770 1.00 . A A . 39 CYS H 1 1 2 1379 1 1 42 CYS HA H 11.468 0.519 -0.727 1.00 . A A . 39 CYS HA 1 1 2 1380 1 1 42 CYS HB2 H 9.497 0.006 -2.134 1.00 . A A . 39 CYS HB2 1 1 2 1381 1 1 42 CYS HB3 H 8.831 -0.972 -0.836 1.00 . A A . 39 CYS HB3 1 1 2 1382 1 1 42 CYS N N 11.427 -1.497 -1.175 1.00 . A A . 39 CYS N 1 1 2 1383 1 1 42 CYS O O 10.815 -1.713 1.452 1.00 . A A . 39 CYS O 1 1 2 1384 1 1 42 CYS SG S 8.588 1.346 -0.409 1.00 . A A . 39 CYS SG 1 1 2 1385 1 1 43 SER C C 9.331 1.048 3.640 1.00 . A A . 40 SER C 1 1 2 1386 1 1 43 SER CA C 10.650 0.412 3.210 1.00 . A A . 40 SER CA 1 1 2 1387 1 1 43 SER CB C 11.821 1.078 3.941 1.00 . A A . 40 SER CB 1 1 2 1388 1 1 43 SER H H 10.955 1.393 1.359 1.00 . A A . 40 SER H 1 1 2 1389 1 1 43 SER HA H 10.626 -0.635 3.468 1.00 . A A . 40 SER HA 1 1 2 1390 1 1 43 SER HB2 H 11.831 2.133 3.716 1.00 . A A . 40 SER HB2 1 1 2 1391 1 1 43 SER HB3 H 11.703 0.938 5.006 1.00 . A A . 40 SER HB3 1 1 2 1392 1 1 43 SER HG H 12.901 -0.360 3.162 1.00 . A A . 40 SER HG 1 1 2 1393 1 1 43 SER N N 10.816 0.511 1.767 1.00 . A A . 40 SER N 1 1 2 1394 1 1 43 SER O O 8.899 0.907 4.783 1.00 . A A . 40 SER O 1 1 2 1395 1 1 43 SER OG O 13.059 0.513 3.543 1.00 . A A . 40 SER OG 1 1 2 1396 1 1 44 GLY C C 7.588 3.601 3.849 1.00 . A A . 41 GLY C 1 1 2 1397 1 1 44 GLY CA C 7.416 2.382 2.970 1.00 . A A . 41 GLY CA 1 1 2 1398 1 1 44 GLY H H 9.061 1.763 1.789 1.00 . A A . 41 GLY H 1 1 2 1399 1 1 44 GLY HA2 H 6.969 2.686 2.035 1.00 . A A . 41 GLY HA2 1 1 2 1400 1 1 44 GLY HA3 H 6.757 1.688 3.461 1.00 . A A . 41 GLY HA3 1 1 2 1401 1 1 44 GLY N N 8.678 1.722 2.692 1.00 . A A . 41 GLY N 1 1 2 1402 1 1 44 GLY O O 6.816 3.822 4.780 1.00 . A A . 41 GLY O 1 1 2 1403 1 1 45 GLN C C 9.551 6.582 3.370 1.00 . A A . 42 GLN C 1 1 2 1404 1 1 45 GLN CA C 8.924 5.575 4.310 1.00 . A A . 42 GLN CA 1 1 2 1405 1 1 45 GLN CB C 9.895 5.205 5.432 1.00 . A A . 42 GLN CB 1 1 2 1406 1 1 45 GLN CD C 11.125 5.940 7.505 1.00 . A A . 42 GLN CD 1 1 2 1407 1 1 45 GLN CG C 10.116 6.319 6.441 1.00 . A A . 42 GLN CG 1 1 2 1408 1 1 45 GLN H H 9.093 4.233 2.709 1.00 . A A . 42 GLN H 1 1 2 1409 1 1 45 GLN HA H 8.016 5.986 4.728 1.00 . A A . 42 GLN HA 1 1 2 1410 1 1 45 GLN HB2 H 9.510 4.343 5.957 1.00 . A A . 42 GLN HB2 1 1 2 1411 1 1 45 GLN HB3 H 10.850 4.951 4.996 1.00 . A A . 42 GLN HB3 1 1 2 1412 1 1 45 GLN HE21 H 12.597 6.675 6.396 1.00 . A A . 42 GLN HE21 1 1 2 1413 1 1 45 GLN HE22 H 13.062 6.001 7.919 1.00 . A A . 42 GLN HE22 1 1 2 1414 1 1 45 GLN HG2 H 10.477 7.192 5.920 1.00 . A A . 42 GLN HG2 1 1 2 1415 1 1 45 GLN HG3 H 9.175 6.546 6.920 1.00 . A A . 42 GLN HG3 1 1 2 1416 1 1 45 GLN N N 8.583 4.406 3.526 1.00 . A A . 42 GLN N 1 1 2 1417 1 1 45 GLN NE2 N 12.387 6.235 7.248 1.00 . A A . 42 GLN NE2 1 1 2 1418 1 1 45 GLN O O 10.149 6.195 2.367 1.00 . A A . 42 GLN O 1 1 2 1419 1 1 45 GLN OE1 O 10.773 5.386 8.546 1.00 . A A . 42 GLN OE1 1 1 2 1420 1 1 46 THR C C 10.490 10.052 3.441 1.00 . A A . 43 THR C 1 1 2 1421 1 1 46 THR CA C 9.869 8.860 2.726 1.00 . A A . 43 THR CA 1 1 2 1422 1 1 46 THR CB C 8.719 9.306 1.805 1.00 . A A . 43 THR CB 1 1 2 1423 1 1 46 THR CG2 C 9.142 10.404 0.853 1.00 . A A . 43 THR CG2 1 1 2 1424 1 1 46 THR H H 8.957 8.127 4.483 1.00 . A A . 43 THR H 1 1 2 1425 1 1 46 THR HA H 10.623 8.396 2.110 1.00 . A A . 43 THR HA 1 1 2 1426 1 1 46 THR HB H 7.904 9.666 2.415 1.00 . A A . 43 THR HB 1 1 2 1427 1 1 46 THR HG1 H 8.953 7.499 1.065 1.00 . A A . 43 THR HG1 1 1 2 1428 1 1 46 THR HG21 H 8.301 10.676 0.233 1.00 . A A . 43 THR HG21 1 1 2 1429 1 1 46 THR HG22 H 9.949 10.048 0.232 1.00 . A A . 43 THR HG22 1 1 2 1430 1 1 46 THR HG23 H 9.469 11.263 1.417 1.00 . A A . 43 THR HG23 1 1 2 1431 1 1 46 THR N N 9.398 7.857 3.650 1.00 . A A . 43 THR N 1 1 2 1432 1 1 46 THR O O 9.803 11.005 3.817 1.00 . A A . 43 THR O 1 1 2 1433 1 1 46 THR OG1 O 8.272 8.180 1.045 1.00 . A A . 43 THR OG1 1 1 2 1434 1 1 47 HIS C C 12.981 11.962 2.958 1.00 . A A . 44 HIS C 1 1 2 1435 1 1 47 HIS CA C 12.553 11.108 4.148 1.00 . A A . 44 HIS CA 1 1 2 1436 1 1 47 HIS CB C 13.775 10.623 4.940 1.00 . A A . 44 HIS CB 1 1 2 1437 1 1 47 HIS CD2 C 15.088 12.814 5.435 1.00 . A A . 44 HIS CD2 1 1 2 1438 1 1 47 HIS CE1 C 15.119 12.680 7.620 1.00 . A A . 44 HIS CE1 1 1 2 1439 1 1 47 HIS CG C 14.428 11.683 5.780 1.00 . A A . 44 HIS CG 1 1 2 1440 1 1 47 HIS H H 12.263 9.136 3.447 1.00 . A A . 44 HIS H 1 1 2 1441 1 1 47 HIS HA H 11.908 11.688 4.790 1.00 . A A . 44 HIS HA 1 1 2 1442 1 1 47 HIS HB2 H 13.472 9.823 5.598 1.00 . A A . 44 HIS HB2 1 1 2 1443 1 1 47 HIS HB3 H 14.514 10.247 4.247 1.00 . A A . 44 HIS HB3 1 1 2 1444 1 1 47 HIS HD1 H 14.070 10.924 7.719 1.00 . A A . 44 HIS HD1 1 1 2 1445 1 1 47 HIS HD2 H 15.253 13.179 4.430 1.00 . A A . 44 HIS HD2 1 1 2 1446 1 1 47 HIS HE1 H 15.305 12.900 8.660 1.00 . A A . 44 HIS HE1 1 1 2 1447 1 1 47 HIS HE2 H 15.920 14.301 6.663 1.00 . A A . 44 HIS HE2 1 1 2 1448 1 1 47 HIS N N 11.795 9.977 3.643 1.00 . A A . 44 HIS N 1 1 2 1449 1 1 47 HIS ND1 N 14.468 11.630 7.158 1.00 . A A . 44 HIS ND1 1 1 2 1450 1 1 47 HIS NE2 N 15.506 13.413 6.596 1.00 . A A . 44 HIS NE2 1 1 2 1451 1 1 47 HIS O O 14.156 12.004 2.595 1.00 . A A . 44 HIS O 1 1 2 1452 1 1 48 ASP C C 11.393 14.629 1.114 1.00 . A A . 45 ASP C 1 1 2 1453 1 1 48 ASP CA C 12.236 13.364 1.115 1.00 . A A . 45 ASP CA 1 1 2 1454 1 1 48 ASP CB C 11.896 12.500 -0.105 1.00 . A A . 45 ASP CB 1 1 2 1455 1 1 48 ASP CG C 12.103 13.223 -1.420 1.00 . A A . 45 ASP CG 1 1 2 1456 1 1 48 ASP H H 11.102 12.587 2.718 1.00 . A A . 45 ASP H 1 1 2 1457 1 1 48 ASP HA H 13.280 13.636 1.078 1.00 . A A . 45 ASP HA 1 1 2 1458 1 1 48 ASP HB2 H 12.524 11.622 -0.100 1.00 . A A . 45 ASP HB2 1 1 2 1459 1 1 48 ASP HB3 H 10.862 12.195 -0.042 1.00 . A A . 45 ASP HB3 1 1 2 1460 1 1 48 ASP N N 12.007 12.611 2.338 1.00 . A A . 45 ASP N 1 1 2 1461 1 1 48 ASP O O 11.947 15.715 1.381 1.00 . A A . 45 ASP O 1 1 2 1462 1 1 48 ASP OXT O 10.170 14.530 0.880 1.00 . A A . 45 ASP OXT 1 1 2 1463 1 1 48 ASP OD1 O 13.271 13.463 -1.796 1.00 . A A . 45 ASP OD1 1 1 2 1464 1 1 48 ASP OD2 O 11.101 13.532 -2.100 1.00 . A A . 45 ASP OD2 1 1 2 1465 2 2 1 ZN ZN ZN -4.372 -5.602 0.519 1.00 . B A . 101 ZN ZN 1 1 2 1466 3 2 1 ZN ZN ZN 6.363 1.244 -0.977 1.00 . C A . 102 ZN ZN 1 1 3 1467 1 1 1 GLY C C -16.730 7.481 -11.536 1.00 . A A . -2 GLY C 1 1 3 1468 1 1 1 GLY CA C -16.452 6.744 -12.830 1.00 . A A . -2 GLY CA 1 1 3 1469 1 1 1 GLY H1 H -14.838 6.138 -13.997 1.00 . A A . -2 GLY H1 1 1 3 1470 1 1 1 GLY H2 H -14.519 6.141 -12.340 1.00 . A A . -2 GLY H2 1 1 3 1471 1 1 1 GLY H3 H -14.589 7.602 -13.189 1.00 . A A . -2 GLY H3 1 1 3 1472 1 1 1 GLY HA2 H -16.931 7.268 -13.642 1.00 . A A . -2 GLY HA2 1 1 3 1473 1 1 1 GLY HA3 H -16.862 5.747 -12.765 1.00 . A A . -2 GLY HA3 1 1 3 1474 1 1 1 GLY N N -14.999 6.648 -13.109 1.00 . A A . -2 GLY N 1 1 3 1475 1 1 1 GLY O O -16.167 8.551 -11.302 1.00 . A A . -2 GLY O 1 1 3 1476 1 1 2 PRO C C -16.823 7.409 -8.340 1.00 . A A . -1 PRO C 1 1 3 1477 1 1 2 PRO CA C -17.929 7.556 -9.385 1.00 . A A . -1 PRO CA 1 1 3 1478 1 1 2 PRO CB C -19.183 6.797 -8.953 1.00 . A A . -1 PRO CB 1 1 3 1479 1 1 2 PRO CD C -18.284 5.637 -10.846 1.00 . A A . -1 PRO CD 1 1 3 1480 1 1 2 PRO CG C -19.026 5.441 -9.548 1.00 . A A . -1 PRO CG 1 1 3 1481 1 1 2 PRO HA H -18.164 8.601 -9.513 1.00 . A A . -1 PRO HA 1 1 3 1482 1 1 2 PRO HB2 H -19.229 6.752 -7.874 1.00 . A A . -1 PRO HB2 1 1 3 1483 1 1 2 PRO HB3 H -20.060 7.296 -9.337 1.00 . A A . -1 PRO HB3 1 1 3 1484 1 1 2 PRO HD2 H -17.580 4.833 -10.999 1.00 . A A . -1 PRO HD2 1 1 3 1485 1 1 2 PRO HD3 H -18.978 5.694 -11.670 1.00 . A A . -1 PRO HD3 1 1 3 1486 1 1 2 PRO HG2 H -18.456 4.812 -8.881 1.00 . A A . -1 PRO HG2 1 1 3 1487 1 1 2 PRO HG3 H -19.997 5.009 -9.735 1.00 . A A . -1 PRO HG3 1 1 3 1488 1 1 2 PRO N N -17.582 6.923 -10.659 1.00 . A A . -1 PRO N 1 1 3 1489 1 1 2 PRO O O -16.914 7.978 -7.250 1.00 . A A . -1 PRO O 1 1 3 1490 1 1 3 HIS C C -15.043 5.545 -6.611 1.00 . A A . 0 HIS C 1 1 3 1491 1 1 3 HIS CA C -14.636 6.396 -7.816 1.00 . A A . 0 HIS CA 1 1 3 1492 1 1 3 HIS CB C -14.001 7.723 -7.372 1.00 . A A . 0 HIS CB 1 1 3 1493 1 1 3 HIS CD2 C -12.331 7.535 -5.391 1.00 . A A . 0 HIS CD2 1 1 3 1494 1 1 3 HIS CE1 C -10.481 7.412 -6.545 1.00 . A A . 0 HIS CE1 1 1 3 1495 1 1 3 HIS CG C -12.666 7.580 -6.701 1.00 . A A . 0 HIS CG 1 1 3 1496 1 1 3 HIS H H -15.805 6.209 -9.571 1.00 . A A . 0 HIS H 1 1 3 1497 1 1 3 HIS HA H -13.910 5.840 -8.391 1.00 . A A . 0 HIS HA 1 1 3 1498 1 1 3 HIS HB2 H -13.866 8.352 -8.238 1.00 . A A . 0 HIS HB2 1 1 3 1499 1 1 3 HIS HB3 H -14.668 8.216 -6.680 1.00 . A A . 0 HIS HB3 1 1 3 1500 1 1 3 HIS HD1 H -11.390 7.498 -8.377 1.00 . A A . 0 HIS HD1 1 1 3 1501 1 1 3 HIS HD2 H -13.014 7.565 -4.557 1.00 . A A . 0 HIS HD2 1 1 3 1502 1 1 3 HIS HE1 H -9.437 7.337 -6.809 1.00 . A A . 0 HIS HE1 1 1 3 1503 1 1 3 HIS HE2 H -10.433 7.667 -4.524 1.00 . A A . 0 HIS HE2 1 1 3 1504 1 1 3 HIS N N -15.789 6.638 -8.689 1.00 . A A . 0 HIS N 1 1 3 1505 1 1 3 HIS ND1 N -11.484 7.499 -7.396 1.00 . A A . 0 HIS ND1 1 1 3 1506 1 1 3 HIS NE2 N -10.964 7.433 -5.318 1.00 . A A . 0 HIS NE2 1 1 3 1507 1 1 3 HIS O O -14.869 4.326 -6.627 1.00 . A A . 0 HIS O 1 1 3 1508 1 1 4 MET C C -15.020 4.638 -3.757 1.00 . A A . 1 MET C 1 1 3 1509 1 1 4 MET CA C -16.101 5.509 -4.390 1.00 . A A . 1 MET CA 1 1 3 1510 1 1 4 MET CB C -17.337 4.667 -4.719 1.00 . A A . 1 MET CB 1 1 3 1511 1 1 4 MET CE C -20.313 7.580 -4.902 1.00 . A A . 1 MET CE 1 1 3 1512 1 1 4 MET CG C -18.517 5.493 -5.199 1.00 . A A . 1 MET CG 1 1 3 1513 1 1 4 MET H H -15.716 7.165 -5.651 1.00 . A A . 1 MET H 1 1 3 1514 1 1 4 MET HA H -16.383 6.269 -3.679 1.00 . A A . 1 MET HA 1 1 3 1515 1 1 4 MET HB2 H -17.082 3.960 -5.493 1.00 . A A . 1 MET HB2 1 1 3 1516 1 1 4 MET HB3 H -17.637 4.129 -3.833 1.00 . A A . 1 MET HB3 1 1 3 1517 1 1 4 MET HE1 H -21.089 6.887 -5.186 1.00 . A A . 1 MET HE1 1 1 3 1518 1 1 4 MET HE2 H -19.877 8.017 -5.790 1.00 . A A . 1 MET HE2 1 1 3 1519 1 1 4 MET HE3 H -20.734 8.361 -4.287 1.00 . A A . 1 MET HE3 1 1 3 1520 1 1 4 MET HG2 H -18.234 6.008 -6.104 1.00 . A A . 1 MET HG2 1 1 3 1521 1 1 4 MET HG3 H -19.344 4.828 -5.406 1.00 . A A . 1 MET HG3 1 1 3 1522 1 1 4 MET N N -15.611 6.191 -5.591 1.00 . A A . 1 MET N 1 1 3 1523 1 1 4 MET O O -15.014 3.416 -3.926 1.00 . A A . 1 MET O 1 1 3 1524 1 1 4 MET SD S -19.047 6.712 -3.980 1.00 . A A . 1 MET SD 1 1 3 1525 1 1 5 ALA C C -12.061 3.946 -3.358 1.00 . A A . 2 ALA C 1 1 3 1526 1 1 5 ALA CA C -13.006 4.603 -2.358 1.00 . A A . 2 ALA CA 1 1 3 1527 1 1 5 ALA CB C -13.537 3.579 -1.360 1.00 . A A . 2 ALA CB 1 1 3 1528 1 1 5 ALA H H -14.165 6.257 -2.960 1.00 . A A . 2 ALA H 1 1 3 1529 1 1 5 ALA HA H -12.452 5.348 -1.804 1.00 . A A . 2 ALA HA 1 1 3 1530 1 1 5 ALA HB1 H -14.221 4.061 -0.678 1.00 . A A . 2 ALA HB1 1 1 3 1531 1 1 5 ALA HB2 H -12.711 3.158 -0.804 1.00 . A A . 2 ALA HB2 1 1 3 1532 1 1 5 ALA HB3 H -14.051 2.792 -1.891 1.00 . A A . 2 ALA HB3 1 1 3 1533 1 1 5 ALA N N -14.103 5.285 -3.036 1.00 . A A . 2 ALA N 1 1 3 1534 1 1 5 ALA O O -12.252 4.034 -4.573 1.00 . A A . 2 ALA O 1 1 3 1535 1 1 6 VAL C C -9.769 1.231 -3.130 1.00 . A A . 3 VAL C 1 1 3 1536 1 1 6 VAL CA C -10.046 2.629 -3.665 1.00 . A A . 3 VAL CA 1 1 3 1537 1 1 6 VAL CB C -8.720 3.417 -3.729 1.00 . A A . 3 VAL CB 1 1 3 1538 1 1 6 VAL CG1 C -7.650 2.636 -4.480 1.00 . A A . 3 VAL CG1 1 1 3 1539 1 1 6 VAL CG2 C -8.935 4.772 -4.379 1.00 . A A . 3 VAL CG2 1 1 3 1540 1 1 6 VAL H H -10.927 3.296 -1.865 1.00 . A A . 3 VAL H 1 1 3 1541 1 1 6 VAL HA H -10.443 2.555 -4.663 1.00 . A A . 3 VAL HA 1 1 3 1542 1 1 6 VAL HB H -8.372 3.579 -2.719 1.00 . A A . 3 VAL HB 1 1 3 1543 1 1 6 VAL HG11 H -7.987 2.439 -5.487 1.00 . A A . 3 VAL HG11 1 1 3 1544 1 1 6 VAL HG12 H -7.467 1.699 -3.974 1.00 . A A . 3 VAL HG12 1 1 3 1545 1 1 6 VAL HG13 H -6.738 3.212 -4.512 1.00 . A A . 3 VAL HG13 1 1 3 1546 1 1 6 VAL HG21 H -9.315 4.635 -5.381 1.00 . A A . 3 VAL HG21 1 1 3 1547 1 1 6 VAL HG22 H -7.998 5.305 -4.420 1.00 . A A . 3 VAL HG22 1 1 3 1548 1 1 6 VAL HG23 H -9.648 5.341 -3.799 1.00 . A A . 3 VAL HG23 1 1 3 1549 1 1 6 VAL N N -11.031 3.309 -2.838 1.00 . A A . 3 VAL N 1 1 3 1550 1 1 6 VAL O O -9.554 1.048 -1.930 1.00 . A A . 3 VAL O 1 1 3 1551 1 1 7 LEU C C -7.913 -1.203 -3.503 1.00 . A A . 4 LEU C 1 1 3 1552 1 1 7 LEU CA C -9.421 -1.109 -3.665 1.00 . A A . 4 LEU CA 1 1 3 1553 1 1 7 LEU CB C -9.892 -2.108 -4.724 1.00 . A A . 4 LEU CB 1 1 3 1554 1 1 7 LEU CD1 C -11.731 -3.413 -5.814 1.00 . A A . 4 LEU CD1 1 1 3 1555 1 1 7 LEU CD2 C -11.761 -3.049 -3.342 1.00 . A A . 4 LEU CD2 1 1 3 1556 1 1 7 LEU CG C -11.383 -2.450 -4.689 1.00 . A A . 4 LEU CG 1 1 3 1557 1 1 7 LEU H H -10.093 0.439 -4.935 1.00 . A A . 4 LEU H 1 1 3 1558 1 1 7 LEU HA H -9.886 -1.350 -2.721 1.00 . A A . 4 LEU HA 1 1 3 1559 1 1 7 LEU HB2 H -9.662 -1.700 -5.697 1.00 . A A . 4 LEU HB2 1 1 3 1560 1 1 7 LEU HB3 H -9.334 -3.024 -4.597 1.00 . A A . 4 LEU HB3 1 1 3 1561 1 1 7 LEU HD11 H -11.176 -4.330 -5.686 1.00 . A A . 4 LEU HD11 1 1 3 1562 1 1 7 LEU HD12 H -11.477 -2.967 -6.763 1.00 . A A . 4 LEU HD12 1 1 3 1563 1 1 7 LEU HD13 H -12.790 -3.627 -5.789 1.00 . A A . 4 LEU HD13 1 1 3 1564 1 1 7 LEU HD21 H -11.139 -3.913 -3.140 1.00 . A A . 4 LEU HD21 1 1 3 1565 1 1 7 LEU HD22 H -12.797 -3.351 -3.360 1.00 . A A . 4 LEU HD22 1 1 3 1566 1 1 7 LEU HD23 H -11.615 -2.312 -2.564 1.00 . A A . 4 LEU HD23 1 1 3 1567 1 1 7 LEU HG H -11.958 -1.546 -4.831 1.00 . A A . 4 LEU HG 1 1 3 1568 1 1 7 LEU N N -9.804 0.246 -4.018 1.00 . A A . 4 LEU N 1 1 3 1569 1 1 7 LEU O O -7.155 -0.590 -4.257 1.00 . A A . 4 LEU O 1 1 3 1570 1 1 8 CYS C C -5.295 -2.503 -3.458 1.00 . A A . 5 CYS C 1 1 3 1571 1 1 8 CYS CA C -6.096 -2.199 -2.195 1.00 . A A . 5 CYS CA 1 1 3 1572 1 1 8 CYS CB C -5.997 -3.370 -1.225 1.00 . A A . 5 CYS CB 1 1 3 1573 1 1 8 CYS H H -8.183 -2.396 -1.933 1.00 . A A . 5 CYS H 1 1 3 1574 1 1 8 CYS HA H -5.700 -1.313 -1.723 1.00 . A A . 5 CYS HA 1 1 3 1575 1 1 8 CYS HB2 H -6.644 -3.179 -0.386 1.00 . A A . 5 CYS HB2 1 1 3 1576 1 1 8 CYS HB3 H -6.335 -4.266 -1.729 1.00 . A A . 5 CYS HB3 1 1 3 1577 1 1 8 CYS N N -7.502 -1.969 -2.501 1.00 . A A . 5 CYS N 1 1 3 1578 1 1 8 CYS O O -5.571 -3.475 -4.153 1.00 . A A . 5 CYS O 1 1 3 1579 1 1 8 CYS SG S -4.343 -3.702 -0.577 1.00 . A A . 5 CYS SG 1 1 3 1580 1 1 9 GLY C C -2.743 -3.128 -4.998 1.00 . A A . 6 GLY C 1 1 3 1581 1 1 9 GLY CA C -3.502 -1.816 -4.938 1.00 . A A . 6 GLY CA 1 1 3 1582 1 1 9 GLY H H -4.102 -0.935 -3.106 1.00 . A A . 6 GLY H 1 1 3 1583 1 1 9 GLY HA2 H -4.156 -1.754 -5.793 1.00 . A A . 6 GLY HA2 1 1 3 1584 1 1 9 GLY HA3 H -2.793 -1.004 -4.986 1.00 . A A . 6 GLY HA3 1 1 3 1585 1 1 9 GLY N N -4.296 -1.670 -3.730 1.00 . A A . 6 GLY N 1 1 3 1586 1 1 9 GLY O O -2.361 -3.582 -6.076 1.00 . A A . 6 GLY O 1 1 3 1587 1 1 10 VAL C C -2.678 -6.200 -3.960 1.00 . A A . 7 VAL C 1 1 3 1588 1 1 10 VAL CA C -1.776 -4.981 -3.767 1.00 . A A . 7 VAL CA 1 1 3 1589 1 1 10 VAL CB C -1.023 -5.104 -2.426 1.00 . A A . 7 VAL CB 1 1 3 1590 1 1 10 VAL CG1 C -0.346 -6.462 -2.302 1.00 . A A . 7 VAL CG1 1 1 3 1591 1 1 10 VAL CG2 C -0.001 -3.986 -2.294 1.00 . A A . 7 VAL CG2 1 1 3 1592 1 1 10 VAL H H -2.887 -3.342 -3.021 1.00 . A A . 7 VAL H 1 1 3 1593 1 1 10 VAL HA H -1.046 -4.966 -4.561 1.00 . A A . 7 VAL HA 1 1 3 1594 1 1 10 VAL HB H -1.736 -5.007 -1.622 1.00 . A A . 7 VAL HB 1 1 3 1595 1 1 10 VAL HG11 H 0.145 -6.533 -1.342 1.00 . A A . 7 VAL HG11 1 1 3 1596 1 1 10 VAL HG12 H 0.385 -6.574 -3.089 1.00 . A A . 7 VAL HG12 1 1 3 1597 1 1 10 VAL HG13 H -1.088 -7.242 -2.386 1.00 . A A . 7 VAL HG13 1 1 3 1598 1 1 10 VAL HG21 H -0.503 -3.032 -2.345 1.00 . A A . 7 VAL HG21 1 1 3 1599 1 1 10 VAL HG22 H 0.717 -4.058 -3.097 1.00 . A A . 7 VAL HG22 1 1 3 1600 1 1 10 VAL HG23 H 0.509 -4.075 -1.347 1.00 . A A . 7 VAL HG23 1 1 3 1601 1 1 10 VAL N N -2.529 -3.738 -3.841 1.00 . A A . 7 VAL N 1 1 3 1602 1 1 10 VAL O O -2.576 -6.899 -4.966 1.00 . A A . 7 VAL O 1 1 3 1603 1 1 11 CYS C C -5.677 -7.483 -3.777 1.00 . A A . 8 CYS C 1 1 3 1604 1 1 11 CYS CA C -4.358 -7.675 -3.023 1.00 . A A . 8 CYS CA 1 1 3 1605 1 1 11 CYS CB C -4.615 -8.173 -1.595 1.00 . A A . 8 CYS CB 1 1 3 1606 1 1 11 CYS H H -3.704 -5.793 -2.295 1.00 . A A . 8 CYS H 1 1 3 1607 1 1 11 CYS HA H -3.776 -8.420 -3.547 1.00 . A A . 8 CYS HA 1 1 3 1608 1 1 11 CYS HB2 H -5.074 -9.148 -1.643 1.00 . A A . 8 CYS HB2 1 1 3 1609 1 1 11 CYS HB3 H -3.670 -8.253 -1.077 1.00 . A A . 8 CYS HB3 1 1 3 1610 1 1 11 CYS N N -3.571 -6.445 -3.006 1.00 . A A . 8 CYS N 1 1 3 1611 1 1 11 CYS O O -6.204 -8.411 -4.389 1.00 . A A . 8 CYS O 1 1 3 1612 1 1 11 CYS SG S -5.694 -7.110 -0.612 1.00 . A A . 8 CYS SG 1 1 3 1613 1 1 12 GLY C C -8.636 -6.550 -4.123 1.00 . A A . 9 GLY C 1 1 3 1614 1 1 12 GLY CA C -7.345 -5.861 -4.513 1.00 . A A . 9 GLY CA 1 1 3 1615 1 1 12 GLY H H -5.754 -5.591 -3.153 1.00 . A A . 9 GLY H 1 1 3 1616 1 1 12 GLY HA2 H -7.484 -4.797 -4.409 1.00 . A A . 9 GLY HA2 1 1 3 1617 1 1 12 GLY HA3 H -7.140 -6.079 -5.551 1.00 . A A . 9 GLY HA3 1 1 3 1618 1 1 12 GLY N N -6.187 -6.254 -3.724 1.00 . A A . 9 GLY N 1 1 3 1619 1 1 12 GLY O O -9.473 -6.810 -4.983 1.00 . A A . 9 GLY O 1 1 3 1620 1 1 13 ILE C C -10.903 -6.685 -1.471 1.00 . A A . 10 ILE C 1 1 3 1621 1 1 13 ILE CA C -10.044 -7.525 -2.417 1.00 . A A . 10 ILE CA 1 1 3 1622 1 1 13 ILE CB C -9.730 -8.902 -1.785 1.00 . A A . 10 ILE CB 1 1 3 1623 1 1 13 ILE CD1 C -8.892 -8.133 0.496 1.00 . A A . 10 ILE CD1 1 1 3 1624 1 1 13 ILE CG1 C -8.557 -8.819 -0.806 1.00 . A A . 10 ILE CG1 1 1 3 1625 1 1 13 ILE CG2 C -9.433 -9.918 -2.874 1.00 . A A . 10 ILE CG2 1 1 3 1626 1 1 13 ILE H H -8.152 -6.580 -2.174 1.00 . A A . 10 ILE H 1 1 3 1627 1 1 13 ILE HA H -10.623 -7.706 -3.311 1.00 . A A . 10 ILE HA 1 1 3 1628 1 1 13 ILE HB H -10.609 -9.235 -1.253 1.00 . A A . 10 ILE HB 1 1 3 1629 1 1 13 ILE HD11 H -7.997 -8.022 1.087 1.00 . A A . 10 ILE HD11 1 1 3 1630 1 1 13 ILE HD12 H -9.614 -8.724 1.038 1.00 . A A . 10 ILE HD12 1 1 3 1631 1 1 13 ILE HD13 H -9.309 -7.156 0.284 1.00 . A A . 10 ILE HD13 1 1 3 1632 1 1 13 ILE HG12 H -8.217 -9.816 -0.576 1.00 . A A . 10 ILE HG12 1 1 3 1633 1 1 13 ILE HG13 H -7.751 -8.270 -1.271 1.00 . A A . 10 ILE HG13 1 1 3 1634 1 1 13 ILE HG21 H -8.579 -9.589 -3.448 1.00 . A A . 10 ILE HG21 1 1 3 1635 1 1 13 ILE HG22 H -10.290 -10.010 -3.523 1.00 . A A . 10 ILE HG22 1 1 3 1636 1 1 13 ILE HG23 H -9.217 -10.875 -2.423 1.00 . A A . 10 ILE HG23 1 1 3 1637 1 1 13 ILE N N -8.829 -6.831 -2.839 1.00 . A A . 10 ILE N 1 1 3 1638 1 1 13 ILE O O -12.042 -7.044 -1.178 1.00 . A A . 10 ILE O 1 1 3 1639 1 1 14 LYS C C -10.541 -3.261 -0.218 1.00 . A A . 11 LYS C 1 1 3 1640 1 1 14 LYS CA C -11.106 -4.671 -0.124 1.00 . A A . 11 LYS CA 1 1 3 1641 1 1 14 LYS CB C -11.072 -5.150 1.333 1.00 . A A . 11 LYS CB 1 1 3 1642 1 1 14 LYS CD C -9.751 -5.420 3.463 1.00 . A A . 11 LYS CD 1 1 3 1643 1 1 14 LYS CE C -10.157 -6.871 3.670 1.00 . A A . 11 LYS CE 1 1 3 1644 1 1 14 LYS CG C -9.703 -5.043 1.990 1.00 . A A . 11 LYS CG 1 1 3 1645 1 1 14 LYS H H -9.445 -5.337 -1.251 1.00 . A A . 11 LYS H 1 1 3 1646 1 1 14 LYS HA H -12.131 -4.655 -0.464 1.00 . A A . 11 LYS HA 1 1 3 1647 1 1 14 LYS HB2 H -11.768 -4.559 1.909 1.00 . A A . 11 LYS HB2 1 1 3 1648 1 1 14 LYS HB3 H -11.381 -6.184 1.364 1.00 . A A . 11 LYS HB3 1 1 3 1649 1 1 14 LYS HD2 H -8.774 -5.268 3.895 1.00 . A A . 11 LYS HD2 1 1 3 1650 1 1 14 LYS HD3 H -10.467 -4.783 3.961 1.00 . A A . 11 LYS HD3 1 1 3 1651 1 1 14 LYS HE2 H -11.130 -7.027 3.231 1.00 . A A . 11 LYS HE2 1 1 3 1652 1 1 14 LYS HE3 H -9.436 -7.507 3.178 1.00 . A A . 11 LYS HE3 1 1 3 1653 1 1 14 LYS HG2 H -9.016 -5.702 1.484 1.00 . A A . 11 LYS HG2 1 1 3 1654 1 1 14 LYS HG3 H -9.354 -4.024 1.902 1.00 . A A . 11 LYS HG3 1 1 3 1655 1 1 14 LYS HZ1 H -9.290 -7.062 5.556 1.00 . A A . 11 LYS HZ1 1 1 3 1656 1 1 14 LYS HZ2 H -10.462 -8.230 5.223 1.00 . A A . 11 LYS HZ2 1 1 3 1657 1 1 14 LYS HZ3 H -10.929 -6.651 5.595 1.00 . A A . 11 LYS HZ3 1 1 3 1658 1 1 14 LYS N N -10.360 -5.570 -0.997 1.00 . A A . 11 LYS N 1 1 3 1659 1 1 14 LYS NZ N -10.214 -7.227 5.110 1.00 . A A . 11 LYS NZ 1 1 3 1660 1 1 14 LYS O O -9.489 -3.053 -0.837 1.00 . A A . 11 LYS O 1 1 3 1661 1 1 15 GLU C C -9.479 -0.748 1.128 1.00 . A A . 12 GLU C 1 1 3 1662 1 1 15 GLU CA C -10.791 -0.914 0.373 1.00 . A A . 12 GLU CA 1 1 3 1663 1 1 15 GLU CB C -11.845 0.023 0.969 1.00 . A A . 12 GLU CB 1 1 3 1664 1 1 15 GLU CD C -14.042 -0.872 0.097 1.00 . A A . 12 GLU CD 1 1 3 1665 1 1 15 GLU CG C -13.048 0.264 0.070 1.00 . A A . 12 GLU CG 1 1 3 1666 1 1 15 GLU H H -12.061 -2.535 0.862 1.00 . A A . 12 GLU H 1 1 3 1667 1 1 15 GLU HA H -10.628 -0.640 -0.659 1.00 . A A . 12 GLU HA 1 1 3 1668 1 1 15 GLU HB2 H -12.199 -0.399 1.898 1.00 . A A . 12 GLU HB2 1 1 3 1669 1 1 15 GLU HB3 H -11.382 0.977 1.175 1.00 . A A . 12 GLU HB3 1 1 3 1670 1 1 15 GLU HG2 H -13.548 1.164 0.394 1.00 . A A . 12 GLU HG2 1 1 3 1671 1 1 15 GLU HG3 H -12.700 0.395 -0.945 1.00 . A A . 12 GLU HG3 1 1 3 1672 1 1 15 GLU N N -11.233 -2.302 0.391 1.00 . A A . 12 GLU N 1 1 3 1673 1 1 15 GLU O O -9.086 -1.598 1.931 1.00 . A A . 12 GLU O 1 1 3 1674 1 1 15 GLU OE1 O -14.777 -0.994 1.097 1.00 . A A . 12 GLU OE1 1 1 3 1675 1 1 15 GLU OE2 O -14.105 -1.643 -0.881 1.00 . A A . 12 GLU OE2 1 1 3 1676 1 1 16 PHE C C -7.612 1.274 2.805 1.00 . A A . 13 PHE C 1 1 3 1677 1 1 16 PHE CA C -7.506 0.629 1.426 1.00 . A A . 13 PHE CA 1 1 3 1678 1 1 16 PHE CB C -6.715 1.549 0.500 1.00 . A A . 13 PHE CB 1 1 3 1679 1 1 16 PHE CD1 C -8.329 3.334 -0.222 1.00 . A A . 13 PHE CD1 1 1 3 1680 1 1 16 PHE CD2 C -6.525 3.946 1.210 1.00 . A A . 13 PHE CD2 1 1 3 1681 1 1 16 PHE CE1 C -8.769 4.642 -0.233 1.00 . A A . 13 PHE CE1 1 1 3 1682 1 1 16 PHE CE2 C -6.960 5.255 1.204 1.00 . A A . 13 PHE CE2 1 1 3 1683 1 1 16 PHE CG C -7.203 2.971 0.497 1.00 . A A . 13 PHE CG 1 1 3 1684 1 1 16 PHE CZ C -8.082 5.604 0.480 1.00 . A A . 13 PHE CZ 1 1 3 1685 1 1 16 PHE H H -9.207 1.004 0.234 1.00 . A A . 13 PHE H 1 1 3 1686 1 1 16 PHE HA H -6.981 -0.307 1.516 1.00 . A A . 13 PHE HA 1 1 3 1687 1 1 16 PHE HB2 H -5.681 1.556 0.809 1.00 . A A . 13 PHE HB2 1 1 3 1688 1 1 16 PHE HB3 H -6.781 1.173 -0.510 1.00 . A A . 13 PHE HB3 1 1 3 1689 1 1 16 PHE HD1 H -8.865 2.581 -0.781 1.00 . A A . 13 PHE HD1 1 1 3 1690 1 1 16 PHE HD2 H -5.651 3.670 1.785 1.00 . A A . 13 PHE HD2 1 1 3 1691 1 1 16 PHE HE1 H -9.648 4.913 -0.798 1.00 . A A . 13 PHE HE1 1 1 3 1692 1 1 16 PHE HE2 H -6.417 6.007 1.756 1.00 . A A . 13 PHE HE2 1 1 3 1693 1 1 16 PHE HZ H -8.424 6.628 0.475 1.00 . A A . 13 PHE HZ 1 1 3 1694 1 1 16 PHE N N -8.812 0.355 0.855 1.00 . A A . 13 PHE N 1 1 3 1695 1 1 16 PHE O O -8.674 1.751 3.211 1.00 . A A . 13 PHE O 1 1 3 1696 1 1 17 LYS C C -5.053 2.675 4.916 1.00 . A A . 14 LYS C 1 1 3 1697 1 1 17 LYS CA C -6.386 1.932 4.803 1.00 . A A . 14 LYS CA 1 1 3 1698 1 1 17 LYS CB C -6.520 0.871 5.900 1.00 . A A . 14 LYS CB 1 1 3 1699 1 1 17 LYS CD C -6.603 0.303 8.345 1.00 . A A . 14 LYS CD 1 1 3 1700 1 1 17 LYS CE C -6.433 0.818 9.766 1.00 . A A . 14 LYS CE 1 1 3 1701 1 1 17 LYS CG C -6.435 1.413 7.319 1.00 . A A . 14 LYS CG 1 1 3 1702 1 1 17 LYS H H -5.695 0.852 3.132 1.00 . A A . 14 LYS H 1 1 3 1703 1 1 17 LYS HA H -7.189 2.641 4.890 1.00 . A A . 14 LYS HA 1 1 3 1704 1 1 17 LYS HB2 H -7.472 0.379 5.785 1.00 . A A . 14 LYS HB2 1 1 3 1705 1 1 17 LYS HB3 H -5.733 0.143 5.769 1.00 . A A . 14 LYS HB3 1 1 3 1706 1 1 17 LYS HD2 H -7.590 -0.120 8.244 1.00 . A A . 14 LYS HD2 1 1 3 1707 1 1 17 LYS HD3 H -5.862 -0.459 8.158 1.00 . A A . 14 LYS HD3 1 1 3 1708 1 1 17 LYS HE2 H -7.093 1.659 9.910 1.00 . A A . 14 LYS HE2 1 1 3 1709 1 1 17 LYS HE3 H -6.704 0.030 10.453 1.00 . A A . 14 LYS HE3 1 1 3 1710 1 1 17 LYS HG2 H -5.472 1.877 7.459 1.00 . A A . 14 LYS HG2 1 1 3 1711 1 1 17 LYS HG3 H -7.215 2.146 7.461 1.00 . A A . 14 LYS HG3 1 1 3 1712 1 1 17 LYS HZ1 H -4.731 1.956 9.352 1.00 . A A . 14 LYS HZ1 1 1 3 1713 1 1 17 LYS HZ2 H -4.393 0.431 10.004 1.00 . A A . 14 LYS HZ2 1 1 3 1714 1 1 17 LYS HZ3 H -4.977 1.666 10.997 1.00 . A A . 14 LYS HZ3 1 1 3 1715 1 1 17 LYS N N -6.489 1.295 3.503 1.00 . A A . 14 LYS N 1 1 3 1716 1 1 17 LYS NZ N -5.037 1.247 10.047 1.00 . A A . 14 LYS NZ 1 1 3 1717 1 1 17 LYS O O -4.860 3.512 5.798 1.00 . A A . 14 LYS O 1 1 3 1718 1 1 18 TYR C C -2.500 3.543 2.627 1.00 . A A . 15 TYR C 1 1 3 1719 1 1 18 TYR CA C -2.812 2.965 3.997 1.00 . A A . 15 TYR CA 1 1 3 1720 1 1 18 TYR CB C -1.745 1.926 4.353 1.00 . A A . 15 TYR CB 1 1 3 1721 1 1 18 TYR CD1 C -2.842 0.510 6.117 1.00 . A A . 15 TYR CD1 1 1 3 1722 1 1 18 TYR CD2 C -0.926 1.784 6.726 1.00 . A A . 15 TYR CD2 1 1 3 1723 1 1 18 TYR CE1 C -2.935 0.023 7.405 1.00 . A A . 15 TYR CE1 1 1 3 1724 1 1 18 TYR CE2 C -1.009 1.301 8.016 1.00 . A A . 15 TYR CE2 1 1 3 1725 1 1 18 TYR CG C -1.840 1.397 5.759 1.00 . A A . 15 TYR CG 1 1 3 1726 1 1 18 TYR CZ C -2.016 0.421 8.351 1.00 . A A . 15 TYR CZ 1 1 3 1727 1 1 18 TYR H H -4.363 1.711 3.310 1.00 . A A . 15 TYR H 1 1 3 1728 1 1 18 TYR HA H -2.796 3.758 4.729 1.00 . A A . 15 TYR HA 1 1 3 1729 1 1 18 TYR HB2 H -1.837 1.085 3.681 1.00 . A A . 15 TYR HB2 1 1 3 1730 1 1 18 TYR HB3 H -0.768 2.372 4.230 1.00 . A A . 15 TYR HB3 1 1 3 1731 1 1 18 TYR HD1 H -3.563 0.205 5.369 1.00 . A A . 15 TYR HD1 1 1 3 1732 1 1 18 TYR HD2 H -0.139 2.474 6.457 1.00 . A A . 15 TYR HD2 1 1 3 1733 1 1 18 TYR HE1 H -3.723 -0.667 7.663 1.00 . A A . 15 TYR HE1 1 1 3 1734 1 1 18 TYR HE2 H -0.285 1.610 8.756 1.00 . A A . 15 TYR HE2 1 1 3 1735 1 1 18 TYR HH H -2.149 -1.015 9.625 1.00 . A A . 15 TYR HH 1 1 3 1736 1 1 18 TYR N N -4.138 2.364 4.006 1.00 . A A . 15 TYR N 1 1 3 1737 1 1 18 TYR O O -3.248 3.339 1.670 1.00 . A A . 15 TYR O 1 1 3 1738 1 1 18 TYR OH O -2.112 -0.051 9.638 1.00 . A A . 15 TYR OH 1 1 3 1739 1 1 19 LYS C C 0.571 5.049 1.353 1.00 . A A . 16 LYS C 1 1 3 1740 1 1 19 LYS CA C -0.938 4.836 1.290 1.00 . A A . 16 LYS CA 1 1 3 1741 1 1 19 LYS CB C -1.675 6.159 1.052 1.00 . A A . 16 LYS CB 1 1 3 1742 1 1 19 LYS CD C -2.656 7.758 -0.601 1.00 . A A . 16 LYS CD 1 1 3 1743 1 1 19 LYS CE C -3.016 7.916 -2.067 1.00 . A A . 16 LYS CE 1 1 3 1744 1 1 19 LYS CG C -1.642 6.646 -0.389 1.00 . A A . 16 LYS CG 1 1 3 1745 1 1 19 LYS H H -0.844 4.381 3.349 1.00 . A A . 16 LYS H 1 1 3 1746 1 1 19 LYS HA H -1.166 4.146 0.491 1.00 . A A . 16 LYS HA 1 1 3 1747 1 1 19 LYS HB2 H -2.708 6.036 1.339 1.00 . A A . 16 LYS HB2 1 1 3 1748 1 1 19 LYS HB3 H -1.229 6.921 1.674 1.00 . A A . 16 LYS HB3 1 1 3 1749 1 1 19 LYS HD2 H -3.552 7.524 -0.047 1.00 . A A . 16 LYS HD2 1 1 3 1750 1 1 19 LYS HD3 H -2.239 8.684 -0.241 1.00 . A A . 16 LYS HD3 1 1 3 1751 1 1 19 LYS HE2 H -2.116 8.120 -2.626 1.00 . A A . 16 LYS HE2 1 1 3 1752 1 1 19 LYS HE3 H -3.455 6.991 -2.414 1.00 . A A . 16 LYS HE3 1 1 3 1753 1 1 19 LYS HG2 H -0.655 7.026 -0.607 1.00 . A A . 16 LYS HG2 1 1 3 1754 1 1 19 LYS HG3 H -1.870 5.827 -1.052 1.00 . A A . 16 LYS HG3 1 1 3 1755 1 1 19 LYS HZ1 H -4.229 9.087 -3.296 1.00 . A A . 16 LYS HZ1 1 1 3 1756 1 1 19 LYS HZ2 H -3.573 9.925 -1.983 1.00 . A A . 16 LYS HZ2 1 1 3 1757 1 1 19 LYS HZ3 H -4.856 8.851 -1.743 1.00 . A A . 16 LYS HZ3 1 1 3 1758 1 1 19 LYS N N -1.385 4.248 2.541 1.00 . A A . 16 LYS N 1 1 3 1759 1 1 19 LYS NZ N -3.986 9.021 -2.286 1.00 . A A . 16 LYS NZ 1 1 3 1760 1 1 19 LYS O O 1.044 6.011 1.963 1.00 . A A . 16 LYS O 1 1 3 1761 1 1 20 CYS C C 3.355 5.505 0.437 1.00 . A A . 17 CYS C 1 1 3 1762 1 1 20 CYS CA C 2.782 4.140 0.813 1.00 . A A . 17 CYS CA 1 1 3 1763 1 1 20 CYS CB C 3.393 3.072 -0.104 1.00 . A A . 17 CYS CB 1 1 3 1764 1 1 20 CYS H H 0.871 3.409 0.247 1.00 . A A . 17 CYS H 1 1 3 1765 1 1 20 CYS HA H 3.062 3.920 1.830 1.00 . A A . 17 CYS HA 1 1 3 1766 1 1 20 CYS HB2 H 3.076 2.096 0.228 1.00 . A A . 17 CYS HB2 1 1 3 1767 1 1 20 CYS HB3 H 3.059 3.237 -1.117 1.00 . A A . 17 CYS HB3 1 1 3 1768 1 1 20 CYS N N 1.319 4.123 0.750 1.00 . A A . 17 CYS N 1 1 3 1769 1 1 20 CYS O O 2.993 6.081 -0.583 1.00 . A A . 17 CYS O 1 1 3 1770 1 1 20 CYS SG S 5.204 3.110 -0.100 1.00 . A A . 17 CYS SG 1 1 3 1771 1 1 21 PRO C C 5.761 7.347 -0.241 1.00 . A A . 18 PRO C 1 1 3 1772 1 1 21 PRO CA C 4.936 7.315 1.043 1.00 . A A . 18 PRO CA 1 1 3 1773 1 1 21 PRO CB C 5.859 7.470 2.258 1.00 . A A . 18 PRO CB 1 1 3 1774 1 1 21 PRO CD C 4.739 5.382 2.513 1.00 . A A . 18 PRO CD 1 1 3 1775 1 1 21 PRO CG C 6.019 6.098 2.806 1.00 . A A . 18 PRO CG 1 1 3 1776 1 1 21 PRO HA H 4.221 8.122 1.027 1.00 . A A . 18 PRO HA 1 1 3 1777 1 1 21 PRO HB2 H 6.810 7.874 1.941 1.00 . A A . 18 PRO HB2 1 1 3 1778 1 1 21 PRO HB3 H 5.403 8.133 2.979 1.00 . A A . 18 PRO HB3 1 1 3 1779 1 1 21 PRO HD2 H 4.923 4.329 2.363 1.00 . A A . 18 PRO HD2 1 1 3 1780 1 1 21 PRO HD3 H 4.029 5.534 3.311 1.00 . A A . 18 PRO HD3 1 1 3 1781 1 1 21 PRO HG2 H 6.845 5.602 2.319 1.00 . A A . 18 PRO HG2 1 1 3 1782 1 1 21 PRO HG3 H 6.186 6.145 3.871 1.00 . A A . 18 PRO HG3 1 1 3 1783 1 1 21 PRO N N 4.278 6.021 1.268 1.00 . A A . 18 PRO N 1 1 3 1784 1 1 21 PRO O O 6.061 8.416 -0.765 1.00 . A A . 18 PRO O 1 1 3 1785 1 1 22 ARG C C 6.068 5.703 -3.150 1.00 . A A . 19 ARG C 1 1 3 1786 1 1 22 ARG CA C 6.934 6.100 -1.960 1.00 . A A . 19 ARG CA 1 1 3 1787 1 1 22 ARG CB C 8.071 5.087 -1.822 1.00 . A A . 19 ARG CB 1 1 3 1788 1 1 22 ARG CD C 10.347 4.585 -0.903 1.00 . A A . 19 ARG CD 1 1 3 1789 1 1 22 ARG CG C 9.103 5.449 -0.772 1.00 . A A . 19 ARG CG 1 1 3 1790 1 1 22 ARG CZ C 11.812 4.104 -2.841 1.00 . A A . 19 ARG CZ 1 1 3 1791 1 1 22 ARG H H 5.884 5.353 -0.274 1.00 . A A . 19 ARG H 1 1 3 1792 1 1 22 ARG HA H 7.357 7.077 -2.141 1.00 . A A . 19 ARG HA 1 1 3 1793 1 1 22 ARG HB2 H 7.648 4.129 -1.560 1.00 . A A . 19 ARG HB2 1 1 3 1794 1 1 22 ARG HB3 H 8.572 4.998 -2.774 1.00 . A A . 19 ARG HB3 1 1 3 1795 1 1 22 ARG HD2 H 10.939 4.692 -0.007 1.00 . A A . 19 ARG HD2 1 1 3 1796 1 1 22 ARG HD3 H 10.042 3.554 -1.011 1.00 . A A . 19 ARG HD3 1 1 3 1797 1 1 22 ARG HE H 11.246 5.931 -2.250 1.00 . A A . 19 ARG HE 1 1 3 1798 1 1 22 ARG HG2 H 9.381 6.484 -0.895 1.00 . A A . 19 ARG HG2 1 1 3 1799 1 1 22 ARG HG3 H 8.673 5.302 0.209 1.00 . A A . 19 ARG HG3 1 1 3 1800 1 1 22 ARG HH11 H 11.111 2.443 -1.926 1.00 . A A . 19 ARG HH11 1 1 3 1801 1 1 22 ARG HH12 H 12.186 2.154 -3.249 1.00 . A A . 19 ARG HH12 1 1 3 1802 1 1 22 ARG HH21 H 12.650 5.556 -3.979 1.00 . A A . 19 ARG HH21 1 1 3 1803 1 1 22 ARG HH22 H 13.068 3.924 -4.416 1.00 . A A . 19 ARG HH22 1 1 3 1804 1 1 22 ARG N N 6.143 6.177 -0.738 1.00 . A A . 19 ARG N 1 1 3 1805 1 1 22 ARG NE N 11.159 4.965 -2.059 1.00 . A A . 19 ARG NE 1 1 3 1806 1 1 22 ARG NH1 N 11.693 2.794 -2.655 1.00 . A A . 19 ARG NH1 1 1 3 1807 1 1 22 ARG NH2 N 12.568 4.560 -3.826 1.00 . A A . 19 ARG NH2 1 1 3 1808 1 1 22 ARG O O 6.057 6.374 -4.180 1.00 . A A . 19 ARG O 1 1 3 1809 1 1 23 CYS C C 3.246 4.705 -4.291 1.00 . A A . 20 CYS C 1 1 3 1810 1 1 23 CYS CA C 4.592 4.018 -4.093 1.00 . A A . 20 CYS CA 1 1 3 1811 1 1 23 CYS CB C 4.365 2.526 -3.839 1.00 . A A . 20 CYS CB 1 1 3 1812 1 1 23 CYS H H 5.302 4.185 -2.110 1.00 . A A . 20 CYS H 1 1 3 1813 1 1 23 CYS HA H 5.177 4.139 -4.988 1.00 . A A . 20 CYS HA 1 1 3 1814 1 1 23 CYS HB2 H 3.708 2.411 -2.993 1.00 . A A . 20 CYS HB2 1 1 3 1815 1 1 23 CYS HB3 H 3.899 2.090 -4.710 1.00 . A A . 20 CYS HB3 1 1 3 1816 1 1 23 CYS N N 5.339 4.607 -2.990 1.00 . A A . 20 CYS N 1 1 3 1817 1 1 23 CYS O O 2.650 4.627 -5.365 1.00 . A A . 20 CYS O 1 1 3 1818 1 1 23 CYS SG S 5.865 1.581 -3.491 1.00 . A A . 20 CYS SG 1 1 3 1819 1 1 24 LEU C C 0.344 4.942 -3.304 1.00 . A A . 21 LEU C 1 1 3 1820 1 1 24 LEU CA C 1.450 5.986 -3.193 1.00 . A A . 21 LEU CA 1 1 3 1821 1 1 24 LEU CB C 1.281 7.041 -4.293 1.00 . A A . 21 LEU CB 1 1 3 1822 1 1 24 LEU CD1 C 1.793 9.358 -5.062 1.00 . A A . 21 LEU CD1 1 1 3 1823 1 1 24 LEU CD2 C 2.799 8.521 -2.928 1.00 . A A . 21 LEU CD2 1 1 3 1824 1 1 24 LEU CG C 2.340 8.146 -4.331 1.00 . A A . 21 LEU CG 1 1 3 1825 1 1 24 LEU H H 3.348 5.445 -2.442 1.00 . A A . 21 LEU H 1 1 3 1826 1 1 24 LEU HA H 1.357 6.474 -2.233 1.00 . A A . 21 LEU HA 1 1 3 1827 1 1 24 LEU HB2 H 1.288 6.535 -5.247 1.00 . A A . 21 LEU HB2 1 1 3 1828 1 1 24 LEU HB3 H 0.315 7.508 -4.163 1.00 . A A . 21 LEU HB3 1 1 3 1829 1 1 24 LEU HD11 H 2.539 10.137 -5.080 1.00 . A A . 21 LEU HD11 1 1 3 1830 1 1 24 LEU HD12 H 0.909 9.714 -4.549 1.00 . A A . 21 LEU HD12 1 1 3 1831 1 1 24 LEU HD13 H 1.534 9.083 -6.074 1.00 . A A . 21 LEU HD13 1 1 3 1832 1 1 24 LEU HD21 H 1.947 8.816 -2.335 1.00 . A A . 21 LEU HD21 1 1 3 1833 1 1 24 LEU HD22 H 3.499 9.341 -2.986 1.00 . A A . 21 LEU HD22 1 1 3 1834 1 1 24 LEU HD23 H 3.282 7.668 -2.471 1.00 . A A . 21 LEU HD23 1 1 3 1835 1 1 24 LEU HG H 3.199 7.789 -4.881 1.00 . A A . 21 LEU HG 1 1 3 1836 1 1 24 LEU N N 2.775 5.360 -3.233 1.00 . A A . 21 LEU N 1 1 3 1837 1 1 24 LEU O O -0.836 5.284 -3.385 1.00 . A A . 21 LEU O 1 1 3 1838 1 1 25 VAL C C -1.047 2.498 -2.140 1.00 . A A . 22 VAL C 1 1 3 1839 1 1 25 VAL CA C -0.213 2.586 -3.405 1.00 . A A . 22 VAL CA 1 1 3 1840 1 1 25 VAL CB C 0.479 1.230 -3.699 1.00 . A A . 22 VAL CB 1 1 3 1841 1 1 25 VAL CG1 C 1.351 0.783 -2.538 1.00 . A A . 22 VAL CG1 1 1 3 1842 1 1 25 VAL CG2 C -0.547 0.159 -4.038 1.00 . A A . 22 VAL CG2 1 1 3 1843 1 1 25 VAL H H 1.675 3.467 -3.215 1.00 . A A . 22 VAL H 1 1 3 1844 1 1 25 VAL HA H -0.871 2.814 -4.232 1.00 . A A . 22 VAL HA 1 1 3 1845 1 1 25 VAL HB H 1.118 1.362 -4.560 1.00 . A A . 22 VAL HB 1 1 3 1846 1 1 25 VAL HG11 H 0.734 0.627 -1.666 1.00 . A A . 22 VAL HG11 1 1 3 1847 1 1 25 VAL HG12 H 2.086 1.543 -2.327 1.00 . A A . 22 VAL HG12 1 1 3 1848 1 1 25 VAL HG13 H 1.848 -0.140 -2.797 1.00 . A A . 22 VAL HG13 1 1 3 1849 1 1 25 VAL HG21 H -0.040 -0.774 -4.241 1.00 . A A . 22 VAL HG21 1 1 3 1850 1 1 25 VAL HG22 H -1.108 0.462 -4.909 1.00 . A A . 22 VAL HG22 1 1 3 1851 1 1 25 VAL HG23 H -1.220 0.028 -3.203 1.00 . A A . 22 VAL HG23 1 1 3 1852 1 1 25 VAL N N 0.733 3.672 -3.294 1.00 . A A . 22 VAL N 1 1 3 1853 1 1 25 VAL O O -0.528 2.497 -1.016 1.00 . A A . 22 VAL O 1 1 3 1854 1 1 26 GLN C C -3.512 0.984 -0.829 1.00 . A A . 23 GLN C 1 1 3 1855 1 1 26 GLN CA C -3.290 2.426 -1.260 1.00 . A A . 23 GLN CA 1 1 3 1856 1 1 26 GLN CB C -4.581 3.101 -1.716 1.00 . A A . 23 GLN CB 1 1 3 1857 1 1 26 GLN CD C -5.506 5.133 -2.922 1.00 . A A . 23 GLN CD 1 1 3 1858 1 1 26 GLN CG C -4.356 4.548 -2.130 1.00 . A A . 23 GLN CG 1 1 3 1859 1 1 26 GLN H H -2.666 2.473 -3.267 1.00 . A A . 23 GLN H 1 1 3 1860 1 1 26 GLN HA H -2.876 2.976 -0.425 1.00 . A A . 23 GLN HA 1 1 3 1861 1 1 26 GLN HB2 H -4.985 2.559 -2.558 1.00 . A A . 23 GLN HB2 1 1 3 1862 1 1 26 GLN HB3 H -5.294 3.085 -0.906 1.00 . A A . 23 GLN HB3 1 1 3 1863 1 1 26 GLN HE21 H -6.335 5.850 -1.268 1.00 . A A . 23 GLN HE21 1 1 3 1864 1 1 26 GLN HE22 H -7.190 6.162 -2.737 1.00 . A A . 23 GLN HE22 1 1 3 1865 1 1 26 GLN HG2 H -4.218 5.142 -1.240 1.00 . A A . 23 GLN HG2 1 1 3 1866 1 1 26 GLN HG3 H -3.462 4.598 -2.735 1.00 . A A . 23 GLN HG3 1 1 3 1867 1 1 26 GLN N N -2.337 2.469 -2.343 1.00 . A A . 23 GLN N 1 1 3 1868 1 1 26 GLN NE2 N -6.435 5.780 -2.240 1.00 . A A . 23 GLN NE2 1 1 3 1869 1 1 26 GLN O O -4.151 0.194 -1.528 1.00 . A A . 23 GLN O 1 1 3 1870 1 1 26 GLN OE1 O -5.543 5.028 -4.143 1.00 . A A . 23 GLN OE1 1 1 3 1871 1 1 27 THR C C -4.026 -0.880 1.899 1.00 . A A . 24 THR C 1 1 3 1872 1 1 27 THR CA C -2.976 -0.717 0.813 1.00 . A A . 24 THR CA 1 1 3 1873 1 1 27 THR CB C -1.595 -1.116 1.357 1.00 . A A . 24 THR CB 1 1 3 1874 1 1 27 THR CG2 C -0.668 -1.522 0.229 1.00 . A A . 24 THR CG2 1 1 3 1875 1 1 27 THR H H -2.516 1.338 0.855 1.00 . A A . 24 THR H 1 1 3 1876 1 1 27 THR HA H -3.218 -1.371 -0.012 1.00 . A A . 24 THR HA 1 1 3 1877 1 1 27 THR HB H -1.717 -1.957 2.023 1.00 . A A . 24 THR HB 1 1 3 1878 1 1 27 THR HG1 H -0.590 0.578 1.465 1.00 . A A . 24 THR HG1 1 1 3 1879 1 1 27 THR HG21 H -1.114 -2.334 -0.323 1.00 . A A . 24 THR HG21 1 1 3 1880 1 1 27 THR HG22 H 0.276 -1.847 0.643 1.00 . A A . 24 THR HG22 1 1 3 1881 1 1 27 THR HG23 H -0.504 -0.682 -0.426 1.00 . A A . 24 THR HG23 1 1 3 1882 1 1 27 THR N N -2.949 0.644 0.315 1.00 . A A . 24 THR N 1 1 3 1883 1 1 27 THR O O -4.314 0.050 2.641 1.00 . A A . 24 THR O 1 1 3 1884 1 1 27 THR OG1 O -1.018 -0.026 2.081 1.00 . A A . 24 THR OG1 1 1 3 1885 1 1 28 CYS C C -5.186 -2.536 4.313 1.00 . A A . 25 CYS C 1 1 3 1886 1 1 28 CYS CA C -5.698 -2.347 2.894 1.00 . A A . 25 CYS CA 1 1 3 1887 1 1 28 CYS CB C -6.462 -3.596 2.444 1.00 . A A . 25 CYS CB 1 1 3 1888 1 1 28 CYS H H -4.278 -2.788 1.392 1.00 . A A . 25 CYS H 1 1 3 1889 1 1 28 CYS HA H -6.366 -1.502 2.875 1.00 . A A . 25 CYS HA 1 1 3 1890 1 1 28 CYS HB2 H -7.369 -3.692 3.018 1.00 . A A . 25 CYS HB2 1 1 3 1891 1 1 28 CYS HB3 H -6.719 -3.492 1.404 1.00 . A A . 25 CYS HB3 1 1 3 1892 1 1 28 CYS N N -4.599 -2.073 1.975 1.00 . A A . 25 CYS N 1 1 3 1893 1 1 28 CYS O O -5.921 -2.335 5.280 1.00 . A A . 25 CYS O 1 1 3 1894 1 1 28 CYS SG S -5.536 -5.135 2.626 1.00 . A A . 25 CYS SG 1 1 3 1895 1 1 29 SER C C -1.809 -3.112 5.634 1.00 . A A . 26 SER C 1 1 3 1896 1 1 29 SER CA C -3.325 -3.185 5.733 1.00 . A A . 26 SER CA 1 1 3 1897 1 1 29 SER CB C -3.754 -4.556 6.265 1.00 . A A . 26 SER CB 1 1 3 1898 1 1 29 SER H H -3.375 -3.035 3.627 1.00 . A A . 26 SER H 1 1 3 1899 1 1 29 SER HA H -3.667 -2.418 6.412 1.00 . A A . 26 SER HA 1 1 3 1900 1 1 29 SER HB2 H -3.474 -5.318 5.555 1.00 . A A . 26 SER HB2 1 1 3 1901 1 1 29 SER HB3 H -3.258 -4.743 7.205 1.00 . A A . 26 SER HB3 1 1 3 1902 1 1 29 SER HG H -5.582 -3.893 5.984 1.00 . A A . 26 SER HG 1 1 3 1903 1 1 29 SER N N -3.925 -2.927 4.434 1.00 . A A . 26 SER N 1 1 3 1904 1 1 29 SER O O -1.269 -3.105 4.524 1.00 . A A . 26 SER O 1 1 3 1905 1 1 29 SER OG O -5.158 -4.618 6.469 1.00 . A A . 26 SER OG 1 1 3 1906 1 1 30 LEU C C 0.982 -4.127 6.089 1.00 . A A . 27 LEU C 1 1 3 1907 1 1 30 LEU CA C 0.324 -2.944 6.805 1.00 . A A . 27 LEU CA 1 1 3 1908 1 1 30 LEU CB C 0.811 -2.838 8.260 1.00 . A A . 27 LEU CB 1 1 3 1909 1 1 30 LEU CD1 C 3.314 -2.681 7.929 1.00 . A A . 27 LEU CD1 1 1 3 1910 1 1 30 LEU CD2 C 1.933 -0.607 7.918 1.00 . A A . 27 LEU CD2 1 1 3 1911 1 1 30 LEU CG C 2.083 -2.004 8.502 1.00 . A A . 27 LEU CG 1 1 3 1912 1 1 30 LEU H H -1.617 -3.171 7.626 1.00 . A A . 27 LEU H 1 1 3 1913 1 1 30 LEU HA H 0.576 -2.036 6.280 1.00 . A A . 27 LEU HA 1 1 3 1914 1 1 30 LEU HB2 H 0.015 -2.405 8.845 1.00 . A A . 27 LEU HB2 1 1 3 1915 1 1 30 LEU HB3 H 0.993 -3.838 8.624 1.00 . A A . 27 LEU HB3 1 1 3 1916 1 1 30 LEU HD11 H 3.192 -2.805 6.863 1.00 . A A . 27 LEU HD11 1 1 3 1917 1 1 30 LEU HD12 H 3.441 -3.649 8.392 1.00 . A A . 27 LEU HD12 1 1 3 1918 1 1 30 LEU HD13 H 4.182 -2.070 8.123 1.00 . A A . 27 LEU HD13 1 1 3 1919 1 1 30 LEU HD21 H 2.799 -0.015 8.176 1.00 . A A . 27 LEU HD21 1 1 3 1920 1 1 30 LEU HD22 H 1.046 -0.141 8.320 1.00 . A A . 27 LEU HD22 1 1 3 1921 1 1 30 LEU HD23 H 1.851 -0.671 6.843 1.00 . A A . 27 LEU HD23 1 1 3 1922 1 1 30 LEU HG H 2.232 -1.900 9.567 1.00 . A A . 27 LEU HG 1 1 3 1923 1 1 30 LEU N N -1.131 -3.085 6.777 1.00 . A A . 27 LEU N 1 1 3 1924 1 1 30 LEU O O 2.038 -3.982 5.473 1.00 . A A . 27 LEU O 1 1 3 1925 1 1 31 GLU C C 1.006 -6.177 3.956 1.00 . A A . 28 GLU C 1 1 3 1926 1 1 31 GLU CA C 0.807 -6.473 5.443 1.00 . A A . 28 GLU CA 1 1 3 1927 1 1 31 GLU CB C -0.181 -7.625 5.619 1.00 . A A . 28 GLU CB 1 1 3 1928 1 1 31 GLU CD C -0.833 -9.975 4.954 1.00 . A A . 28 GLU CD 1 1 3 1929 1 1 31 GLU CG C 0.236 -8.905 4.908 1.00 . A A . 28 GLU CG 1 1 3 1930 1 1 31 GLU H H -0.484 -5.345 6.686 1.00 . A A . 28 GLU H 1 1 3 1931 1 1 31 GLU HA H 1.756 -6.754 5.871 1.00 . A A . 28 GLU HA 1 1 3 1932 1 1 31 GLU HB2 H -0.280 -7.840 6.672 1.00 . A A . 28 GLU HB2 1 1 3 1933 1 1 31 GLU HB3 H -1.141 -7.321 5.232 1.00 . A A . 28 GLU HB3 1 1 3 1934 1 1 31 GLU HG2 H 0.449 -8.675 3.875 1.00 . A A . 28 GLU HG2 1 1 3 1935 1 1 31 GLU HG3 H 1.129 -9.288 5.381 1.00 . A A . 28 GLU HG3 1 1 3 1936 1 1 31 GLU N N 0.333 -5.285 6.146 1.00 . A A . 28 GLU N 1 1 3 1937 1 1 31 GLU O O 2.045 -6.497 3.384 1.00 . A A . 28 GLU O 1 1 3 1938 1 1 31 GLU OE1 O -1.797 -9.892 4.159 1.00 . A A . 28 GLU OE1 1 1 3 1939 1 1 31 GLU OE2 O -0.721 -10.904 5.782 1.00 . A A . 28 GLU OE2 1 1 3 1940 1 1 32 CYS C C 1.033 -3.974 1.753 1.00 . A A . 29 CYS C 1 1 3 1941 1 1 32 CYS CA C 0.106 -5.175 1.940 1.00 . A A . 29 CYS CA 1 1 3 1942 1 1 32 CYS CB C -1.285 -4.870 1.386 1.00 . A A . 29 CYS CB 1 1 3 1943 1 1 32 CYS H H -0.785 -5.297 3.843 1.00 . A A . 29 CYS H 1 1 3 1944 1 1 32 CYS HA H 0.516 -6.017 1.407 1.00 . A A . 29 CYS HA 1 1 3 1945 1 1 32 CYS HB2 H -1.819 -4.260 2.099 1.00 . A A . 29 CYS HB2 1 1 3 1946 1 1 32 CYS HB3 H -1.184 -4.321 0.465 1.00 . A A . 29 CYS HB3 1 1 3 1947 1 1 32 CYS N N 0.018 -5.537 3.341 1.00 . A A . 29 CYS N 1 1 3 1948 1 1 32 CYS O O 1.642 -3.808 0.696 1.00 . A A . 29 CYS O 1 1 3 1949 1 1 32 CYS SG S -2.304 -6.330 1.053 1.00 . A A . 29 CYS SG 1 1 3 1950 1 1 33 SER C C 3.480 -2.407 2.654 1.00 . A A . 30 SER C 1 1 3 1951 1 1 33 SER CA C 2.019 -1.977 2.752 1.00 . A A . 30 SER CA 1 1 3 1952 1 1 33 SER CB C 1.815 -1.120 4.004 1.00 . A A . 30 SER CB 1 1 3 1953 1 1 33 SER H H 0.627 -3.321 3.604 1.00 . A A . 30 SER H 1 1 3 1954 1 1 33 SER HA H 1.765 -1.394 1.880 1.00 . A A . 30 SER HA 1 1 3 1955 1 1 33 SER HB2 H 2.225 -1.634 4.860 1.00 . A A . 30 SER HB2 1 1 3 1956 1 1 33 SER HB3 H 2.323 -0.174 3.877 1.00 . A A . 30 SER HB3 1 1 3 1957 1 1 33 SER HG H 0.021 -0.553 3.430 1.00 . A A . 30 SER HG 1 1 3 1958 1 1 33 SER N N 1.145 -3.144 2.790 1.00 . A A . 30 SER N 1 1 3 1959 1 1 33 SER O O 4.322 -1.672 2.145 1.00 . A A . 30 SER O 1 1 3 1960 1 1 33 SER OG O 0.438 -0.870 4.242 1.00 . A A . 30 SER OG 1 1 3 1961 1 1 34 LYS C C 5.242 -5.270 2.110 1.00 . A A . 31 LYS C 1 1 3 1962 1 1 34 LYS CA C 5.128 -4.122 3.108 1.00 . A A . 31 LYS CA 1 1 3 1963 1 1 34 LYS CB C 5.559 -4.566 4.506 1.00 . A A . 31 LYS CB 1 1 3 1964 1 1 34 LYS CD C 5.168 -6.027 6.495 1.00 . A A . 31 LYS CD 1 1 3 1965 1 1 34 LYS CE C 4.418 -7.221 7.058 1.00 . A A . 31 LYS CE 1 1 3 1966 1 1 34 LYS CG C 4.774 -5.741 5.059 1.00 . A A . 31 LYS CG 1 1 3 1967 1 1 34 LYS H H 3.061 -4.142 3.555 1.00 . A A . 31 LYS H 1 1 3 1968 1 1 34 LYS HA H 5.773 -3.321 2.784 1.00 . A A . 31 LYS HA 1 1 3 1969 1 1 34 LYS HB2 H 6.602 -4.840 4.477 1.00 . A A . 31 LYS HB2 1 1 3 1970 1 1 34 LYS HB3 H 5.435 -3.732 5.182 1.00 . A A . 31 LYS HB3 1 1 3 1971 1 1 34 LYS HD2 H 6.227 -6.231 6.532 1.00 . A A . 31 LYS HD2 1 1 3 1972 1 1 34 LYS HD3 H 4.946 -5.159 7.098 1.00 . A A . 31 LYS HD3 1 1 3 1973 1 1 34 LYS HE2 H 3.359 -7.021 7.010 1.00 . A A . 31 LYS HE2 1 1 3 1974 1 1 34 LYS HE3 H 4.648 -8.090 6.459 1.00 . A A . 31 LYS HE3 1 1 3 1975 1 1 34 LYS HG2 H 3.720 -5.510 5.021 1.00 . A A . 31 LYS HG2 1 1 3 1976 1 1 34 LYS HG3 H 4.976 -6.614 4.456 1.00 . A A . 31 LYS HG3 1 1 3 1977 1 1 34 LYS HZ1 H 4.573 -6.668 9.064 1.00 . A A . 31 LYS HZ1 1 1 3 1978 1 1 34 LYS HZ2 H 5.810 -7.691 8.539 1.00 . A A . 31 LYS HZ2 1 1 3 1979 1 1 34 LYS HZ3 H 4.266 -8.314 8.828 1.00 . A A . 31 LYS HZ3 1 1 3 1980 1 1 34 LYS N N 3.772 -3.602 3.146 1.00 . A A . 31 LYS N 1 1 3 1981 1 1 34 LYS NZ N 4.793 -7.493 8.468 1.00 . A A . 31 LYS NZ 1 1 3 1982 1 1 34 LYS O O 6.325 -5.809 1.881 1.00 . A A . 31 LYS O 1 1 3 1983 1 1 35 LYS C C 4.857 -6.297 -0.729 1.00 . A A . 32 LYS C 1 1 3 1984 1 1 35 LYS CA C 4.071 -6.689 0.513 1.00 . A A . 32 LYS CA 1 1 3 1985 1 1 35 LYS CB C 2.618 -6.983 0.132 1.00 . A A . 32 LYS CB 1 1 3 1986 1 1 35 LYS CD C 2.689 -9.489 0.024 1.00 . A A . 32 LYS CD 1 1 3 1987 1 1 35 LYS CE C 2.386 -10.719 -0.816 1.00 . A A . 32 LYS CE 1 1 3 1988 1 1 35 LYS CG C 2.437 -8.208 -0.749 1.00 . A A . 32 LYS CG 1 1 3 1989 1 1 35 LYS H H 3.291 -5.143 1.726 1.00 . A A . 32 LYS H 1 1 3 1990 1 1 35 LYS HA H 4.512 -7.571 0.951 1.00 . A A . 32 LYS HA 1 1 3 1991 1 1 35 LYS HB2 H 2.052 -7.136 1.036 1.00 . A A . 32 LYS HB2 1 1 3 1992 1 1 35 LYS HB3 H 2.217 -6.127 -0.392 1.00 . A A . 32 LYS HB3 1 1 3 1993 1 1 35 LYS HD2 H 3.723 -9.518 0.327 1.00 . A A . 32 LYS HD2 1 1 3 1994 1 1 35 LYS HD3 H 2.054 -9.497 0.898 1.00 . A A . 32 LYS HD3 1 1 3 1995 1 1 35 LYS HE2 H 2.524 -11.598 -0.205 1.00 . A A . 32 LYS HE2 1 1 3 1996 1 1 35 LYS HE3 H 1.360 -10.669 -1.146 1.00 . A A . 32 LYS HE3 1 1 3 1997 1 1 35 LYS HG2 H 1.427 -8.221 -1.129 1.00 . A A . 32 LYS HG2 1 1 3 1998 1 1 35 LYS HG3 H 3.133 -8.153 -1.573 1.00 . A A . 32 LYS HG3 1 1 3 1999 1 1 35 LYS HZ1 H 3.036 -11.662 -2.561 1.00 . A A . 32 LYS HZ1 1 1 3 2000 1 1 35 LYS HZ2 H 4.268 -10.883 -1.705 1.00 . A A . 32 LYS HZ2 1 1 3 2001 1 1 35 LYS HZ3 H 3.164 -9.977 -2.607 1.00 . A A . 32 LYS HZ3 1 1 3 2002 1 1 35 LYS N N 4.118 -5.617 1.500 1.00 . A A . 32 LYS N 1 1 3 2003 1 1 35 LYS NZ N 3.275 -10.817 -2.005 1.00 . A A . 32 LYS NZ 1 1 3 2004 1 1 35 LYS O O 5.609 -7.095 -1.286 1.00 . A A . 32 LYS O 1 1 3 2005 1 1 36 HIS C C 6.851 -4.318 -2.091 1.00 . A A . 33 HIS C 1 1 3 2006 1 1 36 HIS CA C 5.362 -4.557 -2.346 1.00 . A A . 33 HIS CA 1 1 3 2007 1 1 36 HIS CB C 4.688 -3.271 -2.862 1.00 . A A . 33 HIS CB 1 1 3 2008 1 1 36 HIS CD2 C 5.837 -1.509 -1.350 1.00 . A A . 33 HIS CD2 1 1 3 2009 1 1 36 HIS CE1 C 4.116 -0.394 -0.699 1.00 . A A . 33 HIS CE1 1 1 3 2010 1 1 36 HIS CG C 4.764 -2.099 -1.921 1.00 . A A . 33 HIS CG 1 1 3 2011 1 1 36 HIS H H 4.107 -4.448 -0.641 1.00 . A A . 33 HIS H 1 1 3 2012 1 1 36 HIS HA H 5.267 -5.321 -3.103 1.00 . A A . 33 HIS HA 1 1 3 2013 1 1 36 HIS HB2 H 5.159 -2.977 -3.787 1.00 . A A . 33 HIS HB2 1 1 3 2014 1 1 36 HIS HB3 H 3.644 -3.477 -3.049 1.00 . A A . 33 HIS HB3 1 1 3 2015 1 1 36 HIS HD1 H 2.734 -1.570 -1.717 1.00 . A A . 33 HIS HD1 1 1 3 2016 1 1 36 HIS HD2 H 6.863 -1.827 -1.464 1.00 . A A . 33 HIS HD2 1 1 3 2017 1 1 36 HIS HE1 H 3.474 0.303 -0.184 1.00 . A A . 33 HIS HE1 1 1 3 2018 1 1 36 HIS N N 4.695 -5.049 -1.147 1.00 . A A . 33 HIS N 1 1 3 2019 1 1 36 HIS ND1 N 3.672 -1.383 -1.493 1.00 . A A . 33 HIS ND1 1 1 3 2020 1 1 36 HIS NE2 N 5.433 -0.420 -0.587 1.00 . A A . 33 HIS NE2 1 1 3 2021 1 1 36 HIS O O 7.634 -4.154 -3.025 1.00 . A A . 33 HIS O 1 1 3 2022 1 1 37 LYS C C 9.566 -5.122 -0.795 1.00 . A A . 34 LYS C 1 1 3 2023 1 1 37 LYS CA C 8.610 -3.989 -0.450 1.00 . A A . 34 LYS CA 1 1 3 2024 1 1 37 LYS CB C 8.692 -3.661 1.044 1.00 . A A . 34 LYS CB 1 1 3 2025 1 1 37 LYS CD C 7.993 -2.138 2.928 1.00 . A A . 34 LYS CD 1 1 3 2026 1 1 37 LYS CE C 7.177 -0.913 3.312 1.00 . A A . 34 LYS CE 1 1 3 2027 1 1 37 LYS CG C 7.872 -2.441 1.444 1.00 . A A . 34 LYS CG 1 1 3 2028 1 1 37 LYS H H 6.609 -4.589 -0.123 1.00 . A A . 34 LYS H 1 1 3 2029 1 1 37 LYS HA H 8.897 -3.115 -1.015 1.00 . A A . 34 LYS HA 1 1 3 2030 1 1 37 LYS HB2 H 8.334 -4.509 1.608 1.00 . A A . 34 LYS HB2 1 1 3 2031 1 1 37 LYS HB3 H 9.723 -3.475 1.306 1.00 . A A . 34 LYS HB3 1 1 3 2032 1 1 37 LYS HD2 H 7.638 -2.987 3.491 1.00 . A A . 34 LYS HD2 1 1 3 2033 1 1 37 LYS HD3 H 9.031 -1.956 3.164 1.00 . A A . 34 LYS HD3 1 1 3 2034 1 1 37 LYS HE2 H 7.557 -0.060 2.770 1.00 . A A . 34 LYS HE2 1 1 3 2035 1 1 37 LYS HE3 H 6.144 -1.080 3.035 1.00 . A A . 34 LYS HE3 1 1 3 2036 1 1 37 LYS HG2 H 8.224 -1.587 0.887 1.00 . A A . 34 LYS HG2 1 1 3 2037 1 1 37 LYS HG3 H 6.834 -2.623 1.205 1.00 . A A . 34 LYS HG3 1 1 3 2038 1 1 37 LYS HZ1 H 6.829 -1.410 5.314 1.00 . A A . 34 LYS HZ1 1 1 3 2039 1 1 37 LYS HZ2 H 6.732 0.245 4.993 1.00 . A A . 34 LYS HZ2 1 1 3 2040 1 1 37 LYS HZ3 H 8.240 -0.514 5.069 1.00 . A A . 34 LYS HZ3 1 1 3 2041 1 1 37 LYS N N 7.244 -4.329 -0.823 1.00 . A A . 34 LYS N 1 1 3 2042 1 1 37 LYS NZ N 7.249 -0.629 4.772 1.00 . A A . 34 LYS NZ 1 1 3 2043 1 1 37 LYS O O 10.756 -4.899 -1.007 1.00 . A A . 34 LYS O 1 1 3 2044 1 1 38 THR C C 9.877 -7.836 -2.636 1.00 . A A . 35 THR C 1 1 3 2045 1 1 38 THR CA C 9.847 -7.505 -1.143 1.00 . A A . 35 THR CA 1 1 3 2046 1 1 38 THR CB C 9.318 -8.716 -0.342 1.00 . A A . 35 THR CB 1 1 3 2047 1 1 38 THR CG2 C 7.991 -9.202 -0.902 1.00 . A A . 35 THR CG2 1 1 3 2048 1 1 38 THR H H 8.062 -6.436 -0.769 1.00 . A A . 35 THR H 1 1 3 2049 1 1 38 THR HA H 10.851 -7.290 -0.813 1.00 . A A . 35 THR HA 1 1 3 2050 1 1 38 THR HB H 9.162 -8.403 0.681 1.00 . A A . 35 THR HB 1 1 3 2051 1 1 38 THR HG1 H 10.558 -9.941 -1.270 1.00 . A A . 35 THR HG1 1 1 3 2052 1 1 38 THR HG21 H 7.637 -10.036 -0.317 1.00 . A A . 35 THR HG21 1 1 3 2053 1 1 38 THR HG22 H 8.125 -9.513 -1.928 1.00 . A A . 35 THR HG22 1 1 3 2054 1 1 38 THR HG23 H 7.269 -8.400 -0.861 1.00 . A A . 35 THR HG23 1 1 3 2055 1 1 38 THR N N 9.031 -6.330 -0.885 1.00 . A A . 35 THR N 1 1 3 2056 1 1 38 THR O O 10.557 -8.769 -3.063 1.00 . A A . 35 THR O 1 1 3 2057 1 1 38 THR OG1 O 10.267 -9.789 -0.363 1.00 . A A . 35 THR OG1 1 1 3 2058 1 1 39 ARG C C 9.533 -6.088 -5.657 1.00 . A A . 36 ARG C 1 1 3 2059 1 1 39 ARG CA C 9.069 -7.304 -4.865 1.00 . A A . 36 ARG CA 1 1 3 2060 1 1 39 ARG CB C 7.643 -7.685 -5.275 1.00 . A A . 36 ARG CB 1 1 3 2061 1 1 39 ARG CD C 5.180 -7.190 -5.075 1.00 . A A . 36 ARG CD 1 1 3 2062 1 1 39 ARG CG C 6.566 -6.932 -4.511 1.00 . A A . 36 ARG CG 1 1 3 2063 1 1 39 ARG CZ C 3.967 -6.646 -7.152 1.00 . A A . 36 ARG CZ 1 1 3 2064 1 1 39 ARG H H 8.647 -6.317 -3.037 1.00 . A A . 36 ARG H 1 1 3 2065 1 1 39 ARG HA H 9.727 -8.131 -5.091 1.00 . A A . 36 ARG HA 1 1 3 2066 1 1 39 ARG HB2 H 7.517 -7.480 -6.327 1.00 . A A . 36 ARG HB2 1 1 3 2067 1 1 39 ARG HB3 H 7.504 -8.741 -5.103 1.00 . A A . 36 ARG HB3 1 1 3 2068 1 1 39 ARG HD2 H 5.105 -8.232 -5.352 1.00 . A A . 36 ARG HD2 1 1 3 2069 1 1 39 ARG HD3 H 4.448 -6.969 -4.313 1.00 . A A . 36 ARG HD3 1 1 3 2070 1 1 39 ARG HE H 5.440 -5.534 -6.357 1.00 . A A . 36 ARG HE 1 1 3 2071 1 1 39 ARG HG2 H 6.585 -7.248 -3.478 1.00 . A A . 36 ARG HG2 1 1 3 2072 1 1 39 ARG HG3 H 6.776 -5.873 -4.567 1.00 . A A . 36 ARG HG3 1 1 3 2073 1 1 39 ARG HH11 H 3.429 -8.407 -6.303 1.00 . A A . 36 ARG HH11 1 1 3 2074 1 1 39 ARG HH12 H 2.550 -7.974 -7.731 1.00 . A A . 36 ARG HH12 1 1 3 2075 1 1 39 ARG HH21 H 4.281 -4.969 -8.246 1.00 . A A . 36 ARG HH21 1 1 3 2076 1 1 39 ARG HH22 H 3.028 -6.017 -8.834 1.00 . A A . 36 ARG HH22 1 1 3 2077 1 1 39 ARG N N 9.144 -7.064 -3.428 1.00 . A A . 36 ARG N 1 1 3 2078 1 1 39 ARG NE N 4.905 -6.366 -6.250 1.00 . A A . 36 ARG NE 1 1 3 2079 1 1 39 ARG NH1 N 3.260 -7.765 -7.054 1.00 . A A . 36 ARG NH1 1 1 3 2080 1 1 39 ARG NH2 N 3.744 -5.813 -8.160 1.00 . A A . 36 ARG NH2 1 1 3 2081 1 1 39 ARG O O 10.308 -6.215 -6.606 1.00 . A A . 36 ARG O 1 1 3 2082 1 1 40 ASP C C 10.504 -2.924 -5.297 1.00 . A A . 37 ASP C 1 1 3 2083 1 1 40 ASP CA C 9.382 -3.687 -5.976 1.00 . A A . 37 ASP CA 1 1 3 2084 1 1 40 ASP CB C 8.145 -2.790 -6.083 1.00 . A A . 37 ASP CB 1 1 3 2085 1 1 40 ASP CG C 7.057 -3.386 -6.953 1.00 . A A . 37 ASP CG 1 1 3 2086 1 1 40 ASP H H 8.528 -4.859 -4.440 1.00 . A A . 37 ASP H 1 1 3 2087 1 1 40 ASP HA H 9.700 -3.961 -6.970 1.00 . A A . 37 ASP HA 1 1 3 2088 1 1 40 ASP HB2 H 7.739 -2.632 -5.095 1.00 . A A . 37 ASP HB2 1 1 3 2089 1 1 40 ASP HB3 H 8.434 -1.839 -6.503 1.00 . A A . 37 ASP HB3 1 1 3 2090 1 1 40 ASP N N 9.077 -4.912 -5.252 1.00 . A A . 37 ASP N 1 1 3 2091 1 1 40 ASP O O 10.911 -1.861 -5.763 1.00 . A A . 37 ASP O 1 1 3 2092 1 1 40 ASP OD1 O 7.116 -3.210 -8.189 1.00 . A A . 37 ASP OD1 1 1 3 2093 1 1 40 ASP OD2 O 6.129 -4.021 -6.408 1.00 . A A . 37 ASP OD2 1 1 3 2094 1 1 41 ASN C C 11.685 -1.525 -2.868 1.00 . A A . 38 ASN C 1 1 3 2095 1 1 41 ASN CA C 12.070 -2.896 -3.397 1.00 . A A . 38 ASN CA 1 1 3 2096 1 1 41 ASN CB C 13.355 -2.807 -4.216 1.00 . A A . 38 ASN CB 1 1 3 2097 1 1 41 ASN CG C 14.088 -4.128 -4.300 1.00 . A A . 38 ASN CG 1 1 3 2098 1 1 41 ASN H H 10.610 -4.337 -3.887 1.00 . A A . 38 ASN H 1 1 3 2099 1 1 41 ASN HA H 12.243 -3.549 -2.556 1.00 . A A . 38 ASN HA 1 1 3 2100 1 1 41 ASN HB2 H 13.105 -2.496 -5.218 1.00 . A A . 38 ASN HB2 1 1 3 2101 1 1 41 ASN HB3 H 14.007 -2.077 -3.766 1.00 . A A . 38 ASN HB3 1 1 3 2102 1 1 41 ASN HD21 H 15.832 -3.180 -4.341 1.00 . A A . 38 ASN HD21 1 1 3 2103 1 1 41 ASN HD22 H 15.910 -4.905 -4.410 1.00 . A A . 38 ASN HD22 1 1 3 2104 1 1 41 ASN N N 10.990 -3.488 -4.186 1.00 . A A . 38 ASN N 1 1 3 2105 1 1 41 ASN ND2 N 15.408 -4.065 -4.356 1.00 . A A . 38 ASN ND2 1 1 3 2106 1 1 41 ASN O O 11.897 -0.506 -3.522 1.00 . A A . 38 ASN O 1 1 3 2107 1 1 41 ASN OD1 O 13.477 -5.195 -4.303 1.00 . A A . 38 ASN OD1 1 1 3 2108 1 1 42 CYS C C 10.931 -0.190 0.387 1.00 . A A . 39 CYS C 1 1 3 2109 1 1 42 CYS CA C 10.643 -0.257 -1.107 1.00 . A A . 39 CYS CA 1 1 3 2110 1 1 42 CYS CB C 9.146 -0.134 -1.372 1.00 . A A . 39 CYS CB 1 1 3 2111 1 1 42 CYS H H 11.067 -2.324 -1.150 1.00 . A A . 39 CYS H 1 1 3 2112 1 1 42 CYS HA H 11.154 0.556 -1.599 1.00 . A A . 39 CYS HA 1 1 3 2113 1 1 42 CYS HB2 H 8.972 -0.174 -2.436 1.00 . A A . 39 CYS HB2 1 1 3 2114 1 1 42 CYS HB3 H 8.637 -0.962 -0.903 1.00 . A A . 39 CYS HB3 1 1 3 2115 1 1 42 CYS N N 11.133 -1.496 -1.673 1.00 . A A . 39 CYS N 1 1 3 2116 1 1 42 CYS O O 10.777 -1.174 1.109 1.00 . A A . 39 CYS O 1 1 3 2117 1 1 42 CYS SG S 8.399 1.391 -0.758 1.00 . A A . 39 CYS SG 1 1 3 2118 1 1 43 SER C C 10.371 1.595 2.976 1.00 . A A . 40 SER C 1 1 3 2119 1 1 43 SER CA C 11.644 1.206 2.238 1.00 . A A . 40 SER CA 1 1 3 2120 1 1 43 SER CB C 12.684 2.314 2.379 1.00 . A A . 40 SER CB 1 1 3 2121 1 1 43 SER H H 11.545 1.696 0.195 1.00 . A A . 40 SER H 1 1 3 2122 1 1 43 SER HA H 12.036 0.295 2.661 1.00 . A A . 40 SER HA 1 1 3 2123 1 1 43 SER HB2 H 12.801 2.570 3.422 1.00 . A A . 40 SER HB2 1 1 3 2124 1 1 43 SER HB3 H 13.629 1.973 1.983 1.00 . A A . 40 SER HB3 1 1 3 2125 1 1 43 SER HG H 13.065 3.961 1.378 1.00 . A A . 40 SER HG 1 1 3 2126 1 1 43 SER N N 11.372 0.974 0.833 1.00 . A A . 40 SER N 1 1 3 2127 1 1 43 SER O O 10.206 1.305 4.161 1.00 . A A . 40 SER O 1 1 3 2128 1 1 43 SER OG O 12.279 3.473 1.663 1.00 . A A . 40 SER OG 1 1 3 2129 1 1 44 GLY C C 8.600 3.961 3.756 1.00 . A A . 41 GLY C 1 1 3 2130 1 1 44 GLY CA C 8.269 2.789 2.858 1.00 . A A . 41 GLY CA 1 1 3 2131 1 1 44 GLY H H 9.604 2.333 1.282 1.00 . A A . 41 GLY H 1 1 3 2132 1 1 44 GLY HA2 H 7.592 3.115 2.082 1.00 . A A . 41 GLY HA2 1 1 3 2133 1 1 44 GLY HA3 H 7.789 2.021 3.445 1.00 . A A . 41 GLY HA3 1 1 3 2134 1 1 44 GLY N N 9.462 2.239 2.247 1.00 . A A . 41 GLY N 1 1 3 2135 1 1 44 GLY O O 7.862 4.275 4.686 1.00 . A A . 41 GLY O 1 1 3 2136 1 1 45 GLN C C 10.668 6.866 3.439 1.00 . A A . 42 GLN C 1 1 3 2137 1 1 45 GLN CA C 10.246 5.680 4.301 1.00 . A A . 42 GLN CA 1 1 3 2138 1 1 45 GLN CB C 11.448 5.157 5.097 1.00 . A A . 42 GLN CB 1 1 3 2139 1 1 45 GLN CD C 12.399 3.207 6.409 1.00 . A A . 42 GLN CD 1 1 3 2140 1 1 45 GLN CG C 11.148 3.905 5.908 1.00 . A A . 42 GLN CG 1 1 3 2141 1 1 45 GLN H H 10.202 4.378 2.642 1.00 . A A . 42 GLN H 1 1 3 2142 1 1 45 GLN HA H 9.472 5.991 4.983 1.00 . A A . 42 GLN HA 1 1 3 2143 1 1 45 GLN HB2 H 12.250 4.932 4.411 1.00 . A A . 42 GLN HB2 1 1 3 2144 1 1 45 GLN HB3 H 11.775 5.930 5.777 1.00 . A A . 42 GLN HB3 1 1 3 2145 1 1 45 GLN HE21 H 13.358 4.940 6.550 1.00 . A A . 42 GLN HE21 1 1 3 2146 1 1 45 GLN HE22 H 14.261 3.539 7.009 1.00 . A A . 42 GLN HE22 1 1 3 2147 1 1 45 GLN HG2 H 10.545 4.180 6.760 1.00 . A A . 42 GLN HG2 1 1 3 2148 1 1 45 GLN HG3 H 10.596 3.216 5.286 1.00 . A A . 42 GLN HG3 1 1 3 2149 1 1 45 GLN N N 9.717 4.616 3.458 1.00 . A A . 42 GLN N 1 1 3 2150 1 1 45 GLN NE2 N 13.444 3.971 6.683 1.00 . A A . 42 GLN NE2 1 1 3 2151 1 1 45 GLN O O 11.708 7.477 3.677 1.00 . A A . 42 GLN O 1 1 3 2152 1 1 45 GLN OE1 O 12.422 1.984 6.552 1.00 . A A . 42 GLN OE1 1 1 3 2153 1 1 46 THR C C 11.535 8.078 0.858 1.00 . A A . 43 THR C 1 1 3 2154 1 1 46 THR CA C 10.127 8.219 1.450 1.00 . A A . 43 THR CA 1 1 3 2155 1 1 46 THR CB C 9.914 9.655 1.990 1.00 . A A . 43 THR CB 1 1 3 2156 1 1 46 THR CG2 C 8.432 9.980 2.078 1.00 . A A . 43 THR CG2 1 1 3 2157 1 1 46 THR H H 8.968 6.736 2.413 1.00 . A A . 43 THR H 1 1 3 2158 1 1 46 THR HA H 9.420 8.074 0.644 1.00 . A A . 43 THR HA 1 1 3 2159 1 1 46 THR HB H 10.372 10.346 1.299 1.00 . A A . 43 THR HB 1 1 3 2160 1 1 46 THR HG1 H 10.895 8.975 3.575 1.00 . A A . 43 THR HG1 1 1 3 2161 1 1 46 THR HG21 H 7.967 9.341 2.812 1.00 . A A . 43 THR HG21 1 1 3 2162 1 1 46 THR HG22 H 7.970 9.815 1.114 1.00 . A A . 43 THR HG22 1 1 3 2163 1 1 46 THR HG23 H 8.305 11.014 2.366 1.00 . A A . 43 THR HG23 1 1 3 2164 1 1 46 THR N N 9.832 7.191 2.454 1.00 . A A . 43 THR N 1 1 3 2165 1 1 46 THR O O 11.758 7.231 -0.007 1.00 . A A . 43 THR O 1 1 3 2166 1 1 46 THR OG1 O 10.525 9.821 3.279 1.00 . A A . 43 THR OG1 1 1 3 2167 1 1 47 HIS C C 13.920 9.435 -0.590 1.00 . A A . 44 HIS C 1 1 3 2168 1 1 47 HIS CA C 13.852 8.918 0.848 1.00 . A A . 44 HIS CA 1 1 3 2169 1 1 47 HIS CB C 14.503 7.532 0.955 1.00 . A A . 44 HIS CB 1 1 3 2170 1 1 47 HIS CD2 C 17.060 7.933 1.100 1.00 . A A . 44 HIS CD2 1 1 3 2171 1 1 47 HIS CE1 C 17.628 7.087 -0.837 1.00 . A A . 44 HIS CE1 1 1 3 2172 1 1 47 HIS CG C 15.929 7.499 0.498 1.00 . A A . 44 HIS CG 1 1 3 2173 1 1 47 HIS H H 12.221 9.530 2.051 1.00 . A A . 44 HIS H 1 1 3 2174 1 1 47 HIS HA H 14.403 9.603 1.477 1.00 . A A . 44 HIS HA 1 1 3 2175 1 1 47 HIS HB2 H 14.478 7.208 1.985 1.00 . A A . 44 HIS HB2 1 1 3 2176 1 1 47 HIS HB3 H 13.943 6.832 0.350 1.00 . A A . 44 HIS HB3 1 1 3 2177 1 1 47 HIS HD1 H 15.720 6.579 -1.401 1.00 . A A . 44 HIS HD1 1 1 3 2178 1 1 47 HIS HD2 H 17.128 8.401 2.070 1.00 . A A . 44 HIS HD2 1 1 3 2179 1 1 47 HIS HE1 H 18.213 6.763 -1.686 1.00 . A A . 44 HIS HE1 1 1 3 2180 1 1 47 HIS HE2 H 19.055 7.746 0.474 1.00 . A A . 44 HIS HE2 1 1 3 2181 1 1 47 HIS N N 12.470 8.901 1.339 1.00 . A A . 44 HIS N 1 1 3 2182 1 1 47 HIS ND1 N 16.321 6.976 -0.715 1.00 . A A . 44 HIS ND1 1 1 3 2183 1 1 47 HIS NE2 N 18.101 7.664 0.249 1.00 . A A . 44 HIS NE2 1 1 3 2184 1 1 47 HIS O O 14.321 10.574 -0.832 1.00 . A A . 44 HIS O 1 1 3 2185 1 1 48 ASP C C 12.326 8.464 -3.659 1.00 . A A . 45 ASP C 1 1 3 2186 1 1 48 ASP CA C 13.562 8.985 -2.943 1.00 . A A . 45 ASP CA 1 1 3 2187 1 1 48 ASP CB C 14.846 8.484 -3.625 1.00 . A A . 45 ASP CB 1 1 3 2188 1 1 48 ASP CG C 14.897 6.980 -3.826 1.00 . A A . 45 ASP CG 1 1 3 2189 1 1 48 ASP H H 13.173 7.720 -1.295 1.00 . A A . 45 ASP H 1 1 3 2190 1 1 48 ASP HA H 13.547 10.065 -2.985 1.00 . A A . 45 ASP HA 1 1 3 2191 1 1 48 ASP HB2 H 14.933 8.951 -4.593 1.00 . A A . 45 ASP HB2 1 1 3 2192 1 1 48 ASP HB3 H 15.695 8.773 -3.020 1.00 . A A . 45 ASP HB3 1 1 3 2193 1 1 48 ASP N N 13.522 8.608 -1.542 1.00 . A A . 45 ASP N 1 1 3 2194 1 1 48 ASP O O 12.088 7.241 -3.642 1.00 . A A . 45 ASP O 1 1 3 2195 1 1 48 ASP OXT O 11.581 9.288 -4.222 1.00 . A A . 45 ASP OXT 1 1 3 2196 1 1 48 ASP OD1 O 14.983 6.240 -2.824 1.00 . A A . 45 ASP OD1 1 1 3 2197 1 1 48 ASP OD2 O 14.873 6.535 -4.993 1.00 . A A . 45 ASP OD2 1 1 3 2198 2 2 1 ZN ZN ZN -4.462 -5.634 0.655 1.00 . B A . 101 ZN ZN 1 1 3 2199 3 2 1 ZN ZN ZN 6.153 1.339 -1.223 1.00 . C A . 102 ZN ZN 1 1 4 2200 1 1 1 GLY C C -19.706 5.526 1.217 1.00 . A A . -2 GLY C 1 1 4 2201 1 1 1 GLY CA C -19.644 4.780 2.533 1.00 . A A . -2 GLY CA 1 1 4 2202 1 1 1 GLY H1 H -19.854 2.862 1.755 1.00 . A A . -2 GLY H1 1 1 4 2203 1 1 1 GLY H2 H -21.318 3.603 2.154 1.00 . A A . -2 GLY H2 1 1 4 2204 1 1 1 GLY H3 H -20.319 2.997 3.375 1.00 . A A . -2 GLY H3 1 1 4 2205 1 1 1 GLY HA2 H -20.118 5.378 3.296 1.00 . A A . -2 GLY HA2 1 1 4 2206 1 1 1 GLY HA3 H -18.610 4.620 2.800 1.00 . A A . -2 GLY HA3 1 1 4 2207 1 1 1 GLY N N -20.330 3.469 2.449 1.00 . A A . -2 GLY N 1 1 4 2208 1 1 1 GLY O O -20.612 5.288 0.419 1.00 . A A . -2 GLY O 1 1 4 2209 1 1 2 PRO C C -18.567 6.281 -1.508 1.00 . A A . -1 PRO C 1 1 4 2210 1 1 2 PRO CA C -18.706 7.194 -0.295 1.00 . A A . -1 PRO CA 1 1 4 2211 1 1 2 PRO CB C -17.454 8.064 -0.146 1.00 . A A . -1 PRO CB 1 1 4 2212 1 1 2 PRO CD C -17.667 6.812 1.872 1.00 . A A . -1 PRO CD 1 1 4 2213 1 1 2 PRO CG C -17.201 8.127 1.318 1.00 . A A . -1 PRO CG 1 1 4 2214 1 1 2 PRO HA H -19.574 7.824 -0.418 1.00 . A A . -1 PRO HA 1 1 4 2215 1 1 2 PRO HB2 H -16.629 7.604 -0.671 1.00 . A A . -1 PRO HB2 1 1 4 2216 1 1 2 PRO HB3 H -17.643 9.045 -0.556 1.00 . A A . -1 PRO HB3 1 1 4 2217 1 1 2 PRO HD2 H -16.871 6.085 1.842 1.00 . A A . -1 PRO HD2 1 1 4 2218 1 1 2 PRO HD3 H -18.032 6.935 2.880 1.00 . A A . -1 PRO HD3 1 1 4 2219 1 1 2 PRO HG2 H -16.146 8.260 1.506 1.00 . A A . -1 PRO HG2 1 1 4 2220 1 1 2 PRO HG3 H -17.767 8.938 1.752 1.00 . A A . -1 PRO HG3 1 1 4 2221 1 1 2 PRO N N -18.759 6.439 0.960 1.00 . A A . -1 PRO N 1 1 4 2222 1 1 2 PRO O O -17.822 5.304 -1.473 1.00 . A A . -1 PRO O 1 1 4 2223 1 1 3 HIS C C -18.018 6.166 -4.655 1.00 . A A . 0 HIS C 1 1 4 2224 1 1 3 HIS CA C -19.232 5.803 -3.800 1.00 . A A . 0 HIS CA 1 1 4 2225 1 1 3 HIS CB C -20.536 5.945 -4.605 1.00 . A A . 0 HIS CB 1 1 4 2226 1 1 3 HIS CD2 C -21.582 8.310 -4.371 1.00 . A A . 0 HIS CD2 1 1 4 2227 1 1 3 HIS CE1 C -20.938 9.137 -6.290 1.00 . A A . 0 HIS CE1 1 1 4 2228 1 1 3 HIS CG C -20.875 7.349 -5.011 1.00 . A A . 0 HIS CG 1 1 4 2229 1 1 3 HIS H H -19.821 7.422 -2.561 1.00 . A A . 0 HIS H 1 1 4 2230 1 1 3 HIS HA H -19.129 4.772 -3.494 1.00 . A A . 0 HIS HA 1 1 4 2231 1 1 3 HIS HB2 H -20.455 5.356 -5.506 1.00 . A A . 0 HIS HB2 1 1 4 2232 1 1 3 HIS HB3 H -21.355 5.565 -4.010 1.00 . A A . 0 HIS HB3 1 1 4 2233 1 1 3 HIS HD1 H -19.960 7.451 -6.908 1.00 . A A . 0 HIS HD1 1 1 4 2234 1 1 3 HIS HD2 H -22.045 8.224 -3.398 1.00 . A A . 0 HIS HD2 1 1 4 2235 1 1 3 HIS HE1 H -20.787 9.810 -7.121 1.00 . A A . 0 HIS HE1 1 1 4 2236 1 1 3 HIS HE2 H -21.871 10.316 -4.907 1.00 . A A . 0 HIS HE2 1 1 4 2237 1 1 3 HIS N N -19.269 6.611 -2.583 1.00 . A A . 0 HIS N 1 1 4 2238 1 1 3 HIS ND1 N -20.489 7.901 -6.211 1.00 . A A . 0 HIS ND1 1 1 4 2239 1 1 3 HIS NE2 N -21.605 9.411 -5.189 1.00 . A A . 0 HIS NE2 1 1 4 2240 1 1 3 HIS O O -18.088 6.214 -5.884 1.00 . A A . 0 HIS O 1 1 4 2241 1 1 4 MET C C -14.516 6.095 -3.837 1.00 . A A . 1 MET C 1 1 4 2242 1 1 4 MET CA C -15.648 6.722 -4.633 1.00 . A A . 1 MET CA 1 1 4 2243 1 1 4 MET CB C -15.438 8.232 -4.759 1.00 . A A . 1 MET CB 1 1 4 2244 1 1 4 MET CE C -16.391 11.286 -4.624 1.00 . A A . 1 MET CE 1 1 4 2245 1 1 4 MET CG C -15.422 8.974 -3.429 1.00 . A A . 1 MET CG 1 1 4 2246 1 1 4 MET H H -16.938 6.384 -3.000 1.00 . A A . 1 MET H 1 1 4 2247 1 1 4 MET HA H -15.668 6.281 -5.619 1.00 . A A . 1 MET HA 1 1 4 2248 1 1 4 MET HB2 H -14.498 8.406 -5.254 1.00 . A A . 1 MET HB2 1 1 4 2249 1 1 4 MET HB3 H -16.234 8.637 -5.363 1.00 . A A . 1 MET HB3 1 1 4 2250 1 1 4 MET HE1 H -17.322 11.077 -4.119 1.00 . A A . 1 MET HE1 1 1 4 2251 1 1 4 MET HE2 H -16.372 10.773 -5.574 1.00 . A A . 1 MET HE2 1 1 4 2252 1 1 4 MET HE3 H -16.303 12.350 -4.789 1.00 . A A . 1 MET HE3 1 1 4 2253 1 1 4 MET HG2 H -16.395 8.887 -2.971 1.00 . A A . 1 MET HG2 1 1 4 2254 1 1 4 MET HG3 H -14.683 8.516 -2.789 1.00 . A A . 1 MET HG3 1 1 4 2255 1 1 4 MET N N -16.909 6.419 -3.981 1.00 . A A . 1 MET N 1 1 4 2256 1 1 4 MET O O -13.431 6.663 -3.691 1.00 . A A . 1 MET O 1 1 4 2257 1 1 4 MET SD S -15.024 10.725 -3.612 1.00 . A A . 1 MET SD 1 1 4 2258 1 1 5 ALA C C -12.859 3.469 -3.414 1.00 . A A . 2 ALA C 1 1 4 2259 1 1 5 ALA CA C -13.837 4.189 -2.513 1.00 . A A . 2 ALA CA 1 1 4 2260 1 1 5 ALA CB C -14.536 3.199 -1.598 1.00 . A A . 2 ALA CB 1 1 4 2261 1 1 5 ALA H H -15.669 4.526 -3.474 1.00 . A A . 2 ALA H 1 1 4 2262 1 1 5 ALA HA H -13.297 4.897 -1.901 1.00 . A A . 2 ALA HA 1 1 4 2263 1 1 5 ALA HB1 H -15.039 2.453 -2.192 1.00 . A A . 2 ALA HB1 1 1 4 2264 1 1 5 ALA HB2 H -15.256 3.721 -0.987 1.00 . A A . 2 ALA HB2 1 1 4 2265 1 1 5 ALA HB3 H -13.804 2.721 -0.964 1.00 . A A . 2 ALA HB3 1 1 4 2266 1 1 5 ALA N N -14.796 4.920 -3.307 1.00 . A A . 2 ALA N 1 1 4 2267 1 1 5 ALA O O -13.169 3.150 -4.566 1.00 . A A . 2 ALA O 1 1 4 2268 1 1 6 VAL C C -10.236 1.259 -3.029 1.00 . A A . 3 VAL C 1 1 4 2269 1 1 6 VAL CA C -10.631 2.587 -3.657 1.00 . A A . 3 VAL CA 1 1 4 2270 1 1 6 VAL CB C -9.399 3.510 -3.759 1.00 . A A . 3 VAL CB 1 1 4 2271 1 1 6 VAL CG1 C -8.310 2.864 -4.599 1.00 . A A . 3 VAL CG1 1 1 4 2272 1 1 6 VAL CG2 C -9.792 4.862 -4.338 1.00 . A A . 3 VAL CG2 1 1 4 2273 1 1 6 VAL H H -11.527 3.447 -1.952 1.00 . A A . 3 VAL H 1 1 4 2274 1 1 6 VAL HA H -11.005 2.408 -4.653 1.00 . A A . 3 VAL HA 1 1 4 2275 1 1 6 VAL HB H -9.009 3.668 -2.765 1.00 . A A . 3 VAL HB 1 1 4 2276 1 1 6 VAL HG11 H -8.687 2.672 -5.593 1.00 . A A . 3 VAL HG11 1 1 4 2277 1 1 6 VAL HG12 H -8.011 1.933 -4.140 1.00 . A A . 3 VAL HG12 1 1 4 2278 1 1 6 VAL HG13 H -7.459 3.527 -4.657 1.00 . A A . 3 VAL HG13 1 1 4 2279 1 1 6 VAL HG21 H -10.553 5.312 -3.716 1.00 . A A . 3 VAL HG21 1 1 4 2280 1 1 6 VAL HG22 H -10.178 4.727 -5.338 1.00 . A A . 3 VAL HG22 1 1 4 2281 1 1 6 VAL HG23 H -8.926 5.507 -4.370 1.00 . A A . 3 VAL HG23 1 1 4 2282 1 1 6 VAL N N -11.686 3.216 -2.889 1.00 . A A . 3 VAL N 1 1 4 2283 1 1 6 VAL O O -10.071 1.162 -1.812 1.00 . A A . 3 VAL O 1 1 4 2284 1 1 7 LEU C C -8.153 -1.065 -3.274 1.00 . A A . 4 LEU C 1 1 4 2285 1 1 7 LEU CA C -9.667 -1.064 -3.407 1.00 . A A . 4 LEU CA 1 1 4 2286 1 1 7 LEU CB C -10.107 -2.169 -4.373 1.00 . A A . 4 LEU CB 1 1 4 2287 1 1 7 LEU CD1 C -11.941 -3.442 -5.510 1.00 . A A . 4 LEU CD1 1 1 4 2288 1 1 7 LEU CD2 C -12.007 -3.120 -3.034 1.00 . A A . 4 LEU CD2 1 1 4 2289 1 1 7 LEU CG C -11.602 -2.500 -4.366 1.00 . A A . 4 LEU CG 1 1 4 2290 1 1 7 LEU H H -10.337 0.361 -4.810 1.00 . A A . 4 LEU H 1 1 4 2291 1 1 7 LEU HA H -10.102 -1.249 -2.436 1.00 . A A . 4 LEU HA 1 1 4 2292 1 1 7 LEU HB2 H -9.833 -1.871 -5.374 1.00 . A A . 4 LEU HB2 1 1 4 2293 1 1 7 LEU HB3 H -9.563 -3.069 -4.126 1.00 . A A . 4 LEU HB3 1 1 4 2294 1 1 7 LEU HD11 H -11.686 -2.975 -6.449 1.00 . A A . 4 LEU HD11 1 1 4 2295 1 1 7 LEU HD12 H -12.998 -3.662 -5.493 1.00 . A A . 4 LEU HD12 1 1 4 2296 1 1 7 LEU HD13 H -11.380 -4.358 -5.400 1.00 . A A . 4 LEU HD13 1 1 4 2297 1 1 7 LEU HD21 H -11.851 -2.404 -2.240 1.00 . A A . 4 LEU HD21 1 1 4 2298 1 1 7 LEU HD22 H -11.404 -4.000 -2.845 1.00 . A A . 4 LEU HD22 1 1 4 2299 1 1 7 LEU HD23 H -13.049 -3.399 -3.067 1.00 . A A . 4 LEU HD23 1 1 4 2300 1 1 7 LEU HG H -12.168 -1.590 -4.500 1.00 . A A . 4 LEU HG 1 1 4 2301 1 1 7 LEU N N -10.122 0.235 -3.861 1.00 . A A . 4 LEU N 1 1 4 2302 1 1 7 LEU O O -7.461 -0.290 -3.936 1.00 . A A . 4 LEU O 1 1 4 2303 1 1 8 CYS C C -5.466 -2.256 -3.466 1.00 . A A . 5 CYS C 1 1 4 2304 1 1 8 CYS CA C -6.236 -2.081 -2.158 1.00 . A A . 5 CYS CA 1 1 4 2305 1 1 8 CYS CB C -6.032 -3.295 -1.260 1.00 . A A . 5 CYS CB 1 1 4 2306 1 1 8 CYS H H -8.292 -2.474 -1.883 1.00 . A A . 5 CYS H 1 1 4 2307 1 1 8 CYS HA H -5.879 -1.199 -1.650 1.00 . A A . 5 CYS HA 1 1 4 2308 1 1 8 CYS HB2 H -6.617 -3.165 -0.366 1.00 . A A . 5 CYS HB2 1 1 4 2309 1 1 8 CYS HB3 H -6.384 -4.172 -1.781 1.00 . A A . 5 CYS HB3 1 1 4 2310 1 1 8 CYS N N -7.662 -1.924 -2.399 1.00 . A A . 5 CYS N 1 1 4 2311 1 1 8 CYS O O -5.817 -3.088 -4.298 1.00 . A A . 5 CYS O 1 1 4 2312 1 1 8 CYS SG S -4.326 -3.609 -0.755 1.00 . A A . 5 CYS SG 1 1 4 2313 1 1 9 GLY C C -2.812 -2.797 -4.970 1.00 . A A . 6 GLY C 1 1 4 2314 1 1 9 GLY CA C -3.618 -1.520 -4.844 1.00 . A A . 6 GLY CA 1 1 4 2315 1 1 9 GLY H H -4.179 -0.827 -2.920 1.00 . A A . 6 GLY H 1 1 4 2316 1 1 9 GLY HA2 H -4.278 -1.441 -5.694 1.00 . A A . 6 GLY HA2 1 1 4 2317 1 1 9 GLY HA3 H -2.941 -0.679 -4.850 1.00 . A A . 6 GLY HA3 1 1 4 2318 1 1 9 GLY N N -4.411 -1.470 -3.630 1.00 . A A . 6 GLY N 1 1 4 2319 1 1 9 GLY O O -2.331 -3.131 -6.052 1.00 . A A . 6 GLY O 1 1 4 2320 1 1 10 VAL C C -2.823 -5.959 -4.068 1.00 . A A . 7 VAL C 1 1 4 2321 1 1 10 VAL CA C -1.902 -4.754 -3.866 1.00 . A A . 7 VAL CA 1 1 4 2322 1 1 10 VAL CB C -1.091 -4.927 -2.564 1.00 . A A . 7 VAL CB 1 1 4 2323 1 1 10 VAL CG1 C -0.390 -6.277 -2.534 1.00 . A A . 7 VAL CG1 1 1 4 2324 1 1 10 VAL CG2 C -0.081 -3.798 -2.415 1.00 . A A . 7 VAL CG2 1 1 4 2325 1 1 10 VAL H H -3.038 -3.178 -3.027 1.00 . A A . 7 VAL H 1 1 4 2326 1 1 10 VAL HA H -1.204 -4.712 -4.691 1.00 . A A . 7 VAL HA 1 1 4 2327 1 1 10 VAL HB H -1.774 -4.882 -1.729 1.00 . A A . 7 VAL HB 1 1 4 2328 1 1 10 VAL HG11 H -1.125 -7.064 -2.616 1.00 . A A . 7 VAL HG11 1 1 4 2329 1 1 10 VAL HG12 H 0.150 -6.384 -1.605 1.00 . A A . 7 VAL HG12 1 1 4 2330 1 1 10 VAL HG13 H 0.300 -6.342 -3.361 1.00 . A A . 7 VAL HG13 1 1 4 2331 1 1 10 VAL HG21 H 0.463 -3.920 -1.489 1.00 . A A . 7 VAL HG21 1 1 4 2332 1 1 10 VAL HG22 H -0.598 -2.850 -2.407 1.00 . A A . 7 VAL HG22 1 1 4 2333 1 1 10 VAL HG23 H 0.611 -3.823 -3.244 1.00 . A A . 7 VAL HG23 1 1 4 2334 1 1 10 VAL N N -2.651 -3.506 -3.863 1.00 . A A . 7 VAL N 1 1 4 2335 1 1 10 VAL O O -2.819 -6.576 -5.132 1.00 . A A . 7 VAL O 1 1 4 2336 1 1 11 CYS C C -5.792 -7.201 -3.778 1.00 . A A . 8 CYS C 1 1 4 2337 1 1 11 CYS CA C -4.448 -7.485 -3.110 1.00 . A A . 8 CYS CA 1 1 4 2338 1 1 11 CYS CB C -4.652 -8.066 -1.708 1.00 . A A . 8 CYS CB 1 1 4 2339 1 1 11 CYS H H -3.670 -5.696 -2.280 1.00 . A A . 8 CYS H 1 1 4 2340 1 1 11 CYS HA H -3.918 -8.209 -3.712 1.00 . A A . 8 CYS HA 1 1 4 2341 1 1 11 CYS HB2 H -5.144 -9.023 -1.793 1.00 . A A . 8 CYS HB2 1 1 4 2342 1 1 11 CYS HB3 H -3.687 -8.205 -1.241 1.00 . A A . 8 CYS HB3 1 1 4 2343 1 1 11 CYS N N -3.627 -6.279 -3.058 1.00 . A A . 8 CYS N 1 1 4 2344 1 1 11 CYS O O -6.339 -8.037 -4.494 1.00 . A A . 8 CYS O 1 1 4 2345 1 1 11 CYS SG S -5.652 -7.038 -0.605 1.00 . A A . 8 CYS SG 1 1 4 2346 1 1 12 GLY C C -8.771 -6.224 -3.830 1.00 . A A . 9 GLY C 1 1 4 2347 1 1 12 GLY CA C -7.490 -5.520 -4.217 1.00 . A A . 9 GLY CA 1 1 4 2348 1 1 12 GLY H H -5.852 -5.423 -2.893 1.00 . A A . 9 GLY H 1 1 4 2349 1 1 12 GLY HA2 H -7.603 -4.471 -4.001 1.00 . A A . 9 GLY HA2 1 1 4 2350 1 1 12 GLY HA3 H -7.340 -5.637 -5.278 1.00 . A A . 9 GLY HA3 1 1 4 2351 1 1 12 GLY N N -6.302 -6.001 -3.534 1.00 . A A . 9 GLY N 1 1 4 2352 1 1 12 GLY O O -9.725 -6.220 -4.600 1.00 . A A . 9 GLY O 1 1 4 2353 1 1 13 ILE C C -10.893 -6.757 -1.289 1.00 . A A . 10 ILE C 1 1 4 2354 1 1 13 ILE CA C -10.007 -7.555 -2.243 1.00 . A A . 10 ILE CA 1 1 4 2355 1 1 13 ILE CB C -9.637 -8.927 -1.634 1.00 . A A . 10 ILE CB 1 1 4 2356 1 1 13 ILE CD1 C -8.779 -8.141 0.635 1.00 . A A . 10 ILE CD1 1 1 4 2357 1 1 13 ILE CG1 C -8.449 -8.811 -0.677 1.00 . A A . 10 ILE CG1 1 1 4 2358 1 1 13 ILE CG2 C -9.328 -9.926 -2.738 1.00 . A A . 10 ILE CG2 1 1 4 2359 1 1 13 ILE H H -8.065 -6.720 -2.022 1.00 . A A . 10 ILE H 1 1 4 2360 1 1 13 ILE HA H -10.576 -7.741 -3.143 1.00 . A A . 10 ILE HA 1 1 4 2361 1 1 13 ILE HB H -10.494 -9.291 -1.088 1.00 . A A . 10 ILE HB 1 1 4 2362 1 1 13 ILE HD11 H -9.212 -7.167 0.436 1.00 . A A . 10 ILE HD11 1 1 4 2363 1 1 13 ILE HD12 H -7.878 -8.021 1.215 1.00 . A A . 10 ILE HD12 1 1 4 2364 1 1 13 ILE HD13 H -9.486 -8.744 1.181 1.00 . A A . 10 ILE HD13 1 1 4 2365 1 1 13 ILE HG12 H -8.073 -9.795 -0.462 1.00 . A A . 10 ILE HG12 1 1 4 2366 1 1 13 ILE HG13 H -7.670 -8.235 -1.156 1.00 . A A . 10 ILE HG13 1 1 4 2367 1 1 13 ILE HG21 H -10.191 -10.033 -3.378 1.00 . A A . 10 ILE HG21 1 1 4 2368 1 1 13 ILE HG22 H -9.083 -10.883 -2.300 1.00 . A A . 10 ILE HG22 1 1 4 2369 1 1 13 ILE HG23 H -8.490 -9.571 -3.320 1.00 . A A . 10 ILE HG23 1 1 4 2370 1 1 13 ILE N N -8.823 -6.802 -2.641 1.00 . A A . 10 ILE N 1 1 4 2371 1 1 13 ILE O O -12.060 -7.090 -1.084 1.00 . A A . 10 ILE O 1 1 4 2372 1 1 14 LYS C C -10.595 -3.387 0.011 1.00 . A A . 11 LYS C 1 1 4 2373 1 1 14 LYS CA C -11.110 -4.810 0.146 1.00 . A A . 11 LYS CA 1 1 4 2374 1 1 14 LYS CB C -11.062 -5.242 1.619 1.00 . A A . 11 LYS CB 1 1 4 2375 1 1 14 LYS CD C -9.769 -5.129 3.782 1.00 . A A . 11 LYS CD 1 1 4 2376 1 1 14 LYS CE C -10.444 -6.379 4.329 1.00 . A A . 11 LYS CE 1 1 4 2377 1 1 14 LYS CG C -9.684 -5.132 2.261 1.00 . A A . 11 LYS CG 1 1 4 2378 1 1 14 LYS H H -9.398 -5.500 -0.881 1.00 . A A . 11 LYS H 1 1 4 2379 1 1 14 LYS HA H -12.134 -4.837 -0.193 1.00 . A A . 11 LYS HA 1 1 4 2380 1 1 14 LYS HB2 H -11.743 -4.623 2.182 1.00 . A A . 11 LYS HB2 1 1 4 2381 1 1 14 LYS HB3 H -11.385 -6.270 1.690 1.00 . A A . 11 LYS HB3 1 1 4 2382 1 1 14 LYS HD2 H -8.770 -5.072 4.186 1.00 . A A . 11 LYS HD2 1 1 4 2383 1 1 14 LYS HD3 H -10.332 -4.262 4.097 1.00 . A A . 11 LYS HD3 1 1 4 2384 1 1 14 LYS HE2 H -10.577 -6.264 5.393 1.00 . A A . 11 LYS HE2 1 1 4 2385 1 1 14 LYS HE3 H -11.410 -6.484 3.858 1.00 . A A . 11 LYS HE3 1 1 4 2386 1 1 14 LYS HG2 H -9.082 -5.972 1.949 1.00 . A A . 11 LYS HG2 1 1 4 2387 1 1 14 LYS HG3 H -9.219 -4.213 1.934 1.00 . A A . 11 LYS HG3 1 1 4 2388 1 1 14 LYS HZ1 H -8.731 -7.545 4.563 1.00 . A A . 11 LYS HZ1 1 1 4 2389 1 1 14 LYS HZ2 H -9.476 -7.721 3.060 1.00 . A A . 11 LYS HZ2 1 1 4 2390 1 1 14 LYS HZ3 H -10.158 -8.443 4.424 1.00 . A A . 11 LYS HZ3 1 1 4 2391 1 1 14 LYS N N -10.339 -5.699 -0.712 1.00 . A A . 11 LYS N 1 1 4 2392 1 1 14 LYS NZ N -9.649 -7.607 4.075 1.00 . A A . 11 LYS NZ 1 1 4 2393 1 1 14 LYS O O -9.620 -3.145 -0.710 1.00 . A A . 11 LYS O 1 1 4 2394 1 1 15 GLU C C -9.460 -0.817 1.160 1.00 . A A . 12 GLU C 1 1 4 2395 1 1 15 GLU CA C -10.877 -1.053 0.652 1.00 . A A . 12 GLU CA 1 1 4 2396 1 1 15 GLU CB C -11.857 -0.222 1.476 1.00 . A A . 12 GLU CB 1 1 4 2397 1 1 15 GLU CD C -14.192 0.685 1.702 1.00 . A A . 12 GLU CD 1 1 4 2398 1 1 15 GLU CG C -13.226 -0.093 0.839 1.00 . A A . 12 GLU CG 1 1 4 2399 1 1 15 GLU H H -11.990 -2.735 1.279 1.00 . A A . 12 GLU H 1 1 4 2400 1 1 15 GLU HA H -10.933 -0.737 -0.378 1.00 . A A . 12 GLU HA 1 1 4 2401 1 1 15 GLU HB2 H -11.977 -0.683 2.445 1.00 . A A . 12 GLU HB2 1 1 4 2402 1 1 15 GLU HB3 H -11.451 0.770 1.607 1.00 . A A . 12 GLU HB3 1 1 4 2403 1 1 15 GLU HG2 H -13.121 0.417 -0.109 1.00 . A A . 12 GLU HG2 1 1 4 2404 1 1 15 GLU HG3 H -13.627 -1.082 0.672 1.00 . A A . 12 GLU HG3 1 1 4 2405 1 1 15 GLU N N -11.243 -2.462 0.706 1.00 . A A . 12 GLU N 1 1 4 2406 1 1 15 GLU O O -8.831 -1.698 1.755 1.00 . A A . 12 GLU O 1 1 4 2407 1 1 15 GLU OE1 O -14.039 1.918 1.812 1.00 . A A . 12 GLU OE1 1 1 4 2408 1 1 15 GLU OE2 O -15.102 0.061 2.289 1.00 . A A . 12 GLU OE2 1 1 4 2409 1 1 16 PHE C C -7.707 1.461 2.694 1.00 . A A . 13 PHE C 1 1 4 2410 1 1 16 PHE CA C -7.638 0.761 1.342 1.00 . A A . 13 PHE CA 1 1 4 2411 1 1 16 PHE CB C -6.974 1.680 0.312 1.00 . A A . 13 PHE CB 1 1 4 2412 1 1 16 PHE CD1 C -8.634 3.488 -0.253 1.00 . A A . 13 PHE CD1 1 1 4 2413 1 1 16 PHE CD2 C -6.706 4.069 1.029 1.00 . A A . 13 PHE CD2 1 1 4 2414 1 1 16 PHE CE1 C -9.064 4.800 -0.201 1.00 . A A . 13 PHE CE1 1 1 4 2415 1 1 16 PHE CE2 C -7.133 5.382 1.084 1.00 . A A . 13 PHE CE2 1 1 4 2416 1 1 16 PHE CG C -7.451 3.107 0.362 1.00 . A A . 13 PHE CG 1 1 4 2417 1 1 16 PHE CZ C -8.314 5.747 0.470 1.00 . A A . 13 PHE CZ 1 1 4 2418 1 1 16 PHE H H -9.508 1.023 0.401 1.00 . A A . 13 PHE H 1 1 4 2419 1 1 16 PHE HA H -7.049 -0.138 1.444 1.00 . A A . 13 PHE HA 1 1 4 2420 1 1 16 PHE HB2 H -5.908 1.682 0.481 1.00 . A A . 13 PHE HB2 1 1 4 2421 1 1 16 PHE HB3 H -7.175 1.297 -0.679 1.00 . A A . 13 PHE HB3 1 1 4 2422 1 1 16 PHE HD1 H -9.220 2.748 -0.783 1.00 . A A . 13 PHE HD1 1 1 4 2423 1 1 16 PHE HD2 H -5.784 3.782 1.516 1.00 . A A . 13 PHE HD2 1 1 4 2424 1 1 16 PHE HE1 H -9.988 5.085 -0.682 1.00 . A A . 13 PHE HE1 1 1 4 2425 1 1 16 PHE HE2 H -6.541 6.122 1.602 1.00 . A A . 13 PHE HE2 1 1 4 2426 1 1 16 PHE HZ H -8.650 6.772 0.512 1.00 . A A . 13 PHE HZ 1 1 4 2427 1 1 16 PHE N N -8.964 0.379 0.904 1.00 . A A . 13 PHE N 1 1 4 2428 1 1 16 PHE O O -8.776 1.891 3.135 1.00 . A A . 13 PHE O 1 1 4 2429 1 1 17 LYS C C -5.104 2.961 4.712 1.00 . A A . 14 LYS C 1 1 4 2430 1 1 17 LYS CA C -6.451 2.253 4.616 1.00 . A A . 14 LYS CA 1 1 4 2431 1 1 17 LYS CB C -6.620 1.245 5.758 1.00 . A A . 14 LYS CB 1 1 4 2432 1 1 17 LYS CD C -6.679 0.812 8.232 1.00 . A A . 14 LYS CD 1 1 4 2433 1 1 17 LYS CE C -6.290 1.335 9.607 1.00 . A A . 14 LYS CE 1 1 4 2434 1 1 17 LYS CG C -6.371 1.823 7.141 1.00 . A A . 14 LYS CG 1 1 4 2435 1 1 17 LYS H H -5.757 1.176 2.940 1.00 . A A . 14 LYS H 1 1 4 2436 1 1 17 LYS HA H -7.236 2.989 4.669 1.00 . A A . 14 LYS HA 1 1 4 2437 1 1 17 LYS HB2 H -7.628 0.860 5.732 1.00 . A A . 14 LYS HB2 1 1 4 2438 1 1 17 LYS HB3 H -5.931 0.429 5.603 1.00 . A A . 14 LYS HB3 1 1 4 2439 1 1 17 LYS HD2 H -7.738 0.603 8.225 1.00 . A A . 14 LYS HD2 1 1 4 2440 1 1 17 LYS HD3 H -6.129 -0.097 8.033 1.00 . A A . 14 LYS HD3 1 1 4 2441 1 1 17 LYS HE2 H -6.562 0.598 10.348 1.00 . A A . 14 LYS HE2 1 1 4 2442 1 1 17 LYS HE3 H -5.220 1.486 9.630 1.00 . A A . 14 LYS HE3 1 1 4 2443 1 1 17 LYS HG2 H -5.332 2.110 7.216 1.00 . A A . 14 LYS HG2 1 1 4 2444 1 1 17 LYS HG3 H -6.998 2.692 7.278 1.00 . A A . 14 LYS HG3 1 1 4 2445 1 1 17 LYS HZ1 H -6.748 2.900 10.908 1.00 . A A . 14 LYS HZ1 1 1 4 2446 1 1 17 LYS HZ2 H -7.997 2.516 9.835 1.00 . A A . 14 LYS HZ2 1 1 4 2447 1 1 17 LYS HZ3 H -6.642 3.367 9.287 1.00 . A A . 14 LYS HZ3 1 1 4 2448 1 1 17 LYS N N -6.560 1.573 3.338 1.00 . A A . 14 LYS N 1 1 4 2449 1 1 17 LYS NZ N -6.967 2.618 9.931 1.00 . A A . 14 LYS NZ 1 1 4 2450 1 1 17 LYS O O -4.942 3.929 5.456 1.00 . A A . 14 LYS O 1 1 4 2451 1 1 18 TYR C C -2.479 3.614 2.584 1.00 . A A . 15 TYR C 1 1 4 2452 1 1 18 TYR CA C -2.804 3.027 3.945 1.00 . A A . 15 TYR CA 1 1 4 2453 1 1 18 TYR CB C -1.787 1.943 4.295 1.00 . A A . 15 TYR CB 1 1 4 2454 1 1 18 TYR CD1 C -3.060 0.544 5.958 1.00 . A A . 15 TYR CD1 1 1 4 2455 1 1 18 TYR CD2 C -1.050 1.594 6.674 1.00 . A A . 15 TYR CD2 1 1 4 2456 1 1 18 TYR CE1 C -3.229 -0.001 7.215 1.00 . A A . 15 TYR CE1 1 1 4 2457 1 1 18 TYR CE2 C -1.210 1.053 7.933 1.00 . A A . 15 TYR CE2 1 1 4 2458 1 1 18 TYR CG C -1.970 1.350 5.670 1.00 . A A . 15 TYR CG 1 1 4 2459 1 1 18 TYR CZ C -2.300 0.256 8.198 1.00 . A A . 15 TYR CZ 1 1 4 2460 1 1 18 TYR H H -4.348 1.731 3.339 1.00 . A A . 15 TYR H 1 1 4 2461 1 1 18 TYR HA H -2.762 3.809 4.688 1.00 . A A . 15 TYR HA 1 1 4 2462 1 1 18 TYR HB2 H -1.868 1.139 3.578 1.00 . A A . 15 TYR HB2 1 1 4 2463 1 1 18 TYR HB3 H -0.793 2.362 4.244 1.00 . A A . 15 TYR HB3 1 1 4 2464 1 1 18 TYR HD1 H -3.786 0.350 5.179 1.00 . A A . 15 TYR HD1 1 1 4 2465 1 1 18 TYR HD2 H -0.197 2.220 6.461 1.00 . A A . 15 TYR HD2 1 1 4 2466 1 1 18 TYR HE1 H -4.084 -0.626 7.422 1.00 . A A . 15 TYR HE1 1 1 4 2467 1 1 18 TYR HE2 H -0.481 1.253 8.702 1.00 . A A . 15 TYR HE2 1 1 4 2468 1 1 18 TYR HH H -2.303 0.395 10.118 1.00 . A A . 15 TYR HH 1 1 4 2469 1 1 18 TYR N N -4.147 2.479 3.940 1.00 . A A . 15 TYR N 1 1 4 2470 1 1 18 TYR O O -3.300 3.567 1.666 1.00 . A A . 15 TYR O 1 1 4 2471 1 1 18 TYR OH O -2.461 -0.286 9.451 1.00 . A A . 15 TYR OH 1 1 4 2472 1 1 19 LYS C C 0.660 4.993 1.284 1.00 . A A . 16 LYS C 1 1 4 2473 1 1 19 LYS CA C -0.840 4.769 1.219 1.00 . A A . 16 LYS CA 1 1 4 2474 1 1 19 LYS CB C -1.580 6.094 1.003 1.00 . A A . 16 LYS CB 1 1 4 2475 1 1 19 LYS CD C -2.501 7.770 -0.602 1.00 . A A . 16 LYS CD 1 1 4 2476 1 1 19 LYS CE C -2.689 8.124 -2.067 1.00 . A A . 16 LYS CE 1 1 4 2477 1 1 19 LYS CG C -1.501 6.642 -0.414 1.00 . A A . 16 LYS CG 1 1 4 2478 1 1 19 LYS H H -0.666 4.140 3.225 1.00 . A A . 16 LYS H 1 1 4 2479 1 1 19 LYS HA H -1.065 4.094 0.406 1.00 . A A . 16 LYS HA 1 1 4 2480 1 1 19 LYS HB2 H -2.621 5.950 1.249 1.00 . A A . 16 LYS HB2 1 1 4 2481 1 1 19 LYS HB3 H -1.164 6.832 1.673 1.00 . A A . 16 LYS HB3 1 1 4 2482 1 1 19 LYS HD2 H -3.453 7.465 -0.193 1.00 . A A . 16 LYS HD2 1 1 4 2483 1 1 19 LYS HD3 H -2.145 8.643 -0.074 1.00 . A A . 16 LYS HD3 1 1 4 2484 1 1 19 LYS HE2 H -2.937 7.225 -2.608 1.00 . A A . 16 LYS HE2 1 1 4 2485 1 1 19 LYS HE3 H -3.503 8.827 -2.149 1.00 . A A . 16 LYS HE3 1 1 4 2486 1 1 19 LYS HG2 H -0.505 7.022 -0.593 1.00 . A A . 16 LYS HG2 1 1 4 2487 1 1 19 LYS HG3 H -1.722 5.854 -1.117 1.00 . A A . 16 LYS HG3 1 1 4 2488 1 1 19 LYS HZ1 H -0.670 8.066 -2.589 1.00 . A A . 16 LYS HZ1 1 1 4 2489 1 1 19 LYS HZ2 H -1.225 9.608 -2.175 1.00 . A A . 16 LYS HZ2 1 1 4 2490 1 1 19 LYS HZ3 H -1.632 8.933 -3.673 1.00 . A A . 16 LYS HZ3 1 1 4 2491 1 1 19 LYS N N -1.281 4.154 2.457 1.00 . A A . 16 LYS N 1 1 4 2492 1 1 19 LYS NZ N -1.467 8.723 -2.666 1.00 . A A . 16 LYS NZ 1 1 4 2493 1 1 19 LYS O O 1.114 5.994 1.839 1.00 . A A . 16 LYS O 1 1 4 2494 1 1 20 CYS C C 3.378 5.476 0.372 1.00 . A A . 17 CYS C 1 1 4 2495 1 1 20 CYS CA C 2.877 4.096 0.771 1.00 . A A . 17 CYS CA 1 1 4 2496 1 1 20 CYS CB C 3.492 3.043 -0.164 1.00 . A A . 17 CYS CB 1 1 4 2497 1 1 20 CYS H H 0.980 3.273 0.311 1.00 . A A . 17 CYS H 1 1 4 2498 1 1 20 CYS HA H 3.193 3.890 1.782 1.00 . A A . 17 CYS HA 1 1 4 2499 1 1 20 CYS HB2 H 3.207 2.061 0.176 1.00 . A A . 17 CYS HB2 1 1 4 2500 1 1 20 CYS HB3 H 3.121 3.198 -1.166 1.00 . A A . 17 CYS HB3 1 1 4 2501 1 1 20 CYS N N 1.418 4.037 0.742 1.00 . A A . 17 CYS N 1 1 4 2502 1 1 20 CYS O O 3.049 5.974 -0.699 1.00 . A A . 17 CYS O 1 1 4 2503 1 1 20 CYS SG S 5.303 3.112 -0.220 1.00 . A A . 17 CYS SG 1 1 4 2504 1 1 21 PRO C C 5.724 7.423 -0.203 1.00 . A A . 18 PRO C 1 1 4 2505 1 1 21 PRO CA C 4.735 7.443 0.959 1.00 . A A . 18 PRO CA 1 1 4 2506 1 1 21 PRO CB C 5.441 7.812 2.263 1.00 . A A . 18 PRO CB 1 1 4 2507 1 1 21 PRO CD C 4.624 5.589 2.540 1.00 . A A . 18 PRO CD 1 1 4 2508 1 1 21 PRO CG C 5.748 6.512 2.917 1.00 . A A . 18 PRO CG 1 1 4 2509 1 1 21 PRO HA H 3.953 8.158 0.752 1.00 . A A . 18 PRO HA 1 1 4 2510 1 1 21 PRO HB2 H 6.344 8.364 2.043 1.00 . A A . 18 PRO HB2 1 1 4 2511 1 1 21 PRO HB3 H 4.785 8.413 2.873 1.00 . A A . 18 PRO HB3 1 1 4 2512 1 1 21 PRO HD2 H 4.983 4.574 2.449 1.00 . A A . 18 PRO HD2 1 1 4 2513 1 1 21 PRO HD3 H 3.827 5.648 3.265 1.00 . A A . 18 PRO HD3 1 1 4 2514 1 1 21 PRO HG2 H 6.688 6.130 2.547 1.00 . A A . 18 PRO HG2 1 1 4 2515 1 1 21 PRO HG3 H 5.787 6.638 3.988 1.00 . A A . 18 PRO HG3 1 1 4 2516 1 1 21 PRO N N 4.186 6.112 1.231 1.00 . A A . 18 PRO N 1 1 4 2517 1 1 21 PRO O O 6.154 8.468 -0.694 1.00 . A A . 18 PRO O 1 1 4 2518 1 1 22 ARG C C 6.223 5.653 -3.021 1.00 . A A . 19 ARG C 1 1 4 2519 1 1 22 ARG CA C 6.984 6.042 -1.754 1.00 . A A . 19 ARG CA 1 1 4 2520 1 1 22 ARG CB C 8.035 4.978 -1.435 1.00 . A A . 19 ARG CB 1 1 4 2521 1 1 22 ARG CD C 10.194 4.400 -0.273 1.00 . A A . 19 ARG CD 1 1 4 2522 1 1 22 ARG CG C 9.067 5.416 -0.406 1.00 . A A . 19 ARG CG 1 1 4 2523 1 1 22 ARG CZ C 11.899 3.439 -1.793 1.00 . A A . 19 ARG CZ 1 1 4 2524 1 1 22 ARG H H 5.733 5.428 -0.167 1.00 . A A . 19 ARG H 1 1 4 2525 1 1 22 ARG HA H 7.484 6.983 -1.926 1.00 . A A . 19 ARG HA 1 1 4 2526 1 1 22 ARG HB2 H 7.535 4.098 -1.054 1.00 . A A . 19 ARG HB2 1 1 4 2527 1 1 22 ARG HB3 H 8.551 4.721 -2.345 1.00 . A A . 19 ARG HB3 1 1 4 2528 1 1 22 ARG HD2 H 11.015 4.864 0.250 1.00 . A A . 19 ARG HD2 1 1 4 2529 1 1 22 ARG HD3 H 9.833 3.560 0.303 1.00 . A A . 19 ARG HD3 1 1 4 2530 1 1 22 ARG HE H 10.026 3.913 -2.316 1.00 . A A . 19 ARG HE 1 1 4 2531 1 1 22 ARG HG2 H 9.483 6.365 -0.705 1.00 . A A . 19 ARG HG2 1 1 4 2532 1 1 22 ARG HG3 H 8.577 5.519 0.557 1.00 . A A . 19 ARG HG3 1 1 4 2533 1 1 22 ARG HH11 H 12.595 3.851 0.068 1.00 . A A . 19 ARG HH11 1 1 4 2534 1 1 22 ARG HH12 H 13.735 3.096 -1.000 1.00 . A A . 19 ARG HH12 1 1 4 2535 1 1 22 ARG HH21 H 11.528 2.938 -3.723 1.00 . A A . 19 ARG HH21 1 1 4 2536 1 1 22 ARG HH22 H 13.133 2.589 -3.162 1.00 . A A . 19 ARG HH22 1 1 4 2537 1 1 22 ARG N N 6.084 6.220 -0.629 1.00 . A A . 19 ARG N 1 1 4 2538 1 1 22 ARG NE N 10.672 3.915 -1.572 1.00 . A A . 19 ARG NE 1 1 4 2539 1 1 22 ARG NH1 N 12.815 3.466 -0.831 1.00 . A A . 19 ARG NH1 1 1 4 2540 1 1 22 ARG NH2 N 12.212 2.950 -2.989 1.00 . A A . 19 ARG NH2 1 1 4 2541 1 1 22 ARG O O 6.436 6.234 -4.081 1.00 . A A . 19 ARG O 1 1 4 2542 1 1 23 CYS C C 3.307 4.864 -4.329 1.00 . A A . 20 CYS C 1 1 4 2543 1 1 23 CYS CA C 4.625 4.148 -4.080 1.00 . A A . 20 CYS CA 1 1 4 2544 1 1 23 CYS CB C 4.335 2.657 -3.914 1.00 . A A . 20 CYS CB 1 1 4 2545 1 1 23 CYS H H 5.130 4.309 -2.021 1.00 . A A . 20 CYS H 1 1 4 2546 1 1 23 CYS HA H 5.262 4.289 -4.936 1.00 . A A . 20 CYS HA 1 1 4 2547 1 1 23 CYS HB2 H 3.695 2.518 -3.058 1.00 . A A . 20 CYS HB2 1 1 4 2548 1 1 23 CYS HB3 H 3.824 2.303 -4.795 1.00 . A A . 20 CYS HB3 1 1 4 2549 1 1 23 CYS N N 5.326 4.677 -2.906 1.00 . A A . 20 CYS N 1 1 4 2550 1 1 23 CYS O O 2.807 4.892 -5.453 1.00 . A A . 20 CYS O 1 1 4 2551 1 1 23 CYS SG S 5.789 1.625 -3.676 1.00 . A A . 20 CYS SG 1 1 4 2552 1 1 24 LEU C C 0.330 4.989 -3.397 1.00 . A A . 21 LEU C 1 1 4 2553 1 1 24 LEU CA C 1.425 6.039 -3.263 1.00 . A A . 21 LEU CA 1 1 4 2554 1 1 24 LEU CB C 1.281 7.094 -4.364 1.00 . A A . 21 LEU CB 1 1 4 2555 1 1 24 LEU CD1 C 1.801 9.420 -5.106 1.00 . A A . 21 LEU CD1 1 1 4 2556 1 1 24 LEU CD2 C 2.709 8.582 -2.931 1.00 . A A . 21 LEU CD2 1 1 4 2557 1 1 24 LEU CG C 2.324 8.212 -4.354 1.00 . A A . 21 LEU CG 1 1 4 2558 1 1 24 LEU H H 3.264 5.435 -2.421 1.00 . A A . 21 LEU H 1 1 4 2559 1 1 24 LEU HA H 1.302 6.527 -2.306 1.00 . A A . 21 LEU HA 1 1 4 2560 1 1 24 LEU HB2 H 1.334 6.592 -5.319 1.00 . A A . 21 LEU HB2 1 1 4 2561 1 1 24 LEU HB3 H 0.305 7.545 -4.271 1.00 . A A . 21 LEU HB3 1 1 4 2562 1 1 24 LEU HD11 H 1.598 9.147 -6.130 1.00 . A A . 21 LEU HD11 1 1 4 2563 1 1 24 LEU HD12 H 2.537 10.207 -5.081 1.00 . A A . 21 LEU HD12 1 1 4 2564 1 1 24 LEU HD13 H 0.888 9.762 -4.638 1.00 . A A . 21 LEU HD13 1 1 4 2565 1 1 24 LEU HD21 H 1.818 8.809 -2.365 1.00 . A A . 21 LEU HD21 1 1 4 2566 1 1 24 LEU HD22 H 3.356 9.445 -2.946 1.00 . A A . 21 LEU HD22 1 1 4 2567 1 1 24 LEU HD23 H 3.226 7.750 -2.473 1.00 . A A . 21 LEU HD23 1 1 4 2568 1 1 24 LEU HG H 3.214 7.865 -4.862 1.00 . A A . 21 LEU HG 1 1 4 2569 1 1 24 LEU N N 2.752 5.420 -3.258 1.00 . A A . 21 LEU N 1 1 4 2570 1 1 24 LEU O O -0.849 5.326 -3.519 1.00 . A A . 21 LEU O 1 1 4 2571 1 1 25 VAL C C -1.105 2.571 -2.228 1.00 . A A . 22 VAL C 1 1 4 2572 1 1 25 VAL CA C -0.223 2.631 -3.467 1.00 . A A . 22 VAL CA 1 1 4 2573 1 1 25 VAL CB C 0.481 1.269 -3.705 1.00 . A A . 22 VAL CB 1 1 4 2574 1 1 25 VAL CG1 C 1.349 0.867 -2.523 1.00 . A A . 22 VAL CG1 1 1 4 2575 1 1 25 VAL CG2 C -0.539 0.185 -4.014 1.00 . A A . 22 VAL CG2 1 1 4 2576 1 1 25 VAL H H 1.662 3.519 -3.247 1.00 . A A . 22 VAL H 1 1 4 2577 1 1 25 VAL HA H -0.851 2.835 -4.323 1.00 . A A . 22 VAL HA 1 1 4 2578 1 1 25 VAL HB H 1.124 1.374 -4.566 1.00 . A A . 22 VAL HB 1 1 4 2579 1 1 25 VAL HG11 H 2.074 1.640 -2.327 1.00 . A A . 22 VAL HG11 1 1 4 2580 1 1 25 VAL HG12 H 1.862 -0.059 -2.750 1.00 . A A . 22 VAL HG12 1 1 4 2581 1 1 25 VAL HG13 H 0.726 0.727 -1.652 1.00 . A A . 22 VAL HG13 1 1 4 2582 1 1 25 VAL HG21 H -1.074 0.442 -4.917 1.00 . A A . 22 VAL HG21 1 1 4 2583 1 1 25 VAL HG22 H -1.237 0.104 -3.194 1.00 . A A . 22 VAL HG22 1 1 4 2584 1 1 25 VAL HG23 H -0.033 -0.758 -4.151 1.00 . A A . 22 VAL HG23 1 1 4 2585 1 1 25 VAL N N 0.721 3.720 -3.354 1.00 . A A . 22 VAL N 1 1 4 2586 1 1 25 VAL O O -0.623 2.555 -1.090 1.00 . A A . 22 VAL O 1 1 4 2587 1 1 26 GLN C C -3.565 1.103 -0.945 1.00 . A A . 23 GLN C 1 1 4 2588 1 1 26 GLN CA C -3.390 2.541 -1.418 1.00 . A A . 23 GLN CA 1 1 4 2589 1 1 26 GLN CB C -4.710 3.116 -1.936 1.00 . A A . 23 GLN CB 1 1 4 2590 1 1 26 GLN CD C -5.824 5.079 -3.100 1.00 . A A . 23 GLN CD 1 1 4 2591 1 1 26 GLN CG C -4.614 4.587 -2.326 1.00 . A A . 23 GLN CG 1 1 4 2592 1 1 26 GLN H H -2.691 2.654 -3.403 1.00 . A A . 23 GLN H 1 1 4 2593 1 1 26 GLN HA H -3.041 3.139 -0.585 1.00 . A A . 23 GLN HA 1 1 4 2594 1 1 26 GLN HB2 H -5.018 2.553 -2.803 1.00 . A A . 23 GLN HB2 1 1 4 2595 1 1 26 GLN HB3 H -5.460 3.019 -1.166 1.00 . A A . 23 GLN HB3 1 1 4 2596 1 1 26 GLN HE21 H -6.752 5.558 -1.412 1.00 . A A . 23 GLN HE21 1 1 4 2597 1 1 26 GLN HE22 H -7.631 5.872 -2.864 1.00 . A A . 23 GLN HE22 1 1 4 2598 1 1 26 GLN HG2 H -4.520 5.178 -1.427 1.00 . A A . 23 GLN HG2 1 1 4 2599 1 1 26 GLN HG3 H -3.734 4.725 -2.938 1.00 . A A . 23 GLN HG3 1 1 4 2600 1 1 26 GLN N N -2.394 2.598 -2.471 1.00 . A A . 23 GLN N 1 1 4 2601 1 1 26 GLN NE2 N -6.835 5.552 -2.389 1.00 . A A . 23 GLN NE2 1 1 4 2602 1 1 26 GLN O O -4.287 0.314 -1.552 1.00 . A A . 23 GLN O 1 1 4 2603 1 1 26 GLN OE1 O -5.846 5.038 -4.331 1.00 . A A . 23 GLN OE1 1 1 4 2604 1 1 27 THR C C -3.992 -0.724 1.720 1.00 . A A . 24 THR C 1 1 4 2605 1 1 27 THR CA C -2.905 -0.580 0.662 1.00 . A A . 24 THR CA 1 1 4 2606 1 1 27 THR CB C -1.543 -0.958 1.265 1.00 . A A . 24 THR CB 1 1 4 2607 1 1 27 THR CG2 C -0.553 -1.322 0.178 1.00 . A A . 24 THR CG2 1 1 4 2608 1 1 27 THR H H -2.334 1.447 0.578 1.00 . A A . 24 THR H 1 1 4 2609 1 1 27 THR HA H -3.117 -1.258 -0.152 1.00 . A A . 24 THR HA 1 1 4 2610 1 1 27 THR HB H -1.677 -1.814 1.911 1.00 . A A . 24 THR HB 1 1 4 2611 1 1 27 THR HG1 H -0.130 0.326 1.757 1.00 . A A . 24 THR HG1 1 1 4 2612 1 1 27 THR HG21 H -0.422 -0.483 -0.488 1.00 . A A . 24 THR HG21 1 1 4 2613 1 1 27 THR HG22 H -0.928 -2.169 -0.376 1.00 . A A . 24 THR HG22 1 1 4 2614 1 1 27 THR HG23 H 0.394 -1.578 0.628 1.00 . A A . 24 THR HG23 1 1 4 2615 1 1 27 THR N N -2.875 0.766 0.126 1.00 . A A . 24 THR N 1 1 4 2616 1 1 27 THR O O -4.393 0.248 2.356 1.00 . A A . 24 THR O 1 1 4 2617 1 1 27 THR OG1 O -1.030 0.128 2.037 1.00 . A A . 24 THR OG1 1 1 4 2618 1 1 28 CYS C C -4.983 -2.340 4.251 1.00 . A A . 25 CYS C 1 1 4 2619 1 1 28 CYS CA C -5.535 -2.240 2.833 1.00 . A A . 25 CYS CA 1 1 4 2620 1 1 28 CYS CB C -6.233 -3.550 2.446 1.00 . A A . 25 CYS CB 1 1 4 2621 1 1 28 CYS H H -4.089 -2.678 1.362 1.00 . A A . 25 CYS H 1 1 4 2622 1 1 28 CYS HA H -6.249 -1.432 2.790 1.00 . A A . 25 CYS HA 1 1 4 2623 1 1 28 CYS HB2 H -7.089 -3.707 3.082 1.00 . A A . 25 CYS HB2 1 1 4 2624 1 1 28 CYS HB3 H -6.566 -3.478 1.425 1.00 . A A . 25 CYS HB3 1 1 4 2625 1 1 28 CYS N N -4.466 -1.950 1.891 1.00 . A A . 25 CYS N 1 1 4 2626 1 1 28 CYS O O -5.666 -2.005 5.219 1.00 . A A . 25 CYS O 1 1 4 2627 1 1 28 CYS SG S -5.177 -5.009 2.573 1.00 . A A . 25 CYS SG 1 1 4 2628 1 1 29 SER C C -1.597 -3.048 5.529 1.00 . A A . 26 SER C 1 1 4 2629 1 1 29 SER CA C -3.115 -3.004 5.665 1.00 . A A . 26 SER CA 1 1 4 2630 1 1 29 SER CB C -3.623 -4.300 6.307 1.00 . A A . 26 SER CB 1 1 4 2631 1 1 29 SER H H -3.220 -2.984 3.552 1.00 . A A . 26 SER H 1 1 4 2632 1 1 29 SER HA H -3.383 -2.170 6.297 1.00 . A A . 26 SER HA 1 1 4 2633 1 1 29 SER HB2 H -3.395 -5.132 5.658 1.00 . A A . 26 SER HB2 1 1 4 2634 1 1 29 SER HB3 H -3.134 -4.442 7.259 1.00 . A A . 26 SER HB3 1 1 4 2635 1 1 29 SER HG H -5.362 -3.391 6.251 1.00 . A A . 26 SER HG 1 1 4 2636 1 1 29 SER N N -3.739 -2.797 4.365 1.00 . A A . 26 SER N 1 1 4 2637 1 1 29 SER O O -1.074 -2.987 4.412 1.00 . A A . 26 SER O 1 1 4 2638 1 1 29 SER OG O -5.025 -4.261 6.516 1.00 . A A . 26 SER OG 1 1 4 2639 1 1 30 LEU C C 1.109 -4.377 5.866 1.00 . A A . 27 LEU C 1 1 4 2640 1 1 30 LEU CA C 0.561 -3.192 6.654 1.00 . A A . 27 LEU CA 1 1 4 2641 1 1 30 LEU CB C 1.091 -3.225 8.085 1.00 . A A . 27 LEU CB 1 1 4 2642 1 1 30 LEU CD1 C 1.302 -2.117 10.328 1.00 . A A . 27 LEU CD1 1 1 4 2643 1 1 30 LEU CD2 C 1.722 -0.802 8.250 1.00 . A A . 27 LEU CD2 1 1 4 2644 1 1 30 LEU CG C 0.905 -1.925 8.874 1.00 . A A . 27 LEU CG 1 1 4 2645 1 1 30 LEU H H -1.378 -3.282 7.506 1.00 . A A . 27 LEU H 1 1 4 2646 1 1 30 LEU HA H 0.895 -2.283 6.179 1.00 . A A . 27 LEU HA 1 1 4 2647 1 1 30 LEU HB2 H 0.589 -4.023 8.613 1.00 . A A . 27 LEU HB2 1 1 4 2648 1 1 30 LEU HB3 H 2.144 -3.450 8.048 1.00 . A A . 27 LEU HB3 1 1 4 2649 1 1 30 LEU HD11 H 0.676 -2.873 10.775 1.00 . A A . 27 LEU HD11 1 1 4 2650 1 1 30 LEU HD12 H 1.180 -1.185 10.861 1.00 . A A . 27 LEU HD12 1 1 4 2651 1 1 30 LEU HD13 H 2.335 -2.428 10.380 1.00 . A A . 27 LEU HD13 1 1 4 2652 1 1 30 LEU HD21 H 1.604 0.097 8.837 1.00 . A A . 27 LEU HD21 1 1 4 2653 1 1 30 LEU HD22 H 1.377 -0.621 7.243 1.00 . A A . 27 LEU HD22 1 1 4 2654 1 1 30 LEU HD23 H 2.764 -1.083 8.228 1.00 . A A . 27 LEU HD23 1 1 4 2655 1 1 30 LEU HG H -0.136 -1.638 8.846 1.00 . A A . 27 LEU HG 1 1 4 2656 1 1 30 LEU N N -0.900 -3.180 6.652 1.00 . A A . 27 LEU N 1 1 4 2657 1 1 30 LEU O O 2.173 -4.283 5.255 1.00 . A A . 27 LEU O 1 1 4 2658 1 1 31 GLU C C 0.990 -6.347 3.652 1.00 . A A . 28 GLU C 1 1 4 2659 1 1 31 GLU CA C 0.743 -6.663 5.123 1.00 . A A . 28 GLU CA 1 1 4 2660 1 1 31 GLU CB C -0.362 -7.690 5.243 1.00 . A A . 28 GLU CB 1 1 4 2661 1 1 31 GLU CD C -2.827 -8.158 5.034 1.00 . A A . 28 GLU CD 1 1 4 2662 1 1 31 GLU CG C -1.749 -7.101 5.131 1.00 . A A . 28 GLU CG 1 1 4 2663 1 1 31 GLU H H -0.442 -5.511 6.410 1.00 . A A . 28 GLU H 1 1 4 2664 1 1 31 GLU HA H 1.640 -7.066 5.554 1.00 . A A . 28 GLU HA 1 1 4 2665 1 1 31 GLU HB2 H -0.243 -8.396 4.456 1.00 . A A . 28 GLU HB2 1 1 4 2666 1 1 31 GLU HB3 H -0.277 -8.189 6.196 1.00 . A A . 28 GLU HB3 1 1 4 2667 1 1 31 GLU HG2 H -1.934 -6.498 6.004 1.00 . A A . 28 GLU HG2 1 1 4 2668 1 1 31 GLU HG3 H -1.788 -6.480 4.249 1.00 . A A . 28 GLU HG3 1 1 4 2669 1 1 31 GLU N N 0.373 -5.481 5.872 1.00 . A A . 28 GLU N 1 1 4 2670 1 1 31 GLU O O 1.952 -6.813 3.053 1.00 . A A . 28 GLU O 1 1 4 2671 1 1 31 GLU OE1 O -3.092 -8.639 3.911 1.00 . A A . 28 GLU OE1 1 1 4 2672 1 1 31 GLU OE2 O -3.409 -8.515 6.080 1.00 . A A . 28 GLU OE2 1 1 4 2673 1 1 32 CYS C C 1.186 -3.976 1.546 1.00 . A A . 29 CYS C 1 1 4 2674 1 1 32 CYS CA C 0.229 -5.151 1.697 1.00 . A A . 29 CYS CA 1 1 4 2675 1 1 32 CYS CB C -1.148 -4.801 1.162 1.00 . A A . 29 CYS CB 1 1 4 2676 1 1 32 CYS H H -0.626 -5.193 3.617 1.00 . A A . 29 CYS H 1 1 4 2677 1 1 32 CYS HA H 0.617 -5.992 1.145 1.00 . A A . 29 CYS HA 1 1 4 2678 1 1 32 CYS HB2 H -1.691 -4.282 1.938 1.00 . A A . 29 CYS HB2 1 1 4 2679 1 1 32 CYS HB3 H -1.051 -4.157 0.305 1.00 . A A . 29 CYS HB3 1 1 4 2680 1 1 32 CYS N N 0.116 -5.540 3.083 1.00 . A A . 29 CYS N 1 1 4 2681 1 1 32 CYS O O 1.767 -3.764 0.483 1.00 . A A . 29 CYS O 1 1 4 2682 1 1 32 CYS SG S -2.145 -6.226 0.683 1.00 . A A . 29 CYS SG 1 1 4 2683 1 1 33 SER C C 3.709 -2.611 2.562 1.00 . A A . 30 SER C 1 1 4 2684 1 1 33 SER CA C 2.271 -2.099 2.640 1.00 . A A . 30 SER CA 1 1 4 2685 1 1 33 SER CB C 2.053 -1.264 3.909 1.00 . A A . 30 SER CB 1 1 4 2686 1 1 33 SER H H 0.839 -3.437 3.434 1.00 . A A . 30 SER H 1 1 4 2687 1 1 33 SER HA H 2.069 -1.489 1.772 1.00 . A A . 30 SER HA 1 1 4 2688 1 1 33 SER HB2 H 0.994 -1.109 4.055 1.00 . A A . 30 SER HB2 1 1 4 2689 1 1 33 SER HB3 H 2.456 -1.796 4.758 1.00 . A A . 30 SER HB3 1 1 4 2690 1 1 33 SER HG H 2.324 0.589 4.501 1.00 . A A . 30 SER HG 1 1 4 2691 1 1 33 SER N N 1.351 -3.225 2.624 1.00 . A A . 30 SER N 1 1 4 2692 1 1 33 SER O O 4.590 -1.947 2.023 1.00 . A A . 30 SER O 1 1 4 2693 1 1 33 SER OG O 2.687 0.004 3.823 1.00 . A A . 30 SER OG 1 1 4 2694 1 1 34 LYS C C 5.351 -5.399 1.877 1.00 . A A . 31 LYS C 1 1 4 2695 1 1 34 LYS CA C 5.246 -4.437 3.057 1.00 . A A . 31 LYS CA 1 1 4 2696 1 1 34 LYS CB C 5.511 -5.196 4.363 1.00 . A A . 31 LYS CB 1 1 4 2697 1 1 34 LYS CD C 4.882 -7.141 5.851 1.00 . A A . 31 LYS CD 1 1 4 2698 1 1 34 LYS CE C 4.303 -6.324 6.995 1.00 . A A . 31 LYS CE 1 1 4 2699 1 1 34 LYS CG C 4.674 -6.459 4.509 1.00 . A A . 31 LYS CG 1 1 4 2700 1 1 34 LYS H H 3.190 -4.281 3.535 1.00 . A A . 31 LYS H 1 1 4 2701 1 1 34 LYS HA H 5.982 -3.660 2.942 1.00 . A A . 31 LYS HA 1 1 4 2702 1 1 34 LYS HB2 H 6.555 -5.473 4.401 1.00 . A A . 31 LYS HB2 1 1 4 2703 1 1 34 LYS HB3 H 5.290 -4.545 5.195 1.00 . A A . 31 LYS HB3 1 1 4 2704 1 1 34 LYS HD2 H 4.399 -8.106 5.832 1.00 . A A . 31 LYS HD2 1 1 4 2705 1 1 34 LYS HD3 H 5.943 -7.271 6.014 1.00 . A A . 31 LYS HD3 1 1 4 2706 1 1 34 LYS HE2 H 4.863 -5.407 7.085 1.00 . A A . 31 LYS HE2 1 1 4 2707 1 1 34 LYS HE3 H 3.271 -6.096 6.771 1.00 . A A . 31 LYS HE3 1 1 4 2708 1 1 34 LYS HG2 H 3.631 -6.198 4.412 1.00 . A A . 31 LYS HG2 1 1 4 2709 1 1 34 LYS HG3 H 4.946 -7.148 3.721 1.00 . A A . 31 LYS HG3 1 1 4 2710 1 1 34 LYS HZ1 H 3.996 -6.462 9.053 1.00 . A A . 31 LYS HZ1 1 1 4 2711 1 1 34 LYS HZ2 H 5.352 -7.309 8.508 1.00 . A A . 31 LYS HZ2 1 1 4 2712 1 1 34 LYS HZ3 H 3.802 -7.928 8.233 1.00 . A A . 31 LYS HZ3 1 1 4 2713 1 1 34 LYS N N 3.930 -3.810 3.093 1.00 . A A . 31 LYS N 1 1 4 2714 1 1 34 LYS NZ N 4.368 -7.057 8.286 1.00 . A A . 31 LYS NZ 1 1 4 2715 1 1 34 LYS O O 6.443 -5.831 1.507 1.00 . A A . 31 LYS O 1 1 4 2716 1 1 35 LYS C C 4.940 -6.277 -0.993 1.00 . A A . 32 LYS C 1 1 4 2717 1 1 35 LYS CA C 4.135 -6.712 0.222 1.00 . A A . 32 LYS CA 1 1 4 2718 1 1 35 LYS CB C 2.681 -6.952 -0.184 1.00 . A A . 32 LYS CB 1 1 4 2719 1 1 35 LYS CD C 2.734 -9.447 -0.418 1.00 . A A . 32 LYS CD 1 1 4 2720 1 1 35 LYS CE C 2.634 -10.620 -1.377 1.00 . A A . 32 LYS CE 1 1 4 2721 1 1 35 LYS CG C 2.490 -8.126 -1.128 1.00 . A A . 32 LYS CG 1 1 4 2722 1 1 35 LYS H H 3.385 -5.267 1.569 1.00 . A A . 32 LYS H 1 1 4 2723 1 1 35 LYS HA H 4.550 -7.634 0.603 1.00 . A A . 32 LYS HA 1 1 4 2724 1 1 35 LYS HB2 H 2.101 -7.138 0.705 1.00 . A A . 32 LYS HB2 1 1 4 2725 1 1 35 LYS HB3 H 2.305 -6.062 -0.669 1.00 . A A . 32 LYS HB3 1 1 4 2726 1 1 35 LYS HD2 H 3.720 -9.436 0.019 1.00 . A A . 32 LYS HD2 1 1 4 2727 1 1 35 LYS HD3 H 1.993 -9.567 0.359 1.00 . A A . 32 LYS HD3 1 1 4 2728 1 1 35 LYS HE2 H 1.663 -10.603 -1.844 1.00 . A A . 32 LYS HE2 1 1 4 2729 1 1 35 LYS HE3 H 3.397 -10.514 -2.133 1.00 . A A . 32 LYS HE3 1 1 4 2730 1 1 35 LYS HG2 H 1.480 -8.112 -1.509 1.00 . A A . 32 LYS HG2 1 1 4 2731 1 1 35 LYS HG3 H 3.187 -8.035 -1.949 1.00 . A A . 32 LYS HG3 1 1 4 2732 1 1 35 LYS HZ1 H 1.997 -12.124 -0.077 1.00 . A A . 32 LYS HZ1 1 1 4 2733 1 1 35 LYS HZ2 H 3.671 -11.898 -0.096 1.00 . A A . 32 LYS HZ2 1 1 4 2734 1 1 35 LYS HZ3 H 2.913 -12.689 -1.383 1.00 . A A . 32 LYS HZ3 1 1 4 2735 1 1 35 LYS N N 4.207 -5.716 1.283 1.00 . A A . 32 LYS N 1 1 4 2736 1 1 35 LYS NZ N 2.816 -11.922 -0.685 1.00 . A A . 32 LYS NZ 1 1 4 2737 1 1 35 LYS O O 5.699 -7.060 -1.561 1.00 . A A . 32 LYS O 1 1 4 2738 1 1 36 HIS C C 6.961 -4.287 -2.264 1.00 . A A . 33 HIS C 1 1 4 2739 1 1 36 HIS CA C 5.476 -4.511 -2.559 1.00 . A A . 33 HIS CA 1 1 4 2740 1 1 36 HIS CB C 4.815 -3.217 -3.067 1.00 . A A . 33 HIS CB 1 1 4 2741 1 1 36 HIS CD2 C 5.972 -1.474 -1.556 1.00 . A A . 33 HIS CD2 1 1 4 2742 1 1 36 HIS CE1 C 4.259 -0.364 -0.880 1.00 . A A . 33 HIS CE1 1 1 4 2743 1 1 36 HIS CG C 4.894 -2.056 -2.118 1.00 . A A . 33 HIS CG 1 1 4 2744 1 1 36 HIS H H 4.197 -4.426 -0.869 1.00 . A A . 33 HIS H 1 1 4 2745 1 1 36 HIS HA H 5.394 -5.264 -3.328 1.00 . A A . 33 HIS HA 1 1 4 2746 1 1 36 HIS HB2 H 5.295 -2.919 -3.986 1.00 . A A . 33 HIS HB2 1 1 4 2747 1 1 36 HIS HB3 H 3.771 -3.413 -3.264 1.00 . A A . 33 HIS HB3 1 1 4 2748 1 1 36 HIS HD1 H 2.867 -1.528 -1.900 1.00 . A A . 33 HIS HD1 1 1 4 2749 1 1 36 HIS HD2 H 6.993 -1.791 -1.687 1.00 . A A . 33 HIS HD2 1 1 4 2750 1 1 36 HIS HE1 H 3.625 0.334 -0.359 1.00 . A A . 33 HIS HE1 1 1 4 2751 1 1 36 HIS N N 4.788 -5.020 -1.382 1.00 . A A . 33 HIS N 1 1 4 2752 1 1 36 HIS ND1 N 3.807 -1.345 -1.677 1.00 . A A . 33 HIS ND1 1 1 4 2753 1 1 36 HIS NE2 N 5.578 -0.394 -0.780 1.00 . A A . 33 HIS NE2 1 1 4 2754 1 1 36 HIS O O 7.772 -4.139 -3.176 1.00 . A A . 33 HIS O 1 1 4 2755 1 1 37 LYS C C 9.561 -5.250 -0.863 1.00 . A A . 34 LYS C 1 1 4 2756 1 1 37 LYS CA C 8.690 -4.039 -0.577 1.00 . A A . 34 LYS CA 1 1 4 2757 1 1 37 LYS CB C 8.756 -3.698 0.913 1.00 . A A . 34 LYS CB 1 1 4 2758 1 1 37 LYS CD C 8.062 -2.170 2.784 1.00 . A A . 34 LYS CD 1 1 4 2759 1 1 37 LYS CE C 7.220 -0.965 3.175 1.00 . A A . 34 LYS CE 1 1 4 2760 1 1 37 LYS CG C 7.943 -2.474 1.300 1.00 . A A . 34 LYS CG 1 1 4 2761 1 1 37 LYS H H 6.640 -4.484 -0.300 1.00 . A A . 34 LYS H 1 1 4 2762 1 1 37 LYS HA H 9.057 -3.199 -1.147 1.00 . A A . 34 LYS HA 1 1 4 2763 1 1 37 LYS HB2 H 8.388 -4.541 1.479 1.00 . A A . 34 LYS HB2 1 1 4 2764 1 1 37 LYS HB3 H 9.787 -3.520 1.182 1.00 . A A . 34 LYS HB3 1 1 4 2765 1 1 37 LYS HD2 H 7.730 -3.028 3.348 1.00 . A A . 34 LYS HD2 1 1 4 2766 1 1 37 LYS HD3 H 9.096 -1.964 3.017 1.00 . A A . 34 LYS HD3 1 1 4 2767 1 1 37 LYS HE2 H 7.641 -0.084 2.714 1.00 . A A . 34 LYS HE2 1 1 4 2768 1 1 37 LYS HE3 H 6.212 -1.111 2.813 1.00 . A A . 34 LYS HE3 1 1 4 2769 1 1 37 LYS HG2 H 8.304 -1.624 0.742 1.00 . A A . 34 LYS HG2 1 1 4 2770 1 1 37 LYS HG3 H 6.905 -2.652 1.058 1.00 . A A . 34 LYS HG3 1 1 4 2771 1 1 37 LYS HZ1 H 6.657 0.096 4.881 1.00 . A A . 34 LYS HZ1 1 1 4 2772 1 1 37 LYS HZ2 H 8.149 -0.683 5.024 1.00 . A A . 34 LYS HZ2 1 1 4 2773 1 1 37 LYS HZ3 H 6.718 -1.576 5.107 1.00 . A A . 34 LYS HZ3 1 1 4 2774 1 1 37 LYS N N 7.316 -4.292 -0.985 1.00 . A A . 34 LYS N 1 1 4 2775 1 1 37 LYS NZ N 7.183 -0.768 4.648 1.00 . A A . 34 LYS NZ 1 1 4 2776 1 1 37 LYS O O 10.732 -5.121 -1.207 1.00 . A A . 34 LYS O 1 1 4 2777 1 1 38 THR C C 9.807 -8.062 -2.390 1.00 . A A . 35 THR C 1 1 4 2778 1 1 38 THR CA C 9.697 -7.671 -0.914 1.00 . A A . 35 THR CA 1 1 4 2779 1 1 38 THR CB C 9.014 -8.803 -0.116 1.00 . A A . 35 THR CB 1 1 4 2780 1 1 38 THR CG2 C 7.714 -9.231 -0.779 1.00 . A A . 35 THR CG2 1 1 4 2781 1 1 38 THR H H 8.006 -6.459 -0.553 1.00 . A A . 35 THR H 1 1 4 2782 1 1 38 THR HA H 10.690 -7.526 -0.515 1.00 . A A . 35 THR HA 1 1 4 2783 1 1 38 THR HB H 8.785 -8.431 0.873 1.00 . A A . 35 THR HB 1 1 4 2784 1 1 38 THR HG1 H 10.401 -10.030 -0.814 1.00 . A A . 35 THR HG1 1 1 4 2785 1 1 38 THR HG21 H 7.262 -10.027 -0.206 1.00 . A A . 35 THR HG21 1 1 4 2786 1 1 38 THR HG22 H 7.921 -9.580 -1.781 1.00 . A A . 35 THR HG22 1 1 4 2787 1 1 38 THR HG23 H 7.039 -8.389 -0.824 1.00 . A A . 35 THR HG23 1 1 4 2788 1 1 38 THR N N 8.966 -6.427 -0.754 1.00 . A A . 35 THR N 1 1 4 2789 1 1 38 THR O O 10.359 -9.110 -2.728 1.00 . A A . 35 THR O 1 1 4 2790 1 1 38 THR OG1 O 9.886 -9.935 0.002 1.00 . A A . 35 THR OG1 1 1 4 2791 1 1 39 ARG C C 9.928 -6.304 -5.467 1.00 . A A . 36 ARG C 1 1 4 2792 1 1 39 ARG CA C 9.316 -7.473 -4.701 1.00 . A A . 36 ARG CA 1 1 4 2793 1 1 39 ARG CB C 7.910 -7.772 -5.234 1.00 . A A . 36 ARG CB 1 1 4 2794 1 1 39 ARG CD C 5.495 -7.063 -5.338 1.00 . A A . 36 ARG CD 1 1 4 2795 1 1 39 ARG CG C 6.827 -6.900 -4.624 1.00 . A A . 36 ARG CG 1 1 4 2796 1 1 39 ARG CZ C 4.297 -6.109 -7.272 1.00 . A A . 36 ARG CZ 1 1 4 2797 1 1 39 ARG H H 8.862 -6.391 -2.939 1.00 . A A . 36 ARG H 1 1 4 2798 1 1 39 ARG HA H 9.936 -8.343 -4.857 1.00 . A A . 36 ARG HA 1 1 4 2799 1 1 39 ARG HB2 H 7.903 -7.620 -6.304 1.00 . A A . 36 ARG HB2 1 1 4 2800 1 1 39 ARG HB3 H 7.671 -8.804 -5.025 1.00 . A A . 36 ARG HB3 1 1 4 2801 1 1 39 ARG HD2 H 5.418 -8.077 -5.699 1.00 . A A . 36 ARG HD2 1 1 4 2802 1 1 39 ARG HD3 H 4.697 -6.871 -4.636 1.00 . A A . 36 ARG HD3 1 1 4 2803 1 1 39 ARG HE H 6.102 -5.505 -6.630 1.00 . A A . 36 ARG HE 1 1 4 2804 1 1 39 ARG HG2 H 6.701 -7.174 -3.587 1.00 . A A . 36 ARG HG2 1 1 4 2805 1 1 39 ARG HG3 H 7.135 -5.867 -4.689 1.00 . A A . 36 ARG HG3 1 1 4 2806 1 1 39 ARG HH11 H 3.337 -7.648 -6.367 1.00 . A A . 36 ARG HH11 1 1 4 2807 1 1 39 ARG HH12 H 2.501 -6.938 -7.710 1.00 . A A . 36 ARG HH12 1 1 4 2808 1 1 39 ARG HH21 H 4.995 -4.567 -8.385 1.00 . A A . 36 ARG HH21 1 1 4 2809 1 1 39 ARG HH22 H 3.432 -5.167 -8.843 1.00 . A A . 36 ARG HH22 1 1 4 2810 1 1 39 ARG N N 9.281 -7.212 -3.266 1.00 . A A . 36 ARG N 1 1 4 2811 1 1 39 ARG NE N 5.361 -6.149 -6.471 1.00 . A A . 36 ARG NE 1 1 4 2812 1 1 39 ARG NH1 N 3.298 -6.965 -7.101 1.00 . A A . 36 ARG NH1 1 1 4 2813 1 1 39 ARG NH2 N 4.237 -5.213 -8.246 1.00 . A A . 36 ARG NH2 1 1 4 2814 1 1 39 ARG O O 10.668 -6.505 -6.428 1.00 . A A . 36 ARG O 1 1 4 2815 1 1 40 ASP C C 11.158 -3.155 -4.935 1.00 . A A . 37 ASP C 1 1 4 2816 1 1 40 ASP CA C 10.104 -3.894 -5.746 1.00 . A A . 37 ASP CA 1 1 4 2817 1 1 40 ASP CB C 8.951 -2.942 -6.082 1.00 . A A . 37 ASP CB 1 1 4 2818 1 1 40 ASP CG C 8.038 -3.483 -7.163 1.00 . A A . 37 ASP CG 1 1 4 2819 1 1 40 ASP H H 9.049 -4.975 -4.251 1.00 . A A . 37 ASP H 1 1 4 2820 1 1 40 ASP HA H 10.556 -4.225 -6.669 1.00 . A A . 37 ASP HA 1 1 4 2821 1 1 40 ASP HB2 H 8.362 -2.774 -5.194 1.00 . A A . 37 ASP HB2 1 1 4 2822 1 1 40 ASP HB3 H 9.359 -2.000 -6.420 1.00 . A A . 37 ASP HB3 1 1 4 2823 1 1 40 ASP N N 9.620 -5.083 -5.045 1.00 . A A . 37 ASP N 1 1 4 2824 1 1 40 ASP O O 11.671 -2.125 -5.368 1.00 . A A . 37 ASP O 1 1 4 2825 1 1 40 ASP OD1 O 8.402 -3.387 -8.356 1.00 . A A . 37 ASP OD1 1 1 4 2826 1 1 40 ASP OD2 O 6.953 -4.003 -6.830 1.00 . A A . 37 ASP OD2 1 1 4 2827 1 1 41 ASN C C 12.011 -1.699 -2.436 1.00 . A A . 38 ASN C 1 1 4 2828 1 1 41 ASN CA C 12.436 -3.107 -2.834 1.00 . A A . 38 ASN CA 1 1 4 2829 1 1 41 ASN CB C 13.842 -3.075 -3.440 1.00 . A A . 38 ASN CB 1 1 4 2830 1 1 41 ASN CG C 14.888 -2.646 -2.430 1.00 . A A . 38 ASN CG 1 1 4 2831 1 1 41 ASN H H 11.040 -4.545 -3.509 1.00 . A A . 38 ASN H 1 1 4 2832 1 1 41 ASN HA H 12.454 -3.722 -1.946 1.00 . A A . 38 ASN HA 1 1 4 2833 1 1 41 ASN HB2 H 14.094 -4.061 -3.799 1.00 . A A . 38 ASN HB2 1 1 4 2834 1 1 41 ASN HB3 H 13.856 -2.379 -4.265 1.00 . A A . 38 ASN HB3 1 1 4 2835 1 1 41 ASN HD21 H 15.914 -1.713 -3.849 1.00 . A A . 38 ASN HD21 1 1 4 2836 1 1 41 ASN HD22 H 16.589 -1.640 -2.259 1.00 . A A . 38 ASN HD22 1 1 4 2837 1 1 41 ASN N N 11.471 -3.704 -3.761 1.00 . A A . 38 ASN N 1 1 4 2838 1 1 41 ASN ND2 N 15.897 -1.928 -2.890 1.00 . A A . 38 ASN ND2 1 1 4 2839 1 1 41 ASN O O 12.412 -0.712 -3.055 1.00 . A A . 38 ASN O 1 1 4 2840 1 1 41 ASN OD1 O 14.784 -2.946 -1.238 1.00 . A A . 38 ASN OD1 1 1 4 2841 1 1 42 CYS C C 10.704 -0.169 0.527 1.00 . A A . 39 CYS C 1 1 4 2842 1 1 42 CYS CA C 10.667 -0.318 -0.989 1.00 . A A . 39 CYS CA 1 1 4 2843 1 1 42 CYS CB C 9.233 -0.156 -1.506 1.00 . A A . 39 CYS CB 1 1 4 2844 1 1 42 CYS H H 10.971 -2.407 -0.890 1.00 . A A . 39 CYS H 1 1 4 2845 1 1 42 CYS HA H 11.284 0.452 -1.425 1.00 . A A . 39 CYS HA 1 1 4 2846 1 1 42 CYS HB2 H 9.226 -0.305 -2.575 1.00 . A A . 39 CYS HB2 1 1 4 2847 1 1 42 CYS HB3 H 8.606 -0.899 -1.042 1.00 . A A . 39 CYS HB3 1 1 4 2848 1 1 42 CYS N N 11.201 -1.602 -1.399 1.00 . A A . 39 CYS N 1 1 4 2849 1 1 42 CYS O O 10.917 -1.138 1.259 1.00 . A A . 39 CYS O 1 1 4 2850 1 1 42 CYS SG S 8.505 1.465 -1.173 1.00 . A A . 39 CYS SG 1 1 4 2851 1 1 43 SER C C 9.270 2.314 2.632 1.00 . A A . 40 SER C 1 1 4 2852 1 1 43 SER CA C 10.454 1.382 2.381 1.00 . A A . 40 SER CA 1 1 4 2853 1 1 43 SER CB C 11.765 2.050 2.790 1.00 . A A . 40 SER CB 1 1 4 2854 1 1 43 SER H H 10.359 1.774 0.327 1.00 . A A . 40 SER H 1 1 4 2855 1 1 43 SER HA H 10.320 0.469 2.941 1.00 . A A . 40 SER HA 1 1 4 2856 1 1 43 SER HB2 H 11.878 2.977 2.249 1.00 . A A . 40 SER HB2 1 1 4 2857 1 1 43 SER HB3 H 11.747 2.252 3.847 1.00 . A A . 40 SER HB3 1 1 4 2858 1 1 43 SER HG H 12.783 0.383 2.979 1.00 . A A . 40 SER HG 1 1 4 2859 1 1 43 SER N N 10.500 1.055 0.976 1.00 . A A . 40 SER N 1 1 4 2860 1 1 43 SER O O 8.586 2.713 1.691 1.00 . A A . 40 SER O 1 1 4 2861 1 1 43 SER OG O 12.876 1.215 2.500 1.00 . A A . 40 SER OG 1 1 4 2862 1 1 44 GLY C C 8.332 4.832 4.792 1.00 . A A . 41 GLY C 1 1 4 2863 1 1 44 GLY CA C 7.899 3.524 4.179 1.00 . A A . 41 GLY CA 1 1 4 2864 1 1 44 GLY H H 9.587 2.319 4.604 1.00 . A A . 41 GLY H 1 1 4 2865 1 1 44 GLY HA2 H 7.365 3.731 3.264 1.00 . A A . 41 GLY HA2 1 1 4 2866 1 1 44 GLY HA3 H 7.238 3.020 4.858 1.00 . A A . 41 GLY HA3 1 1 4 2867 1 1 44 GLY N N 9.017 2.656 3.879 1.00 . A A . 41 GLY N 1 1 4 2868 1 1 44 GLY O O 7.822 5.243 5.834 1.00 . A A . 41 GLY O 1 1 4 2869 1 1 45 GLN C C 9.805 7.670 3.328 1.00 . A A . 42 GLN C 1 1 4 2870 1 1 45 GLN CA C 9.762 6.785 4.556 1.00 . A A . 42 GLN CA 1 1 4 2871 1 1 45 GLN CB C 11.155 6.707 5.200 1.00 . A A . 42 GLN CB 1 1 4 2872 1 1 45 GLN CD C 11.342 4.374 6.160 1.00 . A A . 42 GLN CD 1 1 4 2873 1 1 45 GLN CG C 11.225 5.855 6.459 1.00 . A A . 42 GLN CG 1 1 4 2874 1 1 45 GLN H H 9.670 5.078 3.339 1.00 . A A . 42 GLN H 1 1 4 2875 1 1 45 GLN HA H 9.056 7.193 5.265 1.00 . A A . 42 GLN HA 1 1 4 2876 1 1 45 GLN HB2 H 11.844 6.293 4.479 1.00 . A A . 42 GLN HB2 1 1 4 2877 1 1 45 GLN HB3 H 11.474 7.706 5.451 1.00 . A A . 42 GLN HB3 1 1 4 2878 1 1 45 GLN HE21 H 10.351 3.934 7.821 1.00 . A A . 42 GLN HE21 1 1 4 2879 1 1 45 GLN HE22 H 10.862 2.584 6.866 1.00 . A A . 42 GLN HE22 1 1 4 2880 1 1 45 GLN HG2 H 12.087 6.157 7.036 1.00 . A A . 42 GLN HG2 1 1 4 2881 1 1 45 GLN HG3 H 10.330 6.019 7.039 1.00 . A A . 42 GLN HG3 1 1 4 2882 1 1 45 GLN N N 9.285 5.479 4.143 1.00 . A A . 42 GLN N 1 1 4 2883 1 1 45 GLN NE2 N 10.797 3.548 7.034 1.00 . A A . 42 GLN NE2 1 1 4 2884 1 1 45 GLN O O 10.360 7.278 2.299 1.00 . A A . 42 GLN O 1 1 4 2885 1 1 45 GLN OE1 O 11.918 3.976 5.149 1.00 . A A . 42 GLN OE1 1 1 4 2886 1 1 46 THR C C 10.399 10.377 1.925 1.00 . A A . 43 THR C 1 1 4 2887 1 1 46 THR CA C 9.077 9.694 2.254 1.00 . A A . 43 THR CA 1 1 4 2888 1 1 46 THR CB C 7.998 10.770 2.461 1.00 . A A . 43 THR CB 1 1 4 2889 1 1 46 THR CG2 C 7.482 11.258 1.119 1.00 . A A . 43 THR CG2 1 1 4 2890 1 1 46 THR H H 8.843 9.139 4.276 1.00 . A A . 43 THR H 1 1 4 2891 1 1 46 THR HA H 8.784 9.071 1.420 1.00 . A A . 43 THR HA 1 1 4 2892 1 1 46 THR HB H 8.434 11.605 2.990 1.00 . A A . 43 THR HB 1 1 4 2893 1 1 46 THR HG1 H 6.074 10.546 2.838 1.00 . A A . 43 THR HG1 1 1 4 2894 1 1 46 THR HG21 H 7.103 10.418 0.554 1.00 . A A . 43 THR HG21 1 1 4 2895 1 1 46 THR HG22 H 8.286 11.728 0.572 1.00 . A A . 43 THR HG22 1 1 4 2896 1 1 46 THR HG23 H 6.688 11.972 1.276 1.00 . A A . 43 THR HG23 1 1 4 2897 1 1 46 THR N N 9.204 8.840 3.414 1.00 . A A . 43 THR N 1 1 4 2898 1 1 46 THR O O 11.070 10.914 2.809 1.00 . A A . 43 THR O 1 1 4 2899 1 1 46 THR OG1 O 6.906 10.241 3.225 1.00 . A A . 43 THR OG1 1 1 4 2900 1 1 47 HIS C C 11.694 11.755 -1.095 1.00 . A A . 44 HIS C 1 1 4 2901 1 1 47 HIS CA C 11.982 11.005 0.199 1.00 . A A . 44 HIS CA 1 1 4 2902 1 1 47 HIS CB C 13.103 9.982 -0.013 1.00 . A A . 44 HIS CB 1 1 4 2903 1 1 47 HIS CD2 C 15.299 11.298 0.383 1.00 . A A . 44 HIS CD2 1 1 4 2904 1 1 47 HIS CE1 C 16.164 11.095 -1.619 1.00 . A A . 44 HIS CE1 1 1 4 2905 1 1 47 HIS CG C 14.427 10.586 -0.366 1.00 . A A . 44 HIS CG 1 1 4 2906 1 1 47 HIS H H 10.221 9.855 0.006 1.00 . A A . 44 HIS H 1 1 4 2907 1 1 47 HIS HA H 12.283 11.712 0.957 1.00 . A A . 44 HIS HA 1 1 4 2908 1 1 47 HIS HB2 H 13.233 9.409 0.893 1.00 . A A . 44 HIS HB2 1 1 4 2909 1 1 47 HIS HB3 H 12.820 9.316 -0.814 1.00 . A A . 44 HIS HB3 1 1 4 2910 1 1 47 HIS HD1 H 14.610 10.000 -2.384 1.00 . A A . 44 HIS HD1 1 1 4 2911 1 1 47 HIS HD2 H 15.178 11.572 1.420 1.00 . A A . 44 HIS HD2 1 1 4 2912 1 1 47 HIS HE1 H 16.833 11.176 -2.462 1.00 . A A . 44 HIS HE1 1 1 4 2913 1 1 47 HIS HE2 H 17.222 11.985 -0.107 1.00 . A A . 44 HIS HE2 1 1 4 2914 1 1 47 HIS N N 10.774 10.343 0.657 1.00 . A A . 44 HIS N 1 1 4 2915 1 1 47 HIS ND1 N 14.998 10.476 -1.615 1.00 . A A . 44 HIS ND1 1 1 4 2916 1 1 47 HIS NE2 N 16.371 11.602 -0.418 1.00 . A A . 44 HIS NE2 1 1 4 2917 1 1 47 HIS O O 11.363 11.147 -2.111 1.00 . A A . 44 HIS O 1 1 4 2918 1 1 48 ASP C C 12.788 14.293 -2.917 1.00 . A A . 45 ASP C 1 1 4 2919 1 1 48 ASP CA C 11.500 13.895 -2.215 1.00 . A A . 45 ASP CA 1 1 4 2920 1 1 48 ASP CB C 10.712 15.149 -1.822 1.00 . A A . 45 ASP CB 1 1 4 2921 1 1 48 ASP CG C 9.342 14.834 -1.254 1.00 . A A . 45 ASP CG 1 1 4 2922 1 1 48 ASP H H 12.079 13.504 -0.216 1.00 . A A . 45 ASP H 1 1 4 2923 1 1 48 ASP HA H 10.903 13.304 -2.895 1.00 . A A . 45 ASP HA 1 1 4 2924 1 1 48 ASP HB2 H 11.269 15.695 -1.076 1.00 . A A . 45 ASP HB2 1 1 4 2925 1 1 48 ASP HB3 H 10.585 15.774 -2.694 1.00 . A A . 45 ASP HB3 1 1 4 2926 1 1 48 ASP N N 11.791 13.072 -1.049 1.00 . A A . 45 ASP N 1 1 4 2927 1 1 48 ASP O O 13.382 15.324 -2.537 1.00 . A A . 45 ASP O 1 1 4 2928 1 1 48 ASP OXT O 13.209 13.569 -3.841 1.00 . A A . 45 ASP OXT 1 1 4 2929 1 1 48 ASP OD1 O 8.461 14.381 -2.016 1.00 . A A . 45 ASP OD1 1 1 4 2930 1 1 48 ASP OD2 O 9.131 15.057 -0.045 1.00 . A A . 45 ASP OD2 1 1 4 2931 2 2 1 ZN ZN ZN -4.323 -5.525 0.505 1.00 . B A . 101 ZN ZN 1 1 4 2932 3 2 1 ZN ZN ZN 6.228 1.381 -1.437 1.00 . C A . 102 ZN ZN 1 1 5 2933 1 1 1 GLY C C -14.439 8.861 -6.838 1.00 . A A . -2 GLY C 1 1 5 2934 1 1 1 GLY CA C -15.156 8.298 -8.046 1.00 . A A . -2 GLY CA 1 1 5 2935 1 1 1 GLY H1 H -14.728 7.375 -9.862 1.00 . A A . -2 GLY H1 1 1 5 2936 1 1 1 GLY H2 H -13.647 6.984 -8.622 1.00 . A A . -2 GLY H2 1 1 5 2937 1 1 1 GLY H3 H -13.563 8.496 -9.370 1.00 . A A . -2 GLY H3 1 1 5 2938 1 1 1 GLY HA2 H -15.736 9.083 -8.507 1.00 . A A . -2 GLY HA2 1 1 5 2939 1 1 1 GLY HA3 H -15.822 7.511 -7.725 1.00 . A A . -2 GLY HA3 1 1 5 2940 1 1 1 GLY N N -14.208 7.750 -9.044 1.00 . A A . -2 GLY N 1 1 5 2941 1 1 1 GLY O O -13.352 9.424 -6.973 1.00 . A A . -2 GLY O 1 1 5 2942 1 1 2 PRO C C -13.078 8.558 -4.096 1.00 . A A . -1 PRO C 1 1 5 2943 1 1 2 PRO CA C -14.417 9.225 -4.399 1.00 . A A . -1 PRO CA 1 1 5 2944 1 1 2 PRO CB C -15.444 8.873 -3.315 1.00 . A A . -1 PRO CB 1 1 5 2945 1 1 2 PRO CD C -16.307 8.052 -5.382 1.00 . A A . -1 PRO CD 1 1 5 2946 1 1 2 PRO CG C -16.713 8.606 -4.049 1.00 . A A . -1 PRO CG 1 1 5 2947 1 1 2 PRO HA H -14.282 10.294 -4.437 1.00 . A A . -1 PRO HA 1 1 5 2948 1 1 2 PRO HB2 H -15.111 8.001 -2.773 1.00 . A A . -1 PRO HB2 1 1 5 2949 1 1 2 PRO HB3 H -15.550 9.706 -2.635 1.00 . A A . -1 PRO HB3 1 1 5 2950 1 1 2 PRO HD2 H -16.185 6.980 -5.325 1.00 . A A . -1 PRO HD2 1 1 5 2951 1 1 2 PRO HD3 H -17.032 8.314 -6.138 1.00 . A A . -1 PRO HD3 1 1 5 2952 1 1 2 PRO HG2 H -17.306 7.883 -3.506 1.00 . A A . -1 PRO HG2 1 1 5 2953 1 1 2 PRO HG3 H -17.266 9.526 -4.177 1.00 . A A . -1 PRO HG3 1 1 5 2954 1 1 2 PRO N N -15.019 8.718 -5.635 1.00 . A A . -1 PRO N 1 1 5 2955 1 1 2 PRO O O -12.981 7.330 -4.032 1.00 . A A . -1 PRO O 1 1 5 2956 1 1 3 HIS C C -10.527 8.532 -2.154 1.00 . A A . 0 HIS C 1 1 5 2957 1 1 3 HIS CA C -10.706 8.870 -3.632 1.00 . A A . 0 HIS CA 1 1 5 2958 1 1 3 HIS CB C -9.651 9.886 -4.079 1.00 . A A . 0 HIS CB 1 1 5 2959 1 1 3 HIS CD2 C -10.376 10.571 -6.481 1.00 . A A . 0 HIS CD2 1 1 5 2960 1 1 3 HIS CE1 C -8.621 9.840 -7.565 1.00 . A A . 0 HIS CE1 1 1 5 2961 1 1 3 HIS CG C -9.535 10.024 -5.569 1.00 . A A . 0 HIS CG 1 1 5 2962 1 1 3 HIS H H -12.200 10.345 -3.919 1.00 . A A . 0 HIS H 1 1 5 2963 1 1 3 HIS HA H -10.581 7.964 -4.207 1.00 . A A . 0 HIS HA 1 1 5 2964 1 1 3 HIS HB2 H -9.903 10.856 -3.677 1.00 . A A . 0 HIS HB2 1 1 5 2965 1 1 3 HIS HB3 H -8.688 9.584 -3.695 1.00 . A A . 0 HIS HB3 1 1 5 2966 1 1 3 HIS HD1 H -7.655 9.133 -5.906 1.00 . A A . 0 HIS HD1 1 1 5 2967 1 1 3 HIS HD2 H -11.337 11.023 -6.276 1.00 . A A . 0 HIS HD2 1 1 5 2968 1 1 3 HIS HE1 H -7.930 9.601 -8.359 1.00 . A A . 0 HIS HE1 1 1 5 2969 1 1 3 HIS HE2 H -10.091 10.883 -8.537 1.00 . A A . 0 HIS HE2 1 1 5 2970 1 1 3 HIS N N -12.051 9.374 -3.895 1.00 . A A . 0 HIS N 1 1 5 2971 1 1 3 HIS ND1 N -8.444 9.577 -6.284 1.00 . A A . 0 HIS ND1 1 1 5 2972 1 1 3 HIS NE2 N -9.785 10.442 -7.712 1.00 . A A . 0 HIS NE2 1 1 5 2973 1 1 3 HIS O O -9.422 8.232 -1.699 1.00 . A A . 0 HIS O 1 1 5 2974 1 1 4 MET C C -11.983 6.691 0.090 1.00 . A A . 1 MET C 1 1 5 2975 1 1 4 MET CA C -11.637 8.172 -0.008 1.00 . A A . 1 MET CA 1 1 5 2976 1 1 4 MET CB C -12.636 9.007 0.792 1.00 . A A . 1 MET CB 1 1 5 2977 1 1 4 MET CE C -16.777 9.475 0.505 1.00 . A A . 1 MET CE 1 1 5 2978 1 1 4 MET CG C -14.077 8.872 0.322 1.00 . A A . 1 MET CG 1 1 5 2979 1 1 4 MET H H -12.452 8.919 -1.812 1.00 . A A . 1 MET H 1 1 5 2980 1 1 4 MET HA H -10.644 8.326 0.389 1.00 . A A . 1 MET HA 1 1 5 2981 1 1 4 MET HB2 H -12.591 8.701 1.827 1.00 . A A . 1 MET HB2 1 1 5 2982 1 1 4 MET HB3 H -12.353 10.047 0.723 1.00 . A A . 1 MET HB3 1 1 5 2983 1 1 4 MET HE1 H -16.954 8.418 0.641 1.00 . A A . 1 MET HE1 1 1 5 2984 1 1 4 MET HE2 H -16.748 9.702 -0.550 1.00 . A A . 1 MET HE2 1 1 5 2985 1 1 4 MET HE3 H -17.573 10.036 0.973 1.00 . A A . 1 MET HE3 1 1 5 2986 1 1 4 MET HG2 H -14.129 9.150 -0.721 1.00 . A A . 1 MET HG2 1 1 5 2987 1 1 4 MET HG3 H -14.381 7.843 0.434 1.00 . A A . 1 MET HG3 1 1 5 2988 1 1 4 MET N N -11.626 8.584 -1.409 1.00 . A A . 1 MET N 1 1 5 2989 1 1 4 MET O O -12.288 6.168 1.165 1.00 . A A . 1 MET O 1 1 5 2990 1 1 4 MET SD S -15.212 9.917 1.256 1.00 . A A . 1 MET SD 1 1 5 2991 1 1 5 ALA C C -11.484 4.127 -2.426 1.00 . A A . 2 ALA C 1 1 5 2992 1 1 5 ALA CA C -12.165 4.613 -1.173 1.00 . A A . 2 ALA CA 1 1 5 2993 1 1 5 ALA CB C -13.648 4.282 -1.214 1.00 . A A . 2 ALA CB 1 1 5 2994 1 1 5 ALA H H -11.694 6.528 -1.866 1.00 . A A . 2 ALA H 1 1 5 2995 1 1 5 ALA HA H -11.719 4.118 -0.321 1.00 . A A . 2 ALA HA 1 1 5 2996 1 1 5 ALA HB1 H -14.106 4.581 -0.285 1.00 . A A . 2 ALA HB1 1 1 5 2997 1 1 5 ALA HB2 H -13.773 3.215 -1.353 1.00 . A A . 2 ALA HB2 1 1 5 2998 1 1 5 ALA HB3 H -14.112 4.808 -2.033 1.00 . A A . 2 ALA HB3 1 1 5 2999 1 1 5 ALA N N -11.932 6.035 -1.056 1.00 . A A . 2 ALA N 1 1 5 3000 1 1 5 ALA O O -11.024 4.934 -3.238 1.00 . A A . 2 ALA O 1 1 5 3001 1 1 6 VAL C C -10.623 0.722 -3.356 1.00 . A A . 3 VAL C 1 1 5 3002 1 1 6 VAL CA C -10.638 2.213 -3.619 1.00 . A A . 3 VAL CA 1 1 5 3003 1 1 6 VAL CB C -9.189 2.748 -3.544 1.00 . A A . 3 VAL CB 1 1 5 3004 1 1 6 VAL CG1 C -8.388 1.970 -2.539 1.00 . A A . 3 VAL CG1 1 1 5 3005 1 1 6 VAL CG2 C -8.479 2.715 -4.867 1.00 . A A . 3 VAL CG2 1 1 5 3006 1 1 6 VAL H H -11.967 2.251 -1.994 1.00 . A A . 3 VAL H 1 1 5 3007 1 1 6 VAL HA H -11.062 2.433 -4.583 1.00 . A A . 3 VAL HA 1 1 5 3008 1 1 6 VAL HB H -9.230 3.776 -3.212 1.00 . A A . 3 VAL HB 1 1 5 3009 1 1 6 VAL HG11 H -7.569 2.581 -2.192 1.00 . A A . 3 VAL HG11 1 1 5 3010 1 1 6 VAL HG12 H -8.001 1.075 -3.003 1.00 . A A . 3 VAL HG12 1 1 5 3011 1 1 6 VAL HG13 H -9.025 1.701 -1.709 1.00 . A A . 3 VAL HG13 1 1 5 3012 1 1 6 VAL HG21 H -8.516 1.716 -5.268 1.00 . A A . 3 VAL HG21 1 1 5 3013 1 1 6 VAL HG22 H -7.450 3.001 -4.704 1.00 . A A . 3 VAL HG22 1 1 5 3014 1 1 6 VAL HG23 H -8.947 3.404 -5.549 1.00 . A A . 3 VAL HG23 1 1 5 3015 1 1 6 VAL N N -11.439 2.827 -2.587 1.00 . A A . 3 VAL N 1 1 5 3016 1 1 6 VAL O O -11.251 0.259 -2.400 1.00 . A A . 3 VAL O 1 1 5 3017 1 1 7 LEU C C -8.031 -1.448 -3.702 1.00 . A A . 4 LEU C 1 1 5 3018 1 1 7 LEU CA C -9.544 -1.361 -3.789 1.00 . A A . 4 LEU CA 1 1 5 3019 1 1 7 LEU CB C -10.102 -2.405 -4.756 1.00 . A A . 4 LEU CB 1 1 5 3020 1 1 7 LEU CD1 C -12.063 -3.632 -5.717 1.00 . A A . 4 LEU CD1 1 1 5 3021 1 1 7 LEU CD2 C -12.205 -2.676 -3.405 1.00 . A A . 4 LEU CD2 1 1 5 3022 1 1 7 LEU CG C -11.629 -2.496 -4.806 1.00 . A A . 4 LEU CG 1 1 5 3023 1 1 7 LEU H H -9.648 0.326 -5.049 1.00 . A A . 4 LEU H 1 1 5 3024 1 1 7 LEU HA H -9.950 -1.528 -2.801 1.00 . A A . 4 LEU HA 1 1 5 3025 1 1 7 LEU HB2 H -9.743 -2.174 -5.748 1.00 . A A . 4 LEU HB2 1 1 5 3026 1 1 7 LEU HB3 H -9.716 -3.371 -4.469 1.00 . A A . 4 LEU HB3 1 1 5 3027 1 1 7 LEU HD11 H -11.648 -4.561 -5.357 1.00 . A A . 4 LEU HD11 1 1 5 3028 1 1 7 LEU HD12 H -11.710 -3.443 -6.719 1.00 . A A . 4 LEU HD12 1 1 5 3029 1 1 7 LEU HD13 H -13.140 -3.697 -5.722 1.00 . A A . 4 LEU HD13 1 1 5 3030 1 1 7 LEU HD21 H -13.259 -2.891 -3.475 1.00 . A A . 4 LEU HD21 1 1 5 3031 1 1 7 LEU HD22 H -12.062 -1.764 -2.838 1.00 . A A . 4 LEU HD22 1 1 5 3032 1 1 7 LEU HD23 H -11.701 -3.494 -2.907 1.00 . A A . 4 LEU HD23 1 1 5 3033 1 1 7 LEU HG H -12.022 -1.577 -5.213 1.00 . A A . 4 LEU HG 1 1 5 3034 1 1 7 LEU N N -9.918 -0.025 -4.173 1.00 . A A . 4 LEU N 1 1 5 3035 1 1 7 LEU O O -7.325 -1.018 -4.613 1.00 . A A . 4 LEU O 1 1 5 3036 1 1 8 CYS C C -5.303 -2.462 -3.466 1.00 . A A . 5 CYS C 1 1 5 3037 1 1 8 CYS CA C -6.148 -2.112 -2.244 1.00 . A A . 5 CYS CA 1 1 5 3038 1 1 8 CYS CB C -6.023 -3.201 -1.183 1.00 . A A . 5 CYS CB 1 1 5 3039 1 1 8 CYS H H -8.227 -2.266 -1.901 1.00 . A A . 5 CYS H 1 1 5 3040 1 1 8 CYS HA H -5.800 -1.179 -1.830 1.00 . A A . 5 CYS HA 1 1 5 3041 1 1 8 CYS HB2 H -6.553 -2.882 -0.301 1.00 . A A . 5 CYS HB2 1 1 5 3042 1 1 8 CYS HB3 H -6.483 -4.105 -1.558 1.00 . A A . 5 CYS HB3 1 1 5 3043 1 1 8 CYS N N -7.569 -1.967 -2.567 1.00 . A A . 5 CYS N 1 1 5 3044 1 1 8 CYS O O -5.505 -3.494 -4.088 1.00 . A A . 5 CYS O 1 1 5 3045 1 1 8 CYS SG S -4.339 -3.615 -0.677 1.00 . A A . 5 CYS SG 1 1 5 3046 1 1 9 GLY C C -2.802 -3.079 -5.077 1.00 . A A . 6 GLY C 1 1 5 3047 1 1 9 GLY CA C -3.540 -1.753 -4.986 1.00 . A A . 6 GLY CA 1 1 5 3048 1 1 9 GLY H H -4.169 -0.839 -3.175 1.00 . A A . 6 GLY H 1 1 5 3049 1 1 9 GLY HA2 H -4.190 -1.665 -5.839 1.00 . A A . 6 GLY HA2 1 1 5 3050 1 1 9 GLY HA3 H -2.817 -0.952 -5.021 1.00 . A A . 6 GLY HA3 1 1 5 3051 1 1 9 GLY N N -4.338 -1.602 -3.776 1.00 . A A . 6 GLY N 1 1 5 3052 1 1 9 GLY O O -2.455 -3.529 -6.170 1.00 . A A . 6 GLY O 1 1 5 3053 1 1 10 VAL C C -2.737 -6.170 -4.115 1.00 . A A . 7 VAL C 1 1 5 3054 1 1 10 VAL CA C -1.821 -4.963 -3.908 1.00 . A A . 7 VAL CA 1 1 5 3055 1 1 10 VAL CB C -1.052 -5.125 -2.583 1.00 . A A . 7 VAL CB 1 1 5 3056 1 1 10 VAL CG1 C -0.376 -6.484 -2.512 1.00 . A A . 7 VAL CG1 1 1 5 3057 1 1 10 VAL CG2 C -0.030 -4.010 -2.424 1.00 . A A . 7 VAL CG2 1 1 5 3058 1 1 10 VAL H H -2.879 -3.316 -3.100 1.00 . A A . 7 VAL H 1 1 5 3059 1 1 10 VAL HA H -1.098 -4.937 -4.711 1.00 . A A . 7 VAL HA 1 1 5 3060 1 1 10 VAL HB H -1.759 -5.055 -1.768 1.00 . A A . 7 VAL HB 1 1 5 3061 1 1 10 VAL HG11 H 0.336 -6.575 -3.319 1.00 . A A . 7 VAL HG11 1 1 5 3062 1 1 10 VAL HG12 H -1.122 -7.260 -2.601 1.00 . A A . 7 VAL HG12 1 1 5 3063 1 1 10 VAL HG13 H 0.135 -6.583 -1.566 1.00 . A A . 7 VAL HG13 1 1 5 3064 1 1 10 VAL HG21 H 0.485 -4.124 -1.481 1.00 . A A . 7 VAL HG21 1 1 5 3065 1 1 10 VAL HG22 H -0.533 -3.056 -2.448 1.00 . A A . 7 VAL HG22 1 1 5 3066 1 1 10 VAL HG23 H 0.685 -4.062 -3.232 1.00 . A A . 7 VAL HG23 1 1 5 3067 1 1 10 VAL N N -2.559 -3.707 -3.938 1.00 . A A . 7 VAL N 1 1 5 3068 1 1 10 VAL O O -2.597 -6.899 -5.096 1.00 . A A . 7 VAL O 1 1 5 3069 1 1 11 CYS C C -5.862 -7.280 -3.876 1.00 . A A . 8 CYS C 1 1 5 3070 1 1 11 CYS CA C -4.514 -7.568 -3.214 1.00 . A A . 8 CYS CA 1 1 5 3071 1 1 11 CYS CB C -4.722 -8.085 -1.787 1.00 . A A . 8 CYS CB 1 1 5 3072 1 1 11 CYS H H -3.807 -5.703 -2.498 1.00 . A A . 8 CYS H 1 1 5 3073 1 1 11 CYS HA H -4.000 -8.322 -3.788 1.00 . A A . 8 CYS HA 1 1 5 3074 1 1 11 CYS HB2 H -5.202 -9.050 -1.831 1.00 . A A . 8 CYS HB2 1 1 5 3075 1 1 11 CYS HB3 H -3.762 -8.189 -1.305 1.00 . A A . 8 CYS HB3 1 1 5 3076 1 1 11 CYS N N -3.675 -6.371 -3.194 1.00 . A A . 8 CYS N 1 1 5 3077 1 1 11 CYS O O -6.511 -8.190 -4.397 1.00 . A A . 8 CYS O 1 1 5 3078 1 1 11 CYS SG S -5.743 -7.016 -0.748 1.00 . A A . 8 CYS SG 1 1 5 3079 1 1 12 GLY C C -8.702 -6.405 -4.185 1.00 . A A . 9 GLY C 1 1 5 3080 1 1 12 GLY CA C -7.479 -5.583 -4.536 1.00 . A A . 9 GLY CA 1 1 5 3081 1 1 12 GLY H H -5.696 -5.347 -3.425 1.00 . A A . 9 GLY H 1 1 5 3082 1 1 12 GLY HA2 H -7.670 -4.554 -4.268 1.00 . A A . 9 GLY HA2 1 1 5 3083 1 1 12 GLY HA3 H -7.320 -5.635 -5.602 1.00 . A A . 9 GLY HA3 1 1 5 3084 1 1 12 GLY N N -6.259 -6.015 -3.868 1.00 . A A . 9 GLY N 1 1 5 3085 1 1 12 GLY O O -9.236 -7.115 -5.043 1.00 . A A . 9 GLY O 1 1 5 3086 1 1 13 ILE C C -11.235 -6.170 -1.600 1.00 . A A . 10 ILE C 1 1 5 3087 1 1 13 ILE CA C -10.354 -7.024 -2.517 1.00 . A A . 10 ILE CA 1 1 5 3088 1 1 13 ILE CB C -10.038 -8.388 -1.847 1.00 . A A . 10 ILE CB 1 1 5 3089 1 1 13 ILE CD1 C -8.998 -7.567 0.333 1.00 . A A . 10 ILE CD1 1 1 5 3090 1 1 13 ILE CG1 C -8.789 -8.308 -0.965 1.00 . A A . 10 ILE CG1 1 1 5 3091 1 1 13 ILE CG2 C -9.872 -9.472 -2.901 1.00 . A A . 10 ILE CG2 1 1 5 3092 1 1 13 ILE H H -8.646 -5.789 -2.281 1.00 . A A . 10 ILE H 1 1 5 3093 1 1 13 ILE HA H -10.920 -7.231 -3.415 1.00 . A A . 10 ILE HA 1 1 5 3094 1 1 13 ILE HB H -10.884 -8.656 -1.232 1.00 . A A . 10 ILE HB 1 1 5 3095 1 1 13 ILE HD11 H -9.701 -8.108 0.949 1.00 . A A . 10 ILE HD11 1 1 5 3096 1 1 13 ILE HD12 H -9.391 -6.581 0.119 1.00 . A A . 10 ILE HD12 1 1 5 3097 1 1 13 ILE HD13 H -8.056 -7.476 0.852 1.00 . A A . 10 ILE HD13 1 1 5 3098 1 1 13 ILE HG12 H -8.463 -9.307 -0.723 1.00 . A A . 10 ILE HG12 1 1 5 3099 1 1 13 ILE HG13 H -8.006 -7.803 -1.510 1.00 . A A . 10 ILE HG13 1 1 5 3100 1 1 13 ILE HG21 H -9.058 -9.211 -3.560 1.00 . A A . 10 ILE HG21 1 1 5 3101 1 1 13 ILE HG22 H -10.783 -9.562 -3.473 1.00 . A A . 10 ILE HG22 1 1 5 3102 1 1 13 ILE HG23 H -9.656 -10.414 -2.419 1.00 . A A . 10 ILE HG23 1 1 5 3103 1 1 13 ILE N N -9.145 -6.321 -2.936 1.00 . A A . 10 ILE N 1 1 5 3104 1 1 13 ILE O O -12.442 -6.387 -1.526 1.00 . A A . 10 ILE O 1 1 5 3105 1 1 14 LYS C C -10.857 -2.882 -0.096 1.00 . A A . 11 LYS C 1 1 5 3106 1 1 14 LYS CA C -11.413 -4.301 -0.053 1.00 . A A . 11 LYS CA 1 1 5 3107 1 1 14 LYS CB C -11.456 -4.793 1.402 1.00 . A A . 11 LYS CB 1 1 5 3108 1 1 14 LYS CD C -10.263 -4.784 3.627 1.00 . A A . 11 LYS CD 1 1 5 3109 1 1 14 LYS CE C -11.076 -5.967 4.138 1.00 . A A . 11 LYS CE 1 1 5 3110 1 1 14 LYS CG C -10.107 -4.794 2.110 1.00 . A A . 11 LYS CG 1 1 5 3111 1 1 14 LYS H H -9.677 -5.071 -0.985 1.00 . A A . 11 LYS H 1 1 5 3112 1 1 14 LYS HA H -12.422 -4.279 -0.438 1.00 . A A . 11 LYS HA 1 1 5 3113 1 1 14 LYS HB2 H -12.128 -4.161 1.961 1.00 . A A . 11 LYS HB2 1 1 5 3114 1 1 14 LYS HB3 H -11.841 -5.802 1.412 1.00 . A A . 11 LYS HB3 1 1 5 3115 1 1 14 LYS HD2 H -9.281 -4.820 4.075 1.00 . A A . 11 LYS HD2 1 1 5 3116 1 1 14 LYS HD3 H -10.756 -3.868 3.919 1.00 . A A . 11 LYS HD3 1 1 5 3117 1 1 14 LYS HE2 H -11.201 -5.866 5.207 1.00 . A A . 11 LYS HE2 1 1 5 3118 1 1 14 LYS HE3 H -12.047 -5.952 3.665 1.00 . A A . 11 LYS HE3 1 1 5 3119 1 1 14 LYS HG2 H -9.562 -5.679 1.825 1.00 . A A . 11 LYS HG2 1 1 5 3120 1 1 14 LYS HG3 H -9.554 -3.916 1.807 1.00 . A A . 11 LYS HG3 1 1 5 3121 1 1 14 LYS HZ1 H -10.413 -7.454 2.832 1.00 . A A . 11 LYS HZ1 1 1 5 3122 1 1 14 LYS HZ2 H -10.929 -8.040 4.330 1.00 . A A . 11 LYS HZ2 1 1 5 3123 1 1 14 LYS HZ3 H -9.437 -7.257 4.198 1.00 . A A . 11 LYS HZ3 1 1 5 3124 1 1 14 LYS N N -10.640 -5.196 -0.911 1.00 . A A . 11 LYS N 1 1 5 3125 1 1 14 LYS NZ N -10.420 -7.270 3.854 1.00 . A A . 11 LYS NZ 1 1 5 3126 1 1 14 LYS O O -9.838 -2.620 -0.747 1.00 . A A . 11 LYS O 1 1 5 3127 1 1 15 GLU C C -9.798 -0.375 1.287 1.00 . A A . 12 GLU C 1 1 5 3128 1 1 15 GLU CA C -11.180 -0.575 0.661 1.00 . A A . 12 GLU CA 1 1 5 3129 1 1 15 GLU CB C -12.244 0.178 1.465 1.00 . A A . 12 GLU CB 1 1 5 3130 1 1 15 GLU CD C -13.198 2.390 2.200 1.00 . A A . 12 GLU CD 1 1 5 3131 1 1 15 GLU CG C -12.169 1.690 1.337 1.00 . A A . 12 GLU CG 1 1 5 3132 1 1 15 GLU H H -12.302 -2.293 1.144 1.00 . A A . 12 GLU H 1 1 5 3133 1 1 15 GLU HA H -11.168 -0.198 -0.351 1.00 . A A . 12 GLU HA 1 1 5 3134 1 1 15 GLU HB2 H -13.220 -0.138 1.132 1.00 . A A . 12 GLU HB2 1 1 5 3135 1 1 15 GLU HB3 H -12.133 -0.077 2.510 1.00 . A A . 12 GLU HB3 1 1 5 3136 1 1 15 GLU HG2 H -11.185 2.016 1.638 1.00 . A A . 12 GLU HG2 1 1 5 3137 1 1 15 GLU HG3 H -12.338 1.959 0.305 1.00 . A A . 12 GLU HG3 1 1 5 3138 1 1 15 GLU N N -11.532 -1.988 0.618 1.00 . A A . 12 GLU N 1 1 5 3139 1 1 15 GLU O O -9.395 -1.119 2.186 1.00 . A A . 12 GLU O 1 1 5 3140 1 1 15 GLU OE1 O -14.341 2.591 1.735 1.00 . A A . 12 GLU OE1 1 1 5 3141 1 1 15 GLU OE2 O -12.872 2.734 3.353 1.00 . A A . 12 GLU OE2 1 1 5 3142 1 1 16 PHE C C -7.768 1.486 2.688 1.00 . A A . 13 PHE C 1 1 5 3143 1 1 16 PHE CA C -7.733 0.916 1.278 1.00 . A A . 13 PHE CA 1 1 5 3144 1 1 16 PHE CB C -7.030 1.900 0.335 1.00 . A A . 13 PHE CB 1 1 5 3145 1 1 16 PHE CD1 C -6.758 4.169 1.394 1.00 . A A . 13 PHE CD1 1 1 5 3146 1 1 16 PHE CD2 C -8.491 3.880 -0.217 1.00 . A A . 13 PHE CD2 1 1 5 3147 1 1 16 PHE CE1 C -7.122 5.493 1.550 1.00 . A A . 13 PHE CE1 1 1 5 3148 1 1 16 PHE CE2 C -8.859 5.199 -0.066 1.00 . A A . 13 PHE CE2 1 1 5 3149 1 1 16 PHE CG C -7.437 3.346 0.508 1.00 . A A . 13 PHE CG 1 1 5 3150 1 1 16 PHE CZ C -8.175 6.009 0.819 1.00 . A A . 13 PHE CZ 1 1 5 3151 1 1 16 PHE H H -9.462 1.191 0.096 1.00 . A A . 13 PHE H 1 1 5 3152 1 1 16 PHE HA H -7.180 -0.011 1.291 1.00 . A A . 13 PHE HA 1 1 5 3153 1 1 16 PHE HB2 H -5.967 1.837 0.475 1.00 . A A . 13 PHE HB2 1 1 5 3154 1 1 16 PHE HB3 H -7.258 1.616 -0.677 1.00 . A A . 13 PHE HB3 1 1 5 3155 1 1 16 PHE HD1 H -5.934 3.766 1.966 1.00 . A A . 13 PHE HD1 1 1 5 3156 1 1 16 PHE HD2 H -9.025 3.247 -0.924 1.00 . A A . 13 PHE HD2 1 1 5 3157 1 1 16 PHE HE1 H -6.584 6.123 2.241 1.00 . A A . 13 PHE HE1 1 1 5 3158 1 1 16 PHE HE2 H -9.682 5.597 -0.643 1.00 . A A . 13 PHE HE2 1 1 5 3159 1 1 16 PHE HZ H -8.461 7.044 0.938 1.00 . A A . 13 PHE HZ 1 1 5 3160 1 1 16 PHE N N -9.079 0.629 0.799 1.00 . A A . 13 PHE N 1 1 5 3161 1 1 16 PHE O O -8.764 2.072 3.108 1.00 . A A . 13 PHE O 1 1 5 3162 1 1 17 LYS C C -5.209 2.574 4.889 1.00 . A A . 14 LYS C 1 1 5 3163 1 1 17 LYS CA C -6.541 1.837 4.748 1.00 . A A . 14 LYS CA 1 1 5 3164 1 1 17 LYS CB C -6.643 0.687 5.758 1.00 . A A . 14 LYS CB 1 1 5 3165 1 1 17 LYS CD C -6.958 -0.018 8.147 1.00 . A A . 14 LYS CD 1 1 5 3166 1 1 17 LYS CE C -7.196 0.472 9.567 1.00 . A A . 14 LYS CE 1 1 5 3167 1 1 17 LYS CG C -6.647 1.135 7.209 1.00 . A A . 14 LYS CG 1 1 5 3168 1 1 17 LYS H H -5.920 0.823 3.006 1.00 . A A . 14 LYS H 1 1 5 3169 1 1 17 LYS HA H -7.347 2.532 4.918 1.00 . A A . 14 LYS HA 1 1 5 3170 1 1 17 LYS HB2 H -7.556 0.143 5.571 1.00 . A A . 14 LYS HB2 1 1 5 3171 1 1 17 LYS HB3 H -5.805 0.023 5.611 1.00 . A A . 14 LYS HB3 1 1 5 3172 1 1 17 LYS HD2 H -7.845 -0.526 7.798 1.00 . A A . 14 LYS HD2 1 1 5 3173 1 1 17 LYS HD3 H -6.125 -0.704 8.146 1.00 . A A . 14 LYS HD3 1 1 5 3174 1 1 17 LYS HE2 H -7.391 -0.380 10.200 1.00 . A A . 14 LYS HE2 1 1 5 3175 1 1 17 LYS HE3 H -6.307 0.979 9.912 1.00 . A A . 14 LYS HE3 1 1 5 3176 1 1 17 LYS HG2 H -5.672 1.527 7.454 1.00 . A A . 14 LYS HG2 1 1 5 3177 1 1 17 LYS HG3 H -7.392 1.905 7.338 1.00 . A A . 14 LYS HG3 1 1 5 3178 1 1 17 LYS HZ1 H -8.512 1.699 10.630 1.00 . A A . 14 LYS HZ1 1 1 5 3179 1 1 17 LYS HZ2 H -9.211 0.949 9.286 1.00 . A A . 14 LYS HZ2 1 1 5 3180 1 1 17 LYS HZ3 H -8.163 2.258 9.073 1.00 . A A . 14 LYS HZ3 1 1 5 3181 1 1 17 LYS N N -6.672 1.316 3.401 1.00 . A A . 14 LYS N 1 1 5 3182 1 1 17 LYS NZ N -8.350 1.409 9.645 1.00 . A A . 14 LYS NZ 1 1 5 3183 1 1 17 LYS O O -5.023 3.388 5.795 1.00 . A A . 14 LYS O 1 1 5 3184 1 1 18 TYR C C -2.636 3.434 2.607 1.00 . A A . 15 TYR C 1 1 5 3185 1 1 18 TYR CA C -2.966 2.888 3.985 1.00 . A A . 15 TYR CA 1 1 5 3186 1 1 18 TYR CB C -1.900 1.859 4.375 1.00 . A A . 15 TYR CB 1 1 5 3187 1 1 18 TYR CD1 C -3.092 0.327 5.969 1.00 . A A . 15 TYR CD1 1 1 5 3188 1 1 18 TYR CD2 C -1.246 1.580 6.791 1.00 . A A . 15 TYR CD2 1 1 5 3189 1 1 18 TYR CE1 C -3.267 -0.244 7.212 1.00 . A A . 15 TYR CE1 1 1 5 3190 1 1 18 TYR CE2 C -1.413 1.014 8.041 1.00 . A A . 15 TYR CE2 1 1 5 3191 1 1 18 TYR CG C -2.085 1.246 5.740 1.00 . A A . 15 TYR CG 1 1 5 3192 1 1 18 TYR CZ C -2.426 0.103 8.244 1.00 . A A . 15 TYR CZ 1 1 5 3193 1 1 18 TYR H H -4.510 1.647 3.264 1.00 . A A . 15 TYR H 1 1 5 3194 1 1 18 TYR HA H -2.964 3.697 4.701 1.00 . A A . 15 TYR HA 1 1 5 3195 1 1 18 TYR HB2 H -1.912 1.054 3.655 1.00 . A A . 15 TYR HB2 1 1 5 3196 1 1 18 TYR HB3 H -0.930 2.334 4.354 1.00 . A A . 15 TYR HB3 1 1 5 3197 1 1 18 TYR HD1 H -3.752 0.064 5.152 1.00 . A A . 15 TYR HD1 1 1 5 3198 1 1 18 TYR HD2 H -0.454 2.295 6.622 1.00 . A A . 15 TYR HD2 1 1 5 3199 1 1 18 TYR HE1 H -4.058 -0.960 7.371 1.00 . A A . 15 TYR HE1 1 1 5 3200 1 1 18 TYR HE2 H -0.749 1.282 8.849 1.00 . A A . 15 TYR HE2 1 1 5 3201 1 1 18 TYR HH H -2.449 0.195 10.170 1.00 . A A . 15 TYR HH 1 1 5 3202 1 1 18 TYR N N -4.290 2.285 3.977 1.00 . A A . 15 TYR N 1 1 5 3203 1 1 18 TYR O O -3.420 3.286 1.667 1.00 . A A . 15 TYR O 1 1 5 3204 1 1 18 TYR OH O -2.601 -0.468 9.484 1.00 . A A . 15 TYR OH 1 1 5 3205 1 1 19 LYS C C 0.503 4.838 1.321 1.00 . A A . 16 LYS C 1 1 5 3206 1 1 19 LYS CA C -0.990 4.560 1.222 1.00 . A A . 16 LYS CA 1 1 5 3207 1 1 19 LYS CB C -1.751 5.831 0.833 1.00 . A A . 16 LYS CB 1 1 5 3208 1 1 19 LYS CD C -2.331 7.508 -0.948 1.00 . A A . 16 LYS CD 1 1 5 3209 1 1 19 LYS CE C -2.193 8.674 0.015 1.00 . A A . 16 LYS CE 1 1 5 3210 1 1 19 LYS CG C -1.425 6.351 -0.560 1.00 . A A . 16 LYS CG 1 1 5 3211 1 1 19 LYS H H -0.914 4.164 3.292 1.00 . A A . 16 LYS H 1 1 5 3212 1 1 19 LYS HA H -1.157 3.802 0.471 1.00 . A A . 16 LYS HA 1 1 5 3213 1 1 19 LYS HB2 H -2.811 5.628 0.877 1.00 . A A . 16 LYS HB2 1 1 5 3214 1 1 19 LYS HB3 H -1.515 6.607 1.547 1.00 . A A . 16 LYS HB3 1 1 5 3215 1 1 19 LYS HD2 H -2.070 7.842 -1.941 1.00 . A A . 16 LYS HD2 1 1 5 3216 1 1 19 LYS HD3 H -3.356 7.166 -0.939 1.00 . A A . 16 LYS HD3 1 1 5 3217 1 1 19 LYS HE2 H -2.447 8.335 1.007 1.00 . A A . 16 LYS HE2 1 1 5 3218 1 1 19 LYS HE3 H -1.169 9.014 0.005 1.00 . A A . 16 LYS HE3 1 1 5 3219 1 1 19 LYS HG2 H -0.398 6.690 -0.581 1.00 . A A . 16 LYS HG2 1 1 5 3220 1 1 19 LYS HG3 H -1.555 5.549 -1.272 1.00 . A A . 16 LYS HG3 1 1 5 3221 1 1 19 LYS HZ1 H -2.812 10.192 -1.273 1.00 . A A . 16 LYS HZ1 1 1 5 3222 1 1 19 LYS HZ2 H -3.009 10.562 0.365 1.00 . A A . 16 LYS HZ2 1 1 5 3223 1 1 19 LYS HZ3 H -4.070 9.486 -0.394 1.00 . A A . 16 LYS HZ3 1 1 5 3224 1 1 19 LYS N N -1.471 4.047 2.491 1.00 . A A . 16 LYS N 1 1 5 3225 1 1 19 LYS NZ N -3.082 9.807 -0.347 1.00 . A A . 16 LYS NZ 1 1 5 3226 1 1 19 LYS O O 0.914 5.833 1.919 1.00 . A A . 16 LYS O 1 1 5 3227 1 1 20 CYS C C 3.156 5.490 0.292 1.00 . A A . 17 CYS C 1 1 5 3228 1 1 20 CYS CA C 2.761 4.092 0.761 1.00 . A A . 17 CYS CA 1 1 5 3229 1 1 20 CYS CB C 3.409 3.044 -0.148 1.00 . A A . 17 CYS CB 1 1 5 3230 1 1 20 CYS H H 0.912 3.128 0.372 1.00 . A A . 17 CYS H 1 1 5 3231 1 1 20 CYS HA H 3.116 3.950 1.770 1.00 . A A . 17 CYS HA 1 1 5 3232 1 1 20 CYS HB2 H 3.194 2.063 0.241 1.00 . A A . 17 CYS HB2 1 1 5 3233 1 1 20 CYS HB3 H 2.994 3.134 -1.140 1.00 . A A . 17 CYS HB3 1 1 5 3234 1 1 20 CYS N N 1.308 3.932 0.772 1.00 . A A . 17 CYS N 1 1 5 3235 1 1 20 CYS O O 2.802 5.898 -0.806 1.00 . A A . 17 CYS O 1 1 5 3236 1 1 20 CYS SG S 5.210 3.199 -0.285 1.00 . A A . 17 CYS SG 1 1 5 3237 1 1 21 PRO C C 5.213 7.682 -0.443 1.00 . A A . 18 PRO C 1 1 5 3238 1 1 21 PRO CA C 4.323 7.609 0.800 1.00 . A A . 18 PRO CA 1 1 5 3239 1 1 21 PRO CB C 5.102 8.054 2.043 1.00 . A A . 18 PRO CB 1 1 5 3240 1 1 21 PRO CD C 4.393 5.808 2.443 1.00 . A A . 18 PRO CD 1 1 5 3241 1 1 21 PRO CG C 5.483 6.795 2.743 1.00 . A A . 18 PRO CG 1 1 5 3242 1 1 21 PRO HA H 3.468 8.254 0.662 1.00 . A A . 18 PRO HA 1 1 5 3243 1 1 21 PRO HB2 H 5.974 8.613 1.741 1.00 . A A . 18 PRO HB2 1 1 5 3244 1 1 21 PRO HB3 H 4.471 8.673 2.665 1.00 . A A . 18 PRO HB3 1 1 5 3245 1 1 21 PRO HD2 H 4.794 4.806 2.401 1.00 . A A . 18 PRO HD2 1 1 5 3246 1 1 21 PRO HD3 H 3.607 5.872 3.182 1.00 . A A . 18 PRO HD3 1 1 5 3247 1 1 21 PRO HG2 H 6.428 6.436 2.364 1.00 . A A . 18 PRO HG2 1 1 5 3248 1 1 21 PRO HG3 H 5.546 6.971 3.806 1.00 . A A . 18 PRO HG3 1 1 5 3249 1 1 21 PRO N N 3.906 6.235 1.121 1.00 . A A . 18 PRO N 1 1 5 3250 1 1 21 PRO O O 5.424 8.756 -1.004 1.00 . A A . 18 PRO O 1 1 5 3251 1 1 22 ARG C C 5.829 5.961 -3.266 1.00 . A A . 19 ARG C 1 1 5 3252 1 1 22 ARG CA C 6.583 6.487 -2.052 1.00 . A A . 19 ARG CA 1 1 5 3253 1 1 22 ARG CB C 7.823 5.633 -1.794 1.00 . A A . 19 ARG CB 1 1 5 3254 1 1 22 ARG CD C 10.164 5.548 -0.863 1.00 . A A . 19 ARG CD 1 1 5 3255 1 1 22 ARG CG C 8.877 6.349 -0.962 1.00 . A A . 19 ARG CG 1 1 5 3256 1 1 22 ARG CZ C 12.487 6.025 -0.161 1.00 . A A . 19 ARG CZ 1 1 5 3257 1 1 22 ARG H H 5.534 5.713 -0.381 1.00 . A A . 19 ARG H 1 1 5 3258 1 1 22 ARG HA H 6.902 7.497 -2.263 1.00 . A A . 19 ARG HA 1 1 5 3259 1 1 22 ARG HB2 H 7.523 4.738 -1.266 1.00 . A A . 19 ARG HB2 1 1 5 3260 1 1 22 ARG HB3 H 8.259 5.354 -2.741 1.00 . A A . 19 ARG HB3 1 1 5 3261 1 1 22 ARG HD2 H 9.946 4.593 -0.409 1.00 . A A . 19 ARG HD2 1 1 5 3262 1 1 22 ARG HD3 H 10.554 5.392 -1.857 1.00 . A A . 19 ARG HD3 1 1 5 3263 1 1 22 ARG HE H 10.854 6.895 0.605 1.00 . A A . 19 ARG HE 1 1 5 3264 1 1 22 ARG HG2 H 9.094 7.301 -1.421 1.00 . A A . 19 ARG HG2 1 1 5 3265 1 1 22 ARG HG3 H 8.486 6.509 0.032 1.00 . A A . 19 ARG HG3 1 1 5 3266 1 1 22 ARG HH11 H 12.335 4.660 -1.651 1.00 . A A . 19 ARG HH11 1 1 5 3267 1 1 22 ARG HH12 H 13.948 4.998 -1.117 1.00 . A A . 19 ARG HH12 1 1 5 3268 1 1 22 ARG HH21 H 12.979 7.342 1.298 1.00 . A A . 19 ARG HH21 1 1 5 3269 1 1 22 ARG HH22 H 14.317 6.535 0.546 1.00 . A A . 19 ARG HH22 1 1 5 3270 1 1 22 ARG N N 5.732 6.538 -0.870 1.00 . A A . 19 ARG N 1 1 5 3271 1 1 22 ARG NE N 11.174 6.236 -0.058 1.00 . A A . 19 ARG NE 1 1 5 3272 1 1 22 ARG NH1 N 12.959 5.162 -1.048 1.00 . A A . 19 ARG NH1 1 1 5 3273 1 1 22 ARG NH2 N 13.328 6.685 0.623 1.00 . A A . 19 ARG NH2 1 1 5 3274 1 1 22 ARG O O 5.894 6.551 -4.344 1.00 . A A . 19 ARG O 1 1 5 3275 1 1 23 CYS C C 3.061 4.930 -4.455 1.00 . A A . 20 CYS C 1 1 5 3276 1 1 23 CYS CA C 4.397 4.242 -4.210 1.00 . A A . 20 CYS CA 1 1 5 3277 1 1 23 CYS CB C 4.139 2.757 -3.944 1.00 . A A . 20 CYS CB 1 1 5 3278 1 1 23 CYS H H 5.052 4.457 -2.203 1.00 . A A . 20 CYS H 1 1 5 3279 1 1 23 CYS HA H 5.007 4.348 -5.089 1.00 . A A . 20 CYS HA 1 1 5 3280 1 1 23 CYS HB2 H 3.558 2.661 -3.043 1.00 . A A . 20 CYS HB2 1 1 5 3281 1 1 23 CYS HB3 H 3.576 2.357 -4.768 1.00 . A A . 20 CYS HB3 1 1 5 3282 1 1 23 CYS N N 5.110 4.858 -3.094 1.00 . A A . 20 CYS N 1 1 5 3283 1 1 23 CYS O O 2.550 4.955 -5.577 1.00 . A A . 20 CYS O 1 1 5 3284 1 1 23 CYS SG S 5.610 1.732 -3.743 1.00 . A A . 20 CYS SG 1 1 5 3285 1 1 24 LEU C C 0.119 4.980 -3.557 1.00 . A A . 21 LEU C 1 1 5 3286 1 1 24 LEU CA C 1.172 6.058 -3.355 1.00 . A A . 21 LEU CA 1 1 5 3287 1 1 24 LEU CB C 1.009 7.174 -4.390 1.00 . A A . 21 LEU CB 1 1 5 3288 1 1 24 LEU CD1 C 1.523 9.544 -4.993 1.00 . A A . 21 LEU CD1 1 1 5 3289 1 1 24 LEU CD2 C 2.437 8.584 -2.874 1.00 . A A . 21 LEU CD2 1 1 5 3290 1 1 24 LEU CG C 2.049 8.294 -4.315 1.00 . A A . 21 LEU CG 1 1 5 3291 1 1 24 LEU H H 3.041 5.508 -2.550 1.00 . A A . 21 LEU H 1 1 5 3292 1 1 24 LEU HA H 1.029 6.480 -2.369 1.00 . A A . 21 LEU HA 1 1 5 3293 1 1 24 LEU HB2 H 1.057 6.730 -5.372 1.00 . A A . 21 LEU HB2 1 1 5 3294 1 1 24 LEU HB3 H 0.031 7.613 -4.261 1.00 . A A . 21 LEU HB3 1 1 5 3295 1 1 24 LEU HD11 H 1.299 9.324 -6.025 1.00 . A A . 21 LEU HD11 1 1 5 3296 1 1 24 LEU HD12 H 2.270 10.322 -4.943 1.00 . A A . 21 LEU HD12 1 1 5 3297 1 1 24 LEU HD13 H 0.625 9.871 -4.491 1.00 . A A . 21 LEU HD13 1 1 5 3298 1 1 24 LEU HD21 H 2.925 7.714 -2.456 1.00 . A A . 21 LEU HD21 1 1 5 3299 1 1 24 LEU HD22 H 1.552 8.813 -2.300 1.00 . A A . 21 LEU HD22 1 1 5 3300 1 1 24 LEU HD23 H 3.113 9.425 -2.844 1.00 . A A . 21 LEU HD23 1 1 5 3301 1 1 24 LEU HG H 2.938 7.981 -4.844 1.00 . A A . 21 LEU HG 1 1 5 3302 1 1 24 LEU N N 2.512 5.476 -3.378 1.00 . A A . 21 LEU N 1 1 5 3303 1 1 24 LEU O O -1.048 5.276 -3.809 1.00 . A A . 21 LEU O 1 1 5 3304 1 1 25 VAL C C -1.198 2.494 -2.271 1.00 . A A . 22 VAL C 1 1 5 3305 1 1 25 VAL CA C -0.361 2.604 -3.538 1.00 . A A . 22 VAL CA 1 1 5 3306 1 1 25 VAL CB C 0.385 1.273 -3.825 1.00 . A A . 22 VAL CB 1 1 5 3307 1 1 25 VAL CG1 C 1.311 0.883 -2.682 1.00 . A A . 22 VAL CG1 1 1 5 3308 1 1 25 VAL CG2 C -0.606 0.156 -4.117 1.00 . A A . 22 VAL CG2 1 1 5 3309 1 1 25 VAL H H 1.481 3.562 -3.252 1.00 . A A . 22 VAL H 1 1 5 3310 1 1 25 VAL HA H -1.025 2.803 -4.369 1.00 . A A . 22 VAL HA 1 1 5 3311 1 1 25 VAL HB H 0.993 1.415 -4.707 1.00 . A A . 22 VAL HB 1 1 5 3312 1 1 25 VAL HG11 H 0.724 0.678 -1.799 1.00 . A A . 22 VAL HG11 1 1 5 3313 1 1 25 VAL HG12 H 1.994 1.692 -2.478 1.00 . A A . 22 VAL HG12 1 1 5 3314 1 1 25 VAL HG13 H 1.871 -0.001 -2.954 1.00 . A A . 22 VAL HG13 1 1 5 3315 1 1 25 VAL HG21 H -0.070 -0.764 -4.303 1.00 . A A . 22 VAL HG21 1 1 5 3316 1 1 25 VAL HG22 H -1.191 0.413 -4.989 1.00 . A A . 22 VAL HG22 1 1 5 3317 1 1 25 VAL HG23 H -1.262 0.025 -3.269 1.00 . A A . 22 VAL HG23 1 1 5 3318 1 1 25 VAL N N 0.542 3.727 -3.427 1.00 . A A . 22 VAL N 1 1 5 3319 1 1 25 VAL O O -0.676 2.415 -1.155 1.00 . A A . 22 VAL O 1 1 5 3320 1 1 26 GLN C C -3.626 1.033 -0.937 1.00 . A A . 23 GLN C 1 1 5 3321 1 1 26 GLN CA C -3.447 2.483 -1.372 1.00 . A A . 23 GLN CA 1 1 5 3322 1 1 26 GLN CB C -4.771 3.093 -1.829 1.00 . A A . 23 GLN CB 1 1 5 3323 1 1 26 GLN CD C -5.815 4.975 -3.157 1.00 . A A . 23 GLN CD 1 1 5 3324 1 1 26 GLN CG C -4.630 4.523 -2.328 1.00 . A A . 23 GLN CG 1 1 5 3325 1 1 26 GLN H H -2.825 2.674 -3.378 1.00 . A A . 23 GLN H 1 1 5 3326 1 1 26 GLN HA H -3.061 3.051 -0.535 1.00 . A A . 23 GLN HA 1 1 5 3327 1 1 26 GLN HB2 H -5.176 2.490 -2.630 1.00 . A A . 23 GLN HB2 1 1 5 3328 1 1 26 GLN HB3 H -5.463 3.090 -1.002 1.00 . A A . 23 GLN HB3 1 1 5 3329 1 1 26 GLN HE21 H -6.697 5.734 -1.551 1.00 . A A . 23 GLN HE21 1 1 5 3330 1 1 26 GLN HE22 H -7.569 5.895 -3.036 1.00 . A A . 23 GLN HE22 1 1 5 3331 1 1 26 GLN HG2 H -4.534 5.179 -1.476 1.00 . A A . 23 GLN HG2 1 1 5 3332 1 1 26 GLN HG3 H -3.738 4.592 -2.935 1.00 . A A . 23 GLN HG3 1 1 5 3333 1 1 26 GLN N N -2.494 2.561 -2.461 1.00 . A A . 23 GLN N 1 1 5 3334 1 1 26 GLN NE2 N -6.790 5.597 -2.517 1.00 . A A . 23 GLN NE2 1 1 5 3335 1 1 26 GLN O O -4.325 0.252 -1.587 1.00 . A A . 23 GLN O 1 1 5 3336 1 1 26 GLN OE1 O -5.845 4.779 -4.372 1.00 . A A . 23 GLN OE1 1 1 5 3337 1 1 27 THR C C -4.075 -0.841 1.721 1.00 . A A . 24 THR C 1 1 5 3338 1 1 27 THR CA C -2.991 -0.678 0.662 1.00 . A A . 24 THR CA 1 1 5 3339 1 1 27 THR CB C -1.625 -1.047 1.261 1.00 . A A . 24 THR CB 1 1 5 3340 1 1 27 THR CG2 C -0.627 -1.395 0.170 1.00 . A A . 24 THR CG2 1 1 5 3341 1 1 27 THR H H -2.442 1.357 0.631 1.00 . A A . 24 THR H 1 1 5 3342 1 1 27 THR HA H -3.196 -1.346 -0.161 1.00 . A A . 24 THR HA 1 1 5 3343 1 1 27 THR HB H -1.751 -1.907 1.904 1.00 . A A . 24 THR HB 1 1 5 3344 1 1 27 THR HG1 H -0.340 -0.226 2.524 1.00 . A A . 24 THR HG1 1 1 5 3345 1 1 27 THR HG21 H 0.287 -1.751 0.621 1.00 . A A . 24 THR HG21 1 1 5 3346 1 1 27 THR HG22 H -0.417 -0.518 -0.423 1.00 . A A . 24 THR HG22 1 1 5 3347 1 1 27 THR HG23 H -1.040 -2.167 -0.461 1.00 . A A . 24 THR HG23 1 1 5 3348 1 1 27 THR N N -2.964 0.678 0.150 1.00 . A A . 24 THR N 1 1 5 3349 1 1 27 THR O O -4.555 0.137 2.288 1.00 . A A . 24 THR O 1 1 5 3350 1 1 27 THR OG1 O -1.132 0.049 2.036 1.00 . A A . 24 THR OG1 1 1 5 3351 1 1 28 CYS C C -4.943 -2.625 4.316 1.00 . A A . 25 CYS C 1 1 5 3352 1 1 28 CYS CA C -5.526 -2.372 2.929 1.00 . A A . 25 CYS CA 1 1 5 3353 1 1 28 CYS CB C -6.336 -3.591 2.470 1.00 . A A . 25 CYS CB 1 1 5 3354 1 1 28 CYS H H -4.036 -2.820 1.502 1.00 . A A . 25 CYS H 1 1 5 3355 1 1 28 CYS HA H -6.177 -1.512 2.975 1.00 . A A . 25 CYS HA 1 1 5 3356 1 1 28 CYS HB2 H -7.209 -3.695 3.094 1.00 . A A . 25 CYS HB2 1 1 5 3357 1 1 28 CYS HB3 H -6.651 -3.438 1.452 1.00 . A A . 25 CYS HB3 1 1 5 3358 1 1 28 CYS N N -4.466 -2.083 1.973 1.00 . A A . 25 CYS N 1 1 5 3359 1 1 28 CYS O O -5.642 -2.514 5.322 1.00 . A A . 25 CYS O 1 1 5 3360 1 1 28 CYS SG S -5.425 -5.152 2.534 1.00 . A A . 25 CYS SG 1 1 5 3361 1 1 29 SER C C -1.501 -3.019 5.520 1.00 . A A . 26 SER C 1 1 5 3362 1 1 29 SER CA C -2.997 -3.262 5.620 1.00 . A A . 26 SER CA 1 1 5 3363 1 1 29 SER CB C -3.239 -4.719 6.009 1.00 . A A . 26 SER CB 1 1 5 3364 1 1 29 SER H H -3.142 -3.011 3.529 1.00 . A A . 26 SER H 1 1 5 3365 1 1 29 SER HA H -3.413 -2.615 6.379 1.00 . A A . 26 SER HA 1 1 5 3366 1 1 29 SER HB2 H -2.682 -4.947 6.905 1.00 . A A . 26 SER HB2 1 1 5 3367 1 1 29 SER HB3 H -4.286 -4.874 6.189 1.00 . A A . 26 SER HB3 1 1 5 3368 1 1 29 SER HG H -3.253 -6.449 5.085 1.00 . A A . 26 SER HG 1 1 5 3369 1 1 29 SER N N -3.658 -2.961 4.361 1.00 . A A . 26 SER N 1 1 5 3370 1 1 29 SER O O -0.988 -2.701 4.442 1.00 . A A . 26 SER O 1 1 5 3371 1 1 29 SER OG O -2.816 -5.594 4.974 1.00 . A A . 26 SER OG 1 1 5 3372 1 1 30 LEU C C 1.219 -4.315 5.874 1.00 . A A . 27 LEU C 1 1 5 3373 1 1 30 LEU CA C 0.648 -3.121 6.633 1.00 . A A . 27 LEU CA 1 1 5 3374 1 1 30 LEU CB C 1.190 -3.094 8.063 1.00 . A A . 27 LEU CB 1 1 5 3375 1 1 30 LEU CD1 C 1.314 -1.980 10.300 1.00 . A A . 27 LEU CD1 1 1 5 3376 1 1 30 LEU CD2 C 1.612 -0.629 8.224 1.00 . A A . 27 LEU CD2 1 1 5 3377 1 1 30 LEU CG C 0.896 -1.818 8.849 1.00 . A A . 27 LEU CG 1 1 5 3378 1 1 30 LEU H H -1.275 -3.350 7.481 1.00 . A A . 27 LEU H 1 1 5 3379 1 1 30 LEU HA H 0.939 -2.212 6.127 1.00 . A A . 27 LEU HA 1 1 5 3380 1 1 30 LEU HB2 H 0.766 -3.929 8.601 1.00 . A A . 27 LEU HB2 1 1 5 3381 1 1 30 LEU HB3 H 2.259 -3.223 8.022 1.00 . A A . 27 LEU HB3 1 1 5 3382 1 1 30 LEU HD11 H 1.132 -1.060 10.833 1.00 . A A . 27 LEU HD11 1 1 5 3383 1 1 30 LEU HD12 H 2.366 -2.223 10.345 1.00 . A A . 27 LEU HD12 1 1 5 3384 1 1 30 LEU HD13 H 0.742 -2.777 10.751 1.00 . A A . 27 LEU HD13 1 1 5 3385 1 1 30 LEU HD21 H 1.408 0.258 8.804 1.00 . A A . 27 LEU HD21 1 1 5 3386 1 1 30 LEU HD22 H 1.262 -0.487 7.213 1.00 . A A . 27 LEU HD22 1 1 5 3387 1 1 30 LEU HD23 H 2.676 -0.816 8.214 1.00 . A A . 27 LEU HD23 1 1 5 3388 1 1 30 LEU HG H -0.167 -1.621 8.826 1.00 . A A . 27 LEU HG 1 1 5 3389 1 1 30 LEU N N -0.802 -3.183 6.634 1.00 . A A . 27 LEU N 1 1 5 3390 1 1 30 LEU O O 2.307 -4.237 5.303 1.00 . A A . 27 LEU O 1 1 5 3391 1 1 31 GLU C C 1.061 -6.325 3.658 1.00 . A A . 28 GLU C 1 1 5 3392 1 1 31 GLU CA C 0.861 -6.621 5.142 1.00 . A A . 28 GLU CA 1 1 5 3393 1 1 31 GLU CB C -0.196 -7.715 5.326 1.00 . A A . 28 GLU CB 1 1 5 3394 1 1 31 GLU CD C 1.301 -9.764 5.313 1.00 . A A . 28 GLU CD 1 1 5 3395 1 1 31 GLU CG C 0.147 -9.038 4.653 1.00 . A A . 28 GLU CG 1 1 5 3396 1 1 31 GLU H H -0.407 -5.400 6.327 1.00 . A A . 28 GLU H 1 1 5 3397 1 1 31 GLU HA H 1.796 -6.957 5.562 1.00 . A A . 28 GLU HA 1 1 5 3398 1 1 31 GLU HB2 H -0.320 -7.900 6.382 1.00 . A A . 28 GLU HB2 1 1 5 3399 1 1 31 GLU HB3 H -1.134 -7.363 4.922 1.00 . A A . 28 GLU HB3 1 1 5 3400 1 1 31 GLU HG2 H -0.721 -9.677 4.686 1.00 . A A . 28 GLU HG2 1 1 5 3401 1 1 31 GLU HG3 H 0.407 -8.843 3.624 1.00 . A A . 28 GLU HG3 1 1 5 3402 1 1 31 GLU N N 0.457 -5.409 5.850 1.00 . A A . 28 GLU N 1 1 5 3403 1 1 31 GLU O O 2.085 -6.675 3.076 1.00 . A A . 28 GLU O 1 1 5 3404 1 1 31 GLU OE1 O 1.192 -10.105 6.509 1.00 . A A . 28 GLU OE1 1 1 5 3405 1 1 31 GLU OE2 O 2.316 -10.030 4.633 1.00 . A A . 28 GLU OE2 1 1 5 3406 1 1 32 CYS C C 1.139 -4.131 1.441 1.00 . A A . 29 CYS C 1 1 5 3407 1 1 32 CYS CA C 0.161 -5.285 1.658 1.00 . A A . 29 CYS CA 1 1 5 3408 1 1 32 CYS CB C -1.229 -4.919 1.143 1.00 . A A . 29 CYS CB 1 1 5 3409 1 1 32 CYS H H -0.704 -5.391 3.576 1.00 . A A . 29 CYS H 1 1 5 3410 1 1 32 CYS HA H 0.518 -6.146 1.114 1.00 . A A . 29 CYS HA 1 1 5 3411 1 1 32 CYS HB2 H -1.728 -4.316 1.887 1.00 . A A . 29 CYS HB2 1 1 5 3412 1 1 32 CYS HB3 H -1.132 -4.345 0.237 1.00 . A A . 29 CYS HB3 1 1 5 3413 1 1 32 CYS N N 0.087 -5.650 3.061 1.00 . A A . 29 CYS N 1 1 5 3414 1 1 32 CYS O O 1.659 -3.943 0.342 1.00 . A A . 29 CYS O 1 1 5 3415 1 1 32 CYS SG S -2.295 -6.340 0.792 1.00 . A A . 29 CYS SG 1 1 5 3416 1 1 33 SER C C 3.757 -2.734 2.331 1.00 . A A . 30 SER C 1 1 5 3417 1 1 33 SER CA C 2.315 -2.245 2.411 1.00 . A A . 30 SER CA 1 1 5 3418 1 1 33 SER CB C 2.131 -1.320 3.611 1.00 . A A . 30 SER CB 1 1 5 3419 1 1 33 SER H H 0.962 -3.569 3.350 1.00 . A A . 30 SER H 1 1 5 3420 1 1 33 SER HA H 2.087 -1.698 1.509 1.00 . A A . 30 SER HA 1 1 5 3421 1 1 33 SER HB2 H 2.360 -1.861 4.517 1.00 . A A . 30 SER HB2 1 1 5 3422 1 1 33 SER HB3 H 2.797 -0.475 3.518 1.00 . A A . 30 SER HB3 1 1 5 3423 1 1 33 SER HG H 0.244 -1.501 4.129 1.00 . A A . 30 SER HG 1 1 5 3424 1 1 33 SER N N 1.396 -3.368 2.495 1.00 . A A . 30 SER N 1 1 5 3425 1 1 33 SER O O 4.592 -2.124 1.670 1.00 . A A . 30 SER O 1 1 5 3426 1 1 33 SER OG O 0.797 -0.845 3.685 1.00 . A A . 30 SER OG 1 1 5 3427 1 1 34 LYS C C 5.457 -5.468 1.841 1.00 . A A . 31 LYS C 1 1 5 3428 1 1 34 LYS CA C 5.378 -4.428 2.949 1.00 . A A . 31 LYS CA 1 1 5 3429 1 1 34 LYS CB C 5.750 -5.053 4.296 1.00 . A A . 31 LYS CB 1 1 5 3430 1 1 34 LYS CD C 5.343 -6.856 5.999 1.00 . A A . 31 LYS CD 1 1 5 3431 1 1 34 LYS CE C 4.562 -8.118 6.320 1.00 . A A . 31 LYS CE 1 1 5 3432 1 1 34 LYS CG C 4.912 -6.265 4.667 1.00 . A A . 31 LYS CG 1 1 5 3433 1 1 34 LYS H H 3.350 -4.272 3.547 1.00 . A A . 31 LYS H 1 1 5 3434 1 1 34 LYS HA H 6.073 -3.634 2.726 1.00 . A A . 31 LYS HA 1 1 5 3435 1 1 34 LYS HB2 H 6.786 -5.354 4.265 1.00 . A A . 31 LYS HB2 1 1 5 3436 1 1 34 LYS HB3 H 5.625 -4.309 5.067 1.00 . A A . 31 LYS HB3 1 1 5 3437 1 1 34 LYS HD2 H 6.395 -7.096 5.954 1.00 . A A . 31 LYS HD2 1 1 5 3438 1 1 34 LYS HD3 H 5.170 -6.127 6.777 1.00 . A A . 31 LYS HD3 1 1 5 3439 1 1 34 LYS HE2 H 4.878 -8.487 7.284 1.00 . A A . 31 LYS HE2 1 1 5 3440 1 1 34 LYS HE3 H 3.510 -7.877 6.354 1.00 . A A . 31 LYS HE3 1 1 5 3441 1 1 34 LYS HG2 H 3.876 -5.968 4.737 1.00 . A A . 31 LYS HG2 1 1 5 3442 1 1 34 LYS HG3 H 5.021 -7.015 3.897 1.00 . A A . 31 LYS HG3 1 1 5 3443 1 1 34 LYS HZ1 H 4.099 -9.950 5.436 1.00 . A A . 31 LYS HZ1 1 1 5 3444 1 1 34 LYS HZ2 H 5.746 -9.564 5.389 1.00 . A A . 31 LYS HZ2 1 1 5 3445 1 1 34 LYS HZ3 H 4.666 -8.789 4.345 1.00 . A A . 31 LYS HZ3 1 1 5 3446 1 1 34 LYS N N 4.045 -3.843 2.999 1.00 . A A . 31 LYS N 1 1 5 3447 1 1 34 LYS NZ N 4.785 -9.178 5.303 1.00 . A A . 31 LYS NZ 1 1 5 3448 1 1 34 LYS O O 6.539 -5.936 1.482 1.00 . A A . 31 LYS O 1 1 5 3449 1 1 35 LYS C C 4.989 -6.323 -0.998 1.00 . A A . 32 LYS C 1 1 5 3450 1 1 35 LYS CA C 4.203 -6.787 0.220 1.00 . A A . 32 LYS CA 1 1 5 3451 1 1 35 LYS CB C 2.739 -7.006 -0.163 1.00 . A A . 32 LYS CB 1 1 5 3452 1 1 35 LYS CD C 2.751 -9.502 -0.422 1.00 . A A . 32 LYS CD 1 1 5 3453 1 1 35 LYS CE C 2.323 -10.664 -1.299 1.00 . A A . 32 LYS CE 1 1 5 3454 1 1 35 LYS CG C 2.512 -8.171 -1.111 1.00 . A A . 32 LYS CG 1 1 5 3455 1 1 35 LYS H H 3.477 -5.390 1.624 1.00 . A A . 32 LYS H 1 1 5 3456 1 1 35 LYS HA H 4.619 -7.716 0.576 1.00 . A A . 32 LYS HA 1 1 5 3457 1 1 35 LYS HB2 H 2.172 -7.188 0.736 1.00 . A A . 32 LYS HB2 1 1 5 3458 1 1 35 LYS HB3 H 2.367 -6.108 -0.634 1.00 . A A . 32 LYS HB3 1 1 5 3459 1 1 35 LYS HD2 H 3.803 -9.600 -0.199 1.00 . A A . 32 LYS HD2 1 1 5 3460 1 1 35 LYS HD3 H 2.183 -9.526 0.495 1.00 . A A . 32 LYS HD3 1 1 5 3461 1 1 35 LYS HE2 H 1.295 -10.514 -1.593 1.00 . A A . 32 LYS HE2 1 1 5 3462 1 1 35 LYS HE3 H 2.948 -10.684 -2.180 1.00 . A A . 32 LYS HE3 1 1 5 3463 1 1 35 LYS HG2 H 1.494 -8.140 -1.469 1.00 . A A . 32 LYS HG2 1 1 5 3464 1 1 35 LYS HG3 H 3.192 -8.081 -1.945 1.00 . A A . 32 LYS HG3 1 1 5 3465 1 1 35 LYS HZ1 H 1.937 -11.927 0.316 1.00 . A A . 32 LYS HZ1 1 1 5 3466 1 1 35 LYS HZ2 H 3.437 -12.195 -0.418 1.00 . A A . 32 LYS HZ2 1 1 5 3467 1 1 35 LYS HZ3 H 2.019 -12.724 -1.172 1.00 . A A . 32 LYS HZ3 1 1 5 3468 1 1 35 LYS N N 4.299 -5.807 1.291 1.00 . A A . 32 LYS N 1 1 5 3469 1 1 35 LYS NZ N 2.438 -11.967 -0.594 1.00 . A A . 32 LYS NZ 1 1 5 3470 1 1 35 LYS O O 5.718 -7.100 -1.611 1.00 . A A . 32 LYS O 1 1 5 3471 1 1 36 HIS C C 7.022 -4.202 -2.135 1.00 . A A . 33 HIS C 1 1 5 3472 1 1 36 HIS CA C 5.562 -4.499 -2.486 1.00 . A A . 33 HIS CA 1 1 5 3473 1 1 36 HIS CB C 4.858 -3.238 -3.035 1.00 . A A . 33 HIS CB 1 1 5 3474 1 1 36 HIS CD2 C 5.924 -1.401 -1.558 1.00 . A A . 33 HIS CD2 1 1 5 3475 1 1 36 HIS CE1 C 4.159 -0.326 -0.961 1.00 . A A . 33 HIS CE1 1 1 5 3476 1 1 36 HIS CG C 4.879 -2.042 -2.125 1.00 . A A . 33 HIS CG 1 1 5 3477 1 1 36 HIS H H 4.264 -4.465 -0.808 1.00 . A A . 33 HIS H 1 1 5 3478 1 1 36 HIS HA H 5.551 -5.258 -3.254 1.00 . A A . 33 HIS HA 1 1 5 3479 1 1 36 HIS HB2 H 5.335 -2.950 -3.959 1.00 . A A . 33 HIS HB2 1 1 5 3480 1 1 36 HIS HB3 H 3.824 -3.480 -3.238 1.00 . A A . 33 HIS HB3 1 1 5 3481 1 1 36 HIS HD1 H 2.830 -1.572 -1.970 1.00 . A A . 33 HIS HD1 1 1 5 3482 1 1 36 HIS HD2 H 6.956 -1.686 -1.655 1.00 . A A . 33 HIS HD2 1 1 5 3483 1 1 36 HIS HE1 H 3.490 0.363 -0.475 1.00 . A A . 33 HIS HE1 1 1 5 3484 1 1 36 HIS N N 4.855 -5.045 -1.336 1.00 . A A . 33 HIS N 1 1 5 3485 1 1 36 HIS ND1 N 3.759 -1.351 -1.733 1.00 . A A . 33 HIS ND1 1 1 5 3486 1 1 36 HIS NE2 N 5.475 -0.306 -0.830 1.00 . A A . 33 HIS NE2 1 1 5 3487 1 1 36 HIS O O 7.852 -3.994 -3.016 1.00 . A A . 33 HIS O 1 1 5 3488 1 1 37 LYS C C 9.595 -5.105 -0.604 1.00 . A A . 34 LYS C 1 1 5 3489 1 1 37 LYS CA C 8.694 -3.900 -0.398 1.00 . A A . 34 LYS CA 1 1 5 3490 1 1 37 LYS CB C 8.708 -3.500 1.081 1.00 . A A . 34 LYS CB 1 1 5 3491 1 1 37 LYS CD C 7.936 -1.936 2.883 1.00 . A A . 34 LYS CD 1 1 5 3492 1 1 37 LYS CE C 6.993 -0.802 3.249 1.00 . A A . 34 LYS CE 1 1 5 3493 1 1 37 LYS CG C 7.879 -2.266 1.400 1.00 . A A . 34 LYS CG 1 1 5 3494 1 1 37 LYS H H 6.657 -4.438 -0.180 1.00 . A A . 34 LYS H 1 1 5 3495 1 1 37 LYS HA H 9.064 -3.078 -0.992 1.00 . A A . 34 LYS HA 1 1 5 3496 1 1 37 LYS HB2 H 8.325 -4.323 1.666 1.00 . A A . 34 LYS HB2 1 1 5 3497 1 1 37 LYS HB3 H 9.729 -3.306 1.376 1.00 . A A . 34 LYS HB3 1 1 5 3498 1 1 37 LYS HD2 H 7.663 -2.813 3.449 1.00 . A A . 34 LYS HD2 1 1 5 3499 1 1 37 LYS HD3 H 8.945 -1.645 3.136 1.00 . A A . 34 LYS HD3 1 1 5 3500 1 1 37 LYS HE2 H 7.348 0.109 2.788 1.00 . A A . 34 LYS HE2 1 1 5 3501 1 1 37 LYS HE3 H 6.004 -1.032 2.871 1.00 . A A . 34 LYS HE3 1 1 5 3502 1 1 37 LYS HG2 H 8.265 -1.427 0.839 1.00 . A A . 34 LYS HG2 1 1 5 3503 1 1 37 LYS HG3 H 6.853 -2.449 1.118 1.00 . A A . 34 LYS HG3 1 1 5 3504 1 1 37 LYS HZ1 H 6.556 -1.468 5.181 1.00 . A A . 34 LYS HZ1 1 1 5 3505 1 1 37 LYS HZ2 H 6.288 0.185 4.948 1.00 . A A . 34 LYS HZ2 1 1 5 3506 1 1 37 LYS HZ3 H 7.866 -0.400 5.104 1.00 . A A . 34 LYS HZ3 1 1 5 3507 1 1 37 LYS N N 7.341 -4.205 -0.844 1.00 . A A . 34 LYS N 1 1 5 3508 1 1 37 LYS NZ N 6.919 -0.607 4.721 1.00 . A A . 34 LYS NZ 1 1 5 3509 1 1 37 LYS O O 10.741 -4.976 -1.030 1.00 . A A . 34 LYS O 1 1 5 3510 1 1 38 THR C C 10.034 -7.952 -1.852 1.00 . A A . 35 THR C 1 1 5 3511 1 1 38 THR CA C 9.814 -7.511 -0.400 1.00 . A A . 35 THR CA 1 1 5 3512 1 1 38 THR CB C 9.105 -8.627 0.399 1.00 . A A . 35 THR CB 1 1 5 3513 1 1 38 THR CG2 C 7.810 -9.048 -0.280 1.00 . A A . 35 THR CG2 1 1 5 3514 1 1 38 THR H H 8.110 -6.315 -0.053 1.00 . A A . 35 THR H 1 1 5 3515 1 1 38 THR HA H 10.776 -7.329 0.055 1.00 . A A . 35 THR HA 1 1 5 3516 1 1 38 THR HB H 8.864 -8.240 1.378 1.00 . A A . 35 THR HB 1 1 5 3517 1 1 38 THR HG1 H 9.692 -10.448 -0.080 1.00 . A A . 35 THR HG1 1 1 5 3518 1 1 38 THR HG21 H 7.331 -9.817 0.307 1.00 . A A . 35 THR HG21 1 1 5 3519 1 1 38 THR HG22 H 8.026 -9.429 -1.266 1.00 . A A . 35 THR HG22 1 1 5 3520 1 1 38 THR HG23 H 7.152 -8.194 -0.360 1.00 . A A . 35 THR HG23 1 1 5 3521 1 1 38 THR N N 9.052 -6.278 -0.329 1.00 . A A . 35 THR N 1 1 5 3522 1 1 38 THR O O 10.815 -8.867 -2.124 1.00 . A A . 35 THR O 1 1 5 3523 1 1 38 THR OG1 O 9.962 -9.766 0.544 1.00 . A A . 35 THR OG1 1 1 5 3524 1 1 39 ARG C C 10.117 -6.496 -4.995 1.00 . A A . 36 ARG C 1 1 5 3525 1 1 39 ARG CA C 9.476 -7.627 -4.196 1.00 . A A . 36 ARG CA 1 1 5 3526 1 1 39 ARG CB C 8.102 -7.970 -4.782 1.00 . A A . 36 ARG CB 1 1 5 3527 1 1 39 ARG CD C 5.707 -7.278 -5.119 1.00 . A A . 36 ARG CD 1 1 5 3528 1 1 39 ARG CG C 7.006 -6.998 -4.385 1.00 . A A . 36 ARG CG 1 1 5 3529 1 1 39 ARG CZ C 4.791 -7.029 -7.398 1.00 . A A . 36 ARG CZ 1 1 5 3530 1 1 39 ARG H H 8.768 -6.557 -2.511 1.00 . A A . 36 ARG H 1 1 5 3531 1 1 39 ARG HA H 10.110 -8.498 -4.270 1.00 . A A . 36 ARG HA 1 1 5 3532 1 1 39 ARG HB2 H 8.174 -7.975 -5.859 1.00 . A A . 36 ARG HB2 1 1 5 3533 1 1 39 ARG HB3 H 7.817 -8.957 -4.444 1.00 . A A . 36 ARG HB3 1 1 5 3534 1 1 39 ARG HD2 H 5.544 -8.345 -5.138 1.00 . A A . 36 ARG HD2 1 1 5 3535 1 1 39 ARG HD3 H 4.897 -6.799 -4.589 1.00 . A A . 36 ARG HD3 1 1 5 3536 1 1 39 ARG HE H 6.508 -6.209 -6.749 1.00 . A A . 36 ARG HE 1 1 5 3537 1 1 39 ARG HG2 H 6.833 -7.084 -3.323 1.00 . A A . 36 ARG HG2 1 1 5 3538 1 1 39 ARG HG3 H 7.330 -5.993 -4.617 1.00 . A A . 36 ARG HG3 1 1 5 3539 1 1 39 ARG HH11 H 3.649 -8.151 -6.154 1.00 . A A . 36 ARG HH11 1 1 5 3540 1 1 39 ARG HH12 H 3.030 -7.961 -7.761 1.00 . A A . 36 ARG HH12 1 1 5 3541 1 1 39 ARG HH21 H 5.682 -5.951 -8.863 1.00 . A A . 36 ARG HH21 1 1 5 3542 1 1 39 ARG HH22 H 4.183 -6.702 -9.303 1.00 . A A . 36 ARG HH22 1 1 5 3543 1 1 39 ARG N N 9.359 -7.289 -2.782 1.00 . A A . 36 ARG N 1 1 5 3544 1 1 39 ARG NE N 5.736 -6.779 -6.491 1.00 . A A . 36 ARG NE 1 1 5 3545 1 1 39 ARG NH1 N 3.739 -7.773 -7.079 1.00 . A A . 36 ARG NH1 1 1 5 3546 1 1 39 ARG NH2 N 4.894 -6.522 -8.619 1.00 . A A . 36 ARG NH2 1 1 5 3547 1 1 39 ARG O O 10.933 -6.740 -5.881 1.00 . A A . 36 ARG O 1 1 5 3548 1 1 40 ASP C C 11.202 -3.256 -4.678 1.00 . A A . 37 ASP C 1 1 5 3549 1 1 40 ASP CA C 10.211 -4.114 -5.455 1.00 . A A . 37 ASP CA 1 1 5 3550 1 1 40 ASP CB C 9.010 -3.274 -5.898 1.00 . A A . 37 ASP CB 1 1 5 3551 1 1 40 ASP CG C 8.271 -3.883 -7.078 1.00 . A A . 37 ASP CG 1 1 5 3552 1 1 40 ASP H H 9.192 -5.107 -3.893 1.00 . A A . 37 ASP H 1 1 5 3553 1 1 40 ASP HA H 10.708 -4.496 -6.334 1.00 . A A . 37 ASP HA 1 1 5 3554 1 1 40 ASP HB2 H 8.319 -3.184 -5.074 1.00 . A A . 37 ASP HB2 1 1 5 3555 1 1 40 ASP HB3 H 9.354 -2.289 -6.179 1.00 . A A . 37 ASP HB3 1 1 5 3556 1 1 40 ASP N N 9.766 -5.260 -4.671 1.00 . A A . 37 ASP N 1 1 5 3557 1 1 40 ASP O O 11.548 -2.154 -5.106 1.00 . A A . 37 ASP O 1 1 5 3558 1 1 40 ASP OD1 O 7.706 -4.989 -6.937 1.00 . A A . 37 ASP OD1 1 1 5 3559 1 1 40 ASP OD2 O 8.254 -3.257 -8.160 1.00 . A A . 37 ASP OD2 1 1 5 3560 1 1 41 ASN C C 12.323 -1.711 -2.317 1.00 . A A . 38 ASN C 1 1 5 3561 1 1 41 ASN CA C 12.685 -3.137 -2.722 1.00 . A A . 38 ASN CA 1 1 5 3562 1 1 41 ASN CB C 14.017 -3.147 -3.472 1.00 . A A . 38 ASN CB 1 1 5 3563 1 1 41 ASN CG C 14.696 -4.503 -3.441 1.00 . A A . 38 ASN CG 1 1 5 3564 1 1 41 ASN H H 11.255 -4.614 -3.211 1.00 . A A . 38 ASN H 1 1 5 3565 1 1 41 ASN HA H 12.796 -3.725 -1.824 1.00 . A A . 38 ASN HA 1 1 5 3566 1 1 41 ASN HB2 H 13.837 -2.883 -4.503 1.00 . A A . 38 ASN HB2 1 1 5 3567 1 1 41 ASN HB3 H 14.677 -2.422 -3.027 1.00 . A A . 38 ASN HB3 1 1 5 3568 1 1 41 ASN HD21 H 15.551 -4.144 -5.194 1.00 . A A . 38 ASN HD21 1 1 5 3569 1 1 41 ASN HD22 H 15.921 -5.672 -4.477 1.00 . A A . 38 ASN HD22 1 1 5 3570 1 1 41 ASN N N 11.641 -3.773 -3.529 1.00 . A A . 38 ASN N 1 1 5 3571 1 1 41 ASN ND2 N 15.465 -4.804 -4.473 1.00 . A A . 38 ASN ND2 1 1 5 3572 1 1 41 ASN O O 13.181 -0.830 -2.278 1.00 . A A . 38 ASN O 1 1 5 3573 1 1 41 ASN OD1 O 14.534 -5.273 -2.493 1.00 . A A . 38 ASN OD1 1 1 5 3574 1 1 42 CYS C C 10.911 0.030 -0.094 1.00 . A A . 39 CYS C 1 1 5 3575 1 1 42 CYS CA C 10.598 -0.184 -1.572 1.00 . A A . 39 CYS CA 1 1 5 3576 1 1 42 CYS CB C 9.095 -0.045 -1.816 1.00 . A A . 39 CYS CB 1 1 5 3577 1 1 42 CYS H H 10.418 -2.231 -2.059 1.00 . A A . 39 CYS H 1 1 5 3578 1 1 42 CYS HA H 11.120 0.558 -2.153 1.00 . A A . 39 CYS HA 1 1 5 3579 1 1 42 CYS HB2 H 8.896 -0.163 -2.871 1.00 . A A . 39 CYS HB2 1 1 5 3580 1 1 42 CYS HB3 H 8.581 -0.819 -1.271 1.00 . A A . 39 CYS HB3 1 1 5 3581 1 1 42 CYS N N 11.058 -1.493 -2.003 1.00 . A A . 39 CYS N 1 1 5 3582 1 1 42 CYS O O 10.743 -0.874 0.726 1.00 . A A . 39 CYS O 1 1 5 3583 1 1 42 CYS SG S 8.393 1.545 -1.304 1.00 . A A . 39 CYS SG 1 1 5 3584 1 1 43 SER C C 10.420 2.259 2.224 1.00 . A A . 40 SER C 1 1 5 3585 1 1 43 SER CA C 11.646 1.583 1.619 1.00 . A A . 40 SER CA 1 1 5 3586 1 1 43 SER CB C 12.854 2.514 1.696 1.00 . A A . 40 SER CB 1 1 5 3587 1 1 43 SER H H 11.590 1.867 -0.475 1.00 . A A . 40 SER H 1 1 5 3588 1 1 43 SER HA H 11.858 0.678 2.169 1.00 . A A . 40 SER HA 1 1 5 3589 1 1 43 SER HB2 H 12.611 3.456 1.227 1.00 . A A . 40 SER HB2 1 1 5 3590 1 1 43 SER HB3 H 13.112 2.682 2.731 1.00 . A A . 40 SER HB3 1 1 5 3591 1 1 43 SER HG H 14.205 1.112 1.459 1.00 . A A . 40 SER HG 1 1 5 3592 1 1 43 SER N N 11.388 1.220 0.235 1.00 . A A . 40 SER N 1 1 5 3593 1 1 43 SER O O 10.339 2.432 3.436 1.00 . A A . 40 SER O 1 1 5 3594 1 1 43 SER OG O 13.970 1.946 1.032 1.00 . A A . 40 SER OG 1 1 5 3595 1 1 44 GLY C C 8.267 4.159 2.906 1.00 . A A . 41 GLY C 1 1 5 3596 1 1 44 GLY CA C 8.179 3.140 1.791 1.00 . A A . 41 GLY CA 1 1 5 3597 1 1 44 GLY H H 9.646 2.513 0.398 1.00 . A A . 41 GLY H 1 1 5 3598 1 1 44 GLY HA2 H 7.692 3.600 0.945 1.00 . A A . 41 GLY HA2 1 1 5 3599 1 1 44 GLY HA3 H 7.573 2.313 2.130 1.00 . A A . 41 GLY HA3 1 1 5 3600 1 1 44 GLY N N 9.470 2.620 1.358 1.00 . A A . 41 GLY N 1 1 5 3601 1 1 44 GLY O O 7.631 3.991 3.949 1.00 . A A . 41 GLY O 1 1 5 3602 1 1 45 GLN C C 9.705 7.512 3.044 1.00 . A A . 42 GLN C 1 1 5 3603 1 1 45 GLN CA C 9.211 6.238 3.697 1.00 . A A . 42 GLN CA 1 1 5 3604 1 1 45 GLN CB C 10.205 5.802 4.777 1.00 . A A . 42 GLN CB 1 1 5 3605 1 1 45 GLN CD C 11.598 6.567 6.756 1.00 . A A . 42 GLN CD 1 1 5 3606 1 1 45 GLN CG C 10.412 6.853 5.855 1.00 . A A . 42 GLN CG 1 1 5 3607 1 1 45 GLN H H 9.531 5.288 1.850 1.00 . A A . 42 GLN H 1 1 5 3608 1 1 45 GLN HA H 8.249 6.423 4.151 1.00 . A A . 42 GLN HA 1 1 5 3609 1 1 45 GLN HB2 H 9.839 4.899 5.244 1.00 . A A . 42 GLN HB2 1 1 5 3610 1 1 45 GLN HB3 H 11.158 5.598 4.314 1.00 . A A . 42 GLN HB3 1 1 5 3611 1 1 45 GLN HE21 H 11.337 4.610 6.550 1.00 . A A . 42 GLN HE21 1 1 5 3612 1 1 45 GLN HE22 H 12.654 5.089 7.558 1.00 . A A . 42 GLN HE22 1 1 5 3613 1 1 45 GLN HG2 H 10.568 7.808 5.379 1.00 . A A . 42 GLN HG2 1 1 5 3614 1 1 45 GLN HG3 H 9.520 6.899 6.463 1.00 . A A . 42 GLN HG3 1 1 5 3615 1 1 45 GLN N N 9.048 5.204 2.696 1.00 . A A . 42 GLN N 1 1 5 3616 1 1 45 GLN NE2 N 11.892 5.295 6.976 1.00 . A A . 42 GLN NE2 1 1 5 3617 1 1 45 GLN O O 10.686 7.499 2.302 1.00 . A A . 42 GLN O 1 1 5 3618 1 1 45 GLN OE1 O 12.246 7.490 7.255 1.00 . A A . 42 GLN OE1 1 1 5 3619 1 1 46 THR C C 10.034 10.653 4.051 1.00 . A A . 43 THR C 1 1 5 3620 1 1 46 THR CA C 9.475 9.896 2.855 1.00 . A A . 43 THR CA 1 1 5 3621 1 1 46 THR CB C 8.341 10.703 2.205 1.00 . A A . 43 THR CB 1 1 5 3622 1 1 46 THR CG2 C 8.026 10.173 0.815 1.00 . A A . 43 THR CG2 1 1 5 3623 1 1 46 THR H H 8.151 8.531 3.766 1.00 . A A . 43 THR H 1 1 5 3624 1 1 46 THR HA H 10.257 9.742 2.127 1.00 . A A . 43 THR HA 1 1 5 3625 1 1 46 THR HB H 8.654 11.734 2.120 1.00 . A A . 43 THR HB 1 1 5 3626 1 1 46 THR HG1 H 6.528 11.290 2.720 1.00 . A A . 43 THR HG1 1 1 5 3627 1 1 46 THR HG21 H 8.876 10.329 0.169 1.00 . A A . 43 THR HG21 1 1 5 3628 1 1 46 THR HG22 H 7.169 10.693 0.416 1.00 . A A . 43 THR HG22 1 1 5 3629 1 1 46 THR HG23 H 7.811 9.116 0.874 1.00 . A A . 43 THR HG23 1 1 5 3630 1 1 46 THR N N 9.008 8.598 3.286 1.00 . A A . 43 THR N 1 1 5 3631 1 1 46 THR O O 10.755 11.643 3.904 1.00 . A A . 43 THR O 1 1 5 3632 1 1 46 THR OG1 O 7.169 10.638 3.026 1.00 . A A . 43 THR OG1 1 1 5 3633 1 1 47 HIS C C 9.487 12.077 6.773 1.00 . A A . 44 HIS C 1 1 5 3634 1 1 47 HIS CA C 10.119 10.706 6.523 1.00 . A A . 44 HIS CA 1 1 5 3635 1 1 47 HIS CB C 11.654 10.777 6.577 1.00 . A A . 44 HIS CB 1 1 5 3636 1 1 47 HIS CD2 C 12.613 12.132 8.578 1.00 . A A . 44 HIS CD2 1 1 5 3637 1 1 47 HIS CE1 C 12.937 10.468 9.964 1.00 . A A . 44 HIS CE1 1 1 5 3638 1 1 47 HIS CG C 12.215 10.997 7.952 1.00 . A A . 44 HIS CG 1 1 5 3639 1 1 47 HIS H H 9.059 9.392 5.253 1.00 . A A . 44 HIS H 1 1 5 3640 1 1 47 HIS HA H 9.778 10.032 7.295 1.00 . A A . 44 HIS HA 1 1 5 3641 1 1 47 HIS HB2 H 12.062 9.850 6.204 1.00 . A A . 44 HIS HB2 1 1 5 3642 1 1 47 HIS HB3 H 11.989 11.587 5.949 1.00 . A A . 44 HIS HB3 1 1 5 3643 1 1 47 HIS HD1 H 12.251 9.018 8.691 1.00 . A A . 44 HIS HD1 1 1 5 3644 1 1 47 HIS HD2 H 12.583 13.132 8.170 1.00 . A A . 44 HIS HD2 1 1 5 3645 1 1 47 HIS HE1 H 13.208 9.900 10.841 1.00 . A A . 44 HIS HE1 1 1 5 3646 1 1 47 HIS HE2 H 13.563 12.359 10.433 1.00 . A A . 44 HIS HE2 1 1 5 3647 1 1 47 HIS N N 9.671 10.159 5.240 1.00 . A A . 44 HIS N 1 1 5 3648 1 1 47 HIS ND1 N 12.434 9.974 8.850 1.00 . A A . 44 HIS ND1 1 1 5 3649 1 1 47 HIS NE2 N 13.058 11.775 9.826 1.00 . A A . 44 HIS NE2 1 1 5 3650 1 1 47 HIS O O 9.828 12.770 7.731 1.00 . A A . 44 HIS O 1 1 5 3651 1 1 48 ASP C C 6.753 13.797 4.972 1.00 . A A . 45 ASP C 1 1 5 3652 1 1 48 ASP CA C 7.859 13.728 6.011 1.00 . A A . 45 ASP CA 1 1 5 3653 1 1 48 ASP CB C 8.847 14.884 5.809 1.00 . A A . 45 ASP CB 1 1 5 3654 1 1 48 ASP CG C 8.178 16.242 5.863 1.00 . A A . 45 ASP CG 1 1 5 3655 1 1 48 ASP H H 8.278 11.821 5.207 1.00 . A A . 45 ASP H 1 1 5 3656 1 1 48 ASP HA H 7.420 13.805 6.994 1.00 . A A . 45 ASP HA 1 1 5 3657 1 1 48 ASP HB2 H 9.599 14.845 6.583 1.00 . A A . 45 ASP HB2 1 1 5 3658 1 1 48 ASP HB3 H 9.323 14.775 4.846 1.00 . A A . 45 ASP HB3 1 1 5 3659 1 1 48 ASP N N 8.537 12.442 5.922 1.00 . A A . 45 ASP N 1 1 5 3660 1 1 48 ASP O O 7.067 14.015 3.784 1.00 . A A . 45 ASP O 1 1 5 3661 1 1 48 ASP OXT O 5.576 13.610 5.339 1.00 . A A . 45 ASP OXT 1 1 5 3662 1 1 48 ASP OD1 O 7.644 16.604 6.934 1.00 . A A . 45 ASP OD1 1 1 5 3663 1 1 48 ASP OD2 O 8.183 16.954 4.835 1.00 . A A . 45 ASP OD2 1 1 5 3664 2 2 1 ZN ZN ZN -4.444 -5.584 0.500 1.00 . B A . 101 ZN ZN 1 1 5 3665 3 2 1 ZN ZN ZN 6.107 1.468 -1.516 1.00 . C A . 102 ZN ZN 1 1 6 3666 1 1 1 GLY C C -15.181 13.668 4.695 1.00 . A A . -2 GLY C 1 1 6 3667 1 1 1 GLY CA C -15.267 14.259 6.083 1.00 . A A . -2 GLY CA 1 1 6 3668 1 1 1 GLY H1 H -16.695 14.680 7.539 1.00 . A A . -2 GLY H1 1 1 6 3669 1 1 1 GLY H2 H -17.013 13.279 6.648 1.00 . A A . -2 GLY H2 1 1 6 3670 1 1 1 GLY H3 H -17.272 14.796 5.954 1.00 . A A . -2 GLY H3 1 1 6 3671 1 1 1 GLY HA2 H -14.906 15.275 6.054 1.00 . A A . -2 GLY HA2 1 1 6 3672 1 1 1 GLY HA3 H -14.646 13.682 6.751 1.00 . A A . -2 GLY HA3 1 1 6 3673 1 1 1 GLY N N -16.658 14.253 6.592 1.00 . A A . -2 GLY N 1 1 6 3674 1 1 1 GLY O O -16.201 13.263 4.134 1.00 . A A . -2 GLY O 1 1 6 3675 1 1 2 PRO C C -14.049 11.541 2.743 1.00 . A A . -1 PRO C 1 1 6 3676 1 1 2 PRO CA C -13.781 13.043 2.773 1.00 . A A . -1 PRO CA 1 1 6 3677 1 1 2 PRO CB C -12.309 13.336 2.464 1.00 . A A . -1 PRO CB 1 1 6 3678 1 1 2 PRO CD C -12.716 14.095 4.695 1.00 . A A . -1 PRO CD 1 1 6 3679 1 1 2 PRO CG C -11.664 13.507 3.795 1.00 . A A . -1 PRO CG 1 1 6 3680 1 1 2 PRO HA H -14.410 13.531 2.043 1.00 . A A . -1 PRO HA 1 1 6 3681 1 1 2 PRO HB2 H -11.882 12.508 1.920 1.00 . A A . -1 PRO HB2 1 1 6 3682 1 1 2 PRO HB3 H -12.236 14.237 1.873 1.00 . A A . -1 PRO HB3 1 1 6 3683 1 1 2 PRO HD2 H -12.595 13.731 5.704 1.00 . A A . -1 PRO HD2 1 1 6 3684 1 1 2 PRO HD3 H -12.673 15.174 4.672 1.00 . A A . -1 PRO HD3 1 1 6 3685 1 1 2 PRO HG2 H -11.344 12.547 4.172 1.00 . A A . -1 PRO HG2 1 1 6 3686 1 1 2 PRO HG3 H -10.823 14.178 3.713 1.00 . A A . -1 PRO HG3 1 1 6 3687 1 1 2 PRO N N -13.977 13.609 4.107 1.00 . A A . -1 PRO N 1 1 6 3688 1 1 2 PRO O O -13.363 10.759 3.406 1.00 . A A . -1 PRO O 1 1 6 3689 1 1 3 HIS C C -14.485 9.071 0.848 1.00 . A A . 0 HIS C 1 1 6 3690 1 1 3 HIS CA C -15.417 9.744 1.849 1.00 . A A . 0 HIS CA 1 1 6 3691 1 1 3 HIS CB C -16.876 9.608 1.398 1.00 . A A . 0 HIS CB 1 1 6 3692 1 1 3 HIS CD2 C -18.005 7.476 2.354 1.00 . A A . 0 HIS CD2 1 1 6 3693 1 1 3 HIS CE1 C -17.850 6.209 0.578 1.00 . A A . 0 HIS CE1 1 1 6 3694 1 1 3 HIS CG C -17.389 8.198 1.392 1.00 . A A . 0 HIS CG 1 1 6 3695 1 1 3 HIS H H -15.578 11.823 1.492 1.00 . A A . 0 HIS H 1 1 6 3696 1 1 3 HIS HA H -15.297 9.272 2.813 1.00 . A A . 0 HIS HA 1 1 6 3697 1 1 3 HIS HB2 H -17.504 10.182 2.060 1.00 . A A . 0 HIS HB2 1 1 6 3698 1 1 3 HIS HB3 H -16.969 9.999 0.396 1.00 . A A . 0 HIS HB3 1 1 6 3699 1 1 3 HIS HD1 H -16.910 7.614 -0.576 1.00 . A A . 0 HIS HD1 1 1 6 3700 1 1 3 HIS HD2 H -18.235 7.809 3.356 1.00 . A A . 0 HIS HD2 1 1 6 3701 1 1 3 HIS HE1 H -17.924 5.368 -0.093 1.00 . A A . 0 HIS HE1 1 1 6 3702 1 1 3 HIS HE2 H -18.910 5.592 2.213 1.00 . A A . 0 HIS HE2 1 1 6 3703 1 1 3 HIS N N -15.060 11.148 1.984 1.00 . A A . 0 HIS N 1 1 6 3704 1 1 3 HIS ND1 N -17.306 7.374 0.293 1.00 . A A . 0 HIS ND1 1 1 6 3705 1 1 3 HIS NE2 N -18.284 6.241 1.824 1.00 . A A . 0 HIS NE2 1 1 6 3706 1 1 3 HIS O O -14.832 8.887 -0.320 1.00 . A A . 0 HIS O 1 1 6 3707 1 1 4 MET C C -12.473 6.599 0.431 1.00 . A A . 1 MET C 1 1 6 3708 1 1 4 MET CA C -12.299 8.109 0.449 1.00 . A A . 1 MET CA 1 1 6 3709 1 1 4 MET CB C -10.884 8.465 0.911 1.00 . A A . 1 MET CB 1 1 6 3710 1 1 4 MET CE C -8.816 12.081 1.011 1.00 . A A . 1 MET CE 1 1 6 3711 1 1 4 MET CG C -10.559 9.943 0.803 1.00 . A A . 1 MET CG 1 1 6 3712 1 1 4 MET H H -13.082 8.886 2.254 1.00 . A A . 1 MET H 1 1 6 3713 1 1 4 MET HA H -12.446 8.487 -0.550 1.00 . A A . 1 MET HA 1 1 6 3714 1 1 4 MET HB2 H -10.768 8.167 1.942 1.00 . A A . 1 MET HB2 1 1 6 3715 1 1 4 MET HB3 H -10.175 7.919 0.307 1.00 . A A . 1 MET HB3 1 1 6 3716 1 1 4 MET HE1 H -9.027 12.272 -0.031 1.00 . A A . 1 MET HE1 1 1 6 3717 1 1 4 MET HE2 H -7.834 12.457 1.253 1.00 . A A . 1 MET HE2 1 1 6 3718 1 1 4 MET HE3 H -9.554 12.577 1.624 1.00 . A A . 1 MET HE3 1 1 6 3719 1 1 4 MET HG2 H -10.685 10.252 -0.223 1.00 . A A . 1 MET HG2 1 1 6 3720 1 1 4 MET HG3 H -11.243 10.495 1.431 1.00 . A A . 1 MET HG3 1 1 6 3721 1 1 4 MET N N -13.295 8.726 1.308 1.00 . A A . 1 MET N 1 1 6 3722 1 1 4 MET O O -12.790 5.988 1.451 1.00 . A A . 1 MET O 1 1 6 3723 1 1 4 MET SD S -8.871 10.319 1.318 1.00 . A A . 1 MET SD 1 1 6 3724 1 1 5 ALA C C -11.686 4.176 -2.180 1.00 . A A . 2 ALA C 1 1 6 3725 1 1 5 ALA CA C -12.384 4.575 -0.907 1.00 . A A . 2 ALA CA 1 1 6 3726 1 1 5 ALA CB C -13.841 4.129 -0.934 1.00 . A A . 2 ALA CB 1 1 6 3727 1 1 5 ALA H H -11.992 6.549 -1.504 1.00 . A A . 2 ALA H 1 1 6 3728 1 1 5 ALA HA H -11.891 4.088 -0.075 1.00 . A A . 2 ALA HA 1 1 6 3729 1 1 5 ALA HB1 H -13.884 3.057 -1.084 1.00 . A A . 2 ALA HB1 1 1 6 3730 1 1 5 ALA HB2 H -14.355 4.627 -1.742 1.00 . A A . 2 ALA HB2 1 1 6 3731 1 1 5 ALA HB3 H -14.313 4.380 0.004 1.00 . A A . 2 ALA HB3 1 1 6 3732 1 1 5 ALA N N -12.263 6.007 -0.731 1.00 . A A . 2 ALA N 1 1 6 3733 1 1 5 ALA O O -11.212 5.032 -2.931 1.00 . A A . 2 ALA O 1 1 6 3734 1 1 6 VAL C C -10.813 0.831 -3.265 1.00 . A A . 3 VAL C 1 1 6 3735 1 1 6 VAL CA C -10.845 2.329 -3.486 1.00 . A A . 3 VAL CA 1 1 6 3736 1 1 6 VAL CB C -9.404 2.884 -3.412 1.00 . A A . 3 VAL CB 1 1 6 3737 1 1 6 VAL CG1 C -8.571 2.083 -2.452 1.00 . A A . 3 VAL CG1 1 1 6 3738 1 1 6 VAL CG2 C -8.723 2.920 -4.751 1.00 . A A . 3 VAL CG2 1 1 6 3739 1 1 6 VAL H H -12.167 2.278 -1.859 1.00 . A A . 3 VAL H 1 1 6 3740 1 1 6 VAL HA H -11.283 2.574 -4.433 1.00 . A A . 3 VAL HA 1 1 6 3741 1 1 6 VAL HB H -9.457 3.896 -3.037 1.00 . A A . 3 VAL HB 1 1 6 3742 1 1 6 VAL HG11 H -9.170 1.831 -1.587 1.00 . A A . 3 VAL HG11 1 1 6 3743 1 1 6 VAL HG12 H -7.722 2.674 -2.148 1.00 . A A . 3 VAL HG12 1 1 6 3744 1 1 6 VAL HG13 H -8.231 1.179 -2.934 1.00 . A A . 3 VAL HG13 1 1 6 3745 1 1 6 VAL HG21 H -7.707 3.259 -4.605 1.00 . A A . 3 VAL HG21 1 1 6 3746 1 1 6 VAL HG22 H -9.246 3.598 -5.406 1.00 . A A . 3 VAL HG22 1 1 6 3747 1 1 6 VAL HG23 H -8.715 1.931 -5.175 1.00 . A A . 3 VAL HG23 1 1 6 3748 1 1 6 VAL N N -11.641 2.888 -2.421 1.00 . A A . 3 VAL N 1 1 6 3749 1 1 6 VAL O O -11.473 0.339 -2.351 1.00 . A A . 3 VAL O 1 1 6 3750 1 1 7 LEU C C -8.159 -1.271 -3.585 1.00 . A A . 4 LEU C 1 1 6 3751 1 1 7 LEU CA C -9.669 -1.213 -3.675 1.00 . A A . 4 LEU CA 1 1 6 3752 1 1 7 LEU CB C -10.206 -2.282 -4.628 1.00 . A A . 4 LEU CB 1 1 6 3753 1 1 7 LEU CD1 C -12.114 -3.659 -5.482 1.00 . A A . 4 LEU CD1 1 1 6 3754 1 1 7 LEU CD2 C -12.160 -2.792 -3.134 1.00 . A A . 4 LEU CD2 1 1 6 3755 1 1 7 LEU CG C -11.717 -2.513 -4.566 1.00 . A A . 4 LEU CG 1 1 6 3756 1 1 7 LEU H H -9.788 0.472 -4.939 1.00 . A A . 4 LEU H 1 1 6 3757 1 1 7 LEU HA H -10.070 -1.374 -2.684 1.00 . A A . 4 LEU HA 1 1 6 3758 1 1 7 LEU HB2 H -9.947 -1.996 -5.637 1.00 . A A . 4 LEU HB2 1 1 6 3759 1 1 7 LEU HB3 H -9.713 -3.214 -4.401 1.00 . A A . 4 LEU HB3 1 1 6 3760 1 1 7 LEU HD11 H -11.624 -4.565 -5.159 1.00 . A A . 4 LEU HD11 1 1 6 3761 1 1 7 LEU HD12 H -11.814 -3.430 -6.494 1.00 . A A . 4 LEU HD12 1 1 6 3762 1 1 7 LEU HD13 H -13.183 -3.795 -5.447 1.00 . A A . 4 LEU HD13 1 1 6 3763 1 1 7 LEU HD21 H -11.580 -3.613 -2.727 1.00 . A A . 4 LEU HD21 1 1 6 3764 1 1 7 LEU HD22 H -13.206 -3.055 -3.127 1.00 . A A . 4 LEU HD22 1 1 6 3765 1 1 7 LEU HD23 H -12.006 -1.906 -2.528 1.00 . A A . 4 LEU HD23 1 1 6 3766 1 1 7 LEU HG H -12.225 -1.622 -4.906 1.00 . A A . 4 LEU HG 1 1 6 3767 1 1 7 LEU N N -10.069 0.112 -4.068 1.00 . A A . 4 LEU N 1 1 6 3768 1 1 7 LEU O O -7.456 -0.741 -4.447 1.00 . A A . 4 LEU O 1 1 6 3769 1 1 8 CYS C C -5.444 -2.297 -3.438 1.00 . A A . 5 CYS C 1 1 6 3770 1 1 8 CYS CA C -6.270 -2.011 -2.192 1.00 . A A . 5 CYS CA 1 1 6 3771 1 1 8 CYS CB C -6.095 -3.128 -1.171 1.00 . A A . 5 CYS CB 1 1 6 3772 1 1 8 CYS H H -8.343 -2.263 -1.869 1.00 . A A . 5 CYS H 1 1 6 3773 1 1 8 CYS HA H -5.938 -1.081 -1.756 1.00 . A A . 5 CYS HA 1 1 6 3774 1 1 8 CYS HB2 H -6.600 -2.845 -0.262 1.00 . A A . 5 CYS HB2 1 1 6 3775 1 1 8 CYS HB3 H -6.552 -4.028 -1.557 1.00 . A A . 5 CYS HB3 1 1 6 3776 1 1 8 CYS N N -7.690 -1.882 -2.501 1.00 . A A . 5 CYS N 1 1 6 3777 1 1 8 CYS O O -5.647 -3.306 -4.108 1.00 . A A . 5 CYS O 1 1 6 3778 1 1 8 CYS SG S -4.387 -3.529 -0.735 1.00 . A A . 5 CYS SG 1 1 6 3779 1 1 9 GLY C C -2.937 -2.784 -5.081 1.00 . A A . 6 GLY C 1 1 6 3780 1 1 9 GLY CA C -3.711 -1.487 -4.938 1.00 . A A . 6 GLY CA 1 1 6 3781 1 1 9 GLY H H -4.351 -0.662 -3.095 1.00 . A A . 6 GLY H 1 1 6 3782 1 1 9 GLY HA2 H -4.368 -1.384 -5.785 1.00 . A A . 6 GLY HA2 1 1 6 3783 1 1 9 GLY HA3 H -3.009 -0.667 -4.944 1.00 . A A . 6 GLY HA3 1 1 6 3784 1 1 9 GLY N N -4.504 -1.405 -3.722 1.00 . A A . 6 GLY N 1 1 6 3785 1 1 9 GLY O O -2.518 -3.142 -6.180 1.00 . A A . 6 GLY O 1 1 6 3786 1 1 10 VAL C C -2.928 -5.950 -4.185 1.00 . A A . 7 VAL C 1 1 6 3787 1 1 10 VAL CA C -2.006 -4.740 -3.996 1.00 . A A . 7 VAL CA 1 1 6 3788 1 1 10 VAL CB C -1.177 -4.921 -2.710 1.00 . A A . 7 VAL CB 1 1 6 3789 1 1 10 VAL CG1 C -0.539 -6.295 -2.669 1.00 . A A . 7 VAL CG1 1 1 6 3790 1 1 10 VAL CG2 C -0.111 -3.841 -2.608 1.00 . A A . 7 VAL CG2 1 1 6 3791 1 1 10 VAL H H -3.098 -3.151 -3.127 1.00 . A A . 7 VAL H 1 1 6 3792 1 1 10 VAL HA H -1.321 -4.700 -4.829 1.00 . A A . 7 VAL HA 1 1 6 3793 1 1 10 VAL HB H -1.837 -4.827 -1.861 1.00 . A A . 7 VAL HB 1 1 6 3794 1 1 10 VAL HG11 H -1.314 -7.048 -2.658 1.00 . A A . 7 VAL HG11 1 1 6 3795 1 1 10 VAL HG12 H 0.063 -6.381 -1.777 1.00 . A A . 7 VAL HG12 1 1 6 3796 1 1 10 VAL HG13 H 0.084 -6.431 -3.540 1.00 . A A . 7 VAL HG13 1 1 6 3797 1 1 10 VAL HG21 H -0.585 -2.873 -2.559 1.00 . A A . 7 VAL HG21 1 1 6 3798 1 1 10 VAL HG22 H 0.529 -3.886 -3.477 1.00 . A A . 7 VAL HG22 1 1 6 3799 1 1 10 VAL HG23 H 0.481 -4.001 -1.718 1.00 . A A . 7 VAL HG23 1 1 6 3800 1 1 10 VAL N N -2.743 -3.487 -3.975 1.00 . A A . 7 VAL N 1 1 6 3801 1 1 10 VAL O O -2.831 -6.656 -5.185 1.00 . A A . 7 VAL O 1 1 6 3802 1 1 11 CYS C C -6.013 -7.139 -3.896 1.00 . A A . 8 CYS C 1 1 6 3803 1 1 11 CYS CA C -4.647 -7.397 -3.260 1.00 . A A . 8 CYS CA 1 1 6 3804 1 1 11 CYS CB C -4.819 -7.962 -1.848 1.00 . A A . 8 CYS CB 1 1 6 3805 1 1 11 CYS H H -3.937 -5.538 -2.513 1.00 . A A . 8 CYS H 1 1 6 3806 1 1 11 CYS HA H -4.125 -8.125 -3.861 1.00 . A A . 8 CYS HA 1 1 6 3807 1 1 11 CYS HB2 H -5.311 -8.920 -1.912 1.00 . A A . 8 CYS HB2 1 1 6 3808 1 1 11 CYS HB3 H -3.845 -8.093 -1.400 1.00 . A A . 8 CYS HB3 1 1 6 3809 1 1 11 CYS N N -3.826 -6.184 -3.233 1.00 . A A . 8 CYS N 1 1 6 3810 1 1 11 CYS O O -6.585 -8.003 -4.563 1.00 . A A . 8 CYS O 1 1 6 3811 1 1 11 CYS SG S -5.797 -6.917 -0.744 1.00 . A A . 8 CYS SG 1 1 6 3812 1 1 12 GLY C C -8.997 -6.208 -3.842 1.00 . A A . 9 GLY C 1 1 6 3813 1 1 12 GLY CA C -7.749 -5.481 -4.298 1.00 . A A . 9 GLY CA 1 1 6 3814 1 1 12 GLY H H -6.033 -5.327 -3.078 1.00 . A A . 9 GLY H 1 1 6 3815 1 1 12 GLY HA2 H -7.874 -4.433 -4.084 1.00 . A A . 9 GLY HA2 1 1 6 3816 1 1 12 GLY HA3 H -7.651 -5.605 -5.365 1.00 . A A . 9 GLY HA3 1 1 6 3817 1 1 12 GLY N N -6.519 -5.932 -3.670 1.00 . A A . 9 GLY N 1 1 6 3818 1 1 12 GLY O O -9.926 -6.377 -4.625 1.00 . A A . 9 GLY O 1 1 6 3819 1 1 13 ILE C C -11.097 -6.475 -1.199 1.00 . A A . 10 ILE C 1 1 6 3820 1 1 13 ILE CA C -10.215 -7.343 -2.090 1.00 . A A . 10 ILE CA 1 1 6 3821 1 1 13 ILE CB C -9.817 -8.639 -1.352 1.00 . A A . 10 ILE CB 1 1 6 3822 1 1 13 ILE CD1 C -8.870 -7.598 0.782 1.00 . A A . 10 ILE CD1 1 1 6 3823 1 1 13 ILE CG1 C -8.595 -8.423 -0.453 1.00 . A A . 10 ILE CG1 1 1 6 3824 1 1 13 ILE CG2 C -9.541 -9.740 -2.360 1.00 . A A . 10 ILE CG2 1 1 6 3825 1 1 13 ILE H H -8.295 -6.441 -1.980 1.00 . A A . 10 ILE H 1 1 6 3826 1 1 13 ILE HA H -10.796 -7.627 -2.957 1.00 . A A . 10 ILE HA 1 1 6 3827 1 1 13 ILE HB H -10.653 -8.948 -0.743 1.00 . A A . 10 ILE HB 1 1 6 3828 1 1 13 ILE HD11 H -9.214 -6.614 0.486 1.00 . A A . 10 ILE HD11 1 1 6 3829 1 1 13 ILE HD12 H -7.965 -7.503 1.364 1.00 . A A . 10 ILE HD12 1 1 6 3830 1 1 13 ILE HD13 H -9.632 -8.079 1.376 1.00 . A A . 10 ILE HD13 1 1 6 3831 1 1 13 ILE HG12 H -8.220 -9.378 -0.135 1.00 . A A . 10 ILE HG12 1 1 6 3832 1 1 13 ILE HG13 H -7.829 -7.918 -1.021 1.00 . A A . 10 ILE HG13 1 1 6 3833 1 1 13 ILE HG21 H -8.729 -9.440 -3.004 1.00 . A A . 10 ILE HG21 1 1 6 3834 1 1 13 ILE HG22 H -10.426 -9.911 -2.954 1.00 . A A . 10 ILE HG22 1 1 6 3835 1 1 13 ILE HG23 H -9.273 -10.647 -1.840 1.00 . A A . 10 ILE HG23 1 1 6 3836 1 1 13 ILE N N -9.048 -6.619 -2.583 1.00 . A A . 10 ILE N 1 1 6 3837 1 1 13 ILE O O -12.246 -6.822 -0.924 1.00 . A A . 10 ILE O 1 1 6 3838 1 1 14 LYS C C -10.736 -3.021 -0.081 1.00 . A A . 11 LYS C 1 1 6 3839 1 1 14 LYS CA C -11.315 -4.418 0.071 1.00 . A A . 11 LYS CA 1 1 6 3840 1 1 14 LYS CB C -11.318 -4.843 1.550 1.00 . A A . 11 LYS CB 1 1 6 3841 1 1 14 LYS CD C -10.020 -3.612 3.325 1.00 . A A . 11 LYS CD 1 1 6 3842 1 1 14 LYS CE C -10.883 -4.022 4.506 1.00 . A A . 11 LYS CE 1 1 6 3843 1 1 14 LYS CG C -9.973 -4.691 2.250 1.00 . A A . 11 LYS CG 1 1 6 3844 1 1 14 LYS H H -9.638 -5.130 -0.990 1.00 . A A . 11 LYS H 1 1 6 3845 1 1 14 LYS HA H -12.333 -4.409 -0.293 1.00 . A A . 11 LYS HA 1 1 6 3846 1 1 14 LYS HB2 H -12.041 -4.242 2.080 1.00 . A A . 11 LYS HB2 1 1 6 3847 1 1 14 LYS HB3 H -11.615 -5.879 1.611 1.00 . A A . 11 LYS HB3 1 1 6 3848 1 1 14 LYS HD2 H -9.017 -3.424 3.676 1.00 . A A . 11 LYS HD2 1 1 6 3849 1 1 14 LYS HD3 H -10.425 -2.708 2.893 1.00 . A A . 11 LYS HD3 1 1 6 3850 1 1 14 LYS HE2 H -11.017 -3.169 5.154 1.00 . A A . 11 LYS HE2 1 1 6 3851 1 1 14 LYS HE3 H -11.845 -4.347 4.138 1.00 . A A . 11 LYS HE3 1 1 6 3852 1 1 14 LYS HG2 H -9.709 -5.631 2.711 1.00 . A A . 11 LYS HG2 1 1 6 3853 1 1 14 LYS HG3 H -9.226 -4.424 1.517 1.00 . A A . 11 LYS HG3 1 1 6 3854 1 1 14 LYS HZ1 H -10.882 -5.388 6.084 1.00 . A A . 11 LYS HZ1 1 1 6 3855 1 1 14 LYS HZ2 H -9.344 -4.828 5.664 1.00 . A A . 11 LYS HZ2 1 1 6 3856 1 1 14 LYS HZ3 H -10.129 -5.962 4.685 1.00 . A A . 11 LYS HZ3 1 1 6 3857 1 1 14 LYS N N -10.560 -5.349 -0.751 1.00 . A A . 11 LYS N 1 1 6 3858 1 1 14 LYS NZ N -10.268 -5.126 5.287 1.00 . A A . 11 LYS NZ 1 1 6 3859 1 1 14 LYS O O -9.749 -2.836 -0.806 1.00 . A A . 11 LYS O 1 1 6 3860 1 1 15 GLU C C -9.490 -0.470 1.002 1.00 . A A . 12 GLU C 1 1 6 3861 1 1 15 GLU CA C -10.916 -0.663 0.501 1.00 . A A . 12 GLU CA 1 1 6 3862 1 1 15 GLU CB C -11.852 0.252 1.296 1.00 . A A . 12 GLU CB 1 1 6 3863 1 1 15 GLU CD C -14.041 -0.934 0.855 1.00 . A A . 12 GLU CD 1 1 6 3864 1 1 15 GLU CG C -13.257 0.357 0.728 1.00 . A A . 12 GLU CG 1 1 6 3865 1 1 15 GLU H H -12.099 -2.281 1.177 1.00 . A A . 12 GLU H 1 1 6 3866 1 1 15 GLU HA H -10.956 -0.378 -0.540 1.00 . A A . 12 GLU HA 1 1 6 3867 1 1 15 GLU HB2 H -11.926 -0.124 2.305 1.00 . A A . 12 GLU HB2 1 1 6 3868 1 1 15 GLU HB3 H -11.425 1.244 1.323 1.00 . A A . 12 GLU HB3 1 1 6 3869 1 1 15 GLU HG2 H -13.786 1.135 1.255 1.00 . A A . 12 GLU HG2 1 1 6 3870 1 1 15 GLU HG3 H -13.184 0.616 -0.317 1.00 . A A . 12 GLU HG3 1 1 6 3871 1 1 15 GLU N N -11.339 -2.054 0.597 1.00 . A A . 12 GLU N 1 1 6 3872 1 1 15 GLU O O -8.867 -1.381 1.549 1.00 . A A . 12 GLU O 1 1 6 3873 1 1 15 GLU OE1 O -14.028 -1.535 1.947 1.00 . A A . 12 GLU OE1 1 1 6 3874 1 1 15 GLU OE2 O -14.681 -1.347 -0.133 1.00 . A A . 12 GLU OE2 1 1 6 3875 1 1 16 PHE C C -7.710 1.659 2.667 1.00 . A A . 13 PHE C 1 1 6 3876 1 1 16 PHE CA C -7.647 1.064 1.267 1.00 . A A . 13 PHE CA 1 1 6 3877 1 1 16 PHE CB C -6.969 2.047 0.309 1.00 . A A . 13 PHE CB 1 1 6 3878 1 1 16 PHE CD1 C -8.470 4.020 -0.166 1.00 . A A . 13 PHE CD1 1 1 6 3879 1 1 16 PHE CD2 C -6.614 4.331 1.299 1.00 . A A . 13 PHE CD2 1 1 6 3880 1 1 16 PHE CE1 C -8.819 5.344 -0.015 1.00 . A A . 13 PHE CE1 1 1 6 3881 1 1 16 PHE CE2 C -6.959 5.660 1.456 1.00 . A A . 13 PHE CE2 1 1 6 3882 1 1 16 PHE CG C -7.364 3.494 0.487 1.00 . A A . 13 PHE CG 1 1 6 3883 1 1 16 PHE CZ C -8.063 6.168 0.797 1.00 . A A . 13 PHE CZ 1 1 6 3884 1 1 16 PHE H H -9.492 1.381 0.279 1.00 . A A . 13 PHE H 1 1 6 3885 1 1 16 PHE HA H -7.066 0.155 1.303 1.00 . A A . 13 PHE HA 1 1 6 3886 1 1 16 PHE HB2 H -5.903 1.980 0.424 1.00 . A A . 13 PHE HB2 1 1 6 3887 1 1 16 PHE HB3 H -7.221 1.761 -0.697 1.00 . A A . 13 PHE HB3 1 1 6 3888 1 1 16 PHE HD1 H -9.062 3.377 -0.817 1.00 . A A . 13 PHE HD1 1 1 6 3889 1 1 16 PHE HD2 H -5.750 3.932 1.815 1.00 . A A . 13 PHE HD2 1 1 6 3890 1 1 16 PHE HE1 H -9.683 5.735 -0.536 1.00 . A A . 13 PHE HE1 1 1 6 3891 1 1 16 PHE HE2 H -6.364 6.303 2.087 1.00 . A A . 13 PHE HE2 1 1 6 3892 1 1 16 PHE HZ H -8.334 7.206 0.917 1.00 . A A . 13 PHE HZ 1 1 6 3893 1 1 16 PHE N N -8.975 0.723 0.789 1.00 . A A . 13 PHE N 1 1 6 3894 1 1 16 PHE O O -8.731 2.216 3.079 1.00 . A A . 13 PHE O 1 1 6 3895 1 1 17 LYS C C -5.109 2.805 4.793 1.00 . A A . 14 LYS C 1 1 6 3896 1 1 17 LYS CA C -6.466 2.117 4.702 1.00 . A A . 14 LYS CA 1 1 6 3897 1 1 17 LYS CB C -6.608 1.033 5.777 1.00 . A A . 14 LYS CB 1 1 6 3898 1 1 17 LYS CD C -6.602 0.426 8.218 1.00 . A A . 14 LYS CD 1 1 6 3899 1 1 17 LYS CE C -6.260 0.886 9.629 1.00 . A A . 14 LYS CE 1 1 6 3900 1 1 17 LYS CG C -6.342 1.519 7.193 1.00 . A A . 14 LYS CG 1 1 6 3901 1 1 17 LYS H H -5.867 1.005 3.015 1.00 . A A . 14 LYS H 1 1 6 3902 1 1 17 LYS HA H -7.245 2.853 4.830 1.00 . A A . 14 LYS HA 1 1 6 3903 1 1 17 LYS HB2 H -7.612 0.641 5.739 1.00 . A A . 14 LYS HB2 1 1 6 3904 1 1 17 LYS HB3 H -5.914 0.237 5.557 1.00 . A A . 14 LYS HB3 1 1 6 3905 1 1 17 LYS HD2 H -7.646 0.155 8.184 1.00 . A A . 14 LYS HD2 1 1 6 3906 1 1 17 LYS HD3 H -5.997 -0.435 7.973 1.00 . A A . 14 LYS HD3 1 1 6 3907 1 1 17 LYS HE2 H -6.776 1.814 9.824 1.00 . A A . 14 LYS HE2 1 1 6 3908 1 1 17 LYS HE3 H -6.596 0.136 10.329 1.00 . A A . 14 LYS HE3 1 1 6 3909 1 1 17 LYS HG2 H -5.310 1.824 7.267 1.00 . A A . 14 LYS HG2 1 1 6 3910 1 1 17 LYS HG3 H -6.987 2.360 7.403 1.00 . A A . 14 LYS HG3 1 1 6 3911 1 1 17 LYS HZ1 H -4.455 1.841 9.170 1.00 . A A . 14 LYS HZ1 1 1 6 3912 1 1 17 LYS HZ2 H -4.278 0.221 9.629 1.00 . A A . 14 LYS HZ2 1 1 6 3913 1 1 17 LYS HZ3 H -4.604 1.398 10.796 1.00 . A A . 14 LYS HZ3 1 1 6 3914 1 1 17 LYS N N -6.613 1.526 3.384 1.00 . A A . 14 LYS N 1 1 6 3915 1 1 17 LYS NZ N -4.799 1.102 9.817 1.00 . A A . 14 LYS NZ 1 1 6 3916 1 1 17 LYS O O -4.899 3.719 5.591 1.00 . A A . 14 LYS O 1 1 6 3917 1 1 18 TYR C C -2.586 3.526 2.541 1.00 . A A . 15 TYR C 1 1 6 3918 1 1 18 TYR CA C -2.849 2.899 3.899 1.00 . A A . 15 TYR CA 1 1 6 3919 1 1 18 TYR CB C -1.831 1.786 4.151 1.00 . A A . 15 TYR CB 1 1 6 3920 1 1 18 TYR CD1 C -3.008 0.363 5.861 1.00 . A A . 15 TYR CD1 1 1 6 3921 1 1 18 TYR CD2 C -0.925 1.345 6.458 1.00 . A A . 15 TYR CD2 1 1 6 3922 1 1 18 TYR CE1 C -3.100 -0.217 7.107 1.00 . A A . 15 TYR CE1 1 1 6 3923 1 1 18 TYR CE2 C -1.007 0.767 7.708 1.00 . A A . 15 TYR CE2 1 1 6 3924 1 1 18 TYR CG C -1.924 1.154 5.516 1.00 . A A . 15 TYR CG 1 1 6 3925 1 1 18 TYR CZ C -2.098 -0.012 8.027 1.00 . A A . 15 TYR CZ 1 1 6 3926 1 1 18 TYR H H -4.438 1.653 3.312 1.00 . A A . 15 TYR H 1 1 6 3927 1 1 18 TYR HA H -2.757 3.652 4.667 1.00 . A A . 15 TYR HA 1 1 6 3928 1 1 18 TYR HB2 H -1.976 1.006 3.419 1.00 . A A . 15 TYR HB2 1 1 6 3929 1 1 18 TYR HB3 H -0.837 2.189 4.039 1.00 . A A . 15 TYR HB3 1 1 6 3930 1 1 18 TYR HD1 H -3.795 0.208 5.133 1.00 . A A . 15 TYR HD1 1 1 6 3931 1 1 18 TYR HD2 H -0.072 1.955 6.199 1.00 . A A . 15 TYR HD2 1 1 6 3932 1 1 18 TYR HE1 H -3.953 -0.829 7.358 1.00 . A A . 15 TYR HE1 1 1 6 3933 1 1 18 TYR HE2 H -0.219 0.927 8.430 1.00 . A A . 15 TYR HE2 1 1 6 3934 1 1 18 TYR HH H -1.839 0.019 9.934 1.00 . A A . 15 TYR HH 1 1 6 3935 1 1 18 TYR N N -4.197 2.365 3.943 1.00 . A A . 15 TYR N 1 1 6 3936 1 1 18 TYR O O -3.424 3.452 1.640 1.00 . A A . 15 TYR O 1 1 6 3937 1 1 18 TYR OH O -2.188 -0.591 9.268 1.00 . A A . 15 TYR OH 1 1 6 3938 1 1 19 LYS C C 0.476 4.997 1.165 1.00 . A A . 16 LYS C 1 1 6 3939 1 1 19 LYS CA C -1.025 4.753 1.150 1.00 . A A . 16 LYS CA 1 1 6 3940 1 1 19 LYS CB C -1.785 6.070 0.965 1.00 . A A . 16 LYS CB 1 1 6 3941 1 1 19 LYS CD C -2.689 7.811 -0.589 1.00 . A A . 16 LYS CD 1 1 6 3942 1 1 19 LYS CE C -2.910 8.188 -2.043 1.00 . A A . 16 LYS CE 1 1 6 3943 1 1 19 LYS CG C -1.769 6.608 -0.455 1.00 . A A . 16 LYS CG 1 1 6 3944 1 1 19 LYS H H -0.796 4.151 3.157 1.00 . A A . 16 LYS H 1 1 6 3945 1 1 19 LYS HA H -1.269 4.081 0.341 1.00 . A A . 16 LYS HA 1 1 6 3946 1 1 19 LYS HB2 H -2.814 5.920 1.256 1.00 . A A . 16 LYS HB2 1 1 6 3947 1 1 19 LYS HB3 H -1.346 6.815 1.614 1.00 . A A . 16 LYS HB3 1 1 6 3948 1 1 19 LYS HD2 H -3.643 7.573 -0.143 1.00 . A A . 16 LYS HD2 1 1 6 3949 1 1 19 LYS HD3 H -2.247 8.649 -0.072 1.00 . A A . 16 LYS HD3 1 1 6 3950 1 1 19 LYS HE2 H -3.393 7.364 -2.545 1.00 . A A . 16 LYS HE2 1 1 6 3951 1 1 19 LYS HE3 H -3.550 9.057 -2.082 1.00 . A A . 16 LYS HE3 1 1 6 3952 1 1 19 LYS HG2 H -0.761 6.908 -0.708 1.00 . A A . 16 LYS HG2 1 1 6 3953 1 1 19 LYS HG3 H -2.098 5.835 -1.132 1.00 . A A . 16 LYS HG3 1 1 6 3954 1 1 19 LYS HZ1 H -1.154 9.295 -2.275 1.00 . A A . 16 LYS HZ1 1 1 6 3955 1 1 19 LYS HZ2 H -1.822 8.751 -3.730 1.00 . A A . 16 LYS HZ2 1 1 6 3956 1 1 19 LYS HZ3 H -1.007 7.670 -2.721 1.00 . A A . 16 LYS HZ3 1 1 6 3957 1 1 19 LYS N N -1.418 4.126 2.398 1.00 . A A . 16 LYS N 1 1 6 3958 1 1 19 LYS NZ N -1.634 8.495 -2.741 1.00 . A A . 16 LYS NZ 1 1 6 3959 1 1 19 LYS O O 0.945 5.952 1.786 1.00 . A A . 16 LYS O 1 1 6 3960 1 1 20 CYS C C 3.129 5.605 0.047 1.00 . A A . 17 CYS C 1 1 6 3961 1 1 20 CYS CA C 2.683 4.210 0.482 1.00 . A A . 17 CYS CA 1 1 6 3962 1 1 20 CYS CB C 3.286 3.162 -0.463 1.00 . A A . 17 CYS CB 1 1 6 3963 1 1 20 CYS H H 0.784 3.363 0.053 1.00 . A A . 17 CYS H 1 1 6 3964 1 1 20 CYS HA H 3.045 4.027 1.482 1.00 . A A . 17 CYS HA 1 1 6 3965 1 1 20 CYS HB2 H 3.038 2.175 -0.104 1.00 . A A . 17 CYS HB2 1 1 6 3966 1 1 20 CYS HB3 H 2.878 3.300 -1.452 1.00 . A A . 17 CYS HB3 1 1 6 3967 1 1 20 CYS N N 1.226 4.109 0.516 1.00 . A A . 17 CYS N 1 1 6 3968 1 1 20 CYS O O 2.669 6.125 -0.966 1.00 . A A . 17 CYS O 1 1 6 3969 1 1 20 CYS SG S 5.087 3.285 -0.579 1.00 . A A . 17 CYS SG 1 1 6 3970 1 1 21 PRO C C 5.331 7.640 -0.782 1.00 . A A . 18 PRO C 1 1 6 3971 1 1 21 PRO CA C 4.551 7.570 0.526 1.00 . A A . 18 PRO CA 1 1 6 3972 1 1 21 PRO CB C 5.473 7.874 1.711 1.00 . A A . 18 PRO CB 1 1 6 3973 1 1 21 PRO CD C 4.675 5.646 2.019 1.00 . A A . 18 PRO CD 1 1 6 3974 1 1 21 PRO CG C 5.855 6.545 2.257 1.00 . A A . 18 PRO CG 1 1 6 3975 1 1 21 PRO HA H 3.746 8.289 0.500 1.00 . A A . 18 PRO HA 1 1 6 3976 1 1 21 PRO HB2 H 6.342 8.417 1.362 1.00 . A A . 18 PRO HB2 1 1 6 3977 1 1 21 PRO HB3 H 4.942 8.463 2.441 1.00 . A A . 18 PRO HB3 1 1 6 3978 1 1 21 PRO HD2 H 5.003 4.631 1.841 1.00 . A A . 18 PRO HD2 1 1 6 3979 1 1 21 PRO HD3 H 3.995 5.683 2.857 1.00 . A A . 18 PRO HD3 1 1 6 3980 1 1 21 PRO HG2 H 6.727 6.174 1.736 1.00 . A A . 18 PRO HG2 1 1 6 3981 1 1 21 PRO HG3 H 6.057 6.628 3.314 1.00 . A A . 18 PRO HG3 1 1 6 3982 1 1 21 PRO N N 4.051 6.219 0.810 1.00 . A A . 18 PRO N 1 1 6 3983 1 1 21 PRO O O 5.528 8.717 -1.343 1.00 . A A . 18 PRO O 1 1 6 3984 1 1 22 ARG C C 5.683 5.895 -3.646 1.00 . A A . 19 ARG C 1 1 6 3985 1 1 22 ARG CA C 6.535 6.416 -2.498 1.00 . A A . 19 ARG CA 1 1 6 3986 1 1 22 ARG CB C 7.761 5.524 -2.317 1.00 . A A . 19 ARG CB 1 1 6 3987 1 1 22 ARG CD C 10.067 5.249 -1.355 1.00 . A A . 19 ARG CD 1 1 6 3988 1 1 22 ARG CG C 8.846 6.147 -1.455 1.00 . A A . 19 ARG CG 1 1 6 3989 1 1 22 ARG CZ C 11.836 4.363 -2.827 1.00 . A A . 19 ARG CZ 1 1 6 3990 1 1 22 ARG H H 5.573 5.660 -0.770 1.00 . A A . 19 ARG H 1 1 6 3991 1 1 22 ARG HA H 6.866 7.416 -2.738 1.00 . A A . 19 ARG HA 1 1 6 3992 1 1 22 ARG HB2 H 7.450 4.599 -1.853 1.00 . A A . 19 ARG HB2 1 1 6 3993 1 1 22 ARG HB3 H 8.177 5.305 -3.288 1.00 . A A . 19 ARG HB3 1 1 6 3994 1 1 22 ARG HD2 H 10.811 5.744 -0.747 1.00 . A A . 19 ARG HD2 1 1 6 3995 1 1 22 ARG HD3 H 9.777 4.323 -0.880 1.00 . A A . 19 ARG HD3 1 1 6 3996 1 1 22 ARG HE H 10.127 5.194 -3.459 1.00 . A A . 19 ARG HE 1 1 6 3997 1 1 22 ARG HG2 H 9.141 7.090 -1.889 1.00 . A A . 19 ARG HG2 1 1 6 3998 1 1 22 ARG HG3 H 8.452 6.314 -0.461 1.00 . A A . 19 ARG HG3 1 1 6 3999 1 1 22 ARG HH11 H 12.244 4.237 -0.846 1.00 . A A . 19 ARG HH11 1 1 6 4000 1 1 22 ARG HH12 H 13.462 3.582 -1.893 1.00 . A A . 19 ARG HH12 1 1 6 4001 1 1 22 ARG HH21 H 11.743 4.378 -4.850 1.00 . A A . 19 ARG HH21 1 1 6 4002 1 1 22 ARG HH22 H 13.182 3.677 -4.178 1.00 . A A . 19 ARG HH22 1 1 6 4003 1 1 22 ARG N N 5.771 6.486 -1.262 1.00 . A A . 19 ARG N 1 1 6 4004 1 1 22 ARG NE N 10.651 4.949 -2.661 1.00 . A A . 19 ARG NE 1 1 6 4005 1 1 22 ARG NH1 N 12.573 4.036 -1.770 1.00 . A A . 19 ARG NH1 1 1 6 4006 1 1 22 ARG NH2 N 12.289 4.118 -4.049 1.00 . A A . 19 ARG NH2 1 1 6 4007 1 1 22 ARG O O 5.566 6.544 -4.684 1.00 . A A . 19 ARG O 1 1 6 4008 1 1 23 CYS C C 2.953 4.782 -4.686 1.00 . A A . 20 CYS C 1 1 6 4009 1 1 23 CYS CA C 4.296 4.092 -4.502 1.00 . A A . 20 CYS CA 1 1 6 4010 1 1 23 CYS CB C 4.035 2.617 -4.184 1.00 . A A . 20 CYS CB 1 1 6 4011 1 1 23 CYS H H 5.156 4.291 -2.576 1.00 . A A . 20 CYS H 1 1 6 4012 1 1 23 CYS HA H 4.854 4.166 -5.418 1.00 . A A . 20 CYS HA 1 1 6 4013 1 1 23 CYS HB2 H 3.448 2.554 -3.283 1.00 . A A . 20 CYS HB2 1 1 6 4014 1 1 23 CYS HB3 H 3.474 2.186 -4.997 1.00 . A A . 20 CYS HB3 1 1 6 4015 1 1 23 CYS N N 5.077 4.729 -3.448 1.00 . A A . 20 CYS N 1 1 6 4016 1 1 23 CYS O O 2.354 4.725 -5.758 1.00 . A A . 20 CYS O 1 1 6 4017 1 1 23 CYS SG S 5.501 1.595 -3.937 1.00 . A A . 20 CYS SG 1 1 6 4018 1 1 24 LEU C C 0.086 4.914 -3.547 1.00 . A A . 21 LEU C 1 1 6 4019 1 1 24 LEU CA C 1.153 5.998 -3.531 1.00 . A A . 21 LEU CA 1 1 6 4020 1 1 24 LEU CB C 0.891 7.006 -4.656 1.00 . A A . 21 LEU CB 1 1 6 4021 1 1 24 LEU CD1 C 1.182 9.375 -5.393 1.00 . A A . 21 LEU CD1 1 1 6 4022 1 1 24 LEU CD2 C 2.377 8.561 -3.355 1.00 . A A . 21 LEU CD2 1 1 6 4023 1 1 24 LEU CG C 1.859 8.188 -4.733 1.00 . A A . 21 LEU CG 1 1 6 4024 1 1 24 LEU H H 3.077 5.498 -2.829 1.00 . A A . 21 LEU H 1 1 6 4025 1 1 24 LEU HA H 1.088 6.516 -2.584 1.00 . A A . 21 LEU HA 1 1 6 4026 1 1 24 LEU HB2 H 0.931 6.478 -5.596 1.00 . A A . 21 LEU HB2 1 1 6 4027 1 1 24 LEU HB3 H -0.107 7.399 -4.529 1.00 . A A . 21 LEU HB3 1 1 6 4028 1 1 24 LEU HD11 H 0.290 9.630 -4.837 1.00 . A A . 21 LEU HD11 1 1 6 4029 1 1 24 LEU HD12 H 0.914 9.119 -6.408 1.00 . A A . 21 LEU HD12 1 1 6 4030 1 1 24 LEU HD13 H 1.856 10.218 -5.399 1.00 . A A . 21 LEU HD13 1 1 6 4031 1 1 24 LEU HD21 H 2.958 7.739 -2.959 1.00 . A A . 21 LEU HD21 1 1 6 4032 1 1 24 LEU HD22 H 1.542 8.762 -2.700 1.00 . A A . 21 LEU HD22 1 1 6 4033 1 1 24 LEU HD23 H 2.999 9.439 -3.430 1.00 . A A . 21 LEU HD23 1 1 6 4034 1 1 24 LEU HG H 2.706 7.909 -5.345 1.00 . A A . 21 LEU HG 1 1 6 4035 1 1 24 LEU N N 2.490 5.411 -3.609 1.00 . A A . 21 LEU N 1 1 6 4036 1 1 24 LEU O O -1.109 5.210 -3.561 1.00 . A A . 21 LEU O 1 1 6 4037 1 1 25 VAL C C -1.200 2.485 -2.289 1.00 . A A . 22 VAL C 1 1 6 4038 1 1 25 VAL CA C -0.366 2.530 -3.560 1.00 . A A . 22 VAL CA 1 1 6 4039 1 1 25 VAL CB C 0.382 1.187 -3.779 1.00 . A A . 22 VAL CB 1 1 6 4040 1 1 25 VAL CG1 C 1.284 0.835 -2.606 1.00 . A A . 22 VAL CG1 1 1 6 4041 1 1 25 VAL CG2 C -0.604 0.062 -4.047 1.00 . A A . 22 VAL CG2 1 1 6 4042 1 1 25 VAL H H 1.488 3.500 -3.485 1.00 . A A . 22 VAL H 1 1 6 4043 1 1 25 VAL HA H -1.035 2.679 -4.397 1.00 . A A . 22 VAL HA 1 1 6 4044 1 1 25 VAL HB H 1.007 1.293 -4.653 1.00 . A A . 22 VAL HB 1 1 6 4045 1 1 25 VAL HG11 H 1.975 1.643 -2.427 1.00 . A A . 22 VAL HG11 1 1 6 4046 1 1 25 VAL HG12 H 1.836 -0.066 -2.832 1.00 . A A . 22 VAL HG12 1 1 6 4047 1 1 25 VAL HG13 H 0.680 0.675 -1.725 1.00 . A A . 22 VAL HG13 1 1 6 4048 1 1 25 VAL HG21 H -0.067 -0.867 -4.165 1.00 . A A . 22 VAL HG21 1 1 6 4049 1 1 25 VAL HG22 H -1.155 0.278 -4.950 1.00 . A A . 22 VAL HG22 1 1 6 4050 1 1 25 VAL HG23 H -1.290 -0.020 -3.217 1.00 . A A . 22 VAL HG23 1 1 6 4051 1 1 25 VAL N N 0.532 3.660 -3.524 1.00 . A A . 22 VAL N 1 1 6 4052 1 1 25 VAL O O -0.681 2.468 -1.167 1.00 . A A . 22 VAL O 1 1 6 4053 1 1 26 GLN C C -3.632 1.063 -0.930 1.00 . A A . 23 GLN C 1 1 6 4054 1 1 26 GLN CA C -3.448 2.498 -1.405 1.00 . A A . 23 GLN CA 1 1 6 4055 1 1 26 GLN CB C -4.767 3.094 -1.891 1.00 . A A . 23 GLN CB 1 1 6 4056 1 1 26 GLN CD C -5.837 4.948 -3.229 1.00 . A A . 23 GLN CD 1 1 6 4057 1 1 26 GLN CG C -4.622 4.502 -2.445 1.00 . A A . 23 GLN CG 1 1 6 4058 1 1 26 GLN H H -2.821 2.606 -3.411 1.00 . A A . 23 GLN H 1 1 6 4059 1 1 26 GLN HA H -3.063 3.092 -0.588 1.00 . A A . 23 GLN HA 1 1 6 4060 1 1 26 GLN HB2 H -5.171 2.461 -2.668 1.00 . A A . 23 GLN HB2 1 1 6 4061 1 1 26 GLN HB3 H -5.462 3.125 -1.067 1.00 . A A . 23 GLN HB3 1 1 6 4062 1 1 26 GLN HE21 H -6.641 5.756 -1.605 1.00 . A A . 23 GLN HE21 1 1 6 4063 1 1 26 GLN HE22 H -7.571 5.898 -3.055 1.00 . A A . 23 GLN HE22 1 1 6 4064 1 1 26 GLN HG2 H -4.476 5.185 -1.622 1.00 . A A . 23 GLN HG2 1 1 6 4065 1 1 26 GLN HG3 H -3.760 4.534 -3.095 1.00 . A A . 23 GLN HG3 1 1 6 4066 1 1 26 GLN N N -2.493 2.535 -2.489 1.00 . A A . 23 GLN N 1 1 6 4067 1 1 26 GLN NE2 N -6.777 5.597 -2.562 1.00 . A A . 23 GLN NE2 1 1 6 4068 1 1 26 GLN O O -4.401 0.296 -1.508 1.00 . A A . 23 GLN O 1 1 6 4069 1 1 26 GLN OE1 O -5.923 4.718 -4.434 1.00 . A A . 23 GLN OE1 1 1 6 4070 1 1 27 THR C C -3.996 -0.797 1.710 1.00 . A A . 24 THR C 1 1 6 4071 1 1 27 THR CA C -2.932 -0.655 0.628 1.00 . A A . 24 THR CA 1 1 6 4072 1 1 27 THR CB C -1.554 -1.075 1.184 1.00 . A A . 24 THR CB 1 1 6 4073 1 1 27 THR CG2 C -0.602 -1.446 0.062 1.00 . A A . 24 THR CG2 1 1 6 4074 1 1 27 THR H H -2.320 1.363 0.542 1.00 . A A . 24 THR H 1 1 6 4075 1 1 27 THR HA H -3.180 -1.317 -0.190 1.00 . A A . 24 THR HA 1 1 6 4076 1 1 27 THR HB H -1.690 -1.940 1.816 1.00 . A A . 24 THR HB 1 1 6 4077 1 1 27 THR HG1 H -0.270 -0.381 2.508 1.00 . A A . 24 THR HG1 1 1 6 4078 1 1 27 THR HG21 H -0.985 -2.310 -0.461 1.00 . A A . 24 THR HG21 1 1 6 4079 1 1 27 THR HG22 H 0.370 -1.677 0.478 1.00 . A A . 24 THR HG22 1 1 6 4080 1 1 27 THR HG23 H -0.512 -0.618 -0.625 1.00 . A A . 24 THR HG23 1 1 6 4081 1 1 27 THR N N -2.897 0.698 0.107 1.00 . A A . 24 THR N 1 1 6 4082 1 1 27 THR O O -4.397 0.179 2.343 1.00 . A A . 24 THR O 1 1 6 4083 1 1 27 THR OG1 O -0.983 -0.021 1.959 1.00 . A A . 24 THR OG1 1 1 6 4084 1 1 28 CYS C C -4.898 -2.450 4.259 1.00 . A A . 25 CYS C 1 1 6 4085 1 1 28 CYS CA C -5.507 -2.302 2.874 1.00 . A A . 25 CYS CA 1 1 6 4086 1 1 28 CYS CB C -6.270 -3.578 2.495 1.00 . A A . 25 CYS CB 1 1 6 4087 1 1 28 CYS H H -4.116 -2.751 1.354 1.00 . A A . 25 CYS H 1 1 6 4088 1 1 28 CYS HA H -6.193 -1.469 2.879 1.00 . A A . 25 CYS HA 1 1 6 4089 1 1 28 CYS HB2 H -7.090 -3.719 3.178 1.00 . A A . 25 CYS HB2 1 1 6 4090 1 1 28 CYS HB3 H -6.661 -3.469 1.496 1.00 . A A . 25 CYS HB3 1 1 6 4091 1 1 28 CYS N N -4.469 -2.021 1.895 1.00 . A A . 25 CYS N 1 1 6 4092 1 1 28 CYS O O -5.520 -2.111 5.263 1.00 . A A . 25 CYS O 1 1 6 4093 1 1 28 CYS SG S -5.267 -5.082 2.530 1.00 . A A . 25 CYS SG 1 1 6 4094 1 1 29 SER C C -1.486 -3.280 5.353 1.00 . A A . 26 SER C 1 1 6 4095 1 1 29 SER CA C -2.991 -3.194 5.572 1.00 . A A . 26 SER CA 1 1 6 4096 1 1 29 SER CB C -3.507 -4.485 6.225 1.00 . A A . 26 SER CB 1 1 6 4097 1 1 29 SER H H -3.195 -3.150 3.467 1.00 . A A . 26 SER H 1 1 6 4098 1 1 29 SER HA H -3.201 -2.359 6.226 1.00 . A A . 26 SER HA 1 1 6 4099 1 1 29 SER HB2 H -3.313 -5.318 5.568 1.00 . A A . 26 SER HB2 1 1 6 4100 1 1 29 SER HB3 H -2.993 -4.639 7.162 1.00 . A A . 26 SER HB3 1 1 6 4101 1 1 29 SER HG H -5.231 -3.536 6.242 1.00 . A A . 26 SER HG 1 1 6 4102 1 1 29 SER N N -3.669 -2.951 4.308 1.00 . A A . 26 SER N 1 1 6 4103 1 1 29 SER O O -1.031 -3.274 4.204 1.00 . A A . 26 SER O 1 1 6 4104 1 1 29 SER OG O -4.904 -4.421 6.476 1.00 . A A . 26 SER OG 1 1 6 4105 1 1 30 LEU C C 1.160 -4.721 5.599 1.00 . A A . 27 LEU C 1 1 6 4106 1 1 30 LEU CA C 0.733 -3.458 6.339 1.00 . A A . 27 LEU CA 1 1 6 4107 1 1 30 LEU CB C 1.373 -3.420 7.727 1.00 . A A . 27 LEU CB 1 1 6 4108 1 1 30 LEU CD1 C 1.847 -2.189 9.854 1.00 . A A . 27 LEU CD1 1 1 6 4109 1 1 30 LEU CD2 C 2.084 -1.013 7.662 1.00 . A A . 27 LEU CD2 1 1 6 4110 1 1 30 LEU CG C 1.306 -2.068 8.440 1.00 . A A . 27 LEU CG 1 1 6 4111 1 1 30 LEU H H -1.145 -3.390 7.324 1.00 . A A . 27 LEU H 1 1 6 4112 1 1 30 LEU HA H 1.070 -2.600 5.777 1.00 . A A . 27 LEU HA 1 1 6 4113 1 1 30 LEU HB2 H 0.877 -4.153 8.346 1.00 . A A . 27 LEU HB2 1 1 6 4114 1 1 30 LEU HB3 H 2.410 -3.698 7.630 1.00 . A A . 27 LEU HB3 1 1 6 4115 1 1 30 LEU HD11 H 2.879 -2.506 9.818 1.00 . A A . 27 LEU HD11 1 1 6 4116 1 1 30 LEU HD12 H 1.265 -2.915 10.400 1.00 . A A . 27 LEU HD12 1 1 6 4117 1 1 30 LEU HD13 H 1.783 -1.231 10.348 1.00 . A A . 27 LEU HD13 1 1 6 4118 1 1 30 LEU HD21 H 3.108 -1.336 7.543 1.00 . A A . 27 LEU HD21 1 1 6 4119 1 1 30 LEU HD22 H 2.061 -0.079 8.203 1.00 . A A . 27 LEU HD22 1 1 6 4120 1 1 30 LEU HD23 H 1.632 -0.876 6.691 1.00 . A A . 27 LEU HD23 1 1 6 4121 1 1 30 LEU HG H 0.276 -1.748 8.501 1.00 . A A . 27 LEU HG 1 1 6 4122 1 1 30 LEU N N -0.721 -3.374 6.435 1.00 . A A . 27 LEU N 1 1 6 4123 1 1 30 LEU O O 2.208 -4.747 4.954 1.00 . A A . 27 LEU O 1 1 6 4124 1 1 31 GLU C C 0.778 -6.751 3.475 1.00 . A A . 28 GLU C 1 1 6 4125 1 1 31 GLU CA C 0.566 -7.008 4.967 1.00 . A A . 28 GLU CA 1 1 6 4126 1 1 31 GLU CB C -0.621 -7.951 5.177 1.00 . A A . 28 GLU CB 1 1 6 4127 1 1 31 GLU CD C -1.652 -10.213 4.787 1.00 . A A . 28 GLU CD 1 1 6 4128 1 1 31 GLU CG C -0.430 -9.340 4.594 1.00 . A A . 28 GLU CG 1 1 6 4129 1 1 31 GLU H H -0.467 -5.679 6.249 1.00 . A A . 28 GLU H 1 1 6 4130 1 1 31 GLU HA H 1.455 -7.462 5.376 1.00 . A A . 28 GLU HA 1 1 6 4131 1 1 31 GLU HB2 H -0.794 -8.056 6.237 1.00 . A A . 28 GLU HB2 1 1 6 4132 1 1 31 GLU HB3 H -1.497 -7.512 4.722 1.00 . A A . 28 GLU HB3 1 1 6 4133 1 1 31 GLU HG2 H -0.232 -9.251 3.536 1.00 . A A . 28 GLU HG2 1 1 6 4134 1 1 31 GLU HG3 H 0.412 -9.809 5.080 1.00 . A A . 28 GLU HG3 1 1 6 4135 1 1 31 GLU N N 0.327 -5.755 5.679 1.00 . A A . 28 GLU N 1 1 6 4136 1 1 31 GLU O O 1.593 -7.408 2.826 1.00 . A A . 28 GLU O 1 1 6 4137 1 1 31 GLU OE1 O -1.977 -10.542 5.948 1.00 . A A . 28 GLU OE1 1 1 6 4138 1 1 31 GLU OE2 O -2.310 -10.557 3.783 1.00 . A A . 28 GLU OE2 1 1 6 4139 1 1 32 CYS C C 1.213 -4.335 1.330 1.00 . A A . 29 CYS C 1 1 6 4140 1 1 32 CYS CA C 0.161 -5.415 1.546 1.00 . A A . 29 CYS CA 1 1 6 4141 1 1 32 CYS CB C -1.192 -4.953 1.026 1.00 . A A . 29 CYS CB 1 1 6 4142 1 1 32 CYS H H -0.568 -5.280 3.517 1.00 . A A . 29 CYS H 1 1 6 4143 1 1 32 CYS HA H 0.457 -6.298 1.002 1.00 . A A . 29 CYS HA 1 1 6 4144 1 1 32 CYS HB2 H -1.690 -4.385 1.800 1.00 . A A . 29 CYS HB2 1 1 6 4145 1 1 32 CYS HB3 H -1.052 -4.325 0.164 1.00 . A A . 29 CYS HB3 1 1 6 4146 1 1 32 CYS N N 0.053 -5.775 2.946 1.00 . A A . 29 CYS N 1 1 6 4147 1 1 32 CYS O O 1.815 -4.252 0.261 1.00 . A A . 29 CYS O 1 1 6 4148 1 1 32 CYS SG S -2.284 -6.306 0.559 1.00 . A A . 29 CYS SG 1 1 6 4149 1 1 33 SER C C 3.838 -3.146 2.171 1.00 . A A . 30 SER C 1 1 6 4150 1 1 33 SER CA C 2.465 -2.492 2.270 1.00 . A A . 30 SER CA 1 1 6 4151 1 1 33 SER CB C 2.394 -1.573 3.490 1.00 . A A . 30 SER CB 1 1 6 4152 1 1 33 SER H H 0.892 -3.586 3.156 1.00 . A A . 30 SER H 1 1 6 4153 1 1 33 SER HA H 2.292 -1.909 1.377 1.00 . A A . 30 SER HA 1 1 6 4154 1 1 33 SER HB2 H 2.575 -2.153 4.384 1.00 . A A . 30 SER HB2 1 1 6 4155 1 1 33 SER HB3 H 3.145 -0.804 3.400 1.00 . A A . 30 SER HB3 1 1 6 4156 1 1 33 SER HG H 1.233 -0.038 3.860 1.00 . A A . 30 SER HG 1 1 6 4157 1 1 33 SER N N 1.433 -3.511 2.342 1.00 . A A . 30 SER N 1 1 6 4158 1 1 33 SER O O 4.676 -2.735 1.373 1.00 . A A . 30 SER O 1 1 6 4159 1 1 33 SER OG O 1.119 -0.959 3.593 1.00 . A A . 30 SER OG 1 1 6 4160 1 1 34 LYS C C 5.409 -5.828 1.745 1.00 . A A . 31 LYS C 1 1 6 4161 1 1 34 LYS CA C 5.319 -4.909 2.958 1.00 . A A . 31 LYS CA 1 1 6 4162 1 1 34 LYS CB C 5.489 -5.723 4.246 1.00 . A A . 31 LYS CB 1 1 6 4163 1 1 34 LYS CD C 4.867 -7.775 5.565 1.00 . A A . 31 LYS CD 1 1 6 4164 1 1 34 LYS CE C 4.038 -9.049 5.578 1.00 . A A . 31 LYS CE 1 1 6 4165 1 1 34 LYS CG C 4.578 -6.939 4.329 1.00 . A A . 31 LYS CG 1 1 6 4166 1 1 34 LYS H H 3.338 -4.480 3.579 1.00 . A A . 31 LYS H 1 1 6 4167 1 1 34 LYS HA H 6.111 -4.180 2.897 1.00 . A A . 31 LYS HA 1 1 6 4168 1 1 34 LYS HB2 H 6.512 -6.062 4.314 1.00 . A A . 31 LYS HB2 1 1 6 4169 1 1 34 LYS HB3 H 5.274 -5.083 5.090 1.00 . A A . 31 LYS HB3 1 1 6 4170 1 1 34 LYS HD2 H 5.914 -8.040 5.574 1.00 . A A . 31 LYS HD2 1 1 6 4171 1 1 34 LYS HD3 H 4.633 -7.196 6.445 1.00 . A A . 31 LYS HD3 1 1 6 4172 1 1 34 LYS HE2 H 2.992 -8.784 5.572 1.00 . A A . 31 LYS HE2 1 1 6 4173 1 1 34 LYS HE3 H 4.268 -9.622 4.693 1.00 . A A . 31 LYS HE3 1 1 6 4174 1 1 34 LYS HG2 H 3.552 -6.605 4.367 1.00 . A A . 31 LYS HG2 1 1 6 4175 1 1 34 LYS HG3 H 4.728 -7.548 3.450 1.00 . A A . 31 LYS HG3 1 1 6 4176 1 1 34 LYS HZ1 H 4.070 -9.355 7.642 1.00 . A A . 31 LYS HZ1 1 1 6 4177 1 1 34 LYS HZ2 H 5.323 -10.129 6.815 1.00 . A A . 31 LYS HZ2 1 1 6 4178 1 1 34 LYS HZ3 H 3.755 -10.754 6.746 1.00 . A A . 31 LYS HZ3 1 1 6 4179 1 1 34 LYS N N 4.051 -4.189 2.965 1.00 . A A . 31 LYS N 1 1 6 4180 1 1 34 LYS NZ N 4.317 -9.880 6.776 1.00 . A A . 31 LYS NZ 1 1 6 4181 1 1 34 LYS O O 6.496 -6.263 1.362 1.00 . A A . 31 LYS O 1 1 6 4182 1 1 35 LYS C C 4.954 -6.450 -1.189 1.00 . A A . 32 LYS C 1 1 6 4183 1 1 35 LYS CA C 4.203 -7.015 0.006 1.00 . A A . 32 LYS CA 1 1 6 4184 1 1 35 LYS CB C 2.753 -7.304 -0.366 1.00 . A A . 32 LYS CB 1 1 6 4185 1 1 35 LYS CD C 1.185 -9.021 -1.299 1.00 . A A . 32 LYS CD 1 1 6 4186 1 1 35 LYS CE C 0.999 -10.157 -2.296 1.00 . A A . 32 LYS CE 1 1 6 4187 1 1 35 LYS CG C 2.596 -8.467 -1.332 1.00 . A A . 32 LYS CG 1 1 6 4188 1 1 35 LYS H H 3.441 -5.674 1.445 1.00 . A A . 32 LYS H 1 1 6 4189 1 1 35 LYS HA H 4.676 -7.938 0.303 1.00 . A A . 32 LYS HA 1 1 6 4190 1 1 35 LYS HB2 H 2.202 -7.528 0.532 1.00 . A A . 32 LYS HB2 1 1 6 4191 1 1 35 LYS HB3 H 2.332 -6.422 -0.827 1.00 . A A . 32 LYS HB3 1 1 6 4192 1 1 35 LYS HD2 H 0.983 -9.391 -0.305 1.00 . A A . 32 LYS HD2 1 1 6 4193 1 1 35 LYS HD3 H 0.493 -8.230 -1.535 1.00 . A A . 32 LYS HD3 1 1 6 4194 1 1 35 LYS HE2 H -0.014 -10.523 -2.216 1.00 . A A . 32 LYS HE2 1 1 6 4195 1 1 35 LYS HE3 H 1.163 -9.775 -3.291 1.00 . A A . 32 LYS HE3 1 1 6 4196 1 1 35 LYS HG2 H 2.816 -8.125 -2.333 1.00 . A A . 32 LYS HG2 1 1 6 4197 1 1 35 LYS HG3 H 3.288 -9.247 -1.055 1.00 . A A . 32 LYS HG3 1 1 6 4198 1 1 35 LYS HZ1 H 1.771 -12.046 -2.737 1.00 . A A . 32 LYS HZ1 1 1 6 4199 1 1 35 LYS HZ2 H 1.796 -11.666 -1.092 1.00 . A A . 32 LYS HZ2 1 1 6 4200 1 1 35 LYS HZ3 H 2.920 -10.962 -2.136 1.00 . A A . 32 LYS HZ3 1 1 6 4201 1 1 35 LYS N N 4.265 -6.102 1.133 1.00 . A A . 32 LYS N 1 1 6 4202 1 1 35 LYS NZ N 1.937 -11.285 -2.048 1.00 . A A . 32 LYS NZ 1 1 6 4203 1 1 35 LYS O O 5.668 -7.175 -1.880 1.00 . A A . 32 LYS O 1 1 6 4204 1 1 36 HIS C C 6.995 -4.280 -2.134 1.00 . A A . 33 HIS C 1 1 6 4205 1 1 36 HIS CA C 5.537 -4.534 -2.529 1.00 . A A . 33 HIS CA 1 1 6 4206 1 1 36 HIS CB C 4.842 -3.244 -3.014 1.00 . A A . 33 HIS CB 1 1 6 4207 1 1 36 HIS CD2 C 5.984 -1.362 -1.632 1.00 . A A . 33 HIS CD2 1 1 6 4208 1 1 36 HIS CE1 C 4.235 -0.332 -0.909 1.00 . A A . 33 HIS CE1 1 1 6 4209 1 1 36 HIS CG C 4.914 -2.056 -2.089 1.00 . A A . 33 HIS CG 1 1 6 4210 1 1 36 HIS H H 4.200 -4.609 -0.879 1.00 . A A . 33 HIS H 1 1 6 4211 1 1 36 HIS HA H 5.535 -5.245 -3.343 1.00 . A A . 33 HIS HA 1 1 6 4212 1 1 36 HIS HB2 H 5.288 -2.945 -3.949 1.00 . A A . 33 HIS HB2 1 1 6 4213 1 1 36 HIS HB3 H 3.797 -3.463 -3.182 1.00 . A A . 33 HIS HB3 1 1 6 4214 1 1 36 HIS HD1 H 2.873 -1.661 -1.749 1.00 . A A . 33 HIS HD1 1 1 6 4215 1 1 36 HIS HD2 H 7.013 -1.624 -1.798 1.00 . A A . 33 HIS HD2 1 1 6 4216 1 1 36 HIS HE1 H 3.578 0.341 -0.387 1.00 . A A . 33 HIS HE1 1 1 6 4217 1 1 36 HIS N N 4.811 -5.150 -1.431 1.00 . A A . 33 HIS N 1 1 6 4218 1 1 36 HIS ND1 N 3.809 -1.395 -1.610 1.00 . A A . 33 HIS ND1 1 1 6 4219 1 1 36 HIS NE2 N 5.559 -0.256 -0.896 1.00 . A A . 33 HIS NE2 1 1 6 4220 1 1 36 HIS O O 7.858 -4.100 -2.987 1.00 . A A . 33 HIS O 1 1 6 4221 1 1 37 LYS C C 9.513 -5.262 -0.519 1.00 . A A . 34 LYS C 1 1 6 4222 1 1 37 LYS CA C 8.617 -4.045 -0.338 1.00 . A A . 34 LYS CA 1 1 6 4223 1 1 37 LYS CB C 8.582 -3.648 1.139 1.00 . A A . 34 LYS CB 1 1 6 4224 1 1 37 LYS CD C 7.712 -2.080 2.899 1.00 . A A . 34 LYS CD 1 1 6 4225 1 1 37 LYS CE C 6.758 -0.935 3.184 1.00 . A A . 34 LYS CE 1 1 6 4226 1 1 37 LYS CG C 7.712 -2.440 1.423 1.00 . A A . 34 LYS CG 1 1 6 4227 1 1 37 LYS H H 6.556 -4.517 -0.198 1.00 . A A . 34 LYS H 1 1 6 4228 1 1 37 LYS HA H 9.025 -3.226 -0.910 1.00 . A A . 34 LYS HA 1 1 6 4229 1 1 37 LYS HB2 H 8.206 -4.481 1.716 1.00 . A A . 34 LYS HB2 1 1 6 4230 1 1 37 LYS HB3 H 9.588 -3.423 1.462 1.00 . A A . 34 LYS HB3 1 1 6 4231 1 1 37 LYS HD2 H 7.410 -2.941 3.475 1.00 . A A . 34 LYS HD2 1 1 6 4232 1 1 37 LYS HD3 H 8.711 -1.785 3.187 1.00 . A A . 34 LYS HD3 1 1 6 4233 1 1 37 LYS HE2 H 5.787 -1.185 2.781 1.00 . A A . 34 LYS HE2 1 1 6 4234 1 1 37 LYS HE3 H 6.682 -0.802 4.252 1.00 . A A . 34 LYS HE3 1 1 6 4235 1 1 37 LYS HG2 H 8.087 -1.599 0.859 1.00 . A A . 34 LYS HG2 1 1 6 4236 1 1 37 LYS HG3 H 6.700 -2.659 1.115 1.00 . A A . 34 LYS HG3 1 1 6 4237 1 1 37 LYS HZ1 H 7.391 0.199 1.555 1.00 . A A . 34 LYS HZ1 1 1 6 4238 1 1 37 LYS HZ2 H 8.096 0.650 3.023 1.00 . A A . 34 LYS HZ2 1 1 6 4239 1 1 37 LYS HZ3 H 6.494 1.072 2.695 1.00 . A A . 34 LYS HZ3 1 1 6 4240 1 1 37 LYS N N 7.271 -4.308 -0.837 1.00 . A A . 34 LYS N 1 1 6 4241 1 1 37 LYS NZ N 7.216 0.335 2.570 1.00 . A A . 34 LYS NZ 1 1 6 4242 1 1 37 LYS O O 10.707 -5.130 -0.768 1.00 . A A . 34 LYS O 1 1 6 4243 1 1 38 THR C C 10.208 -7.935 -1.926 1.00 . A A . 35 THR C 1 1 6 4244 1 1 38 THR CA C 9.705 -7.678 -0.499 1.00 . A A . 35 THR CA 1 1 6 4245 1 1 38 THR CB C 8.876 -8.885 0.006 1.00 . A A . 35 THR CB 1 1 6 4246 1 1 38 THR CG2 C 7.813 -9.290 -1.004 1.00 . A A . 35 THR CG2 1 1 6 4247 1 1 38 THR H H 7.960 -6.497 -0.271 1.00 . A A . 35 THR H 1 1 6 4248 1 1 38 THR HA H 10.561 -7.566 0.150 1.00 . A A . 35 THR HA 1 1 6 4249 1 1 38 THR HB H 8.383 -8.598 0.923 1.00 . A A . 35 THR HB 1 1 6 4250 1 1 38 THR HG1 H 10.647 -9.762 0.099 1.00 . A A . 35 THR HG1 1 1 6 4251 1 1 38 THR HG21 H 7.265 -10.141 -0.626 1.00 . A A . 35 THR HG21 1 1 6 4252 1 1 38 THR HG22 H 8.286 -9.552 -1.938 1.00 . A A . 35 THR HG22 1 1 6 4253 1 1 38 THR HG23 H 7.133 -8.466 -1.162 1.00 . A A . 35 THR HG23 1 1 6 4254 1 1 38 THR N N 8.931 -6.447 -0.420 1.00 . A A . 35 THR N 1 1 6 4255 1 1 38 THR O O 11.111 -8.746 -2.142 1.00 . A A . 35 THR O 1 1 6 4256 1 1 38 THR OG1 O 9.729 -10.007 0.268 1.00 . A A . 35 THR OG1 1 1 6 4257 1 1 39 ARG C C 10.647 -6.134 -4.879 1.00 . A A . 36 ARG C 1 1 6 4258 1 1 39 ARG CA C 10.040 -7.409 -4.291 1.00 . A A . 36 ARG CA 1 1 6 4259 1 1 39 ARG CB C 8.851 -7.864 -5.146 1.00 . A A . 36 ARG CB 1 1 6 4260 1 1 39 ARG CD C 6.572 -7.320 -6.055 1.00 . A A . 36 ARG CD 1 1 6 4261 1 1 39 ARG CG C 7.608 -7.003 -4.988 1.00 . A A . 36 ARG CG 1 1 6 4262 1 1 39 ARG CZ C 5.555 -9.314 -7.095 1.00 . A A . 36 ARG CZ 1 1 6 4263 1 1 39 ARG H H 8.932 -6.590 -2.677 1.00 . A A . 36 ARG H 1 1 6 4264 1 1 39 ARG HA H 10.792 -8.183 -4.314 1.00 . A A . 36 ARG HA 1 1 6 4265 1 1 39 ARG HB2 H 9.144 -7.845 -6.184 1.00 . A A . 36 ARG HB2 1 1 6 4266 1 1 39 ARG HB3 H 8.596 -8.879 -4.872 1.00 . A A . 36 ARG HB3 1 1 6 4267 1 1 39 ARG HD2 H 5.673 -6.760 -5.841 1.00 . A A . 36 ARG HD2 1 1 6 4268 1 1 39 ARG HD3 H 6.961 -7.018 -7.015 1.00 . A A . 36 ARG HD3 1 1 6 4269 1 1 39 ARG HE H 6.548 -9.305 -5.356 1.00 . A A . 36 ARG HE 1 1 6 4270 1 1 39 ARG HG2 H 7.177 -7.187 -4.015 1.00 . A A . 36 ARG HG2 1 1 6 4271 1 1 39 ARG HG3 H 7.890 -5.963 -5.069 1.00 . A A . 36 ARG HG3 1 1 6 4272 1 1 39 ARG HH11 H 5.287 -7.593 -8.134 1.00 . A A . 36 ARG HH11 1 1 6 4273 1 1 39 ARG HH12 H 4.594 -9.009 -8.853 1.00 . A A . 36 ARG HH12 1 1 6 4274 1 1 39 ARG HH21 H 5.653 -11.183 -6.313 1.00 . A A . 36 ARG HH21 1 1 6 4275 1 1 39 ARG HH22 H 4.804 -11.055 -7.820 1.00 . A A . 36 ARG HH22 1 1 6 4276 1 1 39 ARG N N 9.638 -7.233 -2.900 1.00 . A A . 36 ARG N 1 1 6 4277 1 1 39 ARG NE N 6.239 -8.743 -6.102 1.00 . A A . 36 ARG NE 1 1 6 4278 1 1 39 ARG NH1 N 5.110 -8.581 -8.109 1.00 . A A . 36 ARG NH1 1 1 6 4279 1 1 39 ARG NH2 N 5.318 -10.621 -7.074 1.00 . A A . 36 ARG NH2 1 1 6 4280 1 1 39 ARG O O 11.458 -6.195 -5.802 1.00 . A A . 36 ARG O 1 1 6 4281 1 1 40 ASP C C 11.648 -2.981 -3.947 1.00 . A A . 37 ASP C 1 1 6 4282 1 1 40 ASP CA C 10.707 -3.708 -4.904 1.00 . A A . 37 ASP CA 1 1 6 4283 1 1 40 ASP CB C 9.494 -2.836 -5.238 1.00 . A A . 37 ASP CB 1 1 6 4284 1 1 40 ASP CG C 9.865 -1.531 -5.912 1.00 . A A . 37 ASP CG 1 1 6 4285 1 1 40 ASP H H 9.672 -4.982 -3.566 1.00 . A A . 37 ASP H 1 1 6 4286 1 1 40 ASP HA H 11.244 -3.922 -5.816 1.00 . A A . 37 ASP HA 1 1 6 4287 1 1 40 ASP HB2 H 8.840 -3.383 -5.900 1.00 . A A . 37 ASP HB2 1 1 6 4288 1 1 40 ASP HB3 H 8.964 -2.609 -4.325 1.00 . A A . 37 ASP HB3 1 1 6 4289 1 1 40 ASP N N 10.265 -4.981 -4.344 1.00 . A A . 37 ASP N 1 1 6 4290 1 1 40 ASP O O 12.254 -1.969 -4.296 1.00 . A A . 37 ASP O 1 1 6 4291 1 1 40 ASP OD1 O 10.372 -1.565 -7.055 1.00 . A A . 37 ASP OD1 1 1 6 4292 1 1 40 ASP OD2 O 9.649 -0.465 -5.303 1.00 . A A . 37 ASP OD2 1 1 6 4293 1 1 41 ASN C C 12.297 -1.552 -1.357 1.00 . A A . 38 ASN C 1 1 6 4294 1 1 41 ASN CA C 12.666 -2.987 -1.708 1.00 . A A . 38 ASN CA 1 1 6 4295 1 1 41 ASN CB C 14.125 -3.067 -2.160 1.00 . A A . 38 ASN CB 1 1 6 4296 1 1 41 ASN CG C 14.597 -4.495 -2.343 1.00 . A A . 38 ASN CG 1 1 6 4297 1 1 41 ASN H H 11.259 -4.335 -2.527 1.00 . A A . 38 ASN H 1 1 6 4298 1 1 41 ASN HA H 12.546 -3.595 -0.822 1.00 . A A . 38 ASN HA 1 1 6 4299 1 1 41 ASN HB2 H 14.226 -2.553 -3.105 1.00 . A A . 38 ASN HB2 1 1 6 4300 1 1 41 ASN HB3 H 14.751 -2.590 -1.424 1.00 . A A . 38 ASN HB3 1 1 6 4301 1 1 41 ASN HD21 H 14.180 -4.418 -4.282 1.00 . A A . 38 ASN HD21 1 1 6 4302 1 1 41 ASN HD22 H 14.817 -5.918 -3.711 1.00 . A A . 38 ASN HD22 1 1 6 4303 1 1 41 ASN N N 11.775 -3.530 -2.736 1.00 . A A . 38 ASN N 1 1 6 4304 1 1 41 ASN ND2 N 14.525 -4.993 -3.568 1.00 . A A . 38 ASN ND2 1 1 6 4305 1 1 41 ASN O O 13.147 -0.752 -0.963 1.00 . A A . 38 ASN O 1 1 6 4306 1 1 41 ASN OD1 O 15.033 -5.142 -1.393 1.00 . A A . 38 ASN OD1 1 1 6 4307 1 1 42 CYS C C 10.427 0.417 0.222 1.00 . A A . 39 CYS C 1 1 6 4308 1 1 42 CYS CA C 10.520 0.101 -1.267 1.00 . A A . 39 CYS CA 1 1 6 4309 1 1 42 CYS CB C 9.152 0.256 -1.923 1.00 . A A . 39 CYS CB 1 1 6 4310 1 1 42 CYS H H 10.389 -1.944 -1.756 1.00 . A A . 39 CYS H 1 1 6 4311 1 1 42 CYS HA H 11.209 0.792 -1.726 1.00 . A A . 39 CYS HA 1 1 6 4312 1 1 42 CYS HB2 H 9.265 0.204 -2.996 1.00 . A A . 39 CYS HB2 1 1 6 4313 1 1 42 CYS HB3 H 8.514 -0.548 -1.595 1.00 . A A . 39 CYS HB3 1 1 6 4314 1 1 42 CYS N N 11.019 -1.243 -1.494 1.00 . A A . 39 CYS N 1 1 6 4315 1 1 42 CYS O O 9.526 -0.056 0.917 1.00 . A A . 39 CYS O 1 1 6 4316 1 1 42 CYS SG S 8.319 1.810 -1.538 1.00 . A A . 39 CYS SG 1 1 6 4317 1 1 43 SER C C 10.519 2.959 2.151 1.00 . A A . 40 SER C 1 1 6 4318 1 1 43 SER CA C 11.325 1.671 2.082 1.00 . A A . 40 SER CA 1 1 6 4319 1 1 43 SER CB C 12.750 1.897 2.600 1.00 . A A . 40 SER CB 1 1 6 4320 1 1 43 SER H H 12.062 1.547 0.117 1.00 . A A . 40 SER H 1 1 6 4321 1 1 43 SER HA H 10.838 0.910 2.674 1.00 . A A . 40 SER HA 1 1 6 4322 1 1 43 SER HB2 H 13.343 1.016 2.410 1.00 . A A . 40 SER HB2 1 1 6 4323 1 1 43 SER HB3 H 13.186 2.740 2.087 1.00 . A A . 40 SER HB3 1 1 6 4324 1 1 43 SER HG H 12.656 1.327 4.474 1.00 . A A . 40 SER HG 1 1 6 4325 1 1 43 SER N N 11.354 1.224 0.706 1.00 . A A . 40 SER N 1 1 6 4326 1 1 43 SER O O 10.573 3.771 1.225 1.00 . A A . 40 SER O 1 1 6 4327 1 1 43 SER OG O 12.756 2.158 3.994 1.00 . A A . 40 SER OG 1 1 6 4328 1 1 44 GLY C C 9.697 5.550 3.695 1.00 . A A . 41 GLY C 1 1 6 4329 1 1 44 GLY CA C 8.914 4.307 3.330 1.00 . A A . 41 GLY CA 1 1 6 4330 1 1 44 GLY H H 9.794 2.487 3.955 1.00 . A A . 41 GLY H 1 1 6 4331 1 1 44 GLY HA2 H 8.434 4.466 2.376 1.00 . A A . 41 GLY HA2 1 1 6 4332 1 1 44 GLY HA3 H 8.159 4.131 4.079 1.00 . A A . 41 GLY HA3 1 1 6 4333 1 1 44 GLY N N 9.763 3.141 3.223 1.00 . A A . 41 GLY N 1 1 6 4334 1 1 44 GLY O O 9.661 6.012 4.836 1.00 . A A . 41 GLY O 1 1 6 4335 1 1 45 GLN C C 11.042 8.193 1.734 1.00 . A A . 42 GLN C 1 1 6 4336 1 1 45 GLN CA C 11.252 7.241 2.897 1.00 . A A . 42 GLN CA 1 1 6 4337 1 1 45 GLN CB C 12.727 6.832 2.970 1.00 . A A . 42 GLN CB 1 1 6 4338 1 1 45 GLN CD C 14.487 5.382 4.052 1.00 . A A . 42 GLN CD 1 1 6 4339 1 1 45 GLN CG C 13.037 5.819 4.060 1.00 . A A . 42 GLN CG 1 1 6 4340 1 1 45 GLN H H 10.369 5.658 1.829 1.00 . A A . 42 GLN H 1 1 6 4341 1 1 45 GLN HA H 10.966 7.729 3.817 1.00 . A A . 42 GLN HA 1 1 6 4342 1 1 45 GLN HB2 H 13.016 6.404 2.022 1.00 . A A . 42 GLN HB2 1 1 6 4343 1 1 45 GLN HB3 H 13.323 7.715 3.151 1.00 . A A . 42 GLN HB3 1 1 6 4344 1 1 45 GLN HE21 H 13.968 3.566 4.670 1.00 . A A . 42 GLN HE21 1 1 6 4345 1 1 45 GLN HE22 H 15.663 3.830 4.430 1.00 . A A . 42 GLN HE22 1 1 6 4346 1 1 45 GLN HG2 H 12.817 6.263 5.019 1.00 . A A . 42 GLN HG2 1 1 6 4347 1 1 45 GLN HG3 H 12.412 4.950 3.916 1.00 . A A . 42 GLN HG3 1 1 6 4348 1 1 45 GLN N N 10.411 6.075 2.715 1.00 . A A . 42 GLN N 1 1 6 4349 1 1 45 GLN NE2 N 14.732 4.137 4.419 1.00 . A A . 42 GLN NE2 1 1 6 4350 1 1 45 GLN O O 11.705 8.080 0.702 1.00 . A A . 42 GLN O 1 1 6 4351 1 1 45 GLN OE1 O 15.379 6.149 3.690 1.00 . A A . 42 GLN OE1 1 1 6 4352 1 1 46 THR C C 10.930 11.062 0.680 1.00 . A A . 43 THR C 1 1 6 4353 1 1 46 THR CA C 9.785 10.065 0.841 1.00 . A A . 43 THR CA 1 1 6 4354 1 1 46 THR CB C 8.490 10.826 1.160 1.00 . A A . 43 THR CB 1 1 6 4355 1 1 46 THR CG2 C 7.734 11.153 -0.121 1.00 . A A . 43 THR CG2 1 1 6 4356 1 1 46 THR H H 9.551 9.103 2.702 1.00 . A A . 43 THR H 1 1 6 4357 1 1 46 THR HA H 9.647 9.531 -0.089 1.00 . A A . 43 THR HA 1 1 6 4358 1 1 46 THR HB H 8.741 11.748 1.663 1.00 . A A . 43 THR HB 1 1 6 4359 1 1 46 THR HG1 H 6.886 10.534 2.274 1.00 . A A . 43 THR HG1 1 1 6 4360 1 1 46 THR HG21 H 6.828 11.686 0.120 1.00 . A A . 43 THR HG21 1 1 6 4361 1 1 46 THR HG22 H 7.485 10.235 -0.634 1.00 . A A . 43 THR HG22 1 1 6 4362 1 1 46 THR HG23 H 8.354 11.764 -0.758 1.00 . A A . 43 THR HG23 1 1 6 4363 1 1 46 THR N N 10.085 9.096 1.880 1.00 . A A . 43 THR N 1 1 6 4364 1 1 46 THR O O 10.928 12.134 1.288 1.00 . A A . 43 THR O 1 1 6 4365 1 1 46 THR OG1 O 7.661 10.026 2.015 1.00 . A A . 43 THR OG1 1 1 6 4366 1 1 47 HIS C C 12.677 12.660 -1.327 1.00 . A A . 44 HIS C 1 1 6 4367 1 1 47 HIS CA C 13.066 11.537 -0.376 1.00 . A A . 44 HIS CA 1 1 6 4368 1 1 47 HIS CB C 14.207 10.706 -0.967 1.00 . A A . 44 HIS CB 1 1 6 4369 1 1 47 HIS CD2 C 16.497 11.415 0.020 1.00 . A A . 44 HIS CD2 1 1 6 4370 1 1 47 HIS CE1 C 17.239 12.577 -1.679 1.00 . A A . 44 HIS CE1 1 1 6 4371 1 1 47 HIS CG C 15.543 11.386 -0.940 1.00 . A A . 44 HIS CG 1 1 6 4372 1 1 47 HIS H H 11.862 9.809 -0.562 1.00 . A A . 44 HIS H 1 1 6 4373 1 1 47 HIS HA H 13.383 11.962 0.564 1.00 . A A . 44 HIS HA 1 1 6 4374 1 1 47 HIS HB2 H 14.296 9.786 -0.412 1.00 . A A . 44 HIS HB2 1 1 6 4375 1 1 47 HIS HB3 H 13.974 10.475 -1.997 1.00 . A A . 44 HIS HB3 1 1 6 4376 1 1 47 HIS HD1 H 15.577 12.292 -2.854 1.00 . A A . 44 HIS HD1 1 1 6 4377 1 1 47 HIS HD2 H 16.444 10.941 0.988 1.00 . A A . 44 HIS HD2 1 1 6 4378 1 1 47 HIS HE1 H 17.867 13.190 -2.311 1.00 . A A . 44 HIS HE1 1 1 6 4379 1 1 47 HIS HE2 H 18.430 12.221 -0.054 1.00 . A A . 44 HIS HE2 1 1 6 4380 1 1 47 HIS N N 11.913 10.689 -0.127 1.00 . A A . 44 HIS N 1 1 6 4381 1 1 47 HIS ND1 N 16.040 12.123 -1.991 1.00 . A A . 44 HIS ND1 1 1 6 4382 1 1 47 HIS NE2 N 17.540 12.161 -0.465 1.00 . A A . 44 HIS NE2 1 1 6 4383 1 1 47 HIS O O 12.861 13.839 -1.028 1.00 . A A . 44 HIS O 1 1 6 4384 1 1 48 ASP C C 10.211 12.957 -3.810 1.00 . A A . 45 ASP C 1 1 6 4385 1 1 48 ASP CA C 11.655 13.252 -3.451 1.00 . A A . 45 ASP CA 1 1 6 4386 1 1 48 ASP CB C 12.516 13.228 -4.721 1.00 . A A . 45 ASP CB 1 1 6 4387 1 1 48 ASP CG C 13.963 13.580 -4.459 1.00 . A A . 45 ASP CG 1 1 6 4388 1 1 48 ASP H H 12.009 11.328 -2.654 1.00 . A A . 45 ASP H 1 1 6 4389 1 1 48 ASP HA H 11.711 14.235 -3.004 1.00 . A A . 45 ASP HA 1 1 6 4390 1 1 48 ASP HB2 H 12.482 12.240 -5.151 1.00 . A A . 45 ASP HB2 1 1 6 4391 1 1 48 ASP HB3 H 12.117 13.938 -5.431 1.00 . A A . 45 ASP HB3 1 1 6 4392 1 1 48 ASP N N 12.122 12.284 -2.470 1.00 . A A . 45 ASP N 1 1 6 4393 1 1 48 ASP O O 9.979 12.074 -4.659 1.00 . A A . 45 ASP O 1 1 6 4394 1 1 48 ASP OXT O 9.309 13.598 -3.235 1.00 . A A . 45 ASP OXT 1 1 6 4395 1 1 48 ASP OD1 O 14.304 14.780 -4.479 1.00 . A A . 45 ASP OD1 1 1 6 4396 1 1 48 ASP OD2 O 14.768 12.657 -4.219 1.00 . A A . 45 ASP OD2 1 1 6 4397 2 2 1 ZN ZN ZN -4.428 -5.503 0.434 1.00 . B A . 101 ZN ZN 1 1 6 4398 3 2 1 ZN ZN ZN 6.050 1.521 -1.708 1.00 . C A . 102 ZN ZN 1 1 7 4399 1 1 1 GLY C C -19.627 -0.030 -5.685 1.00 . A A . -2 GLY C 1 1 7 4400 1 1 1 GLY CA C -19.755 -1.538 -5.686 1.00 . A A . -2 GLY CA 1 1 7 4401 1 1 1 GLY H1 H -21.382 -1.624 -6.979 1.00 . A A . -2 GLY H1 1 1 7 4402 1 1 1 GLY H2 H -20.506 -3.067 -6.887 1.00 . A A . -2 GLY H2 1 1 7 4403 1 1 1 GLY H3 H -19.885 -1.752 -7.752 1.00 . A A . -2 GLY H3 1 1 7 4404 1 1 1 GLY HA2 H -20.329 -1.841 -4.825 1.00 . A A . -2 GLY HA2 1 1 7 4405 1 1 1 GLY HA3 H -18.770 -1.976 -5.626 1.00 . A A . -2 GLY HA3 1 1 7 4406 1 1 1 GLY N N -20.428 -2.030 -6.911 1.00 . A A . -2 GLY N 1 1 7 4407 1 1 1 GLY O O -19.734 0.596 -6.741 1.00 . A A . -2 GLY O 1 1 7 4408 1 1 2 PRO C C -18.073 2.589 -5.120 1.00 . A A . -1 PRO C 1 1 7 4409 1 1 2 PRO CA C -19.291 2.041 -4.387 1.00 . A A . -1 PRO CA 1 1 7 4410 1 1 2 PRO CB C -19.152 2.278 -2.875 1.00 . A A . -1 PRO CB 1 1 7 4411 1 1 2 PRO CD C -19.228 -0.088 -3.218 1.00 . A A . -1 PRO CD 1 1 7 4412 1 1 2 PRO CG C -19.556 0.994 -2.232 1.00 . A A . -1 PRO CG 1 1 7 4413 1 1 2 PRO HA H -20.179 2.535 -4.751 1.00 . A A . -1 PRO HA 1 1 7 4414 1 1 2 PRO HB2 H -18.126 2.531 -2.641 1.00 . A A . -1 PRO HB2 1 1 7 4415 1 1 2 PRO HB3 H -19.800 3.087 -2.577 1.00 . A A . -1 PRO HB3 1 1 7 4416 1 1 2 PRO HD2 H -18.210 -0.422 -3.088 1.00 . A A . -1 PRO HD2 1 1 7 4417 1 1 2 PRO HD3 H -19.916 -0.913 -3.116 1.00 . A A . -1 PRO HD3 1 1 7 4418 1 1 2 PRO HG2 H -18.997 0.850 -1.318 1.00 . A A . -1 PRO HG2 1 1 7 4419 1 1 2 PRO HG3 H -20.616 1.005 -2.026 1.00 . A A . -1 PRO HG3 1 1 7 4420 1 1 2 PRO N N -19.401 0.585 -4.513 1.00 . A A . -1 PRO N 1 1 7 4421 1 1 2 PRO O O -16.937 2.410 -4.679 1.00 . A A . -1 PRO O 1 1 7 4422 1 1 3 HIS C C -16.591 5.045 -6.372 1.00 . A A . 0 HIS C 1 1 7 4423 1 1 3 HIS CA C -17.231 3.833 -7.043 1.00 . A A . 0 HIS CA 1 1 7 4424 1 1 3 HIS CB C -17.733 4.223 -8.435 1.00 . A A . 0 HIS CB 1 1 7 4425 1 1 3 HIS CD2 C -17.397 1.905 -9.554 1.00 . A A . 0 HIS CD2 1 1 7 4426 1 1 3 HIS CE1 C -19.218 1.869 -10.767 1.00 . A A . 0 HIS CE1 1 1 7 4427 1 1 3 HIS CG C -18.067 3.056 -9.313 1.00 . A A . 0 HIS CG 1 1 7 4428 1 1 3 HIS H H -19.247 3.426 -6.509 1.00 . A A . 0 HIS H 1 1 7 4429 1 1 3 HIS HA H -16.479 3.063 -7.148 1.00 . A A . 0 HIS HA 1 1 7 4430 1 1 3 HIS HB2 H -18.623 4.823 -8.332 1.00 . A A . 0 HIS HB2 1 1 7 4431 1 1 3 HIS HB3 H -16.971 4.805 -8.933 1.00 . A A . 0 HIS HB3 1 1 7 4432 1 1 3 HIS HD1 H -19.897 3.698 -10.147 1.00 . A A . 0 HIS HD1 1 1 7 4433 1 1 3 HIS HD2 H -16.455 1.608 -9.114 1.00 . A A . 0 HIS HD2 1 1 7 4434 1 1 3 HIS HE1 H -19.985 1.557 -11.458 1.00 . A A . 0 HIS HE1 1 1 7 4435 1 1 3 HIS HE2 H -17.804 0.405 -10.965 1.00 . A A . 0 HIS HE2 1 1 7 4436 1 1 3 HIS N N -18.315 3.281 -6.230 1.00 . A A . 0 HIS N 1 1 7 4437 1 1 3 HIS ND1 N -19.204 3.001 -10.090 1.00 . A A . 0 HIS ND1 1 1 7 4438 1 1 3 HIS NE2 N -18.133 1.185 -10.462 1.00 . A A . 0 HIS NE2 1 1 7 4439 1 1 3 HIS O O -15.721 5.694 -6.944 1.00 . A A . 0 HIS O 1 1 7 4440 1 1 4 MET C C -15.302 5.950 -3.533 1.00 . A A . 1 MET C 1 1 7 4441 1 1 4 MET CA C -16.458 6.444 -4.395 1.00 . A A . 1 MET CA 1 1 7 4442 1 1 4 MET CB C -17.521 7.090 -3.501 1.00 . A A . 1 MET CB 1 1 7 4443 1 1 4 MET CE C -18.241 8.136 -0.553 1.00 . A A . 1 MET CE 1 1 7 4444 1 1 4 MET CG C -18.122 6.136 -2.481 1.00 . A A . 1 MET CG 1 1 7 4445 1 1 4 MET H H -17.769 4.830 -4.781 1.00 . A A . 1 MET H 1 1 7 4446 1 1 4 MET HA H -16.087 7.182 -5.090 1.00 . A A . 1 MET HA 1 1 7 4447 1 1 4 MET HB2 H -17.071 7.915 -2.970 1.00 . A A . 1 MET HB2 1 1 7 4448 1 1 4 MET HB3 H -18.319 7.468 -4.123 1.00 . A A . 1 MET HB3 1 1 7 4449 1 1 4 MET HE1 H -17.843 8.827 -1.280 1.00 . A A . 1 MET HE1 1 1 7 4450 1 1 4 MET HE2 H -17.429 7.620 -0.065 1.00 . A A . 1 MET HE2 1 1 7 4451 1 1 4 MET HE3 H -18.818 8.679 0.182 1.00 . A A . 1 MET HE3 1 1 7 4452 1 1 4 MET HG2 H -18.635 5.346 -3.009 1.00 . A A . 1 MET HG2 1 1 7 4453 1 1 4 MET HG3 H -17.324 5.709 -1.891 1.00 . A A . 1 MET HG3 1 1 7 4454 1 1 4 MET N N -17.032 5.350 -5.162 1.00 . A A . 1 MET N 1 1 7 4455 1 1 4 MET O O -14.605 6.743 -2.900 1.00 . A A . 1 MET O 1 1 7 4456 1 1 4 MET SD S -19.296 6.943 -1.374 1.00 . A A . 1 MET SD 1 1 7 4457 1 1 5 ALA C C -13.078 3.260 -3.519 1.00 . A A . 2 ALA C 1 1 7 4458 1 1 5 ALA CA C -14.069 4.043 -2.677 1.00 . A A . 2 ALA CA 1 1 7 4459 1 1 5 ALA CB C -14.691 3.141 -1.626 1.00 . A A . 2 ALA CB 1 1 7 4460 1 1 5 ALA H H -15.650 4.057 -4.077 1.00 . A A . 2 ALA H 1 1 7 4461 1 1 5 ALA HA H -13.544 4.840 -2.170 1.00 . A A . 2 ALA HA 1 1 7 4462 1 1 5 ALA HB1 H -15.377 3.714 -1.019 1.00 . A A . 2 ALA HB1 1 1 7 4463 1 1 5 ALA HB2 H -13.912 2.729 -1.001 1.00 . A A . 2 ALA HB2 1 1 7 4464 1 1 5 ALA HB3 H -15.224 2.338 -2.112 1.00 . A A . 2 ALA HB3 1 1 7 4465 1 1 5 ALA N N -15.101 4.638 -3.509 1.00 . A A . 2 ALA N 1 1 7 4466 1 1 5 ALA O O -13.424 2.733 -4.575 1.00 . A A . 2 ALA O 1 1 7 4467 1 1 6 VAL C C -10.352 1.267 -2.958 1.00 . A A . 3 VAL C 1 1 7 4468 1 1 6 VAL CA C -10.784 2.494 -3.745 1.00 . A A . 3 VAL CA 1 1 7 4469 1 1 6 VAL CB C -9.571 3.430 -3.958 1.00 . A A . 3 VAL CB 1 1 7 4470 1 1 6 VAL CG1 C -8.466 2.732 -4.733 1.00 . A A . 3 VAL CG1 1 1 7 4471 1 1 6 VAL CG2 C -9.993 4.707 -4.668 1.00 . A A . 3 VAL CG2 1 1 7 4472 1 1 6 VAL H H -11.652 3.607 -2.180 1.00 . A A . 3 VAL H 1 1 7 4473 1 1 6 VAL HA H -11.155 2.177 -4.707 1.00 . A A . 3 VAL HA 1 1 7 4474 1 1 6 VAL HB H -9.179 3.699 -2.987 1.00 . A A . 3 VAL HB 1 1 7 4475 1 1 6 VAL HG11 H -8.838 2.437 -5.702 1.00 . A A . 3 VAL HG11 1 1 7 4476 1 1 6 VAL HG12 H -8.143 1.857 -4.189 1.00 . A A . 3 VAL HG12 1 1 7 4477 1 1 6 VAL HG13 H -7.632 3.407 -4.856 1.00 . A A . 3 VAL HG13 1 1 7 4478 1 1 6 VAL HG21 H -9.130 5.340 -4.815 1.00 . A A . 3 VAL HG21 1 1 7 4479 1 1 6 VAL HG22 H -10.723 5.228 -4.067 1.00 . A A . 3 VAL HG22 1 1 7 4480 1 1 6 VAL HG23 H -10.425 4.460 -5.626 1.00 . A A . 3 VAL HG23 1 1 7 4481 1 1 6 VAL N N -11.850 3.187 -3.041 1.00 . A A . 3 VAL N 1 1 7 4482 1 1 6 VAL O O -10.298 1.299 -1.728 1.00 . A A . 3 VAL O 1 1 7 4483 1 1 7 LEU C C -8.110 -0.931 -2.766 1.00 . A A . 4 LEU C 1 1 7 4484 1 1 7 LEU CA C -9.597 -1.028 -3.039 1.00 . A A . 4 LEU CA 1 1 7 4485 1 1 7 LEU CB C -9.847 -2.254 -3.921 1.00 . A A . 4 LEU CB 1 1 7 4486 1 1 7 LEU CD1 C -12.056 -2.781 -2.845 1.00 . A A . 4 LEU CD1 1 1 7 4487 1 1 7 LEU CD2 C -11.995 -1.677 -5.078 1.00 . A A . 4 LEU CD2 1 1 7 4488 1 1 7 LEU CG C -11.303 -2.647 -4.154 1.00 . A A . 4 LEU CG 1 1 7 4489 1 1 7 LEU H H -10.234 0.182 -4.636 1.00 . A A . 4 LEU H 1 1 7 4490 1 1 7 LEU HA H -10.117 -1.155 -2.105 1.00 . A A . 4 LEU HA 1 1 7 4491 1 1 7 LEU HB2 H -9.394 -2.071 -4.883 1.00 . A A . 4 LEU HB2 1 1 7 4492 1 1 7 LEU HB3 H -9.346 -3.096 -3.467 1.00 . A A . 4 LEU HB3 1 1 7 4493 1 1 7 LEU HD11 H -13.080 -3.057 -3.046 1.00 . A A . 4 LEU HD11 1 1 7 4494 1 1 7 LEU HD12 H -12.034 -1.839 -2.318 1.00 . A A . 4 LEU HD12 1 1 7 4495 1 1 7 LEU HD13 H -11.590 -3.547 -2.238 1.00 . A A . 4 LEU HD13 1 1 7 4496 1 1 7 LEU HD21 H -11.483 -1.670 -6.028 1.00 . A A . 4 LEU HD21 1 1 7 4497 1 1 7 LEU HD22 H -11.971 -0.691 -4.645 1.00 . A A . 4 LEU HD22 1 1 7 4498 1 1 7 LEU HD23 H -13.017 -1.988 -5.220 1.00 . A A . 4 LEU HD23 1 1 7 4499 1 1 7 LEU HG H -11.315 -3.603 -4.633 1.00 . A A . 4 LEU HG 1 1 7 4500 1 1 7 LEU N N -10.086 0.179 -3.664 1.00 . A A . 4 LEU N 1 1 7 4501 1 1 7 LEU O O -7.458 0.065 -3.079 1.00 . A A . 4 LEU O 1 1 7 4502 1 1 8 CYS C C -5.405 -2.194 -3.240 1.00 . A A . 5 CYS C 1 1 7 4503 1 1 8 CYS CA C -6.177 -2.122 -1.928 1.00 . A A . 5 CYS CA 1 1 7 4504 1 1 8 CYS CB C -5.980 -3.398 -1.136 1.00 . A A . 5 CYS CB 1 1 7 4505 1 1 8 CYS H H -8.191 -2.705 -1.897 1.00 . A A . 5 CYS H 1 1 7 4506 1 1 8 CYS HA H -5.839 -1.277 -1.348 1.00 . A A . 5 CYS HA 1 1 7 4507 1 1 8 CYS HB2 H -6.611 -3.364 -0.263 1.00 . A A . 5 CYS HB2 1 1 7 4508 1 1 8 CYS HB3 H -6.282 -4.233 -1.750 1.00 . A A . 5 CYS HB3 1 1 7 4509 1 1 8 CYS N N -7.592 -1.985 -2.180 1.00 . A A . 5 CYS N 1 1 7 4510 1 1 8 CYS O O -5.776 -2.933 -4.143 1.00 . A A . 5 CYS O 1 1 7 4511 1 1 8 CYS SG S -4.301 -3.722 -0.575 1.00 . A A . 5 CYS SG 1 1 7 4512 1 1 9 GLY C C -2.771 -2.737 -4.740 1.00 . A A . 6 GLY C 1 1 7 4513 1 1 9 GLY CA C -3.525 -1.435 -4.543 1.00 . A A . 6 GLY CA 1 1 7 4514 1 1 9 GLY H H -4.106 -0.819 -2.600 1.00 . A A . 6 GLY H 1 1 7 4515 1 1 9 GLY HA2 H -4.168 -1.274 -5.396 1.00 . A A . 6 GLY HA2 1 1 7 4516 1 1 9 GLY HA3 H -2.814 -0.625 -4.487 1.00 . A A . 6 GLY HA3 1 1 7 4517 1 1 9 GLY N N -4.335 -1.427 -3.340 1.00 . A A . 6 GLY N 1 1 7 4518 1 1 9 GLY O O -2.270 -3.011 -5.829 1.00 . A A . 6 GLY O 1 1 7 4519 1 1 10 VAL C C -2.996 -5.965 -4.009 1.00 . A A . 7 VAL C 1 1 7 4520 1 1 10 VAL CA C -1.998 -4.829 -3.779 1.00 . A A . 7 VAL CA 1 1 7 4521 1 1 10 VAL CB C -1.145 -5.131 -2.528 1.00 . A A . 7 VAL CB 1 1 7 4522 1 1 10 VAL CG1 C -0.529 -6.523 -2.612 1.00 . A A . 7 VAL CG1 1 1 7 4523 1 1 10 VAL CG2 C -0.055 -4.083 -2.372 1.00 . A A . 7 VAL CG2 1 1 7 4524 1 1 10 VAL H H -3.044 -3.249 -2.829 1.00 . A A . 7 VAL H 1 1 7 4525 1 1 10 VAL HA H -1.334 -4.785 -4.630 1.00 . A A . 7 VAL HA 1 1 7 4526 1 1 10 VAL HB H -1.784 -5.091 -1.659 1.00 . A A . 7 VAL HB 1 1 7 4527 1 1 10 VAL HG11 H 0.048 -6.717 -1.720 1.00 . A A . 7 VAL HG11 1 1 7 4528 1 1 10 VAL HG12 H 0.117 -6.579 -3.477 1.00 . A A . 7 VAL HG12 1 1 7 4529 1 1 10 VAL HG13 H -1.313 -7.260 -2.702 1.00 . A A . 7 VAL HG13 1 1 7 4530 1 1 10 VAL HG21 H 0.492 -4.265 -1.458 1.00 . A A . 7 VAL HG21 1 1 7 4531 1 1 10 VAL HG22 H -0.504 -3.101 -2.334 1.00 . A A . 7 VAL HG22 1 1 7 4532 1 1 10 VAL HG23 H 0.621 -4.139 -3.212 1.00 . A A . 7 VAL HG23 1 1 7 4533 1 1 10 VAL N N -2.669 -3.538 -3.685 1.00 . A A . 7 VAL N 1 1 7 4534 1 1 10 VAL O O -2.975 -6.606 -5.057 1.00 . A A . 7 VAL O 1 1 7 4535 1 1 11 CYS C C -6.114 -6.948 -3.835 1.00 . A A . 8 CYS C 1 1 7 4536 1 1 11 CYS CA C -4.795 -7.343 -3.159 1.00 . A A . 8 CYS CA 1 1 7 4537 1 1 11 CYS CB C -5.040 -8.017 -1.796 1.00 . A A . 8 CYS CB 1 1 7 4538 1 1 11 CYS H H -3.924 -5.627 -2.267 1.00 . A A . 8 CYS H 1 1 7 4539 1 1 11 CYS HA H -4.307 -8.064 -3.802 1.00 . A A . 8 CYS HA 1 1 7 4540 1 1 11 CYS HB2 H -5.652 -8.892 -1.957 1.00 . A A . 8 CYS HB2 1 1 7 4541 1 1 11 CYS HB3 H -4.090 -8.325 -1.384 1.00 . A A . 8 CYS HB3 1 1 7 4542 1 1 11 CYS N N -3.883 -6.208 -3.046 1.00 . A A . 8 CYS N 1 1 7 4543 1 1 11 CYS O O -6.941 -7.801 -4.143 1.00 . A A . 8 CYS O 1 1 7 4544 1 1 11 CYS SG S -5.884 -7.015 -0.548 1.00 . A A . 8 CYS SG 1 1 7 4545 1 1 12 GLY C C -8.781 -5.443 -4.241 1.00 . A A . 9 GLY C 1 1 7 4546 1 1 12 GLY CA C -7.422 -5.157 -4.851 1.00 . A A . 9 GLY CA 1 1 7 4547 1 1 12 GLY H H -5.632 -5.011 -3.733 1.00 . A A . 9 GLY H 1 1 7 4548 1 1 12 GLY HA2 H -7.322 -4.089 -4.965 1.00 . A A . 9 GLY HA2 1 1 7 4549 1 1 12 GLY HA3 H -7.384 -5.609 -5.832 1.00 . A A . 9 GLY HA3 1 1 7 4550 1 1 12 GLY N N -6.290 -5.649 -4.073 1.00 . A A . 9 GLY N 1 1 7 4551 1 1 12 GLY O O -9.765 -5.565 -4.970 1.00 . A A . 9 GLY O 1 1 7 4552 1 1 13 ILE C C -10.225 -5.177 -0.884 1.00 . A A . 10 ILE C 1 1 7 4553 1 1 13 ILE CA C -10.109 -5.863 -2.250 1.00 . A A . 10 ILE CA 1 1 7 4554 1 1 13 ILE CB C -10.253 -7.404 -2.069 1.00 . A A . 10 ILE CB 1 1 7 4555 1 1 13 ILE CD1 C -9.227 -8.056 0.169 1.00 . A A . 10 ILE CD1 1 1 7 4556 1 1 13 ILE CG1 C -9.050 -7.993 -1.327 1.00 . A A . 10 ILE CG1 1 1 7 4557 1 1 13 ILE CG2 C -10.418 -8.109 -3.404 1.00 . A A . 10 ILE CG2 1 1 7 4558 1 1 13 ILE H H -8.073 -5.328 -2.374 1.00 . A A . 10 ILE H 1 1 7 4559 1 1 13 ILE HA H -10.920 -5.518 -2.881 1.00 . A A . 10 ILE HA 1 1 7 4560 1 1 13 ILE HB H -11.140 -7.585 -1.487 1.00 . A A . 10 ILE HB 1 1 7 4561 1 1 13 ILE HD11 H -9.539 -7.088 0.529 1.00 . A A . 10 ILE HD11 1 1 7 4562 1 1 13 ILE HD12 H -8.291 -8.330 0.631 1.00 . A A . 10 ILE HD12 1 1 7 4563 1 1 13 ILE HD13 H -9.981 -8.789 0.413 1.00 . A A . 10 ILE HD13 1 1 7 4564 1 1 13 ILE HG12 H -8.874 -8.997 -1.682 1.00 . A A . 10 ILE HG12 1 1 7 4565 1 1 13 ILE HG13 H -8.179 -7.388 -1.533 1.00 . A A . 10 ILE HG13 1 1 7 4566 1 1 13 ILE HG21 H -10.634 -9.153 -3.233 1.00 . A A . 10 ILE HG21 1 1 7 4567 1 1 13 ILE HG22 H -9.498 -8.022 -3.967 1.00 . A A . 10 ILE HG22 1 1 7 4568 1 1 13 ILE HG23 H -11.226 -7.656 -3.956 1.00 . A A . 10 ILE HG23 1 1 7 4569 1 1 13 ILE N N -8.859 -5.518 -2.915 1.00 . A A . 10 ILE N 1 1 7 4570 1 1 13 ILE O O -9.266 -4.565 -0.407 1.00 . A A . 10 ILE O 1 1 7 4571 1 1 14 LYS C C -11.385 -3.350 1.328 1.00 . A A . 11 LYS C 1 1 7 4572 1 1 14 LYS CA C -11.765 -4.810 1.057 1.00 . A A . 11 LYS CA 1 1 7 4573 1 1 14 LYS CB C -11.160 -5.727 2.136 1.00 . A A . 11 LYS CB 1 1 7 4574 1 1 14 LYS CD C -9.218 -6.320 3.631 1.00 . A A . 11 LYS CD 1 1 7 4575 1 1 14 LYS CE C -9.988 -6.033 4.915 1.00 . A A . 11 LYS CE 1 1 7 4576 1 1 14 LYS CG C -9.697 -5.453 2.477 1.00 . A A . 11 LYS CG 1 1 7 4577 1 1 14 LYS H H -12.146 -5.693 -0.829 1.00 . A A . 11 LYS H 1 1 7 4578 1 1 14 LYS HA H -12.840 -4.877 1.139 1.00 . A A . 11 LYS HA 1 1 7 4579 1 1 14 LYS HB2 H -11.736 -5.615 3.040 1.00 . A A . 11 LYS HB2 1 1 7 4580 1 1 14 LYS HB3 H -11.241 -6.751 1.800 1.00 . A A . 11 LYS HB3 1 1 7 4581 1 1 14 LYS HD2 H -9.355 -7.359 3.367 1.00 . A A . 11 LYS HD2 1 1 7 4582 1 1 14 LYS HD3 H -8.169 -6.126 3.800 1.00 . A A . 11 LYS HD3 1 1 7 4583 1 1 14 LYS HE2 H -11.036 -6.221 4.743 1.00 . A A . 11 LYS HE2 1 1 7 4584 1 1 14 LYS HE3 H -9.627 -6.696 5.688 1.00 . A A . 11 LYS HE3 1 1 7 4585 1 1 14 LYS HG2 H -9.087 -5.653 1.610 1.00 . A A . 11 LYS HG2 1 1 7 4586 1 1 14 LYS HG3 H -9.594 -4.414 2.756 1.00 . A A . 11 LYS HG3 1 1 7 4587 1 1 14 LYS HZ1 H -10.109 -3.965 4.621 1.00 . A A . 11 LYS HZ1 1 1 7 4588 1 1 14 LYS HZ2 H -8.819 -4.444 5.603 1.00 . A A . 11 LYS HZ2 1 1 7 4589 1 1 14 LYS HZ3 H -10.393 -4.449 6.217 1.00 . A A . 11 LYS HZ3 1 1 7 4590 1 1 14 LYS N N -11.428 -5.276 -0.305 1.00 . A A . 11 LYS N 1 1 7 4591 1 1 14 LYS NZ N -9.815 -4.625 5.369 1.00 . A A . 11 LYS NZ 1 1 7 4592 1 1 14 LYS O O -11.169 -2.967 2.482 1.00 . A A . 11 LYS O 1 1 7 4593 1 1 15 GLU C C -9.570 -0.912 0.863 1.00 . A A . 12 GLU C 1 1 7 4594 1 1 15 GLU CA C -11.011 -1.113 0.400 1.00 . A A . 12 GLU CA 1 1 7 4595 1 1 15 GLU CB C -11.977 -0.420 1.365 1.00 . A A . 12 GLU CB 1 1 7 4596 1 1 15 GLU CD C -14.388 0.107 1.884 1.00 . A A . 12 GLU CD 1 1 7 4597 1 1 15 GLU CG C -13.391 -0.320 0.829 1.00 . A A . 12 GLU CG 1 1 7 4598 1 1 15 GLU H H -11.539 -2.901 -0.609 1.00 . A A . 12 GLU H 1 1 7 4599 1 1 15 GLU HA H -11.121 -0.667 -0.575 1.00 . A A . 12 GLU HA 1 1 7 4600 1 1 15 GLU HB2 H -12.003 -0.974 2.292 1.00 . A A . 12 GLU HB2 1 1 7 4601 1 1 15 GLU HB3 H -11.617 0.579 1.563 1.00 . A A . 12 GLU HB3 1 1 7 4602 1 1 15 GLU HG2 H -13.401 0.405 0.030 1.00 . A A . 12 GLU HG2 1 1 7 4603 1 1 15 GLU HG3 H -13.685 -1.285 0.443 1.00 . A A . 12 GLU HG3 1 1 7 4604 1 1 15 GLU N N -11.342 -2.537 0.276 1.00 . A A . 12 GLU N 1 1 7 4605 1 1 15 GLU O O -8.867 -1.863 1.215 1.00 . A A . 12 GLU O 1 1 7 4606 1 1 15 GLU OE1 O -14.546 1.326 2.103 1.00 . A A . 12 GLU OE1 1 1 7 4607 1 1 15 GLU OE2 O -15.022 -0.773 2.502 1.00 . A A . 12 GLU OE2 1 1 7 4608 1 1 16 PHE C C -7.830 1.324 2.655 1.00 . A A . 13 PHE C 1 1 7 4609 1 1 16 PHE CA C -7.782 0.662 1.286 1.00 . A A . 13 PHE CA 1 1 7 4610 1 1 16 PHE CB C -7.086 1.588 0.282 1.00 . A A . 13 PHE CB 1 1 7 4611 1 1 16 PHE CD1 C -8.690 3.429 -0.334 1.00 . A A . 13 PHE CD1 1 1 7 4612 1 1 16 PHE CD2 C -6.819 3.965 1.048 1.00 . A A . 13 PHE CD2 1 1 7 4613 1 1 16 PHE CE1 C -9.103 4.747 -0.289 1.00 . A A . 13 PHE CE1 1 1 7 4614 1 1 16 PHE CE2 C -7.226 5.284 1.094 1.00 . A A . 13 PHE CE2 1 1 7 4615 1 1 16 PHE CG C -7.546 3.022 0.334 1.00 . A A . 13 PHE CG 1 1 7 4616 1 1 16 PHE CZ C -8.370 5.676 0.426 1.00 . A A . 13 PHE CZ 1 1 7 4617 1 1 16 PHE H H -9.707 1.043 0.498 1.00 . A A . 13 PHE H 1 1 7 4618 1 1 16 PHE HA H -7.223 -0.258 1.362 1.00 . A A . 13 PHE HA 1 1 7 4619 1 1 16 PHE HB2 H -6.028 1.577 0.477 1.00 . A A . 13 PHE HB2 1 1 7 4620 1 1 16 PHE HB3 H -7.262 1.219 -0.717 1.00 . A A . 13 PHE HB3 1 1 7 4621 1 1 16 PHE HD1 H -9.266 2.705 -0.897 1.00 . A A . 13 PHE HD1 1 1 7 4622 1 1 16 PHE HD2 H -5.926 3.657 1.574 1.00 . A A . 13 PHE HD2 1 1 7 4623 1 1 16 PHE HE1 H -9.997 5.052 -0.812 1.00 . A A . 13 PHE HE1 1 1 7 4624 1 1 16 PHE HE2 H -6.648 6.008 1.652 1.00 . A A . 13 PHE HE2 1 1 7 4625 1 1 16 PHE HZ H -8.689 6.706 0.461 1.00 . A A . 13 PHE HZ 1 1 7 4626 1 1 16 PHE N N -9.123 0.331 0.837 1.00 . A A . 13 PHE N 1 1 7 4627 1 1 16 PHE O O -8.889 1.767 3.108 1.00 . A A . 13 PHE O 1 1 7 4628 1 1 17 LYS C C -5.239 2.798 4.680 1.00 . A A . 14 LYS C 1 1 7 4629 1 1 17 LYS CA C -6.563 2.041 4.595 1.00 . A A . 14 LYS CA 1 1 7 4630 1 1 17 LYS CB C -6.675 1.005 5.714 1.00 . A A . 14 LYS CB 1 1 7 4631 1 1 17 LYS CD C -6.810 0.547 8.185 1.00 . A A . 14 LYS CD 1 1 7 4632 1 1 17 LYS CE C -8.258 0.085 8.120 1.00 . A A . 14 LYS CE 1 1 7 4633 1 1 17 LYS CG C -6.501 1.578 7.111 1.00 . A A . 14 LYS CG 1 1 7 4634 1 1 17 LYS H H -5.887 0.964 2.914 1.00 . A A . 14 LYS H 1 1 7 4635 1 1 17 LYS HA H -7.373 2.745 4.686 1.00 . A A . 14 LYS HA 1 1 7 4636 1 1 17 LYS HB2 H -7.647 0.543 5.658 1.00 . A A . 14 LYS HB2 1 1 7 4637 1 1 17 LYS HB3 H -5.919 0.248 5.562 1.00 . A A . 14 LYS HB3 1 1 7 4638 1 1 17 LYS HD2 H -6.165 -0.306 8.044 1.00 . A A . 14 LYS HD2 1 1 7 4639 1 1 17 LYS HD3 H -6.626 0.986 9.154 1.00 . A A . 14 LYS HD3 1 1 7 4640 1 1 17 LYS HE2 H -8.904 0.946 8.208 1.00 . A A . 14 LYS HE2 1 1 7 4641 1 1 17 LYS HE3 H -8.427 -0.394 7.168 1.00 . A A . 14 LYS HE3 1 1 7 4642 1 1 17 LYS HG2 H -5.477 1.901 7.228 1.00 . A A . 14 LYS HG2 1 1 7 4643 1 1 17 LYS HG3 H -7.163 2.422 7.230 1.00 . A A . 14 LYS HG3 1 1 7 4644 1 1 17 LYS HZ1 H -9.564 -1.207 9.108 1.00 . A A . 14 LYS HZ1 1 1 7 4645 1 1 17 LYS HZ2 H -8.479 -0.418 10.132 1.00 . A A . 14 LYS HZ2 1 1 7 4646 1 1 17 LYS HZ3 H -7.947 -1.695 9.163 1.00 . A A . 14 LYS HZ3 1 1 7 4647 1 1 17 LYS N N -6.683 1.385 3.308 1.00 . A A . 14 LYS N 1 1 7 4648 1 1 17 LYS NZ N -8.584 -0.875 9.205 1.00 . A A . 14 LYS NZ 1 1 7 4649 1 1 17 LYS O O -5.130 3.812 5.369 1.00 . A A . 14 LYS O 1 1 7 4650 1 1 18 TYR C C -2.602 3.479 2.586 1.00 . A A . 15 TYR C 1 1 7 4651 1 1 18 TYR CA C -2.919 2.893 3.951 1.00 . A A . 15 TYR CA 1 1 7 4652 1 1 18 TYR CB C -1.870 1.831 4.283 1.00 . A A . 15 TYR CB 1 1 7 4653 1 1 18 TYR CD1 C -3.081 0.431 5.991 1.00 . A A . 15 TYR CD1 1 1 7 4654 1 1 18 TYR CD2 C -1.033 1.461 6.627 1.00 . A A . 15 TYR CD2 1 1 7 4655 1 1 18 TYR CE1 C -3.204 -0.120 7.248 1.00 . A A . 15 TYR CE1 1 1 7 4656 1 1 18 TYR CE2 C -1.145 0.911 7.889 1.00 . A A . 15 TYR CE2 1 1 7 4657 1 1 18 TYR CG C -1.998 1.231 5.661 1.00 . A A . 15 TYR CG 1 1 7 4658 1 1 18 TYR CZ C -2.233 0.122 8.195 1.00 . A A . 15 TYR CZ 1 1 7 4659 1 1 18 TYR H H -4.417 1.523 3.388 1.00 . A A . 15 TYR H 1 1 7 4660 1 1 18 TYR HA H -2.888 3.675 4.694 1.00 . A A . 15 TYR HA 1 1 7 4661 1 1 18 TYR HB2 H -1.952 1.027 3.568 1.00 . A A . 15 TYR HB2 1 1 7 4662 1 1 18 TYR HB3 H -0.888 2.273 4.204 1.00 . A A . 15 TYR HB3 1 1 7 4663 1 1 18 TYR HD1 H -3.840 0.245 5.242 1.00 . A A . 15 TYR HD1 1 1 7 4664 1 1 18 TYR HD2 H -0.183 2.081 6.383 1.00 . A A . 15 TYR HD2 1 1 7 4665 1 1 18 TYR HE1 H -4.058 -0.737 7.483 1.00 . A A . 15 TYR HE1 1 1 7 4666 1 1 18 TYR HE2 H -0.382 1.097 8.628 1.00 . A A . 15 TYR HE2 1 1 7 4667 1 1 18 TYR HH H -2.592 -1.360 9.372 1.00 . A A . 15 TYR HH 1 1 7 4668 1 1 18 TYR N N -4.250 2.308 3.953 1.00 . A A . 15 TYR N 1 1 7 4669 1 1 18 TYR O O -3.408 3.398 1.661 1.00 . A A . 15 TYR O 1 1 7 4670 1 1 18 TYR OH O -2.352 -0.426 9.452 1.00 . A A . 15 TYR OH 1 1 7 4671 1 1 19 LYS C C 0.578 4.770 1.291 1.00 . A A . 16 LYS C 1 1 7 4672 1 1 19 LYS CA C -0.925 4.568 1.203 1.00 . A A . 16 LYS CA 1 1 7 4673 1 1 19 LYS CB C -1.620 5.888 0.847 1.00 . A A . 16 LYS CB 1 1 7 4674 1 1 19 LYS CD C -2.075 7.648 -0.897 1.00 . A A . 16 LYS CD 1 1 7 4675 1 1 19 LYS CE C -1.999 8.770 0.128 1.00 . A A . 16 LYS CE 1 1 7 4676 1 1 19 LYS CG C -1.210 6.460 -0.505 1.00 . A A . 16 LYS CG 1 1 7 4677 1 1 19 LYS H H -0.841 4.119 3.263 1.00 . A A . 16 LYS H 1 1 7 4678 1 1 19 LYS HA H -1.135 3.837 0.437 1.00 . A A . 16 LYS HA 1 1 7 4679 1 1 19 LYS HB2 H -2.687 5.727 0.835 1.00 . A A . 16 LYS HB2 1 1 7 4680 1 1 19 LYS HB3 H -1.385 6.619 1.608 1.00 . A A . 16 LYS HB3 1 1 7 4681 1 1 19 LYS HD2 H -1.740 8.024 -1.851 1.00 . A A . 16 LYS HD2 1 1 7 4682 1 1 19 LYS HD3 H -3.100 7.318 -0.980 1.00 . A A . 16 LYS HD3 1 1 7 4683 1 1 19 LYS HE2 H -2.360 8.399 1.076 1.00 . A A . 16 LYS HE2 1 1 7 4684 1 1 19 LYS HE3 H -0.970 9.078 0.231 1.00 . A A . 16 LYS HE3 1 1 7 4685 1 1 19 LYS HG2 H -0.179 6.783 -0.458 1.00 . A A . 16 LYS HG2 1 1 7 4686 1 1 19 LYS HG3 H -1.312 5.690 -1.255 1.00 . A A . 16 LYS HG3 1 1 7 4687 1 1 19 LYS HZ1 H -3.809 9.651 -0.429 1.00 . A A . 16 LYS HZ1 1 1 7 4688 1 1 19 LYS HZ2 H -2.453 10.351 -1.157 1.00 . A A . 16 LYS HZ2 1 1 7 4689 1 1 19 LYS HZ3 H -2.796 10.668 0.466 1.00 . A A . 16 LYS HZ3 1 1 7 4690 1 1 19 LYS N N -1.415 4.047 2.467 1.00 . A A . 16 LYS N 1 1 7 4691 1 1 19 LYS NZ N -2.820 9.941 -0.276 1.00 . A A . 16 LYS NZ 1 1 7 4692 1 1 19 LYS O O 1.040 5.705 1.938 1.00 . A A . 16 LYS O 1 1 7 4693 1 1 20 CYS C C 3.230 5.359 0.212 1.00 . A A . 17 CYS C 1 1 7 4694 1 1 20 CYS CA C 2.788 3.971 0.666 1.00 . A A . 17 CYS CA 1 1 7 4695 1 1 20 CYS CB C 3.414 2.912 -0.250 1.00 . A A . 17 CYS CB 1 1 7 4696 1 1 20 CYS H H 0.901 3.125 0.201 1.00 . A A . 17 CYS H 1 1 7 4697 1 1 20 CYS HA H 3.132 3.808 1.675 1.00 . A A . 17 CYS HA 1 1 7 4698 1 1 20 CYS HB2 H 3.165 1.931 0.122 1.00 . A A . 17 CYS HB2 1 1 7 4699 1 1 20 CYS HB3 H 3.020 3.029 -1.248 1.00 . A A . 17 CYS HB3 1 1 7 4700 1 1 20 CYS N N 1.334 3.871 0.669 1.00 . A A . 17 CYS N 1 1 7 4701 1 1 20 CYS O O 2.891 5.788 -0.883 1.00 . A A . 17 CYS O 1 1 7 4702 1 1 20 CYS SG S 5.216 3.033 -0.347 1.00 . A A . 17 CYS SG 1 1 7 4703 1 1 21 PRO C C 5.389 7.433 -0.497 1.00 . A A . 18 PRO C 1 1 7 4704 1 1 21 PRO CA C 4.478 7.421 0.728 1.00 . A A . 18 PRO CA 1 1 7 4705 1 1 21 PRO CB C 5.258 7.845 1.981 1.00 . A A . 18 PRO CB 1 1 7 4706 1 1 21 PRO CD C 4.411 5.646 2.394 1.00 . A A . 18 PRO CD 1 1 7 4707 1 1 21 PRO CG C 5.532 6.587 2.725 1.00 . A A . 18 PRO CG 1 1 7 4708 1 1 21 PRO HA H 3.658 8.105 0.566 1.00 . A A . 18 PRO HA 1 1 7 4709 1 1 21 PRO HB2 H 6.177 8.330 1.686 1.00 . A A . 18 PRO HB2 1 1 7 4710 1 1 21 PRO HB3 H 4.659 8.525 2.566 1.00 . A A . 18 PRO HB3 1 1 7 4711 1 1 21 PRO HD2 H 4.769 4.627 2.380 1.00 . A A . 18 PRO HD2 1 1 7 4712 1 1 21 PRO HD3 H 3.605 5.754 3.104 1.00 . A A . 18 PRO HD3 1 1 7 4713 1 1 21 PRO HG2 H 6.475 6.171 2.404 1.00 . A A . 18 PRO HG2 1 1 7 4714 1 1 21 PRO HG3 H 5.552 6.785 3.786 1.00 . A A . 18 PRO HG3 1 1 7 4715 1 1 21 PRO N N 3.990 6.076 1.052 1.00 . A A . 18 PRO N 1 1 7 4716 1 1 21 PRO O O 5.617 8.479 -1.103 1.00 . A A . 18 PRO O 1 1 7 4717 1 1 22 ARG C C 6.020 5.705 -3.260 1.00 . A A . 19 ARG C 1 1 7 4718 1 1 22 ARG CA C 6.784 6.144 -2.017 1.00 . A A . 19 ARG CA 1 1 7 4719 1 1 22 ARG CB C 7.910 5.151 -1.735 1.00 . A A . 19 ARG CB 1 1 7 4720 1 1 22 ARG CD C 10.103 4.680 -0.609 1.00 . A A . 19 ARG CD 1 1 7 4721 1 1 22 ARG CG C 8.974 5.681 -0.789 1.00 . A A . 19 ARG CG 1 1 7 4722 1 1 22 ARG CZ C 11.907 3.747 -2.018 1.00 . A A . 19 ARG CZ 1 1 7 4723 1 1 22 ARG H H 5.680 5.464 -0.342 1.00 . A A . 19 ARG H 1 1 7 4724 1 1 22 ARG HA H 7.218 7.116 -2.202 1.00 . A A . 19 ARG HA 1 1 7 4725 1 1 22 ARG HB2 H 7.483 4.259 -1.297 1.00 . A A . 19 ARG HB2 1 1 7 4726 1 1 22 ARG HB3 H 8.384 4.890 -2.669 1.00 . A A . 19 ARG HB3 1 1 7 4727 1 1 22 ARG HD2 H 10.866 5.126 0.010 1.00 . A A . 19 ARG HD2 1 1 7 4728 1 1 22 ARG HD3 H 9.712 3.801 -0.119 1.00 . A A . 19 ARG HD3 1 1 7 4729 1 1 22 ARG HE H 10.160 4.437 -2.697 1.00 . A A . 19 ARG HE 1 1 7 4730 1 1 22 ARG HG2 H 9.378 6.597 -1.193 1.00 . A A . 19 ARG HG2 1 1 7 4731 1 1 22 ARG HG3 H 8.522 5.876 0.173 1.00 . A A . 19 ARG HG3 1 1 7 4732 1 1 22 ARG HH11 H 12.327 3.755 -0.031 1.00 . A A . 19 ARG HH11 1 1 7 4733 1 1 22 ARG HH12 H 13.580 3.126 -1.054 1.00 . A A . 19 ARG HH12 1 1 7 4734 1 1 22 ARG HH21 H 11.779 3.581 -4.033 1.00 . A A . 19 ARG HH21 1 1 7 4735 1 1 22 ARG HH22 H 13.270 3.022 -3.339 1.00 . A A . 19 ARG HH22 1 1 7 4736 1 1 22 ARG N N 5.904 6.263 -0.862 1.00 . A A . 19 ARG N 1 1 7 4737 1 1 22 ARG NE N 10.697 4.287 -1.886 1.00 . A A . 19 ARG NE 1 1 7 4738 1 1 22 ARG NH1 N 12.663 3.521 -0.948 1.00 . A A . 19 ARG NH1 1 1 7 4739 1 1 22 ARG NH2 N 12.354 3.423 -3.224 1.00 . A A . 19 ARG NH2 1 1 7 4740 1 1 22 ARG O O 6.185 6.278 -4.332 1.00 . A A . 19 ARG O 1 1 7 4741 1 1 23 CYS C C 3.150 4.817 -4.507 1.00 . A A . 20 CYS C 1 1 7 4742 1 1 23 CYS CA C 4.481 4.117 -4.261 1.00 . A A . 20 CYS CA 1 1 7 4743 1 1 23 CYS CB C 4.231 2.621 -4.049 1.00 . A A . 20 CYS CB 1 1 7 4744 1 1 23 CYS H H 5.027 4.319 -2.222 1.00 . A A . 20 CYS H 1 1 7 4745 1 1 23 CYS HA H 5.107 4.251 -5.127 1.00 . A A . 20 CYS HA 1 1 7 4746 1 1 23 CYS HB2 H 3.618 2.492 -3.171 1.00 . A A . 20 CYS HB2 1 1 7 4747 1 1 23 CYS HB3 H 3.705 2.230 -4.906 1.00 . A A . 20 CYS HB3 1 1 7 4748 1 1 23 CYS N N 5.182 4.687 -3.114 1.00 . A A . 20 CYS N 1 1 7 4749 1 1 23 CYS O O 2.621 4.805 -5.618 1.00 . A A . 20 CYS O 1 1 7 4750 1 1 23 CYS SG S 5.719 1.626 -3.818 1.00 . A A . 20 CYS SG 1 1 7 4751 1 1 24 LEU C C 0.228 4.966 -3.624 1.00 . A A . 21 LEU C 1 1 7 4752 1 1 24 LEU CA C 1.297 6.031 -3.437 1.00 . A A . 21 LEU CA 1 1 7 4753 1 1 24 LEU CB C 1.161 7.134 -4.491 1.00 . A A . 21 LEU CB 1 1 7 4754 1 1 24 LEU CD1 C 1.670 9.511 -5.061 1.00 . A A . 21 LEU CD1 1 1 7 4755 1 1 24 LEU CD2 C 2.606 8.530 -2.966 1.00 . A A . 21 LEU CD2 1 1 7 4756 1 1 24 LEU CG C 2.203 8.255 -4.407 1.00 . A A . 21 LEU CG 1 1 7 4757 1 1 24 LEU H H 3.168 5.484 -2.629 1.00 . A A . 21 LEU H 1 1 7 4758 1 1 24 LEU HA H 1.159 6.473 -2.460 1.00 . A A . 21 LEU HA 1 1 7 4759 1 1 24 LEU HB2 H 1.232 6.677 -5.468 1.00 . A A . 21 LEU HB2 1 1 7 4760 1 1 24 LEU HB3 H 0.181 7.577 -4.392 1.00 . A A . 21 LEU HB3 1 1 7 4761 1 1 24 LEU HD11 H 2.408 10.295 -4.989 1.00 . A A . 21 LEU HD11 1 1 7 4762 1 1 24 LEU HD12 H 0.766 9.820 -4.555 1.00 . A A . 21 LEU HD12 1 1 7 4763 1 1 24 LEU HD13 H 1.453 9.313 -6.099 1.00 . A A . 21 LEU HD13 1 1 7 4764 1 1 24 LEU HD21 H 3.295 9.361 -2.938 1.00 . A A . 21 LEU HD21 1 1 7 4765 1 1 24 LEU HD22 H 3.085 7.651 -2.556 1.00 . A A . 21 LEU HD22 1 1 7 4766 1 1 24 LEU HD23 H 1.728 8.769 -2.383 1.00 . A A . 21 LEU HD23 1 1 7 4767 1 1 24 LEU HG H 3.087 7.952 -4.949 1.00 . A A . 21 LEU HG 1 1 7 4768 1 1 24 LEU N N 2.628 5.425 -3.447 1.00 . A A . 21 LEU N 1 1 7 4769 1 1 24 LEU O O -0.927 5.267 -3.940 1.00 . A A . 21 LEU O 1 1 7 4770 1 1 25 VAL C C -1.101 2.499 -2.220 1.00 . A A . 22 VAL C 1 1 7 4771 1 1 25 VAL CA C -0.284 2.598 -3.500 1.00 . A A . 22 VAL CA 1 1 7 4772 1 1 25 VAL CB C 0.459 1.264 -3.789 1.00 . A A . 22 VAL CB 1 1 7 4773 1 1 25 VAL CG1 C 1.367 0.852 -2.637 1.00 . A A . 22 VAL CG1 1 1 7 4774 1 1 25 VAL CG2 C -0.532 0.158 -4.106 1.00 . A A . 22 VAL CG2 1 1 7 4775 1 1 25 VAL H H 1.552 3.550 -3.173 1.00 . A A . 22 VAL H 1 1 7 4776 1 1 25 VAL HA H -0.955 2.794 -4.323 1.00 . A A . 22 VAL HA 1 1 7 4777 1 1 25 VAL HB H 1.079 1.411 -4.661 1.00 . A A . 22 VAL HB 1 1 7 4778 1 1 25 VAL HG11 H 0.765 0.627 -1.769 1.00 . A A . 22 VAL HG11 1 1 7 4779 1 1 25 VAL HG12 H 2.044 1.659 -2.406 1.00 . A A . 22 VAL HG12 1 1 7 4780 1 1 25 VAL HG13 H 1.935 -0.024 -2.918 1.00 . A A . 22 VAL HG13 1 1 7 4781 1 1 25 VAL HG21 H -0.001 -0.770 -4.258 1.00 . A A . 22 VAL HG21 1 1 7 4782 1 1 25 VAL HG22 H -1.077 0.412 -5.002 1.00 . A A . 22 VAL HG22 1 1 7 4783 1 1 25 VAL HG23 H -1.222 0.047 -3.282 1.00 . A A . 22 VAL HG23 1 1 7 4784 1 1 25 VAL N N 0.625 3.716 -3.405 1.00 . A A . 22 VAL N 1 1 7 4785 1 1 25 VAL O O -0.560 2.408 -1.111 1.00 . A A . 22 VAL O 1 1 7 4786 1 1 26 GLN C C -3.598 1.127 -0.825 1.00 . A A . 23 GLN C 1 1 7 4787 1 1 26 GLN CA C -3.321 2.559 -1.263 1.00 . A A . 23 GLN CA 1 1 7 4788 1 1 26 GLN CB C -4.599 3.297 -1.658 1.00 . A A . 23 GLN CB 1 1 7 4789 1 1 26 GLN CD C -5.501 5.476 -2.627 1.00 . A A . 23 GLN CD 1 1 7 4790 1 1 26 GLN CG C -4.348 4.772 -1.938 1.00 . A A . 23 GLN CG 1 1 7 4791 1 1 26 GLN H H -2.756 2.643 -3.293 1.00 . A A . 23 GLN H 1 1 7 4792 1 1 26 GLN HA H -2.854 3.082 -0.441 1.00 . A A . 23 GLN HA 1 1 7 4793 1 1 26 GLN HB2 H -5.008 2.840 -2.546 1.00 . A A . 23 GLN HB2 1 1 7 4794 1 1 26 GLN HB3 H -5.317 3.219 -0.854 1.00 . A A . 23 GLN HB3 1 1 7 4795 1 1 26 GLN HE21 H -6.812 4.238 -1.807 1.00 . A A . 23 GLN HE21 1 1 7 4796 1 1 26 GLN HE22 H -7.475 5.471 -2.824 1.00 . A A . 23 GLN HE22 1 1 7 4797 1 1 26 GLN HG2 H -4.161 5.272 -1.000 1.00 . A A . 23 GLN HG2 1 1 7 4798 1 1 26 GLN HG3 H -3.471 4.857 -2.564 1.00 . A A . 23 GLN HG3 1 1 7 4799 1 1 26 GLN N N -2.400 2.575 -2.382 1.00 . A A . 23 GLN N 1 1 7 4800 1 1 26 GLN NE2 N -6.715 5.012 -2.400 1.00 . A A . 23 GLN NE2 1 1 7 4801 1 1 26 GLN O O -4.420 0.424 -1.406 1.00 . A A . 23 GLN O 1 1 7 4802 1 1 26 GLN OE1 O -5.292 6.436 -3.371 1.00 . A A . 23 GLN OE1 1 1 7 4803 1 1 27 THR C C -4.017 -0.824 1.753 1.00 . A A . 24 THR C 1 1 7 4804 1 1 27 THR CA C -2.947 -0.668 0.677 1.00 . A A . 24 THR CA 1 1 7 4805 1 1 27 THR CB C -1.579 -1.113 1.232 1.00 . A A . 24 THR CB 1 1 7 4806 1 1 27 THR CG2 C -0.643 -1.524 0.110 1.00 . A A . 24 THR CG2 1 1 7 4807 1 1 27 THR H H -2.305 1.339 0.664 1.00 . A A . 24 THR H 1 1 7 4808 1 1 27 THR HA H -3.195 -1.303 -0.161 1.00 . A A . 24 THR HA 1 1 7 4809 1 1 27 THR HB H -1.730 -1.962 1.882 1.00 . A A . 24 THR HB 1 1 7 4810 1 1 27 THR HG1 H -0.496 0.529 1.387 1.00 . A A . 24 THR HG1 1 1 7 4811 1 1 27 THR HG21 H -0.454 -0.679 -0.535 1.00 . A A . 24 THR HG21 1 1 7 4812 1 1 27 THR HG22 H -1.096 -2.321 -0.459 1.00 . A A . 24 THR HG22 1 1 7 4813 1 1 27 THR HG23 H 0.290 -1.869 0.531 1.00 . A A . 24 THR HG23 1 1 7 4814 1 1 27 THR N N -2.881 0.701 0.199 1.00 . A A . 24 THR N 1 1 7 4815 1 1 27 THR O O -4.436 0.153 2.368 1.00 . A A . 24 THR O 1 1 7 4816 1 1 27 THR OG1 O -0.983 -0.050 1.982 1.00 . A A . 24 THR OG1 1 1 7 4817 1 1 28 CYS C C -4.896 -2.440 4.343 1.00 . A A . 25 CYS C 1 1 7 4818 1 1 28 CYS CA C -5.502 -2.333 2.949 1.00 . A A . 25 CYS CA 1 1 7 4819 1 1 28 CYS CB C -6.253 -3.628 2.597 1.00 . A A . 25 CYS CB 1 1 7 4820 1 1 28 CYS H H -4.101 -2.790 1.436 1.00 . A A . 25 CYS H 1 1 7 4821 1 1 28 CYS HA H -6.199 -1.509 2.937 1.00 . A A . 25 CYS HA 1 1 7 4822 1 1 28 CYS HB2 H -7.089 -3.745 3.266 1.00 . A A . 25 CYS HB2 1 1 7 4823 1 1 28 CYS HB3 H -6.623 -3.551 1.587 1.00 . A A . 25 CYS HB3 1 1 7 4824 1 1 28 CYS N N -4.467 -2.056 1.963 1.00 . A A . 25 CYS N 1 1 7 4825 1 1 28 CYS O O -5.533 -2.098 5.337 1.00 . A A . 25 CYS O 1 1 7 4826 1 1 28 CYS SG S -5.255 -5.135 2.702 1.00 . A A . 25 CYS SG 1 1 7 4827 1 1 29 SER C C -1.471 -3.170 5.470 1.00 . A A . 26 SER C 1 1 7 4828 1 1 29 SER CA C -2.976 -3.103 5.685 1.00 . A A . 26 SER CA 1 1 7 4829 1 1 29 SER CB C -3.461 -4.389 6.370 1.00 . A A . 26 SER CB 1 1 7 4830 1 1 29 SER H H -3.172 -3.118 3.577 1.00 . A A . 26 SER H 1 1 7 4831 1 1 29 SER HA H -3.205 -2.256 6.317 1.00 . A A . 26 SER HA 1 1 7 4832 1 1 29 SER HB2 H -3.242 -5.235 5.736 1.00 . A A . 26 SER HB2 1 1 7 4833 1 1 29 SER HB3 H -2.951 -4.507 7.313 1.00 . A A . 26 SER HB3 1 1 7 4834 1 1 29 SER HG H -5.188 -3.457 6.440 1.00 . A A . 26 SER HG 1 1 7 4835 1 1 29 SER N N -3.654 -2.910 4.410 1.00 . A A . 26 SER N 1 1 7 4836 1 1 29 SER O O -1.026 -3.303 4.325 1.00 . A A . 26 SER O 1 1 7 4837 1 1 29 SER OG O -4.858 -4.354 6.609 1.00 . A A . 26 SER OG 1 1 7 4838 1 1 30 LEU C C 1.189 -4.480 5.770 1.00 . A A . 27 LEU C 1 1 7 4839 1 1 30 LEU CA C 0.762 -3.184 6.455 1.00 . A A . 27 LEU CA 1 1 7 4840 1 1 30 LEU CB C 1.412 -3.091 7.839 1.00 . A A . 27 LEU CB 1 1 7 4841 1 1 30 LEU CD1 C 1.908 -1.793 9.918 1.00 . A A . 27 LEU CD1 1 1 7 4842 1 1 30 LEU CD2 C 2.065 -0.673 7.691 1.00 . A A . 27 LEU CD2 1 1 7 4843 1 1 30 LEU CG C 1.330 -1.722 8.514 1.00 . A A . 27 LEU CG 1 1 7 4844 1 1 30 LEU H H -1.111 -2.997 7.436 1.00 . A A . 27 LEU H 1 1 7 4845 1 1 30 LEU HA H 1.094 -2.348 5.858 1.00 . A A . 27 LEU HA 1 1 7 4846 1 1 30 LEU HB2 H 0.937 -3.815 8.483 1.00 . A A . 27 LEU HB2 1 1 7 4847 1 1 30 LEU HB3 H 2.454 -3.355 7.740 1.00 . A A . 27 LEU HB3 1 1 7 4848 1 1 30 LEU HD11 H 1.359 -2.519 10.496 1.00 . A A . 27 LEU HD11 1 1 7 4849 1 1 30 LEU HD12 H 1.830 -0.825 10.387 1.00 . A A . 27 LEU HD12 1 1 7 4850 1 1 30 LEU HD13 H 2.946 -2.085 9.866 1.00 . A A . 27 LEU HD13 1 1 7 4851 1 1 30 LEU HD21 H 2.038 0.274 8.209 1.00 . A A . 27 LEU HD21 1 1 7 4852 1 1 30 LEU HD22 H 1.587 -0.569 6.728 1.00 . A A . 27 LEU HD22 1 1 7 4853 1 1 30 LEU HD23 H 3.092 -0.978 7.552 1.00 . A A . 27 LEU HD23 1 1 7 4854 1 1 30 LEU HG H 0.294 -1.425 8.592 1.00 . A A . 27 LEU HG 1 1 7 4855 1 1 30 LEU N N -0.695 -3.103 6.552 1.00 . A A . 27 LEU N 1 1 7 4856 1 1 30 LEU O O 2.225 -4.532 5.106 1.00 . A A . 27 LEU O 1 1 7 4857 1 1 31 GLU C C 0.817 -6.624 3.774 1.00 . A A . 28 GLU C 1 1 7 4858 1 1 31 GLU CA C 0.592 -6.805 5.278 1.00 . A A . 28 GLU CA 1 1 7 4859 1 1 31 GLU CB C -0.616 -7.717 5.516 1.00 . A A . 28 GLU CB 1 1 7 4860 1 1 31 GLU CD C 0.665 -9.850 5.957 1.00 . A A . 28 GLU CD 1 1 7 4861 1 1 31 GLU CG C -0.391 -9.166 5.112 1.00 . A A . 28 GLU CG 1 1 7 4862 1 1 31 GLU H H -0.410 -5.413 6.517 1.00 . A A . 28 GLU H 1 1 7 4863 1 1 31 GLU HA H 1.468 -7.256 5.715 1.00 . A A . 28 GLU HA 1 1 7 4864 1 1 31 GLU HB2 H -0.865 -7.695 6.565 1.00 . A A . 28 GLU HB2 1 1 7 4865 1 1 31 GLU HB3 H -1.454 -7.337 4.950 1.00 . A A . 28 GLU HB3 1 1 7 4866 1 1 31 GLU HG2 H -1.320 -9.707 5.220 1.00 . A A . 28 GLU HG2 1 1 7 4867 1 1 31 GLU HG3 H -0.078 -9.193 4.079 1.00 . A A . 28 GLU HG3 1 1 7 4868 1 1 31 GLU N N 0.367 -5.516 5.927 1.00 . A A . 28 GLU N 1 1 7 4869 1 1 31 GLU O O 1.689 -7.255 3.181 1.00 . A A . 28 GLU O 1 1 7 4870 1 1 31 GLU OE1 O 0.475 -9.948 7.184 1.00 . A A . 28 GLU OE1 1 1 7 4871 1 1 31 GLU OE2 O 1.683 -10.303 5.396 1.00 . A A . 28 GLU OE2 1 1 7 4872 1 1 32 CYS C C 1.140 -4.329 1.500 1.00 . A A . 29 CYS C 1 1 7 4873 1 1 32 CYS CA C 0.146 -5.458 1.757 1.00 . A A . 29 CYS CA 1 1 7 4874 1 1 32 CYS CB C -1.221 -5.088 1.197 1.00 . A A . 29 CYS CB 1 1 7 4875 1 1 32 CYS H H -0.620 -5.242 3.708 1.00 . A A . 29 CYS H 1 1 7 4876 1 1 32 CYS HA H 0.496 -6.355 1.267 1.00 . A A . 29 CYS HA 1 1 7 4877 1 1 32 CYS HB2 H -1.739 -4.484 1.927 1.00 . A A . 29 CYS HB2 1 1 7 4878 1 1 32 CYS HB3 H -1.092 -4.509 0.300 1.00 . A A . 29 CYS HB3 1 1 7 4879 1 1 32 CYS N N 0.037 -5.737 3.176 1.00 . A A . 29 CYS N 1 1 7 4880 1 1 32 CYS O O 1.704 -4.226 0.413 1.00 . A A . 29 CYS O 1 1 7 4881 1 1 32 CYS SG S -2.294 -6.491 0.807 1.00 . A A . 29 CYS SG 1 1 7 4882 1 1 33 SER C C 3.709 -2.918 2.233 1.00 . A A . 30 SER C 1 1 7 4883 1 1 33 SER CA C 2.290 -2.382 2.376 1.00 . A A . 30 SER CA 1 1 7 4884 1 1 33 SER CB C 2.193 -1.464 3.596 1.00 . A A . 30 SER CB 1 1 7 4885 1 1 33 SER H H 0.861 -3.600 3.343 1.00 . A A . 30 SER H 1 1 7 4886 1 1 33 SER HA H 2.036 -1.820 1.489 1.00 . A A . 30 SER HA 1 1 7 4887 1 1 33 SER HB2 H 2.623 -1.961 4.452 1.00 . A A . 30 SER HB2 1 1 7 4888 1 1 33 SER HB3 H 2.737 -0.550 3.400 1.00 . A A . 30 SER HB3 1 1 7 4889 1 1 33 SER HG H 0.429 -0.739 3.112 1.00 . A A . 30 SER HG 1 1 7 4890 1 1 33 SER N N 1.349 -3.483 2.499 1.00 . A A . 30 SER N 1 1 7 4891 1 1 33 SER O O 4.519 -2.372 1.489 1.00 . A A . 30 SER O 1 1 7 4892 1 1 33 SER OG O 0.842 -1.139 3.885 1.00 . A A . 30 SER OG 1 1 7 4893 1 1 34 LYS C C 5.407 -5.627 1.743 1.00 . A A . 31 LYS C 1 1 7 4894 1 1 34 LYS CA C 5.319 -4.619 2.885 1.00 . A A . 31 LYS CA 1 1 7 4895 1 1 34 LYS CB C 5.645 -5.296 4.219 1.00 . A A . 31 LYS CB 1 1 7 4896 1 1 34 LYS CD C 5.096 -7.074 5.903 1.00 . A A . 31 LYS CD 1 1 7 4897 1 1 34 LYS CE C 4.237 -8.286 6.220 1.00 . A A . 31 LYS CE 1 1 7 4898 1 1 34 LYS CG C 4.770 -6.499 4.535 1.00 . A A . 31 LYS CG 1 1 7 4899 1 1 34 LYS H H 3.305 -4.405 3.511 1.00 . A A . 31 LYS H 1 1 7 4900 1 1 34 LYS HA H 6.036 -3.834 2.707 1.00 . A A . 31 LYS HA 1 1 7 4901 1 1 34 LYS HB2 H 6.674 -5.621 4.202 1.00 . A A . 31 LYS HB2 1 1 7 4902 1 1 34 LYS HB3 H 5.519 -4.573 5.011 1.00 . A A . 31 LYS HB3 1 1 7 4903 1 1 34 LYS HD2 H 6.135 -7.369 5.921 1.00 . A A . 31 LYS HD2 1 1 7 4904 1 1 34 LYS HD3 H 4.923 -6.316 6.650 1.00 . A A . 31 LYS HD3 1 1 7 4905 1 1 34 LYS HE2 H 3.198 -8.013 6.117 1.00 . A A . 31 LYS HE2 1 1 7 4906 1 1 34 LYS HE3 H 4.472 -9.072 5.518 1.00 . A A . 31 LYS HE3 1 1 7 4907 1 1 34 LYS HG2 H 3.734 -6.195 4.521 1.00 . A A . 31 LYS HG2 1 1 7 4908 1 1 34 LYS HG3 H 4.936 -7.260 3.786 1.00 . A A . 31 LYS HG3 1 1 7 4909 1 1 34 LYS HZ1 H 5.469 -9.035 7.727 1.00 . A A . 31 LYS HZ1 1 1 7 4910 1 1 34 LYS HZ2 H 3.889 -9.628 7.778 1.00 . A A . 31 LYS HZ2 1 1 7 4911 1 1 34 LYS HZ3 H 4.215 -8.053 8.293 1.00 . A A . 31 LYS HZ3 1 1 7 4912 1 1 34 LYS N N 3.998 -4.007 2.936 1.00 . A A . 31 LYS N 1 1 7 4913 1 1 34 LYS NZ N 4.468 -8.785 7.600 1.00 . A A . 31 LYS NZ 1 1 7 4914 1 1 34 LYS O O 6.487 -6.128 1.425 1.00 . A A . 31 LYS O 1 1 7 4915 1 1 35 LYS C C 5.035 -6.434 -1.152 1.00 . A A . 32 LYS C 1 1 7 4916 1 1 35 LYS CA C 4.201 -6.879 0.041 1.00 . A A . 32 LYS CA 1 1 7 4917 1 1 35 LYS CB C 2.752 -7.091 -0.396 1.00 . A A . 32 LYS CB 1 1 7 4918 1 1 35 LYS CD C 2.893 -9.561 -0.816 1.00 . A A . 32 LYS CD 1 1 7 4919 1 1 35 LYS CE C 2.751 -10.668 -1.846 1.00 . A A . 32 LYS CE 1 1 7 4920 1 1 35 LYS CG C 2.578 -8.202 -1.416 1.00 . A A . 32 LYS CG 1 1 7 4921 1 1 35 LYS H H 3.458 -5.419 1.376 1.00 . A A . 32 LYS H 1 1 7 4922 1 1 35 LYS HA H 4.596 -7.810 0.416 1.00 . A A . 32 LYS HA 1 1 7 4923 1 1 35 LYS HB2 H 2.158 -7.329 0.471 1.00 . A A . 32 LYS HB2 1 1 7 4924 1 1 35 LYS HB3 H 2.383 -6.174 -0.833 1.00 . A A . 32 LYS HB3 1 1 7 4925 1 1 35 LYS HD2 H 3.906 -9.554 -0.445 1.00 . A A . 32 LYS HD2 1 1 7 4926 1 1 35 LYS HD3 H 2.209 -9.748 -0.001 1.00 . A A . 32 LYS HD3 1 1 7 4927 1 1 35 LYS HE2 H 3.372 -10.429 -2.696 1.00 . A A . 32 LYS HE2 1 1 7 4928 1 1 35 LYS HE3 H 3.084 -11.595 -1.406 1.00 . A A . 32 LYS HE3 1 1 7 4929 1 1 35 LYS HG2 H 1.557 -8.203 -1.767 1.00 . A A . 32 LYS HG2 1 1 7 4930 1 1 35 LYS HG3 H 3.246 -8.022 -2.246 1.00 . A A . 32 LYS HG3 1 1 7 4931 1 1 35 LYS HZ1 H 1.030 -9.963 -2.793 1.00 . A A . 32 LYS HZ1 1 1 7 4932 1 1 35 LYS HZ2 H 0.723 -10.995 -1.494 1.00 . A A . 32 LYS HZ2 1 1 7 4933 1 1 35 LYS HZ3 H 1.270 -11.629 -2.961 1.00 . A A . 32 LYS HZ3 1 1 7 4934 1 1 35 LYS N N 4.271 -5.898 1.114 1.00 . A A . 32 LYS N 1 1 7 4935 1 1 35 LYS NZ N 1.347 -10.825 -2.306 1.00 . A A . 32 LYS NZ 1 1 7 4936 1 1 35 LYS O O 5.793 -7.218 -1.724 1.00 . A A . 32 LYS O 1 1 7 4937 1 1 36 HIS C C 7.096 -4.378 -2.299 1.00 . A A . 33 HIS C 1 1 7 4938 1 1 36 HIS CA C 5.637 -4.643 -2.665 1.00 . A A . 33 HIS CA 1 1 7 4939 1 1 36 HIS CB C 4.976 -3.366 -3.223 1.00 . A A . 33 HIS CB 1 1 7 4940 1 1 36 HIS CD2 C 5.972 -1.558 -1.652 1.00 . A A . 33 HIS CD2 1 1 7 4941 1 1 36 HIS CE1 C 4.182 -0.466 -1.162 1.00 . A A . 33 HIS CE1 1 1 7 4942 1 1 36 HIS CG C 4.957 -2.180 -2.294 1.00 . A A . 33 HIS CG 1 1 7 4943 1 1 36 HIS H H 4.298 -4.579 -1.019 1.00 . A A . 33 HIS H 1 1 7 4944 1 1 36 HIS HA H 5.612 -5.402 -3.432 1.00 . A A . 33 HIS HA 1 1 7 4945 1 1 36 HIS HB2 H 5.505 -3.067 -4.112 1.00 . A A . 33 HIS HB2 1 1 7 4946 1 1 36 HIS HB3 H 3.952 -3.594 -3.486 1.00 . A A . 33 HIS HB3 1 1 7 4947 1 1 36 HIS HD1 H 2.911 -1.682 -2.276 1.00 . A A . 33 HIS HD1 1 1 7 4948 1 1 36 HIS HD2 H 7.003 -1.856 -1.682 1.00 . A A . 33 HIS HD2 1 1 7 4949 1 1 36 HIS HE1 H 3.487 0.231 -0.720 1.00 . A A . 33 HIS HE1 1 1 7 4950 1 1 36 HIS N N 4.903 -5.168 -1.522 1.00 . A A . 33 HIS N 1 1 7 4951 1 1 36 HIS ND1 N 3.823 -1.479 -1.968 1.00 . A A . 33 HIS ND1 1 1 7 4952 1 1 36 HIS NE2 N 5.488 -0.462 -0.943 1.00 . A A . 33 HIS NE2 1 1 7 4953 1 1 36 HIS O O 7.947 -4.222 -3.171 1.00 . A A . 33 HIS O 1 1 7 4954 1 1 37 LYS C C 9.681 -5.157 -0.732 1.00 . A A . 34 LYS C 1 1 7 4955 1 1 37 LYS CA C 8.714 -4.004 -0.530 1.00 . A A . 34 LYS CA 1 1 7 4956 1 1 37 LYS CB C 8.670 -3.617 0.949 1.00 . A A . 34 LYS CB 1 1 7 4957 1 1 37 LYS CD C 7.825 -2.037 2.708 1.00 . A A . 34 LYS CD 1 1 7 4958 1 1 37 LYS CE C 6.794 -0.972 3.035 1.00 . A A . 34 LYS CE 1 1 7 4959 1 1 37 LYS CG C 7.754 -2.443 1.246 1.00 . A A . 34 LYS CG 1 1 7 4960 1 1 37 LYS H H 6.690 -4.592 -0.354 1.00 . A A . 34 LYS H 1 1 7 4961 1 1 37 LYS HA H 9.057 -3.157 -1.104 1.00 . A A . 34 LYS HA 1 1 7 4962 1 1 37 LYS HB2 H 8.326 -4.466 1.520 1.00 . A A . 34 LYS HB2 1 1 7 4963 1 1 37 LYS HB3 H 9.668 -3.358 1.269 1.00 . A A . 34 LYS HB3 1 1 7 4964 1 1 37 LYS HD2 H 7.644 -2.904 3.325 1.00 . A A . 34 LYS HD2 1 1 7 4965 1 1 37 LYS HD3 H 8.811 -1.646 2.915 1.00 . A A . 34 LYS HD3 1 1 7 4966 1 1 37 LYS HE2 H 6.976 -0.110 2.412 1.00 . A A . 34 LYS HE2 1 1 7 4967 1 1 37 LYS HE3 H 5.809 -1.364 2.822 1.00 . A A . 34 LYS HE3 1 1 7 4968 1 1 37 LYS HG2 H 8.051 -1.604 0.635 1.00 . A A . 34 LYS HG2 1 1 7 4969 1 1 37 LYS HG3 H 6.738 -2.722 1.007 1.00 . A A . 34 LYS HG3 1 1 7 4970 1 1 37 LYS HZ1 H 6.120 0.146 4.662 1.00 . A A . 34 LYS HZ1 1 1 7 4971 1 1 37 LYS HZ2 H 7.785 -0.150 4.677 1.00 . A A . 34 LYS HZ2 1 1 7 4972 1 1 37 LYS HZ3 H 6.703 -1.384 5.077 1.00 . A A . 34 LYS HZ3 1 1 7 4973 1 1 37 LYS N N 7.385 -4.355 -1.006 1.00 . A A . 34 LYS N 1 1 7 4974 1 1 37 LYS NZ N 6.854 -0.561 4.460 1.00 . A A . 34 LYS NZ 1 1 7 4975 1 1 37 LYS O O 10.860 -4.949 -1.008 1.00 . A A . 34 LYS O 1 1 7 4976 1 1 38 THR C C 10.414 -7.868 -2.139 1.00 . A A . 35 THR C 1 1 7 4977 1 1 38 THR CA C 10.006 -7.554 -0.701 1.00 . A A . 35 THR CA 1 1 7 4978 1 1 38 THR CB C 9.296 -8.776 -0.085 1.00 . A A . 35 THR CB 1 1 7 4979 1 1 38 THR CG2 C 8.135 -9.239 -0.955 1.00 . A A . 35 THR CG2 1 1 7 4980 1 1 38 THR H H 8.204 -6.475 -0.479 1.00 . A A . 35 THR H 1 1 7 4981 1 1 38 THR HA H 10.899 -7.360 -0.124 1.00 . A A . 35 THR HA 1 1 7 4982 1 1 38 THR HB H 8.905 -8.491 0.881 1.00 . A A . 35 THR HB 1 1 7 4983 1 1 38 THR HG1 H 10.899 -9.805 -0.620 1.00 . A A . 35 THR HG1 1 1 7 4984 1 1 38 THR HG21 H 7.391 -8.459 -1.009 1.00 . A A . 35 THR HG21 1 1 7 4985 1 1 38 THR HG22 H 7.696 -10.127 -0.528 1.00 . A A . 35 THR HG22 1 1 7 4986 1 1 38 THR HG23 H 8.496 -9.459 -1.949 1.00 . A A . 35 THR HG23 1 1 7 4987 1 1 38 THR N N 9.169 -6.372 -0.624 1.00 . A A . 35 THR N 1 1 7 4988 1 1 38 THR O O 11.341 -8.644 -2.370 1.00 . A A . 35 THR O 1 1 7 4989 1 1 38 THR OG1 O 10.228 -9.852 0.080 1.00 . A A . 35 THR OG1 1 1 7 4990 1 1 39 ARG C C 10.409 -6.313 -5.296 1.00 . A A . 36 ARG C 1 1 7 4991 1 1 39 ARG CA C 9.999 -7.555 -4.506 1.00 . A A . 36 ARG CA 1 1 7 4992 1 1 39 ARG CB C 8.763 -8.202 -5.140 1.00 . A A . 36 ARG CB 1 1 7 4993 1 1 39 ARG CD C 6.318 -8.032 -5.704 1.00 . A A . 36 ARG CD 1 1 7 4994 1 1 39 ARG CG C 7.496 -7.373 -5.002 1.00 . A A . 36 ARG CG 1 1 7 4995 1 1 39 ARG CZ C 4.976 -10.102 -5.529 1.00 . A A . 36 ARG CZ 1 1 7 4996 1 1 39 ARG H H 9.060 -6.589 -2.869 1.00 . A A . 36 ARG H 1 1 7 4997 1 1 39 ARG HA H 10.812 -8.264 -4.540 1.00 . A A . 36 ARG HA 1 1 7 4998 1 1 39 ARG HB2 H 8.954 -8.357 -6.190 1.00 . A A . 36 ARG HB2 1 1 7 4999 1 1 39 ARG HB3 H 8.593 -9.159 -4.669 1.00 . A A . 36 ARG HB3 1 1 7 5000 1 1 39 ARG HD2 H 5.452 -7.395 -5.601 1.00 . A A . 36 ARG HD2 1 1 7 5001 1 1 39 ARG HD3 H 6.556 -8.145 -6.751 1.00 . A A . 36 ARG HD3 1 1 7 5002 1 1 39 ARG HE H 6.600 -9.688 -4.434 1.00 . A A . 36 ARG HE 1 1 7 5003 1 1 39 ARG HG2 H 7.263 -7.263 -3.952 1.00 . A A . 36 ARG HG2 1 1 7 5004 1 1 39 ARG HG3 H 7.667 -6.399 -5.438 1.00 . A A . 36 ARG HG3 1 1 7 5005 1 1 39 ARG HH11 H 4.330 -8.819 -6.960 1.00 . A A . 36 ARG HH11 1 1 7 5006 1 1 39 ARG HH12 H 3.396 -10.269 -6.784 1.00 . A A . 36 ARG HH12 1 1 7 5007 1 1 39 ARG HH21 H 5.378 -11.599 -4.226 1.00 . A A . 36 ARG HH21 1 1 7 5008 1 1 39 ARG HH22 H 3.994 -11.852 -5.244 1.00 . A A . 36 ARG HH22 1 1 7 5009 1 1 39 ARG N N 9.741 -7.253 -3.104 1.00 . A A . 36 ARG N 1 1 7 5010 1 1 39 ARG NE N 6.006 -9.347 -5.142 1.00 . A A . 36 ARG NE 1 1 7 5011 1 1 39 ARG NH1 N 4.169 -9.697 -6.502 1.00 . A A . 36 ARG NH1 1 1 7 5012 1 1 39 ARG NH2 N 4.765 -11.276 -4.952 1.00 . A A . 36 ARG NH2 1 1 7 5013 1 1 39 ARG O O 10.764 -6.411 -6.470 1.00 . A A . 36 ARG O 1 1 7 5014 1 1 40 ASP C C 11.707 -3.071 -4.543 1.00 . A A . 37 ASP C 1 1 7 5015 1 1 40 ASP CA C 10.714 -3.906 -5.353 1.00 . A A . 37 ASP CA 1 1 7 5016 1 1 40 ASP CB C 9.439 -3.102 -5.648 1.00 . A A . 37 ASP CB 1 1 7 5017 1 1 40 ASP CG C 9.686 -1.886 -6.519 1.00 . A A . 37 ASP CG 1 1 7 5018 1 1 40 ASP H H 10.111 -5.120 -3.718 1.00 . A A . 37 ASP H 1 1 7 5019 1 1 40 ASP HA H 11.178 -4.174 -6.291 1.00 . A A . 37 ASP HA 1 1 7 5020 1 1 40 ASP HB2 H 8.732 -3.741 -6.152 1.00 . A A . 37 ASP HB2 1 1 7 5021 1 1 40 ASP HB3 H 9.011 -2.771 -4.712 1.00 . A A . 37 ASP HB3 1 1 7 5022 1 1 40 ASP N N 10.375 -5.149 -4.660 1.00 . A A . 37 ASP N 1 1 7 5023 1 1 40 ASP O O 12.110 -1.987 -4.961 1.00 . A A . 37 ASP O 1 1 7 5024 1 1 40 ASP OD1 O 10.102 -2.055 -7.687 1.00 . A A . 37 ASP OD1 1 1 7 5025 1 1 40 ASP OD2 O 9.444 -0.755 -6.050 1.00 . A A . 37 ASP OD2 1 1 7 5026 1 1 41 ASN C C 12.575 -1.586 -2.015 1.00 . A A . 38 ASN C 1 1 7 5027 1 1 41 ASN CA C 13.083 -2.939 -2.508 1.00 . A A . 38 ASN CA 1 1 7 5028 1 1 41 ASN CB C 14.438 -2.758 -3.204 1.00 . A A . 38 ASN CB 1 1 7 5029 1 1 41 ASN CG C 15.128 -4.072 -3.509 1.00 . A A . 38 ASN CG 1 1 7 5030 1 1 41 ASN H H 11.771 -4.479 -3.124 1.00 . A A . 38 ASN H 1 1 7 5031 1 1 41 ASN HA H 13.224 -3.579 -1.649 1.00 . A A . 38 ASN HA 1 1 7 5032 1 1 41 ASN HB2 H 14.289 -2.231 -4.134 1.00 . A A . 38 ASN HB2 1 1 7 5033 1 1 41 ASN HB3 H 15.082 -2.176 -2.565 1.00 . A A . 38 ASN HB3 1 1 7 5034 1 1 41 ASN HD21 H 14.373 -4.085 -5.344 1.00 . A A . 38 ASN HD21 1 1 7 5035 1 1 41 ASN HD22 H 15.384 -5.426 -4.940 1.00 . A A . 38 ASN HD22 1 1 7 5036 1 1 41 ASN N N 12.115 -3.602 -3.389 1.00 . A A . 38 ASN N 1 1 7 5037 1 1 41 ASN ND2 N 14.941 -4.578 -4.718 1.00 . A A . 38 ASN ND2 1 1 7 5038 1 1 41 ASN O O 13.363 -0.680 -1.737 1.00 . A A . 38 ASN O 1 1 7 5039 1 1 41 ASN OD1 O 15.840 -4.620 -2.669 1.00 . A A . 38 ASN OD1 1 1 7 5040 1 1 42 CYS C C 10.771 -0.194 0.128 1.00 . A A . 39 CYS C 1 1 7 5041 1 1 42 CYS CA C 10.678 -0.217 -1.392 1.00 . A A . 39 CYS CA 1 1 7 5042 1 1 42 CYS CB C 9.216 -0.084 -1.830 1.00 . A A . 39 CYS CB 1 1 7 5043 1 1 42 CYS H H 10.677 -2.183 -2.169 1.00 . A A . 39 CYS H 1 1 7 5044 1 1 42 CYS HA H 11.245 0.613 -1.790 1.00 . A A . 39 CYS HA 1 1 7 5045 1 1 42 CYS HB2 H 9.166 -0.097 -2.909 1.00 . A A . 39 CYS HB2 1 1 7 5046 1 1 42 CYS HB3 H 8.656 -0.917 -1.437 1.00 . A A . 39 CYS HB3 1 1 7 5047 1 1 42 CYS N N 11.263 -1.446 -1.904 1.00 . A A . 39 CYS N 1 1 7 5048 1 1 42 CYS O O 10.710 -1.238 0.780 1.00 . A A . 39 CYS O 1 1 7 5049 1 1 42 CYS SG S 8.418 1.437 -1.259 1.00 . A A . 39 CYS SG 1 1 7 5050 1 1 43 SER C C 9.621 1.524 2.677 1.00 . A A . 40 SER C 1 1 7 5051 1 1 43 SER CA C 10.994 1.157 2.128 1.00 . A A . 40 SER CA 1 1 7 5052 1 1 43 SER CB C 12.011 2.235 2.500 1.00 . A A . 40 SER CB 1 1 7 5053 1 1 43 SER H H 11.048 1.780 0.113 1.00 . A A . 40 SER H 1 1 7 5054 1 1 43 SER HA H 11.301 0.216 2.560 1.00 . A A . 40 SER HA 1 1 7 5055 1 1 43 SER HB2 H 11.919 2.465 3.550 1.00 . A A . 40 SER HB2 1 1 7 5056 1 1 43 SER HB3 H 13.004 1.876 2.301 1.00 . A A . 40 SER HB3 1 1 7 5057 1 1 43 SER HG H 12.258 4.156 2.180 1.00 . A A . 40 SER HG 1 1 7 5058 1 1 43 SER N N 10.943 0.994 0.686 1.00 . A A . 40 SER N 1 1 7 5059 1 1 43 SER O O 9.289 1.227 3.823 1.00 . A A . 40 SER O 1 1 7 5060 1 1 43 SER OG O 11.795 3.423 1.749 1.00 . A A . 40 SER OG 1 1 7 5061 1 1 44 GLY C C 7.625 3.791 3.214 1.00 . A A . 41 GLY C 1 1 7 5062 1 1 44 GLY CA C 7.517 2.636 2.244 1.00 . A A . 41 GLY CA 1 1 7 5063 1 1 44 GLY H H 9.107 2.278 0.898 1.00 . A A . 41 GLY H 1 1 7 5064 1 1 44 GLY HA2 H 6.966 2.959 1.373 1.00 . A A . 41 GLY HA2 1 1 7 5065 1 1 44 GLY HA3 H 6.980 1.831 2.719 1.00 . A A . 41 GLY HA3 1 1 7 5066 1 1 44 GLY N N 8.816 2.154 1.825 1.00 . A A . 41 GLY N 1 1 7 5067 1 1 44 GLY O O 6.809 3.925 4.120 1.00 . A A . 41 GLY O 1 1 7 5068 1 1 45 GLN C C 9.597 6.845 3.140 1.00 . A A . 42 GLN C 1 1 7 5069 1 1 45 GLN CA C 8.877 5.749 3.906 1.00 . A A . 42 GLN CA 1 1 7 5070 1 1 45 GLN CB C 9.700 5.289 5.114 1.00 . A A . 42 GLN CB 1 1 7 5071 1 1 45 GLN CD C 11.756 4.074 5.916 1.00 . A A . 42 GLN CD 1 1 7 5072 1 1 45 GLN CG C 11.101 4.819 4.770 1.00 . A A . 42 GLN CG 1 1 7 5073 1 1 45 GLN H H 9.209 4.516 2.237 1.00 . A A . 42 GLN H 1 1 7 5074 1 1 45 GLN HA H 7.923 6.125 4.245 1.00 . A A . 42 GLN HA 1 1 7 5075 1 1 45 GLN HB2 H 9.783 6.107 5.811 1.00 . A A . 42 GLN HB2 1 1 7 5076 1 1 45 GLN HB3 H 9.182 4.472 5.592 1.00 . A A . 42 GLN HB3 1 1 7 5077 1 1 45 GLN HE21 H 13.551 4.683 5.324 1.00 . A A . 42 GLN HE21 1 1 7 5078 1 1 45 GLN HE22 H 13.521 3.684 6.735 1.00 . A A . 42 GLN HE22 1 1 7 5079 1 1 45 GLN HG2 H 11.045 4.162 3.914 1.00 . A A . 42 GLN HG2 1 1 7 5080 1 1 45 GLN HG3 H 11.705 5.678 4.524 1.00 . A A . 42 GLN HG3 1 1 7 5081 1 1 45 GLN N N 8.627 4.633 3.015 1.00 . A A . 42 GLN N 1 1 7 5082 1 1 45 GLN NE2 N 13.074 4.154 6.000 1.00 . A A . 42 GLN NE2 1 1 7 5083 1 1 45 GLN O O 10.401 6.556 2.251 1.00 . A A . 42 GLN O 1 1 7 5084 1 1 45 GLN OE1 O 11.077 3.425 6.717 1.00 . A A . 42 GLN OE1 1 1 7 5085 1 1 46 THR C C 10.580 10.177 3.675 1.00 . A A . 43 THR C 1 1 7 5086 1 1 46 THR CA C 9.870 9.205 2.737 1.00 . A A . 43 THR CA 1 1 7 5087 1 1 46 THR CB C 8.792 9.961 1.936 1.00 . A A . 43 THR CB 1 1 7 5088 1 1 46 THR CG2 C 8.425 9.205 0.669 1.00 . A A . 43 THR CG2 1 1 7 5089 1 1 46 THR H H 8.660 8.260 4.187 1.00 . A A . 43 THR H 1 1 7 5090 1 1 46 THR HA H 10.588 8.804 2.039 1.00 . A A . 43 THR HA 1 1 7 5091 1 1 46 THR HB H 9.188 10.928 1.657 1.00 . A A . 43 THR HB 1 1 7 5092 1 1 46 THR HG1 H 7.872 10.630 3.553 1.00 . A A . 43 THR HG1 1 1 7 5093 1 1 46 THR HG21 H 7.625 9.721 0.161 1.00 . A A . 43 THR HG21 1 1 7 5094 1 1 46 THR HG22 H 8.104 8.207 0.927 1.00 . A A . 43 THR HG22 1 1 7 5095 1 1 46 THR HG23 H 9.286 9.149 0.021 1.00 . A A . 43 THR HG23 1 1 7 5096 1 1 46 THR N N 9.292 8.088 3.457 1.00 . A A . 43 THR N 1 1 7 5097 1 1 46 THR O O 9.940 11.003 4.330 1.00 . A A . 43 THR O 1 1 7 5098 1 1 46 THR OG1 O 7.622 10.155 2.749 1.00 . A A . 43 THR OG1 1 1 7 5099 1 1 47 HIS C C 13.086 12.184 3.645 1.00 . A A . 44 HIS C 1 1 7 5100 1 1 47 HIS CA C 12.697 11.005 4.524 1.00 . A A . 44 HIS CA 1 1 7 5101 1 1 47 HIS CB C 13.951 10.321 5.079 1.00 . A A . 44 HIS CB 1 1 7 5102 1 1 47 HIS CD2 C 14.690 11.295 7.368 1.00 . A A . 44 HIS CD2 1 1 7 5103 1 1 47 HIS CE1 C 16.296 12.603 6.665 1.00 . A A . 44 HIS CE1 1 1 7 5104 1 1 47 HIS CG C 14.751 11.171 6.022 1.00 . A A . 44 HIS CG 1 1 7 5105 1 1 47 HIS H H 12.347 9.336 3.268 1.00 . A A . 44 HIS H 1 1 7 5106 1 1 47 HIS HA H 12.092 11.361 5.346 1.00 . A A . 44 HIS HA 1 1 7 5107 1 1 47 HIS HB2 H 13.658 9.427 5.610 1.00 . A A . 44 HIS HB2 1 1 7 5108 1 1 47 HIS HB3 H 14.593 10.046 4.255 1.00 . A A . 44 HIS HB3 1 1 7 5109 1 1 47 HIS HD1 H 16.054 12.159 4.677 1.00 . A A . 44 HIS HD1 1 1 7 5110 1 1 47 HIS HD2 H 14.001 10.785 8.026 1.00 . A A . 44 HIS HD2 1 1 7 5111 1 1 47 HIS HE1 H 17.110 13.312 6.644 1.00 . A A . 44 HIS HE1 1 1 7 5112 1 1 47 HIS HE2 H 16.003 12.294 8.658 1.00 . A A . 44 HIS HE2 1 1 7 5113 1 1 47 HIS N N 11.899 10.067 3.747 1.00 . A A . 44 HIS N 1 1 7 5114 1 1 47 HIS ND1 N 15.767 12.009 5.613 1.00 . A A . 44 HIS ND1 1 1 7 5115 1 1 47 HIS NE2 N 15.662 12.190 7.744 1.00 . A A . 44 HIS NE2 1 1 7 5116 1 1 47 HIS O O 13.141 13.323 4.103 1.00 . A A . 44 HIS O 1 1 7 5117 1 1 48 ASP C C 13.081 12.597 0.057 1.00 . A A . 45 ASP C 1 1 7 5118 1 1 48 ASP CA C 13.703 12.922 1.404 1.00 . A A . 45 ASP CA 1 1 7 5119 1 1 48 ASP CB C 15.222 13.050 1.251 1.00 . A A . 45 ASP CB 1 1 7 5120 1 1 48 ASP CG C 15.893 13.605 2.487 1.00 . A A . 45 ASP CG 1 1 7 5121 1 1 48 ASP H H 13.305 10.960 2.081 1.00 . A A . 45 ASP H 1 1 7 5122 1 1 48 ASP HA H 13.302 13.861 1.755 1.00 . A A . 45 ASP HA 1 1 7 5123 1 1 48 ASP HB2 H 15.640 12.076 1.047 1.00 . A A . 45 ASP HB2 1 1 7 5124 1 1 48 ASP HB3 H 15.438 13.708 0.421 1.00 . A A . 45 ASP HB3 1 1 7 5125 1 1 48 ASP N N 13.353 11.895 2.377 1.00 . A A . 45 ASP N 1 1 7 5126 1 1 48 ASP O O 13.779 12.018 -0.800 1.00 . A A . 45 ASP O 1 1 7 5127 1 1 48 ASP OXT O 11.888 12.904 -0.136 1.00 . A A . 45 ASP OXT 1 1 7 5128 1 1 48 ASP OD1 O 15.789 14.829 2.729 1.00 . A A . 45 ASP OD1 1 1 7 5129 1 1 48 ASP OD2 O 16.517 12.819 3.233 1.00 . A A . 45 ASP OD2 1 1 7 5130 2 2 1 ZN ZN ZN -4.428 -5.664 0.623 1.00 . B A . 101 ZN ZN 1 1 7 5131 3 2 1 ZN ZN ZN 6.145 1.323 -1.580 1.00 . C A . 102 ZN ZN 1 1 8 5132 1 1 1 GLY C C -11.361 12.952 5.817 1.00 . A A . -2 GLY C 1 1 8 5133 1 1 1 GLY CA C -10.319 13.129 6.896 1.00 . A A . -2 GLY CA 1 1 8 5134 1 1 1 GLY H1 H -11.652 13.323 8.476 1.00 . A A . -2 GLY H1 1 1 8 5135 1 1 1 GLY H2 H -10.103 12.845 8.946 1.00 . A A . -2 GLY H2 1 1 8 5136 1 1 1 GLY H3 H -11.141 11.736 8.203 1.00 . A A . -2 GLY H3 1 1 8 5137 1 1 1 GLY HA2 H -10.023 14.167 6.931 1.00 . A A . -2 GLY HA2 1 1 8 5138 1 1 1 GLY HA3 H -9.457 12.524 6.659 1.00 . A A . -2 GLY HA3 1 1 8 5139 1 1 1 GLY N N -10.838 12.731 8.223 1.00 . A A . -2 GLY N 1 1 8 5140 1 1 1 GLY O O -12.554 12.879 6.118 1.00 . A A . -2 GLY O 1 1 8 5141 1 1 2 PRO C C -12.362 11.218 3.378 1.00 . A A . -1 PRO C 1 1 8 5142 1 1 2 PRO CA C -11.877 12.665 3.436 1.00 . A A . -1 PRO CA 1 1 8 5143 1 1 2 PRO CB C -11.039 13.004 2.203 1.00 . A A . -1 PRO CB 1 1 8 5144 1 1 2 PRO CD C -9.556 13.030 4.085 1.00 . A A . -1 PRO CD 1 1 8 5145 1 1 2 PRO CG C -9.632 12.727 2.612 1.00 . A A . -1 PRO CG 1 1 8 5146 1 1 2 PRO HA H -12.727 13.327 3.494 1.00 . A A . -1 PRO HA 1 1 8 5147 1 1 2 PRO HB2 H -11.342 12.379 1.376 1.00 . A A . -1 PRO HB2 1 1 8 5148 1 1 2 PRO HB3 H -11.176 14.043 1.945 1.00 . A A . -1 PRO HB3 1 1 8 5149 1 1 2 PRO HD2 H -8.912 12.321 4.582 1.00 . A A . -1 PRO HD2 1 1 8 5150 1 1 2 PRO HD3 H -9.202 14.037 4.245 1.00 . A A . -1 PRO HD3 1 1 8 5151 1 1 2 PRO HG2 H -9.395 11.689 2.430 1.00 . A A . -1 PRO HG2 1 1 8 5152 1 1 2 PRO HG3 H -8.958 13.368 2.063 1.00 . A A . -1 PRO HG3 1 1 8 5153 1 1 2 PRO N N -10.951 12.885 4.545 1.00 . A A . -1 PRO N 1 1 8 5154 1 1 2 PRO O O -11.578 10.280 3.558 1.00 . A A . -1 PRO O 1 1 8 5155 1 1 3 HIS C C -13.964 9.133 1.634 1.00 . A A . 0 HIS C 1 1 8 5156 1 1 3 HIS CA C -14.227 9.705 3.018 1.00 . A A . 0 HIS CA 1 1 8 5157 1 1 3 HIS CB C -15.733 9.724 3.304 1.00 . A A . 0 HIS CB 1 1 8 5158 1 1 3 HIS CD2 C -16.003 10.767 5.662 1.00 . A A . 0 HIS CD2 1 1 8 5159 1 1 3 HIS CE1 C -16.763 8.998 6.707 1.00 . A A . 0 HIS CE1 1 1 8 5160 1 1 3 HIS CG C -16.070 9.761 4.761 1.00 . A A . 0 HIS CG 1 1 8 5161 1 1 3 HIS H H -14.225 11.826 2.999 1.00 . A A . 0 HIS H 1 1 8 5162 1 1 3 HIS HA H -13.741 9.076 3.749 1.00 . A A . 0 HIS HA 1 1 8 5163 1 1 3 HIS HB2 H -16.169 10.597 2.841 1.00 . A A . 0 HIS HB2 1 1 8 5164 1 1 3 HIS HB3 H -16.182 8.838 2.880 1.00 . A A . 0 HIS HB3 1 1 8 5165 1 1 3 HIS HD1 H -16.706 7.769 5.071 1.00 . A A . 0 HIS HD1 1 1 8 5166 1 1 3 HIS HD2 H -15.670 11.777 5.472 1.00 . A A . 0 HIS HD2 1 1 8 5167 1 1 3 HIS HE1 H -17.140 8.343 7.478 1.00 . A A . 0 HIS HE1 1 1 8 5168 1 1 3 HIS HE2 H -16.428 10.746 7.721 1.00 . A A . 0 HIS HE2 1 1 8 5169 1 1 3 HIS N N -13.650 11.040 3.130 1.00 . A A . 0 HIS N 1 1 8 5170 1 1 3 HIS ND1 N -16.548 8.665 5.449 1.00 . A A . 0 HIS ND1 1 1 8 5171 1 1 3 HIS NE2 N -16.439 10.266 6.862 1.00 . A A . 0 HIS NE2 1 1 8 5172 1 1 3 HIS O O -14.859 9.061 0.792 1.00 . A A . 0 HIS O 1 1 8 5173 1 1 4 MET C C -12.375 6.639 0.228 1.00 . A A . 1 MET C 1 1 8 5174 1 1 4 MET CA C -12.335 8.156 0.130 1.00 . A A . 1 MET CA 1 1 8 5175 1 1 4 MET CB C -10.935 8.625 -0.271 1.00 . A A . 1 MET CB 1 1 8 5176 1 1 4 MET CE C -8.864 9.757 -2.403 1.00 . A A . 1 MET CE 1 1 8 5177 1 1 4 MET CG C -10.840 10.126 -0.495 1.00 . A A . 1 MET CG 1 1 8 5178 1 1 4 MET H H -12.049 8.853 2.104 1.00 . A A . 1 MET H 1 1 8 5179 1 1 4 MET HA H -13.045 8.478 -0.618 1.00 . A A . 1 MET HA 1 1 8 5180 1 1 4 MET HB2 H -10.239 8.353 0.508 1.00 . A A . 1 MET HB2 1 1 8 5181 1 1 4 MET HB3 H -10.650 8.127 -1.186 1.00 . A A . 1 MET HB3 1 1 8 5182 1 1 4 MET HE1 H -8.891 8.698 -2.194 1.00 . A A . 1 MET HE1 1 1 8 5183 1 1 4 MET HE2 H -7.895 10.023 -2.795 1.00 . A A . 1 MET HE2 1 1 8 5184 1 1 4 MET HE3 H -9.625 9.999 -3.130 1.00 . A A . 1 MET HE3 1 1 8 5185 1 1 4 MET HG2 H -11.495 10.398 -1.308 1.00 . A A . 1 MET HG2 1 1 8 5186 1 1 4 MET HG3 H -11.162 10.628 0.405 1.00 . A A . 1 MET HG3 1 1 8 5187 1 1 4 MET N N -12.723 8.745 1.399 1.00 . A A . 1 MET N 1 1 8 5188 1 1 4 MET O O -12.531 6.085 1.316 1.00 . A A . 1 MET O 1 1 8 5189 1 1 4 MET SD S -9.169 10.673 -0.893 1.00 . A A . 1 MET SD 1 1 8 5190 1 1 5 ALA C C -11.652 4.078 -2.258 1.00 . A A . 2 ALA C 1 1 8 5191 1 1 5 ALA CA C -12.283 4.537 -0.971 1.00 . A A . 2 ALA CA 1 1 8 5192 1 1 5 ALA CB C -13.712 4.035 -0.876 1.00 . A A . 2 ALA CB 1 1 8 5193 1 1 5 ALA H H -12.026 6.471 -1.729 1.00 . A A . 2 ALA H 1 1 8 5194 1 1 5 ALA HA H -11.718 4.132 -0.142 1.00 . A A . 2 ALA HA 1 1 8 5195 1 1 5 ALA HB1 H -13.714 2.954 -0.927 1.00 . A A . 2 ALA HB1 1 1 8 5196 1 1 5 ALA HB2 H -14.287 4.434 -1.697 1.00 . A A . 2 ALA HB2 1 1 8 5197 1 1 5 ALA HB3 H -14.144 4.353 0.058 1.00 . A A . 2 ALA HB3 1 1 8 5198 1 1 5 ALA N N -12.219 5.977 -0.905 1.00 . A A . 2 ALA N 1 1 8 5199 1 1 5 ALA O O -11.272 4.894 -3.101 1.00 . A A . 2 ALA O 1 1 8 5200 1 1 6 VAL C C -10.776 0.696 -3.224 1.00 . A A . 3 VAL C 1 1 8 5201 1 1 6 VAL CA C -10.801 2.187 -3.473 1.00 . A A . 3 VAL CA 1 1 8 5202 1 1 6 VAL CB C -9.357 2.733 -3.421 1.00 . A A . 3 VAL CB 1 1 8 5203 1 1 6 VAL CG1 C -8.530 1.960 -2.436 1.00 . A A . 3 VAL CG1 1 1 8 5204 1 1 6 VAL CG2 C -8.674 2.720 -4.755 1.00 . A A . 3 VAL CG2 1 1 8 5205 1 1 6 VAL H H -12.061 2.193 -1.799 1.00 . A A . 3 VAL H 1 1 8 5206 1 1 6 VAL HA H -11.247 2.415 -4.423 1.00 . A A . 3 VAL HA 1 1 8 5207 1 1 6 VAL HB H -9.404 3.759 -3.080 1.00 . A A . 3 VAL HB 1 1 8 5208 1 1 6 VAL HG11 H -8.139 1.073 -2.909 1.00 . A A . 3 VAL HG11 1 1 8 5209 1 1 6 VAL HG12 H -9.153 1.674 -1.600 1.00 . A A . 3 VAL HG12 1 1 8 5210 1 1 6 VAL HG13 H -7.718 2.582 -2.093 1.00 . A A . 3 VAL HG13 1 1 8 5211 1 1 6 VAL HG21 H -8.697 1.723 -5.158 1.00 . A A . 3 VAL HG21 1 1 8 5212 1 1 6 VAL HG22 H -7.649 3.027 -4.609 1.00 . A A . 3 VAL HG22 1 1 8 5213 1 1 6 VAL HG23 H -9.171 3.403 -5.424 1.00 . A A . 3 VAL HG23 1 1 8 5214 1 1 6 VAL N N -11.576 2.781 -2.416 1.00 . A A . 3 VAL N 1 1 8 5215 1 1 6 VAL O O -11.380 0.228 -2.258 1.00 . A A . 3 VAL O 1 1 8 5216 1 1 7 LEU C C -8.207 -1.473 -3.670 1.00 . A A . 4 LEU C 1 1 8 5217 1 1 7 LEU CA C -9.718 -1.380 -3.694 1.00 . A A . 4 LEU CA 1 1 8 5218 1 1 7 LEU CB C -10.336 -2.428 -4.621 1.00 . A A . 4 LEU CB 1 1 8 5219 1 1 7 LEU CD1 C -12.352 -3.698 -5.407 1.00 . A A . 4 LEU CD1 1 1 8 5220 1 1 7 LEU CD2 C -12.242 -2.888 -3.044 1.00 . A A . 4 LEU CD2 1 1 8 5221 1 1 7 LEU CG C -11.853 -2.596 -4.489 1.00 . A A . 4 LEU CG 1 1 8 5222 1 1 7 LEU H H -9.846 0.310 -4.944 1.00 . A A . 4 LEU H 1 1 8 5223 1 1 7 LEU HA H -10.079 -1.533 -2.684 1.00 . A A . 4 LEU HA 1 1 8 5224 1 1 7 LEU HB2 H -10.111 -2.152 -5.641 1.00 . A A . 4 LEU HB2 1 1 8 5225 1 1 7 LEU HB3 H -9.872 -3.380 -4.413 1.00 . A A . 4 LEU HB3 1 1 8 5226 1 1 7 LEU HD11 H -12.103 -3.455 -6.428 1.00 . A A . 4 LEU HD11 1 1 8 5227 1 1 7 LEU HD12 H -13.423 -3.790 -5.309 1.00 . A A . 4 LEU HD12 1 1 8 5228 1 1 7 LEU HD13 H -11.883 -4.631 -5.135 1.00 . A A . 4 LEU HD13 1 1 8 5229 1 1 7 LEU HD21 H -13.291 -3.137 -2.997 1.00 . A A . 4 LEU HD21 1 1 8 5230 1 1 7 LEU HD22 H -12.056 -2.012 -2.436 1.00 . A A . 4 LEU HD22 1 1 8 5231 1 1 7 LEU HD23 H -11.655 -3.719 -2.669 1.00 . A A . 4 LEU HD23 1 1 8 5232 1 1 7 LEU HG H -12.336 -1.676 -4.784 1.00 . A A . 4 LEU HG 1 1 8 5233 1 1 7 LEU N N -10.098 -0.045 -4.064 1.00 . A A . 4 LEU N 1 1 8 5234 1 1 7 LEU O O -7.528 -0.948 -4.555 1.00 . A A . 4 LEU O 1 1 8 5235 1 1 8 CYS C C -5.441 -2.440 -3.570 1.00 . A A . 5 CYS C 1 1 8 5236 1 1 8 CYS CA C -6.285 -2.218 -2.320 1.00 . A A . 5 CYS CA 1 1 8 5237 1 1 8 CYS CB C -6.097 -3.375 -1.356 1.00 . A A . 5 CYS CB 1 1 8 5238 1 1 8 CYS H H -8.347 -2.518 -1.988 1.00 . A A . 5 CYS H 1 1 8 5239 1 1 8 CYS HA H -5.969 -1.307 -1.838 1.00 . A A . 5 CYS HA 1 1 8 5240 1 1 8 CYS HB2 H -6.691 -3.190 -0.478 1.00 . A A . 5 CYS HB2 1 1 8 5241 1 1 8 CYS HB3 H -6.447 -4.281 -1.829 1.00 . A A . 5 CYS HB3 1 1 8 5242 1 1 8 CYS N N -7.710 -2.105 -2.614 1.00 . A A . 5 CYS N 1 1 8 5243 1 1 8 CYS O O -5.668 -3.380 -4.327 1.00 . A A . 5 CYS O 1 1 8 5244 1 1 8 CYS SG S -4.402 -3.666 -0.811 1.00 . A A . 5 CYS SG 1 1 8 5245 1 1 9 GLY C C -2.800 -2.896 -5.060 1.00 . A A . 6 GLY C 1 1 8 5246 1 1 9 GLY CA C -3.617 -1.623 -4.945 1.00 . A A . 6 GLY CA 1 1 8 5247 1 1 9 GLY H H -4.294 -0.879 -3.079 1.00 . A A . 6 GLY H 1 1 8 5248 1 1 9 GLY HA2 H -4.248 -1.539 -5.814 1.00 . A A . 6 GLY HA2 1 1 8 5249 1 1 9 GLY HA3 H -2.943 -0.780 -4.926 1.00 . A A . 6 GLY HA3 1 1 8 5250 1 1 9 GLY N N -4.452 -1.575 -3.758 1.00 . A A . 6 GLY N 1 1 8 5251 1 1 9 GLY O O -2.338 -3.244 -6.148 1.00 . A A . 6 GLY O 1 1 8 5252 1 1 10 VAL C C -2.684 -6.062 -4.135 1.00 . A A . 7 VAL C 1 1 8 5253 1 1 10 VAL CA C -1.816 -4.813 -3.943 1.00 . A A . 7 VAL CA 1 1 8 5254 1 1 10 VAL CB C -0.985 -4.950 -2.650 1.00 . A A . 7 VAL CB 1 1 8 5255 1 1 10 VAL CG1 C -0.225 -6.266 -2.631 1.00 . A A . 7 VAL CG1 1 1 8 5256 1 1 10 VAL CG2 C -0.018 -3.784 -2.514 1.00 . A A . 7 VAL CG2 1 1 8 5257 1 1 10 VAL H H -3.005 -3.269 -3.109 1.00 . A A . 7 VAL H 1 1 8 5258 1 1 10 VAL HA H -1.129 -4.750 -4.773 1.00 . A A . 7 VAL HA 1 1 8 5259 1 1 10 VAL HB H -1.657 -4.933 -1.807 1.00 . A A . 7 VAL HB 1 1 8 5260 1 1 10 VAL HG11 H -0.927 -7.086 -2.658 1.00 . A A . 7 VAL HG11 1 1 8 5261 1 1 10 VAL HG12 H 0.366 -6.327 -1.730 1.00 . A A . 7 VAL HG12 1 1 8 5262 1 1 10 VAL HG13 H 0.423 -6.319 -3.491 1.00 . A A . 7 VAL HG13 1 1 8 5263 1 1 10 VAL HG21 H 0.626 -3.748 -3.381 1.00 . A A . 7 VAL HG21 1 1 8 5264 1 1 10 VAL HG22 H 0.586 -3.918 -1.625 1.00 . A A . 7 VAL HG22 1 1 8 5265 1 1 10 VAL HG23 H -0.573 -2.863 -2.438 1.00 . A A . 7 VAL HG23 1 1 8 5266 1 1 10 VAL N N -2.611 -3.591 -3.945 1.00 . A A . 7 VAL N 1 1 8 5267 1 1 10 VAL O O -2.568 -6.747 -5.150 1.00 . A A . 7 VAL O 1 1 8 5268 1 1 11 CYS C C -5.635 -7.411 -4.020 1.00 . A A . 8 CYS C 1 1 8 5269 1 1 11 CYS CA C -4.336 -7.597 -3.235 1.00 . A A . 8 CYS CA 1 1 8 5270 1 1 11 CYS CB C -4.626 -8.147 -1.831 1.00 . A A . 8 CYS CB 1 1 8 5271 1 1 11 CYS H H -3.693 -5.735 -2.437 1.00 . A A . 8 CYS H 1 1 8 5272 1 1 11 CYS HA H -3.730 -8.320 -3.763 1.00 . A A . 8 CYS HA 1 1 8 5273 1 1 11 CYS HB2 H -5.108 -9.107 -1.926 1.00 . A A . 8 CYS HB2 1 1 8 5274 1 1 11 CYS HB3 H -3.694 -8.274 -1.305 1.00 . A A . 8 CYS HB3 1 1 8 5275 1 1 11 CYS N N -3.562 -6.355 -3.178 1.00 . A A . 8 CYS N 1 1 8 5276 1 1 11 CYS O O -6.308 -8.382 -4.358 1.00 . A A . 8 CYS O 1 1 8 5277 1 1 11 CYS SG S -5.693 -7.108 -0.813 1.00 . A A . 8 CYS SG 1 1 8 5278 1 1 12 GLY C C -8.466 -6.072 -4.477 1.00 . A A . 9 GLY C 1 1 8 5279 1 1 12 GLY CA C -7.123 -5.869 -5.151 1.00 . A A . 9 GLY CA 1 1 8 5280 1 1 12 GLY H H -5.447 -5.423 -3.941 1.00 . A A . 9 GLY H 1 1 8 5281 1 1 12 GLY HA2 H -7.055 -4.841 -5.474 1.00 . A A . 9 GLY HA2 1 1 8 5282 1 1 12 GLY HA3 H -7.073 -6.506 -6.021 1.00 . A A . 9 GLY HA3 1 1 8 5283 1 1 12 GLY N N -5.981 -6.160 -4.300 1.00 . A A . 9 GLY N 1 1 8 5284 1 1 12 GLY O O -9.493 -6.121 -5.159 1.00 . A A . 9 GLY O 1 1 8 5285 1 1 13 ILE C C -9.873 -5.464 -1.266 1.00 . A A . 10 ILE C 1 1 8 5286 1 1 13 ILE CA C -9.730 -6.420 -2.443 1.00 . A A . 10 ILE CA 1 1 8 5287 1 1 13 ILE CB C -9.844 -7.892 -1.955 1.00 . A A . 10 ILE CB 1 1 8 5288 1 1 13 ILE CD1 C -9.026 -7.965 0.453 1.00 . A A . 10 ILE CD1 1 1 8 5289 1 1 13 ILE CG1 C -8.707 -8.253 -0.996 1.00 . A A . 10 ILE CG1 1 1 8 5290 1 1 13 ILE CG2 C -9.864 -8.853 -3.134 1.00 . A A . 10 ILE CG2 1 1 8 5291 1 1 13 ILE H H -7.653 -6.080 -2.637 1.00 . A A . 10 ILE H 1 1 8 5292 1 1 13 ILE HA H -10.539 -6.234 -3.135 1.00 . A A . 10 ILE HA 1 1 8 5293 1 1 13 ILE HB H -10.784 -7.993 -1.434 1.00 . A A . 10 ILE HB 1 1 8 5294 1 1 13 ILE HD11 H -9.326 -6.929 0.550 1.00 . A A . 10 ILE HD11 1 1 8 5295 1 1 13 ILE HD12 H -8.151 -8.148 1.060 1.00 . A A . 10 ILE HD12 1 1 8 5296 1 1 13 ILE HD13 H -9.832 -8.603 0.778 1.00 . A A . 10 ILE HD13 1 1 8 5297 1 1 13 ILE HG12 H -8.481 -9.305 -1.086 1.00 . A A . 10 ILE HG12 1 1 8 5298 1 1 13 ILE HG13 H -7.830 -7.682 -1.261 1.00 . A A . 10 ILE HG13 1 1 8 5299 1 1 13 ILE HG21 H -10.714 -8.633 -3.762 1.00 . A A . 10 ILE HG21 1 1 8 5300 1 1 13 ILE HG22 H -9.937 -9.866 -2.770 1.00 . A A . 10 ILE HG22 1 1 8 5301 1 1 13 ILE HG23 H -8.955 -8.740 -3.707 1.00 . A A . 10 ILE HG23 1 1 8 5302 1 1 13 ILE N N -8.484 -6.179 -3.151 1.00 . A A . 10 ILE N 1 1 8 5303 1 1 13 ILE O O -8.868 -4.968 -0.745 1.00 . A A . 10 ILE O 1 1 8 5304 1 1 14 LYS C C -10.942 -2.922 0.109 1.00 . A A . 11 LYS C 1 1 8 5305 1 1 14 LYS CA C -11.510 -4.341 0.239 1.00 . A A . 11 LYS CA 1 1 8 5306 1 1 14 LYS CB C -11.142 -4.965 1.599 1.00 . A A . 11 LYS CB 1 1 8 5307 1 1 14 LYS CD C -9.402 -5.469 3.350 1.00 . A A . 11 LYS CD 1 1 8 5308 1 1 14 LYS CE C -10.312 -5.040 4.491 1.00 . A A . 11 LYS CE 1 1 8 5309 1 1 14 LYS CG C -9.713 -4.715 2.063 1.00 . A A . 11 LYS CG 1 1 8 5310 1 1 14 LYS H H -11.852 -5.643 -1.388 1.00 . A A . 11 LYS H 1 1 8 5311 1 1 14 LYS HA H -12.585 -4.256 0.199 1.00 . A A . 11 LYS HA 1 1 8 5312 1 1 14 LYS HB2 H -11.807 -4.566 2.349 1.00 . A A . 11 LYS HB2 1 1 8 5313 1 1 14 LYS HB3 H -11.292 -6.033 1.538 1.00 . A A . 11 LYS HB3 1 1 8 5314 1 1 14 LYS HD2 H -9.537 -6.525 3.176 1.00 . A A . 11 LYS HD2 1 1 8 5315 1 1 14 LYS HD3 H -8.377 -5.278 3.628 1.00 . A A . 11 LYS HD3 1 1 8 5316 1 1 14 LYS HE2 H -11.336 -5.228 4.209 1.00 . A A . 11 LYS HE2 1 1 8 5317 1 1 14 LYS HE3 H -10.068 -5.626 5.365 1.00 . A A . 11 LYS HE3 1 1 8 5318 1 1 14 LYS HG2 H -9.031 -5.043 1.293 1.00 . A A . 11 LYS HG2 1 1 8 5319 1 1 14 LYS HG3 H -9.582 -3.657 2.236 1.00 . A A . 11 LYS HG3 1 1 8 5320 1 1 14 LYS HZ1 H -10.793 -3.343 5.603 1.00 . A A . 11 LYS HZ1 1 1 8 5321 1 1 14 LYS HZ2 H -10.399 -3.014 3.996 1.00 . A A . 11 LYS HZ2 1 1 8 5322 1 1 14 LYS HZ3 H -9.181 -3.396 5.104 1.00 . A A . 11 LYS HZ3 1 1 8 5323 1 1 14 LYS N N -11.128 -5.216 -0.884 1.00 . A A . 11 LYS N 1 1 8 5324 1 1 14 LYS NZ N -10.161 -3.598 4.819 1.00 . A A . 11 LYS NZ 1 1 8 5325 1 1 14 LYS O O -10.091 -2.635 -0.738 1.00 . A A . 11 LYS O 1 1 8 5326 1 1 15 GLU C C -9.619 -0.454 1.405 1.00 . A A . 12 GLU C 1 1 8 5327 1 1 15 GLU CA C -11.038 -0.630 0.903 1.00 . A A . 12 GLU CA 1 1 8 5328 1 1 15 GLU CB C -11.976 0.245 1.735 1.00 . A A . 12 GLU CB 1 1 8 5329 1 1 15 GLU CD C -14.154 -0.784 0.968 1.00 . A A . 12 GLU CD 1 1 8 5330 1 1 15 GLU CG C -13.334 0.481 1.099 1.00 . A A . 12 GLU CG 1 1 8 5331 1 1 15 GLU H H -12.093 -2.313 1.622 1.00 . A A . 12 GLU H 1 1 8 5332 1 1 15 GLU HA H -11.082 -0.308 -0.127 1.00 . A A . 12 GLU HA 1 1 8 5333 1 1 15 GLU HB2 H -12.132 -0.226 2.691 1.00 . A A . 12 GLU HB2 1 1 8 5334 1 1 15 GLU HB3 H -11.506 1.205 1.889 1.00 . A A . 12 GLU HB3 1 1 8 5335 1 1 15 GLU HG2 H -13.882 1.186 1.703 1.00 . A A . 12 GLU HG2 1 1 8 5336 1 1 15 GLU HG3 H -13.180 0.898 0.114 1.00 . A A . 12 GLU HG3 1 1 8 5337 1 1 15 GLU N N -11.440 -2.026 0.949 1.00 . A A . 12 GLU N 1 1 8 5338 1 1 15 GLU O O -9.112 -1.260 2.192 1.00 . A A . 12 GLU O 1 1 8 5339 1 1 15 GLU OE1 O -14.391 -1.454 1.994 1.00 . A A . 12 GLU OE1 1 1 8 5340 1 1 15 GLU OE2 O -14.557 -1.120 -0.164 1.00 . A A . 12 GLU OE2 1 1 8 5341 1 1 16 PHE C C -7.654 1.524 2.761 1.00 . A A . 13 PHE C 1 1 8 5342 1 1 16 PHE CA C -7.640 0.937 1.357 1.00 . A A . 13 PHE CA 1 1 8 5343 1 1 16 PHE CB C -7.005 1.926 0.377 1.00 . A A . 13 PHE CB 1 1 8 5344 1 1 16 PHE CD1 C -8.567 3.850 -0.097 1.00 . A A . 13 PHE CD1 1 1 8 5345 1 1 16 PHE CD2 C -6.723 4.220 1.371 1.00 . A A . 13 PHE CD2 1 1 8 5346 1 1 16 PHE CE1 C -8.964 5.160 0.064 1.00 . A A . 13 PHE CE1 1 1 8 5347 1 1 16 PHE CE2 C -7.119 5.533 1.539 1.00 . A A . 13 PHE CE2 1 1 8 5348 1 1 16 PHE CG C -7.443 3.362 0.554 1.00 . A A . 13 PHE CG 1 1 8 5349 1 1 16 PHE CZ C -8.242 6.003 0.886 1.00 . A A . 13 PHE CZ 1 1 8 5350 1 1 16 PHE H H -9.439 1.174 0.277 1.00 . A A . 13 PHE H 1 1 8 5351 1 1 16 PHE HA H -7.059 0.027 1.366 1.00 . A A . 13 PHE HA 1 1 8 5352 1 1 16 PHE HB2 H -5.936 1.893 0.476 1.00 . A A . 13 PHE HB2 1 1 8 5353 1 1 16 PHE HB3 H -7.266 1.624 -0.622 1.00 . A A . 13 PHE HB3 1 1 8 5354 1 1 16 PHE HD1 H -9.130 3.192 -0.759 1.00 . A A . 13 PHE HD1 1 1 8 5355 1 1 16 PHE HD2 H -5.843 3.851 1.881 1.00 . A A . 13 PHE HD2 1 1 8 5356 1 1 16 PHE HE1 H -9.843 5.524 -0.450 1.00 . A A . 13 PHE HE1 1 1 8 5357 1 1 16 PHE HE2 H -6.545 6.194 2.173 1.00 . A A . 13 PHE HE2 1 1 8 5358 1 1 16 PHE HZ H -8.553 7.029 1.017 1.00 . A A . 13 PHE HZ 1 1 8 5359 1 1 16 PHE N N -8.986 0.605 0.936 1.00 . A A . 13 PHE N 1 1 8 5360 1 1 16 PHE O O -8.664 2.075 3.211 1.00 . A A . 13 PHE O 1 1 8 5361 1 1 17 LYS C C -5.080 2.734 4.860 1.00 . A A . 14 LYS C 1 1 8 5362 1 1 17 LYS CA C -6.384 1.953 4.772 1.00 . A A . 14 LYS CA 1 1 8 5363 1 1 17 LYS CB C -6.421 0.824 5.807 1.00 . A A . 14 LYS CB 1 1 8 5364 1 1 17 LYS CD C -6.552 0.150 8.223 1.00 . A A . 14 LYS CD 1 1 8 5365 1 1 17 LYS CE C -6.563 0.639 9.662 1.00 . A A . 14 LYS CE 1 1 8 5366 1 1 17 LYS CG C -6.365 1.299 7.247 1.00 . A A . 14 LYS CG 1 1 8 5367 1 1 17 LYS H H -5.783 0.911 3.042 1.00 . A A . 14 LYS H 1 1 8 5368 1 1 17 LYS HA H -7.208 2.625 4.948 1.00 . A A . 14 LYS HA 1 1 8 5369 1 1 17 LYS HB2 H -7.333 0.263 5.673 1.00 . A A . 14 LYS HB2 1 1 8 5370 1 1 17 LYS HB3 H -5.580 0.170 5.632 1.00 . A A . 14 LYS HB3 1 1 8 5371 1 1 17 LYS HD2 H -7.493 -0.339 8.014 1.00 . A A . 14 LYS HD2 1 1 8 5372 1 1 17 LYS HD3 H -5.744 -0.555 8.097 1.00 . A A . 14 LYS HD3 1 1 8 5373 1 1 17 LYS HE2 H -7.349 1.368 9.773 1.00 . A A . 14 LYS HE2 1 1 8 5374 1 1 17 LYS HE3 H -6.760 -0.201 10.311 1.00 . A A . 14 LYS HE3 1 1 8 5375 1 1 17 LYS HG2 H -5.402 1.751 7.426 1.00 . A A . 14 LYS HG2 1 1 8 5376 1 1 17 LYS HG3 H -7.145 2.028 7.407 1.00 . A A . 14 LYS HG3 1 1 8 5377 1 1 17 LYS HZ1 H -5.351 1.687 11.002 1.00 . A A . 14 LYS HZ1 1 1 8 5378 1 1 17 LYS HZ2 H -5.008 2.003 9.379 1.00 . A A . 14 LYS HZ2 1 1 8 5379 1 1 17 LYS HZ3 H -4.518 0.545 10.077 1.00 . A A . 14 LYS HZ3 1 1 8 5380 1 1 17 LYS N N -6.535 1.400 3.444 1.00 . A A . 14 LYS N 1 1 8 5381 1 1 17 LYS NZ N -5.271 1.262 10.055 1.00 . A A . 14 LYS NZ 1 1 8 5382 1 1 17 LYS O O -4.943 3.656 5.664 1.00 . A A . 14 LYS O 1 1 8 5383 1 1 18 TYR C C -2.571 3.600 2.604 1.00 . A A . 15 TYR C 1 1 8 5384 1 1 18 TYR CA C -2.829 3.002 3.975 1.00 . A A . 15 TYR CA 1 1 8 5385 1 1 18 TYR CB C -1.727 1.990 4.293 1.00 . A A . 15 TYR CB 1 1 8 5386 1 1 18 TYR CD1 C -2.821 0.504 5.996 1.00 . A A . 15 TYR CD1 1 1 8 5387 1 1 18 TYR CD2 C -0.879 1.712 6.646 1.00 . A A . 15 TYR CD2 1 1 8 5388 1 1 18 TYR CE1 C -2.905 -0.051 7.254 1.00 . A A . 15 TYR CE1 1 1 8 5389 1 1 18 TYR CE2 C -0.954 1.161 7.909 1.00 . A A . 15 TYR CE2 1 1 8 5390 1 1 18 TYR CG C -1.812 1.392 5.672 1.00 . A A . 15 TYR CG 1 1 8 5391 1 1 18 TYR CZ C -1.969 0.281 8.207 1.00 . A A . 15 TYR CZ 1 1 8 5392 1 1 18 TYR H H -4.324 1.651 3.364 1.00 . A A . 15 TYR H 1 1 8 5393 1 1 18 TYR HA H -2.816 3.787 4.715 1.00 . A A . 15 TYR HA 1 1 8 5394 1 1 18 TYR HB2 H -1.784 1.179 3.582 1.00 . A A . 15 TYR HB2 1 1 8 5395 1 1 18 TYR HB3 H -0.767 2.476 4.199 1.00 . A A . 15 TYR HB3 1 1 8 5396 1 1 18 TYR HD1 H -3.554 0.249 5.243 1.00 . A A . 15 TYR HD1 1 1 8 5397 1 1 18 TYR HD2 H -0.084 2.402 6.405 1.00 . A A . 15 TYR HD2 1 1 8 5398 1 1 18 TYR HE1 H -3.700 -0.742 7.485 1.00 . A A . 15 TYR HE1 1 1 8 5399 1 1 18 TYR HE2 H -0.220 1.420 8.655 1.00 . A A . 15 TYR HE2 1 1 8 5400 1 1 18 TYR HH H -1.761 0.376 10.117 1.00 . A A . 15 TYR HH 1 1 8 5401 1 1 18 TYR N N -4.135 2.368 4.006 1.00 . A A . 15 TYR N 1 1 8 5402 1 1 18 TYR O O -3.413 3.513 1.709 1.00 . A A . 15 TYR O 1 1 8 5403 1 1 18 TYR OH O -2.046 -0.274 9.462 1.00 . A A . 15 TYR OH 1 1 8 5404 1 1 19 LYS C C 0.493 5.032 1.190 1.00 . A A . 16 LYS C 1 1 8 5405 1 1 19 LYS CA C -1.011 4.806 1.192 1.00 . A A . 16 LYS CA 1 1 8 5406 1 1 19 LYS CB C -1.756 6.132 1.034 1.00 . A A . 16 LYS CB 1 1 8 5407 1 1 19 LYS CD C -2.765 7.819 -0.491 1.00 . A A . 16 LYS CD 1 1 8 5408 1 1 19 LYS CE C -3.030 8.190 -1.937 1.00 . A A . 16 LYS CE 1 1 8 5409 1 1 19 LYS CG C -1.754 6.695 -0.376 1.00 . A A . 16 LYS CG 1 1 8 5410 1 1 19 LYS H H -0.761 4.188 3.190 1.00 . A A . 16 LYS H 1 1 8 5411 1 1 19 LYS HA H -1.276 4.142 0.383 1.00 . A A . 16 LYS HA 1 1 8 5412 1 1 19 LYS HB2 H -2.784 5.987 1.332 1.00 . A A . 16 LYS HB2 1 1 8 5413 1 1 19 LYS HB3 H -1.304 6.862 1.688 1.00 . A A . 16 LYS HB3 1 1 8 5414 1 1 19 LYS HD2 H -3.692 7.503 -0.039 1.00 . A A . 16 LYS HD2 1 1 8 5415 1 1 19 LYS HD3 H -2.386 8.687 0.030 1.00 . A A . 16 LYS HD3 1 1 8 5416 1 1 19 LYS HE2 H -3.282 7.294 -2.480 1.00 . A A . 16 LYS HE2 1 1 8 5417 1 1 19 LYS HE3 H -3.862 8.875 -1.970 1.00 . A A . 16 LYS HE3 1 1 8 5418 1 1 19 LYS HG2 H -0.769 7.078 -0.606 1.00 . A A . 16 LYS HG2 1 1 8 5419 1 1 19 LYS HG3 H -2.013 5.912 -1.074 1.00 . A A . 16 LYS HG3 1 1 8 5420 1 1 19 LYS HZ1 H -1.035 8.189 -2.541 1.00 . A A . 16 LYS HZ1 1 1 8 5421 1 1 19 LYS HZ2 H -1.605 9.709 -2.081 1.00 . A A . 16 LYS HZ2 1 1 8 5422 1 1 19 LYS HZ3 H -2.062 9.050 -3.570 1.00 . A A . 16 LYS HZ3 1 1 8 5423 1 1 19 LYS N N -1.395 4.180 2.442 1.00 . A A . 16 LYS N 1 1 8 5424 1 1 19 LYS NZ N -1.849 8.826 -2.576 1.00 . A A . 16 LYS NZ 1 1 8 5425 1 1 19 LYS O O 0.976 6.008 1.765 1.00 . A A . 16 LYS O 1 1 8 5426 1 1 20 CYS C C 3.171 5.553 0.104 1.00 . A A . 17 CYS C 1 1 8 5427 1 1 20 CYS CA C 2.686 4.175 0.544 1.00 . A A . 17 CYS CA 1 1 8 5428 1 1 20 CYS CB C 3.284 3.111 -0.384 1.00 . A A . 17 CYS CB 1 1 8 5429 1 1 20 CYS H H 0.772 3.352 0.137 1.00 . A A . 17 CYS H 1 1 8 5430 1 1 20 CYS HA H 3.036 3.995 1.547 1.00 . A A . 17 CYS HA 1 1 8 5431 1 1 20 CYS HB2 H 3.027 2.130 -0.014 1.00 . A A . 17 CYS HB2 1 1 8 5432 1 1 20 CYS HB3 H 2.885 3.239 -1.377 1.00 . A A . 17 CYS HB3 1 1 8 5433 1 1 20 CYS N N 1.227 4.106 0.573 1.00 . A A . 17 CYS N 1 1 8 5434 1 1 20 CYS O O 2.778 6.050 -0.947 1.00 . A A . 17 CYS O 1 1 8 5435 1 1 20 CYS SG S 5.088 3.223 -0.486 1.00 . A A . 17 CYS SG 1 1 8 5436 1 1 21 PRO C C 5.441 7.524 -0.660 1.00 . A A . 18 PRO C 1 1 8 5437 1 1 21 PRO CA C 4.597 7.504 0.616 1.00 . A A . 18 PRO CA 1 1 8 5438 1 1 21 PRO CB C 5.470 7.811 1.838 1.00 . A A . 18 PRO CB 1 1 8 5439 1 1 21 PRO CD C 4.545 5.640 2.188 1.00 . A A . 18 PRO CD 1 1 8 5440 1 1 21 PRO CG C 5.746 6.492 2.467 1.00 . A A . 18 PRO CG 1 1 8 5441 1 1 21 PRO HA H 3.815 8.245 0.536 1.00 . A A . 18 PRO HA 1 1 8 5442 1 1 21 PRO HB2 H 6.385 8.289 1.517 1.00 . A A . 18 PRO HB2 1 1 8 5443 1 1 21 PRO HB3 H 4.935 8.464 2.512 1.00 . A A . 18 PRO HB3 1 1 8 5444 1 1 21 PRO HD2 H 4.833 4.604 2.088 1.00 . A A . 18 PRO HD2 1 1 8 5445 1 1 21 PRO HD3 H 3.808 5.755 2.969 1.00 . A A . 18 PRO HD3 1 1 8 5446 1 1 21 PRO HG2 H 6.627 6.055 2.021 1.00 . A A . 18 PRO HG2 1 1 8 5447 1 1 21 PRO HG3 H 5.882 6.614 3.531 1.00 . A A . 18 PRO HG3 1 1 8 5448 1 1 21 PRO N N 4.043 6.176 0.910 1.00 . A A . 18 PRO N 1 1 8 5449 1 1 21 PRO O O 5.726 8.588 -1.212 1.00 . A A . 18 PRO O 1 1 8 5450 1 1 22 ARG C C 5.775 5.751 -3.513 1.00 . A A . 19 ARG C 1 1 8 5451 1 1 22 ARG CA C 6.629 6.238 -2.345 1.00 . A A . 19 ARG CA 1 1 8 5452 1 1 22 ARG CB C 7.820 5.296 -2.154 1.00 . A A . 19 ARG CB 1 1 8 5453 1 1 22 ARG CD C 10.229 5.055 -1.456 1.00 . A A . 19 ARG CD 1 1 8 5454 1 1 22 ARG CG C 8.961 5.895 -1.344 1.00 . A A . 19 ARG CG 1 1 8 5455 1 1 22 ARG CZ C 11.859 4.601 -3.271 1.00 . A A . 19 ARG CZ 1 1 8 5456 1 1 22 ARG H H 5.611 5.535 -0.623 1.00 . A A . 19 ARG H 1 1 8 5457 1 1 22 ARG HA H 7.002 7.223 -2.582 1.00 . A A . 19 ARG HA 1 1 8 5458 1 1 22 ARG HB2 H 7.476 4.406 -1.646 1.00 . A A . 19 ARG HB2 1 1 8 5459 1 1 22 ARG HB3 H 8.200 5.017 -3.124 1.00 . A A . 19 ARG HB3 1 1 8 5460 1 1 22 ARG HD2 H 11.032 5.567 -0.946 1.00 . A A . 19 ARG HD2 1 1 8 5461 1 1 22 ARG HD3 H 10.054 4.098 -0.986 1.00 . A A . 19 ARG HD3 1 1 8 5462 1 1 22 ARG HE H 9.895 4.857 -3.523 1.00 . A A . 19 ARG HE 1 1 8 5463 1 1 22 ARG HG2 H 9.166 6.890 -1.709 1.00 . A A . 19 ARG HG2 1 1 8 5464 1 1 22 ARG HG3 H 8.664 5.944 -0.305 1.00 . A A . 19 ARG HG3 1 1 8 5465 1 1 22 ARG HH11 H 12.727 4.728 -1.441 1.00 . A A . 19 ARG HH11 1 1 8 5466 1 1 22 ARG HH12 H 13.803 4.388 -2.755 1.00 . A A . 19 ARG HH12 1 1 8 5467 1 1 22 ARG HH21 H 11.325 4.404 -5.213 1.00 . A A . 19 ARG HH21 1 1 8 5468 1 1 22 ARG HH22 H 13.017 4.209 -4.884 1.00 . A A . 19 ARG HH22 1 1 8 5469 1 1 22 ARG N N 5.846 6.347 -1.120 1.00 . A A . 19 ARG N 1 1 8 5470 1 1 22 ARG NE N 10.615 4.838 -2.851 1.00 . A A . 19 ARG NE 1 1 8 5471 1 1 22 ARG NH1 N 12.876 4.571 -2.420 1.00 . A A . 19 ARG NH1 1 1 8 5472 1 1 22 ARG NH2 N 12.084 4.389 -4.559 1.00 . A A . 19 ARG NH2 1 1 8 5473 1 1 22 ARG O O 5.810 6.325 -4.598 1.00 . A A . 19 ARG O 1 1 8 5474 1 1 23 CYS C C 2.902 4.773 -4.589 1.00 . A A . 20 CYS C 1 1 8 5475 1 1 23 CYS CA C 4.236 4.080 -4.369 1.00 . A A . 20 CYS CA 1 1 8 5476 1 1 23 CYS CB C 3.971 2.602 -4.074 1.00 . A A . 20 CYS CB 1 1 8 5477 1 1 23 CYS H H 4.922 4.345 -2.377 1.00 . A A . 20 CYS H 1 1 8 5478 1 1 23 CYS HA H 4.818 4.163 -5.269 1.00 . A A . 20 CYS HA 1 1 8 5479 1 1 23 CYS HB2 H 3.401 2.528 -3.164 1.00 . A A . 20 CYS HB2 1 1 8 5480 1 1 23 CYS HB3 H 3.394 2.186 -4.884 1.00 . A A . 20 CYS HB3 1 1 8 5481 1 1 23 CYS N N 4.996 4.701 -3.286 1.00 . A A . 20 CYS N 1 1 8 5482 1 1 23 CYS O O 2.326 4.707 -5.674 1.00 . A A . 20 CYS O 1 1 8 5483 1 1 23 CYS SG S 5.441 1.581 -3.872 1.00 . A A . 20 CYS SG 1 1 8 5484 1 1 24 LEU C C 0.024 4.916 -3.613 1.00 . A A . 21 LEU C 1 1 8 5485 1 1 24 LEU CA C 1.081 6.003 -3.502 1.00 . A A . 21 LEU CA 1 1 8 5486 1 1 24 LEU CB C 0.880 7.048 -4.605 1.00 . A A . 21 LEU CB 1 1 8 5487 1 1 24 LEU CD1 C 1.300 9.400 -5.318 1.00 . A A . 21 LEU CD1 1 1 8 5488 1 1 24 LEU CD2 C 2.336 8.545 -3.212 1.00 . A A . 21 LEU CD2 1 1 8 5489 1 1 24 LEU CG C 1.894 8.192 -4.622 1.00 . A A . 21 LEU CG 1 1 8 5490 1 1 24 LEU H H 2.992 5.521 -2.743 1.00 . A A . 21 LEU H 1 1 8 5491 1 1 24 LEU HA H 0.965 6.487 -2.543 1.00 . A A . 21 LEU HA 1 1 8 5492 1 1 24 LEU HB2 H 0.925 6.543 -5.560 1.00 . A A . 21 LEU HB2 1 1 8 5493 1 1 24 LEU HB3 H -0.105 7.474 -4.490 1.00 . A A . 21 LEU HB3 1 1 8 5494 1 1 24 LEU HD11 H 0.401 9.702 -4.798 1.00 . A A . 21 LEU HD11 1 1 8 5495 1 1 24 LEU HD12 H 1.057 9.143 -6.339 1.00 . A A . 21 LEU HD12 1 1 8 5496 1 1 24 LEU HD13 H 2.012 10.209 -5.308 1.00 . A A . 21 LEU HD13 1 1 8 5497 1 1 24 LEU HD21 H 2.868 7.705 -2.785 1.00 . A A . 21 LEU HD21 1 1 8 5498 1 1 24 LEU HD22 H 1.467 8.765 -2.609 1.00 . A A . 21 LEU HD22 1 1 8 5499 1 1 24 LEU HD23 H 2.983 9.407 -3.241 1.00 . A A . 21 LEU HD23 1 1 8 5500 1 1 24 LEU HG H 2.767 7.882 -5.180 1.00 . A A . 21 LEU HG 1 1 8 5501 1 1 24 LEU N N 2.419 5.419 -3.535 1.00 . A A . 21 LEU N 1 1 8 5502 1 1 24 LEU O O -1.155 5.198 -3.834 1.00 . A A . 21 LEU O 1 1 8 5503 1 1 25 VAL C C -1.257 2.476 -2.238 1.00 . A A . 22 VAL C 1 1 8 5504 1 1 25 VAL CA C -0.430 2.537 -3.509 1.00 . A A . 22 VAL CA 1 1 8 5505 1 1 25 VAL CB C 0.332 1.200 -3.742 1.00 . A A . 22 VAL CB 1 1 8 5506 1 1 25 VAL CG1 C 1.260 0.857 -2.583 1.00 . A A . 22 VAL CG1 1 1 8 5507 1 1 25 VAL CG2 C -0.644 0.063 -3.997 1.00 . A A . 22 VAL CG2 1 1 8 5508 1 1 25 VAL H H 1.404 3.521 -3.280 1.00 . A A . 22 VAL H 1 1 8 5509 1 1 25 VAL HA H -1.098 2.692 -4.344 1.00 . A A . 22 VAL HA 1 1 8 5510 1 1 25 VAL HB H 0.941 1.317 -4.627 1.00 . A A . 22 VAL HB 1 1 8 5511 1 1 25 VAL HG11 H 0.670 0.628 -1.710 1.00 . A A . 22 VAL HG11 1 1 8 5512 1 1 25 VAL HG12 H 1.897 1.699 -2.372 1.00 . A A . 22 VAL HG12 1 1 8 5513 1 1 25 VAL HG13 H 1.868 0.001 -2.845 1.00 . A A . 22 VAL HG13 1 1 8 5514 1 1 25 VAL HG21 H -0.098 -0.860 -4.122 1.00 . A A . 22 VAL HG21 1 1 8 5515 1 1 25 VAL HG22 H -1.209 0.271 -4.894 1.00 . A A . 22 VAL HG22 1 1 8 5516 1 1 25 VAL HG23 H -1.319 -0.028 -3.159 1.00 . A A . 22 VAL HG23 1 1 8 5517 1 1 25 VAL N N 0.461 3.671 -3.449 1.00 . A A . 22 VAL N 1 1 8 5518 1 1 25 VAL O O -0.726 2.437 -1.122 1.00 . A A . 22 VAL O 1 1 8 5519 1 1 26 GLN C C -3.668 1.045 -0.872 1.00 . A A . 23 GLN C 1 1 8 5520 1 1 26 GLN CA C -3.483 2.488 -1.312 1.00 . A A . 23 GLN CA 1 1 8 5521 1 1 26 GLN CB C -4.809 3.126 -1.719 1.00 . A A . 23 GLN CB 1 1 8 5522 1 1 26 GLN CD C -5.971 5.217 -2.555 1.00 . A A . 23 GLN CD 1 1 8 5523 1 1 26 GLN CG C -4.648 4.539 -2.254 1.00 . A A . 23 GLN CG 1 1 8 5524 1 1 26 GLN H H -2.900 2.618 -3.330 1.00 . A A . 23 GLN H 1 1 8 5525 1 1 26 GLN HA H -3.057 3.047 -0.490 1.00 . A A . 23 GLN HA 1 1 8 5526 1 1 26 GLN HB2 H -5.270 2.520 -2.486 1.00 . A A . 23 GLN HB2 1 1 8 5527 1 1 26 GLN HB3 H -5.459 3.163 -0.860 1.00 . A A . 23 GLN HB3 1 1 8 5528 1 1 26 GLN HE21 H -6.044 4.368 -4.348 1.00 . A A . 23 GLN HE21 1 1 8 5529 1 1 26 GLN HE22 H -7.382 5.387 -3.940 1.00 . A A . 23 GLN HE22 1 1 8 5530 1 1 26 GLN HG2 H -4.128 5.124 -1.510 1.00 . A A . 23 GLN HG2 1 1 8 5531 1 1 26 GLN HG3 H -4.059 4.500 -3.157 1.00 . A A . 23 GLN HG3 1 1 8 5532 1 1 26 GLN N N -2.554 2.538 -2.417 1.00 . A A . 23 GLN N 1 1 8 5533 1 1 26 GLN NE2 N -6.517 4.968 -3.734 1.00 . A A . 23 GLN NE2 1 1 8 5534 1 1 26 GLN O O -4.420 0.278 -1.478 1.00 . A A . 23 GLN O 1 1 8 5535 1 1 26 GLN OE1 O -6.506 5.947 -1.725 1.00 . A A . 23 GLN OE1 1 1 8 5536 1 1 27 THR C C -4.005 -0.860 1.740 1.00 . A A . 24 THR C 1 1 8 5537 1 1 27 THR CA C -2.941 -0.681 0.668 1.00 . A A . 24 THR CA 1 1 8 5538 1 1 27 THR CB C -1.560 -1.053 1.239 1.00 . A A . 24 THR CB 1 1 8 5539 1 1 27 THR CG2 C -0.574 -1.346 0.121 1.00 . A A . 24 THR CG2 1 1 8 5540 1 1 27 THR H H -2.377 1.348 0.608 1.00 . A A . 24 THR H 1 1 8 5541 1 1 27 THR HA H -3.159 -1.344 -0.157 1.00 . A A . 24 THR HA 1 1 8 5542 1 1 27 THR HB H -1.665 -1.939 1.848 1.00 . A A . 24 THR HB 1 1 8 5543 1 1 27 THR HG1 H -0.553 -0.347 2.783 1.00 . A A . 24 THR HG1 1 1 8 5544 1 1 27 THR HG21 H -0.925 -2.189 -0.454 1.00 . A A . 24 THR HG21 1 1 8 5545 1 1 27 THR HG22 H 0.392 -1.577 0.545 1.00 . A A . 24 THR HG22 1 1 8 5546 1 1 27 THR HG23 H -0.489 -0.482 -0.520 1.00 . A A . 24 THR HG23 1 1 8 5547 1 1 27 THR N N -2.936 0.677 0.162 1.00 . A A . 24 THR N 1 1 8 5548 1 1 27 THR O O -4.394 0.091 2.417 1.00 . A A . 24 THR O 1 1 8 5549 1 1 27 THR OG1 O -1.063 0.015 2.051 1.00 . A A . 24 THR OG1 1 1 8 5550 1 1 28 CYS C C -4.969 -2.634 4.213 1.00 . A A . 25 CYS C 1 1 8 5551 1 1 28 CYS CA C -5.540 -2.398 2.818 1.00 . A A . 25 CYS CA 1 1 8 5552 1 1 28 CYS CB C -6.314 -3.632 2.338 1.00 . A A . 25 CYS CB 1 1 8 5553 1 1 28 CYS H H -4.102 -2.803 1.331 1.00 . A A . 25 CYS H 1 1 8 5554 1 1 28 CYS HA H -6.210 -1.552 2.852 1.00 . A A . 25 CYS HA 1 1 8 5555 1 1 28 CYS HB2 H -7.207 -3.750 2.924 1.00 . A A . 25 CYS HB2 1 1 8 5556 1 1 28 CYS HB3 H -6.591 -3.486 1.309 1.00 . A A . 25 CYS HB3 1 1 8 5557 1 1 28 CYS N N -4.476 -2.087 1.880 1.00 . A A . 25 CYS N 1 1 8 5558 1 1 28 CYS O O -5.693 -2.573 5.205 1.00 . A A . 25 CYS O 1 1 8 5559 1 1 28 CYS SG S -5.381 -5.174 2.435 1.00 . A A . 25 CYS SG 1 1 8 5560 1 1 29 SER C C -1.512 -3.014 5.442 1.00 . A A . 26 SER C 1 1 8 5561 1 1 29 SER CA C -3.020 -3.167 5.559 1.00 . A A . 26 SER CA 1 1 8 5562 1 1 29 SER CB C -3.350 -4.588 6.022 1.00 . A A . 26 SER CB 1 1 8 5563 1 1 29 SER H H -3.129 -2.907 3.464 1.00 . A A . 26 SER H 1 1 8 5564 1 1 29 SER HA H -3.393 -2.460 6.283 1.00 . A A . 26 SER HA 1 1 8 5565 1 1 29 SER HB2 H -2.822 -4.800 6.938 1.00 . A A . 26 SER HB2 1 1 8 5566 1 1 29 SER HB3 H -4.408 -4.673 6.187 1.00 . A A . 26 SER HB3 1 1 8 5567 1 1 29 SER HG H -3.692 -6.153 4.892 1.00 . A A . 26 SER HG 1 1 8 5568 1 1 29 SER N N -3.667 -2.896 4.285 1.00 . A A . 26 SER N 1 1 8 5569 1 1 29 SER O O -0.992 -2.745 4.353 1.00 . A A . 26 SER O 1 1 8 5570 1 1 29 SER OG O -2.965 -5.538 5.040 1.00 . A A . 26 SER OG 1 1 8 5571 1 1 30 LEU C C 1.130 -4.483 5.833 1.00 . A A . 27 LEU C 1 1 8 5572 1 1 30 LEU CA C 0.639 -3.234 6.553 1.00 . A A . 27 LEU CA 1 1 8 5573 1 1 30 LEU CB C 1.188 -3.212 7.978 1.00 . A A . 27 LEU CB 1 1 8 5574 1 1 30 LEU CD1 C 1.411 -2.059 10.184 1.00 . A A . 27 LEU CD1 1 1 8 5575 1 1 30 LEU CD2 C 1.835 -0.793 8.076 1.00 . A A . 27 LEU CD2 1 1 8 5576 1 1 30 LEU CG C 1.011 -1.894 8.729 1.00 . A A . 27 LEU CG 1 1 8 5577 1 1 30 LEU H H -1.292 -3.331 7.408 1.00 . A A . 27 LEU H 1 1 8 5578 1 1 30 LEU HA H 0.988 -2.360 6.023 1.00 . A A . 27 LEU HA 1 1 8 5579 1 1 30 LEU HB2 H 0.695 -3.992 8.541 1.00 . A A . 27 LEU HB2 1 1 8 5580 1 1 30 LEU HB3 H 2.242 -3.438 7.937 1.00 . A A . 27 LEU HB3 1 1 8 5581 1 1 30 LEU HD11 H 0.811 -2.835 10.636 1.00 . A A . 27 LEU HD11 1 1 8 5582 1 1 30 LEU HD12 H 1.253 -1.131 10.709 1.00 . A A . 27 LEU HD12 1 1 8 5583 1 1 30 LEU HD13 H 2.454 -2.333 10.240 1.00 . A A . 27 LEU HD13 1 1 8 5584 1 1 30 LEU HD21 H 2.875 -1.080 8.065 1.00 . A A . 27 LEU HD21 1 1 8 5585 1 1 30 LEU HD22 H 1.721 0.122 8.638 1.00 . A A . 27 LEU HD22 1 1 8 5586 1 1 30 LEU HD23 H 1.492 -0.637 7.064 1.00 . A A . 27 LEU HD23 1 1 8 5587 1 1 30 LEU HG H -0.029 -1.602 8.698 1.00 . A A . 27 LEU HG 1 1 8 5588 1 1 30 LEU N N -0.815 -3.206 6.557 1.00 . A A . 27 LEU N 1 1 8 5589 1 1 30 LEU O O 2.255 -4.530 5.334 1.00 . A A . 27 LEU O 1 1 8 5590 1 1 31 GLU C C 0.836 -6.467 3.620 1.00 . A A . 28 GLU C 1 1 8 5591 1 1 31 GLU CA C 0.569 -6.737 5.096 1.00 . A A . 28 GLU CA 1 1 8 5592 1 1 31 GLU CB C -0.602 -7.713 5.238 1.00 . A A . 28 GLU CB 1 1 8 5593 1 1 31 GLU CD C 0.649 -9.825 5.785 1.00 . A A . 28 GLU CD 1 1 8 5594 1 1 31 GLU CG C -0.276 -9.133 4.809 1.00 . A A . 28 GLU CG 1 1 8 5595 1 1 31 GLU H H -0.610 -5.386 6.212 1.00 . A A . 28 GLU H 1 1 8 5596 1 1 31 GLU HA H 1.452 -7.165 5.546 1.00 . A A . 28 GLU HA 1 1 8 5597 1 1 31 GLU HB2 H -0.912 -7.737 6.272 1.00 . A A . 28 GLU HB2 1 1 8 5598 1 1 31 GLU HB3 H -1.424 -7.360 4.634 1.00 . A A . 28 GLU HB3 1 1 8 5599 1 1 31 GLU HG2 H -1.194 -9.698 4.742 1.00 . A A . 28 GLU HG2 1 1 8 5600 1 1 31 GLU HG3 H 0.200 -9.105 3.841 1.00 . A A . 28 GLU HG3 1 1 8 5601 1 1 31 GLU N N 0.264 -5.489 5.778 1.00 . A A . 28 GLU N 1 1 8 5602 1 1 31 GLU O O 1.779 -6.997 3.034 1.00 . A A . 28 GLU O 1 1 8 5603 1 1 31 GLU OE1 O 0.155 -10.345 6.806 1.00 . A A . 28 GLU OE1 1 1 8 5604 1 1 31 GLU OE2 O 1.875 -9.837 5.548 1.00 . A A . 28 GLU OE2 1 1 8 5605 1 1 32 CYS C C 1.153 -4.203 1.369 1.00 . A A . 29 CYS C 1 1 8 5606 1 1 32 CYS CA C 0.126 -5.299 1.625 1.00 . A A . 29 CYS CA 1 1 8 5607 1 1 32 CYS CB C -1.237 -4.910 1.070 1.00 . A A . 29 CYS CB 1 1 8 5608 1 1 32 CYS H H -0.698 -5.189 3.565 1.00 . A A . 29 CYS H 1 1 8 5609 1 1 32 CYS HA H 0.455 -6.195 1.121 1.00 . A A . 29 CYS HA 1 1 8 5610 1 1 32 CYS HB2 H -1.768 -4.335 1.815 1.00 . A A . 29 CYS HB2 1 1 8 5611 1 1 32 CYS HB3 H -1.105 -4.307 0.188 1.00 . A A . 29 CYS HB3 1 1 8 5612 1 1 32 CYS N N 0.010 -5.615 3.034 1.00 . A A . 29 CYS N 1 1 8 5613 1 1 32 CYS O O 1.723 -4.127 0.282 1.00 . A A . 29 CYS O 1 1 8 5614 1 1 32 CYS SG S -2.266 -6.326 0.635 1.00 . A A . 29 CYS SG 1 1 8 5615 1 1 33 SER C C 3.798 -2.910 2.189 1.00 . A A . 30 SER C 1 1 8 5616 1 1 33 SER CA C 2.396 -2.311 2.198 1.00 . A A . 30 SER CA 1 1 8 5617 1 1 33 SER CB C 2.259 -1.243 3.288 1.00 . A A . 30 SER CB 1 1 8 5618 1 1 33 SER H H 0.909 -3.434 3.206 1.00 . A A . 30 SER H 1 1 8 5619 1 1 33 SER HA H 2.222 -1.849 1.238 1.00 . A A . 30 SER HA 1 1 8 5620 1 1 33 SER HB2 H 3.042 -0.508 3.167 1.00 . A A . 30 SER HB2 1 1 8 5621 1 1 33 SER HB3 H 1.297 -0.759 3.192 1.00 . A A . 30 SER HB3 1 1 8 5622 1 1 33 SER HG H 2.897 -1.222 5.134 1.00 . A A . 30 SER HG 1 1 8 5623 1 1 33 SER N N 1.400 -3.357 2.360 1.00 . A A . 30 SER N 1 1 8 5624 1 1 33 SER O O 4.675 -2.431 1.477 1.00 . A A . 30 SER O 1 1 8 5625 1 1 33 SER OG O 2.359 -1.802 4.582 1.00 . A A . 30 SER OG 1 1 8 5626 1 1 34 LYS C C 5.378 -5.652 1.826 1.00 . A A . 31 LYS C 1 1 8 5627 1 1 34 LYS CA C 5.299 -4.645 2.963 1.00 . A A . 31 LYS CA 1 1 8 5628 1 1 34 LYS CB C 5.567 -5.346 4.299 1.00 . A A . 31 LYS CB 1 1 8 5629 1 1 34 LYS CD C 5.287 -7.390 5.725 1.00 . A A . 31 LYS CD 1 1 8 5630 1 1 34 LYS CE C 4.801 -8.830 5.764 1.00 . A A . 31 LYS CE 1 1 8 5631 1 1 34 LYS CG C 4.861 -6.685 4.449 1.00 . A A . 31 LYS CG 1 1 8 5632 1 1 34 LYS H H 3.285 -4.305 3.538 1.00 . A A . 31 LYS H 1 1 8 5633 1 1 34 LYS HA H 6.053 -3.894 2.804 1.00 . A A . 31 LYS HA 1 1 8 5634 1 1 34 LYS HB2 H 6.629 -5.514 4.396 1.00 . A A . 31 LYS HB2 1 1 8 5635 1 1 34 LYS HB3 H 5.242 -4.702 5.101 1.00 . A A . 31 LYS HB3 1 1 8 5636 1 1 34 LYS HD2 H 6.364 -7.382 5.786 1.00 . A A . 31 LYS HD2 1 1 8 5637 1 1 34 LYS HD3 H 4.875 -6.857 6.569 1.00 . A A . 31 LYS HD3 1 1 8 5638 1 1 34 LYS HE2 H 5.081 -9.263 6.710 1.00 . A A . 31 LYS HE2 1 1 8 5639 1 1 34 LYS HE3 H 3.725 -8.834 5.672 1.00 . A A . 31 LYS HE3 1 1 8 5640 1 1 34 LYS HG2 H 3.794 -6.518 4.479 1.00 . A A . 31 LYS HG2 1 1 8 5641 1 1 34 LYS HG3 H 5.108 -7.309 3.603 1.00 . A A . 31 LYS HG3 1 1 8 5642 1 1 34 LYS HZ1 H 5.074 -9.290 3.743 1.00 . A A . 31 LYS HZ1 1 1 8 5643 1 1 34 LYS HZ2 H 5.075 -10.638 4.756 1.00 . A A . 31 LYS HZ2 1 1 8 5644 1 1 34 LYS HZ3 H 6.420 -9.620 4.708 1.00 . A A . 31 LYS HZ3 1 1 8 5645 1 1 34 LYS N N 4.006 -3.975 2.958 1.00 . A A . 31 LYS N 1 1 8 5646 1 1 34 LYS NZ N 5.383 -9.650 4.668 1.00 . A A . 31 LYS NZ 1 1 8 5647 1 1 34 LYS O O 6.458 -6.115 1.462 1.00 . A A . 31 LYS O 1 1 8 5648 1 1 35 LYS C C 4.871 -6.456 -1.053 1.00 . A A . 32 LYS C 1 1 8 5649 1 1 35 LYS CA C 4.148 -6.954 0.191 1.00 . A A . 32 LYS CA 1 1 8 5650 1 1 35 LYS CB C 2.691 -7.272 -0.124 1.00 . A A . 32 LYS CB 1 1 8 5651 1 1 35 LYS CD C 1.050 -9.066 -0.710 1.00 . A A . 32 LYS CD 1 1 8 5652 1 1 35 LYS CE C 0.857 -10.462 -1.281 1.00 . A A . 32 LYS CE 1 1 8 5653 1 1 35 LYS CG C 2.494 -8.610 -0.811 1.00 . A A . 32 LYS CG 1 1 8 5654 1 1 35 LYS H H 3.409 -5.523 1.553 1.00 . A A . 32 LYS H 1 1 8 5655 1 1 35 LYS HA H 4.632 -7.854 0.538 1.00 . A A . 32 LYS HA 1 1 8 5656 1 1 35 LYS HB2 H 2.130 -7.278 0.798 1.00 . A A . 32 LYS HB2 1 1 8 5657 1 1 35 LYS HB3 H 2.301 -6.498 -0.770 1.00 . A A . 32 LYS HB3 1 1 8 5658 1 1 35 LYS HD2 H 0.762 -9.069 0.329 1.00 . A A . 32 LYS HD2 1 1 8 5659 1 1 35 LYS HD3 H 0.427 -8.373 -1.256 1.00 . A A . 32 LYS HD3 1 1 8 5660 1 1 35 LYS HE2 H 1.501 -11.144 -0.749 1.00 . A A . 32 LYS HE2 1 1 8 5661 1 1 35 LYS HE3 H -0.173 -10.756 -1.136 1.00 . A A . 32 LYS HE3 1 1 8 5662 1 1 35 LYS HG2 H 2.761 -8.514 -1.853 1.00 . A A . 32 LYS HG2 1 1 8 5663 1 1 35 LYS HG3 H 3.129 -9.346 -0.339 1.00 . A A . 32 LYS HG3 1 1 8 5664 1 1 35 LYS HZ1 H 0.532 -9.909 -3.266 1.00 . A A . 32 LYS HZ1 1 1 8 5665 1 1 35 LYS HZ2 H 1.078 -11.499 -3.076 1.00 . A A . 32 LYS HZ2 1 1 8 5666 1 1 35 LYS HZ3 H 2.154 -10.210 -2.896 1.00 . A A . 32 LYS HZ3 1 1 8 5667 1 1 35 LYS N N 4.227 -5.967 1.253 1.00 . A A . 32 LYS N 1 1 8 5668 1 1 35 LYS NZ N 1.178 -10.525 -2.729 1.00 . A A . 32 LYS NZ 1 1 8 5669 1 1 35 LYS O O 5.477 -7.237 -1.783 1.00 . A A . 32 LYS O 1 1 8 5670 1 1 36 HIS C C 7.012 -4.300 -2.025 1.00 . A A . 33 HIS C 1 1 8 5671 1 1 36 HIS CA C 5.552 -4.572 -2.408 1.00 . A A . 33 HIS CA 1 1 8 5672 1 1 36 HIS CB C 4.857 -3.299 -2.937 1.00 . A A . 33 HIS CB 1 1 8 5673 1 1 36 HIS CD2 C 6.001 -1.401 -1.584 1.00 . A A . 33 HIS CD2 1 1 8 5674 1 1 36 HIS CE1 C 4.258 -0.359 -0.865 1.00 . A A . 33 HIS CE1 1 1 8 5675 1 1 36 HIS CG C 4.928 -2.090 -2.040 1.00 . A A . 33 HIS CG 1 1 8 5676 1 1 36 HIS H H 4.268 -4.569 -0.717 1.00 . A A . 33 HIS H 1 1 8 5677 1 1 36 HIS HA H 5.550 -5.311 -3.198 1.00 . A A . 33 HIS HA 1 1 8 5678 1 1 36 HIS HB2 H 5.303 -3.027 -3.880 1.00 . A A . 33 HIS HB2 1 1 8 5679 1 1 36 HIS HB3 H 3.811 -3.524 -3.099 1.00 . A A . 33 HIS HB3 1 1 8 5680 1 1 36 HIS HD1 H 2.888 -1.678 -1.711 1.00 . A A . 33 HIS HD1 1 1 8 5681 1 1 36 HIS HD2 H 7.027 -1.665 -1.755 1.00 . A A . 33 HIS HD2 1 1 8 5682 1 1 36 HIS HE1 H 3.608 0.326 -0.348 1.00 . A A . 33 HIS HE1 1 1 8 5683 1 1 36 HIS N N 4.822 -5.148 -1.289 1.00 . A A . 33 HIS N 1 1 8 5684 1 1 36 HIS ND1 N 3.826 -1.420 -1.568 1.00 . A A . 33 HIS ND1 1 1 8 5685 1 1 36 HIS NE2 N 5.581 -0.294 -0.850 1.00 . A A . 33 HIS NE2 1 1 8 5686 1 1 36 HIS O O 7.867 -4.116 -2.890 1.00 . A A . 33 HIS O 1 1 8 5687 1 1 37 LYS C C 9.546 -5.254 -0.426 1.00 . A A . 34 LYS C 1 1 8 5688 1 1 37 LYS CA C 8.659 -4.034 -0.247 1.00 . A A . 34 LYS CA 1 1 8 5689 1 1 37 LYS CB C 8.654 -3.641 1.231 1.00 . A A . 34 LYS CB 1 1 8 5690 1 1 37 LYS CD C 7.760 -2.158 3.038 1.00 . A A . 34 LYS CD 1 1 8 5691 1 1 37 LYS CE C 6.834 -1.001 3.356 1.00 . A A . 34 LYS CE 1 1 8 5692 1 1 37 LYS CG C 7.763 -2.460 1.549 1.00 . A A . 34 LYS CG 1 1 8 5693 1 1 37 LYS H H 6.597 -4.507 -0.076 1.00 . A A . 34 LYS H 1 1 8 5694 1 1 37 LYS HA H 9.062 -3.219 -0.828 1.00 . A A . 34 LYS HA 1 1 8 5695 1 1 37 LYS HB2 H 8.317 -4.483 1.814 1.00 . A A . 34 LYS HB2 1 1 8 5696 1 1 37 LYS HB3 H 9.662 -3.390 1.528 1.00 . A A . 34 LYS HB3 1 1 8 5697 1 1 37 LYS HD2 H 7.436 -3.030 3.581 1.00 . A A . 34 LYS HD2 1 1 8 5698 1 1 37 LYS HD3 H 8.763 -1.896 3.343 1.00 . A A . 34 LYS HD3 1 1 8 5699 1 1 37 LYS HE2 H 5.911 -1.134 2.807 1.00 . A A . 34 LYS HE2 1 1 8 5700 1 1 37 LYS HE3 H 6.627 -0.999 4.415 1.00 . A A . 34 LYS HE3 1 1 8 5701 1 1 37 LYS HG2 H 8.126 -1.594 1.016 1.00 . A A . 34 LYS HG2 1 1 8 5702 1 1 37 LYS HG3 H 6.756 -2.686 1.233 1.00 . A A . 34 LYS HG3 1 1 8 5703 1 1 37 LYS HZ1 H 7.816 0.248 2.009 1.00 . A A . 34 LYS HZ1 1 1 8 5704 1 1 37 LYS HZ2 H 8.203 0.538 3.632 1.00 . A A . 34 LYS HZ2 1 1 8 5705 1 1 37 LYS HZ3 H 6.715 1.047 3.016 1.00 . A A . 34 LYS HZ3 1 1 8 5706 1 1 37 LYS N N 7.305 -4.306 -0.726 1.00 . A A . 34 LYS N 1 1 8 5707 1 1 37 LYS NZ N 7.433 0.298 2.975 1.00 . A A . 34 LYS NZ 1 1 8 5708 1 1 37 LYS O O 10.761 -5.139 -0.561 1.00 . A A . 34 LYS O 1 1 8 5709 1 1 38 THR C C 9.849 -8.087 -1.979 1.00 . A A . 35 THR C 1 1 8 5710 1 1 38 THR CA C 9.649 -7.674 -0.519 1.00 . A A . 35 THR CA 1 1 8 5711 1 1 38 THR CB C 8.899 -8.786 0.248 1.00 . A A . 35 THR CB 1 1 8 5712 1 1 38 THR CG2 C 7.597 -9.144 -0.451 1.00 . A A . 35 THR CG2 1 1 8 5713 1 1 38 THR H H 7.946 -6.440 -0.354 1.00 . A A . 35 THR H 1 1 8 5714 1 1 38 THR HA H 10.617 -7.535 -0.059 1.00 . A A . 35 THR HA 1 1 8 5715 1 1 38 THR HB H 8.665 -8.419 1.237 1.00 . A A . 35 THR HB 1 1 8 5716 1 1 38 THR HG1 H 10.219 -10.081 -0.448 1.00 . A A . 35 THR HG1 1 1 8 5717 1 1 38 THR HG21 H 7.810 -9.478 -1.456 1.00 . A A . 35 THR HG21 1 1 8 5718 1 1 38 THR HG22 H 6.957 -8.274 -0.488 1.00 . A A . 35 THR HG22 1 1 8 5719 1 1 38 THR HG23 H 7.100 -9.933 0.093 1.00 . A A . 35 THR HG23 1 1 8 5720 1 1 38 THR N N 8.925 -6.420 -0.429 1.00 . A A . 35 THR N 1 1 8 5721 1 1 38 THR O O 10.330 -9.184 -2.267 1.00 . A A . 35 THR O 1 1 8 5722 1 1 38 THR OG1 O 9.713 -9.958 0.368 1.00 . A A . 35 THR OG1 1 1 8 5723 1 1 39 ARG C C 10.172 -6.285 -5.083 1.00 . A A . 36 ARG C 1 1 8 5724 1 1 39 ARG CA C 9.625 -7.488 -4.319 1.00 . A A . 36 ARG CA 1 1 8 5725 1 1 39 ARG CB C 8.292 -7.952 -4.917 1.00 . A A . 36 ARG CB 1 1 8 5726 1 1 39 ARG CD C 5.818 -7.595 -5.173 1.00 . A A . 36 ARG CD 1 1 8 5727 1 1 39 ARG CG C 7.114 -7.047 -4.594 1.00 . A A . 36 ARG CG 1 1 8 5728 1 1 39 ARG CZ C 4.770 -9.826 -5.334 1.00 . A A . 36 ARG CZ 1 1 8 5729 1 1 39 ARG H H 9.108 -6.344 -2.612 1.00 . A A . 36 ARG H 1 1 8 5730 1 1 39 ARG HA H 10.338 -8.294 -4.412 1.00 . A A . 36 ARG HA 1 1 8 5731 1 1 39 ARG HB2 H 8.392 -8.002 -5.991 1.00 . A A . 36 ARG HB2 1 1 8 5732 1 1 39 ARG HB3 H 8.070 -8.939 -4.542 1.00 . A A . 36 ARG HB3 1 1 8 5733 1 1 39 ARG HD2 H 5.007 -6.937 -4.895 1.00 . A A . 36 ARG HD2 1 1 8 5734 1 1 39 ARG HD3 H 5.903 -7.626 -6.248 1.00 . A A . 36 ARG HD3 1 1 8 5735 1 1 39 ARG HE H 5.918 -9.202 -3.817 1.00 . A A . 36 ARG HE 1 1 8 5736 1 1 39 ARG HG2 H 7.014 -6.973 -3.520 1.00 . A A . 36 ARG HG2 1 1 8 5737 1 1 39 ARG HG3 H 7.299 -6.068 -5.009 1.00 . A A . 36 ARG HG3 1 1 8 5738 1 1 39 ARG HH11 H 4.344 -8.584 -6.880 1.00 . A A . 36 ARG HH11 1 1 8 5739 1 1 39 ARG HH12 H 3.634 -10.161 -6.979 1.00 . A A . 36 ARG HH12 1 1 8 5740 1 1 39 ARG HH21 H 4.993 -11.289 -3.949 1.00 . A A . 36 ARG HH21 1 1 8 5741 1 1 39 ARG HH22 H 4.006 -11.705 -5.315 1.00 . A A . 36 ARG HH22 1 1 8 5742 1 1 39 ARG N N 9.479 -7.203 -2.898 1.00 . A A . 36 ARG N 1 1 8 5743 1 1 39 ARG NE N 5.525 -8.943 -4.681 1.00 . A A . 36 ARG NE 1 1 8 5744 1 1 39 ARG NH1 N 4.205 -9.498 -6.491 1.00 . A A . 36 ARG NH1 1 1 8 5745 1 1 39 ARG NH2 N 4.574 -11.036 -4.826 1.00 . A A . 36 ARG NH2 1 1 8 5746 1 1 39 ARG O O 10.935 -6.443 -6.034 1.00 . A A . 36 ARG O 1 1 8 5747 1 1 40 ASP C C 11.283 -3.136 -4.447 1.00 . A A . 37 ASP C 1 1 8 5748 1 1 40 ASP CA C 10.273 -3.867 -5.324 1.00 . A A . 37 ASP CA 1 1 8 5749 1 1 40 ASP CB C 9.115 -2.923 -5.666 1.00 . A A . 37 ASP CB 1 1 8 5750 1 1 40 ASP CG C 8.246 -3.438 -6.796 1.00 . A A . 37 ASP CG 1 1 8 5751 1 1 40 ASP H H 9.150 -5.004 -3.927 1.00 . A A . 37 ASP H 1 1 8 5752 1 1 40 ASP HA H 10.764 -4.162 -6.239 1.00 . A A . 37 ASP HA 1 1 8 5753 1 1 40 ASP HB2 H 8.494 -2.797 -4.793 1.00 . A A . 37 ASP HB2 1 1 8 5754 1 1 40 ASP HB3 H 9.519 -1.964 -5.956 1.00 . A A . 37 ASP HB3 1 1 8 5755 1 1 40 ASP N N 9.787 -5.082 -4.671 1.00 . A A . 37 ASP N 1 1 8 5756 1 1 40 ASP O O 11.878 -2.146 -4.879 1.00 . A A . 37 ASP O 1 1 8 5757 1 1 40 ASP OD1 O 8.711 -3.442 -7.956 1.00 . A A . 37 ASP OD1 1 1 8 5758 1 1 40 ASP OD2 O 7.084 -3.827 -6.537 1.00 . A A . 37 ASP OD2 1 1 8 5759 1 1 41 ASN C C 12.019 -1.526 -2.078 1.00 . A A . 38 ASN C 1 1 8 5760 1 1 41 ASN CA C 12.362 -3.007 -2.240 1.00 . A A . 38 ASN CA 1 1 8 5761 1 1 41 ASN CB C 13.834 -3.181 -2.636 1.00 . A A . 38 ASN CB 1 1 8 5762 1 1 41 ASN CG C 14.794 -2.706 -1.560 1.00 . A A . 38 ASN CG 1 1 8 5763 1 1 41 ASN H H 11.021 -4.469 -2.980 1.00 . A A . 38 ASN H 1 1 8 5764 1 1 41 ASN HA H 12.196 -3.500 -1.294 1.00 . A A . 38 ASN HA 1 1 8 5765 1 1 41 ASN HB2 H 14.026 -4.226 -2.824 1.00 . A A . 38 ASN HB2 1 1 8 5766 1 1 41 ASN HB3 H 14.025 -2.618 -3.537 1.00 . A A . 38 ASN HB3 1 1 8 5767 1 1 41 ASN HD21 H 14.784 -4.506 -0.718 1.00 . A A . 38 ASN HD21 1 1 8 5768 1 1 41 ASN HD22 H 15.781 -3.321 0.052 1.00 . A A . 38 ASN HD22 1 1 8 5769 1 1 41 ASN N N 11.477 -3.638 -3.225 1.00 . A A . 38 ASN N 1 1 8 5770 1 1 41 ASN ND2 N 15.152 -3.598 -0.649 1.00 . A A . 38 ASN ND2 1 1 8 5771 1 1 41 ASN O O 12.650 -0.655 -2.676 1.00 . A A . 38 ASN O 1 1 8 5772 1 1 41 ASN OD1 O 15.212 -1.548 -1.544 1.00 . A A . 38 ASN OD1 1 1 8 5773 1 1 42 CYS C C 10.330 0.474 0.351 1.00 . A A . 39 CYS C 1 1 8 5774 1 1 42 CYS CA C 10.502 0.106 -1.117 1.00 . A A . 39 CYS CA 1 1 8 5775 1 1 42 CYS CB C 9.163 0.233 -1.843 1.00 . A A . 39 CYS CB 1 1 8 5776 1 1 42 CYS H H 10.605 -1.968 -0.744 1.00 . A A . 39 CYS H 1 1 8 5777 1 1 42 CYS HA H 11.213 0.782 -1.569 1.00 . A A . 39 CYS HA 1 1 8 5778 1 1 42 CYS HB2 H 9.324 0.138 -2.905 1.00 . A A . 39 CYS HB2 1 1 8 5779 1 1 42 CYS HB3 H 8.511 -0.558 -1.511 1.00 . A A . 39 CYS HB3 1 1 8 5780 1 1 42 CYS N N 11.011 -1.248 -1.266 1.00 . A A . 39 CYS N 1 1 8 5781 1 1 42 CYS O O 9.475 -0.079 1.041 1.00 . A A . 39 CYS O 1 1 8 5782 1 1 42 CYS SG S 8.314 1.799 -1.555 1.00 . A A . 39 CYS SG 1 1 8 5783 1 1 43 SER C C 10.036 3.012 2.287 1.00 . A A . 40 SER C 1 1 8 5784 1 1 43 SER CA C 11.032 1.861 2.196 1.00 . A A . 40 SER CA 1 1 8 5785 1 1 43 SER CB C 12.405 2.296 2.716 1.00 . A A . 40 SER CB 1 1 8 5786 1 1 43 SER H H 11.781 1.835 0.228 1.00 . A A . 40 SER H 1 1 8 5787 1 1 43 SER HA H 10.669 1.034 2.789 1.00 . A A . 40 SER HA 1 1 8 5788 1 1 43 SER HB2 H 13.135 1.539 2.473 1.00 . A A . 40 SER HB2 1 1 8 5789 1 1 43 SER HB3 H 12.686 3.228 2.249 1.00 . A A . 40 SER HB3 1 1 8 5790 1 1 43 SER HG H 12.575 1.632 4.551 1.00 . A A . 40 SER HG 1 1 8 5791 1 1 43 SER N N 11.125 1.416 0.822 1.00 . A A . 40 SER N 1 1 8 5792 1 1 43 SER O O 10.055 3.933 1.465 1.00 . A A . 40 SER O 1 1 8 5793 1 1 43 SER OG O 12.387 2.476 4.123 1.00 . A A . 40 SER OG 1 1 8 5794 1 1 44 GLY C C 8.581 5.179 4.177 1.00 . A A . 41 GLY C 1 1 8 5795 1 1 44 GLY CA C 8.127 3.971 3.389 1.00 . A A . 41 GLY CA 1 1 8 5796 1 1 44 GLY H H 9.234 2.258 3.959 1.00 . A A . 41 GLY H 1 1 8 5797 1 1 44 GLY HA2 H 7.849 4.286 2.394 1.00 . A A . 41 GLY HA2 1 1 8 5798 1 1 44 GLY HA3 H 7.265 3.540 3.873 1.00 . A A . 41 GLY HA3 1 1 8 5799 1 1 44 GLY N N 9.162 2.966 3.280 1.00 . A A . 41 GLY N 1 1 8 5800 1 1 44 GLY O O 7.968 5.548 5.178 1.00 . A A . 41 GLY O 1 1 8 5801 1 1 45 GLN C C 10.104 8.185 3.469 1.00 . A A . 42 GLN C 1 1 8 5802 1 1 45 GLN CA C 10.219 6.968 4.376 1.00 . A A . 42 GLN CA 1 1 8 5803 1 1 45 GLN CB C 11.682 6.727 4.742 1.00 . A A . 42 GLN CB 1 1 8 5804 1 1 45 GLN CD C 13.342 5.371 6.064 1.00 . A A . 42 GLN CD 1 1 8 5805 1 1 45 GLN CG C 11.880 5.641 5.785 1.00 . A A . 42 GLN CG 1 1 8 5806 1 1 45 GLN H H 10.109 5.433 2.924 1.00 . A A . 42 GLN H 1 1 8 5807 1 1 45 GLN HA H 9.653 7.149 5.278 1.00 . A A . 42 GLN HA 1 1 8 5808 1 1 45 GLN HB2 H 12.221 6.441 3.850 1.00 . A A . 42 GLN HB2 1 1 8 5809 1 1 45 GLN HB3 H 12.100 7.646 5.126 1.00 . A A . 42 GLN HB3 1 1 8 5810 1 1 45 GLN HE21 H 13.363 3.939 4.688 1.00 . A A . 42 GLN HE21 1 1 8 5811 1 1 45 GLN HE22 H 14.861 4.224 5.506 1.00 . A A . 42 GLN HE22 1 1 8 5812 1 1 45 GLN HG2 H 11.404 5.948 6.703 1.00 . A A . 42 GLN HG2 1 1 8 5813 1 1 45 GLN HG3 H 11.422 4.729 5.429 1.00 . A A . 42 GLN HG3 1 1 8 5814 1 1 45 GLN N N 9.663 5.791 3.723 1.00 . A A . 42 GLN N 1 1 8 5815 1 1 45 GLN NE2 N 13.914 4.416 5.351 1.00 . A A . 42 GLN NE2 1 1 8 5816 1 1 45 GLN O O 10.428 9.306 3.870 1.00 . A A . 42 GLN O 1 1 8 5817 1 1 45 GLN OE1 O 13.951 6.006 6.925 1.00 . A A . 42 GLN OE1 1 1 8 5818 1 1 46 THR C C 10.813 9.470 0.672 1.00 . A A . 43 THR C 1 1 8 5819 1 1 46 THR CA C 9.471 8.976 1.221 1.00 . A A . 43 THR CA 1 1 8 5820 1 1 46 THR CB C 8.663 10.178 1.752 1.00 . A A . 43 THR CB 1 1 8 5821 1 1 46 THR CG2 C 8.048 10.958 0.601 1.00 . A A . 43 THR CG2 1 1 8 5822 1 1 46 THR H H 9.424 7.018 2.009 1.00 . A A . 43 THR H 1 1 8 5823 1 1 46 THR HA H 8.913 8.534 0.408 1.00 . A A . 43 THR HA 1 1 8 5824 1 1 46 THR HB H 9.327 10.830 2.299 1.00 . A A . 43 THR HB 1 1 8 5825 1 1 46 THR HG1 H 7.156 10.486 2.989 1.00 . A A . 43 THR HG1 1 1 8 5826 1 1 46 THR HG21 H 7.373 10.316 0.053 1.00 . A A . 43 THR HG21 1 1 8 5827 1 1 46 THR HG22 H 8.830 11.303 -0.058 1.00 . A A . 43 THR HG22 1 1 8 5828 1 1 46 THR HG23 H 7.502 11.805 0.990 1.00 . A A . 43 THR HG23 1 1 8 5829 1 1 46 THR N N 9.653 7.938 2.240 1.00 . A A . 43 THR N 1 1 8 5830 1 1 46 THR O O 10.987 9.576 -0.543 1.00 . A A . 43 THR O 1 1 8 5831 1 1 46 THR OG1 O 7.622 9.723 2.624 1.00 . A A . 43 THR OG1 1 1 8 5832 1 1 47 HIS C C 13.773 9.212 0.314 1.00 . A A . 44 HIS C 1 1 8 5833 1 1 47 HIS CA C 13.076 10.237 1.198 1.00 . A A . 44 HIS CA 1 1 8 5834 1 1 47 HIS CB C 13.921 10.507 2.449 1.00 . A A . 44 HIS CB 1 1 8 5835 1 1 47 HIS CD2 C 13.189 12.871 3.228 1.00 . A A . 44 HIS CD2 1 1 8 5836 1 1 47 HIS CE1 C 12.386 12.332 5.193 1.00 . A A . 44 HIS CE1 1 1 8 5837 1 1 47 HIS CG C 13.335 11.534 3.372 1.00 . A A . 44 HIS CG 1 1 8 5838 1 1 47 HIS H H 11.530 9.660 2.526 1.00 . A A . 44 HIS H 1 1 8 5839 1 1 47 HIS HA H 12.959 11.155 0.646 1.00 . A A . 44 HIS HA 1 1 8 5840 1 1 47 HIS HB2 H 14.027 9.588 3.005 1.00 . A A . 44 HIS HB2 1 1 8 5841 1 1 47 HIS HB3 H 14.898 10.851 2.145 1.00 . A A . 44 HIS HB3 1 1 8 5842 1 1 47 HIS HD1 H 12.790 10.333 5.027 1.00 . A A . 44 HIS HD1 1 1 8 5843 1 1 47 HIS HD2 H 13.485 13.460 2.372 1.00 . A A . 44 HIS HD2 1 1 8 5844 1 1 47 HIS HE1 H 11.935 12.398 6.172 1.00 . A A . 44 HIS HE1 1 1 8 5845 1 1 47 HIS HE2 H 12.523 14.292 4.623 1.00 . A A . 44 HIS HE2 1 1 8 5846 1 1 47 HIS N N 11.747 9.764 1.573 1.00 . A A . 44 HIS N 1 1 8 5847 1 1 47 HIS ND1 N 12.822 11.228 4.617 1.00 . A A . 44 HIS ND1 1 1 8 5848 1 1 47 HIS NE2 N 12.597 13.343 4.373 1.00 . A A . 44 HIS NE2 1 1 8 5849 1 1 47 HIS O O 14.030 9.463 -0.865 1.00 . A A . 44 HIS O 1 1 8 5850 1 1 48 ASP C C 14.209 5.640 0.746 1.00 . A A . 45 ASP C 1 1 8 5851 1 1 48 ASP CA C 14.667 6.958 0.148 1.00 . A A . 45 ASP CA 1 1 8 5852 1 1 48 ASP CB C 16.201 7.051 0.159 1.00 . A A . 45 ASP CB 1 1 8 5853 1 1 48 ASP CG C 16.814 6.814 1.528 1.00 . A A . 45 ASP CG 1 1 8 5854 1 1 48 ASP H H 13.852 7.923 1.834 1.00 . A A . 45 ASP H 1 1 8 5855 1 1 48 ASP HA H 14.316 7.014 -0.873 1.00 . A A . 45 ASP HA 1 1 8 5856 1 1 48 ASP HB2 H 16.601 6.314 -0.519 1.00 . A A . 45 ASP HB2 1 1 8 5857 1 1 48 ASP HB3 H 16.493 8.035 -0.178 1.00 . A A . 45 ASP HB3 1 1 8 5858 1 1 48 ASP N N 14.058 8.053 0.884 1.00 . A A . 45 ASP N 1 1 8 5859 1 1 48 ASP O O 13.953 5.607 1.969 1.00 . A A . 45 ASP O 1 1 8 5860 1 1 48 ASP OXT O 14.099 4.649 -0.004 1.00 . A A . 45 ASP OXT 1 1 8 5861 1 1 48 ASP OD1 O 16.956 7.789 2.301 1.00 . A A . 45 ASP OD1 1 1 8 5862 1 1 48 ASP OD2 O 17.170 5.658 1.836 1.00 . A A . 45 ASP OD2 1 1 8 5863 2 2 1 ZN ZN ZN -4.432 -5.616 0.389 1.00 . B A . 101 ZN ZN 1 1 8 5864 3 2 1 ZN ZN ZN 6.043 1.486 -1.659 1.00 . C A . 102 ZN ZN 1 1 9 5865 1 1 1 GLY C C -21.628 8.827 -0.877 1.00 . A A . -2 GLY C 1 1 9 5866 1 1 1 GLY CA C -22.931 8.409 -0.233 1.00 . A A . -2 GLY CA 1 1 9 5867 1 1 1 GLY H1 H -24.139 9.294 -1.676 1.00 . A A . -2 GLY H1 1 1 9 5868 1 1 1 GLY H2 H -23.886 10.257 -0.316 1.00 . A A . -2 GLY H2 1 1 9 5869 1 1 1 GLY H3 H -24.944 8.944 -0.234 1.00 . A A . -2 GLY H3 1 1 9 5870 1 1 1 GLY HA2 H -22.824 8.457 0.839 1.00 . A A . -2 GLY HA2 1 1 9 5871 1 1 1 GLY HA3 H -23.156 7.392 -0.520 1.00 . A A . -2 GLY HA3 1 1 9 5872 1 1 1 GLY N N -24.052 9.286 -0.642 1.00 . A A . -2 GLY N 1 1 9 5873 1 1 1 GLY O O -21.625 9.249 -2.033 1.00 . A A . -2 GLY O 1 1 9 5874 1 1 2 PRO C C -18.867 8.576 -2.030 1.00 . A A . -1 PRO C 1 1 9 5875 1 1 2 PRO CA C -19.178 9.127 -0.642 1.00 . A A . -1 PRO CA 1 1 9 5876 1 1 2 PRO CB C -18.224 8.525 0.392 1.00 . A A . -1 PRO CB 1 1 9 5877 1 1 2 PRO CD C -20.436 8.204 1.231 1.00 . A A . -1 PRO CD 1 1 9 5878 1 1 2 PRO CG C -19.018 8.478 1.647 1.00 . A A . -1 PRO CG 1 1 9 5879 1 1 2 PRO HA H -19.070 10.201 -0.650 1.00 . A A . -1 PRO HA 1 1 9 5880 1 1 2 PRO HB2 H -17.925 7.537 0.075 1.00 . A A . -1 PRO HB2 1 1 9 5881 1 1 2 PRO HB3 H -17.352 9.155 0.496 1.00 . A A . -1 PRO HB3 1 1 9 5882 1 1 2 PRO HD2 H -20.638 7.143 1.251 1.00 . A A . -1 PRO HD2 1 1 9 5883 1 1 2 PRO HD3 H -21.124 8.730 1.874 1.00 . A A . -1 PRO HD3 1 1 9 5884 1 1 2 PRO HG2 H -18.652 7.685 2.283 1.00 . A A . -1 PRO HG2 1 1 9 5885 1 1 2 PRO HG3 H -18.956 9.427 2.156 1.00 . A A . -1 PRO HG3 1 1 9 5886 1 1 2 PRO N N -20.503 8.723 -0.147 1.00 . A A . -1 PRO N 1 1 9 5887 1 1 2 PRO O O -18.652 9.344 -2.969 1.00 . A A . -1 PRO O 1 1 9 5888 1 1 3 HIS C C -17.163 7.051 -3.898 1.00 . A A . 0 HIS C 1 1 9 5889 1 1 3 HIS CA C -18.524 6.580 -3.406 1.00 . A A . 0 HIS CA 1 1 9 5890 1 1 3 HIS CB C -19.599 6.820 -4.473 1.00 . A A . 0 HIS CB 1 1 9 5891 1 1 3 HIS CD2 C -21.214 4.832 -4.081 1.00 . A A . 0 HIS CD2 1 1 9 5892 1 1 3 HIS CE1 C -23.043 5.975 -3.698 1.00 . A A . 0 HIS CE1 1 1 9 5893 1 1 3 HIS CG C -20.900 6.146 -4.172 1.00 . A A . 0 HIS CG 1 1 9 5894 1 1 3 HIS H H -19.099 6.700 -1.371 1.00 . A A . 0 HIS H 1 1 9 5895 1 1 3 HIS HA H -18.467 5.520 -3.203 1.00 . A A . 0 HIS HA 1 1 9 5896 1 1 3 HIS HB2 H -19.785 7.880 -4.554 1.00 . A A . 0 HIS HB2 1 1 9 5897 1 1 3 HIS HB3 H -19.242 6.449 -5.423 1.00 . A A . 0 HIS HB3 1 1 9 5898 1 1 3 HIS HD1 H -22.171 7.815 -3.926 1.00 . A A . 0 HIS HD1 1 1 9 5899 1 1 3 HIS HD2 H -20.538 4.000 -4.215 1.00 . A A . 0 HIS HD2 1 1 9 5900 1 1 3 HIS HE1 H -24.070 6.228 -3.479 1.00 . A A . 0 HIS HE1 1 1 9 5901 1 1 3 HIS HE2 H -23.086 3.931 -3.768 1.00 . A A . 0 HIS HE2 1 1 9 5902 1 1 3 HIS N N -18.865 7.249 -2.152 1.00 . A A . 0 HIS N 1 1 9 5903 1 1 3 HIS ND1 N -22.069 6.834 -3.927 1.00 . A A . 0 HIS ND1 1 1 9 5904 1 1 3 HIS NE2 N -22.552 4.756 -3.785 1.00 . A A . 0 HIS NE2 1 1 9 5905 1 1 3 HIS O O -17.005 7.481 -5.041 1.00 . A A . 0 HIS O 1 1 9 5906 1 1 4 MET C C -13.819 6.497 -2.690 1.00 . A A . 1 MET C 1 1 9 5907 1 1 4 MET CA C -14.841 7.439 -3.305 1.00 . A A . 1 MET CA 1 1 9 5908 1 1 4 MET CB C -14.630 8.861 -2.782 1.00 . A A . 1 MET CB 1 1 9 5909 1 1 4 MET CE C -12.985 10.962 -1.007 1.00 . A A . 1 MET CE 1 1 9 5910 1 1 4 MET CG C -14.951 9.023 -1.303 1.00 . A A . 1 MET CG 1 1 9 5911 1 1 4 MET H H -16.383 6.623 -2.116 1.00 . A A . 1 MET H 1 1 9 5912 1 1 4 MET HA H -14.718 7.436 -4.377 1.00 . A A . 1 MET HA 1 1 9 5913 1 1 4 MET HB2 H -13.598 9.133 -2.937 1.00 . A A . 1 MET HB2 1 1 9 5914 1 1 4 MET HB3 H -15.260 9.533 -3.342 1.00 . A A . 1 MET HB3 1 1 9 5915 1 1 4 MET HE1 H -12.701 11.948 -0.670 1.00 . A A . 1 MET HE1 1 1 9 5916 1 1 4 MET HE2 H -12.780 10.872 -2.062 1.00 . A A . 1 MET HE2 1 1 9 5917 1 1 4 MET HE3 H -12.422 10.219 -0.464 1.00 . A A . 1 MET HE3 1 1 9 5918 1 1 4 MET HG2 H -15.979 8.733 -1.139 1.00 . A A . 1 MET HG2 1 1 9 5919 1 1 4 MET HG3 H -14.304 8.374 -0.732 1.00 . A A . 1 MET HG3 1 1 9 5920 1 1 4 MET N N -16.189 6.988 -3.007 1.00 . A A . 1 MET N 1 1 9 5921 1 1 4 MET O O -12.653 6.847 -2.518 1.00 . A A . 1 MET O 1 1 9 5922 1 1 4 MET SD S -14.736 10.715 -0.715 1.00 . A A . 1 MET SD 1 1 9 5923 1 1 5 ALA C C -12.737 3.471 -2.845 1.00 . A A . 2 ALA C 1 1 9 5924 1 1 5 ALA CA C -13.401 4.300 -1.766 1.00 . A A . 2 ALA CA 1 1 9 5925 1 1 5 ALA CB C -14.171 3.400 -0.821 1.00 . A A . 2 ALA CB 1 1 9 5926 1 1 5 ALA H H -15.208 5.085 -2.523 1.00 . A A . 2 ALA H 1 1 9 5927 1 1 5 ALA HA H -12.638 4.813 -1.199 1.00 . A A . 2 ALA HA 1 1 9 5928 1 1 5 ALA HB1 H -14.936 2.874 -1.371 1.00 . A A . 2 ALA HB1 1 1 9 5929 1 1 5 ALA HB2 H -14.624 3.995 -0.045 1.00 . A A . 2 ALA HB2 1 1 9 5930 1 1 5 ALA HB3 H -13.490 2.687 -0.379 1.00 . A A . 2 ALA HB3 1 1 9 5931 1 1 5 ALA N N -14.270 5.303 -2.356 1.00 . A A . 2 ALA N 1 1 9 5932 1 1 5 ALA O O -13.393 2.961 -3.754 1.00 . A A . 2 ALA O 1 1 9 5933 1 1 6 VAL C C -10.179 1.283 -3.101 1.00 . A A . 3 VAL C 1 1 9 5934 1 1 6 VAL CA C -10.643 2.603 -3.696 1.00 . A A . 3 VAL CA 1 1 9 5935 1 1 6 VAL CB C -9.429 3.444 -4.136 1.00 . A A . 3 VAL CB 1 1 9 5936 1 1 6 VAL CG1 C -8.487 2.647 -5.025 1.00 . A A . 3 VAL CG1 1 1 9 5937 1 1 6 VAL CG2 C -9.905 4.699 -4.845 1.00 . A A . 3 VAL CG2 1 1 9 5938 1 1 6 VAL H H -10.984 3.751 -1.966 1.00 . A A . 3 VAL H 1 1 9 5939 1 1 6 VAL HA H -11.260 2.409 -4.561 1.00 . A A . 3 VAL HA 1 1 9 5940 1 1 6 VAL HB H -8.884 3.743 -3.253 1.00 . A A . 3 VAL HB 1 1 9 5941 1 1 6 VAL HG11 H -7.687 3.287 -5.367 1.00 . A A . 3 VAL HG11 1 1 9 5942 1 1 6 VAL HG12 H -9.031 2.263 -5.874 1.00 . A A . 3 VAL HG12 1 1 9 5943 1 1 6 VAL HG13 H -8.072 1.826 -4.458 1.00 . A A . 3 VAL HG13 1 1 9 5944 1 1 6 VAL HG21 H -10.552 5.257 -4.184 1.00 . A A . 3 VAL HG21 1 1 9 5945 1 1 6 VAL HG22 H -10.450 4.424 -5.735 1.00 . A A . 3 VAL HG22 1 1 9 5946 1 1 6 VAL HG23 H -9.054 5.306 -5.114 1.00 . A A . 3 VAL HG23 1 1 9 5947 1 1 6 VAL N N -11.434 3.340 -2.731 1.00 . A A . 3 VAL N 1 1 9 5948 1 1 6 VAL O O -9.839 1.212 -1.920 1.00 . A A . 3 VAL O 1 1 9 5949 1 1 7 LEU C C -8.223 -1.083 -3.351 1.00 . A A . 4 LEU C 1 1 9 5950 1 1 7 LEU CA C -9.736 -1.070 -3.486 1.00 . A A . 4 LEU CA 1 1 9 5951 1 1 7 LEU CB C -10.174 -2.153 -4.471 1.00 . A A . 4 LEU CB 1 1 9 5952 1 1 7 LEU CD1 C -11.985 -3.486 -5.556 1.00 . A A . 4 LEU CD1 1 1 9 5953 1 1 7 LEU CD2 C -12.094 -3.024 -3.110 1.00 . A A . 4 LEU CD2 1 1 9 5954 1 1 7 LEU CG C -11.668 -2.481 -4.467 1.00 . A A . 4 LEU CG 1 1 9 5955 1 1 7 LEU H H -10.533 0.351 -4.832 1.00 . A A . 4 LEU H 1 1 9 5956 1 1 7 LEU HA H -10.173 -1.275 -2.519 1.00 . A A . 4 LEU HA 1 1 9 5957 1 1 7 LEU HB2 H -9.902 -1.833 -5.466 1.00 . A A . 4 LEU HB2 1 1 9 5958 1 1 7 LEU HB3 H -9.631 -3.057 -4.242 1.00 . A A . 4 LEU HB3 1 1 9 5959 1 1 7 LEU HD11 H -11.426 -4.394 -5.383 1.00 . A A . 4 LEU HD11 1 1 9 5960 1 1 7 LEU HD12 H -11.714 -3.074 -6.516 1.00 . A A . 4 LEU HD12 1 1 9 5961 1 1 7 LEU HD13 H -13.041 -3.706 -5.545 1.00 . A A . 4 LEU HD13 1 1 9 5962 1 1 7 LEU HD21 H -11.485 -3.882 -2.855 1.00 . A A . 4 LEU HD21 1 1 9 5963 1 1 7 LEU HD22 H -13.131 -3.321 -3.153 1.00 . A A . 4 LEU HD22 1 1 9 5964 1 1 7 LEU HD23 H -11.970 -2.259 -2.358 1.00 . A A . 4 LEU HD23 1 1 9 5965 1 1 7 LEU HG H -12.232 -1.582 -4.663 1.00 . A A . 4 LEU HG 1 1 9 5966 1 1 7 LEU N N -10.200 0.237 -3.914 1.00 . A A . 4 LEU N 1 1 9 5967 1 1 7 LEU O O -7.513 -0.419 -4.109 1.00 . A A . 4 LEU O 1 1 9 5968 1 1 8 CYS C C -5.558 -2.295 -3.388 1.00 . A A . 5 CYS C 1 1 9 5969 1 1 8 CYS CA C -6.338 -2.029 -2.105 1.00 . A A . 5 CYS CA 1 1 9 5970 1 1 8 CYS CB C -6.186 -3.206 -1.155 1.00 . A A . 5 CYS CB 1 1 9 5971 1 1 8 CYS H H -8.408 -2.290 -1.783 1.00 . A A . 5 CYS H 1 1 9 5972 1 1 8 CYS HA H -5.957 -1.138 -1.633 1.00 . A A . 5 CYS HA 1 1 9 5973 1 1 8 CYS HB2 H -6.741 -3.000 -0.258 1.00 . A A . 5 CYS HB2 1 1 9 5974 1 1 8 CYS HB3 H -6.601 -4.086 -1.627 1.00 . A A . 5 CYS HB3 1 1 9 5975 1 1 8 CYS N N -7.758 -1.840 -2.370 1.00 . A A . 5 CYS N 1 1 9 5976 1 1 8 CYS O O -5.850 -3.240 -4.115 1.00 . A A . 5 CYS O 1 1 9 5977 1 1 8 CYS SG S -4.489 -3.599 -0.670 1.00 . A A . 5 CYS SG 1 1 9 5978 1 1 9 GLY C C -3.055 -2.890 -5.005 1.00 . A A . 6 GLY C 1 1 9 5979 1 1 9 GLY CA C -3.766 -1.562 -4.852 1.00 . A A . 6 GLY CA 1 1 9 5980 1 1 9 GLY H H -4.343 -0.762 -2.978 1.00 . A A . 6 GLY H 1 1 9 5981 1 1 9 GLY HA2 H -4.420 -1.421 -5.696 1.00 . A A . 6 GLY HA2 1 1 9 5982 1 1 9 GLY HA3 H -3.029 -0.773 -4.849 1.00 . A A . 6 GLY HA3 1 1 9 5983 1 1 9 GLY N N -4.551 -1.465 -3.634 1.00 . A A . 6 GLY N 1 1 9 5984 1 1 9 GLY O O -2.739 -3.301 -6.119 1.00 . A A . 6 GLY O 1 1 9 5985 1 1 10 VAL C C -3.065 -6.014 -4.118 1.00 . A A . 7 VAL C 1 1 9 5986 1 1 10 VAL CA C -2.100 -4.841 -3.926 1.00 . A A . 7 VAL CA 1 1 9 5987 1 1 10 VAL CB C -1.262 -5.068 -2.644 1.00 . A A . 7 VAL CB 1 1 9 5988 1 1 10 VAL CG1 C -0.652 -6.463 -2.632 1.00 . A A . 7 VAL CG1 1 1 9 5989 1 1 10 VAL CG2 C -0.172 -4.011 -2.525 1.00 . A A . 7 VAL CG2 1 1 9 5990 1 1 10 VAL H H -3.088 -3.194 -3.034 1.00 . A A . 7 VAL H 1 1 9 5991 1 1 10 VAL HA H -1.422 -4.817 -4.766 1.00 . A A . 7 VAL HA 1 1 9 5992 1 1 10 VAL HB H -1.915 -4.978 -1.789 1.00 . A A . 7 VAL HB 1 1 9 5993 1 1 10 VAL HG11 H -1.439 -7.199 -2.688 1.00 . A A . 7 VAL HG11 1 1 9 5994 1 1 10 VAL HG12 H -0.090 -6.602 -1.719 1.00 . A A . 7 VAL HG12 1 1 9 5995 1 1 10 VAL HG13 H 0.007 -6.576 -3.481 1.00 . A A . 7 VAL HG13 1 1 9 5996 1 1 10 VAL HG21 H 0.410 -4.193 -1.632 1.00 . A A . 7 VAL HG21 1 1 9 5997 1 1 10 VAL HG22 H -0.624 -3.032 -2.469 1.00 . A A . 7 VAL HG22 1 1 9 5998 1 1 10 VAL HG23 H 0.472 -4.060 -3.391 1.00 . A A . 7 VAL HG23 1 1 9 5999 1 1 10 VAL N N -2.801 -3.565 -3.891 1.00 . A A . 7 VAL N 1 1 9 6000 1 1 10 VAL O O -3.059 -6.664 -5.159 1.00 . A A . 7 VAL O 1 1 9 6001 1 1 11 CYS C C -6.103 -7.226 -3.769 1.00 . A A . 8 CYS C 1 1 9 6002 1 1 11 CYS CA C -4.734 -7.479 -3.132 1.00 . A A . 8 CYS CA 1 1 9 6003 1 1 11 CYS CB C -4.900 -8.030 -1.712 1.00 . A A . 8 CYS CB 1 1 9 6004 1 1 11 CYS H H -3.978 -5.642 -2.381 1.00 . A A . 8 CYS H 1 1 9 6005 1 1 11 CYS HA H -4.216 -8.217 -3.727 1.00 . A A . 8 CYS HA 1 1 9 6006 1 1 11 CYS HB2 H -5.375 -8.996 -1.763 1.00 . A A . 8 CYS HB2 1 1 9 6007 1 1 11 CYS HB3 H -3.925 -8.137 -1.260 1.00 . A A . 8 CYS HB3 1 1 9 6008 1 1 11 CYS N N -3.908 -6.271 -3.122 1.00 . A A . 8 CYS N 1 1 9 6009 1 1 11 CYS O O -6.708 -8.122 -4.359 1.00 . A A . 8 CYS O 1 1 9 6010 1 1 11 CYS SG S -5.901 -6.992 -0.623 1.00 . A A . 8 CYS SG 1 1 9 6011 1 1 12 GLY C C -9.053 -6.262 -3.851 1.00 . A A . 9 GLY C 1 1 9 6012 1 1 12 GLY CA C -7.792 -5.543 -4.289 1.00 . A A . 9 GLY CA 1 1 9 6013 1 1 12 GLY H H -6.064 -5.353 -3.094 1.00 . A A . 9 GLY H 1 1 9 6014 1 1 12 GLY HA2 H -7.920 -4.492 -4.091 1.00 . A A . 9 GLY HA2 1 1 9 6015 1 1 12 GLY HA3 H -7.673 -5.677 -5.353 1.00 . A A . 9 GLY HA3 1 1 9 6016 1 1 12 GLY N N -6.572 -5.988 -3.632 1.00 . A A . 9 GLY N 1 1 9 6017 1 1 12 GLY O O -9.973 -6.422 -4.650 1.00 . A A . 9 GLY O 1 1 9 6018 1 1 13 ILE C C -11.159 -6.555 -1.183 1.00 . A A . 10 ILE C 1 1 9 6019 1 1 13 ILE CA C -10.306 -7.401 -2.126 1.00 . A A . 10 ILE CA 1 1 9 6020 1 1 13 ILE CB C -9.932 -8.748 -1.461 1.00 . A A . 10 ILE CB 1 1 9 6021 1 1 13 ILE CD1 C -9.056 -7.902 0.785 1.00 . A A . 10 ILE CD1 1 1 9 6022 1 1 13 ILE CG1 C -8.735 -8.595 -0.519 1.00 . A A . 10 ILE CG1 1 1 9 6023 1 1 13 ILE CG2 C -9.636 -9.792 -2.525 1.00 . A A . 10 ILE CG2 1 1 9 6024 1 1 13 ILE H H -8.389 -6.491 -1.969 1.00 . A A . 10 ILE H 1 1 9 6025 1 1 13 ILE HA H -10.902 -7.625 -3.000 1.00 . A A . 10 ILE HA 1 1 9 6026 1 1 13 ILE HB H -10.786 -9.087 -0.892 1.00 . A A . 10 ILE HB 1 1 9 6027 1 1 13 ILE HD11 H -9.769 -8.491 1.341 1.00 . A A . 10 ILE HD11 1 1 9 6028 1 1 13 ILE HD12 H -9.481 -6.930 0.572 1.00 . A A . 10 ILE HD12 1 1 9 6029 1 1 13 ILE HD13 H -8.152 -7.782 1.363 1.00 . A A . 10 ILE HD13 1 1 9 6030 1 1 13 ILE HG12 H -8.343 -9.571 -0.288 1.00 . A A . 10 ILE HG12 1 1 9 6031 1 1 13 ILE HG13 H -7.969 -8.020 -1.018 1.00 . A A . 10 ILE HG13 1 1 9 6032 1 1 13 ILE HG21 H -8.820 -9.453 -3.146 1.00 . A A . 10 ILE HG21 1 1 9 6033 1 1 13 ILE HG22 H -10.514 -9.944 -3.134 1.00 . A A . 10 ILE HG22 1 1 9 6034 1 1 13 ILE HG23 H -9.363 -10.723 -2.049 1.00 . A A . 10 ILE HG23 1 1 9 6035 1 1 13 ILE N N -9.128 -6.675 -2.592 1.00 . A A . 10 ILE N 1 1 9 6036 1 1 13 ILE O O -12.313 -6.885 -0.916 1.00 . A A . 10 ILE O 1 1 9 6037 1 1 14 LYS C C -10.776 -3.142 0.000 1.00 . A A . 11 LYS C 1 1 9 6038 1 1 14 LYS CA C -11.318 -4.548 0.174 1.00 . A A . 11 LYS CA 1 1 9 6039 1 1 14 LYS CB C -11.219 -4.962 1.649 1.00 . A A . 11 LYS CB 1 1 9 6040 1 1 14 LYS CD C -9.806 -5.113 3.736 1.00 . A A . 11 LYS CD 1 1 9 6041 1 1 14 LYS CE C -10.668 -4.151 4.540 1.00 . A A . 11 LYS CE 1 1 9 6042 1 1 14 LYS CG C -9.830 -4.781 2.250 1.00 . A A . 11 LYS CG 1 1 9 6043 1 1 14 LYS H H -9.664 -5.260 -0.924 1.00 . A A . 11 LYS H 1 1 9 6044 1 1 14 LYS HA H -12.355 -4.560 -0.129 1.00 . A A . 11 LYS HA 1 1 9 6045 1 1 14 LYS HB2 H -11.915 -4.369 2.222 1.00 . A A . 11 LYS HB2 1 1 9 6046 1 1 14 LYS HB3 H -11.492 -6.003 1.736 1.00 . A A . 11 LYS HB3 1 1 9 6047 1 1 14 LYS HD2 H -10.180 -6.117 3.875 1.00 . A A . 11 LYS HD2 1 1 9 6048 1 1 14 LYS HD3 H -8.788 -5.055 4.090 1.00 . A A . 11 LYS HD3 1 1 9 6049 1 1 14 LYS HE2 H -10.296 -3.148 4.394 1.00 . A A . 11 LYS HE2 1 1 9 6050 1 1 14 LYS HE3 H -11.684 -4.212 4.183 1.00 . A A . 11 LYS HE3 1 1 9 6051 1 1 14 LYS HG2 H -9.137 -5.429 1.739 1.00 . A A . 11 LYS HG2 1 1 9 6052 1 1 14 LYS HG3 H -9.524 -3.753 2.119 1.00 . A A . 11 LYS HG3 1 1 9 6053 1 1 14 LYS HZ1 H -9.692 -4.324 6.377 1.00 . A A . 11 LYS HZ1 1 1 9 6054 1 1 14 LYS HZ2 H -10.927 -5.454 6.145 1.00 . A A . 11 LYS HZ2 1 1 9 6055 1 1 14 LYS HZ3 H -11.311 -3.849 6.500 1.00 . A A . 11 LYS HZ3 1 1 9 6056 1 1 14 LYS N N -10.590 -5.465 -0.690 1.00 . A A . 11 LYS N 1 1 9 6057 1 1 14 LYS NZ N -10.647 -4.466 5.991 1.00 . A A . 11 LYS NZ 1 1 9 6058 1 1 14 LYS O O -9.779 -2.942 -0.706 1.00 . A A . 11 LYS O 1 1 9 6059 1 1 15 GLU C C -9.593 -0.607 1.087 1.00 . A A . 12 GLU C 1 1 9 6060 1 1 15 GLU CA C -11.010 -0.788 0.572 1.00 . A A . 12 GLU CA 1 1 9 6061 1 1 15 GLU CB C -11.948 0.109 1.380 1.00 . A A . 12 GLU CB 1 1 9 6062 1 1 15 GLU CD C -14.214 -0.995 1.243 1.00 . A A . 12 GLU CD 1 1 9 6063 1 1 15 GLU CG C -13.356 0.182 0.828 1.00 . A A . 12 GLU CG 1 1 9 6064 1 1 15 GLU H H -12.231 -2.410 1.153 1.00 . A A . 12 GLU H 1 1 9 6065 1 1 15 GLU HA H -11.043 -0.482 -0.463 1.00 . A A . 12 GLU HA 1 1 9 6066 1 1 15 GLU HB2 H -12.001 -0.267 2.391 1.00 . A A . 12 GLU HB2 1 1 9 6067 1 1 15 GLU HB3 H -11.540 1.108 1.399 1.00 . A A . 12 GLU HB3 1 1 9 6068 1 1 15 GLU HG2 H -13.818 1.090 1.182 1.00 . A A . 12 GLU HG2 1 1 9 6069 1 1 15 GLU HG3 H -13.298 0.207 -0.250 1.00 . A A . 12 GLU HG3 1 1 9 6070 1 1 15 GLU N N -11.429 -2.180 0.636 1.00 . A A . 12 GLU N 1 1 9 6071 1 1 15 GLU O O -9.031 -1.476 1.761 1.00 . A A . 12 GLU O 1 1 9 6072 1 1 15 GLU OE1 O -14.226 -2.013 0.523 1.00 . A A . 12 GLU OE1 1 1 9 6073 1 1 15 GLU OE2 O -14.882 -0.905 2.295 1.00 . A A . 12 GLU OE2 1 1 9 6074 1 1 16 PHE C C -7.721 1.559 2.544 1.00 . A A . 13 PHE C 1 1 9 6075 1 1 16 PHE CA C -7.684 0.868 1.185 1.00 . A A . 13 PHE CA 1 1 9 6076 1 1 16 PHE CB C -7.002 1.768 0.149 1.00 . A A . 13 PHE CB 1 1 9 6077 1 1 16 PHE CD1 C -8.523 3.643 -0.552 1.00 . A A . 13 PHE CD1 1 1 9 6078 1 1 16 PHE CD2 C -6.751 4.127 0.970 1.00 . A A . 13 PHE CD2 1 1 9 6079 1 1 16 PHE CE1 C -8.917 4.965 -0.519 1.00 . A A . 13 PHE CE1 1 1 9 6080 1 1 16 PHE CE2 C -7.141 5.451 1.008 1.00 . A A . 13 PHE CE2 1 1 9 6081 1 1 16 PHE CG C -7.438 3.207 0.191 1.00 . A A . 13 PHE CG 1 1 9 6082 1 1 16 PHE CZ C -8.226 5.872 0.262 1.00 . A A . 13 PHE CZ 1 1 9 6083 1 1 16 PHE H H -9.531 1.169 0.202 1.00 . A A . 13 PHE H 1 1 9 6084 1 1 16 PHE HA H -7.127 -0.052 1.277 1.00 . A A . 13 PHE HA 1 1 9 6085 1 1 16 PHE HB2 H -5.936 1.742 0.307 1.00 . A A . 13 PHE HB2 1 1 9 6086 1 1 16 PHE HB3 H -7.218 1.387 -0.839 1.00 . A A . 13 PHE HB3 1 1 9 6087 1 1 16 PHE HD1 H -9.064 2.934 -1.163 1.00 . A A . 13 PHE HD1 1 1 9 6088 1 1 16 PHE HD2 H -5.904 3.795 1.556 1.00 . A A . 13 PHE HD2 1 1 9 6089 1 1 16 PHE HE1 H -9.764 5.292 -1.105 1.00 . A A . 13 PHE HE1 1 1 9 6090 1 1 16 PHE HE2 H -6.599 6.157 1.618 1.00 . A A . 13 PHE HE2 1 1 9 6091 1 1 16 PHE HZ H -8.530 6.906 0.288 1.00 . A A . 13 PHE HZ 1 1 9 6092 1 1 16 PHE N N -9.028 0.533 0.757 1.00 . A A . 13 PHE N 1 1 9 6093 1 1 16 PHE O O -8.731 2.163 2.921 1.00 . A A . 13 PHE O 1 1 9 6094 1 1 17 LYS C C -5.158 2.802 4.686 1.00 . A A . 14 LYS C 1 1 9 6095 1 1 17 LYS CA C -6.503 2.087 4.571 1.00 . A A . 14 LYS CA 1 1 9 6096 1 1 17 LYS CB C -6.653 1.018 5.658 1.00 . A A . 14 LYS CB 1 1 9 6097 1 1 17 LYS CD C -6.877 0.474 8.099 1.00 . A A . 14 LYS CD 1 1 9 6098 1 1 17 LYS CE C -6.847 1.025 9.517 1.00 . A A . 14 LYS CE 1 1 9 6099 1 1 17 LYS CG C -6.513 1.539 7.079 1.00 . A A . 14 LYS CG 1 1 9 6100 1 1 17 LYS H H -5.862 0.952 2.915 1.00 . A A . 14 LYS H 1 1 9 6101 1 1 17 LYS HA H -7.297 2.812 4.670 1.00 . A A . 14 LYS HA 1 1 9 6102 1 1 17 LYS HB2 H -7.629 0.565 5.561 1.00 . A A . 14 LYS HB2 1 1 9 6103 1 1 17 LYS HB3 H -5.902 0.261 5.500 1.00 . A A . 14 LYS HB3 1 1 9 6104 1 1 17 LYS HD2 H -7.871 0.112 7.887 1.00 . A A . 14 LYS HD2 1 1 9 6105 1 1 17 LYS HD3 H -6.172 -0.341 8.024 1.00 . A A . 14 LYS HD3 1 1 9 6106 1 1 17 LYS HE2 H -7.088 0.229 10.206 1.00 . A A . 14 LYS HE2 1 1 9 6107 1 1 17 LYS HE3 H -5.853 1.392 9.727 1.00 . A A . 14 LYS HE3 1 1 9 6108 1 1 17 LYS HG2 H -5.486 1.834 7.240 1.00 . A A . 14 LYS HG2 1 1 9 6109 1 1 17 LYS HG3 H -7.162 2.392 7.209 1.00 . A A . 14 LYS HG3 1 1 9 6110 1 1 17 LYS HZ1 H -7.566 2.942 9.100 1.00 . A A . 14 LYS HZ1 1 1 9 6111 1 1 17 LYS HZ2 H -7.830 2.445 10.694 1.00 . A A . 14 LYS HZ2 1 1 9 6112 1 1 17 LYS HZ3 H -8.780 1.816 9.445 1.00 . A A . 14 LYS HZ3 1 1 9 6113 1 1 17 LYS N N -6.623 1.465 3.267 1.00 . A A . 14 LYS N 1 1 9 6114 1 1 17 LYS NZ N -7.822 2.134 9.703 1.00 . A A . 14 LYS NZ 1 1 9 6115 1 1 17 LYS O O -4.966 3.667 5.540 1.00 . A A . 14 LYS O 1 1 9 6116 1 1 18 TYR C C -2.578 3.585 2.428 1.00 . A A . 15 TYR C 1 1 9 6117 1 1 18 TYR CA C -2.900 3.015 3.800 1.00 . A A . 15 TYR CA 1 1 9 6118 1 1 18 TYR CB C -1.855 1.950 4.152 1.00 . A A . 15 TYR CB 1 1 9 6119 1 1 18 TYR CD1 C -3.004 0.586 5.933 1.00 . A A . 15 TYR CD1 1 1 9 6120 1 1 18 TYR CD2 C -0.983 1.706 6.496 1.00 . A A . 15 TYR CD2 1 1 9 6121 1 1 18 TYR CE1 C -3.090 0.082 7.214 1.00 . A A . 15 TYR CE1 1 1 9 6122 1 1 18 TYR CE2 C -1.060 1.206 7.779 1.00 . A A . 15 TYR CE2 1 1 9 6123 1 1 18 TYR CG C -1.953 1.406 5.555 1.00 . A A . 15 TYR CG 1 1 9 6124 1 1 18 TYR CZ C -2.114 0.396 8.134 1.00 . A A . 15 TYR CZ 1 1 9 6125 1 1 18 TYR H H -4.465 1.775 3.121 1.00 . A A . 15 TYR H 1 1 9 6126 1 1 18 TYR HA H -2.865 3.806 4.533 1.00 . A A . 15 TYR HA 1 1 9 6127 1 1 18 TYR HB2 H -1.965 1.117 3.473 1.00 . A A . 15 TYR HB2 1 1 9 6128 1 1 18 TYR HB3 H -0.869 2.375 4.028 1.00 . A A . 15 TYR HB3 1 1 9 6129 1 1 18 TYR HD1 H -3.768 0.345 5.207 1.00 . A A . 15 TYR HD1 1 1 9 6130 1 1 18 TYR HD2 H -0.156 2.341 6.215 1.00 . A A . 15 TYR HD2 1 1 9 6131 1 1 18 TYR HE1 H -3.918 -0.555 7.487 1.00 . A A . 15 TYR HE1 1 1 9 6132 1 1 18 TYR HE2 H -0.292 1.449 8.498 1.00 . A A . 15 TYR HE2 1 1 9 6133 1 1 18 TYR HH H -1.833 0.552 10.029 1.00 . A A . 15 TYR HH 1 1 9 6134 1 1 18 TYR N N -4.238 2.443 3.804 1.00 . A A . 15 TYR N 1 1 9 6135 1 1 18 TYR O O -3.400 3.525 1.514 1.00 . A A . 15 TYR O 1 1 9 6136 1 1 18 TYR OH O -2.188 -0.102 9.413 1.00 . A A . 15 TYR OH 1 1 9 6137 1 1 19 LYS C C 0.601 4.907 1.134 1.00 . A A . 16 LYS C 1 1 9 6138 1 1 19 LYS CA C -0.891 4.642 1.024 1.00 . A A . 16 LYS CA 1 1 9 6139 1 1 19 LYS CB C -1.629 5.927 0.634 1.00 . A A . 16 LYS CB 1 1 9 6140 1 1 19 LYS CD C -2.107 7.654 -1.137 1.00 . A A . 16 LYS CD 1 1 9 6141 1 1 19 LYS CE C -1.974 8.811 -0.157 1.00 . A A . 16 LYS CE 1 1 9 6142 1 1 19 LYS CG C -1.240 6.469 -0.737 1.00 . A A . 16 LYS CG 1 1 9 6143 1 1 19 LYS H H -0.783 4.162 3.077 1.00 . A A . 16 LYS H 1 1 9 6144 1 1 19 LYS HA H -1.059 3.888 0.267 1.00 . A A . 16 LYS HA 1 1 9 6145 1 1 19 LYS HB2 H -2.691 5.733 0.632 1.00 . A A . 16 LYS HB2 1 1 9 6146 1 1 19 LYS HB3 H -1.413 6.686 1.371 1.00 . A A . 16 LYS HB3 1 1 9 6147 1 1 19 LYS HD2 H -1.805 7.993 -2.116 1.00 . A A . 16 LYS HD2 1 1 9 6148 1 1 19 LYS HD3 H -3.139 7.337 -1.167 1.00 . A A . 16 LYS HD3 1 1 9 6149 1 1 19 LYS HE2 H -2.643 9.599 -0.464 1.00 . A A . 16 LYS HE2 1 1 9 6150 1 1 19 LYS HE3 H -2.254 8.465 0.825 1.00 . A A . 16 LYS HE3 1 1 9 6151 1 1 19 LYS HG2 H -0.207 6.788 -0.715 1.00 . A A . 16 LYS HG2 1 1 9 6152 1 1 19 LYS HG3 H -1.359 5.686 -1.470 1.00 . A A . 16 LYS HG3 1 1 9 6153 1 1 19 LYS HZ1 H -0.294 9.669 -1.049 1.00 . A A . 16 LYS HZ1 1 1 9 6154 1 1 19 LYS HZ2 H 0.071 8.616 0.222 1.00 . A A . 16 LYS HZ2 1 1 9 6155 1 1 19 LYS HZ3 H -0.542 10.154 0.550 1.00 . A A . 16 LYS HZ3 1 1 9 6156 1 1 19 LYS N N -1.375 4.121 2.292 1.00 . A A . 16 LYS N 1 1 9 6157 1 1 19 LYS NZ N -0.590 9.347 -0.107 1.00 . A A . 16 LYS NZ 1 1 9 6158 1 1 19 LYS O O 1.013 5.922 1.691 1.00 . A A . 16 LYS O 1 1 9 6159 1 1 20 CYS C C 3.365 5.425 0.239 1.00 . A A . 17 CYS C 1 1 9 6160 1 1 20 CYS CA C 2.851 4.067 0.712 1.00 . A A . 17 CYS CA 1 1 9 6161 1 1 20 CYS CB C 3.511 2.963 -0.114 1.00 . A A . 17 CYS CB 1 1 9 6162 1 1 20 CYS H H 0.994 3.203 0.173 1.00 . A A . 17 CYS H 1 1 9 6163 1 1 20 CYS HA H 3.122 3.936 1.747 1.00 . A A . 17 CYS HA 1 1 9 6164 1 1 20 CYS HB2 H 3.228 2.004 0.291 1.00 . A A . 17 CYS HB2 1 1 9 6165 1 1 20 CYS HB3 H 3.181 3.034 -1.138 1.00 . A A . 17 CYS HB3 1 1 9 6166 1 1 20 CYS N N 1.398 3.975 0.622 1.00 . A A . 17 CYS N 1 1 9 6167 1 1 20 CYS O O 3.052 5.864 -0.865 1.00 . A A . 17 CYS O 1 1 9 6168 1 1 20 CYS SG S 5.316 3.063 -0.103 1.00 . A A . 17 CYS SG 1 1 9 6169 1 1 21 PRO C C 5.639 7.386 -0.487 1.00 . A A . 18 PRO C 1 1 9 6170 1 1 21 PRO CA C 4.759 7.408 0.759 1.00 . A A . 18 PRO CA 1 1 9 6171 1 1 21 PRO CB C 5.607 7.750 1.991 1.00 . A A . 18 PRO CB 1 1 9 6172 1 1 21 PRO CD C 4.588 5.625 2.411 1.00 . A A . 18 PRO CD 1 1 9 6173 1 1 21 PRO CG C 5.792 6.466 2.721 1.00 . A A . 18 PRO CG 1 1 9 6174 1 1 21 PRO HA H 3.987 8.153 0.633 1.00 . A A . 18 PRO HA 1 1 9 6175 1 1 21 PRO HB2 H 6.556 8.157 1.673 1.00 . A A . 18 PRO HB2 1 1 9 6176 1 1 21 PRO HB3 H 5.085 8.476 2.598 1.00 . A A . 18 PRO HB3 1 1 9 6177 1 1 21 PRO HD2 H 4.859 4.580 2.389 1.00 . A A . 18 PRO HD2 1 1 9 6178 1 1 21 PRO HD3 H 3.808 5.802 3.136 1.00 . A A . 18 PRO HD3 1 1 9 6179 1 1 21 PRO HG2 H 6.690 5.975 2.376 1.00 . A A . 18 PRO HG2 1 1 9 6180 1 1 21 PRO HG3 H 5.853 6.654 3.783 1.00 . A A . 18 PRO HG3 1 1 9 6181 1 1 21 PRO N N 4.183 6.093 1.075 1.00 . A A . 18 PRO N 1 1 9 6182 1 1 21 PRO O O 5.904 8.424 -1.088 1.00 . A A . 18 PRO O 1 1 9 6183 1 1 22 ARG C C 6.136 5.583 -3.250 1.00 . A A . 19 ARG C 1 1 9 6184 1 1 22 ARG CA C 6.940 6.057 -2.048 1.00 . A A . 19 ARG CA 1 1 9 6185 1 1 22 ARG CB C 8.074 5.067 -1.788 1.00 . A A . 19 ARG CB 1 1 9 6186 1 1 22 ARG CD C 10.335 4.630 -0.804 1.00 . A A . 19 ARG CD 1 1 9 6187 1 1 22 ARG CG C 9.163 5.595 -0.871 1.00 . A A . 19 ARG CG 1 1 9 6188 1 1 22 ARG CZ C 11.949 4.134 -2.615 1.00 . A A . 19 ARG CZ 1 1 9 6189 1 1 22 ARG H H 5.860 5.407 -0.344 1.00 . A A . 19 ARG H 1 1 9 6190 1 1 22 ARG HA H 7.365 7.024 -2.271 1.00 . A A . 19 ARG HA 1 1 9 6191 1 1 22 ARG HB2 H 7.661 4.176 -1.341 1.00 . A A . 19 ARG HB2 1 1 9 6192 1 1 22 ARG HB3 H 8.526 4.807 -2.733 1.00 . A A . 19 ARG HB3 1 1 9 6193 1 1 22 ARG HD2 H 11.180 5.139 -0.369 1.00 . A A . 19 ARG HD2 1 1 9 6194 1 1 22 ARG HD3 H 10.058 3.793 -0.178 1.00 . A A . 19 ARG HD3 1 1 9 6195 1 1 22 ARG HE H 9.992 3.748 -2.682 1.00 . A A . 19 ARG HE 1 1 9 6196 1 1 22 ARG HG2 H 9.509 6.547 -1.244 1.00 . A A . 19 ARG HG2 1 1 9 6197 1 1 22 ARG HG3 H 8.754 5.720 0.122 1.00 . A A . 19 ARG HG3 1 1 9 6198 1 1 22 ARG HH11 H 12.789 5.021 -0.995 1.00 . A A . 19 ARG HH11 1 1 9 6199 1 1 22 ARG HH12 H 13.882 4.649 -2.288 1.00 . A A . 19 ARG HH12 1 1 9 6200 1 1 22 ARG HH21 H 11.429 3.243 -4.358 1.00 . A A . 19 ARG HH21 1 1 9 6201 1 1 22 ARG HH22 H 13.112 3.632 -4.196 1.00 . A A . 19 ARG HH22 1 1 9 6202 1 1 22 ARG N N 6.097 6.201 -0.869 1.00 . A A . 19 ARG N 1 1 9 6203 1 1 22 ARG NE N 10.711 4.128 -2.126 1.00 . A A . 19 ARG NE 1 1 9 6204 1 1 22 ARG NH1 N 12.953 4.640 -1.909 1.00 . A A . 19 ARG NH1 1 1 9 6205 1 1 22 ARG NH2 N 12.182 3.630 -3.820 1.00 . A A . 19 ARG NH2 1 1 9 6206 1 1 22 ARG O O 6.236 6.144 -4.341 1.00 . A A . 19 ARG O 1 1 9 6207 1 1 23 CYS C C 3.297 4.523 -4.443 1.00 . A A . 20 CYS C 1 1 9 6208 1 1 23 CYS CA C 4.649 3.892 -4.145 1.00 . A A . 20 CYS CA 1 1 9 6209 1 1 23 CYS CB C 4.469 2.407 -3.829 1.00 . A A . 20 CYS CB 1 1 9 6210 1 1 23 CYS H H 5.177 4.243 -2.127 1.00 . A A . 20 CYS H 1 1 9 6211 1 1 23 CYS HA H 5.272 3.992 -5.015 1.00 . A A . 20 CYS HA 1 1 9 6212 1 1 23 CYS HB2 H 3.837 2.307 -2.961 1.00 . A A . 20 CYS HB2 1 1 9 6213 1 1 23 CYS HB3 H 3.996 1.922 -4.670 1.00 . A A . 20 CYS HB3 1 1 9 6214 1 1 23 CYS N N 5.326 4.556 -3.041 1.00 . A A . 20 CYS N 1 1 9 6215 1 1 23 CYS O O 2.771 4.391 -5.547 1.00 . A A . 20 CYS O 1 1 9 6216 1 1 23 CYS SG S 6.008 1.530 -3.482 1.00 . A A . 20 CYS SG 1 1 9 6217 1 1 24 LEU C C 0.339 4.766 -3.721 1.00 . A A . 21 LEU C 1 1 9 6218 1 1 24 LEU CA C 1.423 5.816 -3.519 1.00 . A A . 21 LEU CA 1 1 9 6219 1 1 24 LEU CB C 1.354 6.878 -4.624 1.00 . A A . 21 LEU CB 1 1 9 6220 1 1 24 LEU CD1 C 1.945 9.207 -5.317 1.00 . A A . 21 LEU CD1 1 1 9 6221 1 1 24 LEU CD2 C 2.700 8.354 -3.092 1.00 . A A . 21 LEU CD2 1 1 9 6222 1 1 24 LEU CG C 2.405 7.989 -4.539 1.00 . A A . 21 LEU CG 1 1 9 6223 1 1 24 LEU H H 3.259 5.308 -2.611 1.00 . A A . 21 LEU H 1 1 9 6224 1 1 24 LEU HA H 1.244 6.301 -2.570 1.00 . A A . 21 LEU HA 1 1 9 6225 1 1 24 LEU HB2 H 1.465 6.379 -5.576 1.00 . A A . 21 LEU HB2 1 1 9 6226 1 1 24 LEU HB3 H 0.377 7.335 -4.590 1.00 . A A . 21 LEU HB3 1 1 9 6227 1 1 24 LEU HD11 H 1.020 9.573 -4.893 1.00 . A A . 21 LEU HD11 1 1 9 6228 1 1 24 LEU HD12 H 1.786 8.937 -6.351 1.00 . A A . 21 LEU HD12 1 1 9 6229 1 1 24 LEU HD13 H 2.697 9.979 -5.258 1.00 . A A . 21 LEU HD13 1 1 9 6230 1 1 24 LEU HD21 H 3.151 7.505 -2.597 1.00 . A A . 21 LEU HD21 1 1 9 6231 1 1 24 LEU HD22 H 1.780 8.619 -2.591 1.00 . A A . 21 LEU HD22 1 1 9 6232 1 1 24 LEU HD23 H 3.381 9.191 -3.063 1.00 . A A . 21 LEU HD23 1 1 9 6233 1 1 24 LEU HG H 3.324 7.639 -4.989 1.00 . A A . 21 LEU HG 1 1 9 6234 1 1 24 LEU N N 2.748 5.200 -3.442 1.00 . A A . 21 LEU N 1 1 9 6235 1 1 24 LEU O O -0.804 5.091 -4.040 1.00 . A A . 21 LEU O 1 1 9 6236 1 1 25 VAL C C -1.071 2.369 -2.342 1.00 . A A . 22 VAL C 1 1 9 6237 1 1 25 VAL CA C -0.243 2.422 -3.615 1.00 . A A . 22 VAL CA 1 1 9 6238 1 1 25 VAL CB C 0.448 1.059 -3.882 1.00 . A A . 22 VAL CB 1 1 9 6239 1 1 25 VAL CG1 C 1.399 0.673 -2.758 1.00 . A A . 22 VAL CG1 1 1 9 6240 1 1 25 VAL CG2 C -0.587 -0.033 -4.102 1.00 . A A . 22 VAL CG2 1 1 9 6241 1 1 25 VAL H H 1.627 3.310 -3.295 1.00 . A A . 22 VAL H 1 1 9 6242 1 1 25 VAL HA H -0.903 2.636 -4.444 1.00 . A A . 22 VAL HA 1 1 9 6243 1 1 25 VAL HB H 1.029 1.151 -4.789 1.00 . A A . 22 VAL HB 1 1 9 6244 1 1 25 VAL HG11 H 1.909 -0.245 -3.014 1.00 . A A . 22 VAL HG11 1 1 9 6245 1 1 25 VAL HG12 H 0.837 0.529 -1.848 1.00 . A A . 22 VAL HG12 1 1 9 6246 1 1 25 VAL HG13 H 2.124 1.459 -2.612 1.00 . A A . 22 VAL HG13 1 1 9 6247 1 1 25 VAL HG21 H -0.086 -0.972 -4.283 1.00 . A A . 22 VAL HG21 1 1 9 6248 1 1 25 VAL HG22 H -1.199 0.219 -4.955 1.00 . A A . 22 VAL HG22 1 1 9 6249 1 1 25 VAL HG23 H -1.209 -0.119 -3.224 1.00 . A A . 22 VAL HG23 1 1 9 6250 1 1 25 VAL N N 0.704 3.507 -3.520 1.00 . A A . 22 VAL N 1 1 9 6251 1 1 25 VAL O O -0.537 2.272 -1.231 1.00 . A A . 22 VAL O 1 1 9 6252 1 1 26 GLN C C -3.552 1.066 -0.943 1.00 . A A . 23 GLN C 1 1 9 6253 1 1 26 GLN CA C -3.283 2.495 -1.390 1.00 . A A . 23 GLN CA 1 1 9 6254 1 1 26 GLN CB C -4.571 3.222 -1.772 1.00 . A A . 23 GLN CB 1 1 9 6255 1 1 26 GLN CD C -5.607 5.440 -2.469 1.00 . A A . 23 GLN CD 1 1 9 6256 1 1 26 GLN CG C -4.336 4.680 -2.142 1.00 . A A . 23 GLN CG 1 1 9 6257 1 1 26 GLN H H -2.717 2.614 -3.417 1.00 . A A . 23 GLN H 1 1 9 6258 1 1 26 GLN HA H -2.812 3.024 -0.574 1.00 . A A . 23 GLN HA 1 1 9 6259 1 1 26 GLN HB2 H -5.020 2.721 -2.618 1.00 . A A . 23 GLN HB2 1 1 9 6260 1 1 26 GLN HB3 H -5.255 3.189 -0.938 1.00 . A A . 23 GLN HB3 1 1 9 6261 1 1 26 GLN HE21 H -6.454 3.803 -3.204 1.00 . A A . 23 GLN HE21 1 1 9 6262 1 1 26 GLN HE22 H -7.423 5.236 -3.244 1.00 . A A . 23 GLN HE22 1 1 9 6263 1 1 26 GLN HG2 H -3.852 5.171 -1.311 1.00 . A A . 23 GLN HG2 1 1 9 6264 1 1 26 GLN HG3 H -3.683 4.715 -3.002 1.00 . A A . 23 GLN HG3 1 1 9 6265 1 1 26 GLN N N -2.365 2.502 -2.509 1.00 . A A . 23 GLN N 1 1 9 6266 1 1 26 GLN NE2 N -6.592 4.756 -3.028 1.00 . A A . 23 GLN NE2 1 1 9 6267 1 1 26 GLN O O -4.327 0.332 -1.560 1.00 . A A . 23 GLN O 1 1 9 6268 1 1 26 GLN OE1 O -5.696 6.645 -2.234 1.00 . A A . 23 GLN OE1 1 1 9 6269 1 1 27 THR C C -4.040 -0.795 1.702 1.00 . A A . 24 THR C 1 1 9 6270 1 1 27 THR CA C -2.953 -0.677 0.638 1.00 . A A . 24 THR CA 1 1 9 6271 1 1 27 THR CB C -1.597 -1.090 1.236 1.00 . A A . 24 THR CB 1 1 9 6272 1 1 27 THR CG2 C -0.597 -1.428 0.144 1.00 . A A . 24 THR CG2 1 1 9 6273 1 1 27 THR H H -2.312 1.325 0.590 1.00 . A A . 24 THR H 1 1 9 6274 1 1 27 THR HA H -3.183 -1.341 -0.181 1.00 . A A . 24 THR HA 1 1 9 6275 1 1 27 THR HB H -1.742 -1.964 1.856 1.00 . A A . 24 THR HB 1 1 9 6276 1 1 27 THR HG1 H -0.279 -0.321 2.496 1.00 . A A . 24 THR HG1 1 1 9 6277 1 1 27 THR HG21 H 0.330 -1.752 0.595 1.00 . A A . 24 THR HG21 1 1 9 6278 1 1 27 THR HG22 H -0.415 -0.554 -0.465 1.00 . A A . 24 THR HG22 1 1 9 6279 1 1 27 THR HG23 H -0.993 -2.221 -0.472 1.00 . A A . 24 THR HG23 1 1 9 6280 1 1 27 THR N N -2.878 0.675 0.123 1.00 . A A . 24 THR N 1 1 9 6281 1 1 27 THR O O -4.480 0.201 2.267 1.00 . A A . 24 THR O 1 1 9 6282 1 1 27 THR OG1 O -1.083 -0.027 2.041 1.00 . A A . 24 THR OG1 1 1 9 6283 1 1 28 CYS C C -4.954 -2.485 4.316 1.00 . A A . 25 CYS C 1 1 9 6284 1 1 28 CYS CA C -5.539 -2.265 2.927 1.00 . A A . 25 CYS CA 1 1 9 6285 1 1 28 CYS CB C -6.369 -3.486 2.511 1.00 . A A . 25 CYS CB 1 1 9 6286 1 1 28 CYS H H -4.086 -2.773 1.479 1.00 . A A . 25 CYS H 1 1 9 6287 1 1 28 CYS HA H -6.177 -1.395 2.949 1.00 . A A . 25 CYS HA 1 1 9 6288 1 1 28 CYS HB2 H -7.236 -3.567 3.145 1.00 . A A . 25 CYS HB2 1 1 9 6289 1 1 28 CYS HB3 H -6.693 -3.356 1.494 1.00 . A A . 25 CYS HB3 1 1 9 6290 1 1 28 CYS N N -4.478 -2.019 1.958 1.00 . A A . 25 CYS N 1 1 9 6291 1 1 28 CYS O O -5.647 -2.341 5.320 1.00 . A A . 25 CYS O 1 1 9 6292 1 1 28 CYS SG S -5.472 -5.051 2.602 1.00 . A A . 25 CYS SG 1 1 9 6293 1 1 29 SER C C -1.519 -2.972 5.513 1.00 . A A . 26 SER C 1 1 9 6294 1 1 29 SER CA C -3.024 -3.131 5.631 1.00 . A A . 26 SER CA 1 1 9 6295 1 1 29 SER CB C -3.345 -4.563 6.058 1.00 . A A . 26 SER CB 1 1 9 6296 1 1 29 SER H H -3.153 -2.889 3.537 1.00 . A A . 26 SER H 1 1 9 6297 1 1 29 SER HA H -3.399 -2.441 6.375 1.00 . A A . 26 SER HA 1 1 9 6298 1 1 29 SER HB2 H -2.788 -4.804 6.952 1.00 . A A . 26 SER HB2 1 1 9 6299 1 1 29 SER HB3 H -4.398 -4.653 6.256 1.00 . A A . 26 SER HB3 1 1 9 6300 1 1 29 SER HG H -3.692 -6.136 4.933 1.00 . A A . 26 SER HG 1 1 9 6301 1 1 29 SER N N -3.673 -2.833 4.366 1.00 . A A . 26 SER N 1 1 9 6302 1 1 29 SER O O -0.998 -2.728 4.418 1.00 . A A . 26 SER O 1 1 9 6303 1 1 29 SER OG O -2.988 -5.482 5.035 1.00 . A A . 26 SER OG 1 1 9 6304 1 1 30 LEU C C 1.123 -4.394 5.871 1.00 . A A . 27 LEU C 1 1 9 6305 1 1 30 LEU CA C 0.633 -3.159 6.618 1.00 . A A . 27 LEU CA 1 1 9 6306 1 1 30 LEU CB C 1.200 -3.144 8.040 1.00 . A A . 27 LEU CB 1 1 9 6307 1 1 30 LEU CD1 C 1.562 -1.970 10.222 1.00 . A A . 27 LEU CD1 1 1 9 6308 1 1 30 LEU CD2 C 1.775 -0.705 8.083 1.00 . A A . 27 LEU CD2 1 1 9 6309 1 1 30 LEU CG C 1.041 -1.826 8.801 1.00 . A A . 27 LEU CG 1 1 9 6310 1 1 30 LEU H H -1.296 -3.219 7.488 1.00 . A A . 27 LEU H 1 1 9 6311 1 1 30 LEU HA H 0.975 -2.280 6.093 1.00 . A A . 27 LEU HA 1 1 9 6312 1 1 30 LEU HB2 H 0.712 -3.923 8.606 1.00 . A A . 27 LEU HB2 1 1 9 6313 1 1 30 LEU HB3 H 2.252 -3.372 7.984 1.00 . A A . 27 LEU HB3 1 1 9 6314 1 1 30 LEU HD11 H 2.610 -2.229 10.197 1.00 . A A . 27 LEU HD11 1 1 9 6315 1 1 30 LEU HD12 H 1.011 -2.749 10.731 1.00 . A A . 27 LEU HD12 1 1 9 6316 1 1 30 LEU HD13 H 1.435 -1.036 10.748 1.00 . A A . 27 LEU HD13 1 1 9 6317 1 1 30 LEU HD21 H 1.689 0.207 8.657 1.00 . A A . 27 LEU HD21 1 1 9 6318 1 1 30 LEU HD22 H 1.340 -0.556 7.106 1.00 . A A . 27 LEU HD22 1 1 9 6319 1 1 30 LEU HD23 H 2.817 -0.965 7.978 1.00 . A A . 27 LEU HD23 1 1 9 6320 1 1 30 LEU HG H -0.008 -1.567 8.851 1.00 . A A . 27 LEU HG 1 1 9 6321 1 1 30 LEU N N -0.821 -3.128 6.631 1.00 . A A . 27 LEU N 1 1 9 6322 1 1 30 LEU O O 2.218 -4.395 5.313 1.00 . A A . 27 LEU O 1 1 9 6323 1 1 31 GLU C C 0.865 -6.383 3.656 1.00 . A A . 28 GLU C 1 1 9 6324 1 1 31 GLU CA C 0.632 -6.666 5.134 1.00 . A A . 28 GLU CA 1 1 9 6325 1 1 31 GLU CB C -0.478 -7.708 5.292 1.00 . A A . 28 GLU CB 1 1 9 6326 1 1 31 GLU CD C -1.345 -9.984 4.615 1.00 . A A . 28 GLU CD 1 1 9 6327 1 1 31 GLU CG C -0.200 -8.998 4.537 1.00 . A A . 28 GLU CG 1 1 9 6328 1 1 31 GLU H H -0.571 -5.374 6.311 1.00 . A A . 28 GLU H 1 1 9 6329 1 1 31 GLU HA H 1.544 -7.053 5.562 1.00 . A A . 28 GLU HA 1 1 9 6330 1 1 31 GLU HB2 H -0.589 -7.945 6.341 1.00 . A A . 28 GLU HB2 1 1 9 6331 1 1 31 GLU HB3 H -1.404 -7.291 4.925 1.00 . A A . 28 GLU HB3 1 1 9 6332 1 1 31 GLU HG2 H -0.025 -8.758 3.498 1.00 . A A . 28 GLU HG2 1 1 9 6333 1 1 31 GLU HG3 H 0.683 -9.460 4.952 1.00 . A A . 28 GLU HG3 1 1 9 6334 1 1 31 GLU N N 0.292 -5.435 5.841 1.00 . A A . 28 GLU N 1 1 9 6335 1 1 31 GLU O O 1.872 -6.792 3.082 1.00 . A A . 28 GLU O 1 1 9 6336 1 1 31 GLU OE1 O -2.311 -9.846 3.837 1.00 . A A . 28 GLU OE1 1 1 9 6337 1 1 31 GLU OE2 O -1.281 -10.909 5.449 1.00 . A A . 28 GLU OE2 1 1 9 6338 1 1 32 CYS C C 1.065 -4.196 1.444 1.00 . A A . 29 CYS C 1 1 9 6339 1 1 32 CYS CA C 0.044 -5.310 1.652 1.00 . A A . 29 CYS CA 1 1 9 6340 1 1 32 CYS CB C -1.326 -4.909 1.119 1.00 . A A . 29 CYS CB 1 1 9 6341 1 1 32 CYS H H -0.842 -5.356 3.561 1.00 . A A . 29 CYS H 1 1 9 6342 1 1 32 CYS HA H 0.380 -6.187 1.120 1.00 . A A . 29 CYS HA 1 1 9 6343 1 1 32 CYS HB2 H -1.819 -4.291 1.854 1.00 . A A . 29 CYS HB2 1 1 9 6344 1 1 32 CYS HB3 H -1.208 -4.346 0.210 1.00 . A A . 29 CYS HB3 1 1 9 6345 1 1 32 CYS N N -0.063 -5.660 3.051 1.00 . A A . 29 CYS N 1 1 9 6346 1 1 32 CYS O O 1.594 -4.021 0.349 1.00 . A A . 29 CYS O 1 1 9 6347 1 1 32 CYS SG S -2.411 -6.311 0.772 1.00 . A A . 29 CYS SG 1 1 9 6348 1 1 33 SER C C 3.750 -2.982 2.404 1.00 . A A . 30 SER C 1 1 9 6349 1 1 33 SER CA C 2.342 -2.395 2.440 1.00 . A A . 30 SER CA 1 1 9 6350 1 1 33 SER CB C 2.183 -1.448 3.628 1.00 . A A . 30 SER CB 1 1 9 6351 1 1 33 SER H H 0.886 -3.628 3.350 1.00 . A A . 30 SER H 1 1 9 6352 1 1 33 SER HA H 2.175 -1.844 1.527 1.00 . A A . 30 SER HA 1 1 9 6353 1 1 33 SER HB2 H 2.382 -1.984 4.544 1.00 . A A . 30 SER HB2 1 1 9 6354 1 1 33 SER HB3 H 2.881 -0.630 3.531 1.00 . A A . 30 SER HB3 1 1 9 6355 1 1 33 SER HG H 0.293 -1.539 4.151 1.00 . A A . 30 SER HG 1 1 9 6356 1 1 33 SER N N 1.351 -3.456 2.506 1.00 . A A . 30 SER N 1 1 9 6357 1 1 33 SER O O 4.618 -2.482 1.699 1.00 . A A . 30 SER O 1 1 9 6358 1 1 33 SER OG O 0.867 -0.922 3.681 1.00 . A A . 30 SER OG 1 1 9 6359 1 1 34 LYS C C 5.361 -5.702 1.993 1.00 . A A . 31 LYS C 1 1 9 6360 1 1 34 LYS CA C 5.272 -4.718 3.155 1.00 . A A . 31 LYS CA 1 1 9 6361 1 1 34 LYS CB C 5.522 -5.437 4.487 1.00 . A A . 31 LYS CB 1 1 9 6362 1 1 34 LYS CD C 4.837 -7.223 6.112 1.00 . A A . 31 LYS CD 1 1 9 6363 1 1 34 LYS CE C 4.030 -8.494 6.312 1.00 . A A . 31 LYS CE 1 1 9 6364 1 1 34 LYS CG C 4.638 -6.649 4.719 1.00 . A A . 31 LYS CG 1 1 9 6365 1 1 34 LYS H H 3.253 -4.404 3.730 1.00 . A A . 31 LYS H 1 1 9 6366 1 1 34 LYS HA H 6.025 -3.958 3.020 1.00 . A A . 31 LYS HA 1 1 9 6367 1 1 34 LYS HB2 H 6.552 -5.762 4.517 1.00 . A A . 31 LYS HB2 1 1 9 6368 1 1 34 LYS HB3 H 5.354 -4.738 5.293 1.00 . A A . 31 LYS HB3 1 1 9 6369 1 1 34 LYS HD2 H 5.884 -7.448 6.251 1.00 . A A . 31 LYS HD2 1 1 9 6370 1 1 34 LYS HD3 H 4.525 -6.489 6.841 1.00 . A A . 31 LYS HD3 1 1 9 6371 1 1 34 LYS HE2 H 3.006 -8.305 6.032 1.00 . A A . 31 LYS HE2 1 1 9 6372 1 1 34 LYS HE3 H 4.439 -9.266 5.677 1.00 . A A . 31 LYS HE3 1 1 9 6373 1 1 34 LYS HG2 H 3.605 -6.357 4.604 1.00 . A A . 31 LYS HG2 1 1 9 6374 1 1 34 LYS HG3 H 4.884 -7.407 3.989 1.00 . A A . 31 LYS HG3 1 1 9 6375 1 1 34 LYS HZ1 H 3.616 -8.254 8.343 1.00 . A A . 31 LYS HZ1 1 1 9 6376 1 1 34 LYS HZ2 H 5.053 -9.087 8.032 1.00 . A A . 31 LYS HZ2 1 1 9 6377 1 1 34 LYS HZ3 H 3.566 -9.861 7.817 1.00 . A A . 31 LYS HZ3 1 1 9 6378 1 1 34 LYS N N 3.972 -4.056 3.156 1.00 . A A . 31 LYS N 1 1 9 6379 1 1 34 LYS NZ N 4.070 -8.957 7.723 1.00 . A A . 31 LYS NZ 1 1 9 6380 1 1 34 LYS O O 6.444 -6.168 1.640 1.00 . A A . 31 LYS O 1 1 9 6381 1 1 35 LYS C C 4.960 -6.432 -0.903 1.00 . A A . 32 LYS C 1 1 9 6382 1 1 35 LYS CA C 4.127 -6.921 0.278 1.00 . A A . 32 LYS CA 1 1 9 6383 1 1 35 LYS CB C 2.668 -7.079 -0.147 1.00 . A A . 32 LYS CB 1 1 9 6384 1 1 35 LYS CD C 2.548 -9.538 -0.652 1.00 . A A . 32 LYS CD 1 1 9 6385 1 1 35 LYS CE C 2.080 -10.574 -1.661 1.00 . A A . 32 LYS CE 1 1 9 6386 1 1 35 LYS CG C 2.440 -8.132 -1.215 1.00 . A A . 32 LYS CG 1 1 9 6387 1 1 35 LYS H H 3.391 -5.572 1.726 1.00 . A A . 32 LYS H 1 1 9 6388 1 1 35 LYS HA H 4.506 -7.876 0.606 1.00 . A A . 32 LYS HA 1 1 9 6389 1 1 35 LYS HB2 H 2.084 -7.349 0.720 1.00 . A A . 32 LYS HB2 1 1 9 6390 1 1 35 LYS HB3 H 2.312 -6.132 -0.525 1.00 . A A . 32 LYS HB3 1 1 9 6391 1 1 35 LYS HD2 H 3.578 -9.737 -0.398 1.00 . A A . 32 LYS HD2 1 1 9 6392 1 1 35 LYS HD3 H 1.935 -9.609 0.234 1.00 . A A . 32 LYS HD3 1 1 9 6393 1 1 35 LYS HE2 H 2.198 -11.556 -1.230 1.00 . A A . 32 LYS HE2 1 1 9 6394 1 1 35 LYS HE3 H 1.036 -10.400 -1.876 1.00 . A A . 32 LYS HE3 1 1 9 6395 1 1 35 LYS HG2 H 1.457 -7.999 -1.638 1.00 . A A . 32 LYS HG2 1 1 9 6396 1 1 35 LYS HG3 H 3.186 -8.008 -1.987 1.00 . A A . 32 LYS HG3 1 1 9 6397 1 1 35 LYS HZ1 H 3.832 -10.821 -2.767 1.00 . A A . 32 LYS HZ1 1 1 9 6398 1 1 35 LYS HZ2 H 2.872 -9.533 -3.287 1.00 . A A . 32 LYS HZ2 1 1 9 6399 1 1 35 LYS HZ3 H 2.418 -11.119 -3.646 1.00 . A A . 32 LYS HZ3 1 1 9 6400 1 1 35 LYS N N 4.214 -5.991 1.396 1.00 . A A . 32 LYS N 1 1 9 6401 1 1 35 LYS NZ N 2.853 -10.507 -2.929 1.00 . A A . 32 LYS NZ 1 1 9 6402 1 1 35 LYS O O 5.757 -7.185 -1.468 1.00 . A A . 32 LYS O 1 1 9 6403 1 1 36 HIS C C 6.983 -4.358 -2.055 1.00 . A A . 33 HIS C 1 1 9 6404 1 1 36 HIS CA C 5.514 -4.603 -2.401 1.00 . A A . 33 HIS CA 1 1 9 6405 1 1 36 HIS CB C 4.854 -3.300 -2.897 1.00 . A A . 33 HIS CB 1 1 9 6406 1 1 36 HIS CD2 C 5.993 -1.552 -1.349 1.00 . A A . 33 HIS CD2 1 1 9 6407 1 1 36 HIS CE1 C 4.263 -0.432 -0.722 1.00 . A A . 33 HIS CE1 1 1 9 6408 1 1 36 HIS CG C 4.923 -2.135 -1.940 1.00 . A A . 33 HIS CG 1 1 9 6409 1 1 36 HIS H H 4.158 -4.598 -0.767 1.00 . A A . 33 HIS H 1 1 9 6410 1 1 36 HIS HA H 5.473 -5.333 -3.197 1.00 . A A . 33 HIS HA 1 1 9 6411 1 1 36 HIS HB2 H 5.334 -2.995 -3.813 1.00 . A A . 33 HIS HB2 1 1 9 6412 1 1 36 HIS HB3 H 3.811 -3.497 -3.100 1.00 . A A . 33 HIS HB3 1 1 9 6413 1 1 36 HIS HD1 H 2.893 -1.596 -1.769 1.00 . A A . 33 HIS HD1 1 1 9 6414 1 1 36 HIS HD2 H 7.014 -1.871 -1.453 1.00 . A A . 33 HIS HD2 1 1 9 6415 1 1 36 HIS HE1 H 3.613 0.269 -0.224 1.00 . A A . 33 HIS HE1 1 1 9 6416 1 1 36 HIS N N 4.791 -5.164 -1.265 1.00 . A A . 33 HIS N 1 1 9 6417 1 1 36 HIS ND1 N 3.830 -1.416 -1.526 1.00 . A A . 33 HIS ND1 1 1 9 6418 1 1 36 HIS NE2 N 5.583 -0.464 -0.585 1.00 . A A . 33 HIS NE2 1 1 9 6419 1 1 36 HIS O O 7.805 -4.114 -2.935 1.00 . A A . 33 HIS O 1 1 9 6420 1 1 37 LYS C C 9.657 -5.187 -0.651 1.00 . A A . 34 LYS C 1 1 9 6421 1 1 37 LYS CA C 8.653 -4.092 -0.319 1.00 . A A . 34 LYS CA 1 1 9 6422 1 1 37 LYS CB C 8.639 -3.806 1.182 1.00 . A A . 34 LYS CB 1 1 9 6423 1 1 37 LYS CD C 7.900 -2.239 3.014 1.00 . A A . 34 LYS CD 1 1 9 6424 1 1 37 LYS CE C 6.953 -1.107 3.378 1.00 . A A . 34 LYS CE 1 1 9 6425 1 1 37 LYS CG C 7.764 -2.618 1.549 1.00 . A A . 34 LYS CG 1 1 9 6426 1 1 37 LYS H H 6.661 -4.780 -0.127 1.00 . A A . 34 LYS H 1 1 9 6427 1 1 37 LYS HA H 8.944 -3.192 -0.841 1.00 . A A . 34 LYS HA 1 1 9 6428 1 1 37 LYS HB2 H 8.267 -4.676 1.701 1.00 . A A . 34 LYS HB2 1 1 9 6429 1 1 37 LYS HB3 H 9.647 -3.601 1.510 1.00 . A A . 34 LYS HB3 1 1 9 6430 1 1 37 LYS HD2 H 7.673 -3.098 3.625 1.00 . A A . 34 LYS HD2 1 1 9 6431 1 1 37 LYS HD3 H 8.914 -1.919 3.200 1.00 . A A . 34 LYS HD3 1 1 9 6432 1 1 37 LYS HE2 H 7.170 -0.256 2.747 1.00 . A A . 34 LYS HE2 1 1 9 6433 1 1 37 LYS HE3 H 5.937 -1.433 3.201 1.00 . A A . 34 LYS HE3 1 1 9 6434 1 1 37 LYS HG2 H 8.054 -1.772 0.943 1.00 . A A . 34 LYS HG2 1 1 9 6435 1 1 37 LYS HG3 H 6.733 -2.870 1.345 1.00 . A A . 34 LYS HG3 1 1 9 6436 1 1 37 LYS HZ1 H 8.053 -0.343 4.980 1.00 . A A . 34 LYS HZ1 1 1 9 6437 1 1 37 LYS HZ2 H 6.910 -1.510 5.423 1.00 . A A . 34 LYS HZ2 1 1 9 6438 1 1 37 LYS HZ3 H 6.407 0.054 5.024 1.00 . A A . 34 LYS HZ3 1 1 9 6439 1 1 37 LYS N N 7.319 -4.449 -0.777 1.00 . A A . 34 LYS N 1 1 9 6440 1 1 37 LYS NZ N 7.090 -0.700 4.799 1.00 . A A . 34 LYS NZ 1 1 9 6441 1 1 37 LYS O O 10.838 -4.916 -0.853 1.00 . A A . 34 LYS O 1 1 9 6442 1 1 38 THR C C 10.262 -7.729 -2.526 1.00 . A A . 35 THR C 1 1 9 6443 1 1 38 THR CA C 10.041 -7.550 -1.019 1.00 . A A . 35 THR CA 1 1 9 6444 1 1 38 THR CB C 9.449 -8.839 -0.407 1.00 . A A . 35 THR CB 1 1 9 6445 1 1 38 THR CG2 C 8.185 -9.266 -1.141 1.00 . A A . 35 THR CG2 1 1 9 6446 1 1 38 THR H H 8.213 -6.562 -0.629 1.00 . A A . 35 THR H 1 1 9 6447 1 1 38 THR HA H 10.993 -7.358 -0.547 1.00 . A A . 35 THR HA 1 1 9 6448 1 1 38 THR HB H 9.192 -8.636 0.623 1.00 . A A . 35 THR HB 1 1 9 6449 1 1 38 THR HG1 H 10.494 -10.225 -1.357 1.00 . A A . 35 THR HG1 1 1 9 6450 1 1 38 THR HG21 H 8.414 -9.440 -2.181 1.00 . A A . 35 THR HG21 1 1 9 6451 1 1 38 THR HG22 H 7.440 -8.485 -1.064 1.00 . A A . 35 THR HG22 1 1 9 6452 1 1 38 THR HG23 H 7.800 -10.173 -0.700 1.00 . A A . 35 THR HG23 1 1 9 6453 1 1 38 THR N N 9.175 -6.414 -0.750 1.00 . A A . 35 THR N 1 1 9 6454 1 1 38 THR O O 10.959 -8.646 -2.961 1.00 . A A . 35 THR O 1 1 9 6455 1 1 38 THR OG1 O 10.414 -9.901 -0.447 1.00 . A A . 35 THR OG1 1 1 9 6456 1 1 39 ARG C C 10.236 -5.605 -5.379 1.00 . A A . 36 ARG C 1 1 9 6457 1 1 39 ARG CA C 9.782 -6.931 -4.769 1.00 . A A . 36 ARG CA 1 1 9 6458 1 1 39 ARG CB C 8.446 -7.376 -5.370 1.00 . A A . 36 ARG CB 1 1 9 6459 1 1 39 ARG CD C 5.945 -7.114 -5.416 1.00 . A A . 36 ARG CD 1 1 9 6460 1 1 39 ARG CG C 7.255 -6.577 -4.867 1.00 . A A . 36 ARG CG 1 1 9 6461 1 1 39 ARG CZ C 4.974 -7.642 -7.616 1.00 . A A . 36 ARG CZ 1 1 9 6462 1 1 39 ARG H H 9.157 -6.114 -2.916 1.00 . A A . 36 ARG H 1 1 9 6463 1 1 39 ARG HA H 10.528 -7.679 -4.992 1.00 . A A . 36 ARG HA 1 1 9 6464 1 1 39 ARG HB2 H 8.495 -7.271 -6.445 1.00 . A A . 36 ARG HB2 1 1 9 6465 1 1 39 ARG HB3 H 8.284 -8.415 -5.126 1.00 . A A . 36 ARG HB3 1 1 9 6466 1 1 39 ARG HD2 H 5.850 -8.151 -5.135 1.00 . A A . 36 ARG HD2 1 1 9 6467 1 1 39 ARG HD3 H 5.132 -6.550 -4.985 1.00 . A A . 36 ARG HD3 1 1 9 6468 1 1 39 ARG HE H 6.535 -6.426 -7.310 1.00 . A A . 36 ARG HE 1 1 9 6469 1 1 39 ARG HG2 H 7.230 -6.631 -3.788 1.00 . A A . 36 ARG HG2 1 1 9 6470 1 1 39 ARG HG3 H 7.370 -5.548 -5.174 1.00 . A A . 36 ARG HG3 1 1 9 6471 1 1 39 ARG HH11 H 4.065 -8.553 -6.053 1.00 . A A . 36 ARG HH11 1 1 9 6472 1 1 39 ARG HH12 H 3.389 -8.907 -7.610 1.00 . A A . 36 ARG HH12 1 1 9 6473 1 1 39 ARG HH21 H 5.657 -6.884 -9.366 1.00 . A A . 36 ARG HH21 1 1 9 6474 1 1 39 ARG HH22 H 4.303 -7.958 -9.501 1.00 . A A . 36 ARG HH22 1 1 9 6475 1 1 39 ARG N N 9.673 -6.842 -3.317 1.00 . A A . 36 ARG N 1 1 9 6476 1 1 39 ARG NE N 5.874 -7.007 -6.869 1.00 . A A . 36 ARG NE 1 1 9 6477 1 1 39 ARG NH1 N 4.071 -8.431 -7.047 1.00 . A A . 36 ARG NH1 1 1 9 6478 1 1 39 ARG NH2 N 4.978 -7.482 -8.931 1.00 . A A . 36 ARG NH2 1 1 9 6479 1 1 39 ARG O O 10.908 -5.583 -6.409 1.00 . A A . 36 ARG O 1 1 9 6480 1 1 40 ASP C C 11.466 -2.656 -4.462 1.00 . A A . 37 ASP C 1 1 9 6481 1 1 40 ASP CA C 10.262 -3.182 -5.233 1.00 . A A . 37 ASP CA 1 1 9 6482 1 1 40 ASP CB C 9.087 -2.202 -5.116 1.00 . A A . 37 ASP CB 1 1 9 6483 1 1 40 ASP CG C 9.396 -0.836 -5.697 1.00 . A A . 37 ASP CG 1 1 9 6484 1 1 40 ASP H H 9.332 -4.564 -3.929 1.00 . A A . 37 ASP H 1 1 9 6485 1 1 40 ASP HA H 10.533 -3.284 -6.273 1.00 . A A . 37 ASP HA 1 1 9 6486 1 1 40 ASP HB2 H 8.235 -2.609 -5.640 1.00 . A A . 37 ASP HB2 1 1 9 6487 1 1 40 ASP HB3 H 8.835 -2.080 -4.072 1.00 . A A . 37 ASP HB3 1 1 9 6488 1 1 40 ASP N N 9.877 -4.499 -4.741 1.00 . A A . 37 ASP N 1 1 9 6489 1 1 40 ASP O O 12.055 -1.639 -4.821 1.00 . A A . 37 ASP O 1 1 9 6490 1 1 40 ASP OD1 O 9.452 -0.713 -6.941 1.00 . A A . 37 ASP OD1 1 1 9 6491 1 1 40 ASP OD2 O 9.594 0.118 -4.918 1.00 . A A . 37 ASP OD2 1 1 9 6492 1 1 41 ASN C C 12.609 -1.656 -1.850 1.00 . A A . 38 ASN C 1 1 9 6493 1 1 41 ASN CA C 12.922 -2.986 -2.517 1.00 . A A . 38 ASN CA 1 1 9 6494 1 1 41 ASN CB C 14.247 -2.930 -3.275 1.00 . A A . 38 ASN CB 1 1 9 6495 1 1 41 ASN CG C 14.875 -4.300 -3.430 1.00 . A A . 38 ASN CG 1 1 9 6496 1 1 41 ASN H H 11.360 -4.217 -3.219 1.00 . A A . 38 ASN H 1 1 9 6497 1 1 41 ASN HA H 12.998 -3.740 -1.746 1.00 . A A . 38 ASN HA 1 1 9 6498 1 1 41 ASN HB2 H 14.070 -2.521 -4.258 1.00 . A A . 38 ASN HB2 1 1 9 6499 1 1 41 ASN HB3 H 14.933 -2.295 -2.740 1.00 . A A . 38 ASN HB3 1 1 9 6500 1 1 41 ASN HD21 H 16.680 -3.490 -3.568 1.00 . A A . 38 ASN HD21 1 1 9 6501 1 1 41 ASN HD22 H 16.619 -5.213 -3.668 1.00 . A A . 38 ASN HD22 1 1 9 6502 1 1 41 ASN N N 11.831 -3.383 -3.403 1.00 . A A . 38 ASN N 1 1 9 6503 1 1 41 ASN ND2 N 16.188 -4.339 -3.570 1.00 . A A . 38 ASN ND2 1 1 9 6504 1 1 41 ASN O O 13.498 -0.884 -1.489 1.00 . A A . 38 ASN O 1 1 9 6505 1 1 41 ASN OD1 O 14.182 -5.319 -3.425 1.00 . A A . 38 ASN OD1 1 1 9 6506 1 1 42 CYS C C 10.790 -0.494 0.470 1.00 . A A . 39 CYS C 1 1 9 6507 1 1 42 CYS CA C 10.813 -0.236 -1.031 1.00 . A A . 39 CYS CA 1 1 9 6508 1 1 42 CYS CB C 9.402 0.056 -1.556 1.00 . A A . 39 CYS CB 1 1 9 6509 1 1 42 CYS H H 10.682 -2.052 -2.071 1.00 . A A . 39 CYS H 1 1 9 6510 1 1 42 CYS HA H 11.463 0.597 -1.248 1.00 . A A . 39 CYS HA 1 1 9 6511 1 1 42 CYS HB2 H 9.464 0.299 -2.605 1.00 . A A . 39 CYS HB2 1 1 9 6512 1 1 42 CYS HB3 H 8.797 -0.830 -1.436 1.00 . A A . 39 CYS HB3 1 1 9 6513 1 1 42 CYS N N 11.321 -1.410 -1.707 1.00 . A A . 39 CYS N 1 1 9 6514 1 1 42 CYS O O 10.638 -1.634 0.900 1.00 . A A . 39 CYS O 1 1 9 6515 1 1 42 CYS SG S 8.547 1.417 -0.737 1.00 . A A . 39 CYS SG 1 1 9 6516 1 1 43 SER C C 9.691 1.205 3.248 1.00 . A A . 40 SER C 1 1 9 6517 1 1 43 SER CA C 10.871 0.397 2.714 1.00 . A A . 40 SER CA 1 1 9 6518 1 1 43 SER CB C 12.175 0.811 3.397 1.00 . A A . 40 SER CB 1 1 9 6519 1 1 43 SER H H 11.225 1.413 0.888 1.00 . A A . 40 SER H 1 1 9 6520 1 1 43 SER HA H 10.689 -0.647 2.920 1.00 . A A . 40 SER HA 1 1 9 6521 1 1 43 SER HB2 H 12.353 1.860 3.229 1.00 . A A . 40 SER HB2 1 1 9 6522 1 1 43 SER HB3 H 12.098 0.624 4.458 1.00 . A A . 40 SER HB3 1 1 9 6523 1 1 43 SER HG H 12.989 -0.837 2.700 1.00 . A A . 40 SER HG 1 1 9 6524 1 1 43 SER N N 10.982 0.542 1.271 1.00 . A A . 40 SER N 1 1 9 6525 1 1 43 SER O O 9.315 1.085 4.414 1.00 . A A . 40 SER O 1 1 9 6526 1 1 43 SER OG O 13.272 0.071 2.882 1.00 . A A . 40 SER OG 1 1 9 6527 1 1 44 GLY C C 8.210 4.013 3.514 1.00 . A A . 41 GLY C 1 1 9 6528 1 1 44 GLY CA C 7.902 2.755 2.731 1.00 . A A . 41 GLY CA 1 1 9 6529 1 1 44 GLY H H 9.458 2.080 1.464 1.00 . A A . 41 GLY H 1 1 9 6530 1 1 44 GLY HA2 H 7.379 3.030 1.828 1.00 . A A . 41 GLY HA2 1 1 9 6531 1 1 44 GLY HA3 H 7.261 2.125 3.324 1.00 . A A . 41 GLY HA3 1 1 9 6532 1 1 44 GLY N N 9.089 2.004 2.370 1.00 . A A . 41 GLY N 1 1 9 6533 1 1 44 GLY O O 7.549 4.308 4.510 1.00 . A A . 41 GLY O 1 1 9 6534 1 1 45 GLN C C 10.369 6.870 2.738 1.00 . A A . 42 GLN C 1 1 9 6535 1 1 45 GLN CA C 9.587 6.001 3.713 1.00 . A A . 42 GLN CA 1 1 9 6536 1 1 45 GLN CB C 10.427 5.705 4.959 1.00 . A A . 42 GLN CB 1 1 9 6537 1 1 45 GLN CD C 11.593 6.601 7.007 1.00 . A A . 42 GLN CD 1 1 9 6538 1 1 45 GLN CG C 10.776 6.936 5.776 1.00 . A A . 42 GLN CG 1 1 9 6539 1 1 45 GLN H H 9.711 4.461 2.277 1.00 . A A . 42 GLN H 1 1 9 6540 1 1 45 GLN HA H 8.685 6.519 4.004 1.00 . A A . 42 GLN HA 1 1 9 6541 1 1 45 GLN HB2 H 9.878 5.024 5.594 1.00 . A A . 42 GLN HB2 1 1 9 6542 1 1 45 GLN HB3 H 11.347 5.230 4.651 1.00 . A A . 42 GLN HB3 1 1 9 6543 1 1 45 GLN HE21 H 13.274 6.828 5.976 1.00 . A A . 42 GLN HE21 1 1 9 6544 1 1 45 GLN HE22 H 13.462 6.398 7.641 1.00 . A A . 42 GLN HE22 1 1 9 6545 1 1 45 GLN HG2 H 11.346 7.613 5.157 1.00 . A A . 42 GLN HG2 1 1 9 6546 1 1 45 GLN HG3 H 9.861 7.417 6.088 1.00 . A A . 42 GLN HG3 1 1 9 6547 1 1 45 GLN N N 9.206 4.758 3.064 1.00 . A A . 42 GLN N 1 1 9 6548 1 1 45 GLN NE2 N 12.907 6.608 6.862 1.00 . A A . 42 GLN NE2 1 1 9 6549 1 1 45 GLN O O 11.424 6.474 2.244 1.00 . A A . 42 GLN O 1 1 9 6550 1 1 45 GLN OE1 O 11.047 6.338 8.080 1.00 . A A . 42 GLN OE1 1 1 9 6551 1 1 46 THR C C 11.733 9.559 2.195 1.00 . A A . 43 THR C 1 1 9 6552 1 1 46 THR CA C 10.473 8.983 1.545 1.00 . A A . 43 THR CA 1 1 9 6553 1 1 46 THR CB C 9.498 10.105 1.155 1.00 . A A . 43 THR CB 1 1 9 6554 1 1 46 THR CG2 C 8.976 9.904 -0.259 1.00 . A A . 43 THR CG2 1 1 9 6555 1 1 46 THR H H 8.955 8.281 2.828 1.00 . A A . 43 THR H 1 1 9 6556 1 1 46 THR HA H 10.754 8.449 0.650 1.00 . A A . 43 THR HA 1 1 9 6557 1 1 46 THR HB H 10.019 11.050 1.202 1.00 . A A . 43 THR HB 1 1 9 6558 1 1 46 THR HG1 H 8.373 10.976 2.530 1.00 . A A . 43 THR HG1 1 1 9 6559 1 1 46 THR HG21 H 8.461 8.956 -0.320 1.00 . A A . 43 THR HG21 1 1 9 6560 1 1 46 THR HG22 H 9.803 9.910 -0.953 1.00 . A A . 43 THR HG22 1 1 9 6561 1 1 46 THR HG23 H 8.292 10.702 -0.506 1.00 . A A . 43 THR HG23 1 1 9 6562 1 1 46 THR N N 9.823 8.040 2.438 1.00 . A A . 43 THR N 1 1 9 6563 1 1 46 THR O O 12.842 9.321 1.726 1.00 . A A . 43 THR O 1 1 9 6564 1 1 46 THR OG1 O 8.396 10.123 2.080 1.00 . A A . 43 THR OG1 1 1 9 6565 1 1 47 HIS C C 12.239 10.971 5.532 1.00 . A A . 44 HIS C 1 1 9 6566 1 1 47 HIS CA C 12.690 10.733 4.095 1.00 . A A . 44 HIS CA 1 1 9 6567 1 1 47 HIS CB C 13.402 11.975 3.526 1.00 . A A . 44 HIS CB 1 1 9 6568 1 1 47 HIS CD2 C 12.234 14.087 4.492 1.00 . A A . 44 HIS CD2 1 1 9 6569 1 1 47 HIS CE1 C 11.440 14.896 2.620 1.00 . A A . 44 HIS CE1 1 1 9 6570 1 1 47 HIS CG C 12.586 13.234 3.500 1.00 . A A . 44 HIS CG 1 1 9 6571 1 1 47 HIS H H 10.656 10.640 3.488 1.00 . A A . 44 HIS H 1 1 9 6572 1 1 47 HIS HA H 13.390 9.909 4.099 1.00 . A A . 44 HIS HA 1 1 9 6573 1 1 47 HIS HB2 H 14.279 12.173 4.122 1.00 . A A . 44 HIS HB2 1 1 9 6574 1 1 47 HIS HB3 H 13.711 11.762 2.513 1.00 . A A . 44 HIS HB3 1 1 9 6575 1 1 47 HIS HD1 H 12.148 13.380 1.443 1.00 . A A . 44 HIS HD1 1 1 9 6576 1 1 47 HIS HD2 H 12.467 13.980 5.541 1.00 . A A . 44 HIS HD2 1 1 9 6577 1 1 47 HIS HE1 H 10.940 15.533 1.907 1.00 . A A . 44 HIS HE1 1 1 9 6578 1 1 47 HIS HE2 H 11.274 15.948 4.367 1.00 . A A . 44 HIS HE2 1 1 9 6579 1 1 47 HIS N N 11.559 10.325 3.264 1.00 . A A . 44 HIS N 1 1 9 6580 1 1 47 HIS ND1 N 12.069 13.771 2.341 1.00 . A A . 44 HIS ND1 1 1 9 6581 1 1 47 HIS NE2 N 11.525 15.109 3.917 1.00 . A A . 44 HIS NE2 1 1 9 6582 1 1 47 HIS O O 13.032 11.360 6.391 1.00 . A A . 44 HIS O 1 1 9 6583 1 1 48 ASP C C 9.117 10.015 7.182 1.00 . A A . 45 ASP C 1 1 9 6584 1 1 48 ASP CA C 10.384 10.850 7.109 1.00 . A A . 45 ASP CA 1 1 9 6585 1 1 48 ASP CB C 10.085 12.314 7.476 1.00 . A A . 45 ASP CB 1 1 9 6586 1 1 48 ASP CG C 8.976 12.934 6.649 1.00 . A A . 45 ASP CG 1 1 9 6587 1 1 48 ASP H H 10.372 10.454 5.045 1.00 . A A . 45 ASP H 1 1 9 6588 1 1 48 ASP HA H 11.102 10.450 7.811 1.00 . A A . 45 ASP HA 1 1 9 6589 1 1 48 ASP HB2 H 9.797 12.362 8.514 1.00 . A A . 45 ASP HB2 1 1 9 6590 1 1 48 ASP HB3 H 10.983 12.898 7.332 1.00 . A A . 45 ASP HB3 1 1 9 6591 1 1 48 ASP N N 10.957 10.731 5.779 1.00 . A A . 45 ASP N 1 1 9 6592 1 1 48 ASP O O 8.854 9.418 8.247 1.00 . A A . 45 ASP O 1 1 9 6593 1 1 48 ASP OXT O 8.418 9.911 6.150 1.00 . A A . 45 ASP OXT 1 1 9 6594 1 1 48 ASP OD1 O 7.799 12.854 7.057 1.00 . A A . 45 ASP OD1 1 1 9 6595 1 1 48 ASP OD2 O 9.276 13.529 5.595 1.00 . A A . 45 ASP OD2 1 1 9 6596 2 2 1 ZN ZN ZN -4.563 -5.537 0.550 1.00 . B A . 101 ZN ZN 1 1 9 6597 3 2 1 ZN ZN ZN 6.299 1.303 -1.213 1.00 . C A . 102 ZN ZN 1 1 10 6598 1 1 1 GLY C C -19.057 8.032 -1.461 1.00 . A A . -2 GLY C 1 1 10 6599 1 1 1 GLY CA C -20.330 7.243 -1.693 1.00 . A A . -2 GLY CA 1 1 10 6600 1 1 1 GLY H1 H -21.793 6.978 -3.152 1.00 . A A . -2 GLY H1 1 1 10 6601 1 1 1 GLY H2 H -20.242 7.235 -3.772 1.00 . A A . -2 GLY H2 1 1 10 6602 1 1 1 GLY H3 H -21.116 8.529 -3.126 1.00 . A A . -2 GLY H3 1 1 10 6603 1 1 1 GLY HA2 H -21.049 7.510 -0.934 1.00 . A A . -2 GLY HA2 1 1 10 6604 1 1 1 GLY HA3 H -20.110 6.189 -1.613 1.00 . A A . -2 GLY HA3 1 1 10 6605 1 1 1 GLY N N -20.910 7.515 -3.028 1.00 . A A . -2 GLY N 1 1 10 6606 1 1 1 GLY O O -18.776 8.979 -2.197 1.00 . A A . -2 GLY O 1 1 10 6607 1 1 2 PRO C C -15.930 8.146 -1.151 1.00 . A A . -1 PRO C 1 1 10 6608 1 1 2 PRO CA C -17.022 8.370 -0.111 1.00 . A A . -1 PRO CA 1 1 10 6609 1 1 2 PRO CB C -16.615 7.757 1.231 1.00 . A A . -1 PRO CB 1 1 10 6610 1 1 2 PRO CD C -18.502 6.513 0.447 1.00 . A A . -1 PRO CD 1 1 10 6611 1 1 2 PRO CG C -17.223 6.399 1.232 1.00 . A A . -1 PRO CG 1 1 10 6612 1 1 2 PRO HA H -17.193 9.429 0.008 1.00 . A A . -1 PRO HA 1 1 10 6613 1 1 2 PRO HB2 H -15.537 7.709 1.295 1.00 . A A . -1 PRO HB2 1 1 10 6614 1 1 2 PRO HB3 H -17.001 8.362 2.037 1.00 . A A . -1 PRO HB3 1 1 10 6615 1 1 2 PRO HD2 H -18.676 5.612 -0.122 1.00 . A A . -1 PRO HD2 1 1 10 6616 1 1 2 PRO HD3 H -19.333 6.709 1.108 1.00 . A A . -1 PRO HD3 1 1 10 6617 1 1 2 PRO HG2 H -16.553 5.698 0.756 1.00 . A A . -1 PRO HG2 1 1 10 6618 1 1 2 PRO HG3 H -17.431 6.090 2.245 1.00 . A A . -1 PRO HG3 1 1 10 6619 1 1 2 PRO N N -18.260 7.660 -0.447 1.00 . A A . -1 PRO N 1 1 10 6620 1 1 2 PRO O O -15.823 7.065 -1.733 1.00 . A A . -1 PRO O 1 1 10 6621 1 1 3 HIS C C -12.809 8.435 -1.755 1.00 . A A . 0 HIS C 1 1 10 6622 1 1 3 HIS CA C -14.047 9.077 -2.370 1.00 . A A . 0 HIS CA 1 1 10 6623 1 1 3 HIS CB C -13.700 10.451 -2.973 1.00 . A A . 0 HIS CB 1 1 10 6624 1 1 3 HIS CD2 C -13.485 12.207 -1.071 1.00 . A A . 0 HIS CD2 1 1 10 6625 1 1 3 HIS CE1 C -11.316 12.492 -1.138 1.00 . A A . 0 HIS CE1 1 1 10 6626 1 1 3 HIS CG C -13.000 11.397 -2.041 1.00 . A A . 0 HIS CG 1 1 10 6627 1 1 3 HIS H H -15.238 10.005 -0.878 1.00 . A A . 0 HIS H 1 1 10 6628 1 1 3 HIS HA H -14.400 8.432 -3.163 1.00 . A A . 0 HIS HA 1 1 10 6629 1 1 3 HIS HB2 H -13.057 10.302 -3.826 1.00 . A A . 0 HIS HB2 1 1 10 6630 1 1 3 HIS HB3 H -14.612 10.927 -3.303 1.00 . A A . 0 HIS HB3 1 1 10 6631 1 1 3 HIS HD1 H -10.992 11.161 -2.661 1.00 . A A . 0 HIS HD1 1 1 10 6632 1 1 3 HIS HD2 H -14.522 12.308 -0.781 1.00 . A A . 0 HIS HD2 1 1 10 6633 1 1 3 HIS HE1 H -10.321 12.849 -0.924 1.00 . A A . 0 HIS HE1 1 1 10 6634 1 1 3 HIS HE2 H -12.444 13.385 0.315 1.00 . A A . 0 HIS HE2 1 1 10 6635 1 1 3 HIS N N -15.117 9.172 -1.383 1.00 . A A . 0 HIS N 1 1 10 6636 1 1 3 HIS ND1 N -11.636 11.602 -2.057 1.00 . A A . 0 HIS ND1 1 1 10 6637 1 1 3 HIS NE2 N -12.419 12.875 -0.525 1.00 . A A . 0 HIS NE2 1 1 10 6638 1 1 3 HIS O O -11.907 8.002 -2.469 1.00 . A A . 0 HIS O 1 1 10 6639 1 1 4 MET C C -11.871 6.203 0.275 1.00 . A A . 1 MET C 1 1 10 6640 1 1 4 MET CA C -11.662 7.716 0.263 1.00 . A A . 1 MET CA 1 1 10 6641 1 1 4 MET CB C -11.480 8.262 1.683 1.00 . A A . 1 MET CB 1 1 10 6642 1 1 4 MET CE C -13.989 8.449 5.008 1.00 . A A . 1 MET CE 1 1 10 6643 1 1 4 MET CG C -12.695 8.112 2.584 1.00 . A A . 1 MET CG 1 1 10 6644 1 1 4 MET H H -13.497 8.767 0.097 1.00 . A A . 1 MET H 1 1 10 6645 1 1 4 MET HA H -10.766 7.923 -0.305 1.00 . A A . 1 MET HA 1 1 10 6646 1 1 4 MET HB2 H -10.656 7.742 2.145 1.00 . A A . 1 MET HB2 1 1 10 6647 1 1 4 MET HB3 H -11.236 9.312 1.617 1.00 . A A . 1 MET HB3 1 1 10 6648 1 1 4 MET HE1 H -14.760 8.975 4.465 1.00 . A A . 1 MET HE1 1 1 10 6649 1 1 4 MET HE2 H -13.967 8.796 6.030 1.00 . A A . 1 MET HE2 1 1 10 6650 1 1 4 MET HE3 H -14.195 7.390 4.991 1.00 . A A . 1 MET HE3 1 1 10 6651 1 1 4 MET HG2 H -13.522 8.646 2.145 1.00 . A A . 1 MET HG2 1 1 10 6652 1 1 4 MET HG3 H -12.943 7.063 2.658 1.00 . A A . 1 MET HG3 1 1 10 6653 1 1 4 MET N N -12.768 8.371 -0.427 1.00 . A A . 1 MET N 1 1 10 6654 1 1 4 MET O O -11.941 5.559 1.325 1.00 . A A . 1 MET O 1 1 10 6655 1 1 4 MET SD S -12.404 8.758 4.239 1.00 . A A . 1 MET SD 1 1 10 6656 1 1 5 ALA C C -11.518 3.855 -2.447 1.00 . A A . 2 ALA C 1 1 10 6657 1 1 5 ALA CA C -12.158 4.241 -1.136 1.00 . A A . 2 ALA CA 1 1 10 6658 1 1 5 ALA CB C -13.634 3.882 -1.143 1.00 . A A . 2 ALA CB 1 1 10 6659 1 1 5 ALA H H -11.830 6.230 -1.707 1.00 . A A . 2 ALA H 1 1 10 6660 1 1 5 ALA HA H -11.672 3.701 -0.335 1.00 . A A . 2 ALA HA 1 1 10 6661 1 1 5 ALA HB1 H -14.132 4.419 -1.935 1.00 . A A . 2 ALA HB1 1 1 10 6662 1 1 5 ALA HB2 H -14.075 4.147 -0.193 1.00 . A A . 2 ALA HB2 1 1 10 6663 1 1 5 ALA HB3 H -13.741 2.816 -1.307 1.00 . A A . 2 ALA HB3 1 1 10 6664 1 1 5 ALA N N -11.952 5.655 -0.923 1.00 . A A . 2 ALA N 1 1 10 6665 1 1 5 ALA O O -11.106 4.723 -3.224 1.00 . A A . 2 ALA O 1 1 10 6666 1 1 6 VAL C C -10.616 0.529 -3.572 1.00 . A A . 3 VAL C 1 1 10 6667 1 1 6 VAL CA C -10.673 2.027 -3.782 1.00 . A A . 3 VAL CA 1 1 10 6668 1 1 6 VAL CB C -9.238 2.605 -3.720 1.00 . A A . 3 VAL CB 1 1 10 6669 1 1 6 VAL CG1 C -8.378 1.814 -2.772 1.00 . A A . 3 VAL CG1 1 1 10 6670 1 1 6 VAL CG2 C -8.567 2.656 -5.062 1.00 . A A . 3 VAL CG2 1 1 10 6671 1 1 6 VAL H H -11.970 1.948 -2.130 1.00 . A A . 3 VAL H 1 1 10 6672 1 1 6 VAL HA H -11.132 2.272 -4.725 1.00 . A A . 3 VAL HA 1 1 10 6673 1 1 6 VAL HB H -9.304 3.615 -3.342 1.00 . A A . 3 VAL HB 1 1 10 6674 1 1 6 VAL HG11 H -8.045 0.910 -3.256 1.00 . A A . 3 VAL HG11 1 1 10 6675 1 1 6 VAL HG12 H -8.960 1.559 -1.897 1.00 . A A . 3 VAL HG12 1 1 10 6676 1 1 6 VAL HG13 H -7.527 2.412 -2.487 1.00 . A A . 3 VAL HG13 1 1 10 6677 1 1 6 VAL HG21 H -9.116 3.306 -5.719 1.00 . A A . 3 VAL HG21 1 1 10 6678 1 1 6 VAL HG22 H -8.523 1.663 -5.474 1.00 . A A . 3 VAL HG22 1 1 10 6679 1 1 6 VAL HG23 H -7.565 3.035 -4.923 1.00 . A A . 3 VAL HG23 1 1 10 6680 1 1 6 VAL N N -11.460 2.568 -2.697 1.00 . A A . 3 VAL N 1 1 10 6681 1 1 6 VAL O O -11.284 0.015 -2.673 1.00 . A A . 3 VAL O 1 1 10 6682 1 1 7 LEU C C -7.926 -1.549 -3.858 1.00 . A A . 4 LEU C 1 1 10 6683 1 1 7 LEU CA C -9.438 -1.497 -3.977 1.00 . A A . 4 LEU CA 1 1 10 6684 1 1 7 LEU CB C -9.955 -2.566 -4.943 1.00 . A A . 4 LEU CB 1 1 10 6685 1 1 7 LEU CD1 C -11.849 -3.962 -5.814 1.00 . A A . 4 LEU CD1 1 1 10 6686 1 1 7 LEU CD2 C -11.960 -3.017 -3.497 1.00 . A A . 4 LEU CD2 1 1 10 6687 1 1 7 LEU CG C -11.470 -2.790 -4.922 1.00 . A A . 4 LEU CG 1 1 10 6688 1 1 7 LEU H H -9.538 0.200 -5.224 1.00 . A A . 4 LEU H 1 1 10 6689 1 1 7 LEU HA H -9.853 -1.666 -2.992 1.00 . A A . 4 LEU HA 1 1 10 6690 1 1 7 LEU HB2 H -9.669 -2.284 -5.944 1.00 . A A . 4 LEU HB2 1 1 10 6691 1 1 7 LEU HB3 H -9.474 -3.502 -4.700 1.00 . A A . 4 LEU HB3 1 1 10 6692 1 1 7 LEU HD11 H -11.369 -4.859 -5.453 1.00 . A A . 4 LEU HD11 1 1 10 6693 1 1 7 LEU HD12 H -11.526 -3.763 -6.826 1.00 . A A . 4 LEU HD12 1 1 10 6694 1 1 7 LEU HD13 H -12.920 -4.094 -5.799 1.00 . A A . 4 LEU HD13 1 1 10 6695 1 1 7 LEU HD21 H -13.000 -3.308 -3.516 1.00 . A A . 4 LEU HD21 1 1 10 6696 1 1 7 LEU HD22 H -11.858 -2.100 -2.930 1.00 . A A . 4 LEU HD22 1 1 10 6697 1 1 7 LEU HD23 H -11.374 -3.799 -3.029 1.00 . A A . 4 LEU HD23 1 1 10 6698 1 1 7 LEU HG H -11.961 -1.908 -5.307 1.00 . A A . 4 LEU HG 1 1 10 6699 1 1 7 LEU N N -9.841 -0.174 -4.367 1.00 . A A . 4 LEU N 1 1 10 6700 1 1 7 LEU O O -7.207 -1.093 -4.746 1.00 . A A . 4 LEU O 1 1 10 6701 1 1 8 CYS C C -5.209 -2.552 -3.585 1.00 . A A . 5 CYS C 1 1 10 6702 1 1 8 CYS CA C -6.070 -2.210 -2.366 1.00 . A A . 5 CYS CA 1 1 10 6703 1 1 8 CYS CB C -5.968 -3.309 -1.304 1.00 . A A . 5 CYS CB 1 1 10 6704 1 1 8 CYS H H -8.147 -2.367 -2.066 1.00 . A A . 5 CYS H 1 1 10 6705 1 1 8 CYS HA H -5.730 -1.277 -1.942 1.00 . A A . 5 CYS HA 1 1 10 6706 1 1 8 CYS HB2 H -6.590 -3.040 -0.466 1.00 . A A . 5 CYS HB2 1 1 10 6707 1 1 8 CYS HB3 H -6.340 -4.231 -1.727 1.00 . A A . 5 CYS HB3 1 1 10 6708 1 1 8 CYS N N -7.483 -2.067 -2.715 1.00 . A A . 5 CYS N 1 1 10 6709 1 1 8 CYS O O -5.437 -3.555 -4.252 1.00 . A A . 5 CYS O 1 1 10 6710 1 1 8 CYS SG S -4.314 -3.638 -0.661 1.00 . A A . 5 CYS SG 1 1 10 6711 1 1 9 GLY C C -2.585 -3.186 -5.010 1.00 . A A . 6 GLY C 1 1 10 6712 1 1 9 GLY CA C -3.378 -1.892 -5.033 1.00 . A A . 6 GLY CA 1 1 10 6713 1 1 9 GLY H H -4.059 -0.947 -3.258 1.00 . A A . 6 GLY H 1 1 10 6714 1 1 9 GLY HA2 H -4.005 -1.887 -5.911 1.00 . A A . 6 GLY HA2 1 1 10 6715 1 1 9 GLY HA3 H -2.689 -1.063 -5.095 1.00 . A A . 6 GLY HA3 1 1 10 6716 1 1 9 GLY N N -4.219 -1.712 -3.859 1.00 . A A . 6 GLY N 1 1 10 6717 1 1 9 GLY O O -2.050 -3.612 -6.031 1.00 . A A . 6 GLY O 1 1 10 6718 1 1 10 VAL C C -2.726 -6.265 -3.880 1.00 . A A . 7 VAL C 1 1 10 6719 1 1 10 VAL CA C -1.788 -5.069 -3.704 1.00 . A A . 7 VAL CA 1 1 10 6720 1 1 10 VAL CB C -1.083 -5.171 -2.336 1.00 . A A . 7 VAL CB 1 1 10 6721 1 1 10 VAL CG1 C -0.464 -6.549 -2.148 1.00 . A A . 7 VAL CG1 1 1 10 6722 1 1 10 VAL CG2 C -0.025 -4.086 -2.201 1.00 . A A . 7 VAL CG2 1 1 10 6723 1 1 10 VAL H H -2.922 -3.405 -3.057 1.00 . A A . 7 VAL H 1 1 10 6724 1 1 10 VAL HA H -1.032 -5.103 -4.474 1.00 . A A . 7 VAL HA 1 1 10 6725 1 1 10 VAL HB H -1.821 -5.023 -1.560 1.00 . A A . 7 VAL HB 1 1 10 6726 1 1 10 VAL HG11 H 0.281 -6.718 -2.911 1.00 . A A . 7 VAL HG11 1 1 10 6727 1 1 10 VAL HG12 H -1.238 -7.300 -2.226 1.00 . A A . 7 VAL HG12 1 1 10 6728 1 1 10 VAL HG13 H -0.003 -6.609 -1.173 1.00 . A A . 7 VAL HG13 1 1 10 6729 1 1 10 VAL HG21 H 0.429 -4.146 -1.223 1.00 . A A . 7 VAL HG21 1 1 10 6730 1 1 10 VAL HG22 H -0.485 -3.117 -2.326 1.00 . A A . 7 VAL HG22 1 1 10 6731 1 1 10 VAL HG23 H 0.732 -4.225 -2.959 1.00 . A A . 7 VAL HG23 1 1 10 6732 1 1 10 VAL N N -2.501 -3.808 -3.842 1.00 . A A . 7 VAL N 1 1 10 6733 1 1 10 VAL O O -2.555 -7.065 -4.799 1.00 . A A . 7 VAL O 1 1 10 6734 1 1 11 CYS C C -5.962 -7.192 -3.620 1.00 . A A . 8 CYS C 1 1 10 6735 1 1 11 CYS CA C -4.601 -7.543 -3.009 1.00 . A A . 8 CYS CA 1 1 10 6736 1 1 11 CYS CB C -4.773 -8.080 -1.583 1.00 . A A . 8 CYS CB 1 1 10 6737 1 1 11 CYS H H -3.847 -5.683 -2.337 1.00 . A A . 8 CYS H 1 1 10 6738 1 1 11 CYS HA H -4.137 -8.305 -3.615 1.00 . A A . 8 CYS HA 1 1 10 6739 1 1 11 CYS HB2 H -5.257 -9.042 -1.628 1.00 . A A . 8 CYS HB2 1 1 10 6740 1 1 11 CYS HB3 H -3.799 -8.197 -1.132 1.00 . A A . 8 CYS HB3 1 1 10 6741 1 1 11 CYS N N -3.715 -6.382 -3.000 1.00 . A A . 8 CYS N 1 1 10 6742 1 1 11 CYS O O -6.579 -8.019 -4.292 1.00 . A A . 8 CYS O 1 1 10 6743 1 1 11 CYS SG S -5.759 -7.027 -0.492 1.00 . A A . 8 CYS SG 1 1 10 6744 1 1 12 GLY C C -8.841 -6.358 -3.753 1.00 . A A . 9 GLY C 1 1 10 6745 1 1 12 GLY CA C -7.645 -5.457 -3.973 1.00 . A A . 9 GLY CA 1 1 10 6746 1 1 12 GLY H H -5.860 -5.369 -2.841 1.00 . A A . 9 GLY H 1 1 10 6747 1 1 12 GLY HA2 H -7.859 -4.492 -3.539 1.00 . A A . 9 GLY HA2 1 1 10 6748 1 1 12 GLY HA3 H -7.500 -5.329 -5.036 1.00 . A A . 9 GLY HA3 1 1 10 6749 1 1 12 GLY N N -6.403 -5.960 -3.393 1.00 . A A . 9 GLY N 1 1 10 6750 1 1 12 GLY O O -9.335 -6.972 -4.699 1.00 . A A . 9 GLY O 1 1 10 6751 1 1 13 ILE C C -11.387 -6.647 -1.148 1.00 . A A . 10 ILE C 1 1 10 6752 1 1 13 ILE CA C -10.463 -7.281 -2.196 1.00 . A A . 10 ILE CA 1 1 10 6753 1 1 13 ILE CB C -10.023 -8.689 -1.716 1.00 . A A . 10 ILE CB 1 1 10 6754 1 1 13 ILE CD1 C -9.008 -7.920 0.502 1.00 . A A . 10 ILE CD1 1 1 10 6755 1 1 13 ILE CG1 C -8.776 -8.610 -0.823 1.00 . A A . 10 ILE CG1 1 1 10 6756 1 1 13 ILE CG2 C -9.767 -9.605 -2.905 1.00 . A A . 10 ILE CG2 1 1 10 6757 1 1 13 ILE H H -8.866 -5.950 -1.797 1.00 . A A . 10 ILE H 1 1 10 6758 1 1 13 ILE HA H -11.026 -7.408 -3.109 1.00 . A A . 10 ILE HA 1 1 10 6759 1 1 13 ILE HB H -10.835 -9.115 -1.144 1.00 . A A . 10 ILE HB 1 1 10 6760 1 1 13 ILE HD11 H -8.077 -7.855 1.045 1.00 . A A . 10 ILE HD11 1 1 10 6761 1 1 13 ILE HD12 H -9.727 -8.480 1.080 1.00 . A A . 10 ILE HD12 1 1 10 6762 1 1 13 ILE HD13 H -9.390 -6.923 0.319 1.00 . A A . 10 ILE HD13 1 1 10 6763 1 1 13 ILE HG12 H -8.422 -9.608 -0.617 1.00 . A A . 10 ILE HG12 1 1 10 6764 1 1 13 ILE HG13 H -8.005 -8.063 -1.347 1.00 . A A . 10 ILE HG13 1 1 10 6765 1 1 13 ILE HG21 H -8.984 -9.186 -3.520 1.00 . A A . 10 ILE HG21 1 1 10 6766 1 1 13 ILE HG22 H -10.670 -9.699 -3.488 1.00 . A A . 10 ILE HG22 1 1 10 6767 1 1 13 ILE HG23 H -9.463 -10.579 -2.552 1.00 . A A . 10 ILE HG23 1 1 10 6768 1 1 13 ILE N N -9.311 -6.441 -2.514 1.00 . A A . 10 ILE N 1 1 10 6769 1 1 13 ILE O O -12.236 -7.331 -0.580 1.00 . A A . 10 ILE O 1 1 10 6770 1 1 14 LYS C C -12.033 -3.146 -0.054 1.00 . A A . 11 LYS C 1 1 10 6771 1 1 14 LYS CA C -12.075 -4.671 0.100 1.00 . A A . 11 LYS CA 1 1 10 6772 1 1 14 LYS CB C -11.702 -5.096 1.538 1.00 . A A . 11 LYS CB 1 1 10 6773 1 1 14 LYS CD C -9.882 -5.567 3.224 1.00 . A A . 11 LYS CD 1 1 10 6774 1 1 14 LYS CE C -10.677 -5.036 4.407 1.00 . A A . 11 LYS CE 1 1 10 6775 1 1 14 LYS CG C -10.246 -4.857 1.929 1.00 . A A . 11 LYS CG 1 1 10 6776 1 1 14 LYS H H -10.559 -4.837 -1.380 1.00 . A A . 11 LYS H 1 1 10 6777 1 1 14 LYS HA H -13.089 -4.991 -0.090 1.00 . A A . 11 LYS HA 1 1 10 6778 1 1 14 LYS HB2 H -12.325 -4.549 2.230 1.00 . A A . 11 LYS HB2 1 1 10 6779 1 1 14 LYS HB3 H -11.909 -6.151 1.647 1.00 . A A . 11 LYS HB3 1 1 10 6780 1 1 14 LYS HD2 H -10.086 -6.621 3.113 1.00 . A A . 11 LYS HD2 1 1 10 6781 1 1 14 LYS HD3 H -8.830 -5.422 3.416 1.00 . A A . 11 LYS HD3 1 1 10 6782 1 1 14 LYS HE2 H -10.453 -3.988 4.533 1.00 . A A . 11 LYS HE2 1 1 10 6783 1 1 14 LYS HE3 H -11.730 -5.157 4.202 1.00 . A A . 11 LYS HE3 1 1 10 6784 1 1 14 LYS HG2 H -9.606 -5.219 1.140 1.00 . A A . 11 LYS HG2 1 1 10 6785 1 1 14 LYS HG3 H -10.092 -3.797 2.060 1.00 . A A . 11 LYS HG3 1 1 10 6786 1 1 14 LYS HZ1 H -10.873 -5.351 6.461 1.00 . A A . 11 LYS HZ1 1 1 10 6787 1 1 14 LYS HZ2 H -9.326 -5.673 5.866 1.00 . A A . 11 LYS HZ2 1 1 10 6788 1 1 14 LYS HZ3 H -10.585 -6.764 5.576 1.00 . A A . 11 LYS HZ3 1 1 10 6789 1 1 14 LYS N N -11.227 -5.348 -0.887 1.00 . A A . 11 LYS N 1 1 10 6790 1 1 14 LYS NZ N -10.343 -5.756 5.664 1.00 . A A . 11 LYS NZ 1 1 10 6791 1 1 14 LYS O O -13.018 -2.537 -0.470 1.00 . A A . 11 LYS O 1 1 10 6792 1 1 15 GLU C C -9.313 -0.767 0.688 1.00 . A A . 12 GLU C 1 1 10 6793 1 1 15 GLU CA C -10.725 -1.095 0.226 1.00 . A A . 12 GLU CA 1 1 10 6794 1 1 15 GLU CB C -11.756 -0.421 1.147 1.00 . A A . 12 GLU CB 1 1 10 6795 1 1 15 GLU CD C -12.979 1.688 1.796 1.00 . A A . 12 GLU CD 1 1 10 6796 1 1 15 GLU CG C -11.861 1.086 0.972 1.00 . A A . 12 GLU CG 1 1 10 6797 1 1 15 GLU H H -10.131 -3.092 0.541 1.00 . A A . 12 GLU H 1 1 10 6798 1 1 15 GLU HA H -10.861 -0.754 -0.790 1.00 . A A . 12 GLU HA 1 1 10 6799 1 1 15 GLU HB2 H -12.727 -0.850 0.951 1.00 . A A . 12 GLU HB2 1 1 10 6800 1 1 15 GLU HB3 H -11.486 -0.624 2.173 1.00 . A A . 12 GLU HB3 1 1 10 6801 1 1 15 GLU HG2 H -10.928 1.538 1.274 1.00 . A A . 12 GLU HG2 1 1 10 6802 1 1 15 GLU HG3 H -12.044 1.302 -0.070 1.00 . A A . 12 GLU HG3 1 1 10 6803 1 1 15 GLU N N -10.891 -2.544 0.260 1.00 . A A . 12 GLU N 1 1 10 6804 1 1 15 GLU O O -8.604 -1.652 1.168 1.00 . A A . 12 GLU O 1 1 10 6805 1 1 15 GLU OE1 O -14.147 1.611 1.361 1.00 . A A . 12 GLU OE1 1 1 10 6806 1 1 15 GLU OE2 O -12.700 2.232 2.884 1.00 . A A . 12 GLU OE2 1 1 10 6807 1 1 16 PHE C C -7.758 1.587 2.367 1.00 . A A . 13 PHE C 1 1 10 6808 1 1 16 PHE CA C -7.593 0.899 1.019 1.00 . A A . 13 PHE CA 1 1 10 6809 1 1 16 PHE CB C -6.901 1.844 0.033 1.00 . A A . 13 PHE CB 1 1 10 6810 1 1 16 PHE CD1 C -8.395 3.801 -0.512 1.00 . A A . 13 PHE CD1 1 1 10 6811 1 1 16 PHE CD2 C -6.546 4.160 0.948 1.00 . A A . 13 PHE CD2 1 1 10 6812 1 1 16 PHE CE1 C -8.742 5.131 -0.406 1.00 . A A . 13 PHE CE1 1 1 10 6813 1 1 16 PHE CE2 C -6.890 5.492 1.059 1.00 . A A . 13 PHE CE2 1 1 10 6814 1 1 16 PHE CG C -7.292 3.298 0.161 1.00 . A A . 13 PHE CG 1 1 10 6815 1 1 16 PHE CZ C -7.989 5.979 0.380 1.00 . A A . 13 PHE CZ 1 1 10 6816 1 1 16 PHE H H -9.434 1.100 -0.010 1.00 . A A . 13 PHE H 1 1 10 6817 1 1 16 PHE HA H -6.979 0.021 1.151 1.00 . A A . 13 PHE HA 1 1 10 6818 1 1 16 PHE HB2 H -5.837 1.779 0.156 1.00 . A A . 13 PHE HB2 1 1 10 6819 1 1 16 PHE HB3 H -7.149 1.527 -0.965 1.00 . A A . 13 PHE HB3 1 1 10 6820 1 1 16 PHE HD1 H -8.985 3.134 -1.143 1.00 . A A . 13 PHE HD1 1 1 10 6821 1 1 16 PHE HD2 H -5.688 3.778 1.483 1.00 . A A . 13 PHE HD2 1 1 10 6822 1 1 16 PHE HE1 H -9.604 5.507 -0.939 1.00 . A A . 13 PHE HE1 1 1 10 6823 1 1 16 PHE HE2 H -6.297 6.153 1.672 1.00 . A A . 13 PHE HE2 1 1 10 6824 1 1 16 PHE HZ H -8.259 7.021 0.465 1.00 . A A . 13 PHE HZ 1 1 10 6825 1 1 16 PHE N N -8.884 0.470 0.502 1.00 . A A . 13 PHE N 1 1 10 6826 1 1 16 PHE O O -8.807 2.164 2.663 1.00 . A A . 13 PHE O 1 1 10 6827 1 1 17 LYS C C -5.343 2.948 4.573 1.00 . A A . 14 LYS C 1 1 10 6828 1 1 17 LYS CA C -6.673 2.210 4.443 1.00 . A A . 14 LYS CA 1 1 10 6829 1 1 17 LYS CB C -6.870 1.213 5.593 1.00 . A A . 14 LYS CB 1 1 10 6830 1 1 17 LYS CD C -7.106 0.845 8.080 1.00 . A A . 14 LYS CD 1 1 10 6831 1 1 17 LYS CE C -8.577 0.455 8.047 1.00 . A A . 14 LYS CE 1 1 10 6832 1 1 17 LYS CG C -6.751 1.832 6.978 1.00 . A A . 14 LYS CG 1 1 10 6833 1 1 17 LYS H H -5.946 0.971 2.901 1.00 . A A . 14 LYS H 1 1 10 6834 1 1 17 LYS HA H -7.472 2.931 4.458 1.00 . A A . 14 LYS HA 1 1 10 6835 1 1 17 LYS HB2 H -7.851 0.773 5.503 1.00 . A A . 14 LYS HB2 1 1 10 6836 1 1 17 LYS HB3 H -6.128 0.434 5.506 1.00 . A A . 14 LYS HB3 1 1 10 6837 1 1 17 LYS HD2 H -6.509 -0.045 7.953 1.00 . A A . 14 LYS HD2 1 1 10 6838 1 1 17 LYS HD3 H -6.883 1.295 9.035 1.00 . A A . 14 LYS HD3 1 1 10 6839 1 1 17 LYS HE2 H -9.174 1.353 7.998 1.00 . A A . 14 LYS HE2 1 1 10 6840 1 1 17 LYS HE3 H -8.758 -0.144 7.167 1.00 . A A . 14 LYS HE3 1 1 10 6841 1 1 17 LYS HG2 H -5.732 2.158 7.122 1.00 . A A . 14 LYS HG2 1 1 10 6842 1 1 17 LYS HG3 H -7.415 2.683 7.039 1.00 . A A . 14 LYS HG3 1 1 10 6843 1 1 17 LYS HZ1 H -9.968 -0.610 9.184 1.00 . A A . 14 LYS HZ1 1 1 10 6844 1 1 17 LYS HZ2 H -8.848 0.255 10.109 1.00 . A A . 14 LYS HZ2 1 1 10 6845 1 1 17 LYS HZ3 H -8.382 -1.176 9.339 1.00 . A A . 14 LYS HZ3 1 1 10 6846 1 1 17 LYS N N -6.718 1.516 3.171 1.00 . A A . 14 LYS N 1 1 10 6847 1 1 17 LYS NZ N -8.970 -0.323 9.252 1.00 . A A . 14 LYS NZ 1 1 10 6848 1 1 17 LYS O O -5.204 3.886 5.358 1.00 . A A . 14 LYS O 1 1 10 6849 1 1 18 TYR C C -2.645 3.586 2.408 1.00 . A A . 15 TYR C 1 1 10 6850 1 1 18 TYR CA C -3.041 3.097 3.789 1.00 . A A . 15 TYR CA 1 1 10 6851 1 1 18 TYR CB C -2.016 2.056 4.239 1.00 . A A . 15 TYR CB 1 1 10 6852 1 1 18 TYR CD1 C -3.279 0.677 5.918 1.00 . A A . 15 TYR CD1 1 1 10 6853 1 1 18 TYR CD2 C -1.374 1.891 6.661 1.00 . A A . 15 TYR CD2 1 1 10 6854 1 1 18 TYR CE1 C -3.474 0.188 7.194 1.00 . A A . 15 TYR CE1 1 1 10 6855 1 1 18 TYR CE2 C -1.558 1.409 7.941 1.00 . A A . 15 TYR CE2 1 1 10 6856 1 1 18 TYR CG C -2.230 1.533 5.634 1.00 . A A . 15 TYR CG 1 1 10 6857 1 1 18 TYR CZ C -2.610 0.558 8.203 1.00 . A A . 15 TYR CZ 1 1 10 6858 1 1 18 TYR H H -4.568 1.809 3.128 1.00 . A A . 15 TYR H 1 1 10 6859 1 1 18 TYR HA H -3.035 3.927 4.479 1.00 . A A . 15 TYR HA 1 1 10 6860 1 1 18 TYR HB2 H -2.053 1.215 3.565 1.00 . A A . 15 TYR HB2 1 1 10 6861 1 1 18 TYR HB3 H -1.029 2.496 4.197 1.00 . A A . 15 TYR HB3 1 1 10 6862 1 1 18 TYR HD1 H -3.954 0.397 5.117 1.00 . A A . 15 TYR HD1 1 1 10 6863 1 1 18 TYR HD2 H -0.553 2.561 6.446 1.00 . A A . 15 TYR HD2 1 1 10 6864 1 1 18 TYR HE1 H -4.297 -0.480 7.398 1.00 . A A . 15 TYR HE1 1 1 10 6865 1 1 18 TYR HE2 H -0.880 1.697 8.729 1.00 . A A . 15 TYR HE2 1 1 10 6866 1 1 18 TYR HH H -2.967 -0.878 9.437 1.00 . A A . 15 TYR HH 1 1 10 6867 1 1 18 TYR N N -4.376 2.528 3.767 1.00 . A A . 15 TYR N 1 1 10 6868 1 1 18 TYR O O -3.342 3.339 1.423 1.00 . A A . 15 TYR O 1 1 10 6869 1 1 18 TYR OH O -2.800 0.074 9.477 1.00 . A A . 15 TYR OH 1 1 10 6870 1 1 19 LYS C C 0.568 4.847 1.279 1.00 . A A . 16 LYS C 1 1 10 6871 1 1 19 LYS CA C -0.932 4.687 1.092 1.00 . A A . 16 LYS CA 1 1 10 6872 1 1 19 LYS CB C -1.561 6.003 0.618 1.00 . A A . 16 LYS CB 1 1 10 6873 1 1 19 LYS CD C -1.928 7.601 -1.294 1.00 . A A . 16 LYS CD 1 1 10 6874 1 1 19 LYS CE C -1.811 8.838 -0.416 1.00 . A A . 16 LYS CE 1 1 10 6875 1 1 19 LYS CG C -1.094 6.445 -0.763 1.00 . A A . 16 LYS CG 1 1 10 6876 1 1 19 LYS H H -1.045 4.474 3.185 1.00 . A A . 16 LYS H 1 1 10 6877 1 1 19 LYS HA H -1.117 3.918 0.356 1.00 . A A . 16 LYS HA 1 1 10 6878 1 1 19 LYS HB2 H -2.634 5.885 0.591 1.00 . A A . 16 LYS HB2 1 1 10 6879 1 1 19 LYS HB3 H -1.311 6.781 1.326 1.00 . A A . 16 LYS HB3 1 1 10 6880 1 1 19 LYS HD2 H -1.591 7.846 -2.290 1.00 . A A . 16 LYS HD2 1 1 10 6881 1 1 19 LYS HD3 H -2.963 7.293 -1.329 1.00 . A A . 16 LYS HD3 1 1 10 6882 1 1 19 LYS HE2 H -2.209 8.610 0.561 1.00 . A A . 16 LYS HE2 1 1 10 6883 1 1 19 LYS HE3 H -0.769 9.106 -0.328 1.00 . A A . 16 LYS HE3 1 1 10 6884 1 1 19 LYS HG2 H -0.061 6.761 -0.705 1.00 . A A . 16 LYS HG2 1 1 10 6885 1 1 19 LYS HG3 H -1.179 5.611 -1.444 1.00 . A A . 16 LYS HG3 1 1 10 6886 1 1 19 LYS HZ1 H -2.499 10.808 -0.350 1.00 . A A . 16 LYS HZ1 1 1 10 6887 1 1 19 LYS HZ2 H -3.562 9.738 -1.114 1.00 . A A . 16 LYS HZ2 1 1 10 6888 1 1 19 LYS HZ3 H -2.162 10.251 -1.911 1.00 . A A . 16 LYS HZ3 1 1 10 6889 1 1 19 LYS N N -1.513 4.258 2.347 1.00 . A A . 16 LYS N 1 1 10 6890 1 1 19 LYS NZ N -2.561 9.988 -0.986 1.00 . A A . 16 LYS NZ 1 1 10 6891 1 1 19 LYS O O 1.014 5.764 1.969 1.00 . A A . 16 LYS O 1 1 10 6892 1 1 20 CYS C C 3.334 5.337 0.433 1.00 . A A . 17 CYS C 1 1 10 6893 1 1 20 CYS CA C 2.790 3.959 0.806 1.00 . A A . 17 CYS CA 1 1 10 6894 1 1 20 CYS CB C 3.436 2.900 -0.099 1.00 . A A . 17 CYS CB 1 1 10 6895 1 1 20 CYS H H 0.906 3.184 0.224 1.00 . A A . 17 CYS H 1 1 10 6896 1 1 20 CYS HA H 3.057 3.750 1.830 1.00 . A A . 17 CYS HA 1 1 10 6897 1 1 20 CYS HB2 H 3.134 1.920 0.234 1.00 . A A . 17 CYS HB2 1 1 10 6898 1 1 20 CYS HB3 H 3.111 3.052 -1.116 1.00 . A A . 17 CYS HB3 1 1 10 6899 1 1 20 CYS N N 1.334 3.919 0.711 1.00 . A A . 17 CYS N 1 1 10 6900 1 1 20 CYS O O 2.991 5.881 -0.611 1.00 . A A . 17 CYS O 1 1 10 6901 1 1 20 CYS SG S 5.243 2.972 -0.072 1.00 . A A . 17 CYS SG 1 1 10 6902 1 1 21 PRO C C 5.835 7.158 -0.111 1.00 . A A . 18 PRO C 1 1 10 6903 1 1 21 PRO CA C 4.821 7.215 1.027 1.00 . A A . 18 PRO CA 1 1 10 6904 1 1 21 PRO CB C 5.523 7.539 2.346 1.00 . A A . 18 PRO CB 1 1 10 6905 1 1 21 PRO CD C 4.651 5.328 2.564 1.00 . A A . 18 PRO CD 1 1 10 6906 1 1 21 PRO CG C 5.798 6.215 2.962 1.00 . A A . 18 PRO CG 1 1 10 6907 1 1 21 PRO HA H 4.079 7.971 0.812 1.00 . A A . 18 PRO HA 1 1 10 6908 1 1 21 PRO HB2 H 6.441 8.075 2.146 1.00 . A A . 18 PRO HB2 1 1 10 6909 1 1 21 PRO HB3 H 4.875 8.137 2.966 1.00 . A A . 18 PRO HB3 1 1 10 6910 1 1 21 PRO HD2 H 4.989 4.311 2.431 1.00 . A A . 18 PRO HD2 1 1 10 6911 1 1 21 PRO HD3 H 3.864 5.373 3.302 1.00 . A A . 18 PRO HD3 1 1 10 6912 1 1 21 PRO HG2 H 6.727 5.823 2.579 1.00 . A A . 18 PRO HG2 1 1 10 6913 1 1 21 PRO HG3 H 5.843 6.310 4.036 1.00 . A A . 18 PRO HG3 1 1 10 6914 1 1 21 PRO N N 4.204 5.908 1.281 1.00 . A A . 18 PRO N 1 1 10 6915 1 1 21 PRO O O 6.296 8.186 -0.608 1.00 . A A . 18 PRO O 1 1 10 6916 1 1 22 ARG C C 6.424 5.350 -2.882 1.00 . A A . 19 ARG C 1 1 10 6917 1 1 22 ARG CA C 7.138 5.742 -1.592 1.00 . A A . 19 ARG CA 1 1 10 6918 1 1 22 ARG CB C 8.149 4.659 -1.221 1.00 . A A . 19 ARG CB 1 1 10 6919 1 1 22 ARG CD C 10.268 4.107 0.003 1.00 . A A . 19 ARG CD 1 1 10 6920 1 1 22 ARG CG C 9.061 5.029 -0.061 1.00 . A A . 19 ARG CG 1 1 10 6921 1 1 22 ARG CZ C 12.031 3.333 -1.550 1.00 . A A . 19 ARG CZ 1 1 10 6922 1 1 22 ARG H H 5.797 5.164 -0.063 1.00 . A A . 19 ARG H 1 1 10 6923 1 1 22 ARG HA H 7.663 6.673 -1.752 1.00 . A A . 19 ARG HA 1 1 10 6924 1 1 22 ARG HB2 H 7.609 3.763 -0.946 1.00 . A A . 19 ARG HB2 1 1 10 6925 1 1 22 ARG HB3 H 8.762 4.445 -2.084 1.00 . A A . 19 ARG HB3 1 1 10 6926 1 1 22 ARG HD2 H 10.906 4.418 0.817 1.00 . A A . 19 ARG HD2 1 1 10 6927 1 1 22 ARG HD3 H 9.928 3.096 0.175 1.00 . A A . 19 ARG HD3 1 1 10 6928 1 1 22 ARG HE H 10.744 4.827 -1.913 1.00 . A A . 19 ARG HE 1 1 10 6929 1 1 22 ARG HG2 H 9.402 6.045 -0.192 1.00 . A A . 19 ARG HG2 1 1 10 6930 1 1 22 ARG HG3 H 8.507 4.949 0.863 1.00 . A A . 19 ARG HG3 1 1 10 6931 1 1 22 ARG HH11 H 12.133 2.436 0.266 1.00 . A A . 19 ARG HH11 1 1 10 6932 1 1 22 ARG HH12 H 13.277 1.870 -0.903 1.00 . A A . 19 ARG HH12 1 1 10 6933 1 1 22 ARG HH21 H 12.233 4.077 -3.426 1.00 . A A . 19 ARG HH21 1 1 10 6934 1 1 22 ARG HH22 H 13.342 2.804 -3.003 1.00 . A A . 19 ARG HH22 1 1 10 6935 1 1 22 ARG N N 6.188 5.945 -0.512 1.00 . A A . 19 ARG N 1 1 10 6936 1 1 22 ARG NE N 11.026 4.149 -1.240 1.00 . A A . 19 ARG NE 1 1 10 6937 1 1 22 ARG NH1 N 12.516 2.477 -0.658 1.00 . A A . 19 ARG NH1 1 1 10 6938 1 1 22 ARG NH2 N 12.580 3.408 -2.753 1.00 . A A . 19 ARG NH2 1 1 10 6939 1 1 22 ARG O O 6.660 5.937 -3.939 1.00 . A A . 19 ARG O 1 1 10 6940 1 1 23 CYS C C 3.575 4.514 -4.259 1.00 . A A . 20 CYS C 1 1 10 6941 1 1 23 CYS CA C 4.889 3.809 -3.968 1.00 . A A . 20 CYS CA 1 1 10 6942 1 1 23 CYS CB C 4.617 2.316 -3.787 1.00 . A A . 20 CYS CB 1 1 10 6943 1 1 23 CYS H H 5.327 3.998 -1.903 1.00 . A A . 20 CYS H 1 1 10 6944 1 1 23 CYS HA H 5.552 3.947 -4.805 1.00 . A A . 20 CYS HA 1 1 10 6945 1 1 23 CYS HB2 H 3.896 2.185 -2.996 1.00 . A A . 20 CYS HB2 1 1 10 6946 1 1 23 CYS HB3 H 4.209 1.921 -4.705 1.00 . A A . 20 CYS HB3 1 1 10 6947 1 1 23 CYS N N 5.544 4.359 -2.786 1.00 . A A . 20 CYS N 1 1 10 6948 1 1 23 CYS O O 3.060 4.454 -5.374 1.00 . A A . 20 CYS O 1 1 10 6949 1 1 23 CYS SG S 6.066 1.333 -3.367 1.00 . A A . 20 CYS SG 1 1 10 6950 1 1 24 LEU C C 0.621 4.804 -3.541 1.00 . A A . 21 LEU C 1 1 10 6951 1 1 24 LEU CA C 1.733 5.817 -3.289 1.00 . A A . 21 LEU CA 1 1 10 6952 1 1 24 LEU CB C 1.705 6.913 -4.358 1.00 . A A . 21 LEU CB 1 1 10 6953 1 1 24 LEU CD1 C 2.486 9.166 -5.092 1.00 . A A . 21 LEU CD1 1 1 10 6954 1 1 24 LEU CD2 C 3.162 8.308 -2.847 1.00 . A A . 21 LEU CD2 1 1 10 6955 1 1 24 LEU CG C 2.844 7.934 -4.287 1.00 . A A . 21 LEU CG 1 1 10 6956 1 1 24 LEU H H 3.545 5.216 -2.393 1.00 . A A . 21 LEU H 1 1 10 6957 1 1 24 LEU HA H 1.560 6.273 -2.325 1.00 . A A . 21 LEU HA 1 1 10 6958 1 1 24 LEU HB2 H 1.738 6.439 -5.328 1.00 . A A . 21 LEU HB2 1 1 10 6959 1 1 24 LEU HB3 H 0.770 7.446 -4.270 1.00 . A A . 21 LEU HB3 1 1 10 6960 1 1 24 LEU HD11 H 3.287 9.886 -5.026 1.00 . A A . 21 LEU HD11 1 1 10 6961 1 1 24 LEU HD12 H 1.579 9.599 -4.695 1.00 . A A . 21 LEU HD12 1 1 10 6962 1 1 24 LEU HD13 H 2.332 8.890 -6.124 1.00 . A A . 21 LEU HD13 1 1 10 6963 1 1 24 LEU HD21 H 3.530 7.434 -2.325 1.00 . A A . 21 LEU HD21 1 1 10 6964 1 1 24 LEU HD22 H 2.267 8.667 -2.361 1.00 . A A . 21 LEU HD22 1 1 10 6965 1 1 24 LEU HD23 H 3.917 9.080 -2.832 1.00 . A A . 21 LEU HD23 1 1 10 6966 1 1 24 LEU HG H 3.732 7.500 -4.724 1.00 . A A . 21 LEU HG 1 1 10 6967 1 1 24 LEU N N 3.037 5.159 -3.230 1.00 . A A . 21 LEU N 1 1 10 6968 1 1 24 LEU O O -0.493 5.168 -3.916 1.00 . A A . 21 LEU O 1 1 10 6969 1 1 25 VAL C C -0.985 2.392 -2.318 1.00 . A A . 22 VAL C 1 1 10 6970 1 1 25 VAL CA C -0.048 2.478 -3.517 1.00 . A A . 22 VAL CA 1 1 10 6971 1 1 25 VAL CB C 0.620 1.104 -3.793 1.00 . A A . 22 VAL CB 1 1 10 6972 1 1 25 VAL CG1 C 1.457 0.640 -2.612 1.00 . A A . 22 VAL CG1 1 1 10 6973 1 1 25 VAL CG2 C -0.428 0.058 -4.153 1.00 . A A . 22 VAL CG2 1 1 10 6974 1 1 25 VAL H H 1.817 3.303 -3.007 1.00 . A A . 22 VAL H 1 1 10 6975 1 1 25 VAL HA H -0.634 2.744 -4.385 1.00 . A A . 22 VAL HA 1 1 10 6976 1 1 25 VAL HB H 1.278 1.219 -4.640 1.00 . A A . 22 VAL HB 1 1 10 6977 1 1 25 VAL HG11 H 1.947 -0.291 -2.862 1.00 . A A . 22 VAL HG11 1 1 10 6978 1 1 25 VAL HG12 H 0.819 0.490 -1.755 1.00 . A A . 22 VAL HG12 1 1 10 6979 1 1 25 VAL HG13 H 2.200 1.386 -2.380 1.00 . A A . 22 VAL HG13 1 1 10 6980 1 1 25 VAL HG21 H -1.131 -0.043 -3.339 1.00 . A A . 22 VAL HG21 1 1 10 6981 1 1 25 VAL HG22 H 0.055 -0.893 -4.330 1.00 . A A . 22 VAL HG22 1 1 10 6982 1 1 25 VAL HG23 H -0.953 0.367 -5.044 1.00 . A A . 22 VAL HG23 1 1 10 6983 1 1 25 VAL N N 0.924 3.531 -3.315 1.00 . A A . 22 VAL N 1 1 10 6984 1 1 25 VAL O O -0.556 2.226 -1.168 1.00 . A A . 22 VAL O 1 1 10 6985 1 1 26 GLN C C -3.436 1.026 -1.127 1.00 . A A . 23 GLN C 1 1 10 6986 1 1 26 GLN CA C -3.302 2.470 -1.594 1.00 . A A . 23 GLN CA 1 1 10 6987 1 1 26 GLN CB C -4.617 2.980 -2.180 1.00 . A A . 23 GLN CB 1 1 10 6988 1 1 26 GLN CD C -5.753 4.808 -3.510 1.00 . A A . 23 GLN CD 1 1 10 6989 1 1 26 GLN CG C -4.525 4.400 -2.717 1.00 . A A . 23 GLN CG 1 1 10 6990 1 1 26 GLN H H -2.508 2.782 -3.522 1.00 . A A . 23 GLN H 1 1 10 6991 1 1 26 GLN HA H -3.022 3.085 -0.747 1.00 . A A . 23 GLN HA 1 1 10 6992 1 1 26 GLN HB2 H -4.917 2.328 -2.987 1.00 . A A . 23 GLN HB2 1 1 10 6993 1 1 26 GLN HB3 H -5.374 2.958 -1.411 1.00 . A A . 23 GLN HB3 1 1 10 6994 1 1 26 GLN HE21 H -6.586 5.579 -1.886 1.00 . A A . 23 GLN HE21 1 1 10 6995 1 1 26 GLN HE22 H -7.521 5.692 -3.336 1.00 . A A . 23 GLN HE22 1 1 10 6996 1 1 26 GLN HG2 H -4.411 5.077 -1.884 1.00 . A A . 23 GLN HG2 1 1 10 6997 1 1 26 GLN HG3 H -3.661 4.473 -3.357 1.00 . A A . 23 GLN HG3 1 1 10 6998 1 1 26 GLN N N -2.259 2.569 -2.599 1.00 . A A . 23 GLN N 1 1 10 6999 1 1 26 GLN NE2 N -6.715 5.420 -2.844 1.00 . A A . 23 GLN NE2 1 1 10 7000 1 1 26 GLN O O -3.901 0.156 -1.864 1.00 . A A . 23 GLN O 1 1 10 7001 1 1 26 GLN OE1 O -5.827 4.587 -4.718 1.00 . A A . 23 GLN OE1 1 1 10 7002 1 1 27 THR C C -4.077 -0.694 1.722 1.00 . A A . 24 THR C 1 1 10 7003 1 1 27 THR CA C -2.997 -0.553 0.658 1.00 . A A . 24 THR CA 1 1 10 7004 1 1 27 THR CB C -1.614 -0.875 1.256 1.00 . A A . 24 THR CB 1 1 10 7005 1 1 27 THR CG2 C -0.685 -1.439 0.197 1.00 . A A . 24 THR CG2 1 1 10 7006 1 1 27 THR H H -2.716 1.536 0.655 1.00 . A A . 24 THR H 1 1 10 7007 1 1 27 THR HA H -3.197 -1.254 -0.140 1.00 . A A . 24 THR HA 1 1 10 7008 1 1 27 THR HB H -1.738 -1.613 2.035 1.00 . A A . 24 THR HB 1 1 10 7009 1 1 27 THR HG1 H -0.831 0.931 1.114 1.00 . A A . 24 THR HG1 1 1 10 7010 1 1 27 THR HG21 H -1.101 -2.355 -0.192 1.00 . A A . 24 THR HG21 1 1 10 7011 1 1 27 THR HG22 H 0.282 -1.640 0.637 1.00 . A A . 24 THR HG22 1 1 10 7012 1 1 27 THR HG23 H -0.574 -0.723 -0.605 1.00 . A A . 24 THR HG23 1 1 10 7013 1 1 27 THR N N -3.011 0.783 0.098 1.00 . A A . 24 THR N 1 1 10 7014 1 1 27 THR O O -4.464 0.282 2.353 1.00 . A A . 24 THR O 1 1 10 7015 1 1 27 THR OG1 O -1.035 0.308 1.820 1.00 . A A . 24 THR OG1 1 1 10 7016 1 1 28 CYS C C -5.128 -2.250 4.262 1.00 . A A . 25 CYS C 1 1 10 7017 1 1 28 CYS CA C -5.658 -2.157 2.837 1.00 . A A . 25 CYS CA 1 1 10 7018 1 1 28 CYS CB C -6.399 -3.445 2.474 1.00 . A A . 25 CYS CB 1 1 10 7019 1 1 28 CYS H H -4.222 -2.647 1.369 1.00 . A A . 25 CYS H 1 1 10 7020 1 1 28 CYS HA H -6.348 -1.328 2.778 1.00 . A A . 25 CYS HA 1 1 10 7021 1 1 28 CYS HB2 H -7.262 -3.547 3.115 1.00 . A A . 25 CYS HB2 1 1 10 7022 1 1 28 CYS HB3 H -6.726 -3.387 1.448 1.00 . A A . 25 CYS HB3 1 1 10 7023 1 1 28 CYS N N -4.578 -1.907 1.894 1.00 . A A . 25 CYS N 1 1 10 7024 1 1 28 CYS O O -5.813 -1.883 5.214 1.00 . A A . 25 CYS O 1 1 10 7025 1 1 28 CYS SG S -5.406 -4.943 2.654 1.00 . A A . 25 CYS SG 1 1 10 7026 1 1 29 SER C C -1.794 -2.972 5.614 1.00 . A A . 26 SER C 1 1 10 7027 1 1 29 SER CA C -3.311 -2.938 5.715 1.00 . A A . 26 SER CA 1 1 10 7028 1 1 29 SER CB C -3.827 -4.234 6.349 1.00 . A A . 26 SER CB 1 1 10 7029 1 1 29 SER H H -3.385 -2.981 3.605 1.00 . A A . 26 SER H 1 1 10 7030 1 1 29 SER HA H -3.601 -2.101 6.336 1.00 . A A . 26 SER HA 1 1 10 7031 1 1 29 SER HB2 H -3.649 -5.057 5.675 1.00 . A A . 26 SER HB2 1 1 10 7032 1 1 29 SER HB3 H -3.305 -4.411 7.277 1.00 . A A . 26 SER HB3 1 1 10 7033 1 1 29 SER HG H -5.586 -3.381 6.154 1.00 . A A . 26 SER HG 1 1 10 7034 1 1 29 SER N N -3.906 -2.744 4.403 1.00 . A A . 26 SER N 1 1 10 7035 1 1 29 SER O O -1.256 -3.078 4.508 1.00 . A A . 26 SER O 1 1 10 7036 1 1 29 SER OG O -5.218 -4.153 6.613 1.00 . A A . 26 SER OG 1 1 10 7037 1 1 30 LEU C C 0.938 -4.109 6.082 1.00 . A A . 27 LEU C 1 1 10 7038 1 1 30 LEU CA C 0.346 -2.889 6.786 1.00 . A A . 27 LEU CA 1 1 10 7039 1 1 30 LEU CB C 0.849 -2.818 8.228 1.00 . A A . 27 LEU CB 1 1 10 7040 1 1 30 LEU CD1 C 0.935 -1.621 10.424 1.00 . A A . 27 LEU CD1 1 1 10 7041 1 1 30 LEU CD2 C 1.375 -0.370 8.307 1.00 . A A . 27 LEU CD2 1 1 10 7042 1 1 30 LEU CG C 0.581 -1.499 8.951 1.00 . A A . 27 LEU CG 1 1 10 7043 1 1 30 LEU H H -1.610 -2.882 7.603 1.00 . A A . 27 LEU H 1 1 10 7044 1 1 30 LEU HA H 0.667 -2.000 6.263 1.00 . A A . 27 LEU HA 1 1 10 7045 1 1 30 LEU HB2 H 0.380 -3.613 8.789 1.00 . A A . 27 LEU HB2 1 1 10 7046 1 1 30 LEU HB3 H 1.915 -2.987 8.221 1.00 . A A . 27 LEU HB3 1 1 10 7047 1 1 30 LEU HD11 H 0.343 -2.404 10.873 1.00 . A A . 27 LEU HD11 1 1 10 7048 1 1 30 LEU HD12 H 0.731 -0.684 10.922 1.00 . A A . 27 LEU HD12 1 1 10 7049 1 1 30 LEU HD13 H 1.983 -1.860 10.524 1.00 . A A . 27 LEU HD13 1 1 10 7050 1 1 30 LEU HD21 H 1.074 -0.260 7.276 1.00 . A A . 27 LEU HD21 1 1 10 7051 1 1 30 LEU HD22 H 2.429 -0.601 8.351 1.00 . A A . 27 LEU HD22 1 1 10 7052 1 1 30 LEU HD23 H 1.187 0.551 8.838 1.00 . A A . 27 LEU HD23 1 1 10 7053 1 1 30 LEU HG H -0.469 -1.258 8.876 1.00 . A A . 27 LEU HG 1 1 10 7054 1 1 30 LEU N N -1.115 -2.910 6.755 1.00 . A A . 27 LEU N 1 1 10 7055 1 1 30 LEU O O 2.003 -4.022 5.470 1.00 . A A . 27 LEU O 1 1 10 7056 1 1 31 GLU C C 0.898 -6.203 4.001 1.00 . A A . 28 GLU C 1 1 10 7057 1 1 31 GLU CA C 0.657 -6.464 5.488 1.00 . A A . 28 GLU CA 1 1 10 7058 1 1 31 GLU CB C -0.405 -7.554 5.663 1.00 . A A . 28 GLU CB 1 1 10 7059 1 1 31 GLU CD C 1.169 -9.526 5.872 1.00 . A A . 28 GLU CD 1 1 10 7060 1 1 31 GLU CG C 0.006 -8.915 5.115 1.00 . A A . 28 GLU CG 1 1 10 7061 1 1 31 GLU H H -0.579 -5.250 6.710 1.00 . A A . 28 GLU H 1 1 10 7062 1 1 31 GLU HA H 1.582 -6.791 5.940 1.00 . A A . 28 GLU HA 1 1 10 7063 1 1 31 GLU HB2 H -0.617 -7.666 6.716 1.00 . A A . 28 GLU HB2 1 1 10 7064 1 1 31 GLU HB3 H -1.306 -7.244 5.156 1.00 . A A . 28 GLU HB3 1 1 10 7065 1 1 31 GLU HG2 H -0.837 -9.586 5.181 1.00 . A A . 28 GLU HG2 1 1 10 7066 1 1 31 GLU HG3 H 0.292 -8.799 4.080 1.00 . A A . 28 GLU HG3 1 1 10 7067 1 1 31 GLU N N 0.237 -5.237 6.163 1.00 . A A . 28 GLU N 1 1 10 7068 1 1 31 GLU O O 1.913 -6.617 3.443 1.00 . A A . 28 GLU O 1 1 10 7069 1 1 31 GLU OE1 O 0.951 -10.040 6.989 1.00 . A A . 28 GLU OE1 1 1 10 7070 1 1 31 GLU OE2 O 2.306 -9.490 5.362 1.00 . A A . 28 GLU OE2 1 1 10 7071 1 1 32 CYS C C 1.071 -3.992 1.768 1.00 . A A . 29 CYS C 1 1 10 7072 1 1 32 CYS CA C 0.104 -5.156 1.964 1.00 . A A . 29 CYS CA 1 1 10 7073 1 1 32 CYS CB C -1.263 -4.821 1.377 1.00 . A A . 29 CYS CB 1 1 10 7074 1 1 32 CYS H H -0.801 -5.163 3.866 1.00 . A A . 29 CYS H 1 1 10 7075 1 1 32 CYS HA H 0.497 -6.023 1.456 1.00 . A A . 29 CYS HA 1 1 10 7076 1 1 32 CYS HB2 H -1.807 -4.216 2.086 1.00 . A A . 29 CYS HB2 1 1 10 7077 1 1 32 CYS HB3 H -1.130 -4.260 0.469 1.00 . A A . 29 CYS HB3 1 1 10 7078 1 1 32 CYS N N -0.024 -5.488 3.371 1.00 . A A . 29 CYS N 1 1 10 7079 1 1 32 CYS O O 1.725 -3.885 0.730 1.00 . A A . 29 CYS O 1 1 10 7080 1 1 32 CYS SG S -2.289 -6.260 0.996 1.00 . A A . 29 CYS SG 1 1 10 7081 1 1 33 SER C C 3.529 -2.472 2.733 1.00 . A A . 30 SER C 1 1 10 7082 1 1 33 SER CA C 2.078 -1.996 2.721 1.00 . A A . 30 SER CA 1 1 10 7083 1 1 33 SER CB C 1.814 -1.055 3.900 1.00 . A A . 30 SER CB 1 1 10 7084 1 1 33 SER H H 0.625 -3.265 3.579 1.00 . A A . 30 SER H 1 1 10 7085 1 1 33 SER HA H 1.894 -1.466 1.798 1.00 . A A . 30 SER HA 1 1 10 7086 1 1 33 SER HB2 H 2.135 -1.529 4.814 1.00 . A A . 30 SER HB2 1 1 10 7087 1 1 33 SER HB3 H 2.367 -0.138 3.756 1.00 . A A . 30 SER HB3 1 1 10 7088 1 1 33 SER HG H 0.143 -0.270 3.213 1.00 . A A . 30 SER HG 1 1 10 7089 1 1 33 SER N N 1.172 -3.132 2.775 1.00 . A A . 30 SER N 1 1 10 7090 1 1 33 SER O O 4.429 -1.768 2.283 1.00 . A A . 30 SER O 1 1 10 7091 1 1 33 SER OG O 0.432 -0.745 4.004 1.00 . A A . 30 SER OG 1 1 10 7092 1 1 34 LYS C C 5.150 -5.458 2.315 1.00 . A A . 31 LYS C 1 1 10 7093 1 1 34 LYS CA C 5.076 -4.264 3.263 1.00 . A A . 31 LYS CA 1 1 10 7094 1 1 34 LYS CB C 5.462 -4.677 4.686 1.00 . A A . 31 LYS CB 1 1 10 7095 1 1 34 LYS CD C 5.050 -6.141 6.683 1.00 . A A . 31 LYS CD 1 1 10 7096 1 1 34 LYS CE C 4.312 -7.353 7.228 1.00 . A A . 31 LYS CE 1 1 10 7097 1 1 34 LYS CG C 4.660 -5.842 5.243 1.00 . A A . 31 LYS CG 1 1 10 7098 1 1 34 LYS H H 2.997 -4.176 3.638 1.00 . A A . 31 LYS H 1 1 10 7099 1 1 34 LYS HA H 5.768 -3.512 2.920 1.00 . A A . 31 LYS HA 1 1 10 7100 1 1 34 LYS HB2 H 6.505 -4.953 4.696 1.00 . A A . 31 LYS HB2 1 1 10 7101 1 1 34 LYS HB3 H 5.318 -3.829 5.339 1.00 . A A . 31 LYS HB3 1 1 10 7102 1 1 34 LYS HD2 H 6.111 -6.330 6.726 1.00 . A A . 31 LYS HD2 1 1 10 7103 1 1 34 LYS HD3 H 4.811 -5.282 7.293 1.00 . A A . 31 LYS HD3 1 1 10 7104 1 1 34 LYS HE2 H 4.575 -7.479 8.268 1.00 . A A . 31 LYS HE2 1 1 10 7105 1 1 34 LYS HE3 H 3.250 -7.178 7.147 1.00 . A A . 31 LYS HE3 1 1 10 7106 1 1 34 LYS HG2 H 3.609 -5.595 5.208 1.00 . A A . 31 LYS HG2 1 1 10 7107 1 1 34 LYS HG3 H 4.848 -6.718 4.640 1.00 . A A . 31 LYS HG3 1 1 10 7108 1 1 34 LYS HZ1 H 4.081 -9.389 6.841 1.00 . A A . 31 LYS HZ1 1 1 10 7109 1 1 34 LYS HZ2 H 5.660 -8.830 6.625 1.00 . A A . 31 LYS HZ2 1 1 10 7110 1 1 34 LYS HZ3 H 4.473 -8.476 5.476 1.00 . A A . 31 LYS HZ3 1 1 10 7111 1 1 34 LYS N N 3.748 -3.678 3.246 1.00 . A A . 31 LYS N 1 1 10 7112 1 1 34 LYS NZ N 4.656 -8.596 6.491 1.00 . A A . 31 LYS NZ 1 1 10 7113 1 1 34 LYS O O 6.141 -6.185 2.287 1.00 . A A . 31 LYS O 1 1 10 7114 1 1 35 LYS C C 4.811 -6.394 -0.686 1.00 . A A . 32 LYS C 1 1 10 7115 1 1 35 LYS CA C 4.033 -6.742 0.575 1.00 . A A . 32 LYS CA 1 1 10 7116 1 1 35 LYS CB C 2.576 -7.040 0.216 1.00 . A A . 32 LYS CB 1 1 10 7117 1 1 35 LYS CD C 2.632 -9.551 0.200 1.00 . A A . 32 LYS CD 1 1 10 7118 1 1 35 LYS CE C 2.385 -10.811 -0.615 1.00 . A A . 32 LYS CE 1 1 10 7119 1 1 35 LYS CG C 2.381 -8.296 -0.618 1.00 . A A . 32 LYS CG 1 1 10 7120 1 1 35 LYS H H 3.346 -5.015 1.588 1.00 . A A . 32 LYS H 1 1 10 7121 1 1 35 LYS HA H 4.474 -7.613 1.034 1.00 . A A . 32 LYS HA 1 1 10 7122 1 1 35 LYS HB2 H 2.012 -7.152 1.128 1.00 . A A . 32 LYS HB2 1 1 10 7123 1 1 35 LYS HB3 H 2.180 -6.203 -0.339 1.00 . A A . 32 LYS HB3 1 1 10 7124 1 1 35 LYS HD2 H 3.655 -9.549 0.537 1.00 . A A . 32 LYS HD2 1 1 10 7125 1 1 35 LYS HD3 H 1.968 -9.549 1.052 1.00 . A A . 32 LYS HD3 1 1 10 7126 1 1 35 LYS HE2 H 2.553 -11.670 0.017 1.00 . A A . 32 LYS HE2 1 1 10 7127 1 1 35 LYS HE3 H 1.359 -10.810 -0.952 1.00 . A A . 32 LYS HE3 1 1 10 7128 1 1 35 LYS HG2 H 1.367 -8.318 -0.988 1.00 . A A . 32 LYS HG2 1 1 10 7129 1 1 35 LYS HG3 H 3.070 -8.275 -1.449 1.00 . A A . 32 LYS HG3 1 1 10 7130 1 1 35 LYS HZ1 H 3.134 -10.082 -2.420 1.00 . A A . 32 LYS HZ1 1 1 10 7131 1 1 35 LYS HZ2 H 3.081 -11.769 -2.332 1.00 . A A . 32 LYS HZ2 1 1 10 7132 1 1 35 LYS HZ3 H 4.278 -10.917 -1.492 1.00 . A A . 32 LYS HZ3 1 1 10 7133 1 1 35 LYS N N 4.100 -5.640 1.527 1.00 . A A . 32 LYS N 1 1 10 7134 1 1 35 LYS NZ N 3.283 -10.899 -1.796 1.00 . A A . 32 LYS NZ 1 1 10 7135 1 1 35 LYS O O 5.538 -7.219 -1.235 1.00 . A A . 32 LYS O 1 1 10 7136 1 1 36 HIS C C 6.812 -4.487 -2.138 1.00 . A A . 33 HIS C 1 1 10 7137 1 1 36 HIS CA C 5.310 -4.689 -2.345 1.00 . A A . 33 HIS CA 1 1 10 7138 1 1 36 HIS CB C 4.661 -3.380 -2.830 1.00 . A A . 33 HIS CB 1 1 10 7139 1 1 36 HIS CD2 C 5.873 -1.679 -1.298 1.00 . A A . 33 HIS CD2 1 1 10 7140 1 1 36 HIS CE1 C 4.189 -0.560 -0.563 1.00 . A A . 33 HIS CE1 1 1 10 7141 1 1 36 HIS CG C 4.775 -2.232 -1.862 1.00 . A A . 33 HIS CG 1 1 10 7142 1 1 36 HIS H H 4.097 -4.534 -0.617 1.00 . A A . 33 HIS H 1 1 10 7143 1 1 36 HIS HA H 5.166 -5.449 -3.099 1.00 . A A . 33 HIS HA 1 1 10 7144 1 1 36 HIS HB2 H 5.133 -3.079 -3.753 1.00 . A A . 33 HIS HB2 1 1 10 7145 1 1 36 HIS HB3 H 3.611 -3.557 -3.014 1.00 . A A . 33 HIS HB3 1 1 10 7146 1 1 36 HIS HD1 H 2.760 -1.673 -1.589 1.00 . A A . 33 HIS HD1 1 1 10 7147 1 1 36 HIS HD2 H 6.889 -2.010 -1.449 1.00 . A A . 33 HIS HD2 1 1 10 7148 1 1 36 HIS HE1 H 3.576 0.121 0.004 1.00 . A A . 33 HIS HE1 1 1 10 7149 1 1 36 HIS N N 4.664 -5.153 -1.124 1.00 . A A . 33 HIS N 1 1 10 7150 1 1 36 HIS ND1 N 3.707 -1.513 -1.380 1.00 . A A . 33 HIS ND1 1 1 10 7151 1 1 36 HIS NE2 N 5.506 -0.614 -0.485 1.00 . A A . 33 HIS NE2 1 1 10 7152 1 1 36 HIS O O 7.573 -4.394 -3.097 1.00 . A A . 33 HIS O 1 1 10 7153 1 1 37 LYS C C 9.593 -5.150 -1.028 1.00 . A A . 34 LYS C 1 1 10 7154 1 1 37 LYS CA C 8.613 -4.089 -0.550 1.00 . A A . 34 LYS CA 1 1 10 7155 1 1 37 LYS CB C 8.756 -3.868 0.959 1.00 . A A . 34 LYS CB 1 1 10 7156 1 1 37 LYS CD C 8.095 -2.503 2.977 1.00 . A A . 34 LYS CD 1 1 10 7157 1 1 37 LYS CE C 7.221 -1.363 3.479 1.00 . A A . 34 LYS CE 1 1 10 7158 1 1 37 LYS CG C 7.922 -2.706 1.480 1.00 . A A . 34 LYS CG 1 1 10 7159 1 1 37 LYS H H 6.622 -4.693 -0.161 1.00 . A A . 34 LYS H 1 1 10 7160 1 1 37 LYS HA H 8.838 -3.165 -1.059 1.00 . A A . 34 LYS HA 1 1 10 7161 1 1 37 LYS HB2 H 8.445 -4.765 1.473 1.00 . A A . 34 LYS HB2 1 1 10 7162 1 1 37 LYS HB3 H 9.793 -3.671 1.187 1.00 . A A . 34 LYS HB3 1 1 10 7163 1 1 37 LYS HD2 H 7.817 -3.410 3.491 1.00 . A A . 34 LYS HD2 1 1 10 7164 1 1 37 LYS HD3 H 9.129 -2.271 3.183 1.00 . A A . 34 LYS HD3 1 1 10 7165 1 1 37 LYS HE2 H 7.513 -0.459 2.968 1.00 . A A . 34 LYS HE2 1 1 10 7166 1 1 37 LYS HE3 H 6.187 -1.583 3.249 1.00 . A A . 34 LYS HE3 1 1 10 7167 1 1 37 LYS HG2 H 8.226 -1.803 0.971 1.00 . A A . 34 LYS HG2 1 1 10 7168 1 1 37 LYS HG3 H 6.881 -2.903 1.271 1.00 . A A . 34 LYS HG3 1 1 10 7169 1 1 37 LYS HZ1 H 7.288 -2.050 5.451 1.00 . A A . 34 LYS HZ1 1 1 10 7170 1 1 37 LYS HZ2 H 6.610 -0.511 5.283 1.00 . A A . 34 LYS HZ2 1 1 10 7171 1 1 37 LYS HZ3 H 8.284 -0.714 5.154 1.00 . A A . 34 LYS HZ3 1 1 10 7172 1 1 37 LYS N N 7.240 -4.451 -0.881 1.00 . A A . 34 LYS N 1 1 10 7173 1 1 37 LYS NZ N 7.360 -1.145 4.944 1.00 . A A . 34 LYS NZ 1 1 10 7174 1 1 37 LYS O O 10.775 -4.873 -1.230 1.00 . A A . 34 LYS O 1 1 10 7175 1 1 38 THR C C 10.191 -7.436 -3.156 1.00 . A A . 35 THR C 1 1 10 7176 1 1 38 THR CA C 9.912 -7.469 -1.650 1.00 . A A . 35 THR CA 1 1 10 7177 1 1 38 THR CB C 9.239 -8.806 -1.263 1.00 . A A . 35 THR CB 1 1 10 7178 1 1 38 THR CG2 C 8.003 -9.068 -2.115 1.00 . A A . 35 THR CG2 1 1 10 7179 1 1 38 THR H H 8.122 -6.491 -1.115 1.00 . A A . 35 THR H 1 1 10 7180 1 1 38 THR HA H 10.849 -7.397 -1.121 1.00 . A A . 35 THR HA 1 1 10 7181 1 1 38 THR HB H 8.931 -8.744 -0.229 1.00 . A A . 35 THR HB 1 1 10 7182 1 1 38 THR HG1 H 10.902 -9.772 -0.802 1.00 . A A . 35 THR HG1 1 1 10 7183 1 1 38 THR HG21 H 7.582 -10.027 -1.853 1.00 . A A . 35 THR HG21 1 1 10 7184 1 1 38 THR HG22 H 8.278 -9.068 -3.158 1.00 . A A . 35 THR HG22 1 1 10 7185 1 1 38 THR HG23 H 7.271 -8.294 -1.935 1.00 . A A . 35 THR HG23 1 1 10 7186 1 1 38 THR N N 9.084 -6.351 -1.242 1.00 . A A . 35 THR N 1 1 10 7187 1 1 38 THR O O 11.167 -8.021 -3.625 1.00 . A A . 35 THR O 1 1 10 7188 1 1 38 THR OG1 O 10.159 -9.895 -1.412 1.00 . A A . 35 THR OG1 1 1 10 7189 1 1 39 ARG C C 9.734 -5.315 -5.899 1.00 . A A . 36 ARG C 1 1 10 7190 1 1 39 ARG CA C 9.459 -6.717 -5.364 1.00 . A A . 36 ARG CA 1 1 10 7191 1 1 39 ARG CB C 8.179 -7.276 -5.991 1.00 . A A . 36 ARG CB 1 1 10 7192 1 1 39 ARG CD C 5.685 -7.119 -6.230 1.00 . A A . 36 ARG CD 1 1 10 7193 1 1 39 ARG CG C 6.920 -6.537 -5.569 1.00 . A A . 36 ARG CG 1 1 10 7194 1 1 39 ARG CZ C 3.266 -6.971 -5.780 1.00 . A A . 36 ARG CZ 1 1 10 7195 1 1 39 ARG H H 8.640 -6.207 -3.475 1.00 . A A . 36 ARG H 1 1 10 7196 1 1 39 ARG HA H 10.285 -7.358 -5.635 1.00 . A A . 36 ARG HA 1 1 10 7197 1 1 39 ARG HB2 H 8.263 -7.217 -7.066 1.00 . A A . 36 ARG HB2 1 1 10 7198 1 1 39 ARG HB3 H 8.075 -8.312 -5.705 1.00 . A A . 36 ARG HB3 1 1 10 7199 1 1 39 ARG HD2 H 5.804 -7.063 -7.301 1.00 . A A . 36 ARG HD2 1 1 10 7200 1 1 39 ARG HD3 H 5.589 -8.152 -5.934 1.00 . A A . 36 ARG HD3 1 1 10 7201 1 1 39 ARG HE H 4.554 -5.445 -5.646 1.00 . A A . 36 ARG HE 1 1 10 7202 1 1 39 ARG HG2 H 6.813 -6.614 -4.497 1.00 . A A . 36 ARG HG2 1 1 10 7203 1 1 39 ARG HG3 H 7.014 -5.497 -5.849 1.00 . A A . 36 ARG HG3 1 1 10 7204 1 1 39 ARG HH11 H 3.907 -8.805 -6.361 1.00 . A A . 36 ARG HH11 1 1 10 7205 1 1 39 ARG HH12 H 2.212 -8.689 -6.013 1.00 . A A . 36 ARG HH12 1 1 10 7206 1 1 39 ARG HH21 H 2.309 -5.269 -5.226 1.00 . A A . 36 ARG HH21 1 1 10 7207 1 1 39 ARG HH22 H 1.304 -6.675 -5.379 1.00 . A A . 36 ARG HH22 1 1 10 7208 1 1 39 ARG N N 9.349 -6.728 -3.907 1.00 . A A . 36 ARG N 1 1 10 7209 1 1 39 ARG NE N 4.468 -6.404 -5.852 1.00 . A A . 36 ARG NE 1 1 10 7210 1 1 39 ARG NH1 N 3.116 -8.257 -6.077 1.00 . A A . 36 ARG NH1 1 1 10 7211 1 1 39 ARG NH2 N 2.210 -6.248 -5.433 1.00 . A A . 36 ARG NH2 1 1 10 7212 1 1 39 ARG O O 10.175 -5.151 -7.035 1.00 . A A . 36 ARG O 1 1 10 7213 1 1 40 ASP C C 10.922 -2.375 -4.795 1.00 . A A . 37 ASP C 1 1 10 7214 1 1 40 ASP CA C 9.688 -2.925 -5.484 1.00 . A A . 37 ASP CA 1 1 10 7215 1 1 40 ASP CB C 8.473 -2.049 -5.145 1.00 . A A . 37 ASP CB 1 1 10 7216 1 1 40 ASP CG C 7.288 -2.286 -6.064 1.00 . A A . 37 ASP CG 1 1 10 7217 1 1 40 ASP H H 9.110 -4.490 -4.193 1.00 . A A . 37 ASP H 1 1 10 7218 1 1 40 ASP HA H 9.848 -2.909 -6.551 1.00 . A A . 37 ASP HA 1 1 10 7219 1 1 40 ASP HB2 H 8.162 -2.258 -4.132 1.00 . A A . 37 ASP HB2 1 1 10 7220 1 1 40 ASP HB3 H 8.759 -1.010 -5.219 1.00 . A A . 37 ASP HB3 1 1 10 7221 1 1 40 ASP N N 9.467 -4.307 -5.084 1.00 . A A . 37 ASP N 1 1 10 7222 1 1 40 ASP O O 11.332 -1.238 -5.037 1.00 . A A . 37 ASP O 1 1 10 7223 1 1 40 ASP OD1 O 6.737 -3.406 -6.063 1.00 . A A . 37 ASP OD1 1 1 10 7224 1 1 40 ASP OD2 O 6.897 -1.349 -6.794 1.00 . A A . 37 ASP OD2 1 1 10 7225 1 1 41 ASN C C 12.390 -1.591 -2.325 1.00 . A A . 38 ASN C 1 1 10 7226 1 1 41 ASN CA C 12.682 -2.844 -3.140 1.00 . A A . 38 ASN CA 1 1 10 7227 1 1 41 ASN CB C 13.897 -2.637 -4.043 1.00 . A A . 38 ASN CB 1 1 10 7228 1 1 41 ASN CG C 14.371 -3.921 -4.701 1.00 . A A . 38 ASN CG 1 1 10 7229 1 1 41 ASN H H 11.139 -4.113 -3.823 1.00 . A A . 38 ASN H 1 1 10 7230 1 1 41 ASN HA H 12.886 -3.657 -2.458 1.00 . A A . 38 ASN HA 1 1 10 7231 1 1 41 ASN HB2 H 13.631 -1.940 -4.821 1.00 . A A . 38 ASN HB2 1 1 10 7232 1 1 41 ASN HB3 H 14.708 -2.230 -3.460 1.00 . A A . 38 ASN HB3 1 1 10 7233 1 1 41 ASN HD21 H 15.168 -2.888 -6.198 1.00 . A A . 38 ASN HD21 1 1 10 7234 1 1 41 ASN HD22 H 15.338 -4.608 -6.295 1.00 . A A . 38 ASN HD22 1 1 10 7235 1 1 41 ASN N N 11.508 -3.214 -3.929 1.00 . A A . 38 ASN N 1 1 10 7236 1 1 41 ASN ND2 N 15.024 -3.794 -5.845 1.00 . A A . 38 ASN ND2 1 1 10 7237 1 1 41 ASN O O 13.180 -0.646 -2.288 1.00 . A A . 38 ASN O 1 1 10 7238 1 1 41 ASN OD1 O 14.167 -5.020 -4.178 1.00 . A A . 38 ASN OD1 1 1 10 7239 1 1 42 CYS C C 10.942 -0.617 0.546 1.00 . A A . 39 CYS C 1 1 10 7240 1 1 42 CYS CA C 10.737 -0.453 -0.954 1.00 . A A . 39 CYS CA 1 1 10 7241 1 1 42 CYS CB C 9.256 -0.275 -1.286 1.00 . A A . 39 CYS CB 1 1 10 7242 1 1 42 CYS H H 10.728 -2.442 -1.646 1.00 . A A . 39 CYS H 1 1 10 7243 1 1 42 CYS HA H 11.282 0.415 -1.289 1.00 . A A . 39 CYS HA 1 1 10 7244 1 1 42 CYS HB2 H 9.140 -0.227 -2.357 1.00 . A A . 39 CYS HB2 1 1 10 7245 1 1 42 CYS HB3 H 8.711 -1.127 -0.911 1.00 . A A . 39 CYS HB3 1 1 10 7246 1 1 42 CYS N N 11.244 -1.611 -1.666 1.00 . A A . 39 CYS N 1 1 10 7247 1 1 42 CYS O O 11.310 -1.692 1.016 1.00 . A A . 39 CYS O 1 1 10 7248 1 1 42 CYS SG S 8.496 1.208 -0.593 1.00 . A A . 39 CYS SG 1 1 10 7249 1 1 43 SER C C 10.008 1.438 3.427 1.00 . A A . 40 SER C 1 1 10 7250 1 1 43 SER CA C 10.956 0.474 2.707 1.00 . A A . 40 SER CA 1 1 10 7251 1 1 43 SER CB C 12.405 0.883 2.937 1.00 . A A . 40 SER CB 1 1 10 7252 1 1 43 SER H H 10.341 1.254 0.864 1.00 . A A . 40 SER H 1 1 10 7253 1 1 43 SER HA H 10.805 -0.524 3.086 1.00 . A A . 40 SER HA 1 1 10 7254 1 1 43 SER HB2 H 12.552 1.097 3.981 1.00 . A A . 40 SER HB2 1 1 10 7255 1 1 43 SER HB3 H 13.056 0.079 2.633 1.00 . A A . 40 SER HB3 1 1 10 7256 1 1 43 SER HG H 13.585 2.384 2.461 1.00 . A A . 40 SER HG 1 1 10 7257 1 1 43 SER N N 10.703 0.455 1.286 1.00 . A A . 40 SER N 1 1 10 7258 1 1 43 SER O O 9.038 1.024 4.058 1.00 . A A . 40 SER O 1 1 10 7259 1 1 43 SER OG O 12.722 2.045 2.180 1.00 . A A . 40 SER OG 1 1 10 7260 1 1 44 GLY C C 10.326 4.967 4.271 1.00 . A A . 41 GLY C 1 1 10 7261 1 1 44 GLY CA C 9.497 3.746 3.956 1.00 . A A . 41 GLY CA 1 1 10 7262 1 1 44 GLY H H 11.095 2.987 2.797 1.00 . A A . 41 GLY H 1 1 10 7263 1 1 44 GLY HA2 H 8.684 4.028 3.302 1.00 . A A . 41 GLY HA2 1 1 10 7264 1 1 44 GLY HA3 H 9.097 3.353 4.873 1.00 . A A . 41 GLY HA3 1 1 10 7265 1 1 44 GLY N N 10.300 2.726 3.310 1.00 . A A . 41 GLY N 1 1 10 7266 1 1 44 GLY O O 10.519 5.318 5.434 1.00 . A A . 41 GLY O 1 1 10 7267 1 1 45 GLN C C 11.241 7.959 2.704 1.00 . A A . 42 GLN C 1 1 10 7268 1 1 45 GLN CA C 11.764 6.700 3.383 1.00 . A A . 42 GLN CA 1 1 10 7269 1 1 45 GLN CB C 13.111 6.295 2.786 1.00 . A A . 42 GLN CB 1 1 10 7270 1 1 45 GLN CD C 15.545 6.874 2.460 1.00 . A A . 42 GLN CD 1 1 10 7271 1 1 45 GLN CG C 14.227 7.271 3.094 1.00 . A A . 42 GLN CG 1 1 10 7272 1 1 45 GLN H H 10.524 5.357 2.334 1.00 . A A . 42 GLN H 1 1 10 7273 1 1 45 GLN HA H 11.886 6.893 4.437 1.00 . A A . 42 GLN HA 1 1 10 7274 1 1 45 GLN HB2 H 13.390 5.327 3.177 1.00 . A A . 42 GLN HB2 1 1 10 7275 1 1 45 GLN HB3 H 13.010 6.224 1.713 1.00 . A A . 42 GLN HB3 1 1 10 7276 1 1 45 GLN HE21 H 16.038 5.838 4.080 1.00 . A A . 42 GLN HE21 1 1 10 7277 1 1 45 GLN HE22 H 17.207 5.843 2.805 1.00 . A A . 42 GLN HE22 1 1 10 7278 1 1 45 GLN HG2 H 13.944 8.245 2.727 1.00 . A A . 42 GLN HG2 1 1 10 7279 1 1 45 GLN HG3 H 14.355 7.313 4.165 1.00 . A A . 42 GLN HG3 1 1 10 7280 1 1 45 GLN N N 10.818 5.610 3.229 1.00 . A A . 42 GLN N 1 1 10 7281 1 1 45 GLN NE2 N 16.341 6.107 3.186 1.00 . A A . 42 GLN NE2 1 1 10 7282 1 1 45 GLN O O 11.575 9.075 3.103 1.00 . A A . 42 GLN O 1 1 10 7283 1 1 45 GLN OE1 O 15.843 7.253 1.325 1.00 . A A . 42 GLN OE1 1 1 10 7284 1 1 46 THR C C 10.949 9.664 0.231 1.00 . A A . 43 THR C 1 1 10 7285 1 1 46 THR CA C 9.842 8.874 0.930 1.00 . A A . 43 THR CA 1 1 10 7286 1 1 46 THR CB C 9.014 9.800 1.843 1.00 . A A . 43 THR CB 1 1 10 7287 1 1 46 THR CG2 C 8.120 10.718 1.024 1.00 . A A . 43 THR CG2 1 1 10 7288 1 1 46 THR H H 10.163 6.859 1.443 1.00 . A A . 43 THR H 1 1 10 7289 1 1 46 THR HA H 9.183 8.459 0.180 1.00 . A A . 43 THR HA 1 1 10 7290 1 1 46 THR HB H 9.687 10.402 2.435 1.00 . A A . 43 THR HB 1 1 10 7291 1 1 46 THR HG1 H 8.520 9.080 3.617 1.00 . A A . 43 THR HG1 1 1 10 7292 1 1 46 THR HG21 H 8.726 11.307 0.353 1.00 . A A . 43 THR HG21 1 1 10 7293 1 1 46 THR HG22 H 7.574 11.372 1.687 1.00 . A A . 43 THR HG22 1 1 10 7294 1 1 46 THR HG23 H 7.424 10.122 0.452 1.00 . A A . 43 THR HG23 1 1 10 7295 1 1 46 THR N N 10.409 7.768 1.686 1.00 . A A . 43 THR N 1 1 10 7296 1 1 46 THR O O 11.335 10.755 0.664 1.00 . A A . 43 THR O 1 1 10 7297 1 1 46 THR OG1 O 8.199 9.003 2.711 1.00 . A A . 43 THR OG1 1 1 10 7298 1 1 47 HIS C C 12.385 9.281 -3.062 1.00 . A A . 44 HIS C 1 1 10 7299 1 1 47 HIS CA C 12.542 9.698 -1.607 1.00 . A A . 44 HIS CA 1 1 10 7300 1 1 47 HIS CB C 13.906 9.252 -1.056 1.00 . A A . 44 HIS CB 1 1 10 7301 1 1 47 HIS CD2 C 15.575 10.518 -2.600 1.00 . A A . 44 HIS CD2 1 1 10 7302 1 1 47 HIS CE1 C 16.754 11.508 -1.046 1.00 . A A . 44 HIS CE1 1 1 10 7303 1 1 47 HIS CG C 15.048 10.161 -1.405 1.00 . A A . 44 HIS CG 1 1 10 7304 1 1 47 HIS H H 11.122 8.208 -1.128 1.00 . A A . 44 HIS H 1 1 10 7305 1 1 47 HIS HA H 12.450 10.770 -1.528 1.00 . A A . 44 HIS HA 1 1 10 7306 1 1 47 HIS HB2 H 13.847 9.198 0.020 1.00 . A A . 44 HIS HB2 1 1 10 7307 1 1 47 HIS HB3 H 14.134 8.270 -1.443 1.00 . A A . 44 HIS HB3 1 1 10 7308 1 1 47 HIS HD1 H 15.691 10.735 0.521 1.00 . A A . 44 HIS HD1 1 1 10 7309 1 1 47 HIS HD2 H 15.224 10.202 -3.573 1.00 . A A . 44 HIS HD2 1 1 10 7310 1 1 47 HIS HE1 H 17.499 12.109 -0.550 1.00 . A A . 44 HIS HE1 1 1 10 7311 1 1 47 HIS HE2 H 17.294 11.643 -3.015 1.00 . A A . 44 HIS HE2 1 1 10 7312 1 1 47 HIS N N 11.472 9.083 -0.837 1.00 . A A . 44 HIS N 1 1 10 7313 1 1 47 HIS ND1 N 15.813 10.799 -0.451 1.00 . A A . 44 HIS ND1 1 1 10 7314 1 1 47 HIS NE2 N 16.631 11.354 -2.349 1.00 . A A . 44 HIS NE2 1 1 10 7315 1 1 47 HIS O O 13.354 9.119 -3.802 1.00 . A A . 44 HIS O 1 1 10 7316 1 1 48 ASP C C 10.162 9.605 -5.626 1.00 . A A . 45 ASP C 1 1 10 7317 1 1 48 ASP CA C 10.835 8.550 -4.769 1.00 . A A . 45 ASP CA 1 1 10 7318 1 1 48 ASP CB C 9.929 7.323 -4.627 1.00 . A A . 45 ASP CB 1 1 10 7319 1 1 48 ASP CG C 10.521 6.268 -3.712 1.00 . A A . 45 ASP CG 1 1 10 7320 1 1 48 ASP H H 10.403 9.334 -2.863 1.00 . A A . 45 ASP H 1 1 10 7321 1 1 48 ASP HA H 11.761 8.254 -5.236 1.00 . A A . 45 ASP HA 1 1 10 7322 1 1 48 ASP HB2 H 8.978 7.630 -4.221 1.00 . A A . 45 ASP HB2 1 1 10 7323 1 1 48 ASP HB3 H 9.773 6.881 -5.601 1.00 . A A . 45 ASP HB3 1 1 10 7324 1 1 48 ASP N N 11.142 9.094 -3.461 1.00 . A A . 45 ASP N 1 1 10 7325 1 1 48 ASP O O 10.879 10.350 -6.330 1.00 . A A . 45 ASP O 1 1 10 7326 1 1 48 ASP OXT O 8.923 9.703 -5.582 1.00 . A A . 45 ASP OXT 1 1 10 7327 1 1 48 ASP OD1 O 10.496 6.460 -2.478 1.00 . A A . 45 ASP OD1 1 1 10 7328 1 1 48 ASP OD2 O 11.026 5.242 -4.215 1.00 . A A . 45 ASP OD2 1 1 10 7329 2 2 1 ZN ZN ZN -4.437 -5.524 0.649 1.00 . B A . 101 ZN ZN 1 1 10 7330 3 2 1 ZN ZN ZN 6.253 1.155 -1.084 1.00 . C A . 102 ZN ZN 1 1 11 7331 1 1 1 GLY C C -11.868 0.787 -9.916 1.00 . A A . -2 GLY C 1 1 11 7332 1 1 1 GLY CA C -10.691 -0.170 -9.865 1.00 . A A . -2 GLY CA 1 1 11 7333 1 1 1 GLY H1 H -9.331 1.129 -8.973 1.00 . A A . -2 GLY H1 1 1 11 7334 1 1 1 GLY H2 H -9.302 1.160 -10.663 1.00 . A A . -2 GLY H2 1 1 11 7335 1 1 1 GLY H3 H -8.606 -0.133 -9.830 1.00 . A A . -2 GLY H3 1 1 11 7336 1 1 1 GLY HA2 H -10.718 -0.805 -10.739 1.00 . A A . -2 GLY HA2 1 1 11 7337 1 1 1 GLY HA3 H -10.776 -0.786 -8.982 1.00 . A A . -2 GLY HA3 1 1 11 7338 1 1 1 GLY N N -9.391 0.544 -9.830 1.00 . A A . -2 GLY N 1 1 11 7339 1 1 1 GLY O O -11.956 1.607 -10.831 1.00 . A A . -2 GLY O 1 1 11 7340 1 1 2 PRO C C -13.568 3.002 -8.392 1.00 . A A . -1 PRO C 1 1 11 7341 1 1 2 PRO CA C -13.951 1.604 -8.879 1.00 . A A . -1 PRO CA 1 1 11 7342 1 1 2 PRO CB C -14.876 0.918 -7.871 1.00 . A A . -1 PRO CB 1 1 11 7343 1 1 2 PRO CD C -12.794 -0.283 -7.849 1.00 . A A . -1 PRO CD 1 1 11 7344 1 1 2 PRO CG C -13.971 0.116 -6.999 1.00 . A A . -1 PRO CG 1 1 11 7345 1 1 2 PRO HA H -14.449 1.682 -9.834 1.00 . A A . -1 PRO HA 1 1 11 7346 1 1 2 PRO HB2 H -15.409 1.666 -7.304 1.00 . A A . -1 PRO HB2 1 1 11 7347 1 1 2 PRO HB3 H -15.578 0.288 -8.394 1.00 . A A . -1 PRO HB3 1 1 11 7348 1 1 2 PRO HD2 H -11.880 -0.220 -7.278 1.00 . A A . -1 PRO HD2 1 1 11 7349 1 1 2 PRO HD3 H -12.931 -1.284 -8.232 1.00 . A A . -1 PRO HD3 1 1 11 7350 1 1 2 PRO HG2 H -13.641 0.717 -6.166 1.00 . A A . -1 PRO HG2 1 1 11 7351 1 1 2 PRO HG3 H -14.490 -0.762 -6.644 1.00 . A A . -1 PRO HG3 1 1 11 7352 1 1 2 PRO N N -12.796 0.703 -8.948 1.00 . A A . -1 PRO N 1 1 11 7353 1 1 2 PRO O O -12.487 3.201 -7.837 1.00 . A A . -1 PRO O 1 1 11 7354 1 1 3 HIS C C -15.029 5.777 -7.021 1.00 . A A . 0 HIS C 1 1 11 7355 1 1 3 HIS CA C -14.183 5.350 -8.216 1.00 . A A . 0 HIS CA 1 1 11 7356 1 1 3 HIS CB C -14.405 6.300 -9.394 1.00 . A A . 0 HIS CB 1 1 11 7357 1 1 3 HIS CD2 C -12.047 6.841 -10.319 1.00 . A A . 0 HIS CD2 1 1 11 7358 1 1 3 HIS CE1 C -12.215 5.827 -12.254 1.00 . A A . 0 HIS CE1 1 1 11 7359 1 1 3 HIS CG C -13.281 6.290 -10.382 1.00 . A A . 0 HIS CG 1 1 11 7360 1 1 3 HIS H H -15.312 3.751 -9.031 1.00 . A A . 0 HIS H 1 1 11 7361 1 1 3 HIS HA H -13.143 5.403 -7.926 1.00 . A A . 0 HIS HA 1 1 11 7362 1 1 3 HIS HB2 H -15.306 6.014 -9.913 1.00 . A A . 0 HIS HB2 1 1 11 7363 1 1 3 HIS HB3 H -14.513 7.309 -9.021 1.00 . A A . 0 HIS HB3 1 1 11 7364 1 1 3 HIS HD1 H -14.130 5.165 -11.953 1.00 . A A . 0 HIS HD1 1 1 11 7365 1 1 3 HIS HD2 H -11.639 7.411 -9.495 1.00 . A A . 0 HIS HD2 1 1 11 7366 1 1 3 HIS HE1 H -11.986 5.447 -13.238 1.00 . A A . 0 HIS HE1 1 1 11 7367 1 1 3 HIS HE2 H -10.479 6.776 -11.717 1.00 . A A . 0 HIS HE2 1 1 11 7368 1 1 3 HIS N N -14.454 3.969 -8.604 1.00 . A A . 0 HIS N 1 1 11 7369 1 1 3 HIS ND1 N -13.356 5.662 -11.608 1.00 . A A . 0 HIS ND1 1 1 11 7370 1 1 3 HIS NE2 N -11.407 6.539 -11.494 1.00 . A A . 0 HIS NE2 1 1 11 7371 1 1 3 HIS O O -14.934 6.912 -6.554 1.00 . A A . 0 HIS O 1 1 11 7372 1 1 4 MET C C -15.601 4.948 -4.127 1.00 . A A . 1 MET C 1 1 11 7373 1 1 4 MET CA C -16.582 5.092 -5.285 1.00 . A A . 1 MET CA 1 1 11 7374 1 1 4 MET CB C -17.744 4.099 -5.127 1.00 . A A . 1 MET CB 1 1 11 7375 1 1 4 MET CE C -19.675 1.784 -6.265 1.00 . A A . 1 MET CE 1 1 11 7376 1 1 4 MET CG C -17.312 2.638 -5.086 1.00 . A A . 1 MET CG 1 1 11 7377 1 1 4 MET H H -16.022 4.041 -7.040 1.00 . A A . 1 MET H 1 1 11 7378 1 1 4 MET HA H -16.969 6.101 -5.295 1.00 . A A . 1 MET HA 1 1 11 7379 1 1 4 MET HB2 H -18.269 4.321 -4.211 1.00 . A A . 1 MET HB2 1 1 11 7380 1 1 4 MET HB3 H -18.424 4.227 -5.957 1.00 . A A . 1 MET HB3 1 1 11 7381 1 1 4 MET HE1 H -20.557 1.161 -6.230 1.00 . A A . 1 MET HE1 1 1 11 7382 1 1 4 MET HE2 H -19.098 1.539 -7.143 1.00 . A A . 1 MET HE2 1 1 11 7383 1 1 4 MET HE3 H -19.970 2.822 -6.305 1.00 . A A . 1 MET HE3 1 1 11 7384 1 1 4 MET HG2 H -16.853 2.389 -6.030 1.00 . A A . 1 MET HG2 1 1 11 7385 1 1 4 MET HG3 H -16.588 2.515 -4.294 1.00 . A A . 1 MET HG3 1 1 11 7386 1 1 4 MET N N -15.868 4.869 -6.537 1.00 . A A . 1 MET N 1 1 11 7387 1 1 4 MET O O -15.700 5.635 -3.111 1.00 . A A . 1 MET O 1 1 11 7388 1 1 4 MET SD S -18.684 1.502 -4.799 1.00 . A A . 1 MET SD 1 1 11 7389 1 1 5 ALA C C -12.525 2.945 -4.043 1.00 . A A . 2 ALA C 1 1 11 7390 1 1 5 ALA CA C -13.579 3.799 -3.368 1.00 . A A . 2 ALA CA 1 1 11 7391 1 1 5 ALA CB C -14.114 3.100 -2.126 1.00 . A A . 2 ALA CB 1 1 11 7392 1 1 5 ALA H H -14.640 3.548 -5.161 1.00 . A A . 2 ALA H 1 1 11 7393 1 1 5 ALA HA H -13.141 4.743 -3.077 1.00 . A A . 2 ALA HA 1 1 11 7394 1 1 5 ALA HB1 H -14.849 3.730 -1.648 1.00 . A A . 2 ALA HB1 1 1 11 7395 1 1 5 ALA HB2 H -13.299 2.914 -1.442 1.00 . A A . 2 ALA HB2 1 1 11 7396 1 1 5 ALA HB3 H -14.570 2.163 -2.407 1.00 . A A . 2 ALA HB3 1 1 11 7397 1 1 5 ALA N N -14.640 4.057 -4.324 1.00 . A A . 2 ALA N 1 1 11 7398 1 1 5 ALA O O -12.853 2.084 -4.857 1.00 . A A . 2 ALA O 1 1 11 7399 1 1 6 VAL C C -9.871 1.196 -3.609 1.00 . A A . 3 VAL C 1 1 11 7400 1 1 6 VAL CA C -10.187 2.474 -4.369 1.00 . A A . 3 VAL CA 1 1 11 7401 1 1 6 VAL CB C -8.924 3.349 -4.475 1.00 . A A . 3 VAL CB 1 1 11 7402 1 1 6 VAL CG1 C -7.790 2.592 -5.147 1.00 . A A . 3 VAL CG1 1 1 11 7403 1 1 6 VAL CG2 C -9.234 4.629 -5.231 1.00 . A A . 3 VAL CG2 1 1 11 7404 1 1 6 VAL H H -11.066 3.868 -3.054 1.00 . A A . 3 VAL H 1 1 11 7405 1 1 6 VAL HA H -10.504 2.215 -5.369 1.00 . A A . 3 VAL HA 1 1 11 7406 1 1 6 VAL HB H -8.610 3.615 -3.477 1.00 . A A . 3 VAL HB 1 1 11 7407 1 1 6 VAL HG11 H -6.912 3.218 -5.184 1.00 . A A . 3 VAL HG11 1 1 11 7408 1 1 6 VAL HG12 H -8.082 2.320 -6.151 1.00 . A A . 3 VAL HG12 1 1 11 7409 1 1 6 VAL HG13 H -7.571 1.697 -4.581 1.00 . A A . 3 VAL HG13 1 1 11 7410 1 1 6 VAL HG21 H -10.021 5.164 -4.721 1.00 . A A . 3 VAL HG21 1 1 11 7411 1 1 6 VAL HG22 H -9.555 4.387 -6.233 1.00 . A A . 3 VAL HG22 1 1 11 7412 1 1 6 VAL HG23 H -8.350 5.245 -5.275 1.00 . A A . 3 VAL HG23 1 1 11 7413 1 1 6 VAL N N -11.271 3.193 -3.733 1.00 . A A . 3 VAL N 1 1 11 7414 1 1 6 VAL O O -9.794 1.190 -2.379 1.00 . A A . 3 VAL O 1 1 11 7415 1 1 7 LEU C C -7.845 -1.180 -3.483 1.00 . A A . 4 LEU C 1 1 11 7416 1 1 7 LEU CA C -9.338 -1.159 -3.761 1.00 . A A . 4 LEU CA 1 1 11 7417 1 1 7 LEU CB C -9.720 -2.316 -4.690 1.00 . A A . 4 LEU CB 1 1 11 7418 1 1 7 LEU CD1 C -11.491 -3.686 -5.810 1.00 . A A . 4 LEU CD1 1 1 11 7419 1 1 7 LEU CD2 C -11.623 -3.253 -3.357 1.00 . A A . 4 LEU CD2 1 1 11 7420 1 1 7 LEU CG C -11.204 -2.684 -4.705 1.00 . A A . 4 LEU CG 1 1 11 7421 1 1 7 LEU H H -9.846 0.172 -5.316 1.00 . A A . 4 LEU H 1 1 11 7422 1 1 7 LEU HA H -9.868 -1.265 -2.829 1.00 . A A . 4 LEU HA 1 1 11 7423 1 1 7 LEU HB2 H -9.428 -2.051 -5.695 1.00 . A A . 4 LEU HB2 1 1 11 7424 1 1 7 LEU HB3 H -9.161 -3.188 -4.390 1.00 . A A . 4 LEU HB3 1 1 11 7425 1 1 7 LEU HD11 H -10.928 -4.590 -5.631 1.00 . A A . 4 LEU HD11 1 1 11 7426 1 1 7 LEU HD12 H -11.201 -3.265 -6.762 1.00 . A A . 4 LEU HD12 1 1 11 7427 1 1 7 LEU HD13 H -12.545 -3.915 -5.824 1.00 . A A . 4 LEU HD13 1 1 11 7428 1 1 7 LEU HD21 H -11.008 -4.111 -3.118 1.00 . A A . 4 LEU HD21 1 1 11 7429 1 1 7 LEU HD22 H -12.659 -3.555 -3.399 1.00 . A A . 4 LEU HD22 1 1 11 7430 1 1 7 LEU HD23 H -11.499 -2.500 -2.593 1.00 . A A . 4 LEU HD23 1 1 11 7431 1 1 7 LEU HG H -11.790 -1.796 -4.896 1.00 . A A . 4 LEU HG 1 1 11 7432 1 1 7 LEU N N -9.716 0.112 -4.346 1.00 . A A . 4 LEU N 1 1 11 7433 1 1 7 LEU O O -7.066 -0.530 -4.179 1.00 . A A . 4 LEU O 1 1 11 7434 1 1 8 CYS C C -5.197 -2.359 -3.269 1.00 . A A . 5 CYS C 1 1 11 7435 1 1 8 CYS CA C -6.080 -2.095 -2.050 1.00 . A A . 5 CYS CA 1 1 11 7436 1 1 8 CYS CB C -5.997 -3.277 -1.088 1.00 . A A . 5 CYS CB 1 1 11 7437 1 1 8 CYS H H -8.169 -2.334 -1.898 1.00 . A A . 5 CYS H 1 1 11 7438 1 1 8 CYS HA H -5.743 -1.202 -1.550 1.00 . A A . 5 CYS HA 1 1 11 7439 1 1 8 CYS HB2 H -6.654 -3.103 -0.251 1.00 . A A . 5 CYS HB2 1 1 11 7440 1 1 8 CYS HB3 H -6.325 -4.166 -1.606 1.00 . A A . 5 CYS HB3 1 1 11 7441 1 1 8 CYS N N -7.474 -1.910 -2.439 1.00 . A A . 5 CYS N 1 1 11 7442 1 1 8 CYS O O -5.440 -3.289 -4.027 1.00 . A A . 5 CYS O 1 1 11 7443 1 1 8 CYS SG S -4.350 -3.612 -0.433 1.00 . A A . 5 CYS SG 1 1 11 7444 1 1 9 GLY C C -2.601 -3.012 -4.680 1.00 . A A . 6 GLY C 1 1 11 7445 1 1 9 GLY CA C -3.295 -1.664 -4.592 1.00 . A A . 6 GLY CA 1 1 11 7446 1 1 9 GLY H H -4.018 -0.818 -2.784 1.00 . A A . 6 GLY H 1 1 11 7447 1 1 9 GLY HA2 H -3.877 -1.518 -5.487 1.00 . A A . 6 GLY HA2 1 1 11 7448 1 1 9 GLY HA3 H -2.543 -0.890 -4.538 1.00 . A A . 6 GLY HA3 1 1 11 7449 1 1 9 GLY N N -4.172 -1.538 -3.441 1.00 . A A . 6 GLY N 1 1 11 7450 1 1 9 GLY O O -2.161 -3.420 -5.753 1.00 . A A . 6 GLY O 1 1 11 7451 1 1 10 VAL C C -2.835 -6.149 -3.736 1.00 . A A . 7 VAL C 1 1 11 7452 1 1 10 VAL CA C -1.837 -5.005 -3.529 1.00 . A A . 7 VAL CA 1 1 11 7453 1 1 10 VAL CB C -1.065 -5.221 -2.210 1.00 . A A . 7 VAL CB 1 1 11 7454 1 1 10 VAL CG1 C -0.480 -6.628 -2.142 1.00 . A A . 7 VAL CG1 1 1 11 7455 1 1 10 VAL CG2 C 0.035 -4.180 -2.071 1.00 . A A . 7 VAL CG2 1 1 11 7456 1 1 10 VAL H H -2.856 -3.330 -2.727 1.00 . A A . 7 VAL H 1 1 11 7457 1 1 10 VAL HA H -1.122 -5.022 -4.339 1.00 . A A . 7 VAL HA 1 1 11 7458 1 1 10 VAL HB H -1.753 -5.099 -1.388 1.00 . A A . 7 VAL HB 1 1 11 7459 1 1 10 VAL HG11 H -1.279 -7.352 -2.217 1.00 . A A . 7 VAL HG11 1 1 11 7460 1 1 10 VAL HG12 H 0.036 -6.760 -1.200 1.00 . A A . 7 VAL HG12 1 1 11 7461 1 1 10 VAL HG13 H 0.214 -6.772 -2.956 1.00 . A A . 7 VAL HG13 1 1 11 7462 1 1 10 VAL HG21 H 0.553 -4.327 -1.135 1.00 . A A . 7 VAL HG21 1 1 11 7463 1 1 10 VAL HG22 H -0.401 -3.192 -2.090 1.00 . A A . 7 VAL HG22 1 1 11 7464 1 1 10 VAL HG23 H 0.733 -4.281 -2.888 1.00 . A A . 7 VAL HG23 1 1 11 7465 1 1 10 VAL N N -2.492 -3.704 -3.555 1.00 . A A . 7 VAL N 1 1 11 7466 1 1 10 VAL O O -2.774 -6.854 -4.743 1.00 . A A . 7 VAL O 1 1 11 7467 1 1 11 CYS C C -6.023 -7.054 -3.431 1.00 . A A . 8 CYS C 1 1 11 7468 1 1 11 CYS CA C -4.678 -7.458 -2.824 1.00 . A A . 8 CYS CA 1 1 11 7469 1 1 11 CYS CB C -4.878 -8.023 -1.409 1.00 . A A . 8 CYS CB 1 1 11 7470 1 1 11 CYS H H -3.812 -5.679 -2.060 1.00 . A A . 8 CYS H 1 1 11 7471 1 1 11 CYS HA H -4.235 -8.223 -3.444 1.00 . A A . 8 CYS HA 1 1 11 7472 1 1 11 CYS HB2 H -5.392 -8.970 -1.481 1.00 . A A . 8 CYS HB2 1 1 11 7473 1 1 11 CYS HB3 H -3.912 -8.180 -0.954 1.00 . A A . 8 CYS HB3 1 1 11 7474 1 1 11 CYS N N -3.754 -6.322 -2.789 1.00 . A A . 8 CYS N 1 1 11 7475 1 1 11 CYS O O -6.720 -7.886 -4.012 1.00 . A A . 8 CYS O 1 1 11 7476 1 1 11 CYS SG S -5.843 -6.967 -0.298 1.00 . A A . 8 CYS SG 1 1 11 7477 1 1 12 GLY C C -8.815 -6.054 -3.689 1.00 . A A . 9 GLY C 1 1 11 7478 1 1 12 GLY CA C -7.566 -5.228 -3.922 1.00 . A A . 9 GLY CA 1 1 11 7479 1 1 12 GLY H H -5.747 -5.176 -2.845 1.00 . A A . 9 GLY H 1 1 11 7480 1 1 12 GLY HA2 H -7.731 -4.241 -3.519 1.00 . A A . 9 GLY HA2 1 1 11 7481 1 1 12 GLY HA3 H -7.406 -5.139 -4.986 1.00 . A A . 9 GLY HA3 1 1 11 7482 1 1 12 GLY N N -6.355 -5.774 -3.318 1.00 . A A . 9 GLY N 1 1 11 7483 1 1 12 GLY O O -9.442 -6.506 -4.645 1.00 . A A . 9 GLY O 1 1 11 7484 1 1 13 ILE C C -11.170 -6.420 -0.923 1.00 . A A . 10 ILE C 1 1 11 7485 1 1 13 ILE CA C -10.388 -7.014 -2.105 1.00 . A A . 10 ILE CA 1 1 11 7486 1 1 13 ILE CB C -10.070 -8.508 -1.828 1.00 . A A . 10 ILE CB 1 1 11 7487 1 1 13 ILE CD1 C -8.890 -8.192 0.409 1.00 . A A . 10 ILE CD1 1 1 11 7488 1 1 13 ILE CG1 C -8.779 -8.666 -1.017 1.00 . A A . 10 ILE CG1 1 1 11 7489 1 1 13 ILE CG2 C -9.969 -9.285 -3.131 1.00 . A A . 10 ILE CG2 1 1 11 7490 1 1 13 ILE H H -8.617 -5.918 -1.705 1.00 . A A . 10 ILE H 1 1 11 7491 1 1 13 ILE HA H -11.025 -6.976 -2.977 1.00 . A A . 10 ILE HA 1 1 11 7492 1 1 13 ILE HB H -10.890 -8.923 -1.260 1.00 . A A . 10 ILE HB 1 1 11 7493 1 1 13 ILE HD11 H -9.210 -7.159 0.413 1.00 . A A . 10 ILE HD11 1 1 11 7494 1 1 13 ILE HD12 H -7.927 -8.270 0.893 1.00 . A A . 10 ILE HD12 1 1 11 7495 1 1 13 ILE HD13 H -9.612 -8.795 0.937 1.00 . A A . 10 ILE HD13 1 1 11 7496 1 1 13 ILE HG12 H -8.498 -9.708 -0.996 1.00 . A A . 10 ILE HG12 1 1 11 7497 1 1 13 ILE HG13 H -7.993 -8.095 -1.494 1.00 . A A . 10 ILE HG13 1 1 11 7498 1 1 13 ILE HG21 H -9.182 -8.863 -3.740 1.00 . A A . 10 ILE HG21 1 1 11 7499 1 1 13 ILE HG22 H -10.907 -9.223 -3.663 1.00 . A A . 10 ILE HG22 1 1 11 7500 1 1 13 ILE HG23 H -9.744 -10.319 -2.918 1.00 . A A . 10 ILE HG23 1 1 11 7501 1 1 13 ILE N N -9.180 -6.256 -2.427 1.00 . A A . 10 ILE N 1 1 11 7502 1 1 13 ILE O O -12.307 -6.814 -0.676 1.00 . A A . 10 ILE O 1 1 11 7503 1 1 14 LYS C C -10.966 -3.389 1.083 1.00 . A A . 11 LYS C 1 1 11 7504 1 1 14 LYS CA C -11.247 -4.886 0.968 1.00 . A A . 11 LYS CA 1 1 11 7505 1 1 14 LYS CB C -10.823 -5.592 2.269 1.00 . A A . 11 LYS CB 1 1 11 7506 1 1 14 LYS CD C -9.033 -5.734 4.050 1.00 . A A . 11 LYS CD 1 1 11 7507 1 1 14 LYS CE C -9.498 -7.098 4.539 1.00 . A A . 11 LYS CE 1 1 11 7508 1 1 14 LYS CG C -9.329 -5.512 2.572 1.00 . A A . 11 LYS CG 1 1 11 7509 1 1 14 LYS H H -9.683 -5.165 -0.441 1.00 . A A . 11 LYS H 1 1 11 7510 1 1 14 LYS HA H -12.309 -5.024 0.831 1.00 . A A . 11 LYS HA 1 1 11 7511 1 1 14 LYS HB2 H -11.356 -5.145 3.094 1.00 . A A . 11 LYS HB2 1 1 11 7512 1 1 14 LYS HB3 H -11.097 -6.635 2.201 1.00 . A A . 11 LYS HB3 1 1 11 7513 1 1 14 LYS HD2 H -7.968 -5.655 4.208 1.00 . A A . 11 LYS HD2 1 1 11 7514 1 1 14 LYS HD3 H -9.538 -4.969 4.623 1.00 . A A . 11 LYS HD3 1 1 11 7515 1 1 14 LYS HE2 H -9.355 -7.150 5.608 1.00 . A A . 11 LYS HE2 1 1 11 7516 1 1 14 LYS HE3 H -10.549 -7.205 4.312 1.00 . A A . 11 LYS HE3 1 1 11 7517 1 1 14 LYS HG2 H -8.815 -6.267 2.001 1.00 . A A . 11 LYS HG2 1 1 11 7518 1 1 14 LYS HG3 H -8.967 -4.535 2.285 1.00 . A A . 11 LYS HG3 1 1 11 7519 1 1 14 LYS HZ1 H -7.731 -8.110 4.069 1.00 . A A . 11 LYS HZ1 1 1 11 7520 1 1 14 LYS HZ2 H -8.924 -8.225 2.877 1.00 . A A . 11 LYS HZ2 1 1 11 7521 1 1 14 LYS HZ3 H -9.063 -9.123 4.297 1.00 . A A . 11 LYS HZ3 1 1 11 7522 1 1 14 LYS N N -10.575 -5.474 -0.195 1.00 . A A . 11 LYS N 1 1 11 7523 1 1 14 LYS NZ N -8.751 -8.213 3.900 1.00 . A A . 11 LYS NZ 1 1 11 7524 1 1 14 LYS O O -10.750 -2.877 2.185 1.00 . A A . 11 LYS O 1 1 11 7525 1 1 15 GLU C C -9.266 -0.971 0.378 1.00 . A A . 12 GLU C 1 1 11 7526 1 1 15 GLU CA C -10.706 -1.248 -0.087 1.00 . A A . 12 GLU CA 1 1 11 7527 1 1 15 GLU CB C -11.730 -0.516 0.799 1.00 . A A . 12 GLU CB 1 1 11 7528 1 1 15 GLU CD C -12.747 1.665 1.565 1.00 . A A . 12 GLU CD 1 1 11 7529 1 1 15 GLU CG C -11.739 0.998 0.652 1.00 . A A . 12 GLU CG 1 1 11 7530 1 1 15 GLU H H -11.186 -3.152 -0.893 1.00 . A A . 12 GLU H 1 1 11 7531 1 1 15 GLU HA H -10.814 -0.910 -1.107 1.00 . A A . 12 GLU HA 1 1 11 7532 1 1 15 GLU HB2 H -12.716 -0.881 0.557 1.00 . A A . 12 GLU HB2 1 1 11 7533 1 1 15 GLU HB3 H -11.518 -0.752 1.832 1.00 . A A . 12 GLU HB3 1 1 11 7534 1 1 15 GLU HG2 H -10.758 1.377 0.893 1.00 . A A . 12 GLU HG2 1 1 11 7535 1 1 15 GLU HG3 H -11.980 1.248 -0.371 1.00 . A A . 12 GLU HG3 1 1 11 7536 1 1 15 GLU N N -10.976 -2.691 -0.056 1.00 . A A . 12 GLU N 1 1 11 7537 1 1 15 GLU O O -8.512 -1.903 0.678 1.00 . A A . 12 GLU O 1 1 11 7538 1 1 15 GLU OE1 O -12.429 1.880 2.756 1.00 . A A . 12 GLU OE1 1 1 11 7539 1 1 15 GLU OE2 O -13.854 1.993 1.096 1.00 . A A . 12 GLU OE2 1 1 11 7540 1 1 16 PHE C C -7.737 1.405 2.236 1.00 . A A . 13 PHE C 1 1 11 7541 1 1 16 PHE CA C -7.570 0.675 0.911 1.00 . A A . 13 PHE CA 1 1 11 7542 1 1 16 PHE CB C -6.824 1.569 -0.078 1.00 . A A . 13 PHE CB 1 1 11 7543 1 1 16 PHE CD1 C -8.392 3.368 -0.878 1.00 . A A . 13 PHE CD1 1 1 11 7544 1 1 16 PHE CD2 C -6.627 3.981 0.604 1.00 . A A . 13 PHE CD2 1 1 11 7545 1 1 16 PHE CE1 C -8.811 4.685 -0.925 1.00 . A A . 13 PHE CE1 1 1 11 7546 1 1 16 PHE CE2 C -7.042 5.299 0.562 1.00 . A A . 13 PHE CE2 1 1 11 7547 1 1 16 PHE CG C -7.298 3.000 -0.114 1.00 . A A . 13 PHE CG 1 1 11 7548 1 1 16 PHE CZ C -8.134 5.651 -0.207 1.00 . A A . 13 PHE CZ 1 1 11 7549 1 1 16 PHE H H -9.443 0.980 -0.005 1.00 . A A . 13 PHE H 1 1 11 7550 1 1 16 PHE HA H -6.997 -0.225 1.076 1.00 . A A . 13 PHE HA 1 1 11 7551 1 1 16 PHE HB2 H -5.779 1.579 0.183 1.00 . A A . 13 PHE HB2 1 1 11 7552 1 1 16 PHE HB3 H -6.931 1.158 -1.071 1.00 . A A . 13 PHE HB3 1 1 11 7553 1 1 16 PHE HD1 H -8.924 2.615 -1.441 1.00 . A A . 13 PHE HD1 1 1 11 7554 1 1 16 PHE HD2 H -5.775 3.704 1.212 1.00 . A A . 13 PHE HD2 1 1 11 7555 1 1 16 PHE HE1 H -9.667 4.957 -1.526 1.00 . A A . 13 PHE HE1 1 1 11 7556 1 1 16 PHE HE2 H -6.507 6.056 1.118 1.00 . A A . 13 PHE HE2 1 1 11 7557 1 1 16 PHE HZ H -8.459 6.679 -0.246 1.00 . A A . 13 PHE HZ 1 1 11 7558 1 1 16 PHE N N -8.864 0.291 0.379 1.00 . A A . 13 PHE N 1 1 11 7559 1 1 16 PHE O O -8.824 1.893 2.557 1.00 . A A . 13 PHE O 1 1 11 7560 1 1 17 LYS C C -5.358 2.965 4.431 1.00 . A A . 14 LYS C 1 1 11 7561 1 1 17 LYS CA C -6.655 2.177 4.263 1.00 . A A . 14 LYS CA 1 1 11 7562 1 1 17 LYS CB C -6.834 1.162 5.399 1.00 . A A . 14 LYS CB 1 1 11 7563 1 1 17 LYS CD C -7.054 0.733 7.865 1.00 . A A . 14 LYS CD 1 1 11 7564 1 1 17 LYS CE C -6.976 1.338 9.257 1.00 . A A . 14 LYS CE 1 1 11 7565 1 1 17 LYS CG C -6.704 1.752 6.793 1.00 . A A . 14 LYS CG 1 1 11 7566 1 1 17 LYS H H -5.830 1.048 2.687 1.00 . A A . 14 LYS H 1 1 11 7567 1 1 17 LYS HA H -7.485 2.865 4.267 1.00 . A A . 14 LYS HA 1 1 11 7568 1 1 17 LYS HB2 H -7.813 0.718 5.312 1.00 . A A . 14 LYS HB2 1 1 11 7569 1 1 17 LYS HB3 H -6.088 0.389 5.288 1.00 . A A . 14 LYS HB3 1 1 11 7570 1 1 17 LYS HD2 H -8.058 0.377 7.694 1.00 . A A . 14 LYS HD2 1 1 11 7571 1 1 17 LYS HD3 H -6.361 -0.094 7.801 1.00 . A A . 14 LYS HD3 1 1 11 7572 1 1 17 LYS HE2 H -7.625 2.199 9.299 1.00 . A A . 14 LYS HE2 1 1 11 7573 1 1 17 LYS HE3 H -7.308 0.602 9.974 1.00 . A A . 14 LYS HE3 1 1 11 7574 1 1 17 LYS HG2 H -5.683 2.071 6.939 1.00 . A A . 14 LYS HG2 1 1 11 7575 1 1 17 LYS HG3 H -7.367 2.599 6.880 1.00 . A A . 14 LYS HG3 1 1 11 7576 1 1 17 LYS HZ1 H -4.972 0.929 9.671 1.00 . A A . 14 LYS HZ1 1 1 11 7577 1 1 17 LYS HZ2 H -5.588 2.255 10.518 1.00 . A A . 14 LYS HZ2 1 1 11 7578 1 1 17 LYS HZ3 H -5.221 2.401 8.877 1.00 . A A . 14 LYS HZ3 1 1 11 7579 1 1 17 LYS N N -6.659 1.482 2.993 1.00 . A A . 14 LYS N 1 1 11 7580 1 1 17 LYS NZ N -5.594 1.760 9.604 1.00 . A A . 14 LYS NZ 1 1 11 7581 1 1 17 LYS O O -5.334 4.020 5.066 1.00 . A A . 14 LYS O 1 1 11 7582 1 1 18 TYR C C -2.597 3.693 2.584 1.00 . A A . 15 TYR C 1 1 11 7583 1 1 18 TYR CA C -2.978 3.069 3.917 1.00 . A A . 15 TYR CA 1 1 11 7584 1 1 18 TYR CB C -1.921 2.027 4.299 1.00 . A A . 15 TYR CB 1 1 11 7585 1 1 18 TYR CD1 C -3.219 0.645 5.962 1.00 . A A . 15 TYR CD1 1 1 11 7586 1 1 18 TYR CD2 C -1.160 1.608 6.664 1.00 . A A . 15 TYR CD2 1 1 11 7587 1 1 18 TYR CE1 C -3.391 0.085 7.207 1.00 . A A . 15 TYR CE1 1 1 11 7588 1 1 18 TYR CE2 C -1.323 1.049 7.917 1.00 . A A . 15 TYR CE2 1 1 11 7589 1 1 18 TYR CG C -2.105 1.414 5.667 1.00 . A A . 15 TYR CG 1 1 11 7590 1 1 18 TYR CZ C -2.441 0.290 8.183 1.00 . A A . 15 TYR CZ 1 1 11 7591 1 1 18 TYR H H -4.397 1.635 3.301 1.00 . A A . 15 TYR H 1 1 11 7592 1 1 18 TYR HA H -3.012 3.837 4.674 1.00 . A A . 15 TYR HA 1 1 11 7593 1 1 18 TYR HB2 H -1.946 1.224 3.578 1.00 . A A . 15 TYR HB2 1 1 11 7594 1 1 18 TYR HB3 H -0.946 2.492 4.273 1.00 . A A . 15 TYR HB3 1 1 11 7595 1 1 18 TYR HD1 H -3.961 0.483 5.194 1.00 . A A . 15 TYR HD1 1 1 11 7596 1 1 18 TYR HD2 H -0.285 2.202 6.449 1.00 . A A . 15 TYR HD2 1 1 11 7597 1 1 18 TYR HE1 H -4.269 -0.509 7.411 1.00 . A A . 15 TYR HE1 1 1 11 7598 1 1 18 TYR HE2 H -0.578 1.209 8.681 1.00 . A A . 15 TYR HE2 1 1 11 7599 1 1 18 TYR HH H -2.295 0.349 10.100 1.00 . A A . 15 TYR HH 1 1 11 7600 1 1 18 TYR N N -4.295 2.454 3.831 1.00 . A A . 15 TYR N 1 1 11 7601 1 1 18 TYR O O -3.386 3.694 1.637 1.00 . A A . 15 TYR O 1 1 11 7602 1 1 18 TYR OH O -2.611 -0.267 9.427 1.00 . A A . 15 TYR OH 1 1 11 7603 1 1 19 LYS C C 0.649 4.975 1.443 1.00 . A A . 16 LYS C 1 1 11 7604 1 1 19 LYS CA C -0.858 4.813 1.305 1.00 . A A . 16 LYS CA 1 1 11 7605 1 1 19 LYS CB C -1.535 6.170 1.078 1.00 . A A . 16 LYS CB 1 1 11 7606 1 1 19 LYS CD C -2.357 7.875 -0.549 1.00 . A A . 16 LYS CD 1 1 11 7607 1 1 19 LYS CE C -2.355 8.361 -1.987 1.00 . A A . 16 LYS CE 1 1 11 7608 1 1 19 LYS CG C -1.377 6.736 -0.326 1.00 . A A . 16 LYS CG 1 1 11 7609 1 1 19 LYS H H -0.811 4.186 3.319 1.00 . A A . 16 LYS H 1 1 11 7610 1 1 19 LYS HA H -1.074 4.157 0.476 1.00 . A A . 16 LYS HA 1 1 11 7611 1 1 19 LYS HB2 H -2.592 6.064 1.277 1.00 . A A . 16 LYS HB2 1 1 11 7612 1 1 19 LYS HB3 H -1.121 6.882 1.776 1.00 . A A . 16 LYS HB3 1 1 11 7613 1 1 19 LYS HD2 H -3.351 7.535 -0.300 1.00 . A A . 16 LYS HD2 1 1 11 7614 1 1 19 LYS HD3 H -2.086 8.696 0.099 1.00 . A A . 16 LYS HD3 1 1 11 7615 1 1 19 LYS HE2 H -2.440 7.505 -2.638 1.00 . A A . 16 LYS HE2 1 1 11 7616 1 1 19 LYS HE3 H -3.207 9.007 -2.131 1.00 . A A . 16 LYS HE3 1 1 11 7617 1 1 19 LYS HG2 H -0.369 7.107 -0.450 1.00 . A A . 16 LYS HG2 1 1 11 7618 1 1 19 LYS HG3 H -1.571 5.957 -1.048 1.00 . A A . 16 LYS HG3 1 1 11 7619 1 1 19 LYS HZ1 H -0.277 8.525 -2.129 1.00 . A A . 16 LYS HZ1 1 1 11 7620 1 1 19 LYS HZ2 H -1.052 9.980 -1.762 1.00 . A A . 16 LYS HZ2 1 1 11 7621 1 1 19 LYS HZ3 H -1.114 9.363 -3.336 1.00 . A A . 16 LYS HZ3 1 1 11 7622 1 1 19 LYS N N -1.379 4.207 2.518 1.00 . A A . 16 LYS N 1 1 11 7623 1 1 19 LYS NZ N -1.113 9.107 -2.327 1.00 . A A . 16 LYS NZ 1 1 11 7624 1 1 19 LYS O O 1.114 5.889 2.124 1.00 . A A . 16 LYS O 1 1 11 7625 1 1 20 CYS C C 3.432 5.444 0.578 1.00 . A A . 17 CYS C 1 1 11 7626 1 1 20 CYS CA C 2.866 4.081 0.957 1.00 . A A . 17 CYS CA 1 1 11 7627 1 1 20 CYS CB C 3.523 3.005 0.083 1.00 . A A . 17 CYS CB 1 1 11 7628 1 1 20 CYS H H 0.976 3.354 0.310 1.00 . A A . 17 CYS H 1 1 11 7629 1 1 20 CYS HA H 3.107 3.882 1.989 1.00 . A A . 17 CYS HA 1 1 11 7630 1 1 20 CYS HB2 H 3.189 2.035 0.408 1.00 . A A . 17 CYS HB2 1 1 11 7631 1 1 20 CYS HB3 H 3.239 3.160 -0.946 1.00 . A A . 17 CYS HB3 1 1 11 7632 1 1 20 CYS N N 1.408 4.060 0.839 1.00 . A A . 17 CYS N 1 1 11 7633 1 1 20 CYS O O 3.159 5.958 -0.503 1.00 . A A . 17 CYS O 1 1 11 7634 1 1 20 CYS SG S 5.335 3.044 0.177 1.00 . A A . 17 CYS SG 1 1 11 7635 1 1 21 PRO C C 5.686 7.404 -0.022 1.00 . A A . 18 PRO C 1 1 11 7636 1 1 21 PRO CA C 4.872 7.341 1.267 1.00 . A A . 18 PRO CA 1 1 11 7637 1 1 21 PRO CB C 5.798 7.514 2.483 1.00 . A A . 18 PRO CB 1 1 11 7638 1 1 21 PRO CD C 4.574 5.480 2.802 1.00 . A A . 18 PRO CD 1 1 11 7639 1 1 21 PRO CG C 5.844 6.187 3.160 1.00 . A A . 18 PRO CG 1 1 11 7640 1 1 21 PRO HA H 4.138 8.133 1.261 1.00 . A A . 18 PRO HA 1 1 11 7641 1 1 21 PRO HB2 H 6.782 7.808 2.147 1.00 . A A . 18 PRO HB2 1 1 11 7642 1 1 21 PRO HB3 H 5.396 8.274 3.136 1.00 . A A . 18 PRO HB3 1 1 11 7643 1 1 21 PRO HD2 H 4.743 4.415 2.743 1.00 . A A . 18 PRO HD2 1 1 11 7644 1 1 21 PRO HD3 H 3.800 5.704 3.521 1.00 . A A . 18 PRO HD3 1 1 11 7645 1 1 21 PRO HG2 H 6.697 5.626 2.805 1.00 . A A . 18 PRO HG2 1 1 11 7646 1 1 21 PRO HG3 H 5.907 6.325 4.229 1.00 . A A . 18 PRO HG3 1 1 11 7647 1 1 21 PRO N N 4.239 6.034 1.481 1.00 . A A . 18 PRO N 1 1 11 7648 1 1 21 PRO O O 5.861 8.470 -0.599 1.00 . A A . 18 PRO O 1 1 11 7649 1 1 22 ARG C C 6.206 5.725 -2.874 1.00 . A A . 19 ARG C 1 1 11 7650 1 1 22 ARG CA C 7.004 6.205 -1.671 1.00 . A A . 19 ARG CA 1 1 11 7651 1 1 22 ARG CB C 8.203 5.285 -1.459 1.00 . A A . 19 ARG CB 1 1 11 7652 1 1 22 ARG CD C 10.406 4.883 -0.345 1.00 . A A . 19 ARG CD 1 1 11 7653 1 1 22 ARG CG C 9.305 5.891 -0.615 1.00 . A A . 19 ARG CG 1 1 11 7654 1 1 22 ARG CZ C 12.102 3.845 -1.818 1.00 . A A . 19 ARG CZ 1 1 11 7655 1 1 22 ARG H H 5.986 5.432 0.020 1.00 . A A . 19 ARG H 1 1 11 7656 1 1 22 ARG HA H 7.363 7.203 -1.870 1.00 . A A . 19 ARG HA 1 1 11 7657 1 1 22 ARG HB2 H 7.866 4.380 -0.977 1.00 . A A . 19 ARG HB2 1 1 11 7658 1 1 22 ARG HB3 H 8.618 5.034 -2.422 1.00 . A A . 19 ARG HB3 1 1 11 7659 1 1 22 ARG HD2 H 11.249 5.400 0.080 1.00 . A A . 19 ARG HD2 1 1 11 7660 1 1 22 ARG HD3 H 10.039 4.154 0.364 1.00 . A A . 19 ARG HD3 1 1 11 7661 1 1 22 ARG HE H 10.139 3.932 -2.202 1.00 . A A . 19 ARG HE 1 1 11 7662 1 1 22 ARG HG2 H 9.724 6.738 -1.136 1.00 . A A . 19 ARG HG2 1 1 11 7663 1 1 22 ARG HG3 H 8.886 6.215 0.328 1.00 . A A . 19 ARG HG3 1 1 11 7664 1 1 22 ARG HH11 H 12.881 4.775 -0.189 1.00 . A A . 19 ARG HH11 1 1 11 7665 1 1 22 ARG HH12 H 14.030 3.958 -1.201 1.00 . A A . 19 ARG HH12 1 1 11 7666 1 1 22 ARG HH21 H 11.652 2.866 -3.539 1.00 . A A . 19 ARG HH21 1 1 11 7667 1 1 22 ARG HH22 H 13.335 2.886 -3.109 1.00 . A A . 19 ARG HH22 1 1 11 7668 1 1 22 ARG N N 6.184 6.259 -0.468 1.00 . A A . 19 ARG N 1 1 11 7669 1 1 22 ARG NE N 10.838 4.187 -1.557 1.00 . A A . 19 ARG NE 1 1 11 7670 1 1 22 ARG NH1 N 13.082 4.224 -1.006 1.00 . A A . 19 ARG NH1 1 1 11 7671 1 1 22 ARG NH2 N 12.386 3.143 -2.909 1.00 . A A . 19 ARG NH2 1 1 11 7672 1 1 22 ARG O O 6.165 6.389 -3.908 1.00 . A A . 19 ARG O 1 1 11 7673 1 1 23 CYS C C 3.558 4.635 -4.156 1.00 . A A . 20 CYS C 1 1 11 7674 1 1 23 CYS CA C 4.876 3.945 -3.854 1.00 . A A . 20 CYS CA 1 1 11 7675 1 1 23 CYS CB C 4.612 2.468 -3.562 1.00 . A A . 20 CYS CB 1 1 11 7676 1 1 23 CYS H H 5.553 4.138 -1.856 1.00 . A A . 20 CYS H 1 1 11 7677 1 1 23 CYS HA H 5.513 4.023 -4.716 1.00 . A A . 20 CYS HA 1 1 11 7678 1 1 23 CYS HB2 H 3.954 2.393 -2.712 1.00 . A A . 20 CYS HB2 1 1 11 7679 1 1 23 CYS HB3 H 4.135 2.020 -4.421 1.00 . A A . 20 CYS HB3 1 1 11 7680 1 1 23 CYS N N 5.566 4.572 -2.731 1.00 . A A . 20 CYS N 1 1 11 7681 1 1 23 CYS O O 3.053 4.570 -5.277 1.00 . A A . 20 CYS O 1 1 11 7682 1 1 23 CYS SG S 6.089 1.505 -3.189 1.00 . A A . 20 CYS SG 1 1 11 7683 1 1 24 LEU C C 0.592 4.872 -3.377 1.00 . A A . 21 LEU C 1 1 11 7684 1 1 24 LEU CA C 1.691 5.913 -3.192 1.00 . A A . 21 LEU CA 1 1 11 7685 1 1 24 LEU CB C 1.610 6.972 -4.299 1.00 . A A . 21 LEU CB 1 1 11 7686 1 1 24 LEU CD1 C 2.195 9.298 -5.000 1.00 . A A . 21 LEU CD1 1 1 11 7687 1 1 24 LEU CD2 C 3.065 8.418 -2.832 1.00 . A A . 21 LEU CD2 1 1 11 7688 1 1 24 LEU CG C 2.682 8.067 -4.261 1.00 . A A . 21 LEU CG 1 1 11 7689 1 1 24 LEU H H 3.516 5.352 -2.298 1.00 . A A . 21 LEU H 1 1 11 7690 1 1 24 LEU HA H 1.532 6.400 -2.241 1.00 . A A . 21 LEU HA 1 1 11 7691 1 1 24 LEU HB2 H 1.681 6.467 -5.251 1.00 . A A . 21 LEU HB2 1 1 11 7692 1 1 24 LEU HB3 H 0.643 7.447 -4.236 1.00 . A A . 21 LEU HB3 1 1 11 7693 1 1 24 LEU HD11 H 2.952 10.068 -4.960 1.00 . A A . 21 LEU HD11 1 1 11 7694 1 1 24 LEU HD12 H 1.288 9.659 -4.533 1.00 . A A . 21 LEU HD12 1 1 11 7695 1 1 24 LEU HD13 H 1.993 9.044 -6.030 1.00 . A A . 21 LEU HD13 1 1 11 7696 1 1 24 LEU HD21 H 3.513 7.555 -2.359 1.00 . A A . 21 LEU HD21 1 1 11 7697 1 1 24 LEU HD22 H 2.183 8.710 -2.285 1.00 . A A . 21 LEU HD22 1 1 11 7698 1 1 24 LEU HD23 H 3.773 9.234 -2.837 1.00 . A A . 21 LEU HD23 1 1 11 7699 1 1 24 LEU HG H 3.568 7.708 -4.766 1.00 . A A . 21 LEU HG 1 1 11 7700 1 1 24 LEU N N 3.007 5.280 -3.133 1.00 . A A . 21 LEU N 1 1 11 7701 1 1 24 LEU O O -0.579 5.216 -3.527 1.00 . A A . 21 LEU O 1 1 11 7702 1 1 25 VAL C C -0.804 2.455 -2.199 1.00 . A A . 22 VAL C 1 1 11 7703 1 1 25 VAL CA C 0.033 2.516 -3.463 1.00 . A A . 22 VAL CA 1 1 11 7704 1 1 25 VAL CB C 0.727 1.155 -3.734 1.00 . A A . 22 VAL CB 1 1 11 7705 1 1 25 VAL CG1 C 1.573 0.713 -2.553 1.00 . A A . 22 VAL CG1 1 1 11 7706 1 1 25 VAL CG2 C -0.297 0.088 -4.084 1.00 . A A . 22 VAL CG2 1 1 11 7707 1 1 25 VAL H H 1.918 3.392 -3.250 1.00 . A A . 22 VAL H 1 1 11 7708 1 1 25 VAL HA H -0.619 2.737 -4.297 1.00 . A A . 22 VAL HA 1 1 11 7709 1 1 25 VAL HB H 1.383 1.279 -4.584 1.00 . A A . 22 VAL HB 1 1 11 7710 1 1 25 VAL HG11 H 2.292 1.481 -2.316 1.00 . A A . 22 VAL HG11 1 1 11 7711 1 1 25 VAL HG12 H 2.091 -0.201 -2.803 1.00 . A A . 22 VAL HG12 1 1 11 7712 1 1 25 VAL HG13 H 0.934 0.542 -1.699 1.00 . A A . 22 VAL HG13 1 1 11 7713 1 1 25 VAL HG21 H 0.204 -0.856 -4.242 1.00 . A A . 22 VAL HG21 1 1 11 7714 1 1 25 VAL HG22 H -0.821 0.373 -4.985 1.00 . A A . 22 VAL HG22 1 1 11 7715 1 1 25 VAL HG23 H -1.003 -0.011 -3.272 1.00 . A A . 22 VAL HG23 1 1 11 7716 1 1 25 VAL N N 0.979 3.599 -3.350 1.00 . A A . 22 VAL N 1 1 11 7717 1 1 25 VAL O O -0.285 2.487 -1.075 1.00 . A A . 22 VAL O 1 1 11 7718 1 1 26 GLN C C -3.352 1.051 -0.828 1.00 . A A . 23 GLN C 1 1 11 7719 1 1 26 GLN CA C -3.035 2.464 -1.304 1.00 . A A . 23 GLN CA 1 1 11 7720 1 1 26 GLN CB C -4.285 3.217 -1.750 1.00 . A A . 23 GLN CB 1 1 11 7721 1 1 26 GLN CD C -5.193 5.435 -2.621 1.00 . A A . 23 GLN CD 1 1 11 7722 1 1 26 GLN CG C -3.971 4.635 -2.215 1.00 . A A . 23 GLN CG 1 1 11 7723 1 1 26 GLN H H -2.428 2.382 -3.316 1.00 . A A . 23 GLN H 1 1 11 7724 1 1 26 GLN HA H -2.573 3.006 -0.491 1.00 . A A . 23 GLN HA 1 1 11 7725 1 1 26 GLN HB2 H -4.748 2.680 -2.566 1.00 . A A . 23 GLN HB2 1 1 11 7726 1 1 26 GLN HB3 H -4.978 3.275 -0.924 1.00 . A A . 23 GLN HB3 1 1 11 7727 1 1 26 GLN HE21 H -6.119 3.795 -3.245 1.00 . A A . 23 GLN HE21 1 1 11 7728 1 1 26 GLN HE22 H -7.009 5.271 -3.406 1.00 . A A . 23 GLN HE22 1 1 11 7729 1 1 26 GLN HG2 H -3.480 5.157 -1.409 1.00 . A A . 23 GLN HG2 1 1 11 7730 1 1 26 GLN HG3 H -3.301 4.577 -3.060 1.00 . A A . 23 GLN HG3 1 1 11 7731 1 1 26 GLN N N -2.094 2.427 -2.396 1.00 . A A . 23 GLN N 1 1 11 7732 1 1 26 GLN NE2 N -6.207 4.766 -3.144 1.00 . A A . 23 GLN NE2 1 1 11 7733 1 1 26 GLN O O -4.155 0.337 -1.427 1.00 . A A . 23 GLN O 1 1 11 7734 1 1 26 GLN OE1 O -5.219 6.655 -2.477 1.00 . A A . 23 GLN OE1 1 1 11 7735 1 1 27 THR C C -3.946 -0.740 1.811 1.00 . A A . 24 THR C 1 1 11 7736 1 1 27 THR CA C -2.821 -0.685 0.788 1.00 . A A . 24 THR CA 1 1 11 7737 1 1 27 THR CB C -1.506 -1.135 1.452 1.00 . A A . 24 THR CB 1 1 11 7738 1 1 27 THR CG2 C -0.452 -1.455 0.408 1.00 . A A . 24 THR CG2 1 1 11 7739 1 1 27 THR H H -2.087 1.286 0.689 1.00 . A A . 24 THR H 1 1 11 7740 1 1 27 THR HA H -3.044 -1.362 -0.023 1.00 . A A . 24 THR HA 1 1 11 7741 1 1 27 THR HB H -1.699 -2.027 2.030 1.00 . A A . 24 THR HB 1 1 11 7742 1 1 27 THR HG1 H -0.276 -0.451 2.843 1.00 . A A . 24 THR HG1 1 1 11 7743 1 1 27 THR HG21 H -0.831 -2.210 -0.262 1.00 . A A . 24 THR HG21 1 1 11 7744 1 1 27 THR HG22 H 0.435 -1.826 0.901 1.00 . A A . 24 THR HG22 1 1 11 7745 1 1 27 THR HG23 H -0.209 -0.563 -0.149 1.00 . A A . 24 THR HG23 1 1 11 7746 1 1 27 THR N N -2.685 0.652 0.242 1.00 . A A . 24 THR N 1 1 11 7747 1 1 27 THR O O -4.396 0.286 2.303 1.00 . A A . 24 THR O 1 1 11 7748 1 1 27 THR OG1 O -1.021 -0.109 2.322 1.00 . A A . 24 THR OG1 1 1 11 7749 1 1 28 CYS C C -4.932 -2.255 4.487 1.00 . A A . 25 CYS C 1 1 11 7750 1 1 28 CYS CA C -5.486 -2.121 3.075 1.00 . A A . 25 CYS CA 1 1 11 7751 1 1 28 CYS CB C -6.316 -3.359 2.724 1.00 . A A . 25 CYS CB 1 1 11 7752 1 1 28 CYS H H -4.014 -2.724 1.689 1.00 . A A . 25 CYS H 1 1 11 7753 1 1 28 CYS HA H -6.119 -1.247 3.031 1.00 . A A . 25 CYS HA 1 1 11 7754 1 1 28 CYS HB2 H -7.169 -3.408 3.382 1.00 . A A . 25 CYS HB2 1 1 11 7755 1 1 28 CYS HB3 H -6.660 -3.273 1.705 1.00 . A A . 25 CYS HB3 1 1 11 7756 1 1 28 CYS N N -4.405 -1.943 2.120 1.00 . A A . 25 CYS N 1 1 11 7757 1 1 28 CYS O O -5.610 -1.941 5.462 1.00 . A A . 25 CYS O 1 1 11 7758 1 1 28 CYS SG S -5.419 -4.923 2.874 1.00 . A A . 25 CYS SG 1 1 11 7759 1 1 29 SER C C -1.550 -3.029 5.724 1.00 . A A . 26 SER C 1 1 11 7760 1 1 29 SER CA C -3.065 -2.951 5.880 1.00 . A A . 26 SER CA 1 1 11 7761 1 1 29 SER CB C -3.590 -4.243 6.520 1.00 . A A . 26 SER CB 1 1 11 7762 1 1 29 SER H H -3.180 -2.907 3.771 1.00 . A A . 26 SER H 1 1 11 7763 1 1 29 SER HA H -3.309 -2.114 6.520 1.00 . A A . 26 SER HA 1 1 11 7764 1 1 29 SER HB2 H -3.421 -5.065 5.844 1.00 . A A . 26 SER HB2 1 1 11 7765 1 1 29 SER HB3 H -3.062 -4.425 7.443 1.00 . A A . 26 SER HB3 1 1 11 7766 1 1 29 SER HG H -5.363 -3.409 6.322 1.00 . A A . 26 SER HG 1 1 11 7767 1 1 29 SER N N -3.693 -2.723 4.589 1.00 . A A . 26 SER N 1 1 11 7768 1 1 29 SER O O -1.046 -3.034 4.597 1.00 . A A . 26 SER O 1 1 11 7769 1 1 29 SER OG O -4.981 -4.165 6.798 1.00 . A A . 26 SER OG 1 1 11 7770 1 1 30 LEU C C 1.102 -4.436 6.099 1.00 . A A . 27 LEU C 1 1 11 7771 1 1 30 LEU CA C 0.622 -3.180 6.822 1.00 . A A . 27 LEU CA 1 1 11 7772 1 1 30 LEU CB C 1.176 -3.147 8.248 1.00 . A A . 27 LEU CB 1 1 11 7773 1 1 30 LEU CD1 C 1.448 -1.948 10.432 1.00 . A A . 27 LEU CD1 1 1 11 7774 1 1 30 LEU CD2 C 1.751 -0.706 8.288 1.00 . A A . 27 LEU CD2 1 1 11 7775 1 1 30 LEU CG C 0.988 -1.821 8.989 1.00 . A A . 27 LEU CG 1 1 11 7776 1 1 30 LEU H H -1.301 -3.118 7.707 1.00 . A A . 27 LEU H 1 1 11 7777 1 1 30 LEU HA H 0.985 -2.315 6.288 1.00 . A A . 27 LEU HA 1 1 11 7778 1 1 30 LEU HB2 H 0.691 -3.927 8.816 1.00 . A A . 27 LEU HB2 1 1 11 7779 1 1 30 LEU HB3 H 2.232 -3.361 8.204 1.00 . A A . 27 LEU HB3 1 1 11 7780 1 1 30 LEU HD11 H 1.319 -1.001 10.935 1.00 . A A . 27 LEU HD11 1 1 11 7781 1 1 30 LEU HD12 H 2.491 -2.228 10.455 1.00 . A A . 27 LEU HD12 1 1 11 7782 1 1 30 LEU HD13 H 0.861 -2.704 10.933 1.00 . A A . 27 LEU HD13 1 1 11 7783 1 1 30 LEU HD21 H 1.641 0.211 8.847 1.00 . A A . 27 LEU HD21 1 1 11 7784 1 1 30 LEU HD22 H 1.356 -0.569 7.293 1.00 . A A . 27 LEU HD22 1 1 11 7785 1 1 30 LEU HD23 H 2.797 -0.967 8.228 1.00 . A A . 27 LEU HD23 1 1 11 7786 1 1 30 LEU HG H -0.060 -1.561 8.993 1.00 . A A . 27 LEU HG 1 1 11 7787 1 1 30 LEU N N -0.836 -3.107 6.841 1.00 . A A . 27 LEU N 1 1 11 7788 1 1 30 LEU O O 2.163 -4.434 5.477 1.00 . A A . 27 LEU O 1 1 11 7789 1 1 31 GLU C C 0.829 -6.493 3.997 1.00 . A A . 28 GLU C 1 1 11 7790 1 1 31 GLU CA C 0.603 -6.753 5.485 1.00 . A A . 28 GLU CA 1 1 11 7791 1 1 31 GLU CB C -0.554 -7.738 5.675 1.00 . A A . 28 GLU CB 1 1 11 7792 1 1 31 GLU CD C 0.474 -9.787 4.564 1.00 . A A . 28 GLU CD 1 1 11 7793 1 1 31 GLU CG C -0.132 -9.195 5.821 1.00 . A A . 28 GLU CG 1 1 11 7794 1 1 31 GLU H H -0.503 -5.446 6.733 1.00 . A A . 28 GLU H 1 1 11 7795 1 1 31 GLU HA H 1.501 -7.166 5.912 1.00 . A A . 28 GLU HA 1 1 11 7796 1 1 31 GLU HB2 H -1.099 -7.460 6.562 1.00 . A A . 28 GLU HB2 1 1 11 7797 1 1 31 GLU HB3 H -1.213 -7.664 4.824 1.00 . A A . 28 GLU HB3 1 1 11 7798 1 1 31 GLU HG2 H 0.596 -9.265 6.614 1.00 . A A . 28 GLU HG2 1 1 11 7799 1 1 31 GLU HG3 H -1.003 -9.776 6.089 1.00 . A A . 28 GLU HG3 1 1 11 7800 1 1 31 GLU N N 0.303 -5.499 6.177 1.00 . A A . 28 GLU N 1 1 11 7801 1 1 31 GLU O O 1.746 -7.037 3.389 1.00 . A A . 28 GLU O 1 1 11 7802 1 1 31 GLU OE1 O -0.266 -9.975 3.570 1.00 . A A . 28 GLU OE1 1 1 11 7803 1 1 31 GLU OE2 O 1.689 -10.089 4.572 1.00 . A A . 28 GLU OE2 1 1 11 7804 1 1 32 CYS C C 1.137 -4.191 1.788 1.00 . A A . 29 CYS C 1 1 11 7805 1 1 32 CYS CA C 0.107 -5.294 2.022 1.00 . A A . 29 CYS CA 1 1 11 7806 1 1 32 CYS CB C -1.258 -4.890 1.481 1.00 . A A . 29 CYS CB 1 1 11 7807 1 1 32 CYS H H -0.690 -5.199 3.966 1.00 . A A . 29 CYS H 1 1 11 7808 1 1 32 CYS HA H 0.427 -6.183 1.506 1.00 . A A . 29 CYS HA 1 1 11 7809 1 1 32 CYS HB2 H -1.753 -4.264 2.209 1.00 . A A . 29 CYS HB2 1 1 11 7810 1 1 32 CYS HB3 H -1.129 -4.335 0.568 1.00 . A A . 29 CYS HB3 1 1 11 7811 1 1 32 CYS N N 0.003 -5.628 3.426 1.00 . A A . 29 CYS N 1 1 11 7812 1 1 32 CYS O O 1.685 -4.064 0.694 1.00 . A A . 29 CYS O 1 1 11 7813 1 1 32 CYS SG S -2.347 -6.293 1.136 1.00 . A A . 29 CYS SG 1 1 11 7814 1 1 33 SER C C 3.806 -2.948 2.636 1.00 . A A . 30 SER C 1 1 11 7815 1 1 33 SER CA C 2.408 -2.346 2.724 1.00 . A A . 30 SER CA 1 1 11 7816 1 1 33 SER CB C 2.309 -1.407 3.926 1.00 . A A . 30 SER CB 1 1 11 7817 1 1 33 SER H H 0.923 -3.522 3.661 1.00 . A A . 30 SER H 1 1 11 7818 1 1 33 SER HA H 2.215 -1.784 1.823 1.00 . A A . 30 SER HA 1 1 11 7819 1 1 33 SER HB2 H 2.526 -1.957 4.829 1.00 . A A . 30 SER HB2 1 1 11 7820 1 1 33 SER HB3 H 3.022 -0.604 3.813 1.00 . A A . 30 SER HB3 1 1 11 7821 1 1 33 SER HG H 0.994 -0.208 4.746 1.00 . A A . 30 SER HG 1 1 11 7822 1 1 33 SER N N 1.407 -3.399 2.818 1.00 . A A . 30 SER N 1 1 11 7823 1 1 33 SER O O 4.677 -2.419 1.955 1.00 . A A . 30 SER O 1 1 11 7824 1 1 33 SER OG O 1.007 -0.850 4.031 1.00 . A A . 30 SER OG 1 1 11 7825 1 1 34 LYS C C 5.325 -5.774 2.153 1.00 . A A . 31 LYS C 1 1 11 7826 1 1 34 LYS CA C 5.301 -4.745 3.280 1.00 . A A . 31 LYS CA 1 1 11 7827 1 1 34 LYS CB C 5.594 -5.410 4.627 1.00 . A A . 31 LYS CB 1 1 11 7828 1 1 34 LYS CD C 4.953 -7.122 6.344 1.00 . A A . 31 LYS CD 1 1 11 7829 1 1 34 LYS CE C 4.089 -8.335 6.642 1.00 . A A . 31 LYS CE 1 1 11 7830 1 1 34 LYS CG C 4.669 -6.567 4.961 1.00 . A A . 31 LYS CG 1 1 11 7831 1 1 34 LYS H H 3.286 -4.440 3.865 1.00 . A A . 31 LYS H 1 1 11 7832 1 1 34 LYS HA H 6.057 -4.001 3.084 1.00 . A A . 31 LYS HA 1 1 11 7833 1 1 34 LYS HB2 H 6.606 -5.780 4.619 1.00 . A A . 31 LYS HB2 1 1 11 7834 1 1 34 LYS HB3 H 5.498 -4.667 5.406 1.00 . A A . 31 LYS HB3 1 1 11 7835 1 1 34 LYS HD2 H 5.992 -7.409 6.401 1.00 . A A . 31 LYS HD2 1 1 11 7836 1 1 34 LYS HD3 H 4.749 -6.356 7.077 1.00 . A A . 31 LYS HD3 1 1 11 7837 1 1 34 LYS HE2 H 3.058 -8.081 6.461 1.00 . A A . 31 LYS HE2 1 1 11 7838 1 1 34 LYS HE3 H 4.381 -9.137 5.983 1.00 . A A . 31 LYS HE3 1 1 11 7839 1 1 34 LYS HG2 H 3.647 -6.221 4.926 1.00 . A A . 31 LYS HG2 1 1 11 7840 1 1 34 LYS HG3 H 4.810 -7.351 4.232 1.00 . A A . 31 LYS HG3 1 1 11 7841 1 1 34 LYS HZ1 H 3.692 -9.669 8.192 1.00 . A A . 31 LYS HZ1 1 1 11 7842 1 1 34 LYS HZ2 H 3.865 -8.067 8.695 1.00 . A A . 31 LYS HZ2 1 1 11 7843 1 1 34 LYS HZ3 H 5.230 -8.970 8.270 1.00 . A A . 31 LYS HZ3 1 1 11 7844 1 1 34 LYS N N 4.013 -4.066 3.317 1.00 . A A . 31 LYS N 1 1 11 7845 1 1 34 LYS NZ N 4.230 -8.791 8.047 1.00 . A A . 31 LYS NZ 1 1 11 7846 1 1 34 LYS O O 6.343 -6.419 1.899 1.00 . A A . 31 LYS O 1 1 11 7847 1 1 35 LYS C C 4.807 -6.380 -0.849 1.00 . A A . 32 LYS C 1 1 11 7848 1 1 35 LYS CA C 4.059 -6.861 0.383 1.00 . A A . 32 LYS CA 1 1 11 7849 1 1 35 LYS CB C 2.583 -7.044 0.039 1.00 . A A . 32 LYS CB 1 1 11 7850 1 1 35 LYS CD C 2.343 -9.332 1.004 1.00 . A A . 32 LYS CD 1 1 11 7851 1 1 35 LYS CE C 1.719 -10.704 0.835 1.00 . A A . 32 LYS CE 1 1 11 7852 1 1 35 LYS CG C 2.180 -8.479 -0.239 1.00 . A A . 32 LYS CG 1 1 11 7853 1 1 35 LYS H H 3.434 -5.337 1.705 1.00 . A A . 32 LYS H 1 1 11 7854 1 1 35 LYS HA H 4.473 -7.804 0.705 1.00 . A A . 32 LYS HA 1 1 11 7855 1 1 35 LYS HB2 H 1.997 -6.685 0.864 1.00 . A A . 32 LYS HB2 1 1 11 7856 1 1 35 LYS HB3 H 2.356 -6.453 -0.837 1.00 . A A . 32 LYS HB3 1 1 11 7857 1 1 35 LYS HD2 H 3.392 -9.449 1.212 1.00 . A A . 32 LYS HD2 1 1 11 7858 1 1 35 LYS HD3 H 1.864 -8.831 1.831 1.00 . A A . 32 LYS HD3 1 1 11 7859 1 1 35 LYS HE2 H 1.930 -11.060 -0.163 1.00 . A A . 32 LYS HE2 1 1 11 7860 1 1 35 LYS HE3 H 2.158 -11.376 1.557 1.00 . A A . 32 LYS HE3 1 1 11 7861 1 1 35 LYS HG2 H 1.146 -8.503 -0.552 1.00 . A A . 32 LYS HG2 1 1 11 7862 1 1 35 LYS HG3 H 2.808 -8.876 -1.024 1.00 . A A . 32 LYS HG3 1 1 11 7863 1 1 35 LYS HZ1 H 0.024 -10.309 1.991 1.00 . A A . 32 LYS HZ1 1 1 11 7864 1 1 35 LYS HZ2 H -0.150 -11.625 0.937 1.00 . A A . 32 LYS HZ2 1 1 11 7865 1 1 35 LYS HZ3 H -0.200 -10.049 0.329 1.00 . A A . 32 LYS HZ3 1 1 11 7866 1 1 35 LYS N N 4.199 -5.903 1.469 1.00 . A A . 32 LYS N 1 1 11 7867 1 1 35 LYS NZ N 0.247 -10.669 1.034 1.00 . A A . 32 LYS NZ 1 1 11 7868 1 1 35 LYS O O 5.479 -7.154 -1.529 1.00 . A A . 32 LYS O 1 1 11 7869 1 1 36 HIS C C 6.817 -4.317 -2.084 1.00 . A A . 33 HIS C 1 1 11 7870 1 1 36 HIS CA C 5.321 -4.515 -2.308 1.00 . A A . 33 HIS CA 1 1 11 7871 1 1 36 HIS CB C 4.650 -3.186 -2.700 1.00 . A A . 33 HIS CB 1 1 11 7872 1 1 36 HIS CD2 C 5.923 -1.554 -1.136 1.00 . A A . 33 HIS CD2 1 1 11 7873 1 1 36 HIS CE1 C 4.271 -0.394 -0.389 1.00 . A A . 33 HIS CE1 1 1 11 7874 1 1 36 HIS CG C 4.806 -2.070 -1.701 1.00 . A A . 33 HIS CG 1 1 11 7875 1 1 36 HIS H H 4.176 -4.508 -0.527 1.00 . A A . 33 HIS H 1 1 11 7876 1 1 36 HIS HA H 5.188 -5.218 -3.116 1.00 . A A . 33 HIS HA 1 1 11 7877 1 1 36 HIS HB2 H 5.071 -2.847 -3.635 1.00 . A A . 33 HIS HB2 1 1 11 7878 1 1 36 HIS HB3 H 3.592 -3.360 -2.838 1.00 . A A . 33 HIS HB3 1 1 11 7879 1 1 36 HIS HD1 H 2.809 -1.465 -1.410 1.00 . A A . 33 HIS HD1 1 1 11 7880 1 1 36 HIS HD2 H 6.929 -1.914 -1.291 1.00 . A A . 33 HIS HD2 1 1 11 7881 1 1 36 HIS HE1 H 3.676 0.311 0.167 1.00 . A A . 33 HIS HE1 1 1 11 7882 1 1 36 HIS N N 4.694 -5.088 -1.128 1.00 . A A . 33 HIS N 1 1 11 7883 1 1 36 HIS ND1 N 3.761 -1.327 -1.209 1.00 . A A . 33 HIS ND1 1 1 11 7884 1 1 36 HIS NE2 N 5.589 -0.483 -0.315 1.00 . A A . 33 HIS NE2 1 1 11 7885 1 1 36 HIS O O 7.579 -4.147 -3.028 1.00 . A A . 33 HIS O 1 1 11 7886 1 1 37 LYS C C 9.557 -5.158 -0.943 1.00 . A A . 34 LYS C 1 1 11 7887 1 1 37 LYS CA C 8.613 -4.063 -0.474 1.00 . A A . 34 LYS CA 1 1 11 7888 1 1 37 LYS CB C 8.734 -3.856 1.038 1.00 . A A . 34 LYS CB 1 1 11 7889 1 1 37 LYS CD C 8.090 -2.444 3.033 1.00 . A A . 34 LYS CD 1 1 11 7890 1 1 37 LYS CE C 7.175 -1.331 3.525 1.00 . A A . 34 LYS CE 1 1 11 7891 1 1 37 LYS CG C 7.882 -2.704 1.550 1.00 . A A . 34 LYS CG 1 1 11 7892 1 1 37 LYS H H 6.616 -4.664 -0.128 1.00 . A A . 34 LYS H 1 1 11 7893 1 1 37 LYS HA H 8.877 -3.144 -0.974 1.00 . A A . 34 LYS HA 1 1 11 7894 1 1 37 LYS HB2 H 8.425 -4.761 1.542 1.00 . A A . 34 LYS HB2 1 1 11 7895 1 1 37 LYS HB3 H 9.766 -3.650 1.281 1.00 . A A . 34 LYS HB3 1 1 11 7896 1 1 37 LYS HD2 H 7.874 -3.347 3.585 1.00 . A A . 34 LYS HD2 1 1 11 7897 1 1 37 LYS HD3 H 9.117 -2.154 3.199 1.00 . A A . 34 LYS HD3 1 1 11 7898 1 1 37 LYS HE2 H 7.394 -0.432 2.967 1.00 . A A . 34 LYS HE2 1 1 11 7899 1 1 37 LYS HE3 H 6.150 -1.622 3.344 1.00 . A A . 34 LYS HE3 1 1 11 7900 1 1 37 LYS HG2 H 8.140 -1.811 1.002 1.00 . A A . 34 LYS HG2 1 1 11 7901 1 1 37 LYS HG3 H 6.842 -2.941 1.378 1.00 . A A . 34 LYS HG3 1 1 11 7902 1 1 37 LYS HZ1 H 6.673 -0.328 5.284 1.00 . A A . 34 LYS HZ1 1 1 11 7903 1 1 37 LYS HZ2 H 8.315 -0.708 5.160 1.00 . A A . 34 LYS HZ2 1 1 11 7904 1 1 37 LYS HZ3 H 7.193 -1.917 5.528 1.00 . A A . 34 LYS HZ3 1 1 11 7905 1 1 37 LYS N N 7.238 -4.381 -0.829 1.00 . A A . 34 LYS N 1 1 11 7906 1 1 37 LYS NZ N 7.351 -1.052 4.974 1.00 . A A . 34 LYS NZ 1 1 11 7907 1 1 37 LYS O O 10.754 -4.934 -1.110 1.00 . A A . 34 LYS O 1 1 11 7908 1 1 38 THR C C 9.708 -7.685 -3.115 1.00 . A A . 35 THR C 1 1 11 7909 1 1 38 THR CA C 9.781 -7.476 -1.601 1.00 . A A . 35 THR CA 1 1 11 7910 1 1 38 THR CB C 9.298 -8.746 -0.866 1.00 . A A . 35 THR CB 1 1 11 7911 1 1 38 THR CG2 C 7.909 -9.162 -1.334 1.00 . A A . 35 THR CG2 1 1 11 7912 1 1 38 THR H H 8.026 -6.427 -1.090 1.00 . A A . 35 THR H 1 1 11 7913 1 1 38 THR HA H 10.808 -7.291 -1.324 1.00 . A A . 35 THR HA 1 1 11 7914 1 1 38 THR HB H 9.246 -8.524 0.190 1.00 . A A . 35 THR HB 1 1 11 7915 1 1 38 THR HG1 H 10.633 -9.735 -1.941 1.00 . A A . 35 THR HG1 1 1 11 7916 1 1 38 THR HG21 H 7.609 -10.060 -0.816 1.00 . A A . 35 THR HG21 1 1 11 7917 1 1 38 THR HG22 H 7.930 -9.348 -2.398 1.00 . A A . 35 THR HG22 1 1 11 7918 1 1 38 THR HG23 H 7.205 -8.371 -1.120 1.00 . A A . 35 THR HG23 1 1 11 7919 1 1 38 THR N N 8.996 -6.329 -1.194 1.00 . A A . 35 THR N 1 1 11 7920 1 1 38 THR O O 10.289 -8.629 -3.647 1.00 . A A . 35 THR O 1 1 11 7921 1 1 38 THR OG1 O 10.211 -9.830 -1.074 1.00 . A A . 35 THR OG1 1 1 11 7922 1 1 39 ARG C C 9.050 -5.633 -5.998 1.00 . A A . 36 ARG C 1 1 11 7923 1 1 39 ARG CA C 8.808 -6.943 -5.248 1.00 . A A . 36 ARG CA 1 1 11 7924 1 1 39 ARG CB C 7.399 -7.473 -5.532 1.00 . A A . 36 ARG CB 1 1 11 7925 1 1 39 ARG CD C 4.927 -7.275 -5.096 1.00 . A A . 36 ARG CD 1 1 11 7926 1 1 39 ARG CG C 6.298 -6.657 -4.877 1.00 . A A . 36 ARG CG 1 1 11 7927 1 1 39 ARG CZ C 3.673 -9.147 -4.085 1.00 . A A . 36 ARG CZ 1 1 11 7928 1 1 39 ARG H H 8.617 -6.024 -3.343 1.00 . A A . 36 ARG H 1 1 11 7929 1 1 39 ARG HA H 9.525 -7.672 -5.597 1.00 . A A . 36 ARG HA 1 1 11 7930 1 1 39 ARG HB2 H 7.234 -7.468 -6.599 1.00 . A A . 36 ARG HB2 1 1 11 7931 1 1 39 ARG HB3 H 7.328 -8.487 -5.169 1.00 . A A . 36 ARG HB3 1 1 11 7932 1 1 39 ARG HD2 H 4.182 -6.633 -4.651 1.00 . A A . 36 ARG HD2 1 1 11 7933 1 1 39 ARG HD3 H 4.747 -7.349 -6.158 1.00 . A A . 36 ARG HD3 1 1 11 7934 1 1 39 ARG HE H 5.644 -9.132 -4.422 1.00 . A A . 36 ARG HE 1 1 11 7935 1 1 39 ARG HG2 H 6.491 -6.604 -3.815 1.00 . A A . 36 ARG HG2 1 1 11 7936 1 1 39 ARG HG3 H 6.306 -5.661 -5.295 1.00 . A A . 36 ARG HG3 1 1 11 7937 1 1 39 ARG HH11 H 2.530 -7.539 -4.556 1.00 . A A . 36 ARG HH11 1 1 11 7938 1 1 39 ARG HH12 H 1.676 -8.882 -3.863 1.00 . A A . 36 ARG HH12 1 1 11 7939 1 1 39 ARG HH21 H 4.524 -10.892 -3.510 1.00 . A A . 36 ARG HH21 1 1 11 7940 1 1 39 ARG HH22 H 2.809 -10.786 -3.261 1.00 . A A . 36 ARG HH22 1 1 11 7941 1 1 39 ARG N N 9.006 -6.793 -3.808 1.00 . A A . 36 ARG N 1 1 11 7942 1 1 39 ARG NE N 4.818 -8.607 -4.503 1.00 . A A . 36 ARG NE 1 1 11 7943 1 1 39 ARG NH1 N 2.536 -8.466 -4.173 1.00 . A A . 36 ARG NH1 1 1 11 7944 1 1 39 ARG NH2 N 3.669 -10.371 -3.578 1.00 . A A . 36 ARG NH2 1 1 11 7945 1 1 39 ARG O O 9.423 -5.642 -7.171 1.00 . A A . 36 ARG O 1 1 11 7946 1 1 40 ASP C C 10.267 -2.517 -5.344 1.00 . A A . 37 ASP C 1 1 11 7947 1 1 40 ASP CA C 9.048 -3.205 -5.939 1.00 . A A . 37 ASP CA 1 1 11 7948 1 1 40 ASP CB C 7.815 -2.309 -5.770 1.00 . A A . 37 ASP CB 1 1 11 7949 1 1 40 ASP CG C 6.659 -2.717 -6.664 1.00 . A A . 37 ASP CG 1 1 11 7950 1 1 40 ASP H H 8.518 -4.556 -4.401 1.00 . A A . 37 ASP H 1 1 11 7951 1 1 40 ASP HA H 9.221 -3.363 -6.992 1.00 . A A . 37 ASP HA 1 1 11 7952 1 1 40 ASP HB2 H 7.483 -2.357 -4.745 1.00 . A A . 37 ASP HB2 1 1 11 7953 1 1 40 ASP HB3 H 8.086 -1.291 -6.006 1.00 . A A . 37 ASP HB3 1 1 11 7954 1 1 40 ASP N N 8.837 -4.512 -5.327 1.00 . A A . 37 ASP N 1 1 11 7955 1 1 40 ASP O O 10.649 -1.431 -5.782 1.00 . A A . 37 ASP O 1 1 11 7956 1 1 40 ASP OD1 O 6.719 -2.442 -7.886 1.00 . A A . 37 ASP OD1 1 1 11 7957 1 1 40 ASP OD2 O 5.682 -3.309 -6.157 1.00 . A A . 37 ASP OD2 1 1 11 7958 1 1 41 ASN C C 11.665 -1.351 -2.903 1.00 . A A . 38 ASN C 1 1 11 7959 1 1 41 ASN CA C 12.031 -2.642 -3.623 1.00 . A A . 38 ASN CA 1 1 11 7960 1 1 41 ASN CB C 13.219 -2.419 -4.565 1.00 . A A . 38 ASN CB 1 1 11 7961 1 1 41 ASN CG C 14.446 -1.878 -3.848 1.00 . A A . 38 ASN CG 1 1 11 7962 1 1 41 ASN H H 10.537 -4.062 -4.103 1.00 . A A . 38 ASN H 1 1 11 7963 1 1 41 ASN HA H 12.309 -3.374 -2.880 1.00 . A A . 38 ASN HA 1 1 11 7964 1 1 41 ASN HB2 H 13.483 -3.358 -5.026 1.00 . A A . 38 ASN HB2 1 1 11 7965 1 1 41 ASN HB3 H 12.935 -1.715 -5.332 1.00 . A A . 38 ASN HB3 1 1 11 7966 1 1 41 ASN HD21 H 15.019 -3.725 -3.380 1.00 . A A . 38 ASN HD21 1 1 11 7967 1 1 41 ASN HD22 H 16.065 -2.452 -2.848 1.00 . A A . 38 ASN HD22 1 1 11 7968 1 1 41 ASN N N 10.875 -3.177 -4.351 1.00 . A A . 38 ASN N 1 1 11 7969 1 1 41 ASN ND2 N 15.254 -2.773 -3.299 1.00 . A A . 38 ASN ND2 1 1 11 7970 1 1 41 ASN O O 11.704 -0.266 -3.477 1.00 . A A . 38 ASN O 1 1 11 7971 1 1 41 ASN OD1 O 14.656 -0.666 -3.775 1.00 . A A . 38 ASN OD1 1 1 11 7972 1 1 42 CYS C C 10.931 -0.630 0.612 1.00 . A A . 39 CYS C 1 1 11 7973 1 1 42 CYS CA C 10.820 -0.344 -0.877 1.00 . A A . 39 CYS CA 1 1 11 7974 1 1 42 CYS CB C 9.362 -0.077 -1.270 1.00 . A A . 39 CYS CB 1 1 11 7975 1 1 42 CYS H H 11.390 -2.350 -1.199 1.00 . A A . 39 CYS H 1 1 11 7976 1 1 42 CYS HA H 11.420 0.519 -1.122 1.00 . A A . 39 CYS HA 1 1 11 7977 1 1 42 CYS HB2 H 9.319 0.122 -2.329 1.00 . A A . 39 CYS HB2 1 1 11 7978 1 1 42 CYS HB3 H 8.781 -0.961 -1.056 1.00 . A A . 39 CYS HB3 1 1 11 7979 1 1 42 CYS N N 11.312 -1.476 -1.639 1.00 . A A . 39 CYS N 1 1 11 7980 1 1 42 CYS O O 10.939 -1.787 1.029 1.00 . A A . 39 CYS O 1 1 11 7981 1 1 42 CYS SG S 8.573 1.315 -0.427 1.00 . A A . 39 CYS SG 1 1 11 7982 1 1 43 SER C C 9.911 1.190 3.400 1.00 . A A . 40 SER C 1 1 11 7983 1 1 43 SER CA C 11.021 0.300 2.847 1.00 . A A . 40 SER CA 1 1 11 7984 1 1 43 SER CB C 12.374 0.668 3.461 1.00 . A A . 40 SER CB 1 1 11 7985 1 1 43 SER H H 11.238 1.299 1.003 1.00 . A A . 40 SER H 1 1 11 7986 1 1 43 SER HA H 10.794 -0.728 3.084 1.00 . A A . 40 SER HA 1 1 11 7987 1 1 43 SER HB2 H 12.560 1.721 3.316 1.00 . A A . 40 SER HB2 1 1 11 7988 1 1 43 SER HB3 H 12.358 0.447 4.515 1.00 . A A . 40 SER HB3 1 1 11 7989 1 1 43 SER HG H 13.313 -1.006 3.062 1.00 . A A . 40 SER HG 1 1 11 7990 1 1 43 SER N N 11.072 0.421 1.402 1.00 . A A . 40 SER N 1 1 11 7991 1 1 43 SER O O 9.417 0.986 4.508 1.00 . A A . 40 SER O 1 1 11 7992 1 1 43 SER OG O 13.426 -0.069 2.853 1.00 . A A . 40 SER OG 1 1 11 7993 1 1 44 GLY C C 8.846 4.160 3.879 1.00 . A A . 41 GLY C 1 1 11 7994 1 1 44 GLY CA C 8.414 3.047 2.950 1.00 . A A . 41 GLY CA 1 1 11 7995 1 1 44 GLY H H 9.958 2.286 1.729 1.00 . A A . 41 GLY H 1 1 11 7996 1 1 44 GLY HA2 H 8.005 3.483 2.051 1.00 . A A . 41 GLY HA2 1 1 11 7997 1 1 44 GLY HA3 H 7.644 2.467 3.435 1.00 . A A . 41 GLY HA3 1 1 11 7998 1 1 44 GLY N N 9.506 2.166 2.588 1.00 . A A . 41 GLY N 1 1 11 7999 1 1 44 GLY O O 8.151 4.469 4.845 1.00 . A A . 41 GLY O 1 1 11 8000 1 1 45 GLN C C 10.990 7.008 3.618 1.00 . A A . 42 GLN C 1 1 11 8001 1 1 45 GLN CA C 10.537 5.813 4.440 1.00 . A A . 42 GLN CA 1 1 11 8002 1 1 45 GLN CB C 11.726 5.274 5.239 1.00 . A A . 42 GLN CB 1 1 11 8003 1 1 45 GLN CD C 12.604 3.604 6.906 1.00 . A A . 42 GLN CD 1 1 11 8004 1 1 45 GLN CG C 11.404 4.072 6.110 1.00 . A A . 42 GLN CG 1 1 11 8005 1 1 45 GLN H H 10.449 4.551 2.747 1.00 . A A . 42 GLN H 1 1 11 8006 1 1 45 GLN HA H 9.765 6.130 5.125 1.00 . A A . 42 GLN HA 1 1 11 8007 1 1 45 GLN HB2 H 12.505 4.991 4.550 1.00 . A A . 42 GLN HB2 1 1 11 8008 1 1 45 GLN HB3 H 12.096 6.063 5.878 1.00 . A A . 42 GLN HB3 1 1 11 8009 1 1 45 GLN HE21 H 13.170 2.430 5.412 1.00 . A A . 42 GLN HE21 1 1 11 8010 1 1 45 GLN HE22 H 14.186 2.412 6.805 1.00 . A A . 42 GLN HE22 1 1 11 8011 1 1 45 GLN HG2 H 10.615 4.339 6.797 1.00 . A A . 42 GLN HG2 1 1 11 8012 1 1 45 GLN HG3 H 11.071 3.262 5.477 1.00 . A A . 42 GLN HG3 1 1 11 8013 1 1 45 GLN N N 9.980 4.780 3.578 1.00 . A A . 42 GLN N 1 1 11 8014 1 1 45 GLN NE2 N 13.398 2.726 6.316 1.00 . A A . 42 GLN NE2 1 1 11 8015 1 1 45 GLN O O 12.130 7.060 3.156 1.00 . A A . 42 GLN O 1 1 11 8016 1 1 45 GLN OE1 O 12.823 4.038 8.038 1.00 . A A . 42 GLN OE1 1 1 11 8017 1 1 46 THR C C 11.201 10.132 3.604 1.00 . A A . 43 THR C 1 1 11 8018 1 1 46 THR CA C 10.435 9.173 2.704 1.00 . A A . 43 THR CA 1 1 11 8019 1 1 46 THR CB C 9.176 9.866 2.164 1.00 . A A . 43 THR CB 1 1 11 8020 1 1 46 THR CG2 C 8.687 9.183 0.899 1.00 . A A . 43 THR CG2 1 1 11 8021 1 1 46 THR H H 9.189 7.855 3.780 1.00 . A A . 43 THR H 1 1 11 8022 1 1 46 THR HA H 11.061 8.897 1.867 1.00 . A A . 43 THR HA 1 1 11 8023 1 1 46 THR HB H 9.419 10.893 1.932 1.00 . A A . 43 THR HB 1 1 11 8024 1 1 46 THR HG1 H 8.298 10.560 3.794 1.00 . A A . 43 THR HG1 1 1 11 8025 1 1 46 THR HG21 H 8.485 8.144 1.108 1.00 . A A . 43 THR HG21 1 1 11 8026 1 1 46 THR HG22 H 9.444 9.255 0.134 1.00 . A A . 43 THR HG22 1 1 11 8027 1 1 46 THR HG23 H 7.782 9.663 0.557 1.00 . A A . 43 THR HG23 1 1 11 8028 1 1 46 THR N N 10.097 7.961 3.424 1.00 . A A . 43 THR N 1 1 11 8029 1 1 46 THR O O 10.921 10.228 4.799 1.00 . A A . 43 THR O 1 1 11 8030 1 1 46 THR OG1 O 8.147 9.844 3.162 1.00 . A A . 43 THR OG1 1 1 11 8031 1 1 47 HIS C C 12.716 13.185 3.339 1.00 . A A . 44 HIS C 1 1 11 8032 1 1 47 HIS CA C 12.992 11.757 3.792 1.00 . A A . 44 HIS CA 1 1 11 8033 1 1 47 HIS CB C 14.477 11.421 3.619 1.00 . A A . 44 HIS CB 1 1 11 8034 1 1 47 HIS CD2 C 14.794 9.331 5.132 1.00 . A A . 44 HIS CD2 1 1 11 8035 1 1 47 HIS CE1 C 15.453 7.921 3.592 1.00 . A A . 44 HIS CE1 1 1 11 8036 1 1 47 HIS CG C 14.817 9.998 3.953 1.00 . A A . 44 HIS CG 1 1 11 8037 1 1 47 HIS H H 12.324 10.731 2.067 1.00 . A A . 44 HIS H 1 1 11 8038 1 1 47 HIS HA H 12.724 11.663 4.834 1.00 . A A . 44 HIS HA 1 1 11 8039 1 1 47 HIS HB2 H 14.761 11.595 2.592 1.00 . A A . 44 HIS HB2 1 1 11 8040 1 1 47 HIS HB3 H 15.061 12.063 4.262 1.00 . A A . 44 HIS HB3 1 1 11 8041 1 1 47 HIS HD1 H 15.355 9.265 2.052 1.00 . A A . 44 HIS HD1 1 1 11 8042 1 1 47 HIS HD2 H 14.515 9.737 6.092 1.00 . A A . 44 HIS HD2 1 1 11 8043 1 1 47 HIS HE1 H 15.788 7.022 3.098 1.00 . A A . 44 HIS HE1 1 1 11 8044 1 1 47 HIS HE2 H 15.110 7.291 5.509 1.00 . A A . 44 HIS HE2 1 1 11 8045 1 1 47 HIS N N 12.167 10.831 3.033 1.00 . A A . 44 HIS N 1 1 11 8046 1 1 47 HIS ND1 N 15.235 9.084 3.011 1.00 . A A . 44 HIS ND1 1 1 11 8047 1 1 47 HIS NE2 N 15.193 8.043 4.878 1.00 . A A . 44 HIS NE2 1 1 11 8048 1 1 47 HIS O O 13.628 14.003 3.202 1.00 . A A . 44 HIS O 1 1 11 8049 1 1 48 ASP C C 9.789 15.236 3.378 1.00 . A A . 45 ASP C 1 1 11 8050 1 1 48 ASP CA C 11.030 14.788 2.626 1.00 . A A . 45 ASP CA 1 1 11 8051 1 1 48 ASP CB C 10.746 14.764 1.123 1.00 . A A . 45 ASP CB 1 1 11 8052 1 1 48 ASP CG C 10.394 16.136 0.579 1.00 . A A . 45 ASP CG 1 1 11 8053 1 1 48 ASP H H 10.765 12.785 3.240 1.00 . A A . 45 ASP H 1 1 11 8054 1 1 48 ASP HA H 11.832 15.483 2.825 1.00 . A A . 45 ASP HA 1 1 11 8055 1 1 48 ASP HB2 H 11.621 14.407 0.603 1.00 . A A . 45 ASP HB2 1 1 11 8056 1 1 48 ASP HB3 H 9.919 14.097 0.930 1.00 . A A . 45 ASP HB3 1 1 11 8057 1 1 48 ASP N N 11.447 13.473 3.094 1.00 . A A . 45 ASP N 1 1 11 8058 1 1 48 ASP O O 9.871 16.230 4.127 1.00 . A A . 45 ASP O 1 1 11 8059 1 1 48 ASP OXT O 8.742 14.567 3.245 1.00 . A A . 45 ASP OXT 1 1 11 8060 1 1 48 ASP OD1 O 11.318 16.872 0.162 1.00 . A A . 45 ASP OD1 1 1 11 8061 1 1 48 ASP OD2 O 9.198 16.490 0.558 1.00 . A A . 45 ASP OD2 1 1 11 8062 2 2 1 ZN ZN ZN -4.487 -5.505 0.852 1.00 . B A . 101 ZN ZN 1 1 11 8063 3 2 1 ZN ZN ZN 6.329 1.276 -0.918 1.00 . C A . 102 ZN ZN 1 1 12 8064 1 1 1 GLY C C -21.176 11.954 -2.870 1.00 . A A . -2 GLY C 1 1 12 8065 1 1 1 GLY CA C -21.338 13.437 -2.620 1.00 . A A . -2 GLY CA 1 1 12 8066 1 1 1 GLY H1 H -22.054 14.729 -1.156 1.00 . A A . -2 GLY H1 1 1 12 8067 1 1 1 GLY H2 H -21.411 13.290 -0.546 1.00 . A A . -2 GLY H2 1 1 12 8068 1 1 1 GLY H3 H -22.928 13.290 -1.291 1.00 . A A . -2 GLY H3 1 1 12 8069 1 1 1 GLY HA2 H -21.951 13.857 -3.402 1.00 . A A . -2 GLY HA2 1 1 12 8070 1 1 1 GLY HA3 H -20.366 13.908 -2.642 1.00 . A A . -2 GLY HA3 1 1 12 8071 1 1 1 GLY N N -21.976 13.706 -1.312 1.00 . A A . -2 GLY N 1 1 12 8072 1 1 1 GLY O O -21.718 11.140 -2.120 1.00 . A A . -2 GLY O 1 1 12 8073 1 1 2 PRO C C -19.334 9.485 -3.158 1.00 . A A . -1 PRO C 1 1 12 8074 1 1 2 PRO CA C -20.184 10.160 -4.228 1.00 . A A . -1 PRO CA 1 1 12 8075 1 1 2 PRO CB C -19.429 10.212 -5.561 1.00 . A A . -1 PRO CB 1 1 12 8076 1 1 2 PRO CD C -19.786 12.472 -4.882 1.00 . A A . -1 PRO CD 1 1 12 8077 1 1 2 PRO CG C -18.826 11.573 -5.608 1.00 . A A . -1 PRO CG 1 1 12 8078 1 1 2 PRO HA H -21.106 9.612 -4.353 1.00 . A A . -1 PRO HA 1 1 12 8079 1 1 2 PRO HB2 H -18.670 9.442 -5.578 1.00 . A A . -1 PRO HB2 1 1 12 8080 1 1 2 PRO HB3 H -20.121 10.060 -6.375 1.00 . A A . -1 PRO HB3 1 1 12 8081 1 1 2 PRO HD2 H -19.252 13.262 -4.374 1.00 . A A . -1 PRO HD2 1 1 12 8082 1 1 2 PRO HD3 H -20.510 12.883 -5.569 1.00 . A A . -1 PRO HD3 1 1 12 8083 1 1 2 PRO HG2 H -17.868 11.568 -5.110 1.00 . A A . -1 PRO HG2 1 1 12 8084 1 1 2 PRO HG3 H -18.716 11.892 -6.633 1.00 . A A . -1 PRO HG3 1 1 12 8085 1 1 2 PRO N N -20.435 11.567 -3.917 1.00 . A A . -1 PRO N 1 1 12 8086 1 1 2 PRO O O -18.438 10.104 -2.580 1.00 . A A . -1 PRO O 1 1 12 8087 1 1 3 HIS C C -17.613 6.870 -2.560 1.00 . A A . 0 HIS C 1 1 12 8088 1 1 3 HIS CA C -18.862 7.461 -1.906 1.00 . A A . 0 HIS CA 1 1 12 8089 1 1 3 HIS CB C -19.736 6.371 -1.250 1.00 . A A . 0 HIS CB 1 1 12 8090 1 1 3 HIS CD2 C -21.171 5.429 -3.209 1.00 . A A . 0 HIS CD2 1 1 12 8091 1 1 3 HIS CE1 C -20.569 3.331 -3.057 1.00 . A A . 0 HIS CE1 1 1 12 8092 1 1 3 HIS CG C -20.283 5.333 -2.190 1.00 . A A . 0 HIS CG 1 1 12 8093 1 1 3 HIS H H -20.354 7.787 -3.372 1.00 . A A . 0 HIS H 1 1 12 8094 1 1 3 HIS HA H -18.543 8.156 -1.142 1.00 . A A . 0 HIS HA 1 1 12 8095 1 1 3 HIS HB2 H -19.147 5.856 -0.507 1.00 . A A . 0 HIS HB2 1 1 12 8096 1 1 3 HIS HB3 H -20.574 6.847 -0.760 1.00 . A A . 0 HIS HB3 1 1 12 8097 1 1 3 HIS HD1 H -19.291 3.613 -1.483 1.00 . A A . 0 HIS HD1 1 1 12 8098 1 1 3 HIS HD2 H -21.664 6.330 -3.546 1.00 . A A . 0 HIS HD2 1 1 12 8099 1 1 3 HIS HE1 H -20.486 2.272 -3.239 1.00 . A A . 0 HIS HE1 1 1 12 8100 1 1 3 HIS HE2 H -21.750 3.970 -4.597 1.00 . A A . 0 HIS HE2 1 1 12 8101 1 1 3 HIS N N -19.622 8.222 -2.890 1.00 . A A . 0 HIS N 1 1 12 8102 1 1 3 HIS ND1 N -19.928 4.006 -2.123 1.00 . A A . 0 HIS ND1 1 1 12 8103 1 1 3 HIS NE2 N -21.332 4.171 -3.731 1.00 . A A . 0 HIS NE2 1 1 12 8104 1 1 3 HIS O O -17.485 5.658 -2.735 1.00 . A A . 0 HIS O 1 1 12 8105 1 1 4 MET C C -14.626 6.455 -2.756 1.00 . A A . 1 MET C 1 1 12 8106 1 1 4 MET CA C -15.480 7.365 -3.624 1.00 . A A . 1 MET CA 1 1 12 8107 1 1 4 MET CB C -14.673 8.599 -4.034 1.00 . A A . 1 MET CB 1 1 12 8108 1 1 4 MET CE C -13.132 10.216 -6.364 1.00 . A A . 1 MET CE 1 1 12 8109 1 1 4 MET CG C -15.428 9.554 -4.946 1.00 . A A . 1 MET CG 1 1 12 8110 1 1 4 MET H H -16.833 8.701 -2.702 1.00 . A A . 1 MET H 1 1 12 8111 1 1 4 MET HA H -15.770 6.824 -4.513 1.00 . A A . 1 MET HA 1 1 12 8112 1 1 4 MET HB2 H -14.386 9.139 -3.144 1.00 . A A . 1 MET HB2 1 1 12 8113 1 1 4 MET HB3 H -13.782 8.275 -4.549 1.00 . A A . 1 MET HB3 1 1 12 8114 1 1 4 MET HE1 H -12.479 10.978 -6.763 1.00 . A A . 1 MET HE1 1 1 12 8115 1 1 4 MET HE2 H -13.560 9.646 -7.174 1.00 . A A . 1 MET HE2 1 1 12 8116 1 1 4 MET HE3 H -12.568 9.560 -5.719 1.00 . A A . 1 MET HE3 1 1 12 8117 1 1 4 MET HG2 H -15.717 9.023 -5.841 1.00 . A A . 1 MET HG2 1 1 12 8118 1 1 4 MET HG3 H -16.314 9.895 -4.432 1.00 . A A . 1 MET HG3 1 1 12 8119 1 1 4 MET N N -16.694 7.754 -2.926 1.00 . A A . 1 MET N 1 1 12 8120 1 1 4 MET O O -14.212 6.828 -1.656 1.00 . A A . 1 MET O 1 1 12 8121 1 1 4 MET SD S -14.446 10.992 -5.422 1.00 . A A . 1 MET SD 1 1 12 8122 1 1 5 ALA C C -12.550 3.681 -3.493 1.00 . A A . 2 ALA C 1 1 12 8123 1 1 5 ALA CA C -13.554 4.300 -2.539 1.00 . A A . 2 ALA CA 1 1 12 8124 1 1 5 ALA CB C -14.406 3.225 -1.882 1.00 . A A . 2 ALA CB 1 1 12 8125 1 1 5 ALA H H -14.768 5.003 -4.113 1.00 . A A . 2 ALA H 1 1 12 8126 1 1 5 ALA HA H -13.021 4.830 -1.765 1.00 . A A . 2 ALA HA 1 1 12 8127 1 1 5 ALA HB1 H -14.950 2.682 -2.641 1.00 . A A . 2 ALA HB1 1 1 12 8128 1 1 5 ALA HB2 H -15.103 3.685 -1.199 1.00 . A A . 2 ALA HB2 1 1 12 8129 1 1 5 ALA HB3 H -13.769 2.542 -1.341 1.00 . A A . 2 ALA HB3 1 1 12 8130 1 1 5 ALA N N -14.383 5.255 -3.245 1.00 . A A . 2 ALA N 1 1 12 8131 1 1 5 ALA O O -12.770 3.649 -4.706 1.00 . A A . 2 ALA O 1 1 12 8132 1 1 6 VAL C C -10.017 1.259 -3.148 1.00 . A A . 3 VAL C 1 1 12 8133 1 1 6 VAL CA C -10.407 2.594 -3.756 1.00 . A A . 3 VAL CA 1 1 12 8134 1 1 6 VAL CB C -9.152 3.490 -3.877 1.00 . A A . 3 VAL CB 1 1 12 8135 1 1 6 VAL CG1 C -8.060 2.792 -4.675 1.00 . A A . 3 VAL CG1 1 1 12 8136 1 1 6 VAL CG2 C -9.500 4.826 -4.513 1.00 . A A . 3 VAL CG2 1 1 12 8137 1 1 6 VAL H H -11.313 3.286 -1.983 1.00 . A A . 3 VAL H 1 1 12 8138 1 1 6 VAL HA H -10.807 2.427 -4.746 1.00 . A A . 3 VAL HA 1 1 12 8139 1 1 6 VAL HB H -8.773 3.678 -2.883 1.00 . A A . 3 VAL HB 1 1 12 8140 1 1 6 VAL HG11 H -7.207 3.448 -4.766 1.00 . A A . 3 VAL HG11 1 1 12 8141 1 1 6 VAL HG12 H -8.432 2.546 -5.658 1.00 . A A . 3 VAL HG12 1 1 12 8142 1 1 6 VAL HG13 H -7.765 1.888 -4.163 1.00 . A A . 3 VAL HG13 1 1 12 8143 1 1 6 VAL HG21 H -9.914 4.659 -5.497 1.00 . A A . 3 VAL HG21 1 1 12 8144 1 1 6 VAL HG22 H -8.609 5.430 -4.596 1.00 . A A . 3 VAL HG22 1 1 12 8145 1 1 6 VAL HG23 H -10.227 5.336 -3.900 1.00 . A A . 3 VAL HG23 1 1 12 8146 1 1 6 VAL N N -11.441 3.218 -2.953 1.00 . A A . 3 VAL N 1 1 12 8147 1 1 6 VAL O O -9.792 1.160 -1.939 1.00 . A A . 3 VAL O 1 1 12 8148 1 1 7 LEU C C -8.029 -1.106 -3.365 1.00 . A A . 4 LEU C 1 1 12 8149 1 1 7 LEU CA C -9.537 -1.078 -3.538 1.00 . A A . 4 LEU CA 1 1 12 8150 1 1 7 LEU CB C -9.967 -2.157 -4.533 1.00 . A A . 4 LEU CB 1 1 12 8151 1 1 7 LEU CD1 C -11.770 -3.503 -5.627 1.00 . A A . 4 LEU CD1 1 1 12 8152 1 1 7 LEU CD2 C -11.962 -2.906 -3.206 1.00 . A A . 4 LEU CD2 1 1 12 8153 1 1 7 LEU CG C -11.467 -2.450 -4.574 1.00 . A A . 4 LEU CG 1 1 12 8154 1 1 7 LEU H H -10.235 0.362 -4.916 1.00 . A A . 4 LEU H 1 1 12 8155 1 1 7 LEU HA H -9.998 -1.276 -2.584 1.00 . A A . 4 LEU HA 1 1 12 8156 1 1 7 LEU HB2 H -9.656 -1.849 -5.520 1.00 . A A . 4 LEU HB2 1 1 12 8157 1 1 7 LEU HB3 H -9.452 -3.072 -4.283 1.00 . A A . 4 LEU HB3 1 1 12 8158 1 1 7 LEU HD11 H -12.833 -3.688 -5.655 1.00 . A A . 4 LEU HD11 1 1 12 8159 1 1 7 LEU HD12 H -11.253 -4.419 -5.380 1.00 . A A . 4 LEU HD12 1 1 12 8160 1 1 7 LEU HD13 H -11.440 -3.152 -6.593 1.00 . A A . 4 LEU HD13 1 1 12 8161 1 1 7 LEU HD21 H -13.003 -3.186 -3.275 1.00 . A A . 4 LEU HD21 1 1 12 8162 1 1 7 LEU HD22 H -11.855 -2.098 -2.496 1.00 . A A . 4 LEU HD22 1 1 12 8163 1 1 7 LEU HD23 H -11.381 -3.757 -2.873 1.00 . A A . 4 LEU HD23 1 1 12 8164 1 1 7 LEU HG H -11.998 -1.548 -4.840 1.00 . A A . 4 LEU HG 1 1 12 8165 1 1 7 LEU N N -9.970 0.233 -3.979 1.00 . A A . 4 LEU N 1 1 12 8166 1 1 7 LEU O O -7.292 -0.438 -4.094 1.00 . A A . 4 LEU O 1 1 12 8167 1 1 8 CYS C C -5.404 -2.398 -3.355 1.00 . A A . 5 CYS C 1 1 12 8168 1 1 8 CYS CA C -6.186 -2.078 -2.085 1.00 . A A . 5 CYS CA 1 1 12 8169 1 1 8 CYS CB C -6.080 -3.234 -1.100 1.00 . A A . 5 CYS CB 1 1 12 8170 1 1 8 CYS H H -8.262 -2.302 -1.800 1.00 . A A . 5 CYS H 1 1 12 8171 1 1 8 CYS HA H -5.789 -1.183 -1.631 1.00 . A A . 5 CYS HA 1 1 12 8172 1 1 8 CYS HB2 H -6.683 -3.010 -0.239 1.00 . A A . 5 CYS HB2 1 1 12 8173 1 1 8 CYS HB3 H -6.469 -4.124 -1.573 1.00 . A A . 5 CYS HB3 1 1 12 8174 1 1 8 CYS N N -7.597 -1.867 -2.374 1.00 . A A . 5 CYS N 1 1 12 8175 1 1 8 CYS O O -5.718 -3.350 -4.061 1.00 . A A . 5 CYS O 1 1 12 8176 1 1 8 CYS SG S -4.418 -3.617 -0.511 1.00 . A A . 5 CYS SG 1 1 12 8177 1 1 9 GLY C C -2.891 -3.103 -4.938 1.00 . A A . 6 GLY C 1 1 12 8178 1 1 9 GLY CA C -3.601 -1.764 -4.845 1.00 . A A . 6 GLY CA 1 1 12 8179 1 1 9 GLY H H -4.145 -0.888 -2.991 1.00 . A A . 6 GLY H 1 1 12 8180 1 1 9 GLY HA2 H -4.260 -1.664 -5.692 1.00 . A A . 6 GLY HA2 1 1 12 8181 1 1 9 GLY HA3 H -2.861 -0.978 -4.888 1.00 . A A . 6 GLY HA3 1 1 12 8182 1 1 9 GLY N N -4.375 -1.604 -3.626 1.00 . A A . 6 GLY N 1 1 12 8183 1 1 9 GLY O O -2.543 -3.554 -6.027 1.00 . A A . 6 GLY O 1 1 12 8184 1 1 10 VAL C C -2.927 -6.190 -3.925 1.00 . A A . 7 VAL C 1 1 12 8185 1 1 10 VAL CA C -1.966 -5.013 -3.764 1.00 . A A . 7 VAL CA 1 1 12 8186 1 1 10 VAL CB C -1.160 -5.183 -2.458 1.00 . A A . 7 VAL CB 1 1 12 8187 1 1 10 VAL CG1 C -0.543 -6.572 -2.379 1.00 . A A . 7 VAL CG1 1 1 12 8188 1 1 10 VAL CG2 C -0.081 -4.113 -2.359 1.00 . A A . 7 VAL CG2 1 1 12 8189 1 1 10 VAL H H -2.988 -3.340 -2.961 1.00 . A A . 7 VAL H 1 1 12 8190 1 1 10 VAL HA H -1.271 -5.023 -4.589 1.00 . A A . 7 VAL HA 1 1 12 8191 1 1 10 VAL HB H -1.834 -5.063 -1.622 1.00 . A A . 7 VAL HB 1 1 12 8192 1 1 10 VAL HG11 H -1.330 -7.313 -2.416 1.00 . A A . 7 VAL HG11 1 1 12 8193 1 1 10 VAL HG12 H 0.004 -6.671 -1.454 1.00 . A A . 7 VAL HG12 1 1 12 8194 1 1 10 VAL HG13 H 0.127 -6.718 -3.213 1.00 . A A . 7 VAL HG13 1 1 12 8195 1 1 10 VAL HG21 H 0.594 -4.205 -3.197 1.00 . A A . 7 VAL HG21 1 1 12 8196 1 1 10 VAL HG22 H 0.468 -4.239 -1.437 1.00 . A A . 7 VAL HG22 1 1 12 8197 1 1 10 VAL HG23 H -0.541 -3.136 -2.374 1.00 . A A . 7 VAL HG23 1 1 12 8198 1 1 10 VAL N N -2.670 -3.738 -3.796 1.00 . A A . 7 VAL N 1 1 12 8199 1 1 10 VAL O O -2.890 -6.892 -4.935 1.00 . A A . 7 VAL O 1 1 12 8200 1 1 11 CYS C C -5.997 -7.237 -3.616 1.00 . A A . 8 CYS C 1 1 12 8201 1 1 11 CYS CA C -4.670 -7.560 -2.929 1.00 . A A . 8 CYS CA 1 1 12 8202 1 1 11 CYS CB C -4.900 -8.044 -1.487 1.00 . A A . 8 CYS CB 1 1 12 8203 1 1 11 CYS H H -3.845 -5.747 -2.211 1.00 . A A . 8 CYS H 1 1 12 8204 1 1 11 CYS HA H -4.177 -8.343 -3.485 1.00 . A A . 8 CYS HA 1 1 12 8205 1 1 11 CYS HB2 H -5.389 -9.006 -1.516 1.00 . A A . 8 CYS HB2 1 1 12 8206 1 1 11 CYS HB3 H -3.943 -8.150 -0.997 1.00 . A A . 8 CYS HB3 1 1 12 8207 1 1 11 CYS N N -3.793 -6.393 -2.937 1.00 . A A . 8 CYS N 1 1 12 8208 1 1 11 CYS O O -6.577 -8.091 -4.286 1.00 . A A . 8 CYS O 1 1 12 8209 1 1 11 CYS SG S -5.919 -6.951 -0.466 1.00 . A A . 8 CYS SG 1 1 12 8210 1 1 12 GLY C C -8.887 -6.413 -3.808 1.00 . A A . 9 GLY C 1 1 12 8211 1 1 12 GLY CA C -7.676 -5.561 -4.136 1.00 . A A . 9 GLY CA 1 1 12 8212 1 1 12 GLY H H -5.940 -5.364 -2.941 1.00 . A A . 9 GLY H 1 1 12 8213 1 1 12 GLY HA2 H -7.882 -4.545 -3.838 1.00 . A A . 9 GLY HA2 1 1 12 8214 1 1 12 GLY HA3 H -7.517 -5.582 -5.204 1.00 . A A . 9 GLY HA3 1 1 12 8215 1 1 12 GLY N N -6.453 -5.999 -3.476 1.00 . A A . 9 GLY N 1 1 12 8216 1 1 12 GLY O O -9.556 -6.927 -4.710 1.00 . A A . 9 GLY O 1 1 12 8217 1 1 13 ILE C C -11.197 -6.512 -1.118 1.00 . A A . 10 ILE C 1 1 12 8218 1 1 13 ILE CA C -10.353 -7.318 -2.103 1.00 . A A . 10 ILE CA 1 1 12 8219 1 1 13 ILE CB C -9.990 -8.697 -1.494 1.00 . A A . 10 ILE CB 1 1 12 8220 1 1 13 ILE CD1 C -9.105 -7.878 0.765 1.00 . A A . 10 ILE CD1 1 1 12 8221 1 1 13 ILE CG1 C -8.801 -8.599 -0.530 1.00 . A A . 10 ILE CG1 1 1 12 8222 1 1 13 ILE CG2 C -9.688 -9.698 -2.600 1.00 . A A . 10 ILE CG2 1 1 12 8223 1 1 13 ILE H H -8.562 -6.215 -1.844 1.00 . A A . 10 ILE H 1 1 12 8224 1 1 13 ILE HA H -10.946 -7.495 -2.987 1.00 . A A . 10 ILE HA 1 1 12 8225 1 1 13 ILE HB H -10.851 -9.057 -0.952 1.00 . A A . 10 ILE HB 1 1 12 8226 1 1 13 ILE HD11 H -8.207 -7.808 1.358 1.00 . A A . 10 ILE HD11 1 1 12 8227 1 1 13 ILE HD12 H -9.859 -8.422 1.313 1.00 . A A . 10 ILE HD12 1 1 12 8228 1 1 13 ILE HD13 H -9.469 -6.882 0.541 1.00 . A A . 10 ILE HD13 1 1 12 8229 1 1 13 ILE HG12 H -8.467 -9.594 -0.279 1.00 . A A . 10 ILE HG12 1 1 12 8230 1 1 13 ILE HG13 H -7.995 -8.070 -1.020 1.00 . A A . 10 ILE HG13 1 1 12 8231 1 1 13 ILE HG21 H -8.874 -9.329 -3.208 1.00 . A A . 10 ILE HG21 1 1 12 8232 1 1 13 ILE HG22 H -10.565 -9.830 -3.216 1.00 . A A . 10 ILE HG22 1 1 12 8233 1 1 13 ILE HG23 H -9.409 -10.644 -2.163 1.00 . A A . 10 ILE HG23 1 1 12 8234 1 1 13 ILE N N -9.169 -6.578 -2.523 1.00 . A A . 10 ILE N 1 1 12 8235 1 1 13 ILE O O -12.257 -6.960 -0.682 1.00 . A A . 10 ILE O 1 1 12 8236 1 1 14 LYS C C -10.893 -3.033 0.091 1.00 . A A . 11 LYS C 1 1 12 8237 1 1 14 LYS CA C -11.436 -4.456 0.161 1.00 . A A . 11 LYS CA 1 1 12 8238 1 1 14 LYS CB C -11.318 -5.002 1.590 1.00 . A A . 11 LYS CB 1 1 12 8239 1 1 14 LYS CD C -9.856 -5.448 3.596 1.00 . A A . 11 LYS CD 1 1 12 8240 1 1 14 LYS CE C -10.948 -4.988 4.551 1.00 . A A . 11 LYS CE 1 1 12 8241 1 1 14 LYS CG C -9.959 -4.768 2.237 1.00 . A A . 11 LYS CG 1 1 12 8242 1 1 14 LYS H H -9.900 -4.992 -1.184 1.00 . A A . 11 LYS H 1 1 12 8243 1 1 14 LYS HA H -12.478 -4.443 -0.124 1.00 . A A . 11 LYS HA 1 1 12 8244 1 1 14 LYS HB2 H -12.068 -4.532 2.204 1.00 . A A . 11 LYS HB2 1 1 12 8245 1 1 14 LYS HB3 H -11.501 -6.066 1.569 1.00 . A A . 11 LYS HB3 1 1 12 8246 1 1 14 LYS HD2 H -9.941 -6.516 3.458 1.00 . A A . 11 LYS HD2 1 1 12 8247 1 1 14 LYS HD3 H -8.893 -5.217 4.027 1.00 . A A . 11 LYS HD3 1 1 12 8248 1 1 14 LYS HE2 H -11.907 -5.267 4.144 1.00 . A A . 11 LYS HE2 1 1 12 8249 1 1 14 LYS HE3 H -10.806 -5.481 5.502 1.00 . A A . 11 LYS HE3 1 1 12 8250 1 1 14 LYS HG2 H -9.190 -5.162 1.590 1.00 . A A . 11 LYS HG2 1 1 12 8251 1 1 14 LYS HG3 H -9.813 -3.704 2.365 1.00 . A A . 11 LYS HG3 1 1 12 8252 1 1 14 LYS HZ1 H -11.638 -3.245 5.470 1.00 . A A . 11 LYS HZ1 1 1 12 8253 1 1 14 LYS HZ2 H -11.136 -3.020 3.876 1.00 . A A . 11 LYS HZ2 1 1 12 8254 1 1 14 LYS HZ3 H -9.989 -3.217 5.102 1.00 . A A . 11 LYS HZ3 1 1 12 8255 1 1 14 LYS N N -10.728 -5.315 -0.779 1.00 . A A . 11 LYS N 1 1 12 8256 1 1 14 LYS NZ N -10.925 -3.516 4.764 1.00 . A A . 11 LYS NZ 1 1 12 8257 1 1 14 LYS O O -9.888 -2.782 -0.589 1.00 . A A . 11 LYS O 1 1 12 8258 1 1 15 GLU C C -9.754 -0.546 1.370 1.00 . A A . 12 GLU C 1 1 12 8259 1 1 15 GLU CA C -11.165 -0.712 0.804 1.00 . A A . 12 GLU CA 1 1 12 8260 1 1 15 GLU CB C -12.157 0.103 1.639 1.00 . A A . 12 GLU CB 1 1 12 8261 1 1 15 GLU CD C -12.819 2.412 2.451 1.00 . A A . 12 GLU CD 1 1 12 8262 1 1 15 GLU CG C -12.031 1.605 1.435 1.00 . A A . 12 GLU CG 1 1 12 8263 1 1 15 GLU H H -12.336 -2.396 1.318 1.00 . A A . 12 GLU H 1 1 12 8264 1 1 15 GLU HA H -11.179 -0.353 -0.213 1.00 . A A . 12 GLU HA 1 1 12 8265 1 1 15 GLU HB2 H -13.162 -0.193 1.374 1.00 . A A . 12 GLU HB2 1 1 12 8266 1 1 15 GLU HB3 H -11.993 -0.111 2.685 1.00 . A A . 12 GLU HB3 1 1 12 8267 1 1 15 GLU HG2 H -10.990 1.877 1.513 1.00 . A A . 12 GLU HG2 1 1 12 8268 1 1 15 GLU HG3 H -12.392 1.849 0.446 1.00 . A A . 12 GLU HG3 1 1 12 8269 1 1 15 GLU N N -11.554 -2.118 0.792 1.00 . A A . 12 GLU N 1 1 12 8270 1 1 15 GLU O O -9.318 -1.316 2.234 1.00 . A A . 12 GLU O 1 1 12 8271 1 1 15 GLU OE1 O -14.058 2.503 2.324 1.00 . A A . 12 GLU OE1 1 1 12 8272 1 1 15 GLU OE2 O -12.196 2.968 3.381 1.00 . A A . 12 GLU OE2 1 1 12 8273 1 1 16 PHE C C -7.724 1.483 2.649 1.00 . A A . 13 PHE C 1 1 12 8274 1 1 16 PHE CA C -7.694 0.745 1.316 1.00 . A A . 13 PHE CA 1 1 12 8275 1 1 16 PHE CB C -6.959 1.601 0.283 1.00 . A A . 13 PHE CB 1 1 12 8276 1 1 16 PHE CD1 C -8.486 3.496 -0.354 1.00 . A A . 13 PHE CD1 1 1 12 8277 1 1 16 PHE CD2 C -6.579 3.982 0.993 1.00 . A A . 13 PHE CD2 1 1 12 8278 1 1 16 PHE CE1 C -8.844 4.831 -0.333 1.00 . A A . 13 PHE CE1 1 1 12 8279 1 1 16 PHE CE2 C -6.931 5.318 1.016 1.00 . A A . 13 PHE CE2 1 1 12 8280 1 1 16 PHE CG C -7.352 3.056 0.308 1.00 . A A . 13 PHE CG 1 1 12 8281 1 1 16 PHE CZ C -8.066 5.742 0.353 1.00 . A A . 13 PHE CZ 1 1 12 8282 1 1 16 PHE H H -9.443 1.010 0.161 1.00 . A A . 13 PHE H 1 1 12 8283 1 1 16 PHE HA H -7.172 -0.189 1.440 1.00 . A A . 13 PHE HA 1 1 12 8284 1 1 16 PHE HB2 H -5.898 1.541 0.468 1.00 . A A . 13 PHE HB2 1 1 12 8285 1 1 16 PHE HB3 H -7.167 1.217 -0.705 1.00 . A A . 13 PHE HB3 1 1 12 8286 1 1 16 PHE HD1 H -9.094 2.784 -0.893 1.00 . A A . 13 PHE HD1 1 1 12 8287 1 1 16 PHE HD2 H -5.695 3.648 1.521 1.00 . A A . 13 PHE HD2 1 1 12 8288 1 1 16 PHE HE1 H -9.732 5.160 -0.853 1.00 . A A . 13 PHE HE1 1 1 12 8289 1 1 16 PHE HE2 H -6.317 6.030 1.549 1.00 . A A . 13 PHE HE2 1 1 12 8290 1 1 16 PHE HZ H -8.344 6.786 0.370 1.00 . A A . 13 PHE HZ 1 1 12 8291 1 1 16 PHE N N -9.045 0.453 0.865 1.00 . A A . 13 PHE N 1 1 12 8292 1 1 16 PHE O O -8.724 2.106 3.006 1.00 . A A . 13 PHE O 1 1 12 8293 1 1 17 LYS C C -5.133 2.815 4.738 1.00 . A A . 14 LYS C 1 1 12 8294 1 1 17 LYS CA C -6.492 2.128 4.633 1.00 . A A . 14 LYS CA 1 1 12 8295 1 1 17 LYS CB C -6.701 1.142 5.787 1.00 . A A . 14 LYS CB 1 1 12 8296 1 1 17 LYS CD C -6.905 0.791 8.272 1.00 . A A . 14 LYS CD 1 1 12 8297 1 1 17 LYS CE C -6.678 1.410 9.640 1.00 . A A . 14 LYS CE 1 1 12 8298 1 1 17 LYS CG C -6.506 1.752 7.165 1.00 . A A . 14 LYS CG 1 1 12 8299 1 1 17 LYS H H -5.854 0.909 3.028 1.00 . A A . 14 LYS H 1 1 12 8300 1 1 17 LYS HA H -7.260 2.880 4.669 1.00 . A A . 14 LYS HA 1 1 12 8301 1 1 17 LYS HB2 H -7.704 0.751 5.730 1.00 . A A . 14 LYS HB2 1 1 12 8302 1 1 17 LYS HB3 H -6.001 0.329 5.675 1.00 . A A . 14 LYS HB3 1 1 12 8303 1 1 17 LYS HD2 H -7.952 0.546 8.167 1.00 . A A . 14 LYS HD2 1 1 12 8304 1 1 17 LYS HD3 H -6.311 -0.107 8.189 1.00 . A A . 14 LYS HD3 1 1 12 8305 1 1 17 LYS HE2 H -5.621 1.586 9.769 1.00 . A A . 14 LYS HE2 1 1 12 8306 1 1 17 LYS HE3 H -7.204 2.352 9.686 1.00 . A A . 14 LYS HE3 1 1 12 8307 1 1 17 LYS HG2 H -5.463 2.004 7.287 1.00 . A A . 14 LYS HG2 1 1 12 8308 1 1 17 LYS HG3 H -7.106 2.646 7.241 1.00 . A A . 14 LYS HG3 1 1 12 8309 1 1 17 LYS HZ1 H -6.668 -0.381 10.708 1.00 . A A . 14 LYS HZ1 1 1 12 8310 1 1 17 LYS HZ2 H -8.179 0.372 10.653 1.00 . A A . 14 LYS HZ2 1 1 12 8311 1 1 17 LYS HZ3 H -6.969 0.981 11.660 1.00 . A A . 14 LYS HZ3 1 1 12 8312 1 1 17 LYS N N -6.616 1.433 3.364 1.00 . A A . 14 LYS N 1 1 12 8313 1 1 17 LYS NZ N -7.156 0.533 10.740 1.00 . A A . 14 LYS NZ 1 1 12 8314 1 1 17 LYS O O -4.921 3.685 5.580 1.00 . A A . 14 LYS O 1 1 12 8315 1 1 18 TYR C C -2.524 3.571 2.524 1.00 . A A . 15 TYR C 1 1 12 8316 1 1 18 TYR CA C -2.874 2.975 3.875 1.00 . A A . 15 TYR CA 1 1 12 8317 1 1 18 TYR CB C -1.866 1.884 4.225 1.00 . A A . 15 TYR CB 1 1 12 8318 1 1 18 TYR CD1 C -3.045 0.508 5.978 1.00 . A A . 15 TYR CD1 1 1 12 8319 1 1 18 TYR CD2 C -1.067 1.675 6.592 1.00 . A A . 15 TYR CD2 1 1 12 8320 1 1 18 TYR CE1 C -3.158 0.012 7.264 1.00 . A A . 15 TYR CE1 1 1 12 8321 1 1 18 TYR CE2 C -1.168 1.184 7.878 1.00 . A A . 15 TYR CE2 1 1 12 8322 1 1 18 TYR CG C -1.998 1.346 5.626 1.00 . A A . 15 TYR CG 1 1 12 8323 1 1 18 TYR CZ C -2.216 0.354 8.209 1.00 . A A . 15 TYR CZ 1 1 12 8324 1 1 18 TYR H H -4.459 1.777 3.173 1.00 . A A . 15 TYR H 1 1 12 8325 1 1 18 TYR HA H -2.830 3.751 4.625 1.00 . A A . 15 TYR HA 1 1 12 8326 1 1 18 TYR HB2 H -1.992 1.058 3.542 1.00 . A A . 15 TYR HB2 1 1 12 8327 1 1 18 TYR HB3 H -0.866 2.282 4.115 1.00 . A A . 15 TYR HB3 1 1 12 8328 1 1 18 TYR HD1 H -3.783 0.249 5.230 1.00 . A A . 15 TYR HD1 1 1 12 8329 1 1 18 TYR HD2 H -0.249 2.327 6.327 1.00 . A A . 15 TYR HD2 1 1 12 8330 1 1 18 TYR HE1 H -3.981 -0.638 7.523 1.00 . A A . 15 TYR HE1 1 1 12 8331 1 1 18 TYR HE2 H -0.429 1.453 8.617 1.00 . A A . 15 TYR HE2 1 1 12 8332 1 1 18 TYR HH H -2.507 -1.086 9.458 1.00 . A A . 15 TYR HH 1 1 12 8333 1 1 18 TYR N N -4.222 2.436 3.861 1.00 . A A . 15 TYR N 1 1 12 8334 1 1 18 TYR O O -3.302 3.479 1.575 1.00 . A A . 15 TYR O 1 1 12 8335 1 1 18 TYR OH O -2.317 -0.138 9.490 1.00 . A A . 15 TYR OH 1 1 12 8336 1 1 19 LYS C C 0.629 4.929 1.287 1.00 . A A . 16 LYS C 1 1 12 8337 1 1 19 LYS CA C -0.882 4.783 1.221 1.00 . A A . 16 LYS CA 1 1 12 8338 1 1 19 LYS CB C -1.545 6.153 1.042 1.00 . A A . 16 LYS CB 1 1 12 8339 1 1 19 LYS CD C -2.179 8.052 -0.452 1.00 . A A . 16 LYS CD 1 1 12 8340 1 1 19 LYS CE C -2.575 8.380 -1.879 1.00 . A A . 16 LYS CE 1 1 12 8341 1 1 19 LYS CG C -1.439 6.728 -0.361 1.00 . A A . 16 LYS CG 1 1 12 8342 1 1 19 LYS H H -0.778 4.204 3.245 1.00 . A A . 16 LYS H 1 1 12 8343 1 1 19 LYS HA H -1.146 4.142 0.394 1.00 . A A . 16 LYS HA 1 1 12 8344 1 1 19 LYS HB2 H -2.593 6.064 1.288 1.00 . A A . 16 LYS HB2 1 1 12 8345 1 1 19 LYS HB3 H -1.085 6.850 1.728 1.00 . A A . 16 LYS HB3 1 1 12 8346 1 1 19 LYS HD2 H -3.070 7.996 0.153 1.00 . A A . 16 LYS HD2 1 1 12 8347 1 1 19 LYS HD3 H -1.537 8.837 -0.078 1.00 . A A . 16 LYS HD3 1 1 12 8348 1 1 19 LYS HE2 H -1.688 8.400 -2.494 1.00 . A A . 16 LYS HE2 1 1 12 8349 1 1 19 LYS HE3 H -3.246 7.610 -2.235 1.00 . A A . 16 LYS HE3 1 1 12 8350 1 1 19 LYS HG2 H -0.397 6.890 -0.599 1.00 . A A . 16 LYS HG2 1 1 12 8351 1 1 19 LYS HG3 H -1.870 6.032 -1.066 1.00 . A A . 16 LYS HG3 1 1 12 8352 1 1 19 LYS HZ1 H -3.614 9.848 -2.937 1.00 . A A . 16 LYS HZ1 1 1 12 8353 1 1 19 LYS HZ2 H -2.599 10.464 -1.735 1.00 . A A . 16 LYS HZ2 1 1 12 8354 1 1 19 LYS HZ3 H -4.063 9.732 -1.311 1.00 . A A . 16 LYS HZ3 1 1 12 8355 1 1 19 LYS N N -1.350 4.170 2.446 1.00 . A A . 16 LYS N 1 1 12 8356 1 1 19 LYS NZ N -3.260 9.697 -1.971 1.00 . A A . 16 LYS NZ 1 1 12 8357 1 1 19 LYS O O 1.136 5.838 1.944 1.00 . A A . 16 LYS O 1 1 12 8358 1 1 20 CYS C C 3.344 5.404 0.234 1.00 . A A . 17 CYS C 1 1 12 8359 1 1 20 CYS CA C 2.802 4.041 0.661 1.00 . A A . 17 CYS CA 1 1 12 8360 1 1 20 CYS CB C 3.397 2.963 -0.250 1.00 . A A . 17 CYS CB 1 1 12 8361 1 1 20 CYS H H 0.879 3.300 0.154 1.00 . A A . 17 CYS H 1 1 12 8362 1 1 20 CYS HA H 3.116 3.848 1.675 1.00 . A A . 17 CYS HA 1 1 12 8363 1 1 20 CYS HB2 H 3.111 1.989 0.112 1.00 . A A . 17 CYS HB2 1 1 12 8364 1 1 20 CYS HB3 H 3.034 3.100 -1.256 1.00 . A A . 17 CYS HB3 1 1 12 8365 1 1 20 CYS N N 1.344 4.012 0.643 1.00 . A A . 17 CYS N 1 1 12 8366 1 1 20 CYS O O 2.969 5.930 -0.808 1.00 . A A . 17 CYS O 1 1 12 8367 1 1 20 CYS SG S 5.200 3.046 -0.291 1.00 . A A . 17 CYS SG 1 1 12 8368 1 1 21 PRO C C 5.720 7.247 -0.518 1.00 . A A . 18 PRO C 1 1 12 8369 1 1 21 PRO CA C 4.877 7.276 0.755 1.00 . A A . 18 PRO CA 1 1 12 8370 1 1 21 PRO CB C 5.769 7.532 1.977 1.00 . A A . 18 PRO CB 1 1 12 8371 1 1 21 PRO CD C 4.722 5.413 2.321 1.00 . A A . 18 PRO CD 1 1 12 8372 1 1 21 PRO CG C 5.965 6.197 2.607 1.00 . A A . 18 PRO CG 1 1 12 8373 1 1 21 PRO HA H 4.139 8.061 0.677 1.00 . A A . 18 PRO HA 1 1 12 8374 1 1 21 PRO HB2 H 6.713 7.951 1.657 1.00 . A A . 18 PRO HB2 1 1 12 8375 1 1 21 PRO HB3 H 5.276 8.216 2.650 1.00 . A A . 18 PRO HB3 1 1 12 8376 1 1 21 PRO HD2 H 4.954 4.364 2.217 1.00 . A A . 18 PRO HD2 1 1 12 8377 1 1 21 PRO HD3 H 3.992 5.564 3.102 1.00 . A A . 18 PRO HD3 1 1 12 8378 1 1 21 PRO HG2 H 6.824 5.708 2.170 1.00 . A A . 18 PRO HG2 1 1 12 8379 1 1 21 PRO HG3 H 6.101 6.311 3.673 1.00 . A A . 18 PRO HG3 1 1 12 8380 1 1 21 PRO N N 4.250 5.980 1.045 1.00 . A A . 18 PRO N 1 1 12 8381 1 1 21 PRO O O 5.949 8.278 -1.148 1.00 . A A . 18 PRO O 1 1 12 8382 1 1 22 ARG C C 6.140 5.486 -3.282 1.00 . A A . 19 ARG C 1 1 12 8383 1 1 22 ARG CA C 6.992 5.889 -2.089 1.00 . A A . 19 ARG CA 1 1 12 8384 1 1 22 ARG CB C 8.068 4.822 -1.870 1.00 . A A . 19 ARG CB 1 1 12 8385 1 1 22 ARG CD C 10.338 4.214 -0.986 1.00 . A A . 19 ARG CD 1 1 12 8386 1 1 22 ARG CG C 9.304 5.320 -1.147 1.00 . A A . 19 ARG CG 1 1 12 8387 1 1 22 ARG CZ C 11.673 2.857 -2.571 1.00 . A A . 19 ARG CZ 1 1 12 8388 1 1 22 ARG H H 5.951 5.270 -0.349 1.00 . A A . 19 ARG H 1 1 12 8389 1 1 22 ARG HA H 7.471 6.832 -2.303 1.00 . A A . 19 ARG HA 1 1 12 8390 1 1 22 ARG HB2 H 7.643 4.014 -1.293 1.00 . A A . 19 ARG HB2 1 1 12 8391 1 1 22 ARG HB3 H 8.371 4.440 -2.832 1.00 . A A . 19 ARG HB3 1 1 12 8392 1 1 22 ARG HD2 H 11.283 4.665 -0.732 1.00 . A A . 19 ARG HD2 1 1 12 8393 1 1 22 ARG HD3 H 10.025 3.565 -0.180 1.00 . A A . 19 ARG HD3 1 1 12 8394 1 1 22 ARG HE H 9.713 3.233 -2.747 1.00 . A A . 19 ARG HE 1 1 12 8395 1 1 22 ARG HG2 H 9.740 6.130 -1.711 1.00 . A A . 19 ARG HG2 1 1 12 8396 1 1 22 ARG HG3 H 9.015 5.672 -0.166 1.00 . A A . 19 ARG HG3 1 1 12 8397 1 1 22 ARG HH11 H 12.773 3.762 -1.124 1.00 . A A . 19 ARG HH11 1 1 12 8398 1 1 22 ARG HH12 H 13.662 2.722 -2.189 1.00 . A A . 19 ARG HH12 1 1 12 8399 1 1 22 ARG HH21 H 10.881 1.816 -4.129 1.00 . A A . 19 ARG HH21 1 1 12 8400 1 1 22 ARG HH22 H 12.591 1.619 -3.891 1.00 . A A . 19 ARG HH22 1 1 12 8401 1 1 22 ARG N N 6.177 6.057 -0.892 1.00 . A A . 19 ARG N 1 1 12 8402 1 1 22 ARG NE N 10.513 3.409 -2.201 1.00 . A A . 19 ARG NE 1 1 12 8403 1 1 22 ARG NH1 N 12.790 3.133 -1.905 1.00 . A A . 19 ARG NH1 1 1 12 8404 1 1 22 ARG NH2 N 11.718 2.032 -3.612 1.00 . A A . 19 ARG NH2 1 1 12 8405 1 1 22 ARG O O 6.129 6.155 -4.314 1.00 . A A . 19 ARG O 1 1 12 8406 1 1 23 CYS C C 3.363 4.495 -4.488 1.00 . A A . 20 CYS C 1 1 12 8407 1 1 23 CYS CA C 4.690 3.791 -4.235 1.00 . A A . 20 CYS CA 1 1 12 8408 1 1 23 CYS CB C 4.441 2.307 -3.952 1.00 . A A . 20 CYS CB 1 1 12 8409 1 1 23 CYS H H 5.353 3.985 -2.238 1.00 . A A . 20 CYS H 1 1 12 8410 1 1 23 CYS HA H 5.303 3.883 -5.115 1.00 . A A . 20 CYS HA 1 1 12 8411 1 1 23 CYS HB2 H 3.770 2.221 -3.112 1.00 . A A . 20 CYS HB2 1 1 12 8412 1 1 23 CYS HB3 H 3.979 1.855 -4.817 1.00 . A A . 20 CYS HB3 1 1 12 8413 1 1 23 CYS N N 5.412 4.392 -3.124 1.00 . A A . 20 CYS N 1 1 12 8414 1 1 23 CYS O O 2.812 4.437 -5.588 1.00 . A A . 20 CYS O 1 1 12 8415 1 1 23 CYS SG S 5.929 1.356 -3.558 1.00 . A A . 20 CYS SG 1 1 12 8416 1 1 24 LEU C C 0.449 4.753 -3.634 1.00 . A A . 21 LEU C 1 1 12 8417 1 1 24 LEU CA C 1.545 5.791 -3.449 1.00 . A A . 21 LEU CA 1 1 12 8418 1 1 24 LEU CB C 1.424 6.878 -4.522 1.00 . A A . 21 LEU CB 1 1 12 8419 1 1 24 LEU CD1 C 1.948 9.237 -5.146 1.00 . A A . 21 LEU CD1 1 1 12 8420 1 1 24 LEU CD2 C 2.918 8.279 -3.054 1.00 . A A . 21 LEU CD2 1 1 12 8421 1 1 24 LEU CG C 2.483 7.983 -4.480 1.00 . A A . 21 LEU CG 1 1 12 8422 1 1 24 LEU H H 3.415 5.244 -2.639 1.00 . A A . 21 LEU H 1 1 12 8423 1 1 24 LEU HA H 1.409 6.249 -2.479 1.00 . A A . 21 LEU HA 1 1 12 8424 1 1 24 LEU HB2 H 1.475 6.401 -5.487 1.00 . A A . 21 LEU HB2 1 1 12 8425 1 1 24 LEU HB3 H 0.452 7.341 -4.423 1.00 . A A . 21 LEU HB3 1 1 12 8426 1 1 24 LEU HD11 H 2.698 10.013 -5.107 1.00 . A A . 21 LEU HD11 1 1 12 8427 1 1 24 LEU HD12 H 1.061 9.566 -4.625 1.00 . A A . 21 LEU HD12 1 1 12 8428 1 1 24 LEU HD13 H 1.703 9.022 -6.175 1.00 . A A . 21 LEU HD13 1 1 12 8429 1 1 24 LEU HD21 H 3.622 9.098 -3.055 1.00 . A A . 21 LEU HD21 1 1 12 8430 1 1 24 LEU HD22 H 3.390 7.400 -2.635 1.00 . A A . 21 LEU HD22 1 1 12 8431 1 1 24 LEU HD23 H 2.056 8.544 -2.461 1.00 . A A . 21 LEU HD23 1 1 12 8432 1 1 24 LEU HG H 3.352 7.658 -5.036 1.00 . A A . 21 LEU HG 1 1 12 8433 1 1 24 LEU N N 2.866 5.159 -3.447 1.00 . A A . 21 LEU N 1 1 12 8434 1 1 24 LEU O O -0.693 5.087 -3.948 1.00 . A A . 21 LEU O 1 1 12 8435 1 1 25 VAL C C -0.991 2.388 -2.267 1.00 . A A . 22 VAL C 1 1 12 8436 1 1 25 VAL CA C -0.144 2.414 -3.526 1.00 . A A . 22 VAL CA 1 1 12 8437 1 1 25 VAL CB C 0.540 1.042 -3.758 1.00 . A A . 22 VAL CB 1 1 12 8438 1 1 25 VAL CG1 C 1.405 0.640 -2.575 1.00 . A A . 22 VAL CG1 1 1 12 8439 1 1 25 VAL CG2 C -0.494 -0.034 -4.053 1.00 . A A . 22 VAL CG2 1 1 12 8440 1 1 25 VAL H H 1.725 3.290 -3.207 1.00 . A A . 22 VAL H 1 1 12 8441 1 1 25 VAL HA H -0.789 2.618 -4.371 1.00 . A A . 22 VAL HA 1 1 12 8442 1 1 25 VAL HB H 1.182 1.132 -4.622 1.00 . A A . 22 VAL HB 1 1 12 8443 1 1 25 VAL HG11 H 2.144 1.404 -2.395 1.00 . A A . 22 VAL HG11 1 1 12 8444 1 1 25 VAL HG12 H 1.898 -0.296 -2.792 1.00 . A A . 22 VAL HG12 1 1 12 8445 1 1 25 VAL HG13 H 0.785 0.526 -1.700 1.00 . A A . 22 VAL HG13 1 1 12 8446 1 1 25 VAL HG21 H 0.004 -0.982 -4.198 1.00 . A A . 22 VAL HG21 1 1 12 8447 1 1 25 VAL HG22 H -1.038 0.227 -4.948 1.00 . A A . 22 VAL HG22 1 1 12 8448 1 1 25 VAL HG23 H -1.181 -0.110 -3.223 1.00 . A A . 22 VAL HG23 1 1 12 8449 1 1 25 VAL N N 0.806 3.492 -3.431 1.00 . A A . 22 VAL N 1 1 12 8450 1 1 25 VAL O O -0.479 2.413 -1.142 1.00 . A A . 22 VAL O 1 1 12 8451 1 1 26 GLN C C -3.529 1.024 -0.908 1.00 . A A . 23 GLN C 1 1 12 8452 1 1 26 GLN CA C -3.228 2.436 -1.382 1.00 . A A . 23 GLN CA 1 1 12 8453 1 1 26 GLN CB C -4.484 3.168 -1.843 1.00 . A A . 23 GLN CB 1 1 12 8454 1 1 26 GLN CD C -5.360 5.251 -3.010 1.00 . A A . 23 GLN CD 1 1 12 8455 1 1 26 GLN CG C -4.175 4.564 -2.364 1.00 . A A . 23 GLN CG 1 1 12 8456 1 1 26 GLN H H -2.612 2.379 -3.395 1.00 . A A . 23 GLN H 1 1 12 8457 1 1 26 GLN HA H -2.775 2.985 -0.567 1.00 . A A . 23 GLN HA 1 1 12 8458 1 1 26 GLN HB2 H -4.956 2.600 -2.632 1.00 . A A . 23 GLN HB2 1 1 12 8459 1 1 26 GLN HB3 H -5.166 3.256 -1.011 1.00 . A A . 23 GLN HB3 1 1 12 8460 1 1 26 GLN HE21 H -6.612 4.318 -1.797 1.00 . A A . 23 GLN HE21 1 1 12 8461 1 1 26 GLN HE22 H -7.330 5.410 -2.926 1.00 . A A . 23 GLN HE22 1 1 12 8462 1 1 26 GLN HG2 H -3.841 5.171 -1.537 1.00 . A A . 23 GLN HG2 1 1 12 8463 1 1 26 GLN HG3 H -3.381 4.490 -3.094 1.00 . A A . 23 GLN HG3 1 1 12 8464 1 1 26 GLN N N -2.281 2.397 -2.472 1.00 . A A . 23 GLN N 1 1 12 8465 1 1 26 GLN NE2 N -6.551 4.960 -2.533 1.00 . A A . 23 GLN NE2 1 1 12 8466 1 1 26 GLN O O -4.344 0.310 -1.492 1.00 . A A . 23 GLN O 1 1 12 8467 1 1 26 GLN OE1 O -5.197 6.049 -3.931 1.00 . A A . 23 GLN OE1 1 1 12 8468 1 1 27 THR C C -4.046 -0.763 1.741 1.00 . A A . 24 THR C 1 1 12 8469 1 1 27 THR CA C -2.952 -0.713 0.684 1.00 . A A . 24 THR CA 1 1 12 8470 1 1 27 THR CB C -1.617 -1.160 1.300 1.00 . A A . 24 THR CB 1 1 12 8471 1 1 27 THR CG2 C -0.619 -1.529 0.219 1.00 . A A . 24 THR CG2 1 1 12 8472 1 1 27 THR H H -2.201 1.249 0.557 1.00 . A A . 24 THR H 1 1 12 8473 1 1 27 THR HA H -3.203 -1.389 -0.121 1.00 . A A . 24 THR HA 1 1 12 8474 1 1 27 THR HB H -1.795 -2.027 1.921 1.00 . A A . 24 THR HB 1 1 12 8475 1 1 27 THR HG1 H -0.314 -0.435 2.596 1.00 . A A . 24 THR HG1 1 1 12 8476 1 1 27 THR HG21 H -1.023 -2.329 -0.382 1.00 . A A . 24 THR HG21 1 1 12 8477 1 1 27 THR HG22 H 0.303 -1.856 0.678 1.00 . A A . 24 THR HG22 1 1 12 8478 1 1 27 THR HG23 H -0.426 -0.669 -0.403 1.00 . A A . 24 THR HG23 1 1 12 8479 1 1 27 THR N N -2.826 0.620 0.135 1.00 . A A . 24 THR N 1 1 12 8480 1 1 27 THR O O -4.437 0.259 2.295 1.00 . A A . 24 THR O 1 1 12 8481 1 1 27 THR OG1 O -1.083 -0.108 2.105 1.00 . A A . 24 THR OG1 1 1 12 8482 1 1 28 CYS C C -5.051 -2.318 4.368 1.00 . A A . 25 CYS C 1 1 12 8483 1 1 28 CYS CA C -5.619 -2.142 2.969 1.00 . A A . 25 CYS CA 1 1 12 8484 1 1 28 CYS CB C -6.471 -3.360 2.593 1.00 . A A . 25 CYS CB 1 1 12 8485 1 1 28 CYS H H -4.184 -2.736 1.539 1.00 . A A . 25 CYS H 1 1 12 8486 1 1 28 CYS HA H -6.239 -1.258 2.951 1.00 . A A . 25 CYS HA 1 1 12 8487 1 1 28 CYS HB2 H -7.340 -3.397 3.229 1.00 . A A . 25 CYS HB2 1 1 12 8488 1 1 28 CYS HB3 H -6.790 -3.261 1.570 1.00 . A A . 25 CYS HB3 1 1 12 8489 1 1 28 CYS N N -4.544 -1.959 2.007 1.00 . A A . 25 CYS N 1 1 12 8490 1 1 28 CYS O O -5.714 -2.025 5.362 1.00 . A A . 25 CYS O 1 1 12 8491 1 1 28 CYS SG S -5.609 -4.943 2.750 1.00 . A A . 25 CYS SG 1 1 12 8492 1 1 29 SER C C -1.658 -3.110 5.546 1.00 . A A . 26 SER C 1 1 12 8493 1 1 29 SER CA C -3.173 -3.067 5.713 1.00 . A A . 26 SER CA 1 1 12 8494 1 1 29 SER CB C -3.678 -4.394 6.297 1.00 . A A . 26 SER CB 1 1 12 8495 1 1 29 SER H H -3.309 -2.947 3.612 1.00 . A A . 26 SER H 1 1 12 8496 1 1 29 SER HA H -3.427 -2.264 6.391 1.00 . A A . 26 SER HA 1 1 12 8497 1 1 29 SER HB2 H -3.478 -5.190 5.596 1.00 . A A . 26 SER HB2 1 1 12 8498 1 1 29 SER HB3 H -3.163 -4.595 7.224 1.00 . A A . 26 SER HB3 1 1 12 8499 1 1 29 SER HG H -5.436 -3.515 6.211 1.00 . A A . 26 SER HG 1 1 12 8500 1 1 29 SER N N -3.813 -2.792 4.439 1.00 . A A . 26 SER N 1 1 12 8501 1 1 29 SER O O -1.164 -3.149 4.414 1.00 . A A . 26 SER O 1 1 12 8502 1 1 29 SER OG O -5.074 -4.349 6.551 1.00 . A A . 26 SER OG 1 1 12 8503 1 1 30 LEU C C 1.032 -4.381 5.889 1.00 . A A . 27 LEU C 1 1 12 8504 1 1 30 LEU CA C 0.527 -3.152 6.638 1.00 . A A . 27 LEU CA 1 1 12 8505 1 1 30 LEU CB C 1.076 -3.152 8.066 1.00 . A A . 27 LEU CB 1 1 12 8506 1 1 30 LEU CD1 C 1.207 -2.061 10.319 1.00 . A A . 27 LEU CD1 1 1 12 8507 1 1 30 LEU CD2 C 1.692 -0.731 8.258 1.00 . A A . 27 LEU CD2 1 1 12 8508 1 1 30 LEU CG C 0.857 -1.857 8.852 1.00 . A A . 27 LEU CG 1 1 12 8509 1 1 30 LEU H H -1.395 -3.078 7.527 1.00 . A A . 27 LEU H 1 1 12 8510 1 1 30 LEU HA H 0.876 -2.266 6.128 1.00 . A A . 27 LEU HA 1 1 12 8511 1 1 30 LEU HB2 H 0.608 -3.961 8.608 1.00 . A A . 27 LEU HB2 1 1 12 8512 1 1 30 LEU HB3 H 2.138 -3.341 8.019 1.00 . A A . 27 LEU HB3 1 1 12 8513 1 1 30 LEU HD11 H 2.241 -2.360 10.406 1.00 . A A . 27 LEU HD11 1 1 12 8514 1 1 30 LEU HD12 H 0.574 -2.831 10.736 1.00 . A A . 27 LEU HD12 1 1 12 8515 1 1 30 LEU HD13 H 1.053 -1.139 10.857 1.00 . A A . 27 LEU HD13 1 1 12 8516 1 1 30 LEU HD21 H 1.389 -0.560 7.235 1.00 . A A . 27 LEU HD21 1 1 12 8517 1 1 30 LEU HD22 H 2.736 -1.004 8.283 1.00 . A A . 27 LEU HD22 1 1 12 8518 1 1 30 LEU HD23 H 1.542 0.171 8.833 1.00 . A A . 27 LEU HD23 1 1 12 8519 1 1 30 LEU HG H -0.183 -1.575 8.790 1.00 . A A . 27 LEU HG 1 1 12 8520 1 1 30 LEU N N -0.935 -3.109 6.660 1.00 . A A . 27 LEU N 1 1 12 8521 1 1 30 LEU O O 2.036 -4.320 5.183 1.00 . A A . 27 LEU O 1 1 12 8522 1 1 31 GLU C C 0.762 -6.563 3.851 1.00 . A A . 28 GLU C 1 1 12 8523 1 1 31 GLU CA C 0.663 -6.739 5.369 1.00 . A A . 28 GLU CA 1 1 12 8524 1 1 31 GLU CB C -0.375 -7.806 5.709 1.00 . A A . 28 GLU CB 1 1 12 8525 1 1 31 GLU CD C -1.024 -10.235 5.653 1.00 . A A . 28 GLU CD 1 1 12 8526 1 1 31 GLU CG C -0.002 -9.201 5.242 1.00 . A A . 28 GLU CG 1 1 12 8527 1 1 31 GLU H H -0.479 -5.465 6.614 1.00 . A A . 28 GLU H 1 1 12 8528 1 1 31 GLU HA H 1.624 -7.053 5.748 1.00 . A A . 28 GLU HA 1 1 12 8529 1 1 31 GLU HB2 H -0.506 -7.833 6.781 1.00 . A A . 28 GLU HB2 1 1 12 8530 1 1 31 GLU HB3 H -1.313 -7.535 5.249 1.00 . A A . 28 GLU HB3 1 1 12 8531 1 1 31 GLU HG2 H 0.076 -9.198 4.165 1.00 . A A . 28 GLU HG2 1 1 12 8532 1 1 31 GLU HG3 H 0.954 -9.468 5.671 1.00 . A A . 28 GLU HG3 1 1 12 8533 1 1 31 GLU N N 0.309 -5.487 6.031 1.00 . A A . 28 GLU N 1 1 12 8534 1 1 31 GLU O O 1.547 -7.239 3.186 1.00 . A A . 28 GLU O 1 1 12 8535 1 1 31 GLU OE1 O -0.981 -10.685 6.820 1.00 . A A . 28 GLU OE1 1 1 12 8536 1 1 31 GLU OE2 O -1.881 -10.596 4.818 1.00 . A A . 28 GLU OE2 1 1 12 8537 1 1 32 CYS C C 1.047 -4.267 1.587 1.00 . A A . 29 CYS C 1 1 12 8538 1 1 32 CYS CA C 0.019 -5.356 1.887 1.00 . A A . 29 CYS CA 1 1 12 8539 1 1 32 CYS CB C -1.361 -4.949 1.383 1.00 . A A . 29 CYS CB 1 1 12 8540 1 1 32 CYS H H -0.650 -5.150 3.876 1.00 . A A . 29 CYS H 1 1 12 8541 1 1 32 CYS HA H 0.319 -6.260 1.381 1.00 . A A . 29 CYS HA 1 1 12 8542 1 1 32 CYS HB2 H -1.819 -4.290 2.106 1.00 . A A . 29 CYS HB2 1 1 12 8543 1 1 32 CYS HB3 H -1.257 -4.426 0.448 1.00 . A A . 29 CYS HB3 1 1 12 8544 1 1 32 CYS N N -0.027 -5.646 3.307 1.00 . A A . 29 CYS N 1 1 12 8545 1 1 32 CYS O O 1.591 -4.201 0.486 1.00 . A A . 29 CYS O 1 1 12 8546 1 1 32 CYS SG S -2.488 -6.338 1.121 1.00 . A A . 29 CYS SG 1 1 12 8547 1 1 33 SER C C 3.717 -2.999 2.373 1.00 . A A . 30 SER C 1 1 12 8548 1 1 33 SER CA C 2.322 -2.379 2.428 1.00 . A A . 30 SER CA 1 1 12 8549 1 1 33 SER CB C 2.227 -1.392 3.591 1.00 . A A . 30 SER CB 1 1 12 8550 1 1 33 SER H H 0.814 -3.486 3.413 1.00 . A A . 30 SER H 1 1 12 8551 1 1 33 SER HA H 2.136 -1.856 1.503 1.00 . A A . 30 SER HA 1 1 12 8552 1 1 33 SER HB2 H 2.512 -1.889 4.507 1.00 . A A . 30 SER HB2 1 1 12 8553 1 1 33 SER HB3 H 2.893 -0.562 3.409 1.00 . A A . 30 SER HB3 1 1 12 8554 1 1 33 SER HG H 0.881 -0.280 4.476 1.00 . A A . 30 SER HG 1 1 12 8555 1 1 33 SER N N 1.311 -3.419 2.570 1.00 . A A . 30 SER N 1 1 12 8556 1 1 33 SER O O 4.604 -2.503 1.684 1.00 . A A . 30 SER O 1 1 12 8557 1 1 33 SER OG O 0.908 -0.894 3.734 1.00 . A A . 30 SER OG 1 1 12 8558 1 1 34 LYS C C 5.227 -5.794 1.940 1.00 . A A . 31 LYS C 1 1 12 8559 1 1 34 LYS CA C 5.169 -4.806 3.101 1.00 . A A . 31 LYS CA 1 1 12 8560 1 1 34 LYS CB C 5.367 -5.543 4.428 1.00 . A A . 31 LYS CB 1 1 12 8561 1 1 34 LYS CD C 4.573 -7.342 6.004 1.00 . A A . 31 LYS CD 1 1 12 8562 1 1 34 LYS CE C 5.797 -8.244 5.925 1.00 . A A . 31 LYS CE 1 1 12 8563 1 1 34 LYS CG C 4.317 -6.607 4.696 1.00 . A A . 31 LYS CG 1 1 12 8564 1 1 34 LYS H H 3.167 -4.415 3.673 1.00 . A A . 31 LYS H 1 1 12 8565 1 1 34 LYS HA H 5.957 -4.080 2.980 1.00 . A A . 31 LYS HA 1 1 12 8566 1 1 34 LYS HB2 H 6.336 -6.015 4.423 1.00 . A A . 31 LYS HB2 1 1 12 8567 1 1 34 LYS HB3 H 5.330 -4.822 5.231 1.00 . A A . 31 LYS HB3 1 1 12 8568 1 1 34 LYS HD2 H 4.727 -6.615 6.787 1.00 . A A . 31 LYS HD2 1 1 12 8569 1 1 34 LYS HD3 H 3.709 -7.946 6.237 1.00 . A A . 31 LYS HD3 1 1 12 8570 1 1 34 LYS HE2 H 6.650 -7.650 5.633 1.00 . A A . 31 LYS HE2 1 1 12 8571 1 1 34 LYS HE3 H 5.975 -8.668 6.902 1.00 . A A . 31 LYS HE3 1 1 12 8572 1 1 34 LYS HG2 H 3.347 -6.134 4.746 1.00 . A A . 31 LYS HG2 1 1 12 8573 1 1 34 LYS HG3 H 4.328 -7.318 3.885 1.00 . A A . 31 LYS HG3 1 1 12 8574 1 1 34 LYS HZ1 H 4.762 -9.894 5.171 1.00 . A A . 31 LYS HZ1 1 1 12 8575 1 1 34 LYS HZ2 H 6.436 -9.986 4.967 1.00 . A A . 31 LYS HZ2 1 1 12 8576 1 1 34 LYS HZ3 H 5.520 -8.963 3.982 1.00 . A A . 31 LYS HZ3 1 1 12 8577 1 1 34 LYS N N 3.900 -4.090 3.103 1.00 . A A . 31 LYS N 1 1 12 8578 1 1 34 LYS NZ N 5.617 -9.347 4.943 1.00 . A A . 31 LYS NZ 1 1 12 8579 1 1 34 LYS O O 6.295 -6.296 1.589 1.00 . A A . 31 LYS O 1 1 12 8580 1 1 35 LYS C C 4.729 -6.549 -0.973 1.00 . A A . 32 LYS C 1 1 12 8581 1 1 35 LYS CA C 3.967 -7.025 0.260 1.00 . A A . 32 LYS CA 1 1 12 8582 1 1 35 LYS CB C 2.497 -7.249 -0.099 1.00 . A A . 32 LYS CB 1 1 12 8583 1 1 35 LYS CD C 2.186 -9.682 0.410 1.00 . A A . 32 LYS CD 1 1 12 8584 1 1 35 LYS CE C 1.837 -11.053 -0.139 1.00 . A A . 32 LYS CE 1 1 12 8585 1 1 35 LYS CG C 2.200 -8.621 -0.680 1.00 . A A . 32 LYS CG 1 1 12 8586 1 1 35 LYS H H 3.274 -5.565 1.620 1.00 . A A . 32 LYS H 1 1 12 8587 1 1 35 LYS HA H 4.394 -7.954 0.605 1.00 . A A . 32 LYS HA 1 1 12 8588 1 1 35 LYS HB2 H 1.902 -7.128 0.792 1.00 . A A . 32 LYS HB2 1 1 12 8589 1 1 35 LYS HB3 H 2.198 -6.504 -0.823 1.00 . A A . 32 LYS HB3 1 1 12 8590 1 1 35 LYS HD2 H 3.163 -9.728 0.866 1.00 . A A . 32 LYS HD2 1 1 12 8591 1 1 35 LYS HD3 H 1.454 -9.406 1.154 1.00 . A A . 32 LYS HD3 1 1 12 8592 1 1 35 LYS HE2 H 1.728 -11.739 0.687 1.00 . A A . 32 LYS HE2 1 1 12 8593 1 1 35 LYS HE3 H 0.901 -10.984 -0.675 1.00 . A A . 32 LYS HE3 1 1 12 8594 1 1 35 LYS HG2 H 1.233 -8.598 -1.159 1.00 . A A . 32 LYS HG2 1 1 12 8595 1 1 35 LYS HG3 H 2.962 -8.869 -1.404 1.00 . A A . 32 LYS HG3 1 1 12 8596 1 1 35 LYS HZ1 H 2.621 -12.513 -1.401 1.00 . A A . 32 LYS HZ1 1 1 12 8597 1 1 35 LYS HZ2 H 3.794 -11.634 -0.561 1.00 . A A . 32 LYS HZ2 1 1 12 8598 1 1 35 LYS HZ3 H 2.992 -10.932 -1.870 1.00 . A A . 32 LYS HZ3 1 1 12 8599 1 1 35 LYS N N 4.076 -6.049 1.335 1.00 . A A . 32 LYS N 1 1 12 8600 1 1 35 LYS NZ N 2.883 -11.568 -1.056 1.00 . A A . 32 LYS NZ 1 1 12 8601 1 1 35 LYS O O 5.367 -7.340 -1.666 1.00 . A A . 32 LYS O 1 1 12 8602 1 1 36 HIS C C 6.807 -4.418 -2.145 1.00 . A A . 33 HIS C 1 1 12 8603 1 1 36 HIS CA C 5.324 -4.681 -2.408 1.00 . A A . 33 HIS CA 1 1 12 8604 1 1 36 HIS CB C 4.618 -3.384 -2.858 1.00 . A A . 33 HIS CB 1 1 12 8605 1 1 36 HIS CD2 C 5.850 -1.630 -1.397 1.00 . A A . 33 HIS CD2 1 1 12 8606 1 1 36 HIS CE1 C 4.168 -0.521 -0.639 1.00 . A A . 33 HIS CE1 1 1 12 8607 1 1 36 HIS CG C 4.745 -2.220 -1.907 1.00 . A A . 33 HIS CG 1 1 12 8608 1 1 36 HIS H H 4.175 -4.658 -0.625 1.00 . A A . 33 HIS H 1 1 12 8609 1 1 36 HIS HA H 5.245 -5.409 -3.202 1.00 . A A . 33 HIS HA 1 1 12 8610 1 1 36 HIS HB2 H 5.032 -3.074 -3.805 1.00 . A A . 33 HIS HB2 1 1 12 8611 1 1 36 HIS HB3 H 3.566 -3.590 -2.988 1.00 . A A . 33 HIS HB3 1 1 12 8612 1 1 36 HIS HD1 H 2.730 -1.697 -1.576 1.00 . A A . 33 HIS HD1 1 1 12 8613 1 1 36 HIS HD2 H 6.868 -1.946 -1.574 1.00 . A A . 33 HIS HD2 1 1 12 8614 1 1 36 HIS HE1 H 3.560 0.168 -0.077 1.00 . A A . 33 HIS HE1 1 1 12 8615 1 1 36 HIS N N 4.673 -5.247 -1.233 1.00 . A A . 33 HIS N 1 1 12 8616 1 1 36 HIS ND1 N 3.679 -1.509 -1.409 1.00 . A A . 33 HIS ND1 1 1 12 8617 1 1 36 HIS NE2 N 5.489 -0.545 -0.606 1.00 . A A . 33 HIS NE2 1 1 12 8618 1 1 36 HIS O O 7.581 -4.186 -3.071 1.00 . A A . 33 HIS O 1 1 12 8619 1 1 37 LYS C C 9.556 -5.176 -0.939 1.00 . A A . 34 LYS C 1 1 12 8620 1 1 37 LYS CA C 8.563 -4.111 -0.498 1.00 . A A . 34 LYS CA 1 1 12 8621 1 1 37 LYS CB C 8.655 -3.888 1.013 1.00 . A A . 34 LYS CB 1 1 12 8622 1 1 37 LYS CD C 7.982 -2.484 2.993 1.00 . A A . 34 LYS CD 1 1 12 8623 1 1 37 LYS CE C 7.116 -1.330 3.474 1.00 . A A . 34 LYS CE 1 1 12 8624 1 1 37 LYS CG C 7.801 -2.728 1.503 1.00 . A A . 34 LYS CG 1 1 12 8625 1 1 37 LYS H H 6.577 -4.781 -0.192 1.00 . A A . 34 LYS H 1 1 12 8626 1 1 37 LYS HA H 8.808 -3.187 -1.000 1.00 . A A . 34 LYS HA 1 1 12 8627 1 1 37 LYS HB2 H 8.333 -4.786 1.520 1.00 . A A . 34 LYS HB2 1 1 12 8628 1 1 37 LYS HB3 H 9.683 -3.686 1.273 1.00 . A A . 34 LYS HB3 1 1 12 8629 1 1 37 LYS HD2 H 7.711 -3.378 3.534 1.00 . A A . 34 LYS HD2 1 1 12 8630 1 1 37 LYS HD3 H 9.017 -2.247 3.183 1.00 . A A . 34 LYS HD3 1 1 12 8631 1 1 37 LYS HE2 H 7.420 -0.433 2.958 1.00 . A A . 34 LYS HE2 1 1 12 8632 1 1 37 LYS HE3 H 6.081 -1.544 3.239 1.00 . A A . 34 LYS HE3 1 1 12 8633 1 1 37 LYS HG2 H 8.087 -1.836 0.968 1.00 . A A . 34 LYS HG2 1 1 12 8634 1 1 37 LYS HG3 H 6.762 -2.951 1.307 1.00 . A A . 34 LYS HG3 1 1 12 8635 1 1 37 LYS HZ1 H 6.611 -0.345 5.245 1.00 . A A . 34 LYS HZ1 1 1 12 8636 1 1 37 LYS HZ2 H 8.223 -0.843 5.178 1.00 . A A . 34 LYS HZ2 1 1 12 8637 1 1 37 LYS HZ3 H 7.000 -1.974 5.457 1.00 . A A . 34 LYS HZ3 1 1 12 8638 1 1 37 LYS N N 7.205 -4.474 -0.880 1.00 . A A . 34 LYS N 1 1 12 8639 1 1 37 LYS NZ N 7.247 -1.108 4.939 1.00 . A A . 34 LYS NZ 1 1 12 8640 1 1 37 LYS O O 10.725 -4.887 -1.184 1.00 . A A . 34 LYS O 1 1 12 8641 1 1 38 THR C C 10.128 -7.584 -2.960 1.00 . A A . 35 THR C 1 1 12 8642 1 1 38 THR CA C 9.906 -7.526 -1.445 1.00 . A A . 35 THR CA 1 1 12 8643 1 1 38 THR CB C 9.277 -8.848 -0.952 1.00 . A A . 35 THR CB 1 1 12 8644 1 1 38 THR CG2 C 8.011 -9.177 -1.730 1.00 . A A . 35 THR CG2 1 1 12 8645 1 1 38 THR H H 8.110 -6.547 -0.928 1.00 . A A . 35 THR H 1 1 12 8646 1 1 38 THR HA H 10.861 -7.401 -0.957 1.00 . A A . 35 THR HA 1 1 12 8647 1 1 38 THR HB H 9.013 -8.731 0.088 1.00 . A A . 35 THR HB 1 1 12 8648 1 1 38 THR HG1 H 11.029 -9.604 -1.471 1.00 . A A . 35 THR HG1 1 1 12 8649 1 1 38 THR HG21 H 7.588 -10.098 -1.358 1.00 . A A . 35 THR HG21 1 1 12 8650 1 1 38 THR HG22 H 8.252 -9.287 -2.777 1.00 . A A . 35 THR HG22 1 1 12 8651 1 1 38 THR HG23 H 7.295 -8.376 -1.608 1.00 . A A . 35 THR HG23 1 1 12 8652 1 1 38 THR N N 9.066 -6.397 -1.080 1.00 . A A . 35 THR N 1 1 12 8653 1 1 38 THR O O 10.822 -8.469 -3.461 1.00 . A A . 35 THR O 1 1 12 8654 1 1 38 THR OG1 O 10.208 -9.932 -1.082 1.00 . A A . 35 THR OG1 1 1 12 8655 1 1 39 ARG C C 10.080 -5.209 -5.625 1.00 . A A . 36 ARG C 1 1 12 8656 1 1 39 ARG CA C 9.675 -6.599 -5.135 1.00 . A A . 36 ARG CA 1 1 12 8657 1 1 39 ARG CB C 8.366 -7.034 -5.804 1.00 . A A . 36 ARG CB 1 1 12 8658 1 1 39 ARG CD C 5.878 -6.721 -6.021 1.00 . A A . 36 ARG CD 1 1 12 8659 1 1 39 ARG CG C 7.140 -6.300 -5.287 1.00 . A A . 36 ARG CG 1 1 12 8660 1 1 39 ARG CZ C 4.472 -8.745 -6.128 1.00 . A A . 36 ARG CZ 1 1 12 8661 1 1 39 ARG H H 8.996 -5.961 -3.232 1.00 . A A . 36 ARG H 1 1 12 8662 1 1 39 ARG HA H 10.451 -7.298 -5.409 1.00 . A A . 36 ARG HA 1 1 12 8663 1 1 39 ARG HB2 H 8.442 -6.856 -6.865 1.00 . A A . 36 ARG HB2 1 1 12 8664 1 1 39 ARG HB3 H 8.223 -8.090 -5.635 1.00 . A A . 36 ARG HB3 1 1 12 8665 1 1 39 ARG HD2 H 5.035 -6.218 -5.575 1.00 . A A . 36 ARG HD2 1 1 12 8666 1 1 39 ARG HD3 H 5.965 -6.427 -7.056 1.00 . A A . 36 ARG HD3 1 1 12 8667 1 1 39 ARG HE H 6.443 -8.734 -5.795 1.00 . A A . 36 ARG HE 1 1 12 8668 1 1 39 ARG HG2 H 7.022 -6.516 -4.235 1.00 . A A . 36 ARG HG2 1 1 12 8669 1 1 39 ARG HG3 H 7.288 -5.237 -5.421 1.00 . A A . 36 ARG HG3 1 1 12 8670 1 1 39 ARG HH11 H 3.442 -7.009 -6.330 1.00 . A A . 36 ARG HH11 1 1 12 8671 1 1 39 ARG HH12 H 2.494 -8.454 -6.464 1.00 . A A . 36 ARG HH12 1 1 12 8672 1 1 39 ARG HH21 H 5.203 -10.627 -5.956 1.00 . A A . 36 ARG HH21 1 1 12 8673 1 1 39 ARG HH22 H 3.493 -10.516 -6.232 1.00 . A A . 36 ARG HH22 1 1 12 8674 1 1 39 ARG N N 9.538 -6.640 -3.684 1.00 . A A . 36 ARG N 1 1 12 8675 1 1 39 ARG NE N 5.657 -8.163 -5.955 1.00 . A A . 36 ARG NE 1 1 12 8676 1 1 39 ARG NH1 N 3.381 -8.010 -6.318 1.00 . A A . 36 ARG NH1 1 1 12 8677 1 1 39 ARG NH2 N 4.380 -10.069 -6.102 1.00 . A A . 36 ARG NH2 1 1 12 8678 1 1 39 ARG O O 10.521 -5.050 -6.762 1.00 . A A . 36 ARG O 1 1 12 8679 1 1 40 ASP C C 11.481 -2.308 -4.455 1.00 . A A . 37 ASP C 1 1 12 8680 1 1 40 ASP CA C 10.236 -2.831 -5.164 1.00 . A A . 37 ASP CA 1 1 12 8681 1 1 40 ASP CB C 9.037 -1.920 -4.860 1.00 . A A . 37 ASP CB 1 1 12 8682 1 1 40 ASP CG C 9.209 -0.505 -5.388 1.00 . A A . 37 ASP CG 1 1 12 8683 1 1 40 ASP H H 9.612 -4.387 -3.866 1.00 . A A . 37 ASP H 1 1 12 8684 1 1 40 ASP HA H 10.418 -2.826 -6.226 1.00 . A A . 37 ASP HA 1 1 12 8685 1 1 40 ASP HB2 H 8.153 -2.344 -5.312 1.00 . A A . 37 ASP HB2 1 1 12 8686 1 1 40 ASP HB3 H 8.896 -1.870 -3.790 1.00 . A A . 37 ASP HB3 1 1 12 8687 1 1 40 ASP N N 9.937 -4.207 -4.770 1.00 . A A . 37 ASP N 1 1 12 8688 1 1 40 ASP O O 11.986 -1.236 -4.787 1.00 . A A . 37 ASP O 1 1 12 8689 1 1 40 ASP OD1 O 9.002 -0.292 -6.603 1.00 . A A . 37 ASP OD1 1 1 12 8690 1 1 40 ASP OD2 O 9.514 0.406 -4.588 1.00 . A A . 37 ASP OD2 1 1 12 8691 1 1 41 ASN C C 12.647 -1.431 -1.832 1.00 . A A . 38 ASN C 1 1 12 8692 1 1 41 ASN CA C 13.093 -2.652 -2.635 1.00 . A A . 38 ASN CA 1 1 12 8693 1 1 41 ASN CB C 14.353 -2.360 -3.476 1.00 . A A . 38 ASN CB 1 1 12 8694 1 1 41 ASN CG C 15.586 -2.041 -2.645 1.00 . A A . 38 ASN CG 1 1 12 8695 1 1 41 ASN H H 11.607 -3.984 -3.360 1.00 . A A . 38 ASN H 1 1 12 8696 1 1 41 ASN HA H 13.305 -3.457 -1.945 1.00 . A A . 38 ASN HA 1 1 12 8697 1 1 41 ASN HB2 H 14.575 -3.224 -4.084 1.00 . A A . 38 ASN HB2 1 1 12 8698 1 1 41 ASN HB3 H 14.152 -1.519 -4.124 1.00 . A A . 38 ASN HB3 1 1 12 8699 1 1 41 ASN HD21 H 15.985 -3.975 -2.435 1.00 . A A . 38 ASN HD21 1 1 12 8700 1 1 41 ASN HD22 H 17.087 -2.891 -1.659 1.00 . A A . 38 ASN HD22 1 1 12 8701 1 1 41 ASN N N 11.984 -3.087 -3.492 1.00 . A A . 38 ASN N 1 1 12 8702 1 1 41 ASN ND2 N 16.289 -3.072 -2.203 1.00 . A A . 38 ASN ND2 1 1 12 8703 1 1 41 ASN O O 13.438 -0.589 -1.413 1.00 . A A . 38 ASN O 1 1 12 8704 1 1 41 ASN OD1 O 15.908 -0.874 -2.404 1.00 . A A . 38 ASN OD1 1 1 12 8705 1 1 42 CYS C C 10.790 -0.460 0.578 1.00 . A A . 39 CYS C 1 1 12 8706 1 1 42 CYS CA C 10.732 -0.251 -0.930 1.00 . A A . 39 CYS CA 1 1 12 8707 1 1 42 CYS CB C 9.283 -0.116 -1.402 1.00 . A A . 39 CYS CB 1 1 12 8708 1 1 42 CYS H H 10.784 -2.106 -1.914 1.00 . A A . 39 CYS H 1 1 12 8709 1 1 42 CYS HA H 11.277 0.645 -1.185 1.00 . A A . 39 CYS HA 1 1 12 8710 1 1 42 CYS HB2 H 9.267 -0.077 -2.481 1.00 . A A . 39 CYS HB2 1 1 12 8711 1 1 42 CYS HB3 H 8.725 -0.978 -1.071 1.00 . A A . 39 CYS HB3 1 1 12 8712 1 1 42 CYS N N 11.349 -1.368 -1.610 1.00 . A A . 39 CYS N 1 1 12 8713 1 1 42 CYS O O 10.761 -1.595 1.054 1.00 . A A . 39 CYS O 1 1 12 8714 1 1 42 CYS SG S 8.435 1.354 -0.795 1.00 . A A . 39 CYS SG 1 1 12 8715 1 1 43 SER C C 9.694 1.344 3.323 1.00 . A A . 40 SER C 1 1 12 8716 1 1 43 SER CA C 10.872 0.543 2.775 1.00 . A A . 40 SER CA 1 1 12 8717 1 1 43 SER CB C 12.187 1.042 3.375 1.00 . A A . 40 SER CB 1 1 12 8718 1 1 43 SER H H 11.045 1.493 0.897 1.00 . A A . 40 SER H 1 1 12 8719 1 1 43 SER HA H 10.738 -0.495 3.042 1.00 . A A . 40 SER HA 1 1 12 8720 1 1 43 SER HB2 H 12.307 2.092 3.154 1.00 . A A . 40 SER HB2 1 1 12 8721 1 1 43 SER HB3 H 12.168 0.900 4.445 1.00 . A A . 40 SER HB3 1 1 12 8722 1 1 43 SER HG H 13.684 0.847 2.124 1.00 . A A . 40 SER HG 1 1 12 8723 1 1 43 SER N N 10.912 0.624 1.325 1.00 . A A . 40 SER N 1 1 12 8724 1 1 43 SER O O 9.304 1.191 4.480 1.00 . A A . 40 SER O 1 1 12 8725 1 1 43 SER OG O 13.291 0.334 2.838 1.00 . A A . 40 SER OG 1 1 12 8726 1 1 44 GLY C C 8.409 4.072 3.851 1.00 . A A . 41 GLY C 1 1 12 8727 1 1 44 GLY CA C 7.998 3.016 2.852 1.00 . A A . 41 GLY CA 1 1 12 8728 1 1 44 GLY H H 9.438 2.204 1.536 1.00 . A A . 41 GLY H 1 1 12 8729 1 1 44 GLY HA2 H 7.598 3.502 1.974 1.00 . A A . 41 GLY HA2 1 1 12 8730 1 1 44 GLY HA3 H 7.231 2.401 3.290 1.00 . A A . 41 GLY HA3 1 1 12 8731 1 1 44 GLY N N 9.113 2.175 2.458 1.00 . A A . 41 GLY N 1 1 12 8732 1 1 44 GLY O O 7.712 4.318 4.834 1.00 . A A . 41 GLY O 1 1 12 8733 1 1 45 GLN C C 10.772 6.794 3.697 1.00 . A A . 42 GLN C 1 1 12 8734 1 1 45 GLN CA C 10.109 5.680 4.494 1.00 . A A . 42 GLN CA 1 1 12 8735 1 1 45 GLN CB C 11.129 5.014 5.425 1.00 . A A . 42 GLN CB 1 1 12 8736 1 1 45 GLN CD C 11.494 3.112 7.071 1.00 . A A . 42 GLN CD 1 1 12 8737 1 1 45 GLN CG C 10.502 4.082 6.454 1.00 . A A . 42 GLN CG 1 1 12 8738 1 1 45 GLN H H 10.016 4.496 2.755 1.00 . A A . 42 GLN H 1 1 12 8739 1 1 45 GLN HA H 9.307 6.097 5.084 1.00 . A A . 42 GLN HA 1 1 12 8740 1 1 45 GLN HB2 H 11.821 4.441 4.827 1.00 . A A . 42 GLN HB2 1 1 12 8741 1 1 45 GLN HB3 H 11.674 5.783 5.952 1.00 . A A . 42 GLN HB3 1 1 12 8742 1 1 45 GLN HE21 H 12.993 4.394 6.787 1.00 . A A . 42 GLN HE21 1 1 12 8743 1 1 45 GLN HE22 H 13.410 2.887 7.531 1.00 . A A . 42 GLN HE22 1 1 12 8744 1 1 45 GLN HG2 H 10.072 4.679 7.243 1.00 . A A . 42 GLN HG2 1 1 12 8745 1 1 45 GLN HG3 H 9.720 3.514 5.971 1.00 . A A . 42 GLN HG3 1 1 12 8746 1 1 45 GLN N N 9.542 4.696 3.591 1.00 . A A . 42 GLN N 1 1 12 8747 1 1 45 GLN NE2 N 12.758 3.503 7.138 1.00 . A A . 42 GLN NE2 1 1 12 8748 1 1 45 GLN O O 11.957 6.723 3.384 1.00 . A A . 42 GLN O 1 1 12 8749 1 1 45 GLN OE1 O 11.123 2.009 7.478 1.00 . A A . 42 GLN OE1 1 1 12 8750 1 1 46 THR C C 11.248 9.948 3.480 1.00 . A A . 43 THR C 1 1 12 8751 1 1 46 THR CA C 10.518 8.943 2.592 1.00 . A A . 43 THR CA 1 1 12 8752 1 1 46 THR CB C 9.382 9.639 1.824 1.00 . A A . 43 THR CB 1 1 12 8753 1 1 46 THR CG2 C 8.999 8.837 0.590 1.00 . A A . 43 THR CG2 1 1 12 8754 1 1 46 THR H H 9.066 7.840 3.668 1.00 . A A . 43 THR H 1 1 12 8755 1 1 46 THR HA H 11.218 8.547 1.870 1.00 . A A . 43 THR HA 1 1 12 8756 1 1 46 THR HB H 9.726 10.615 1.509 1.00 . A A . 43 THR HB 1 1 12 8757 1 1 46 THR HG1 H 7.999 10.731 2.711 1.00 . A A . 43 THR HG1 1 1 12 8758 1 1 46 THR HG21 H 8.170 9.317 0.092 1.00 . A A . 43 THR HG21 1 1 12 8759 1 1 46 THR HG22 H 8.714 7.839 0.884 1.00 . A A . 43 THR HG22 1 1 12 8760 1 1 46 THR HG23 H 9.842 8.787 -0.084 1.00 . A A . 43 THR HG23 1 1 12 8761 1 1 46 THR N N 10.005 7.825 3.374 1.00 . A A . 43 THR N 1 1 12 8762 1 1 46 THR O O 11.344 11.135 3.164 1.00 . A A . 43 THR O 1 1 12 8763 1 1 46 THR OG1 O 8.241 9.798 2.676 1.00 . A A . 43 THR OG1 1 1 12 8764 1 1 47 HIS C C 13.702 9.401 6.042 1.00 . A A . 44 HIS C 1 1 12 8765 1 1 47 HIS CA C 12.544 10.244 5.523 1.00 . A A . 44 HIS CA 1 1 12 8766 1 1 47 HIS CB C 11.673 10.768 6.679 1.00 . A A . 44 HIS CB 1 1 12 8767 1 1 47 HIS CD2 C 11.299 9.012 8.559 1.00 . A A . 44 HIS CD2 1 1 12 8768 1 1 47 HIS CE1 C 9.311 8.318 7.960 1.00 . A A . 44 HIS CE1 1 1 12 8769 1 1 47 HIS CG C 10.946 9.703 7.449 1.00 . A A . 44 HIS CG 1 1 12 8770 1 1 47 HIS H H 11.617 8.500 4.790 1.00 . A A . 44 HIS H 1 1 12 8771 1 1 47 HIS HA H 12.947 11.084 4.976 1.00 . A A . 44 HIS HA 1 1 12 8772 1 1 47 HIS HB2 H 12.303 11.301 7.376 1.00 . A A . 44 HIS HB2 1 1 12 8773 1 1 47 HIS HB3 H 10.937 11.449 6.280 1.00 . A A . 44 HIS HB3 1 1 12 8774 1 1 47 HIS HD1 H 9.153 9.563 6.343 1.00 . A A . 44 HIS HD1 1 1 12 8775 1 1 47 HIS HD2 H 12.223 9.115 9.110 1.00 . A A . 44 HIS HD2 1 1 12 8776 1 1 47 HIS HE1 H 8.374 7.782 7.936 1.00 . A A . 44 HIS HE1 1 1 12 8777 1 1 47 HIS HE2 H 10.305 7.431 9.513 1.00 . A A . 44 HIS HE2 1 1 12 8778 1 1 47 HIS N N 11.760 9.449 4.594 1.00 . A A . 44 HIS N 1 1 12 8779 1 1 47 HIS ND1 N 9.692 9.244 7.102 1.00 . A A . 44 HIS ND1 1 1 12 8780 1 1 47 HIS NE2 N 10.267 8.158 8.853 1.00 . A A . 44 HIS NE2 1 1 12 8781 1 1 47 HIS O O 14.135 9.551 7.184 1.00 . A A . 44 HIS O 1 1 12 8782 1 1 48 ASP C C 14.828 6.522 6.462 1.00 . A A . 45 ASP C 1 1 12 8783 1 1 48 ASP CA C 15.271 7.584 5.465 1.00 . A A . 45 ASP CA 1 1 12 8784 1 1 48 ASP CB C 16.518 8.315 5.975 1.00 . A A . 45 ASP CB 1 1 12 8785 1 1 48 ASP CG C 17.695 7.380 6.161 1.00 . A A . 45 ASP CG 1 1 12 8786 1 1 48 ASP H H 13.776 8.482 4.273 1.00 . A A . 45 ASP H 1 1 12 8787 1 1 48 ASP HA H 15.523 7.087 4.540 1.00 . A A . 45 ASP HA 1 1 12 8788 1 1 48 ASP HB2 H 16.796 9.078 5.264 1.00 . A A . 45 ASP HB2 1 1 12 8789 1 1 48 ASP HB3 H 16.293 8.779 6.926 1.00 . A A . 45 ASP HB3 1 1 12 8790 1 1 48 ASP N N 14.178 8.514 5.168 1.00 . A A . 45 ASP N 1 1 12 8791 1 1 48 ASP O O 14.413 5.433 6.017 1.00 . A A . 45 ASP O 1 1 12 8792 1 1 48 ASP OXT O 14.878 6.776 7.682 1.00 . A A . 45 ASP OXT 1 1 12 8793 1 1 48 ASP OD1 O 18.228 6.877 5.152 1.00 . A A . 45 ASP OD1 1 1 12 8794 1 1 48 ASP OD2 O 18.115 7.161 7.317 1.00 . A A . 45 ASP OD2 1 1 12 8795 2 2 1 ZN ZN ZN -4.604 -5.514 0.758 1.00 . B A . 101 ZN ZN 1 1 12 8796 3 2 1 ZN ZN ZN 6.191 1.216 -1.277 1.00 . C A . 102 ZN ZN 1 1 13 8797 1 1 1 GLY C C -16.032 11.670 1.511 1.00 . A A . -2 GLY C 1 1 13 8798 1 1 1 GLY CA C -15.574 11.925 2.931 1.00 . A A . -2 GLY CA 1 1 13 8799 1 1 1 GLY H1 H -16.614 13.710 3.193 1.00 . A A . -2 GLY H1 1 1 13 8800 1 1 1 GLY H2 H -16.185 12.950 4.641 1.00 . A A . -2 GLY H2 1 1 13 8801 1 1 1 GLY H3 H -17.458 12.343 3.710 1.00 . A A . -2 GLY H3 1 1 13 8802 1 1 1 GLY HA2 H -14.607 12.404 2.906 1.00 . A A . -2 GLY HA2 1 1 13 8803 1 1 1 GLY HA3 H -15.486 10.982 3.446 1.00 . A A . -2 GLY HA3 1 1 13 8804 1 1 1 GLY N N -16.523 12.792 3.670 1.00 . A A . -2 GLY N 1 1 13 8805 1 1 1 GLY O O -17.171 11.987 1.165 1.00 . A A . -2 GLY O 1 1 13 8806 1 1 2 PRO C C -16.625 9.808 -0.894 1.00 . A A . -1 PRO C 1 1 13 8807 1 1 2 PRO CA C -15.496 10.823 -0.742 1.00 . A A . -1 PRO CA 1 1 13 8808 1 1 2 PRO CB C -14.194 10.257 -1.318 1.00 . A A . -1 PRO CB 1 1 13 8809 1 1 2 PRO CD C -13.809 10.640 1.006 1.00 . A A . -1 PRO CD 1 1 13 8810 1 1 2 PRO CG C -13.447 9.737 -0.139 1.00 . A A . -1 PRO CG 1 1 13 8811 1 1 2 PRO HA H -15.760 11.729 -1.265 1.00 . A A . -1 PRO HA 1 1 13 8812 1 1 2 PRO HB2 H -14.421 9.468 -2.020 1.00 . A A . -1 PRO HB2 1 1 13 8813 1 1 2 PRO HB3 H -13.647 11.042 -1.816 1.00 . A A . -1 PRO HB3 1 1 13 8814 1 1 2 PRO HD2 H -13.807 10.090 1.937 1.00 . A A . -1 PRO HD2 1 1 13 8815 1 1 2 PRO HD3 H -13.128 11.476 1.058 1.00 . A A . -1 PRO HD3 1 1 13 8816 1 1 2 PRO HG2 H -13.753 8.723 0.071 1.00 . A A . -1 PRO HG2 1 1 13 8817 1 1 2 PRO HG3 H -12.386 9.779 -0.329 1.00 . A A . -1 PRO HG3 1 1 13 8818 1 1 2 PRO N N -15.169 11.088 0.663 1.00 . A A . -1 PRO N 1 1 13 8819 1 1 2 PRO O O -16.668 8.798 -0.187 1.00 . A A . -1 PRO O 1 1 13 8820 1 1 3 HIS C C -18.221 8.118 -3.116 1.00 . A A . 0 HIS C 1 1 13 8821 1 1 3 HIS CA C -18.644 9.171 -2.089 1.00 . A A . 0 HIS CA 1 1 13 8822 1 1 3 HIS CB C -19.864 9.964 -2.585 1.00 . A A . 0 HIS CB 1 1 13 8823 1 1 3 HIS CD2 C -21.954 8.680 -1.728 1.00 . A A . 0 HIS CD2 1 1 13 8824 1 1 3 HIS CE1 C -22.772 8.068 -3.665 1.00 . A A . 0 HIS CE1 1 1 13 8825 1 1 3 HIS CG C -21.125 9.153 -2.687 1.00 . A A . 0 HIS CG 1 1 13 8826 1 1 3 HIS H H -17.446 10.900 -2.352 1.00 . A A . 0 HIS H 1 1 13 8827 1 1 3 HIS HA H -18.897 8.676 -1.162 1.00 . A A . 0 HIS HA 1 1 13 8828 1 1 3 HIS HB2 H -20.051 10.780 -1.905 1.00 . A A . 0 HIS HB2 1 1 13 8829 1 1 3 HIS HB3 H -19.646 10.364 -3.564 1.00 . A A . 0 HIS HB3 1 1 13 8830 1 1 3 HIS HD1 H -21.291 8.940 -4.780 1.00 . A A . 0 HIS HD1 1 1 13 8831 1 1 3 HIS HD2 H -21.838 8.806 -0.660 1.00 . A A . 0 HIS HD2 1 1 13 8832 1 1 3 HIS HE1 H -23.406 7.631 -4.421 1.00 . A A . 0 HIS HE1 1 1 13 8833 1 1 3 HIS HE2 H -23.780 7.660 -1.931 1.00 . A A . 0 HIS HE2 1 1 13 8834 1 1 3 HIS N N -17.531 10.074 -1.823 1.00 . A A . 0 HIS N 1 1 13 8835 1 1 3 HIS ND1 N -21.666 8.752 -3.889 1.00 . A A . 0 HIS ND1 1 1 13 8836 1 1 3 HIS NE2 N -22.970 8.009 -2.364 1.00 . A A . 0 HIS NE2 1 1 13 8837 1 1 3 HIS O O -18.863 7.935 -4.151 1.00 . A A . 0 HIS O 1 1 13 8838 1 1 4 MET C C -15.422 5.707 -2.980 1.00 . A A . 1 MET C 1 1 13 8839 1 1 4 MET CA C -16.570 6.410 -3.688 1.00 . A A . 1 MET CA 1 1 13 8840 1 1 4 MET CB C -16.082 7.012 -5.012 1.00 . A A . 1 MET CB 1 1 13 8841 1 1 4 MET CE C -15.971 9.609 -6.880 1.00 . A A . 1 MET CE 1 1 13 8842 1 1 4 MET CG C -14.944 8.012 -4.863 1.00 . A A . 1 MET CG 1 1 13 8843 1 1 4 MET H H -16.659 7.637 -1.971 1.00 . A A . 1 MET H 1 1 13 8844 1 1 4 MET HA H -17.351 5.693 -3.890 1.00 . A A . 1 MET HA 1 1 13 8845 1 1 4 MET HB2 H -15.744 6.210 -5.652 1.00 . A A . 1 MET HB2 1 1 13 8846 1 1 4 MET HB3 H -16.911 7.513 -5.489 1.00 . A A . 1 MET HB3 1 1 13 8847 1 1 4 MET HE1 H -16.771 8.893 -6.990 1.00 . A A . 1 MET HE1 1 1 13 8848 1 1 4 MET HE2 H -15.827 10.132 -7.813 1.00 . A A . 1 MET HE2 1 1 13 8849 1 1 4 MET HE3 H -16.227 10.318 -6.106 1.00 . A A . 1 MET HE3 1 1 13 8850 1 1 4 MET HG2 H -15.259 8.798 -4.191 1.00 . A A . 1 MET HG2 1 1 13 8851 1 1 4 MET HG3 H -14.089 7.503 -4.442 1.00 . A A . 1 MET HG3 1 1 13 8852 1 1 4 MET N N -17.121 7.440 -2.818 1.00 . A A . 1 MET N 1 1 13 8853 1 1 4 MET O O -14.797 6.281 -2.085 1.00 . A A . 1 MET O 1 1 13 8854 1 1 4 MET SD S -14.461 8.755 -6.433 1.00 . A A . 1 MET SD 1 1 13 8855 1 1 5 ALA C C -13.064 3.239 -3.740 1.00 . A A . 2 ALA C 1 1 13 8856 1 1 5 ALA CA C -14.095 3.702 -2.734 1.00 . A A . 2 ALA CA 1 1 13 8857 1 1 5 ALA CB C -14.665 2.498 -2.004 1.00 . A A . 2 ALA CB 1 1 13 8858 1 1 5 ALA H H -15.661 4.072 -4.103 1.00 . A A . 2 ALA H 1 1 13 8859 1 1 5 ALA HA H -13.610 4.335 -2.005 1.00 . A A . 2 ALA HA 1 1 13 8860 1 1 5 ALA HB1 H -13.854 1.926 -1.571 1.00 . A A . 2 ALA HB1 1 1 13 8861 1 1 5 ALA HB2 H -15.208 1.878 -2.701 1.00 . A A . 2 ALA HB2 1 1 13 8862 1 1 5 ALA HB3 H -15.328 2.831 -1.223 1.00 . A A . 2 ALA HB3 1 1 13 8863 1 1 5 ALA N N -15.149 4.473 -3.368 1.00 . A A . 2 ALA N 1 1 13 8864 1 1 5 ALA O O -13.346 3.100 -4.931 1.00 . A A . 2 ALA O 1 1 13 8865 1 1 6 VAL C C -10.220 1.278 -3.251 1.00 . A A . 3 VAL C 1 1 13 8866 1 1 6 VAL CA C -10.792 2.440 -4.024 1.00 . A A . 3 VAL CA 1 1 13 8867 1 1 6 VAL CB C -9.677 3.468 -4.314 1.00 . A A . 3 VAL CB 1 1 13 8868 1 1 6 VAL CG1 C -8.592 2.859 -5.185 1.00 . A A . 3 VAL CG1 1 1 13 8869 1 1 6 VAL CG2 C -10.246 4.720 -4.961 1.00 . A A . 3 VAL CG2 1 1 13 8870 1 1 6 VAL H H -11.699 3.227 -2.298 1.00 . A A . 3 VAL H 1 1 13 8871 1 1 6 VAL HA H -11.198 2.074 -4.956 1.00 . A A . 3 VAL HA 1 1 13 8872 1 1 6 VAL HB H -9.229 3.751 -3.372 1.00 . A A . 3 VAL HB 1 1 13 8873 1 1 6 VAL HG11 H -9.023 2.514 -6.113 1.00 . A A . 3 VAL HG11 1 1 13 8874 1 1 6 VAL HG12 H -8.141 2.025 -4.665 1.00 . A A . 3 VAL HG12 1 1 13 8875 1 1 6 VAL HG13 H -7.836 3.603 -5.393 1.00 . A A . 3 VAL HG13 1 1 13 8876 1 1 6 VAL HG21 H -9.445 5.411 -5.175 1.00 . A A . 3 VAL HG21 1 1 13 8877 1 1 6 VAL HG22 H -10.952 5.184 -4.288 1.00 . A A . 3 VAL HG22 1 1 13 8878 1 1 6 VAL HG23 H -10.747 4.454 -5.880 1.00 . A A . 3 VAL HG23 1 1 13 8879 1 1 6 VAL N N -11.867 3.013 -3.241 1.00 . A A . 3 VAL N 1 1 13 8880 1 1 6 VAL O O -10.136 1.322 -2.023 1.00 . A A . 3 VAL O 1 1 13 8881 1 1 7 LEU C C -7.902 -0.989 -3.195 1.00 . A A . 4 LEU C 1 1 13 8882 1 1 7 LEU CA C -9.410 -0.961 -3.261 1.00 . A A . 4 LEU CA 1 1 13 8883 1 1 7 LEU CB C -9.960 -2.235 -3.909 1.00 . A A . 4 LEU CB 1 1 13 8884 1 1 7 LEU CD1 C -11.813 -3.764 -3.268 1.00 . A A . 4 LEU CD1 1 1 13 8885 1 1 7 LEU CD2 C -12.132 -1.378 -2.965 1.00 . A A . 4 LEU CD2 1 1 13 8886 1 1 7 LEU CG C -11.483 -2.413 -3.839 1.00 . A A . 4 LEU CG 1 1 13 8887 1 1 7 LEU H H -9.903 0.240 -4.926 1.00 . A A . 4 LEU H 1 1 13 8888 1 1 7 LEU HA H -9.785 -0.909 -2.251 1.00 . A A . 4 LEU HA 1 1 13 8889 1 1 7 LEU HB2 H -9.663 -2.243 -4.948 1.00 . A A . 4 LEU HB2 1 1 13 8890 1 1 7 LEU HB3 H -9.505 -3.086 -3.416 1.00 . A A . 4 LEU HB3 1 1 13 8891 1 1 7 LEU HD11 H -11.372 -3.836 -2.280 1.00 . A A . 4 LEU HD11 1 1 13 8892 1 1 7 LEU HD12 H -11.414 -4.536 -3.905 1.00 . A A . 4 LEU HD12 1 1 13 8893 1 1 7 LEU HD13 H -12.883 -3.866 -3.192 1.00 . A A . 4 LEU HD13 1 1 13 8894 1 1 7 LEU HD21 H -11.711 -0.411 -3.186 1.00 . A A . 4 LEU HD21 1 1 13 8895 1 1 7 LEU HD22 H -11.945 -1.633 -1.935 1.00 . A A . 4 LEU HD22 1 1 13 8896 1 1 7 LEU HD23 H -13.193 -1.364 -3.148 1.00 . A A . 4 LEU HD23 1 1 13 8897 1 1 7 LEU HG H -11.905 -2.336 -4.831 1.00 . A A . 4 LEU HG 1 1 13 8898 1 1 7 LEU N N -9.866 0.222 -3.944 1.00 . A A . 4 LEU N 1 1 13 8899 1 1 7 LEU O O -7.224 -0.175 -3.821 1.00 . A A . 4 LEU O 1 1 13 8900 1 1 8 CYS C C -5.226 -2.135 -3.529 1.00 . A A . 5 CYS C 1 1 13 8901 1 1 8 CYS CA C -5.981 -2.092 -2.201 1.00 . A A . 5 CYS CA 1 1 13 8902 1 1 8 CYS CB C -5.795 -3.398 -1.450 1.00 . A A . 5 CYS CB 1 1 13 8903 1 1 8 CYS H H -8.020 -2.507 -1.936 1.00 . A A . 5 CYS H 1 1 13 8904 1 1 8 CYS HA H -5.613 -1.277 -1.599 1.00 . A A . 5 CYS HA 1 1 13 8905 1 1 8 CYS HB2 H -6.453 -3.403 -0.599 1.00 . A A . 5 CYS HB2 1 1 13 8906 1 1 8 CYS HB3 H -6.070 -4.213 -2.104 1.00 . A A . 5 CYS HB3 1 1 13 8907 1 1 8 CYS N N -7.402 -1.914 -2.407 1.00 . A A . 5 CYS N 1 1 13 8908 1 1 8 CYS O O -5.584 -2.879 -4.432 1.00 . A A . 5 CYS O 1 1 13 8909 1 1 8 CYS SG S -4.132 -3.720 -0.849 1.00 . A A . 5 CYS SG 1 1 13 8910 1 1 9 GLY C C -2.606 -2.627 -5.003 1.00 . A A . 6 GLY C 1 1 13 8911 1 1 9 GLY CA C -3.377 -1.332 -4.841 1.00 . A A . 6 GLY CA 1 1 13 8912 1 1 9 GLY H H -3.984 -0.695 -2.913 1.00 . A A . 6 GLY H 1 1 13 8913 1 1 9 GLY HA2 H -4.019 -1.197 -5.699 1.00 . A A . 6 GLY HA2 1 1 13 8914 1 1 9 GLY HA3 H -2.677 -0.513 -4.794 1.00 . A A . 6 GLY HA3 1 1 13 8915 1 1 9 GLY N N -4.188 -1.326 -3.642 1.00 . A A . 6 GLY N 1 1 13 8916 1 1 9 GLY O O -2.122 -2.940 -6.088 1.00 . A A . 6 GLY O 1 1 13 8917 1 1 10 VAL C C -2.731 -5.827 -4.223 1.00 . A A . 7 VAL C 1 1 13 8918 1 1 10 VAL CA C -1.786 -4.656 -3.945 1.00 . A A . 7 VAL CA 1 1 13 8919 1 1 10 VAL CB C -1.035 -4.909 -2.621 1.00 . A A . 7 VAL CB 1 1 13 8920 1 1 10 VAL CG1 C -0.418 -6.297 -2.603 1.00 . A A . 7 VAL CG1 1 1 13 8921 1 1 10 VAL CG2 C 0.034 -3.853 -2.405 1.00 . A A . 7 VAL CG2 1 1 13 8922 1 1 10 VAL H H -2.889 -3.074 -3.078 1.00 . A A . 7 VAL H 1 1 13 8923 1 1 10 VAL HA H -1.054 -4.607 -4.739 1.00 . A A . 7 VAL HA 1 1 13 8924 1 1 10 VAL HB H -1.744 -4.843 -1.810 1.00 . A A . 7 VAL HB 1 1 13 8925 1 1 10 VAL HG11 H 0.269 -6.398 -3.430 1.00 . A A . 7 VAL HG11 1 1 13 8926 1 1 10 VAL HG12 H -1.200 -7.037 -2.691 1.00 . A A . 7 VAL HG12 1 1 13 8927 1 1 10 VAL HG13 H 0.113 -6.443 -1.675 1.00 . A A . 7 VAL HG13 1 1 13 8928 1 1 10 VAL HG21 H -0.431 -2.882 -2.330 1.00 . A A . 7 VAL HG21 1 1 13 8929 1 1 10 VAL HG22 H 0.722 -3.860 -3.238 1.00 . A A . 7 VAL HG22 1 1 13 8930 1 1 10 VAL HG23 H 0.573 -4.067 -1.492 1.00 . A A . 7 VAL HG23 1 1 13 8931 1 1 10 VAL N N -2.495 -3.385 -3.918 1.00 . A A . 7 VAL N 1 1 13 8932 1 1 10 VAL O O -2.555 -6.550 -5.203 1.00 . A A . 7 VAL O 1 1 13 8933 1 1 11 CYS C C -6.001 -6.807 -4.017 1.00 . A A . 8 CYS C 1 1 13 8934 1 1 11 CYS CA C -4.605 -7.182 -3.495 1.00 . A A . 8 CYS CA 1 1 13 8935 1 1 11 CYS CB C -4.704 -7.936 -2.161 1.00 . A A . 8 CYS CB 1 1 13 8936 1 1 11 CYS H H -3.874 -5.381 -2.642 1.00 . A A . 8 CYS H 1 1 13 8937 1 1 11 CYS HA H -4.147 -7.838 -4.220 1.00 . A A . 8 CYS HA 1 1 13 8938 1 1 11 CYS HB2 H -5.210 -8.870 -2.336 1.00 . A A . 8 CYS HB2 1 1 13 8939 1 1 11 CYS HB3 H -3.709 -8.139 -1.797 1.00 . A A . 8 CYS HB3 1 1 13 8940 1 1 11 CYS N N -3.731 -6.018 -3.365 1.00 . A A . 8 CYS N 1 1 13 8941 1 1 11 CYS O O -6.790 -7.675 -4.387 1.00 . A A . 8 CYS O 1 1 13 8942 1 1 11 CYS SG S -5.607 -7.081 -0.850 1.00 . A A . 8 CYS SG 1 1 13 8943 1 1 12 GLY C C -8.773 -5.528 -3.942 1.00 . A A . 9 GLY C 1 1 13 8944 1 1 12 GLY CA C -7.531 -4.982 -4.598 1.00 . A A . 9 GLY CA 1 1 13 8945 1 1 12 GLY H H -5.599 -4.874 -3.742 1.00 . A A . 9 GLY H 1 1 13 8946 1 1 12 GLY HA2 H -7.545 -3.904 -4.472 1.00 . A A . 9 GLY HA2 1 1 13 8947 1 1 12 GLY HA3 H -7.572 -5.204 -5.652 1.00 . A A . 9 GLY HA3 1 1 13 8948 1 1 12 GLY N N -6.275 -5.503 -4.056 1.00 . A A . 9 GLY N 1 1 13 8949 1 1 12 GLY O O -9.784 -5.717 -4.610 1.00 . A A . 9 GLY O 1 1 13 8950 1 1 13 ILE C C -9.968 -5.480 -0.560 1.00 . A A . 10 ILE C 1 1 13 8951 1 1 13 ILE CA C -9.888 -6.196 -1.905 1.00 . A A . 10 ILE CA 1 1 13 8952 1 1 13 ILE CB C -9.916 -7.739 -1.701 1.00 . A A . 10 ILE CB 1 1 13 8953 1 1 13 ILE CD1 C -8.688 -8.216 0.481 1.00 . A A . 10 ILE CD1 1 1 13 8954 1 1 13 ILE CG1 C -8.636 -8.242 -1.029 1.00 . A A . 10 ILE CG1 1 1 13 8955 1 1 13 ILE CG2 C -10.120 -8.457 -3.025 1.00 . A A . 10 ILE CG2 1 1 13 8956 1 1 13 ILE H H -7.866 -5.661 -2.169 1.00 . A A . 10 ILE H 1 1 13 8957 1 1 13 ILE HA H -10.757 -5.916 -2.487 1.00 . A A . 10 ILE HA 1 1 13 8958 1 1 13 ILE HB H -10.757 -7.972 -1.066 1.00 . A A . 10 ILE HB 1 1 13 8959 1 1 13 ILE HD11 H -9.464 -8.882 0.825 1.00 . A A . 10 ILE HD11 1 1 13 8960 1 1 13 ILE HD12 H -8.907 -7.210 0.809 1.00 . A A . 10 ILE HD12 1 1 13 8961 1 1 13 ILE HD13 H -7.737 -8.529 0.881 1.00 . A A . 10 ILE HD13 1 1 13 8962 1 1 13 ILE HG12 H -8.447 -9.259 -1.336 1.00 . A A . 10 ILE HG12 1 1 13 8963 1 1 13 ILE HG13 H -7.808 -7.620 -1.340 1.00 . A A . 10 ILE HG13 1 1 13 8964 1 1 13 ILE HG21 H -10.195 -9.519 -2.850 1.00 . A A . 10 ILE HG21 1 1 13 8965 1 1 13 ILE HG22 H -9.279 -8.257 -3.672 1.00 . A A . 10 ILE HG22 1 1 13 8966 1 1 13 ILE HG23 H -11.027 -8.102 -3.492 1.00 . A A . 10 ILE HG23 1 1 13 8967 1 1 13 ILE N N -8.714 -5.766 -2.642 1.00 . A A . 10 ILE N 1 1 13 8968 1 1 13 ILE O O -8.990 -4.875 -0.117 1.00 . A A . 10 ILE O 1 1 13 8969 1 1 14 LYS C C -11.145 -3.515 1.538 1.00 . A A . 11 LYS C 1 1 13 8970 1 1 14 LYS CA C -11.461 -5.004 1.380 1.00 . A A . 11 LYS CA 1 1 13 8971 1 1 14 LYS CB C -10.749 -5.831 2.475 1.00 . A A . 11 LYS CB 1 1 13 8972 1 1 14 LYS CD C -8.630 -6.412 3.715 1.00 . A A . 11 LYS CD 1 1 13 8973 1 1 14 LYS CE C -9.251 -6.285 5.096 1.00 . A A . 11 LYS CE 1 1 13 8974 1 1 14 LYS CG C -9.285 -5.473 2.713 1.00 . A A . 11 LYS CG 1 1 13 8975 1 1 14 LYS H H -11.914 -5.882 -0.495 1.00 . A A . 11 LYS H 1 1 13 8976 1 1 14 LYS HA H -12.525 -5.120 1.522 1.00 . A A . 11 LYS HA 1 1 13 8977 1 1 14 LYS HB2 H -11.279 -5.695 3.405 1.00 . A A . 11 LYS HB2 1 1 13 8978 1 1 14 LYS HB3 H -10.798 -6.875 2.200 1.00 . A A . 11 LYS HB3 1 1 13 8979 1 1 14 LYS HD2 H -8.749 -7.429 3.371 1.00 . A A . 11 LYS HD2 1 1 13 8980 1 1 14 LYS HD3 H -7.579 -6.174 3.781 1.00 . A A . 11 LYS HD3 1 1 13 8981 1 1 14 LYS HE2 H -9.120 -5.272 5.444 1.00 . A A . 11 LYS HE2 1 1 13 8982 1 1 14 LYS HE3 H -10.305 -6.508 5.026 1.00 . A A . 11 LYS HE3 1 1 13 8983 1 1 14 LYS HG2 H -8.751 -5.534 1.778 1.00 . A A . 11 LYS HG2 1 1 13 8984 1 1 14 LYS HG3 H -9.232 -4.463 3.094 1.00 . A A . 11 LYS HG3 1 1 13 8985 1 1 14 LYS HZ1 H -7.598 -7.049 6.113 1.00 . A A . 11 LYS HZ1 1 1 13 8986 1 1 14 LYS HZ2 H -8.793 -8.198 5.786 1.00 . A A . 11 LYS HZ2 1 1 13 8987 1 1 14 LYS HZ3 H -9.025 -7.064 7.015 1.00 . A A . 11 LYS HZ3 1 1 13 8988 1 1 14 LYS N N -11.168 -5.510 0.025 1.00 . A A . 11 LYS N 1 1 13 8989 1 1 14 LYS NZ N -8.624 -7.214 6.070 1.00 . A A . 11 LYS NZ 1 1 13 8990 1 1 14 LYS O O -11.003 -3.024 2.660 1.00 . A A . 11 LYS O 1 1 13 8991 1 1 15 GLU C C -9.411 -1.024 0.924 1.00 . A A . 12 GLU C 1 1 13 8992 1 1 15 GLU CA C -10.801 -1.363 0.402 1.00 . A A . 12 GLU CA 1 1 13 8993 1 1 15 GLU CB C -11.855 -0.600 1.206 1.00 . A A . 12 GLU CB 1 1 13 8994 1 1 15 GLU CD C -14.216 0.269 1.307 1.00 . A A . 12 GLU CD 1 1 13 8995 1 1 15 GLU CG C -13.184 -0.472 0.488 1.00 . A A . 12 GLU CG 1 1 13 8996 1 1 15 GLU H H -11.205 -3.264 -0.439 1.00 . A A . 12 GLU H 1 1 13 8997 1 1 15 GLU HA H -10.857 -1.035 -0.620 1.00 . A A . 12 GLU HA 1 1 13 8998 1 1 15 GLU HB2 H -12.022 -1.116 2.139 1.00 . A A . 12 GLU HB2 1 1 13 8999 1 1 15 GLU HB3 H -11.485 0.393 1.413 1.00 . A A . 12 GLU HB3 1 1 13 9000 1 1 15 GLU HG2 H -13.027 0.063 -0.436 1.00 . A A . 12 GLU HG2 1 1 13 9001 1 1 15 GLU HG3 H -13.558 -1.462 0.271 1.00 . A A . 12 GLU HG3 1 1 13 9002 1 1 15 GLU N N -11.070 -2.804 0.413 1.00 . A A . 12 GLU N 1 1 13 9003 1 1 15 GLU O O -8.810 -1.758 1.711 1.00 . A A . 12 GLU O 1 1 13 9004 1 1 15 GLU OE1 O -14.178 1.519 1.339 1.00 . A A . 12 GLU OE1 1 1 13 9005 1 1 15 GLU OE2 O -15.076 -0.394 1.923 1.00 . A A . 12 GLU OE2 1 1 13 9006 1 1 16 PHE C C -7.767 1.267 2.276 1.00 . A A . 13 PHE C 1 1 13 9007 1 1 16 PHE CA C -7.607 0.587 0.918 1.00 . A A . 13 PHE CA 1 1 13 9008 1 1 16 PHE CB C -6.992 1.566 -0.089 1.00 . A A . 13 PHE CB 1 1 13 9009 1 1 16 PHE CD1 C -8.630 3.391 -0.660 1.00 . A A . 13 PHE CD1 1 1 13 9010 1 1 16 PHE CD2 C -6.829 3.904 0.817 1.00 . A A . 13 PHE CD2 1 1 13 9011 1 1 16 PHE CE1 C -9.087 4.690 -0.558 1.00 . A A . 13 PHE CE1 1 1 13 9012 1 1 16 PHE CE2 C -7.281 5.204 0.923 1.00 . A A . 13 PHE CE2 1 1 13 9013 1 1 16 PHE CG C -7.498 2.982 0.025 1.00 . A A . 13 PHE CG 1 1 13 9014 1 1 16 PHE CZ C -8.412 5.597 0.235 1.00 . A A . 13 PHE CZ 1 1 13 9015 1 1 16 PHE H H -9.376 0.577 -0.259 1.00 . A A . 13 PHE H 1 1 13 9016 1 1 16 PHE HA H -6.947 -0.260 1.031 1.00 . A A . 13 PHE HA 1 1 13 9017 1 1 16 PHE HB2 H -5.924 1.589 0.055 1.00 . A A . 13 PHE HB2 1 1 13 9018 1 1 16 PHE HB3 H -7.199 1.219 -1.089 1.00 . A A . 13 PHE HB3 1 1 13 9019 1 1 16 PHE HD1 H -9.158 2.683 -1.282 1.00 . A A . 13 PHE HD1 1 1 13 9020 1 1 16 PHE HD2 H -5.943 3.594 1.360 1.00 . A A . 13 PHE HD2 1 1 13 9021 1 1 16 PHE HE1 H -9.972 4.996 -1.097 1.00 . A A . 13 PHE HE1 1 1 13 9022 1 1 16 PHE HE2 H -6.749 5.911 1.542 1.00 . A A . 13 PHE HE2 1 1 13 9023 1 1 16 PHE HZ H -8.766 6.614 0.316 1.00 . A A . 13 PHE HZ 1 1 13 9024 1 1 16 PHE N N -8.890 0.089 0.445 1.00 . A A . 13 PHE N 1 1 13 9025 1 1 16 PHE O O -8.846 1.762 2.613 1.00 . A A . 13 PHE O 1 1 13 9026 1 1 17 LYS C C -5.371 2.731 4.515 1.00 . A A . 14 LYS C 1 1 13 9027 1 1 17 LYS CA C -6.669 1.940 4.342 1.00 . A A . 14 LYS CA 1 1 13 9028 1 1 17 LYS CB C -6.819 0.886 5.443 1.00 . A A . 14 LYS CB 1 1 13 9029 1 1 17 LYS CD C -6.952 0.371 7.913 1.00 . A A . 14 LYS CD 1 1 13 9030 1 1 17 LYS CE C -8.446 0.142 8.141 1.00 . A A . 14 LYS CE 1 1 13 9031 1 1 17 LYS CG C -6.672 1.430 6.855 1.00 . A A . 14 LYS CG 1 1 13 9032 1 1 17 LYS H H -5.873 0.844 2.726 1.00 . A A . 14 LYS H 1 1 13 9033 1 1 17 LYS HA H -7.503 2.621 4.390 1.00 . A A . 14 LYS HA 1 1 13 9034 1 1 17 LYS HB2 H -7.792 0.433 5.357 1.00 . A A . 14 LYS HB2 1 1 13 9035 1 1 17 LYS HB3 H -6.067 0.125 5.296 1.00 . A A . 14 LYS HB3 1 1 13 9036 1 1 17 LYS HD2 H -6.505 -0.558 7.597 1.00 . A A . 14 LYS HD2 1 1 13 9037 1 1 17 LYS HD3 H -6.502 0.687 8.843 1.00 . A A . 14 LYS HD3 1 1 13 9038 1 1 17 LYS HE2 H -8.569 -0.505 8.996 1.00 . A A . 14 LYS HE2 1 1 13 9039 1 1 17 LYS HE3 H -8.912 1.094 8.348 1.00 . A A . 14 LYS HE3 1 1 13 9040 1 1 17 LYS HG2 H -5.658 1.782 6.983 1.00 . A A . 14 LYS HG2 1 1 13 9041 1 1 17 LYS HG3 H -7.360 2.252 6.987 1.00 . A A . 14 LYS HG3 1 1 13 9042 1 1 17 LYS HZ1 H -10.081 -0.796 7.243 1.00 . A A . 14 LYS HZ1 1 1 13 9043 1 1 17 LYS HZ2 H -8.588 -1.304 6.634 1.00 . A A . 14 LYS HZ2 1 1 13 9044 1 1 17 LYS HZ3 H -9.213 0.205 6.198 1.00 . A A . 14 LYS HZ3 1 1 13 9045 1 1 17 LYS N N -6.689 1.290 3.042 1.00 . A A . 14 LYS N 1 1 13 9046 1 1 17 LYS NZ N -9.127 -0.481 6.973 1.00 . A A . 14 LYS NZ 1 1 13 9047 1 1 17 LYS O O -5.323 3.736 5.226 1.00 . A A . 14 LYS O 1 1 13 9048 1 1 18 TYR C C -2.630 3.508 2.593 1.00 . A A . 15 TYR C 1 1 13 9049 1 1 18 TYR CA C -3.015 2.887 3.923 1.00 . A A . 15 TYR CA 1 1 13 9050 1 1 18 TYR CB C -1.962 1.842 4.293 1.00 . A A . 15 TYR CB 1 1 13 9051 1 1 18 TYR CD1 C -3.217 0.406 5.936 1.00 . A A . 15 TYR CD1 1 1 13 9052 1 1 18 TYR CD2 C -1.214 1.464 6.666 1.00 . A A . 15 TYR CD2 1 1 13 9053 1 1 18 TYR CE1 C -3.379 -0.160 7.182 1.00 . A A . 15 TYR CE1 1 1 13 9054 1 1 18 TYR CE2 C -1.365 0.898 7.917 1.00 . A A . 15 TYR CE2 1 1 13 9055 1 1 18 TYR CG C -2.136 1.227 5.658 1.00 . A A . 15 TYR CG 1 1 13 9056 1 1 18 TYR CZ C -2.449 0.087 8.170 1.00 . A A . 15 TYR CZ 1 1 13 9057 1 1 18 TYR H H -4.452 1.509 3.238 1.00 . A A . 15 TYR H 1 1 13 9058 1 1 18 TYR HA H -3.043 3.653 4.682 1.00 . A A . 15 TYR HA 1 1 13 9059 1 1 18 TYR HB2 H -2.002 1.044 3.567 1.00 . A A . 15 TYR HB2 1 1 13 9060 1 1 18 TYR HB3 H -0.984 2.302 4.258 1.00 . A A . 15 TYR HB3 1 1 13 9061 1 1 18 TYR HD1 H -3.943 0.217 5.157 1.00 . A A . 15 TYR HD1 1 1 13 9062 1 1 18 TYR HD2 H -0.366 2.101 6.461 1.00 . A A . 15 TYR HD2 1 1 13 9063 1 1 18 TYR HE1 H -4.231 -0.794 7.375 1.00 . A A . 15 TYR HE1 1 1 13 9064 1 1 18 TYR HE2 H -0.635 1.093 8.689 1.00 . A A . 15 TYR HE2 1 1 13 9065 1 1 18 TYR HH H -2.833 -1.410 9.318 1.00 . A A . 15 TYR HH 1 1 13 9066 1 1 18 TYR N N -4.330 2.277 3.835 1.00 . A A . 15 TYR N 1 1 13 9067 1 1 18 TYR O O -3.413 3.503 1.642 1.00 . A A . 15 TYR O 1 1 13 9068 1 1 18 TYR OH O -2.603 -0.477 9.416 1.00 . A A . 15 TYR OH 1 1 13 9069 1 1 19 LYS C C 0.636 4.779 1.486 1.00 . A A . 16 LYS C 1 1 13 9070 1 1 19 LYS CA C -0.864 4.584 1.319 1.00 . A A . 16 LYS CA 1 1 13 9071 1 1 19 LYS CB C -1.555 5.912 0.990 1.00 . A A . 16 LYS CB 1 1 13 9072 1 1 19 LYS CD C -2.117 7.606 -0.781 1.00 . A A . 16 LYS CD 1 1 13 9073 1 1 19 LYS CE C -2.199 8.717 0.254 1.00 . A A . 16 LYS CE 1 1 13 9074 1 1 19 LYS CG C -1.165 6.497 -0.358 1.00 . A A . 16 LYS CG 1 1 13 9075 1 1 19 LYS H H -0.862 4.026 3.348 1.00 . A A . 16 LYS H 1 1 13 9076 1 1 19 LYS HA H -1.041 3.882 0.518 1.00 . A A . 16 LYS HA 1 1 13 9077 1 1 19 LYS HB2 H -2.623 5.756 0.991 1.00 . A A . 16 LYS HB2 1 1 13 9078 1 1 19 LYS HB3 H -1.305 6.632 1.755 1.00 . A A . 16 LYS HB3 1 1 13 9079 1 1 19 LYS HD2 H -1.770 8.027 -1.712 1.00 . A A . 16 LYS HD2 1 1 13 9080 1 1 19 LYS HD3 H -3.102 7.184 -0.920 1.00 . A A . 16 LYS HD3 1 1 13 9081 1 1 19 LYS HE2 H -2.464 8.286 1.208 1.00 . A A . 16 LYS HE2 1 1 13 9082 1 1 19 LYS HE3 H -1.234 9.192 0.329 1.00 . A A . 16 LYS HE3 1 1 13 9083 1 1 19 LYS HG2 H -0.164 6.900 -0.296 1.00 . A A . 16 LYS HG2 1 1 13 9084 1 1 19 LYS HG3 H -1.195 5.712 -1.099 1.00 . A A . 16 LYS HG3 1 1 13 9085 1 1 19 LYS HZ1 H -4.155 9.298 -0.179 1.00 . A A . 16 LYS HZ1 1 1 13 9086 1 1 19 LYS HZ2 H -2.983 10.160 -1.037 1.00 . A A . 16 LYS HZ2 1 1 13 9087 1 1 19 LYS HZ3 H -3.245 10.490 0.602 1.00 . A A . 16 LYS HZ3 1 1 13 9088 1 1 19 LYS N N -1.413 4.022 2.537 1.00 . A A . 16 LYS N 1 1 13 9089 1 1 19 LYS NZ N -3.216 9.737 -0.115 1.00 . A A . 16 LYS NZ 1 1 13 9090 1 1 19 LYS O O 1.073 5.680 2.206 1.00 . A A . 16 LYS O 1 1 13 9091 1 1 20 CYS C C 3.347 5.390 0.557 1.00 . A A . 17 CYS C 1 1 13 9092 1 1 20 CYS CA C 2.877 3.984 0.912 1.00 . A A . 17 CYS CA 1 1 13 9093 1 1 20 CYS CB C 3.522 2.973 -0.046 1.00 . A A . 17 CYS CB 1 1 13 9094 1 1 20 CYS H H 0.999 3.169 0.354 1.00 . A A . 17 CYS H 1 1 13 9095 1 1 20 CYS HA H 3.186 3.758 1.922 1.00 . A A . 17 CYS HA 1 1 13 9096 1 1 20 CYS HB2 H 3.245 1.976 0.259 1.00 . A A . 17 CYS HB2 1 1 13 9097 1 1 20 CYS HB3 H 3.161 3.155 -1.046 1.00 . A A . 17 CYS HB3 1 1 13 9098 1 1 20 CYS N N 1.418 3.899 0.860 1.00 . A A . 17 CYS N 1 1 13 9099 1 1 20 CYS O O 2.985 5.922 -0.488 1.00 . A A . 17 CYS O 1 1 13 9100 1 1 20 CYS SG S 5.334 3.063 -0.084 1.00 . A A . 17 CYS SG 1 1 13 9101 1 1 21 PRO C C 5.572 7.466 -0.024 1.00 . A A . 18 PRO C 1 1 13 9102 1 1 21 PRO CA C 4.672 7.365 1.207 1.00 . A A . 18 PRO CA 1 1 13 9103 1 1 21 PRO CB C 5.466 7.663 2.482 1.00 . A A . 18 PRO CB 1 1 13 9104 1 1 21 PRO CD C 4.642 5.434 2.695 1.00 . A A . 18 PRO CD 1 1 13 9105 1 1 21 PRO CG C 5.785 6.332 3.064 1.00 . A A . 18 PRO CG 1 1 13 9106 1 1 21 PRO HA H 3.863 8.074 1.112 1.00 . A A . 18 PRO HA 1 1 13 9107 1 1 21 PRO HB2 H 6.364 8.208 2.229 1.00 . A A . 18 PRO HB2 1 1 13 9108 1 1 21 PRO HB3 H 4.862 8.252 3.156 1.00 . A A . 18 PRO HB3 1 1 13 9109 1 1 21 PRO HD2 H 4.989 4.420 2.556 1.00 . A A . 18 PRO HD2 1 1 13 9110 1 1 21 PRO HD3 H 3.871 5.472 3.449 1.00 . A A . 18 PRO HD3 1 1 13 9111 1 1 21 PRO HG2 H 6.708 5.959 2.643 1.00 . A A . 18 PRO HG2 1 1 13 9112 1 1 21 PRO HG3 H 5.868 6.411 4.138 1.00 . A A . 18 PRO HG3 1 1 13 9113 1 1 21 PRO N N 4.163 6.006 1.424 1.00 . A A . 18 PRO N 1 1 13 9114 1 1 21 PRO O O 5.885 8.559 -0.492 1.00 . A A . 18 PRO O 1 1 13 9115 1 1 22 ARG C C 6.013 5.826 -2.950 1.00 . A A . 19 ARG C 1 1 13 9116 1 1 22 ARG CA C 6.813 6.296 -1.743 1.00 . A A . 19 ARG CA 1 1 13 9117 1 1 22 ARG CB C 8.042 5.408 -1.547 1.00 . A A . 19 ARG CB 1 1 13 9118 1 1 22 ARG CD C 10.424 5.313 -0.724 1.00 . A A . 19 ARG CD 1 1 13 9119 1 1 22 ARG CG C 9.078 6.012 -0.613 1.00 . A A . 19 ARG CG 1 1 13 9120 1 1 22 ARG CZ C 12.723 5.766 0.075 1.00 . A A . 19 ARG CZ 1 1 13 9121 1 1 22 ARG H H 5.734 5.478 -0.115 1.00 . A A . 19 ARG H 1 1 13 9122 1 1 22 ARG HA H 7.144 7.308 -1.928 1.00 . A A . 19 ARG HA 1 1 13 9123 1 1 22 ARG HB2 H 7.724 4.462 -1.134 1.00 . A A . 19 ARG HB2 1 1 13 9124 1 1 22 ARG HB3 H 8.503 5.234 -2.506 1.00 . A A . 19 ARG HB3 1 1 13 9125 1 1 22 ARG HD2 H 10.294 4.265 -0.496 1.00 . A A . 19 ARG HD2 1 1 13 9126 1 1 22 ARG HD3 H 10.791 5.419 -1.735 1.00 . A A . 19 ARG HD3 1 1 13 9127 1 1 22 ARG HE H 11.046 6.393 0.970 1.00 . A A . 19 ARG HE 1 1 13 9128 1 1 22 ARG HG2 H 9.207 7.054 -0.860 1.00 . A A . 19 ARG HG2 1 1 13 9129 1 1 22 ARG HG3 H 8.722 5.923 0.404 1.00 . A A . 19 ARG HG3 1 1 13 9130 1 1 22 ARG HH11 H 12.640 4.700 -1.645 1.00 . A A . 19 ARG HH11 1 1 13 9131 1 1 22 ARG HH12 H 14.235 5.013 -1.047 1.00 . A A . 19 ARG HH12 1 1 13 9132 1 1 22 ARG HH21 H 13.142 6.815 1.764 1.00 . A A . 19 ARG HH21 1 1 13 9133 1 1 22 ARG HH22 H 14.524 6.218 0.898 1.00 . A A . 19 ARG HH22 1 1 13 9134 1 1 22 ARG N N 5.991 6.321 -0.545 1.00 . A A . 19 ARG N 1 1 13 9135 1 1 22 ARG NE N 11.402 5.885 0.200 1.00 . A A . 19 ARG NE 1 1 13 9136 1 1 22 ARG NH1 N 13.241 5.109 -0.954 1.00 . A A . 19 ARG NH1 1 1 13 9137 1 1 22 ARG NH2 N 13.527 6.309 0.984 1.00 . A A . 19 ARG NH2 1 1 13 9138 1 1 22 ARG O O 5.928 6.528 -3.953 1.00 . A A . 19 ARG O 1 1 13 9139 1 1 23 CYS C C 3.367 4.795 -4.211 1.00 . A A . 20 CYS C 1 1 13 9140 1 1 23 CYS CA C 4.687 4.073 -3.970 1.00 . A A . 20 CYS CA 1 1 13 9141 1 1 23 CYS CB C 4.399 2.589 -3.740 1.00 . A A . 20 CYS CB 1 1 13 9142 1 1 23 CYS H H 5.451 4.165 -1.996 1.00 . A A . 20 CYS H 1 1 13 9143 1 1 23 CYS HA H 5.302 4.182 -4.847 1.00 . A A . 20 CYS HA 1 1 13 9144 1 1 23 CYS HB2 H 3.778 2.487 -2.867 1.00 . A A . 20 CYS HB2 1 1 13 9145 1 1 23 CYS HB3 H 3.869 2.208 -4.594 1.00 . A A . 20 CYS HB3 1 1 13 9146 1 1 23 CYS N N 5.410 4.649 -2.844 1.00 . A A . 20 CYS N 1 1 13 9147 1 1 23 CYS O O 2.840 4.792 -5.322 1.00 . A A . 20 CYS O 1 1 13 9148 1 1 23 CYS SG S 5.850 1.546 -3.493 1.00 . A A . 20 CYS SG 1 1 13 9149 1 1 24 LEU C C 0.440 4.991 -3.338 1.00 . A A . 21 LEU C 1 1 13 9150 1 1 24 LEU CA C 1.531 6.036 -3.141 1.00 . A A . 21 LEU CA 1 1 13 9151 1 1 24 LEU CB C 1.411 7.142 -4.198 1.00 . A A . 21 LEU CB 1 1 13 9152 1 1 24 LEU CD1 C 1.958 9.507 -4.801 1.00 . A A . 21 LEU CD1 1 1 13 9153 1 1 24 LEU CD2 C 2.893 8.527 -2.698 1.00 . A A . 21 LEU CD2 1 1 13 9154 1 1 24 LEU CG C 2.475 8.245 -4.133 1.00 . A A . 21 LEU CG 1 1 13 9155 1 1 24 LEU H H 3.387 5.450 -2.328 1.00 . A A . 21 LEU H 1 1 13 9156 1 1 24 LEU HA H 1.396 6.477 -2.164 1.00 . A A . 21 LEU HA 1 1 13 9157 1 1 24 LEU HB2 H 1.462 6.682 -5.174 1.00 . A A . 21 LEU HB2 1 1 13 9158 1 1 24 LEU HB3 H 0.442 7.604 -4.090 1.00 . A A . 21 LEU HB3 1 1 13 9159 1 1 24 LEU HD11 H 2.719 10.273 -4.762 1.00 . A A . 21 LEU HD11 1 1 13 9160 1 1 24 LEU HD12 H 1.074 9.850 -4.283 1.00 . A A . 21 LEU HD12 1 1 13 9161 1 1 24 LEU HD13 H 1.714 9.295 -5.831 1.00 . A A . 21 LEU HD13 1 1 13 9162 1 1 24 LEU HD21 H 3.356 7.642 -2.282 1.00 . A A . 21 LEU HD21 1 1 13 9163 1 1 24 LEU HD22 H 2.025 8.790 -2.113 1.00 . A A . 21 LEU HD22 1 1 13 9164 1 1 24 LEU HD23 H 3.600 9.344 -2.682 1.00 . A A . 21 LEU HD23 1 1 13 9165 1 1 24 LEU HG H 3.349 7.919 -4.677 1.00 . A A . 21 LEU HG 1 1 13 9166 1 1 24 LEU N N 2.852 5.405 -3.148 1.00 . A A . 21 LEU N 1 1 13 9167 1 1 24 LEU O O -0.717 5.323 -3.596 1.00 . A A . 21 LEU O 1 1 13 9168 1 1 25 VAL C C -1.018 2.545 -2.130 1.00 . A A . 22 VAL C 1 1 13 9169 1 1 25 VAL CA C -0.107 2.630 -3.343 1.00 . A A . 22 VAL CA 1 1 13 9170 1 1 25 VAL CB C 0.626 1.282 -3.572 1.00 . A A . 22 VAL CB 1 1 13 9171 1 1 25 VAL CG1 C 1.480 0.889 -2.377 1.00 . A A . 22 VAL CG1 1 1 13 9172 1 1 25 VAL CG2 C -0.365 0.180 -3.906 1.00 . A A . 22 VAL CG2 1 1 13 9173 1 1 25 VAL H H 1.743 3.535 -2.973 1.00 . A A . 22 VAL H 1 1 13 9174 1 1 25 VAL HA H -0.714 2.834 -4.214 1.00 . A A . 22 VAL HA 1 1 13 9175 1 1 25 VAL HB H 1.283 1.402 -4.418 1.00 . A A . 22 VAL HB 1 1 13 9176 1 1 25 VAL HG11 H 2.027 -0.015 -2.606 1.00 . A A . 22 VAL HG11 1 1 13 9177 1 1 25 VAL HG12 H 0.843 0.716 -1.522 1.00 . A A . 22 VAL HG12 1 1 13 9178 1 1 25 VAL HG13 H 2.173 1.682 -2.153 1.00 . A A . 22 VAL HG13 1 1 13 9179 1 1 25 VAL HG21 H -0.891 0.435 -4.813 1.00 . A A . 22 VAL HG21 1 1 13 9180 1 1 25 VAL HG22 H -1.072 0.075 -3.096 1.00 . A A . 22 VAL HG22 1 1 13 9181 1 1 25 VAL HG23 H 0.165 -0.749 -4.045 1.00 . A A . 22 VAL HG23 1 1 13 9182 1 1 25 VAL N N 0.819 3.728 -3.190 1.00 . A A . 22 VAL N 1 1 13 9183 1 1 25 VAL O O -0.561 2.451 -0.986 1.00 . A A . 22 VAL O 1 1 13 9184 1 1 26 GLN C C -3.510 1.105 -0.937 1.00 . A A . 23 GLN C 1 1 13 9185 1 1 26 GLN CA C -3.302 2.555 -1.346 1.00 . A A . 23 GLN CA 1 1 13 9186 1 1 26 GLN CB C -4.609 3.176 -1.823 1.00 . A A . 23 GLN CB 1 1 13 9187 1 1 26 GLN CD C -5.803 5.256 -2.613 1.00 . A A . 23 GLN CD 1 1 13 9188 1 1 26 GLN CG C -4.476 4.632 -2.230 1.00 . A A . 23 GLN CG 1 1 13 9189 1 1 26 GLN H H -2.585 2.784 -3.318 1.00 . A A . 23 GLN H 1 1 13 9190 1 1 26 GLN HA H -2.940 3.106 -0.490 1.00 . A A . 23 GLN HA 1 1 13 9191 1 1 26 GLN HB2 H -4.971 2.618 -2.671 1.00 . A A . 23 GLN HB2 1 1 13 9192 1 1 26 GLN HB3 H -5.334 3.114 -1.027 1.00 . A A . 23 GLN HB3 1 1 13 9193 1 1 26 GLN HE21 H -6.479 3.507 -3.272 1.00 . A A . 23 GLN HE21 1 1 13 9194 1 1 26 GLN HE22 H -7.583 4.833 -3.393 1.00 . A A . 23 GLN HE22 1 1 13 9195 1 1 26 GLN HG2 H -4.063 5.186 -1.400 1.00 . A A . 23 GLN HG2 1 1 13 9196 1 1 26 GLN HG3 H -3.805 4.695 -3.072 1.00 . A A . 23 GLN HG3 1 1 13 9197 1 1 26 GLN N N -2.301 2.641 -2.390 1.00 . A A . 23 GLN N 1 1 13 9198 1 1 26 GLN NE2 N -6.711 4.454 -3.149 1.00 . A A . 23 GLN NE2 1 1 13 9199 1 1 26 GLN O O -4.255 0.359 -1.567 1.00 . A A . 23 GLN O 1 1 13 9200 1 1 26 GLN OE1 O -6.010 6.455 -2.431 1.00 . A A . 23 GLN OE1 1 1 13 9201 1 1 27 THR C C -3.978 -0.837 1.626 1.00 . A A . 24 THR C 1 1 13 9202 1 1 27 THR CA C -2.860 -0.647 0.607 1.00 . A A . 24 THR CA 1 1 13 9203 1 1 27 THR CB C -1.510 -0.998 1.245 1.00 . A A . 24 THR CB 1 1 13 9204 1 1 27 THR CG2 C -0.510 -1.450 0.195 1.00 . A A . 24 THR CG2 1 1 13 9205 1 1 27 THR H H -2.287 1.376 0.596 1.00 . A A . 24 THR H 1 1 13 9206 1 1 27 THR HA H -3.025 -1.307 -0.232 1.00 . A A . 24 THR HA 1 1 13 9207 1 1 27 THR HB H -1.658 -1.801 1.954 1.00 . A A . 24 THR HB 1 1 13 9208 1 1 27 THR HG1 H -0.281 -0.122 2.527 1.00 . A A . 24 THR HG1 1 1 13 9209 1 1 27 THR HG21 H 0.433 -1.675 0.670 1.00 . A A . 24 THR HG21 1 1 13 9210 1 1 27 THR HG22 H -0.369 -0.663 -0.532 1.00 . A A . 24 THR HG22 1 1 13 9211 1 1 27 THR HG23 H -0.884 -2.334 -0.296 1.00 . A A . 24 THR HG23 1 1 13 9212 1 1 27 THR N N -2.829 0.715 0.118 1.00 . A A . 24 THR N 1 1 13 9213 1 1 27 THR O O -4.421 0.115 2.261 1.00 . A A . 24 THR O 1 1 13 9214 1 1 27 THR OG1 O -1.001 0.147 1.934 1.00 . A A . 24 THR OG1 1 1 13 9215 1 1 28 CYS C C -5.014 -2.532 4.103 1.00 . A A . 25 CYS C 1 1 13 9216 1 1 28 CYS CA C -5.532 -2.381 2.682 1.00 . A A . 25 CYS CA 1 1 13 9217 1 1 28 CYS CB C -6.237 -3.672 2.260 1.00 . A A . 25 CYS CB 1 1 13 9218 1 1 28 CYS H H -4.033 -2.792 1.248 1.00 . A A . 25 CYS H 1 1 13 9219 1 1 28 CYS HA H -6.236 -1.565 2.650 1.00 . A A . 25 CYS HA 1 1 13 9220 1 1 28 CYS HB2 H -7.105 -3.819 2.885 1.00 . A A . 25 CYS HB2 1 1 13 9221 1 1 28 CYS HB3 H -6.554 -3.582 1.235 1.00 . A A . 25 CYS HB3 1 1 13 9222 1 1 28 CYS N N -4.437 -2.072 1.769 1.00 . A A . 25 CYS N 1 1 13 9223 1 1 28 CYS O O -5.731 -2.282 5.072 1.00 . A A . 25 CYS O 1 1 13 9224 1 1 28 CYS SG S -5.213 -5.158 2.394 1.00 . A A . 25 CYS SG 1 1 13 9225 1 1 29 SER C C -1.683 -2.906 5.475 1.00 . A A . 26 SER C 1 1 13 9226 1 1 29 SER CA C -3.167 -3.207 5.505 1.00 . A A . 26 SER CA 1 1 13 9227 1 1 29 SER CB C -3.382 -4.673 5.871 1.00 . A A . 26 SER CB 1 1 13 9228 1 1 29 SER H H -3.224 -3.072 3.407 1.00 . A A . 26 SER H 1 1 13 9229 1 1 29 SER HA H -3.650 -2.576 6.239 1.00 . A A . 26 SER HA 1 1 13 9230 1 1 29 SER HB2 H -2.871 -4.890 6.795 1.00 . A A . 26 SER HB2 1 1 13 9231 1 1 29 SER HB3 H -4.433 -4.866 5.987 1.00 . A A . 26 SER HB3 1 1 13 9232 1 1 29 SER HG H -3.531 -6.191 4.630 1.00 . A A . 26 SER HG 1 1 13 9233 1 1 29 SER N N -3.762 -2.941 4.215 1.00 . A A . 26 SER N 1 1 13 9234 1 1 29 SER O O -1.126 -2.605 4.415 1.00 . A A . 26 SER O 1 1 13 9235 1 1 29 SER OG O -2.870 -5.522 4.853 1.00 . A A . 26 SER OG 1 1 13 9236 1 1 30 LEU C C 1.060 -4.048 6.025 1.00 . A A . 27 LEU C 1 1 13 9237 1 1 30 LEU CA C 0.400 -2.850 6.707 1.00 . A A . 27 LEU CA 1 1 13 9238 1 1 30 LEU CB C 0.832 -2.734 8.179 1.00 . A A . 27 LEU CB 1 1 13 9239 1 1 30 LEU CD1 C 3.348 -2.605 7.960 1.00 . A A . 27 LEU CD1 1 1 13 9240 1 1 30 LEU CD2 C 1.983 -0.519 7.844 1.00 . A A . 27 LEU CD2 1 1 13 9241 1 1 30 LEU CG C 2.098 -1.904 8.462 1.00 . A A . 27 LEU CG 1 1 13 9242 1 1 30 LEU H H -1.548 -3.201 7.445 1.00 . A A . 27 LEU H 1 1 13 9243 1 1 30 LEU HA H 0.669 -1.949 6.178 1.00 . A A . 27 LEU HA 1 1 13 9244 1 1 30 LEU HB2 H 0.015 -2.294 8.731 1.00 . A A . 27 LEU HB2 1 1 13 9245 1 1 30 LEU HB3 H 0.996 -3.732 8.558 1.00 . A A . 27 LEU HB3 1 1 13 9246 1 1 30 LEU HD11 H 3.453 -3.556 8.460 1.00 . A A . 27 LEU HD11 1 1 13 9247 1 1 30 LEU HD12 H 4.212 -1.991 8.167 1.00 . A A . 27 LEU HD12 1 1 13 9248 1 1 30 LEU HD13 H 3.267 -2.765 6.895 1.00 . A A . 27 LEU HD13 1 1 13 9249 1 1 30 LEU HD21 H 1.954 -0.603 6.768 1.00 . A A . 27 LEU HD21 1 1 13 9250 1 1 30 LEU HD22 H 2.834 0.078 8.135 1.00 . A A . 27 LEU HD22 1 1 13 9251 1 1 30 LEU HD23 H 1.076 -0.045 8.191 1.00 . A A . 27 LEU HD23 1 1 13 9252 1 1 30 LEU HG H 2.200 -1.780 9.531 1.00 . A A . 27 LEU HG 1 1 13 9253 1 1 30 LEU N N -1.041 -3.008 6.627 1.00 . A A . 27 LEU N 1 1 13 9254 1 1 30 LEU O O 2.174 -3.955 5.511 1.00 . A A . 27 LEU O 1 1 13 9255 1 1 31 GLU C C 1.078 -6.163 3.868 1.00 . A A . 28 GLU C 1 1 13 9256 1 1 31 GLU CA C 0.820 -6.382 5.357 1.00 . A A . 28 GLU CA 1 1 13 9257 1 1 31 GLU CB C -0.182 -7.516 5.565 1.00 . A A . 28 GLU CB 1 1 13 9258 1 1 31 GLU CD C -0.731 -9.950 5.239 1.00 . A A . 28 GLU CD 1 1 13 9259 1 1 31 GLU CG C 0.279 -8.850 5.010 1.00 . A A . 28 GLU CG 1 1 13 9260 1 1 31 GLU H H -0.574 -5.153 6.367 1.00 . A A . 28 GLU H 1 1 13 9261 1 1 31 GLU HA H 1.751 -6.642 5.835 1.00 . A A . 28 GLU HA 1 1 13 9262 1 1 31 GLU HB2 H -0.359 -7.634 6.624 1.00 . A A . 28 GLU HB2 1 1 13 9263 1 1 31 GLU HB3 H -1.111 -7.251 5.081 1.00 . A A . 28 GLU HB3 1 1 13 9264 1 1 31 GLU HG2 H 0.443 -8.749 3.947 1.00 . A A . 28 GLU HG2 1 1 13 9265 1 1 31 GLU HG3 H 1.205 -9.126 5.493 1.00 . A A . 28 GLU HG3 1 1 13 9266 1 1 31 GLU N N 0.329 -5.158 5.976 1.00 . A A . 28 GLU N 1 1 13 9267 1 1 31 GLU O O 2.160 -6.459 3.365 1.00 . A A . 28 GLU O 1 1 13 9268 1 1 31 GLU OE1 O -1.729 -10.012 4.491 1.00 . A A . 28 GLU OE1 1 1 13 9269 1 1 31 GLU OE2 O -0.526 -10.771 6.157 1.00 . A A . 28 GLU OE2 1 1 13 9270 1 1 32 CYS C C 1.231 -4.156 1.561 1.00 . A A . 29 CYS C 1 1 13 9271 1 1 32 CYS CA C 0.249 -5.310 1.756 1.00 . A A . 29 CYS CA 1 1 13 9272 1 1 32 CYS CB C -1.105 -4.971 1.138 1.00 . A A . 29 CYS CB 1 1 13 9273 1 1 32 CYS H H -0.760 -5.421 3.611 1.00 . A A . 29 CYS H 1 1 13 9274 1 1 32 CYS HA H 0.645 -6.189 1.271 1.00 . A A . 29 CYS HA 1 1 13 9275 1 1 32 CYS HB2 H -1.680 -4.402 1.856 1.00 . A A . 29 CYS HB2 1 1 13 9276 1 1 32 CYS HB3 H -0.951 -4.366 0.260 1.00 . A A . 29 CYS HB3 1 1 13 9277 1 1 32 CYS N N 0.092 -5.618 3.169 1.00 . A A . 29 CYS N 1 1 13 9278 1 1 32 CYS O O 1.849 -4.027 0.504 1.00 . A A . 29 CYS O 1 1 13 9279 1 1 32 CYS SG S -2.104 -6.404 0.658 1.00 . A A . 29 CYS SG 1 1 13 9280 1 1 33 SER C C 3.747 -2.676 2.564 1.00 . A A . 30 SER C 1 1 13 9281 1 1 33 SER CA C 2.300 -2.199 2.540 1.00 . A A . 30 SER CA 1 1 13 9282 1 1 33 SER CB C 2.042 -1.249 3.710 1.00 . A A . 30 SER CB 1 1 13 9283 1 1 33 SER H H 0.866 -3.486 3.408 1.00 . A A . 30 SER H 1 1 13 9284 1 1 33 SER HA H 2.127 -1.672 1.615 1.00 . A A . 30 SER HA 1 1 13 9285 1 1 33 SER HB2 H 2.245 -1.760 4.638 1.00 . A A . 30 SER HB2 1 1 13 9286 1 1 33 SER HB3 H 2.691 -0.389 3.622 1.00 . A A . 30 SER HB3 1 1 13 9287 1 1 33 SER HG H 0.136 -1.483 4.120 1.00 . A A . 30 SER HG 1 1 13 9288 1 1 33 SER N N 1.381 -3.330 2.590 1.00 . A A . 30 SER N 1 1 13 9289 1 1 33 SER O O 4.647 -1.981 2.099 1.00 . A A . 30 SER O 1 1 13 9290 1 1 33 SER OG O 0.696 -0.806 3.717 1.00 . A A . 30 SER OG 1 1 13 9291 1 1 34 LYS C C 5.460 -5.538 2.117 1.00 . A A . 31 LYS C 1 1 13 9292 1 1 34 LYS CA C 5.305 -4.430 3.152 1.00 . A A . 31 LYS CA 1 1 13 9293 1 1 34 LYS CB C 5.623 -4.945 4.557 1.00 . A A . 31 LYS CB 1 1 13 9294 1 1 34 LYS CD C 5.138 -6.537 6.426 1.00 . A A . 31 LYS CD 1 1 13 9295 1 1 34 LYS CE C 4.259 -7.668 6.925 1.00 . A A . 31 LYS CE 1 1 13 9296 1 1 34 LYS CG C 4.737 -6.082 5.033 1.00 . A A . 31 LYS CG 1 1 13 9297 1 1 34 LYS H H 3.219 -4.368 3.492 1.00 . A A . 31 LYS H 1 1 13 9298 1 1 34 LYS HA H 5.998 -3.639 2.908 1.00 . A A . 31 LYS HA 1 1 13 9299 1 1 34 LYS HB2 H 6.644 -5.288 4.577 1.00 . A A . 31 LYS HB2 1 1 13 9300 1 1 34 LYS HB3 H 5.517 -4.125 5.253 1.00 . A A . 31 LYS HB3 1 1 13 9301 1 1 34 LYS HD2 H 6.163 -6.876 6.402 1.00 . A A . 31 LYS HD2 1 1 13 9302 1 1 34 LYS HD3 H 5.051 -5.701 7.105 1.00 . A A . 31 LYS HD3 1 1 13 9303 1 1 34 LYS HE2 H 3.244 -7.312 7.003 1.00 . A A . 31 LYS HE2 1 1 13 9304 1 1 34 LYS HE3 H 4.301 -8.480 6.214 1.00 . A A . 31 LYS HE3 1 1 13 9305 1 1 34 LYS HG2 H 3.711 -5.745 5.056 1.00 . A A . 31 LYS HG2 1 1 13 9306 1 1 34 LYS HG3 H 4.833 -6.913 4.350 1.00 . A A . 31 LYS HG3 1 1 13 9307 1 1 34 LYS HZ1 H 4.068 -8.919 8.583 1.00 . A A . 31 LYS HZ1 1 1 13 9308 1 1 34 LYS HZ2 H 4.687 -7.391 8.947 1.00 . A A . 31 LYS HZ2 1 1 13 9309 1 1 34 LYS HZ3 H 5.668 -8.542 8.192 1.00 . A A . 31 LYS HZ3 1 1 13 9310 1 1 34 LYS N N 3.969 -3.865 3.106 1.00 . A A . 31 LYS N 1 1 13 9311 1 1 34 LYS NZ N 4.701 -8.163 8.253 1.00 . A A . 31 LYS NZ 1 1 13 9312 1 1 34 LYS O O 6.563 -6.037 1.882 1.00 . A A . 31 LYS O 1 1 13 9313 1 1 35 LYS C C 5.100 -6.446 -0.779 1.00 . A A . 32 LYS C 1 1 13 9314 1 1 35 LYS CA C 4.346 -6.923 0.453 1.00 . A A . 32 LYS CA 1 1 13 9315 1 1 35 LYS CB C 2.909 -7.283 0.082 1.00 . A A . 32 LYS CB 1 1 13 9316 1 1 35 LYS CD C 1.394 -9.079 -0.775 1.00 . A A . 32 LYS CD 1 1 13 9317 1 1 35 LYS CE C 1.245 -10.279 -1.699 1.00 . A A . 32 LYS CE 1 1 13 9318 1 1 35 LYS CG C 2.794 -8.499 -0.823 1.00 . A A . 32 LYS CG 1 1 13 9319 1 1 35 LYS H H 3.505 -5.463 1.724 1.00 . A A . 32 LYS H 1 1 13 9320 1 1 35 LYS HA H 4.837 -7.800 0.851 1.00 . A A . 32 LYS HA 1 1 13 9321 1 1 35 LYS HB2 H 2.352 -7.477 0.984 1.00 . A A . 32 LYS HB2 1 1 13 9322 1 1 35 LYS HB3 H 2.464 -6.441 -0.430 1.00 . A A . 32 LYS HB3 1 1 13 9323 1 1 35 LYS HD2 H 1.183 -9.389 0.238 1.00 . A A . 32 LYS HD2 1 1 13 9324 1 1 35 LYS HD3 H 0.689 -8.317 -1.072 1.00 . A A . 32 LYS HD3 1 1 13 9325 1 1 35 LYS HE2 H 2.049 -10.971 -1.498 1.00 . A A . 32 LYS HE2 1 1 13 9326 1 1 35 LYS HE3 H 0.300 -10.760 -1.492 1.00 . A A . 32 LYS HE3 1 1 13 9327 1 1 35 LYS HG2 H 3.019 -8.205 -1.838 1.00 . A A . 32 LYS HG2 1 1 13 9328 1 1 35 LYS HG3 H 3.498 -9.249 -0.496 1.00 . A A . 32 LYS HG3 1 1 13 9329 1 1 35 LYS HZ1 H 0.525 -9.220 -3.349 1.00 . A A . 32 LYS HZ1 1 1 13 9330 1 1 35 LYS HZ2 H 1.167 -10.733 -3.736 1.00 . A A . 32 LYS HZ2 1 1 13 9331 1 1 35 LYS HZ3 H 2.200 -9.449 -3.364 1.00 . A A . 32 LYS HZ3 1 1 13 9332 1 1 35 LYS N N 4.351 -5.896 1.483 1.00 . A A . 32 LYS N 1 1 13 9333 1 1 35 LYS NZ N 1.287 -9.893 -3.135 1.00 . A A . 32 LYS NZ 1 1 13 9334 1 1 35 LYS O O 5.885 -7.188 -1.368 1.00 . A A . 32 LYS O 1 1 13 9335 1 1 36 HIS C C 7.016 -4.383 -2.073 1.00 . A A . 33 HIS C 1 1 13 9336 1 1 36 HIS CA C 5.528 -4.636 -2.333 1.00 . A A . 33 HIS CA 1 1 13 9337 1 1 36 HIS CB C 4.822 -3.348 -2.809 1.00 . A A . 33 HIS CB 1 1 13 9338 1 1 36 HIS CD2 C 6.018 -1.560 -1.364 1.00 . A A . 33 HIS CD2 1 1 13 9339 1 1 36 HIS CE1 C 4.315 -0.478 -0.618 1.00 . A A . 33 HIS CE1 1 1 13 9340 1 1 36 HIS CG C 4.925 -2.171 -1.875 1.00 . A A . 33 HIS CG 1 1 13 9341 1 1 36 HIS H H 4.251 -4.638 -0.638 1.00 . A A . 33 HIS H 1 1 13 9342 1 1 36 HIS HA H 5.450 -5.376 -3.117 1.00 . A A . 33 HIS HA 1 1 13 9343 1 1 36 HIS HB2 H 5.245 -3.050 -3.755 1.00 . A A . 33 HIS HB2 1 1 13 9344 1 1 36 HIS HB3 H 3.771 -3.564 -2.950 1.00 . A A . 33 HIS HB3 1 1 13 9345 1 1 36 HIS HD1 H 2.900 -1.672 -1.568 1.00 . A A . 33 HIS HD1 1 1 13 9346 1 1 36 HIS HD2 H 7.039 -1.857 -1.536 1.00 . A A . 33 HIS HD2 1 1 13 9347 1 1 36 HIS HE1 H 3.693 0.203 -0.061 1.00 . A A . 33 HIS HE1 1 1 13 9348 1 1 36 HIS N N 4.876 -5.193 -1.155 1.00 . A A . 33 HIS N 1 1 13 9349 1 1 36 HIS ND1 N 3.846 -1.474 -1.387 1.00 . A A . 33 HIS ND1 1 1 13 9350 1 1 36 HIS NE2 N 5.635 -0.480 -0.577 1.00 . A A . 33 HIS NE2 1 1 13 9351 1 1 36 HIS O O 7.804 -4.265 -3.006 1.00 . A A . 33 HIS O 1 1 13 9352 1 1 37 LYS C C 9.706 -5.179 -0.776 1.00 . A A . 34 LYS C 1 1 13 9353 1 1 37 LYS CA C 8.782 -4.020 -0.438 1.00 . A A . 34 LYS CA 1 1 13 9354 1 1 37 LYS CB C 8.895 -3.710 1.056 1.00 . A A . 34 LYS CB 1 1 13 9355 1 1 37 LYS CD C 8.177 -2.332 3.020 1.00 . A A . 34 LYS CD 1 1 13 9356 1 1 37 LYS CE C 7.324 -1.172 3.501 1.00 . A A . 34 LYS CE 1 1 13 9357 1 1 37 LYS CG C 8.055 -2.532 1.518 1.00 . A A . 34 LYS CG 1 1 13 9358 1 1 37 LYS H H 6.757 -4.539 -0.093 1.00 . A A . 34 LYS H 1 1 13 9359 1 1 37 LYS HA H 9.087 -3.151 -1.003 1.00 . A A . 34 LYS HA 1 1 13 9360 1 1 37 LYS HB2 H 8.587 -4.581 1.614 1.00 . A A . 34 LYS HB2 1 1 13 9361 1 1 37 LYS HB3 H 9.929 -3.495 1.289 1.00 . A A . 34 LYS HB3 1 1 13 9362 1 1 37 LYS HD2 H 7.858 -3.233 3.521 1.00 . A A . 34 LYS HD2 1 1 13 9363 1 1 37 LYS HD3 H 9.210 -2.132 3.263 1.00 . A A . 34 LYS HD3 1 1 13 9364 1 1 37 LYS HE2 H 7.710 -0.261 3.073 1.00 . A A . 34 LYS HE2 1 1 13 9365 1 1 37 LYS HE3 H 6.306 -1.323 3.164 1.00 . A A . 34 LYS HE3 1 1 13 9366 1 1 37 LYS HG2 H 8.396 -1.639 1.015 1.00 . A A . 34 LYS HG2 1 1 13 9367 1 1 37 LYS HG3 H 7.022 -2.719 1.269 1.00 . A A . 34 LYS HG3 1 1 13 9368 1 1 37 LYS HZ1 H 8.309 -0.952 5.333 1.00 . A A . 34 LYS HZ1 1 1 13 9369 1 1 37 LYS HZ2 H 6.908 -1.891 5.421 1.00 . A A . 34 LYS HZ2 1 1 13 9370 1 1 37 LYS HZ3 H 6.789 -0.213 5.280 1.00 . A A . 34 LYS HZ3 1 1 13 9371 1 1 37 LYS N N 7.405 -4.338 -0.802 1.00 . A A . 34 LYS N 1 1 13 9372 1 1 37 LYS NZ N 7.334 -1.049 4.986 1.00 . A A . 34 LYS NZ 1 1 13 9373 1 1 37 LYS O O 10.857 -4.980 -1.158 1.00 . A A . 34 LYS O 1 1 13 9374 1 1 38 THR C C 10.026 -8.070 -2.243 1.00 . A A . 35 THR C 1 1 13 9375 1 1 38 THR CA C 9.987 -7.587 -0.792 1.00 . A A . 35 THR CA 1 1 13 9376 1 1 38 THR CB C 9.445 -8.706 0.126 1.00 . A A . 35 THR CB 1 1 13 9377 1 1 38 THR CG2 C 8.137 -9.270 -0.412 1.00 . A A . 35 THR CG2 1 1 13 9378 1 1 38 THR H H 8.222 -6.475 -0.462 1.00 . A A . 35 THR H 1 1 13 9379 1 1 38 THR HA H 10.992 -7.348 -0.479 1.00 . A A . 35 THR HA 1 1 13 9380 1 1 38 THR HB H 9.257 -8.282 1.100 1.00 . A A . 35 THR HB 1 1 13 9381 1 1 38 THR HG1 H 10.457 -10.248 -0.585 1.00 . A A . 35 THR HG1 1 1 13 9382 1 1 38 THR HG21 H 8.294 -9.659 -1.407 1.00 . A A . 35 THR HG21 1 1 13 9383 1 1 38 THR HG22 H 7.392 -8.487 -0.444 1.00 . A A . 35 THR HG22 1 1 13 9384 1 1 38 THR HG23 H 7.794 -10.065 0.234 1.00 . A A . 35 THR HG23 1 1 13 9385 1 1 38 THR N N 9.181 -6.387 -0.654 1.00 . A A . 35 THR N 1 1 13 9386 1 1 38 THR O O 10.628 -9.099 -2.552 1.00 . A A . 35 THR O 1 1 13 9387 1 1 38 THR OG1 O 10.403 -9.766 0.252 1.00 . A A . 35 THR OG1 1 1 13 9388 1 1 39 ARG C C 9.734 -6.530 -5.439 1.00 . A A . 36 ARG C 1 1 13 9389 1 1 39 ARG CA C 9.338 -7.694 -4.537 1.00 . A A . 36 ARG CA 1 1 13 9390 1 1 39 ARG CB C 7.937 -8.188 -4.906 1.00 . A A . 36 ARG CB 1 1 13 9391 1 1 39 ARG CD C 5.504 -7.616 -5.127 1.00 . A A . 36 ARG CD 1 1 13 9392 1 1 39 ARG CG C 6.825 -7.240 -4.486 1.00 . A A . 36 ARG CG 1 1 13 9393 1 1 39 ARG CZ C 4.758 -8.121 -7.424 1.00 . A A . 36 ARG CZ 1 1 13 9394 1 1 39 ARG H H 8.943 -6.503 -2.832 1.00 . A A . 36 ARG H 1 1 13 9395 1 1 39 ARG HA H 10.040 -8.499 -4.687 1.00 . A A . 36 ARG HA 1 1 13 9396 1 1 39 ARG HB2 H 7.885 -8.318 -5.976 1.00 . A A . 36 ARG HB2 1 1 13 9397 1 1 39 ARG HB3 H 7.768 -9.142 -4.428 1.00 . A A . 36 ARG HB3 1 1 13 9398 1 1 39 ARG HD2 H 5.281 -8.644 -4.886 1.00 . A A . 36 ARG HD2 1 1 13 9399 1 1 39 ARG HD3 H 4.729 -6.976 -4.731 1.00 . A A . 36 ARG HD3 1 1 13 9400 1 1 39 ARG HE H 6.215 -6.838 -6.946 1.00 . A A . 36 ARG HE 1 1 13 9401 1 1 39 ARG HG2 H 6.719 -7.279 -3.412 1.00 . A A . 36 ARG HG2 1 1 13 9402 1 1 39 ARG HG3 H 7.089 -6.237 -4.787 1.00 . A A . 36 ARG HG3 1 1 13 9403 1 1 39 ARG HH11 H 3.737 -9.119 -5.982 1.00 . A A . 36 ARG HH11 1 1 13 9404 1 1 39 ARG HH12 H 3.255 -9.464 -7.611 1.00 . A A . 36 ARG HH12 1 1 13 9405 1 1 39 ARG HH21 H 5.572 -7.278 -9.077 1.00 . A A . 36 ARG HH21 1 1 13 9406 1 1 39 ARG HH22 H 4.293 -8.413 -9.375 1.00 . A A . 36 ARG HH22 1 1 13 9407 1 1 39 ARG N N 9.389 -7.321 -3.130 1.00 . A A . 36 ARG N 1 1 13 9408 1 1 39 ARG NE N 5.550 -7.466 -6.578 1.00 . A A . 36 ARG NE 1 1 13 9409 1 1 39 ARG NH1 N 3.843 -8.967 -6.969 1.00 . A A . 36 ARG NH1 1 1 13 9410 1 1 39 ARG NH2 N 4.885 -7.921 -8.728 1.00 . A A . 36 ARG NH2 1 1 13 9411 1 1 39 ARG O O 10.367 -6.726 -6.476 1.00 . A A . 36 ARG O 1 1 13 9412 1 1 40 ASP C C 10.764 -3.324 -5.299 1.00 . A A . 37 ASP C 1 1 13 9413 1 1 40 ASP CA C 9.605 -4.141 -5.861 1.00 . A A . 37 ASP CA 1 1 13 9414 1 1 40 ASP CB C 8.331 -3.291 -5.930 1.00 . A A . 37 ASP CB 1 1 13 9415 1 1 40 ASP CG C 8.448 -2.104 -6.865 1.00 . A A . 37 ASP CG 1 1 13 9416 1 1 40 ASP H H 8.912 -5.216 -4.179 1.00 . A A . 37 ASP H 1 1 13 9417 1 1 40 ASP HA H 9.862 -4.473 -6.856 1.00 . A A . 37 ASP HA 1 1 13 9418 1 1 40 ASP HB2 H 7.514 -3.909 -6.270 1.00 . A A . 37 ASP HB2 1 1 13 9419 1 1 40 ASP HB3 H 8.103 -2.921 -4.938 1.00 . A A . 37 ASP HB3 1 1 13 9420 1 1 40 ASP N N 9.363 -5.322 -5.042 1.00 . A A . 37 ASP N 1 1 13 9421 1 1 40 ASP O O 11.219 -2.363 -5.919 1.00 . A A . 37 ASP O 1 1 13 9422 1 1 40 ASP OD1 O 8.463 -2.313 -8.093 1.00 . A A . 37 ASP OD1 1 1 13 9423 1 1 40 ASP OD2 O 8.480 -0.955 -6.378 1.00 . A A . 37 ASP OD2 1 1 13 9424 1 1 41 ASN C C 11.878 -1.644 -3.017 1.00 . A A . 38 ASN C 1 1 13 9425 1 1 41 ASN CA C 12.318 -3.048 -3.416 1.00 . A A . 38 ASN CA 1 1 13 9426 1 1 41 ASN CB C 13.595 -2.990 -4.261 1.00 . A A . 38 ASN CB 1 1 13 9427 1 1 41 ASN CG C 14.743 -2.307 -3.539 1.00 . A A . 38 ASN CG 1 1 13 9428 1 1 41 ASN H H 10.877 -4.562 -3.730 1.00 . A A . 38 ASN H 1 1 13 9429 1 1 41 ASN HA H 12.525 -3.607 -2.515 1.00 . A A . 38 ASN HA 1 1 13 9430 1 1 41 ASN HB2 H 13.897 -3.996 -4.510 1.00 . A A . 38 ASN HB2 1 1 13 9431 1 1 41 ASN HB3 H 13.391 -2.446 -5.173 1.00 . A A . 38 ASN HB3 1 1 13 9432 1 1 41 ASN HD21 H 15.512 -1.710 -5.268 1.00 . A A . 38 ASN HD21 1 1 13 9433 1 1 41 ASN HD22 H 16.391 -1.248 -3.853 1.00 . A A . 38 ASN HD22 1 1 13 9434 1 1 41 ASN N N 11.247 -3.745 -4.126 1.00 . A A . 38 ASN N 1 1 13 9435 1 1 41 ASN ND2 N 15.636 -1.693 -4.295 1.00 . A A . 38 ASN ND2 1 1 13 9436 1 1 41 ASN O O 12.077 -0.680 -3.752 1.00 . A A . 38 ASN O 1 1 13 9437 1 1 41 ASN OD1 O 14.831 -2.335 -2.310 1.00 . A A . 38 ASN OD1 1 1 13 9438 1 1 42 CYS C C 11.107 -0.118 0.125 1.00 . A A . 39 CYS C 1 1 13 9439 1 1 42 CYS CA C 10.788 -0.264 -1.355 1.00 . A A . 39 CYS CA 1 1 13 9440 1 1 42 CYS CB C 9.280 -0.143 -1.583 1.00 . A A . 39 CYS CB 1 1 13 9441 1 1 42 CYS H H 11.162 -2.338 -1.292 1.00 . A A . 39 CYS H 1 1 13 9442 1 1 42 CYS HA H 11.293 0.516 -1.902 1.00 . A A . 39 CYS HA 1 1 13 9443 1 1 42 CYS HB2 H 9.078 -0.195 -2.643 1.00 . A A . 39 CYS HB2 1 1 13 9444 1 1 42 CYS HB3 H 8.786 -0.965 -1.089 1.00 . A A . 39 CYS HB3 1 1 13 9445 1 1 42 CYS N N 11.273 -1.539 -1.847 1.00 . A A . 39 CYS N 1 1 13 9446 1 1 42 CYS O O 10.970 -1.070 0.896 1.00 . A A . 39 CYS O 1 1 13 9447 1 1 42 CYS SG S 8.546 1.392 -0.962 1.00 . A A . 39 CYS SG 1 1 13 9448 1 1 43 SER C C 10.557 1.803 2.623 1.00 . A A . 40 SER C 1 1 13 9449 1 1 43 SER CA C 11.831 1.353 1.907 1.00 . A A . 40 SER CA 1 1 13 9450 1 1 43 SER CB C 12.916 2.424 2.015 1.00 . A A . 40 SER CB 1 1 13 9451 1 1 43 SER H H 11.705 1.767 -0.161 1.00 . A A . 40 SER H 1 1 13 9452 1 1 43 SER HA H 12.185 0.441 2.367 1.00 . A A . 40 SER HA 1 1 13 9453 1 1 43 SER HB2 H 12.520 3.370 1.676 1.00 . A A . 40 SER HB2 1 1 13 9454 1 1 43 SER HB3 H 13.234 2.513 3.044 1.00 . A A . 40 SER HB3 1 1 13 9455 1 1 43 SER HG H 13.968 1.162 0.939 1.00 . A A . 40 SER HG 1 1 13 9456 1 1 43 SER N N 11.550 1.068 0.514 1.00 . A A . 40 SER N 1 1 13 9457 1 1 43 SER O O 10.492 1.835 3.850 1.00 . A A . 40 SER O 1 1 13 9458 1 1 43 SER OG O 14.037 2.086 1.215 1.00 . A A . 40 SER OG 1 1 13 9459 1 1 44 GLY C C 8.208 3.594 3.335 1.00 . A A . 41 GLY C 1 1 13 9460 1 1 44 GLY CA C 8.222 2.482 2.312 1.00 . A A . 41 GLY CA 1 1 13 9461 1 1 44 GLY H H 9.710 2.153 0.844 1.00 . A A . 41 GLY H 1 1 13 9462 1 1 44 GLY HA2 H 7.606 2.779 1.477 1.00 . A A . 41 GLY HA2 1 1 13 9463 1 1 44 GLY HA3 H 7.791 1.600 2.757 1.00 . A A . 41 GLY HA3 1 1 13 9464 1 1 44 GLY N N 9.550 2.146 1.814 1.00 . A A . 41 GLY N 1 1 13 9465 1 1 44 GLY O O 7.416 3.559 4.274 1.00 . A A . 41 GLY O 1 1 13 9466 1 1 45 GLN C C 9.686 6.912 3.415 1.00 . A A . 42 GLN C 1 1 13 9467 1 1 45 GLN CA C 9.176 5.668 4.110 1.00 . A A . 42 GLN CA 1 1 13 9468 1 1 45 GLN CB C 10.134 5.265 5.231 1.00 . A A . 42 GLN CB 1 1 13 9469 1 1 45 GLN CD C 12.461 4.519 5.851 1.00 . A A . 42 GLN CD 1 1 13 9470 1 1 45 GLN CG C 11.522 4.904 4.732 1.00 . A A . 42 GLN CG 1 1 13 9471 1 1 45 GLN H H 9.612 4.614 2.343 1.00 . A A . 42 GLN H 1 1 13 9472 1 1 45 GLN HA H 8.198 5.865 4.525 1.00 . A A . 42 GLN HA 1 1 13 9473 1 1 45 GLN HB2 H 10.224 6.086 5.926 1.00 . A A . 42 GLN HB2 1 1 13 9474 1 1 45 GLN HB3 H 9.727 4.409 5.748 1.00 . A A . 42 GLN HB3 1 1 13 9475 1 1 45 GLN HE21 H 11.923 2.617 5.680 1.00 . A A . 42 GLN HE21 1 1 13 9476 1 1 45 GLN HE22 H 13.104 2.958 6.895 1.00 . A A . 42 GLN HE22 1 1 13 9477 1 1 45 GLN HG2 H 11.440 4.071 4.049 1.00 . A A . 42 GLN HG2 1 1 13 9478 1 1 45 GLN HG3 H 11.935 5.755 4.211 1.00 . A A . 42 GLN HG3 1 1 13 9479 1 1 45 GLN N N 9.056 4.591 3.150 1.00 . A A . 42 GLN N 1 1 13 9480 1 1 45 GLN NE2 N 12.499 3.239 6.176 1.00 . A A . 42 GLN NE2 1 1 13 9481 1 1 45 GLN O O 10.416 6.823 2.433 1.00 . A A . 42 GLN O 1 1 13 9482 1 1 45 GLN OE1 O 13.145 5.371 6.421 1.00 . A A . 42 GLN OE1 1 1 13 9483 1 1 46 THR C C 10.354 10.161 4.486 1.00 . A A . 43 THR C 1 1 13 9484 1 1 46 THR CA C 9.771 9.316 3.366 1.00 . A A . 43 THR CA 1 1 13 9485 1 1 46 THR CB C 8.654 10.091 2.646 1.00 . A A . 43 THR CB 1 1 13 9486 1 1 46 THR CG2 C 8.454 9.564 1.234 1.00 . A A . 43 THR CG2 1 1 13 9487 1 1 46 THR H H 8.627 8.071 4.642 1.00 . A A . 43 THR H 1 1 13 9488 1 1 46 THR HA H 10.545 9.081 2.650 1.00 . A A . 43 THR HA 1 1 13 9489 1 1 46 THR HB H 8.940 11.130 2.588 1.00 . A A . 43 THR HB 1 1 13 9490 1 1 46 THR HG1 H 7.481 9.255 4.016 1.00 . A A . 43 THR HG1 1 1 13 9491 1 1 46 THR HG21 H 9.356 9.720 0.661 1.00 . A A . 43 THR HG21 1 1 13 9492 1 1 46 THR HG22 H 7.635 10.089 0.766 1.00 . A A . 43 THR HG22 1 1 13 9493 1 1 46 THR HG23 H 8.231 8.508 1.271 1.00 . A A . 43 THR HG23 1 1 13 9494 1 1 46 THR N N 9.279 8.062 3.898 1.00 . A A . 43 THR N 1 1 13 9495 1 1 46 THR O O 11.426 10.755 4.362 1.00 . A A . 43 THR O 1 1 13 9496 1 1 46 THR OG1 O 7.424 9.990 3.386 1.00 . A A . 43 THR OG1 1 1 13 9497 1 1 47 HIS C C 9.384 10.066 7.949 1.00 . A A . 44 HIS C 1 1 13 9498 1 1 47 HIS CA C 10.052 10.820 6.816 1.00 . A A . 44 HIS CA 1 1 13 9499 1 1 47 HIS CB C 9.684 12.313 6.836 1.00 . A A . 44 HIS CB 1 1 13 9500 1 1 47 HIS CD2 C 7.471 12.615 5.506 1.00 . A A . 44 HIS CD2 1 1 13 9501 1 1 47 HIS CE1 C 6.168 13.184 7.169 1.00 . A A . 44 HIS CE1 1 1 13 9502 1 1 47 HIS CG C 8.225 12.607 6.631 1.00 . A A . 44 HIS CG 1 1 13 9503 1 1 47 HIS H H 8.750 9.730 5.574 1.00 . A A . 44 HIS H 1 1 13 9504 1 1 47 HIS HA H 11.123 10.706 6.900 1.00 . A A . 44 HIS HA 1 1 13 9505 1 1 47 HIS HB2 H 9.968 12.729 7.791 1.00 . A A . 44 HIS HB2 1 1 13 9506 1 1 47 HIS HB3 H 10.237 12.817 6.057 1.00 . A A . 44 HIS HB3 1 1 13 9507 1 1 47 HIS HD1 H 7.623 13.049 8.605 1.00 . A A . 44 HIS HD1 1 1 13 9508 1 1 47 HIS HD2 H 7.809 12.375 4.508 1.00 . A A . 44 HIS HD2 1 1 13 9509 1 1 47 HIS HE1 H 5.300 13.481 7.741 1.00 . A A . 44 HIS HE1 1 1 13 9510 1 1 47 HIS HE2 H 5.456 13.149 5.249 1.00 . A A . 44 HIS HE2 1 1 13 9511 1 1 47 HIS N N 9.625 10.183 5.584 1.00 . A A . 44 HIS N 1 1 13 9512 1 1 47 HIS ND1 N 7.377 12.967 7.656 1.00 . A A . 44 HIS ND1 1 1 13 9513 1 1 47 HIS NE2 N 6.201 12.978 5.870 1.00 . A A . 44 HIS NE2 1 1 13 9514 1 1 47 HIS O O 8.940 10.635 8.946 1.00 . A A . 44 HIS O 1 1 13 9515 1 1 48 ASP C C 9.367 6.995 9.433 1.00 . A A . 45 ASP C 1 1 13 9516 1 1 48 ASP CA C 8.498 7.885 8.560 1.00 . A A . 45 ASP CA 1 1 13 9517 1 1 48 ASP CB C 7.607 7.031 7.648 1.00 . A A . 45 ASP CB 1 1 13 9518 1 1 48 ASP CG C 6.775 7.864 6.684 1.00 . A A . 45 ASP CG 1 1 13 9519 1 1 48 ASP H H 9.874 8.363 7.045 1.00 . A A . 45 ASP H 1 1 13 9520 1 1 48 ASP HA H 7.873 8.499 9.191 1.00 . A A . 45 ASP HA 1 1 13 9521 1 1 48 ASP HB2 H 8.230 6.366 7.069 1.00 . A A . 45 ASP HB2 1 1 13 9522 1 1 48 ASP HB3 H 6.936 6.446 8.257 1.00 . A A . 45 ASP HB3 1 1 13 9523 1 1 48 ASP N N 9.322 8.760 7.753 1.00 . A A . 45 ASP N 1 1 13 9524 1 1 48 ASP O O 9.549 7.325 10.621 1.00 . A A . 45 ASP O 1 1 13 9525 1 1 48 ASP OXT O 9.879 5.973 8.928 1.00 . A A . 45 ASP OXT 1 1 13 9526 1 1 48 ASP OD1 O 7.339 8.378 5.685 1.00 . A A . 45 ASP OD1 1 1 13 9527 1 1 48 ASP OD2 O 5.556 8.017 6.919 1.00 . A A . 45 ASP OD2 1 1 13 9528 2 2 1 ZN ZN ZN -4.258 -5.658 0.362 1.00 . B A . 101 ZN ZN 1 1 13 9529 3 2 1 ZN ZN ZN 6.270 1.304 -1.249 1.00 . C A . 102 ZN ZN 1 1 14 9530 1 1 1 GLY C C -17.895 7.532 6.909 1.00 . A A . -2 GLY C 1 1 14 9531 1 1 1 GLY CA C -18.880 6.918 7.879 1.00 . A A . -2 GLY CA 1 1 14 9532 1 1 1 GLY H1 H -20.021 8.630 8.194 1.00 . A A . -2 GLY H1 1 1 14 9533 1 1 1 GLY H2 H -20.835 7.193 8.546 1.00 . A A . -2 GLY H2 1 1 14 9534 1 1 1 GLY H3 H -20.589 7.651 6.940 1.00 . A A . -2 GLY H3 1 1 14 9535 1 1 1 GLY HA2 H -18.455 6.940 8.870 1.00 . A A . -2 GLY HA2 1 1 14 9536 1 1 1 GLY HA3 H -19.059 5.892 7.596 1.00 . A A . -2 GLY HA3 1 1 14 9537 1 1 1 GLY N N -20.170 7.648 7.892 1.00 . A A . -2 GLY N 1 1 14 9538 1 1 1 GLY O O -18.228 8.495 6.218 1.00 . A A . -2 GLY O 1 1 14 9539 1 1 2 PRO C C -16.007 7.175 4.461 1.00 . A A . -1 PRO C 1 1 14 9540 1 1 2 PRO CA C -15.649 7.494 5.908 1.00 . A A . -1 PRO CA 1 1 14 9541 1 1 2 PRO CB C -14.372 6.744 6.322 1.00 . A A . -1 PRO CB 1 1 14 9542 1 1 2 PRO CD C -16.169 5.885 7.644 1.00 . A A . -1 PRO CD 1 1 14 9543 1 1 2 PRO CG C -14.687 6.114 7.639 1.00 . A A . -1 PRO CG 1 1 14 9544 1 1 2 PRO HA H -15.498 8.558 6.015 1.00 . A A . -1 PRO HA 1 1 14 9545 1 1 2 PRO HB2 H -14.136 6.000 5.577 1.00 . A A . -1 PRO HB2 1 1 14 9546 1 1 2 PRO HB3 H -13.554 7.443 6.407 1.00 . A A . -1 PRO HB3 1 1 14 9547 1 1 2 PRO HD2 H -16.408 4.935 7.186 1.00 . A A . -1 PRO HD2 1 1 14 9548 1 1 2 PRO HD3 H -16.557 5.932 8.649 1.00 . A A . -1 PRO HD3 1 1 14 9549 1 1 2 PRO HG2 H -14.162 5.175 7.729 1.00 . A A . -1 PRO HG2 1 1 14 9550 1 1 2 PRO HG3 H -14.407 6.780 8.441 1.00 . A A . -1 PRO HG3 1 1 14 9551 1 1 2 PRO N N -16.668 7.003 6.835 1.00 . A A . -1 PRO N 1 1 14 9552 1 1 2 PRO O O -16.252 6.018 4.112 1.00 . A A . -1 PRO O 1 1 14 9553 1 1 3 HIS C C -15.154 7.632 1.416 1.00 . A A . 0 HIS C 1 1 14 9554 1 1 3 HIS CA C -16.389 8.022 2.217 1.00 . A A . 0 HIS CA 1 1 14 9555 1 1 3 HIS CB C -17.011 9.297 1.638 1.00 . A A . 0 HIS CB 1 1 14 9556 1 1 3 HIS CD2 C -19.469 8.894 2.368 1.00 . A A . 0 HIS CD2 1 1 14 9557 1 1 3 HIS CE1 C -19.895 10.882 3.181 1.00 . A A . 0 HIS CE1 1 1 14 9558 1 1 3 HIS CG C -18.346 9.639 2.229 1.00 . A A . 0 HIS CG 1 1 14 9559 1 1 3 HIS H H -15.850 9.103 3.962 1.00 . A A . 0 HIS H 1 1 14 9560 1 1 3 HIS HA H -17.110 7.222 2.151 1.00 . A A . 0 HIS HA 1 1 14 9561 1 1 3 HIS HB2 H -16.345 10.125 1.818 1.00 . A A . 0 HIS HB2 1 1 14 9562 1 1 3 HIS HB3 H -17.141 9.172 0.574 1.00 . A A . 0 HIS HB3 1 1 14 9563 1 1 3 HIS HD1 H -18.040 11.656 2.781 1.00 . A A . 0 HIS HD1 1 1 14 9564 1 1 3 HIS HD2 H -19.594 7.865 2.068 1.00 . A A . 0 HIS HD2 1 1 14 9565 1 1 3 HIS HE1 H -20.405 11.720 3.635 1.00 . A A . 0 HIS HE1 1 1 14 9566 1 1 3 HIS HE2 H -21.365 9.463 3.063 1.00 . A A . 0 HIS HE2 1 1 14 9567 1 1 3 HIS N N -16.053 8.200 3.625 1.00 . A A . 0 HIS N 1 1 14 9568 1 1 3 HIS ND1 N -18.649 10.881 2.746 1.00 . A A . 0 HIS ND1 1 1 14 9569 1 1 3 HIS NE2 N -20.414 9.690 2.963 1.00 . A A . 0 HIS NE2 1 1 14 9570 1 1 3 HIS O O -15.252 7.245 0.254 1.00 . A A . 0 HIS O 1 1 14 9571 1 1 4 MET C C -12.733 5.850 1.147 1.00 . A A . 1 MET C 1 1 14 9572 1 1 4 MET CA C -12.736 7.351 1.427 1.00 . A A . 1 MET CA 1 1 14 9573 1 1 4 MET CB C -11.550 7.744 2.321 1.00 . A A . 1 MET CB 1 1 14 9574 1 1 4 MET CE C -8.873 7.485 4.094 1.00 . A A . 1 MET CE 1 1 14 9575 1 1 4 MET CG C -11.614 7.160 3.728 1.00 . A A . 1 MET CG 1 1 14 9576 1 1 4 MET H H -13.980 8.116 2.954 1.00 . A A . 1 MET H 1 1 14 9577 1 1 4 MET HA H -12.654 7.877 0.489 1.00 . A A . 1 MET HA 1 1 14 9578 1 1 4 MET HB2 H -10.638 7.404 1.856 1.00 . A A . 1 MET HB2 1 1 14 9579 1 1 4 MET HB3 H -11.520 8.820 2.404 1.00 . A A . 1 MET HB3 1 1 14 9580 1 1 4 MET HE1 H -8.825 7.919 3.106 1.00 . A A . 1 MET HE1 1 1 14 9581 1 1 4 MET HE2 H -8.795 6.410 4.019 1.00 . A A . 1 MET HE2 1 1 14 9582 1 1 4 MET HE3 H -8.059 7.863 4.693 1.00 . A A . 1 MET HE3 1 1 14 9583 1 1 4 MET HG2 H -12.609 7.310 4.119 1.00 . A A . 1 MET HG2 1 1 14 9584 1 1 4 MET HG3 H -11.409 6.102 3.671 1.00 . A A . 1 MET HG3 1 1 14 9585 1 1 4 MET N N -13.992 7.748 2.047 1.00 . A A . 1 MET N 1 1 14 9586 1 1 4 MET O O -12.994 5.041 2.041 1.00 . A A . 1 MET O 1 1 14 9587 1 1 4 MET SD S -10.432 7.919 4.862 1.00 . A A . 1 MET SD 1 1 14 9588 1 1 5 ALA C C -11.812 3.942 -1.863 1.00 . A A . 2 ALA C 1 1 14 9589 1 1 5 ALA CA C -12.505 4.104 -0.528 1.00 . A A . 2 ALA CA 1 1 14 9590 1 1 5 ALA CB C -13.944 3.614 -0.619 1.00 . A A . 2 ALA CB 1 1 14 9591 1 1 5 ALA H H -12.166 6.169 -0.745 1.00 . A A . 2 ALA H 1 1 14 9592 1 1 5 ALA HA H -11.985 3.500 0.204 1.00 . A A . 2 ALA HA 1 1 14 9593 1 1 5 ALA HB1 H -14.470 4.177 -1.374 1.00 . A A . 2 ALA HB1 1 1 14 9594 1 1 5 ALA HB2 H -14.433 3.747 0.335 1.00 . A A . 2 ALA HB2 1 1 14 9595 1 1 5 ALA HB3 H -13.948 2.564 -0.884 1.00 . A A . 2 ALA HB3 1 1 14 9596 1 1 5 ALA N N -12.447 5.487 -0.097 1.00 . A A . 2 ALA N 1 1 14 9597 1 1 5 ALA O O -11.425 4.926 -2.499 1.00 . A A . 2 ALA O 1 1 14 9598 1 1 6 VAL C C -10.702 0.809 -3.320 1.00 . A A . 3 VAL C 1 1 14 9599 1 1 6 VAL CA C -10.881 2.315 -3.416 1.00 . A A . 3 VAL CA 1 1 14 9600 1 1 6 VAL CB C -9.495 2.992 -3.342 1.00 . A A . 3 VAL CB 1 1 14 9601 1 1 6 VAL CG1 C -8.544 2.170 -2.521 1.00 . A A . 3 VAL CG1 1 1 14 9602 1 1 6 VAL CG2 C -8.892 3.236 -4.694 1.00 . A A . 3 VAL CG2 1 1 14 9603 1 1 6 VAL H H -12.171 1.991 -1.794 1.00 . A A . 3 VAL H 1 1 14 9604 1 1 6 VAL HA H -11.382 2.588 -4.329 1.00 . A A . 3 VAL HA 1 1 14 9605 1 1 6 VAL HB H -9.615 3.949 -2.852 1.00 . A A . 3 VAL HB 1 1 14 9606 1 1 6 VAL HG11 H -9.071 1.770 -1.665 1.00 . A A . 3 VAL HG11 1 1 14 9607 1 1 6 VAL HG12 H -7.733 2.799 -2.189 1.00 . A A . 3 VAL HG12 1 1 14 9608 1 1 6 VAL HG13 H -8.154 1.359 -3.119 1.00 . A A . 3 VAL HG13 1 1 14 9609 1 1 6 VAL HG21 H -8.842 2.307 -5.235 1.00 . A A . 3 VAL HG21 1 1 14 9610 1 1 6 VAL HG22 H -7.893 3.624 -4.551 1.00 . A A . 3 VAL HG22 1 1 14 9611 1 1 6 VAL HG23 H -9.488 3.950 -5.235 1.00 . A A . 3 VAL HG23 1 1 14 9612 1 1 6 VAL N N -11.689 2.697 -2.277 1.00 . A A . 3 VAL N 1 1 14 9613 1 1 6 VAL O O -11.257 0.191 -2.411 1.00 . A A . 3 VAL O 1 1 14 9614 1 1 7 LEU C C -7.983 -1.195 -3.832 1.00 . A A . 4 LEU C 1 1 14 9615 1 1 7 LEU CA C -9.497 -1.139 -3.965 1.00 . A A . 4 LEU CA 1 1 14 9616 1 1 7 LEU CB C -9.995 -2.097 -5.048 1.00 . A A . 4 LEU CB 1 1 14 9617 1 1 7 LEU CD1 C -11.886 -3.359 -6.108 1.00 . A A . 4 LEU CD1 1 1 14 9618 1 1 7 LEU CD2 C -11.980 -2.788 -3.671 1.00 . A A . 4 LEU CD2 1 1 14 9619 1 1 7 LEU CG C -11.508 -2.337 -5.049 1.00 . A A . 4 LEU CG 1 1 14 9620 1 1 7 LEU H H -9.674 0.679 -5.028 1.00 . A A . 4 LEU H 1 1 14 9621 1 1 7 LEU HA H -9.920 -1.427 -3.013 1.00 . A A . 4 LEU HA 1 1 14 9622 1 1 7 LEU HB2 H -9.715 -1.697 -6.011 1.00 . A A . 4 LEU HB2 1 1 14 9623 1 1 7 LEU HB3 H -9.503 -3.049 -4.914 1.00 . A A . 4 LEU HB3 1 1 14 9624 1 1 7 LEU HD11 H -11.386 -4.294 -5.902 1.00 . A A . 4 LEU HD11 1 1 14 9625 1 1 7 LEU HD12 H -11.586 -2.997 -7.081 1.00 . A A . 4 LEU HD12 1 1 14 9626 1 1 7 LEU HD13 H -12.955 -3.513 -6.096 1.00 . A A . 4 LEU HD13 1 1 14 9627 1 1 7 LEU HD21 H -11.854 -1.979 -2.963 1.00 . A A . 4 LEU HD21 1 1 14 9628 1 1 7 LEU HD22 H -11.398 -3.642 -3.350 1.00 . A A . 4 LEU HD22 1 1 14 9629 1 1 7 LEU HD23 H -13.024 -3.063 -3.721 1.00 . A A . 4 LEU HD23 1 1 14 9630 1 1 7 LEU HG H -12.010 -1.411 -5.287 1.00 . A A . 4 LEU HG 1 1 14 9631 1 1 7 LEU N N -9.937 0.212 -4.206 1.00 . A A . 4 LEU N 1 1 14 9632 1 1 7 LEU O O -7.250 -0.602 -4.624 1.00 . A A . 4 LEU O 1 1 14 9633 1 1 8 CYS C C -5.288 -2.384 -3.657 1.00 . A A . 5 CYS C 1 1 14 9634 1 1 8 CYS CA C -6.143 -2.058 -2.434 1.00 . A A . 5 CYS CA 1 1 14 9635 1 1 8 CYS CB C -6.036 -3.178 -1.395 1.00 . A A . 5 CYS CB 1 1 14 9636 1 1 8 CYS H H -8.220 -2.317 -2.211 1.00 . A A . 5 CYS H 1 1 14 9637 1 1 8 CYS HA H -5.796 -1.136 -1.995 1.00 . A A . 5 CYS HA 1 1 14 9638 1 1 8 CYS HB2 H -6.632 -2.910 -0.537 1.00 . A A . 5 CYS HB2 1 1 14 9639 1 1 8 CYS HB3 H -6.432 -4.088 -1.825 1.00 . A A . 5 CYS HB3 1 1 14 9640 1 1 8 CYS N N -7.552 -1.894 -2.784 1.00 . A A . 5 CYS N 1 1 14 9641 1 1 8 CYS O O -5.549 -3.347 -4.371 1.00 . A A . 5 CYS O 1 1 14 9642 1 1 8 CYS SG S -4.367 -3.533 -0.799 1.00 . A A . 5 CYS SG 1 1 14 9643 1 1 9 GLY C C -2.698 -3.075 -5.081 1.00 . A A . 6 GLY C 1 1 14 9644 1 1 9 GLY CA C -3.403 -1.733 -5.038 1.00 . A A . 6 GLY CA 1 1 14 9645 1 1 9 GLY H H -4.093 -0.834 -3.248 1.00 . A A . 6 GLY H 1 1 14 9646 1 1 9 GLY HA2 H -3.999 -1.629 -5.928 1.00 . A A . 6 GLY HA2 1 1 14 9647 1 1 9 GLY HA3 H -2.658 -0.952 -5.028 1.00 . A A . 6 GLY HA3 1 1 14 9648 1 1 9 GLY N N -4.262 -1.571 -3.878 1.00 . A A . 6 GLY N 1 1 14 9649 1 1 9 GLY O O -2.372 -3.574 -6.155 1.00 . A A . 6 GLY O 1 1 14 9650 1 1 10 VAL C C -2.699 -6.125 -4.050 1.00 . A A . 7 VAL C 1 1 14 9651 1 1 10 VAL CA C -1.759 -4.934 -3.843 1.00 . A A . 7 VAL CA 1 1 14 9652 1 1 10 VAL CB C -1.020 -5.083 -2.496 1.00 . A A . 7 VAL CB 1 1 14 9653 1 1 10 VAL CG1 C -0.383 -6.459 -2.367 1.00 . A A . 7 VAL CG1 1 1 14 9654 1 1 10 VAL CG2 C 0.031 -3.994 -2.356 1.00 . A A . 7 VAL CG2 1 1 14 9655 1 1 10 VAL H H -2.777 -3.234 -3.095 1.00 . A A . 7 VAL H 1 1 14 9656 1 1 10 VAL HA H -1.019 -4.938 -4.630 1.00 . A A . 7 VAL HA 1 1 14 9657 1 1 10 VAL HB H -1.739 -4.965 -1.698 1.00 . A A . 7 VAL HB 1 1 14 9658 1 1 10 VAL HG11 H -1.149 -7.217 -2.457 1.00 . A A . 7 VAL HG11 1 1 14 9659 1 1 10 VAL HG12 H 0.099 -6.546 -1.403 1.00 . A A . 7 VAL HG12 1 1 14 9660 1 1 10 VAL HG13 H 0.349 -6.591 -3.151 1.00 . A A . 7 VAL HG13 1 1 14 9661 1 1 10 VAL HG21 H 0.529 -4.095 -1.403 1.00 . A A . 7 VAL HG21 1 1 14 9662 1 1 10 VAL HG22 H -0.443 -3.026 -2.415 1.00 . A A . 7 VAL HG22 1 1 14 9663 1 1 10 VAL HG23 H 0.755 -4.090 -3.151 1.00 . A A . 7 VAL HG23 1 1 14 9664 1 1 10 VAL N N -2.469 -3.666 -3.918 1.00 . A A . 7 VAL N 1 1 14 9665 1 1 10 VAL O O -2.586 -6.847 -5.038 1.00 . A A . 7 VAL O 1 1 14 9666 1 1 11 CYS C C -5.823 -7.195 -3.849 1.00 . A A . 8 CYS C 1 1 14 9667 1 1 11 CYS CA C -4.490 -7.502 -3.161 1.00 . A A . 8 CYS CA 1 1 14 9668 1 1 11 CYS CB C -4.729 -8.027 -1.740 1.00 . A A . 8 CYS CB 1 1 14 9669 1 1 11 CYS H H -3.739 -5.668 -2.411 1.00 . A A . 8 CYS H 1 1 14 9670 1 1 11 CYS HA H -3.977 -8.264 -3.730 1.00 . A A . 8 CYS HA 1 1 14 9671 1 1 11 CYS HB2 H -5.226 -8.983 -1.799 1.00 . A A . 8 CYS HB2 1 1 14 9672 1 1 11 CYS HB3 H -3.777 -8.153 -1.247 1.00 . A A . 8 CYS HB3 1 1 14 9673 1 1 11 CYS N N -3.630 -6.322 -3.124 1.00 . A A . 8 CYS N 1 1 14 9674 1 1 11 CYS O O -6.399 -8.060 -4.507 1.00 . A A . 8 CYS O 1 1 14 9675 1 1 11 CYS SG S -5.747 -6.950 -0.707 1.00 . A A . 8 CYS SG 1 1 14 9676 1 1 12 GLY C C -8.709 -6.423 -4.095 1.00 . A A . 9 GLY C 1 1 14 9677 1 1 12 GLY CA C -7.518 -5.522 -4.361 1.00 . A A . 9 GLY CA 1 1 14 9678 1 1 12 GLY H H -5.772 -5.321 -3.178 1.00 . A A . 9 GLY H 1 1 14 9679 1 1 12 GLY HA2 H -7.756 -4.527 -4.016 1.00 . A A . 9 GLY HA2 1 1 14 9680 1 1 12 GLY HA3 H -7.346 -5.483 -5.427 1.00 . A A . 9 GLY HA3 1 1 14 9681 1 1 12 GLY N N -6.287 -5.958 -3.709 1.00 . A A . 9 GLY N 1 1 14 9682 1 1 12 GLY O O -9.163 -7.138 -4.993 1.00 . A A . 9 GLY O 1 1 14 9683 1 1 13 ILE C C -11.404 -6.455 -1.651 1.00 . A A . 10 ILE C 1 1 14 9684 1 1 13 ILE CA C -10.390 -7.203 -2.528 1.00 . A A . 10 ILE CA 1 1 14 9685 1 1 13 ILE CB C -10.003 -8.553 -1.863 1.00 . A A . 10 ILE CB 1 1 14 9686 1 1 13 ILE CD1 C -9.025 -7.637 0.309 1.00 . A A . 10 ILE CD1 1 1 14 9687 1 1 13 ILE CG1 C -8.773 -8.415 -0.957 1.00 . A A . 10 ILE CG1 1 1 14 9688 1 1 13 ILE CG2 C -9.751 -9.616 -2.920 1.00 . A A . 10 ILE CG2 1 1 14 9689 1 1 13 ILE H H -8.799 -5.844 -2.181 1.00 . A A . 10 ILE H 1 1 14 9690 1 1 13 ILE HA H -10.881 -7.439 -3.462 1.00 . A A . 10 ILE HA 1 1 14 9691 1 1 13 ILE HB H -10.842 -8.878 -1.264 1.00 . A A . 10 ILE HB 1 1 14 9692 1 1 13 ILE HD11 H -9.386 -6.651 0.051 1.00 . A A . 10 ILE HD11 1 1 14 9693 1 1 13 ILE HD12 H -8.106 -7.548 0.868 1.00 . A A . 10 ILE HD12 1 1 14 9694 1 1 13 ILE HD13 H -9.764 -8.146 0.907 1.00 . A A . 10 ILE HD13 1 1 14 9695 1 1 13 ILE HG12 H -8.429 -9.398 -0.675 1.00 . A A . 10 ILE HG12 1 1 14 9696 1 1 13 ILE HG13 H -7.989 -7.911 -1.504 1.00 . A A . 10 ILE HG13 1 1 14 9697 1 1 13 ILE HG21 H -10.655 -9.780 -3.489 1.00 . A A . 10 ILE HG21 1 1 14 9698 1 1 13 ILE HG22 H -9.454 -10.538 -2.441 1.00 . A A . 10 ILE HG22 1 1 14 9699 1 1 13 ILE HG23 H -8.965 -9.285 -3.582 1.00 . A A . 10 ILE HG23 1 1 14 9700 1 1 13 ILE N N -9.220 -6.397 -2.866 1.00 . A A . 10 ILE N 1 1 14 9701 1 1 13 ILE O O -12.595 -6.748 -1.710 1.00 . A A . 10 ILE O 1 1 14 9702 1 1 14 LYS C C -11.873 -3.286 -0.096 1.00 . A A . 11 LYS C 1 1 14 9703 1 1 14 LYS CA C -11.874 -4.809 0.073 1.00 . A A . 11 LYS CA 1 1 14 9704 1 1 14 LYS CB C -11.579 -5.192 1.540 1.00 . A A . 11 LYS CB 1 1 14 9705 1 1 14 LYS CD C -9.973 -5.219 3.494 1.00 . A A . 11 LYS CD 1 1 14 9706 1 1 14 LYS CE C -10.759 -4.293 4.411 1.00 . A A . 11 LYS CE 1 1 14 9707 1 1 14 LYS CG C -10.169 -4.863 2.027 1.00 . A A . 11 LYS CG 1 1 14 9708 1 1 14 LYS H H -10.020 -5.221 -0.882 1.00 . A A . 11 LYS H 1 1 14 9709 1 1 14 LYS HA H -12.865 -5.162 -0.168 1.00 . A A . 11 LYS HA 1 1 14 9710 1 1 14 LYS HB2 H -12.277 -4.672 2.177 1.00 . A A . 11 LYS HB2 1 1 14 9711 1 1 14 LYS HB3 H -11.733 -6.255 1.654 1.00 . A A . 11 LYS HB3 1 1 14 9712 1 1 14 LYS HD2 H -10.306 -6.234 3.655 1.00 . A A . 11 LYS HD2 1 1 14 9713 1 1 14 LYS HD3 H -8.923 -5.141 3.734 1.00 . A A . 11 LYS HD3 1 1 14 9714 1 1 14 LYS HE2 H -10.468 -3.273 4.207 1.00 . A A . 11 LYS HE2 1 1 14 9715 1 1 14 LYS HE3 H -11.812 -4.413 4.206 1.00 . A A . 11 LYS HE3 1 1 14 9716 1 1 14 LYS HG2 H -9.456 -5.414 1.438 1.00 . A A . 11 LYS HG2 1 1 14 9717 1 1 14 LYS HG3 H -9.997 -3.805 1.901 1.00 . A A . 11 LYS HG3 1 1 14 9718 1 1 14 LYS HZ1 H -11.013 -3.902 6.445 1.00 . A A . 11 LYS HZ1 1 1 14 9719 1 1 14 LYS HZ2 H -9.493 -4.528 6.054 1.00 . A A . 11 LYS HZ2 1 1 14 9720 1 1 14 LYS HZ3 H -10.845 -5.544 6.082 1.00 . A A . 11 LYS HZ3 1 1 14 9721 1 1 14 LYS N N -10.957 -5.484 -0.850 1.00 . A A . 11 LYS N 1 1 14 9722 1 1 14 LYS NZ N -10.510 -4.587 5.847 1.00 . A A . 11 LYS NZ 1 1 14 9723 1 1 14 LYS O O -12.881 -2.706 -0.497 1.00 . A A . 11 LYS O 1 1 14 9724 1 1 15 GLU C C -9.248 -0.826 0.711 1.00 . A A . 12 GLU C 1 1 14 9725 1 1 15 GLU CA C -10.663 -1.196 0.283 1.00 . A A . 12 GLU CA 1 1 14 9726 1 1 15 GLU CB C -11.682 -0.699 1.319 1.00 . A A . 12 GLU CB 1 1 14 9727 1 1 15 GLU CD C -12.945 1.207 2.358 1.00 . A A . 12 GLU CD 1 1 14 9728 1 1 15 GLU CG C -11.908 0.803 1.330 1.00 . A A . 12 GLU CG 1 1 14 9729 1 1 15 GLU H H -9.935 -3.172 0.364 1.00 . A A . 12 GLU H 1 1 14 9730 1 1 15 GLU HA H -10.878 -0.770 -0.685 1.00 . A A . 12 GLU HA 1 1 14 9731 1 1 15 GLU HB2 H -12.630 -1.176 1.123 1.00 . A A . 12 GLU HB2 1 1 14 9732 1 1 15 GLU HB3 H -11.342 -0.994 2.301 1.00 . A A . 12 GLU HB3 1 1 14 9733 1 1 15 GLU HG2 H -10.976 1.297 1.563 1.00 . A A . 12 GLU HG2 1 1 14 9734 1 1 15 GLU HG3 H -12.249 1.113 0.353 1.00 . A A . 12 GLU HG3 1 1 14 9735 1 1 15 GLU N N -10.743 -2.650 0.194 1.00 . A A . 12 GLU N 1 1 14 9736 1 1 15 GLU O O -8.477 -1.707 1.091 1.00 . A A . 12 GLU O 1 1 14 9737 1 1 15 GLU OE1 O -12.596 1.310 3.552 1.00 . A A . 12 GLU OE1 1 1 14 9738 1 1 15 GLU OE2 O -14.120 1.404 1.984 1.00 . A A . 12 GLU OE2 1 1 14 9739 1 1 16 PHE C C -7.708 1.438 2.525 1.00 . A A . 13 PHE C 1 1 14 9740 1 1 16 PHE CA C -7.590 0.894 1.108 1.00 . A A . 13 PHE CA 1 1 14 9741 1 1 16 PHE CB C -6.992 1.965 0.194 1.00 . A A . 13 PHE CB 1 1 14 9742 1 1 16 PHE CD1 C -8.636 3.862 -0.068 1.00 . A A . 13 PHE CD1 1 1 14 9743 1 1 16 PHE CD2 C -6.699 4.218 1.273 1.00 . A A . 13 PHE CD2 1 1 14 9744 1 1 16 PHE CE1 C -9.052 5.152 0.180 1.00 . A A . 13 PHE CE1 1 1 14 9745 1 1 16 PHE CE2 C -7.110 5.512 1.527 1.00 . A A . 13 PHE CE2 1 1 14 9746 1 1 16 PHE CG C -7.456 3.376 0.474 1.00 . A A . 13 PHE CG 1 1 14 9747 1 1 16 PHE CZ C -8.287 5.980 0.977 1.00 . A A . 13 PHE CZ 1 1 14 9748 1 1 16 PHE H H -9.488 1.085 0.175 1.00 . A A . 13 PHE H 1 1 14 9749 1 1 16 PHE HA H -6.930 0.038 1.122 1.00 . A A . 13 PHE HA 1 1 14 9750 1 1 16 PHE HB2 H -5.921 1.950 0.280 1.00 . A A . 13 PHE HB2 1 1 14 9751 1 1 16 PHE HB3 H -7.255 1.728 -0.821 1.00 . A A . 13 PHE HB3 1 1 14 9752 1 1 16 PHE HD1 H -9.235 3.214 -0.710 1.00 . A A . 13 PHE HD1 1 1 14 9753 1 1 16 PHE HD2 H -5.779 3.852 1.705 1.00 . A A . 13 PHE HD2 1 1 14 9754 1 1 16 PHE HE1 H -9.973 5.516 -0.251 1.00 . A A . 13 PHE HE1 1 1 14 9755 1 1 16 PHE HE2 H -6.509 6.157 2.149 1.00 . A A . 13 PHE HE2 1 1 14 9756 1 1 16 PHE HZ H -8.610 6.991 1.173 1.00 . A A . 13 PHE HZ 1 1 14 9757 1 1 16 PHE N N -8.887 0.444 0.612 1.00 . A A . 13 PHE N 1 1 14 9758 1 1 16 PHE O O -8.787 1.838 2.964 1.00 . A A . 13 PHE O 1 1 14 9759 1 1 17 LYS C C -5.187 2.759 4.718 1.00 . A A . 14 LYS C 1 1 14 9760 1 1 17 LYS CA C -6.509 2.007 4.559 1.00 . A A . 14 LYS CA 1 1 14 9761 1 1 17 LYS CB C -6.633 0.887 5.599 1.00 . A A . 14 LYS CB 1 1 14 9762 1 1 17 LYS CD C -6.884 0.223 8.007 1.00 . A A . 14 LYS CD 1 1 14 9763 1 1 17 LYS CE C -7.051 0.718 9.435 1.00 . A A . 14 LYS CE 1 1 14 9764 1 1 17 LYS CG C -6.660 1.372 7.038 1.00 . A A . 14 LYS CG 1 1 14 9765 1 1 17 LYS H H -5.780 1.057 2.825 1.00 . A A . 14 LYS H 1 1 14 9766 1 1 17 LYS HA H -7.325 2.701 4.682 1.00 . A A . 14 LYS HA 1 1 14 9767 1 1 17 LYS HB2 H -7.547 0.343 5.413 1.00 . A A . 14 LYS HB2 1 1 14 9768 1 1 17 LYS HB3 H -5.797 0.213 5.485 1.00 . A A . 14 LYS HB3 1 1 14 9769 1 1 17 LYS HD2 H -7.776 -0.312 7.716 1.00 . A A . 14 LYS HD2 1 1 14 9770 1 1 17 LYS HD3 H -6.033 -0.442 7.964 1.00 . A A . 14 LYS HD3 1 1 14 9771 1 1 17 LYS HE2 H -7.916 1.363 9.479 1.00 . A A . 14 LYS HE2 1 1 14 9772 1 1 17 LYS HE3 H -7.206 -0.134 10.080 1.00 . A A . 14 LYS HE3 1 1 14 9773 1 1 17 LYS HG2 H -5.714 1.840 7.266 1.00 . A A . 14 LYS HG2 1 1 14 9774 1 1 17 LYS HG3 H -7.458 2.090 7.152 1.00 . A A . 14 LYS HG3 1 1 14 9775 1 1 17 LYS HZ1 H -5.021 0.865 9.893 1.00 . A A . 14 LYS HZ1 1 1 14 9776 1 1 17 LYS HZ2 H -6.016 1.807 10.877 1.00 . A A . 14 LYS HZ2 1 1 14 9777 1 1 17 LYS HZ3 H -5.693 2.299 9.294 1.00 . A A . 14 LYS HZ3 1 1 14 9778 1 1 17 LYS N N -6.589 1.446 3.224 1.00 . A A . 14 LYS N 1 1 14 9779 1 1 17 LYS NZ N -5.863 1.474 9.907 1.00 . A A . 14 LYS NZ 1 1 14 9780 1 1 17 LYS O O -5.034 3.610 5.594 1.00 . A A . 14 LYS O 1 1 14 9781 1 1 18 TYR C C -2.608 3.610 2.470 1.00 . A A . 15 TYR C 1 1 14 9782 1 1 18 TYR CA C -2.924 3.064 3.852 1.00 . A A . 15 TYR CA 1 1 14 9783 1 1 18 TYR CB C -1.838 2.057 4.247 1.00 . A A . 15 TYR CB 1 1 14 9784 1 1 18 TYR CD1 C -3.026 0.583 5.902 1.00 . A A . 15 TYR CD1 1 1 14 9785 1 1 18 TYR CD2 C -1.132 1.812 6.652 1.00 . A A . 15 TYR CD2 1 1 14 9786 1 1 18 TYR CE1 C -3.185 0.046 7.162 1.00 . A A . 15 TYR CE1 1 1 14 9787 1 1 18 TYR CE2 C -1.282 1.280 7.917 1.00 . A A . 15 TYR CE2 1 1 14 9788 1 1 18 TYR CG C -2.003 1.474 5.628 1.00 . A A . 15 TYR CG 1 1 14 9789 1 1 18 TYR CZ C -2.310 0.397 8.166 1.00 . A A . 15 TYR CZ 1 1 14 9790 1 1 18 TYR H H -4.426 1.756 3.168 1.00 . A A . 15 TYR H 1 1 14 9791 1 1 18 TYR HA H -2.937 3.877 4.562 1.00 . A A . 15 TYR HA 1 1 14 9792 1 1 18 TYR HB2 H -1.846 1.239 3.544 1.00 . A A . 15 TYR HB2 1 1 14 9793 1 1 18 TYR HB3 H -0.877 2.547 4.207 1.00 . A A . 15 TYR HB3 1 1 14 9794 1 1 18 TYR HD1 H -3.710 0.313 5.107 1.00 . A A . 15 TYR HD1 1 1 14 9795 1 1 18 TYR HD2 H -0.330 2.505 6.450 1.00 . A A . 15 TYR HD2 1 1 14 9796 1 1 18 TYR HE1 H -3.990 -0.644 7.357 1.00 . A A . 15 TYR HE1 1 1 14 9797 1 1 18 TYR HE2 H -0.594 1.553 8.703 1.00 . A A . 15 TYR HE2 1 1 14 9798 1 1 18 TYR HH H -2.250 0.538 10.087 1.00 . A A . 15 TYR HH 1 1 14 9799 1 1 18 TYR N N -4.237 2.437 3.847 1.00 . A A . 15 TYR N 1 1 14 9800 1 1 18 TYR O O -3.417 3.493 1.548 1.00 . A A . 15 TYR O 1 1 14 9801 1 1 18 TYR OH O -2.468 -0.134 9.425 1.00 . A A . 15 TYR OH 1 1 14 9802 1 1 19 LYS C C 0.519 5.003 1.152 1.00 . A A . 16 LYS C 1 1 14 9803 1 1 19 LYS CA C -0.971 4.719 1.061 1.00 . A A . 16 LYS CA 1 1 14 9804 1 1 19 LYS CB C -1.750 5.991 0.699 1.00 . A A . 16 LYS CB 1 1 14 9805 1 1 19 LYS CD C -2.453 7.599 -1.106 1.00 . A A . 16 LYS CD 1 1 14 9806 1 1 19 LYS CE C -2.480 8.762 -0.126 1.00 . A A . 16 LYS CE 1 1 14 9807 1 1 19 LYS CG C -1.450 6.531 -0.693 1.00 . A A . 16 LYS CG 1 1 14 9808 1 1 19 LYS H H -0.839 4.260 3.113 1.00 . A A . 16 LYS H 1 1 14 9809 1 1 19 LYS HA H -1.140 3.967 0.303 1.00 . A A . 16 LYS HA 1 1 14 9810 1 1 19 LYS HB2 H -2.807 5.777 0.756 1.00 . A A . 16 LYS HB2 1 1 14 9811 1 1 19 LYS HB3 H -1.511 6.760 1.419 1.00 . A A . 16 LYS HB3 1 1 14 9812 1 1 19 LYS HD2 H -2.183 7.973 -2.082 1.00 . A A . 16 LYS HD2 1 1 14 9813 1 1 19 LYS HD3 H -3.437 7.155 -1.150 1.00 . A A . 16 LYS HD3 1 1 14 9814 1 1 19 LYS HE2 H -2.732 8.385 0.852 1.00 . A A . 16 LYS HE2 1 1 14 9815 1 1 19 LYS HE3 H -1.500 9.214 -0.096 1.00 . A A . 16 LYS HE3 1 1 14 9816 1 1 19 LYS HG2 H -0.459 6.963 -0.699 1.00 . A A . 16 LYS HG2 1 1 14 9817 1 1 19 LYS HG3 H -1.495 5.717 -1.400 1.00 . A A . 16 LYS HG3 1 1 14 9818 1 1 19 LYS HZ1 H -3.228 10.198 -1.441 1.00 . A A . 16 LYS HZ1 1 1 14 9819 1 1 19 LYS HZ2 H -3.505 10.555 0.188 1.00 . A A . 16 LYS HZ2 1 1 14 9820 1 1 19 LYS HZ3 H -4.424 9.365 -0.587 1.00 . A A . 16 LYS HZ3 1 1 14 9821 1 1 19 LYS N N -1.429 4.189 2.332 1.00 . A A . 16 LYS N 1 1 14 9822 1 1 19 LYS NZ N -3.478 9.790 -0.518 1.00 . A A . 16 LYS NZ 1 1 14 9823 1 1 19 LYS O O 0.921 6.038 1.681 1.00 . A A . 16 LYS O 1 1 14 9824 1 1 20 CYS C C 3.282 5.543 0.351 1.00 . A A . 17 CYS C 1 1 14 9825 1 1 20 CYS CA C 2.783 4.155 0.737 1.00 . A A . 17 CYS CA 1 1 14 9826 1 1 20 CYS CB C 3.449 3.111 -0.167 1.00 . A A . 17 CYS CB 1 1 14 9827 1 1 20 CYS H H 0.921 3.272 0.237 1.00 . A A . 17 CYS H 1 1 14 9828 1 1 20 CYS HA H 3.066 3.960 1.759 1.00 . A A . 17 CYS HA 1 1 14 9829 1 1 20 CYS HB2 H 3.180 2.125 0.177 1.00 . A A . 17 CYS HB2 1 1 14 9830 1 1 20 CYS HB3 H 3.103 3.245 -1.180 1.00 . A A . 17 CYS HB3 1 1 14 9831 1 1 20 CYS N N 1.325 4.060 0.660 1.00 . A A . 17 CYS N 1 1 14 9832 1 1 20 CYS O O 2.984 6.039 -0.730 1.00 . A A . 17 CYS O 1 1 14 9833 1 1 20 CYS SG S 5.256 3.226 -0.173 1.00 . A A . 17 CYS SG 1 1 14 9834 1 1 21 PRO C C 5.577 7.552 -0.186 1.00 . A A . 18 PRO C 1 1 14 9835 1 1 21 PRO CA C 4.615 7.516 1.000 1.00 . A A . 18 PRO CA 1 1 14 9836 1 1 21 PRO CB C 5.354 7.845 2.300 1.00 . A A . 18 PRO CB 1 1 14 9837 1 1 21 PRO CD C 4.446 5.649 2.557 1.00 . A A . 18 PRO CD 1 1 14 9838 1 1 21 PRO CG C 5.581 6.537 2.971 1.00 . A A . 18 PRO CG 1 1 14 9839 1 1 21 PRO HA H 3.830 8.240 0.839 1.00 . A A . 18 PRO HA 1 1 14 9840 1 1 21 PRO HB2 H 6.292 8.331 2.068 1.00 . A A . 18 PRO HB2 1 1 14 9841 1 1 21 PRO HB3 H 4.745 8.498 2.908 1.00 . A A . 18 PRO HB3 1 1 14 9842 1 1 21 PRO HD2 H 4.779 4.625 2.479 1.00 . A A . 18 PRO HD2 1 1 14 9843 1 1 21 PRO HD3 H 3.629 5.731 3.257 1.00 . A A . 18 PRO HD3 1 1 14 9844 1 1 21 PRO HG2 H 6.522 6.118 2.644 1.00 . A A . 18 PRO HG2 1 1 14 9845 1 1 21 PRO HG3 H 5.583 6.671 4.043 1.00 . A A . 18 PRO HG3 1 1 14 9846 1 1 21 PRO N N 4.063 6.179 1.238 1.00 . A A . 18 PRO N 1 1 14 9847 1 1 21 PRO O O 5.942 8.621 -0.672 1.00 . A A . 18 PRO O 1 1 14 9848 1 1 22 ARG C C 5.980 5.922 -3.052 1.00 . A A . 19 ARG C 1 1 14 9849 1 1 22 ARG CA C 6.825 6.267 -1.833 1.00 . A A . 19 ARG CA 1 1 14 9850 1 1 22 ARG CB C 7.892 5.184 -1.672 1.00 . A A . 19 ARG CB 1 1 14 9851 1 1 22 ARG CD C 10.242 4.560 -1.169 1.00 . A A . 19 ARG CD 1 1 14 9852 1 1 22 ARG CG C 9.176 5.629 -0.998 1.00 . A A . 19 ARG CG 1 1 14 9853 1 1 22 ARG CZ C 12.676 4.291 -0.934 1.00 . A A . 19 ARG CZ 1 1 14 9854 1 1 22 ARG H H 5.717 5.559 -0.170 1.00 . A A . 19 ARG H 1 1 14 9855 1 1 22 ARG HA H 7.306 7.220 -1.992 1.00 . A A . 19 ARG HA 1 1 14 9856 1 1 22 ARG HB2 H 7.475 4.378 -1.087 1.00 . A A . 19 ARG HB2 1 1 14 9857 1 1 22 ARG HB3 H 8.142 4.803 -2.652 1.00 . A A . 19 ARG HB3 1 1 14 9858 1 1 22 ARG HD2 H 9.932 3.677 -0.633 1.00 . A A . 19 ARG HD2 1 1 14 9859 1 1 22 ARG HD3 H 10.324 4.326 -2.220 1.00 . A A . 19 ARG HD3 1 1 14 9860 1 1 22 ARG HE H 11.605 5.779 -0.121 1.00 . A A . 19 ARG HE 1 1 14 9861 1 1 22 ARG HG2 H 9.516 6.551 -1.449 1.00 . A A . 19 ARG HG2 1 1 14 9862 1 1 22 ARG HG3 H 8.992 5.781 0.056 1.00 . A A . 19 ARG HG3 1 1 14 9863 1 1 22 ARG HH11 H 11.793 2.936 -2.162 1.00 . A A . 19 ARG HH11 1 1 14 9864 1 1 22 ARG HH12 H 13.502 2.732 -1.938 1.00 . A A . 19 ARG HH12 1 1 14 9865 1 1 22 ARG HH21 H 13.848 5.505 0.181 1.00 . A A . 19 ARG HH21 1 1 14 9866 1 1 22 ARG HH22 H 14.668 4.193 -0.607 1.00 . A A . 19 ARG HH22 1 1 14 9867 1 1 22 ARG N N 5.992 6.375 -0.643 1.00 . A A . 19 ARG N 1 1 14 9868 1 1 22 ARG NE N 11.554 4.966 -0.677 1.00 . A A . 19 ARG NE 1 1 14 9869 1 1 22 ARG NH1 N 12.654 3.233 -1.738 1.00 . A A . 19 ARG NH1 1 1 14 9870 1 1 22 ARG NH2 N 13.820 4.692 -0.412 1.00 . A A . 19 ARG NH2 1 1 14 9871 1 1 22 ARG O O 5.931 6.669 -4.025 1.00 . A A . 19 ARG O 1 1 14 9872 1 1 23 CYS C C 3.258 4.852 -4.362 1.00 . A A . 20 CYS C 1 1 14 9873 1 1 23 CYS CA C 4.619 4.211 -4.129 1.00 . A A . 20 CYS CA 1 1 14 9874 1 1 23 CYS CB C 4.442 2.704 -3.932 1.00 . A A . 20 CYS CB 1 1 14 9875 1 1 23 CYS H H 5.248 4.322 -2.112 1.00 . A A . 20 CYS H 1 1 14 9876 1 1 23 CYS HA H 5.236 4.383 -4.993 1.00 . A A . 20 CYS HA 1 1 14 9877 1 1 23 CYS HB2 H 3.775 2.536 -3.102 1.00 . A A . 20 CYS HB2 1 1 14 9878 1 1 23 CYS HB3 H 4.007 2.283 -4.827 1.00 . A A . 20 CYS HB3 1 1 14 9879 1 1 23 CYS N N 5.300 4.784 -2.973 1.00 . A A . 20 CYS N 1 1 14 9880 1 1 23 CYS O O 2.705 4.781 -5.458 1.00 . A A . 20 CYS O 1 1 14 9881 1 1 23 CYS SG S 5.973 1.807 -3.590 1.00 . A A . 20 CYS SG 1 1 14 9882 1 1 24 LEU C C 0.327 5.010 -3.545 1.00 . A A . 21 LEU C 1 1 14 9883 1 1 24 LEU CA C 1.399 6.069 -3.318 1.00 . A A . 21 LEU CA 1 1 14 9884 1 1 24 LEU CB C 1.287 7.176 -4.374 1.00 . A A . 21 LEU CB 1 1 14 9885 1 1 24 LEU CD1 C 1.932 9.482 -5.098 1.00 . A A . 21 LEU CD1 1 1 14 9886 1 1 24 LEU CD2 C 2.734 8.615 -2.895 1.00 . A A . 21 LEU CD2 1 1 14 9887 1 1 24 LEU CG C 2.377 8.252 -4.328 1.00 . A A . 21 LEU CG 1 1 14 9888 1 1 24 LEU H H 3.262 5.528 -2.487 1.00 . A A . 21 LEU H 1 1 14 9889 1 1 24 LEU HA H 1.241 6.506 -2.342 1.00 . A A . 21 LEU HA 1 1 14 9890 1 1 24 LEU HB2 H 1.310 6.713 -5.349 1.00 . A A . 21 LEU HB2 1 1 14 9891 1 1 24 LEU HB3 H 0.330 7.662 -4.250 1.00 . A A . 21 LEU HB3 1 1 14 9892 1 1 24 LEU HD11 H 1.024 9.869 -4.657 1.00 . A A . 21 LEU HD11 1 1 14 9893 1 1 24 LEU HD12 H 1.747 9.215 -6.127 1.00 . A A . 21 LEU HD12 1 1 14 9894 1 1 24 LEU HD13 H 2.705 10.235 -5.052 1.00 . A A . 21 LEU HD13 1 1 14 9895 1 1 24 LEU HD21 H 3.154 7.750 -2.402 1.00 . A A . 21 LEU HD21 1 1 14 9896 1 1 24 LEU HD22 H 1.846 8.932 -2.370 1.00 . A A . 21 LEU HD22 1 1 14 9897 1 1 24 LEU HD23 H 3.458 9.416 -2.895 1.00 . A A . 21 LEU HD23 1 1 14 9898 1 1 24 LEU HG H 3.267 7.867 -4.806 1.00 . A A . 21 LEU HG 1 1 14 9899 1 1 24 LEU N N 2.731 5.465 -3.310 1.00 . A A . 21 LEU N 1 1 14 9900 1 1 24 LEU O O -0.814 5.328 -3.877 1.00 . A A . 21 LEU O 1 1 14 9901 1 1 25 VAL C C -1.119 2.549 -2.296 1.00 . A A . 22 VAL C 1 1 14 9902 1 1 25 VAL CA C -0.217 2.648 -3.514 1.00 . A A . 22 VAL CA 1 1 14 9903 1 1 25 VAL CB C 0.517 1.303 -3.763 1.00 . A A . 22 VAL CB 1 1 14 9904 1 1 25 VAL CG1 C 1.421 0.931 -2.598 1.00 . A A . 22 VAL CG1 1 1 14 9905 1 1 25 VAL CG2 C -0.481 0.186 -4.044 1.00 . A A . 22 VAL CG2 1 1 14 9906 1 1 25 VAL H H 1.615 3.566 -3.080 1.00 . A A . 22 VAL H 1 1 14 9907 1 1 25 VAL HA H -0.831 2.861 -4.379 1.00 . A A . 22 VAL HA 1 1 14 9908 1 1 25 VAL HB H 1.138 1.421 -4.638 1.00 . A A . 22 VAL HB 1 1 14 9909 1 1 25 VAL HG11 H 0.823 0.784 -1.712 1.00 . A A . 22 VAL HG11 1 1 14 9910 1 1 25 VAL HG12 H 2.130 1.725 -2.426 1.00 . A A . 22 VAL HG12 1 1 14 9911 1 1 25 VAL HG13 H 1.951 0.018 -2.830 1.00 . A A . 22 VAL HG13 1 1 14 9912 1 1 25 VAL HG21 H -1.058 0.433 -4.923 1.00 . A A . 22 VAL HG21 1 1 14 9913 1 1 25 VAL HG22 H -1.145 0.074 -3.199 1.00 . A A . 22 VAL HG22 1 1 14 9914 1 1 25 VAL HG23 H 0.050 -0.740 -4.211 1.00 . A A . 22 VAL HG23 1 1 14 9915 1 1 25 VAL N N 0.703 3.751 -3.350 1.00 . A A . 22 VAL N 1 1 14 9916 1 1 25 VAL O O -0.655 2.509 -1.153 1.00 . A A . 22 VAL O 1 1 14 9917 1 1 26 GLN C C -3.584 1.062 -1.048 1.00 . A A . 23 GLN C 1 1 14 9918 1 1 26 GLN CA C -3.410 2.501 -1.517 1.00 . A A . 23 GLN CA 1 1 14 9919 1 1 26 GLN CB C -4.725 3.073 -2.048 1.00 . A A . 23 GLN CB 1 1 14 9920 1 1 26 GLN CD C -5.854 5.015 -3.218 1.00 . A A . 23 GLN CD 1 1 14 9921 1 1 26 GLN CG C -4.618 4.527 -2.486 1.00 . A A . 23 GLN CG 1 1 14 9922 1 1 26 GLN H H -2.689 2.617 -3.494 1.00 . A A . 23 GLN H 1 1 14 9923 1 1 26 GLN HA H -3.072 3.098 -0.680 1.00 . A A . 23 GLN HA 1 1 14 9924 1 1 26 GLN HB2 H -5.043 2.485 -2.894 1.00 . A A . 23 GLN HB2 1 1 14 9925 1 1 26 GLN HB3 H -5.472 3.009 -1.273 1.00 . A A . 23 GLN HB3 1 1 14 9926 1 1 26 GLN HE21 H -6.676 5.600 -1.510 1.00 . A A . 23 GLN HE21 1 1 14 9927 1 1 26 GLN HE22 H -7.624 5.866 -2.930 1.00 . A A . 23 GLN HE22 1 1 14 9928 1 1 26 GLN HG2 H -4.474 5.143 -1.610 1.00 . A A . 23 GLN HG2 1 1 14 9929 1 1 26 GLN HG3 H -3.765 4.630 -3.141 1.00 . A A . 23 GLN HG3 1 1 14 9930 1 1 26 GLN N N -2.404 2.565 -2.559 1.00 . A A . 23 GLN N 1 1 14 9931 1 1 26 GLN NE2 N -6.813 5.548 -2.478 1.00 . A A . 23 GLN NE2 1 1 14 9932 1 1 26 GLN O O -4.314 0.275 -1.653 1.00 . A A . 23 GLN O 1 1 14 9933 1 1 26 GLN OE1 O -5.942 4.917 -4.442 1.00 . A A . 23 GLN OE1 1 1 14 9934 1 1 27 THR C C -4.008 -0.727 1.627 1.00 . A A . 24 THR C 1 1 14 9935 1 1 27 THR CA C -2.919 -0.612 0.572 1.00 . A A . 24 THR CA 1 1 14 9936 1 1 27 THR CB C -1.561 -0.982 1.192 1.00 . A A . 24 THR CB 1 1 14 9937 1 1 27 THR CG2 C -0.551 -1.324 0.114 1.00 . A A . 24 THR CG2 1 1 14 9938 1 1 27 THR H H -2.315 1.401 0.446 1.00 . A A . 24 THR H 1 1 14 9939 1 1 27 THR HA H -3.130 -1.305 -0.229 1.00 . A A . 24 THR HA 1 1 14 9940 1 1 27 THR HB H -1.695 -1.845 1.827 1.00 . A A . 24 THR HB 1 1 14 9941 1 1 27 THR HG1 H -0.341 -0.201 2.537 1.00 . A A . 24 THR HG1 1 1 14 9942 1 1 27 THR HG21 H 0.378 -1.622 0.576 1.00 . A A . 24 THR HG21 1 1 14 9943 1 1 27 THR HG22 H -0.382 -0.461 -0.512 1.00 . A A . 24 THR HG22 1 1 14 9944 1 1 27 THR HG23 H -0.931 -2.139 -0.486 1.00 . A A . 24 THR HG23 1 1 14 9945 1 1 27 THR N N -2.880 0.724 0.015 1.00 . A A . 24 THR N 1 1 14 9946 1 1 27 THR O O -4.427 0.265 2.214 1.00 . A A . 24 THR O 1 1 14 9947 1 1 27 THR OG1 O -1.073 0.106 1.980 1.00 . A A . 24 THR OG1 1 1 14 9948 1 1 28 CYS C C -4.993 -2.367 4.206 1.00 . A A . 25 CYS C 1 1 14 9949 1 1 28 CYS CA C -5.547 -2.187 2.799 1.00 . A A . 25 CYS CA 1 1 14 9950 1 1 28 CYS CB C -6.339 -3.427 2.390 1.00 . A A . 25 CYS CB 1 1 14 9951 1 1 28 CYS H H -4.093 -2.695 1.360 1.00 . A A . 25 CYS H 1 1 14 9952 1 1 28 CYS HA H -6.204 -1.330 2.787 1.00 . A A . 25 CYS HA 1 1 14 9953 1 1 28 CYS HB2 H -7.203 -3.527 3.030 1.00 . A A . 25 CYS HB2 1 1 14 9954 1 1 28 CYS HB3 H -6.668 -3.314 1.370 1.00 . A A . 25 CYS HB3 1 1 14 9955 1 1 28 CYS N N -4.473 -1.944 1.851 1.00 . A A . 25 CYS N 1 1 14 9956 1 1 28 CYS O O -5.697 -2.147 5.190 1.00 . A A . 25 CYS O 1 1 14 9957 1 1 28 CYS SG S -5.398 -4.962 2.495 1.00 . A A . 25 CYS SG 1 1 14 9958 1 1 29 SER C C -1.585 -2.985 5.448 1.00 . A A . 26 SER C 1 1 14 9959 1 1 29 SER CA C -3.099 -3.030 5.583 1.00 . A A . 26 SER CA 1 1 14 9960 1 1 29 SER CB C -3.523 -4.395 6.141 1.00 . A A . 26 SER CB 1 1 14 9961 1 1 29 SER H H -3.208 -2.901 3.474 1.00 . A A . 26 SER H 1 1 14 9962 1 1 29 SER HA H -3.415 -2.254 6.267 1.00 . A A . 26 SER HA 1 1 14 9963 1 1 29 SER HB2 H -3.234 -5.169 5.446 1.00 . A A . 26 SER HB2 1 1 14 9964 1 1 29 SER HB3 H -3.030 -4.562 7.087 1.00 . A A . 26 SER HB3 1 1 14 9965 1 1 29 SER HG H -5.346 -3.715 5.885 1.00 . A A . 26 SER HG 1 1 14 9966 1 1 29 SER N N -3.733 -2.778 4.296 1.00 . A A . 26 SER N 1 1 14 9967 1 1 29 SER O O -1.067 -2.960 4.327 1.00 . A A . 26 SER O 1 1 14 9968 1 1 29 SER OG O -4.926 -4.465 6.336 1.00 . A A . 26 SER OG 1 1 14 9969 1 1 30 LEU C C 1.101 -4.228 5.833 1.00 . A A . 27 LEU C 1 1 14 9970 1 1 30 LEU CA C 0.575 -3.004 6.580 1.00 . A A . 27 LEU CA 1 1 14 9971 1 1 30 LEU CB C 1.101 -3.000 8.018 1.00 . A A . 27 LEU CB 1 1 14 9972 1 1 30 LEU CD1 C 1.156 -1.933 10.280 1.00 . A A . 27 LEU CD1 1 1 14 9973 1 1 30 LEU CD2 C 1.609 -0.560 8.249 1.00 . A A . 27 LEU CD2 1 1 14 9974 1 1 30 LEU CG C 0.817 -1.727 8.814 1.00 . A A . 27 LEU CG 1 1 14 9975 1 1 30 LEU H H -1.362 -2.990 7.435 1.00 . A A . 27 LEU H 1 1 14 9976 1 1 30 LEU HA H 0.914 -2.111 6.078 1.00 . A A . 27 LEU HA 1 1 14 9977 1 1 30 LEU HB2 H 0.659 -3.833 8.543 1.00 . A A . 27 LEU HB2 1 1 14 9978 1 1 30 LEU HB3 H 2.168 -3.143 7.986 1.00 . A A . 27 LEU HB3 1 1 14 9979 1 1 30 LEU HD11 H 0.954 -1.024 10.827 1.00 . A A . 27 LEU HD11 1 1 14 9980 1 1 30 LEU HD12 H 2.201 -2.187 10.375 1.00 . A A . 27 LEU HD12 1 1 14 9981 1 1 30 LEU HD13 H 0.553 -2.736 10.680 1.00 . A A . 27 LEU HD13 1 1 14 9982 1 1 30 LEU HD21 H 2.664 -0.788 8.290 1.00 . A A . 27 LEU HD21 1 1 14 9983 1 1 30 LEU HD22 H 1.409 0.327 8.833 1.00 . A A . 27 LEU HD22 1 1 14 9984 1 1 30 LEU HD23 H 1.317 -0.388 7.223 1.00 . A A . 27 LEU HD23 1 1 14 9985 1 1 30 LEU HG H -0.233 -1.487 8.743 1.00 . A A . 27 LEU HG 1 1 14 9986 1 1 30 LEU N N -0.884 -2.992 6.576 1.00 . A A . 27 LEU N 1 1 14 9987 1 1 30 LEU O O 2.154 -4.176 5.195 1.00 . A A . 27 LEU O 1 1 14 9988 1 1 31 GLU C C 0.902 -6.247 3.713 1.00 . A A . 28 GLU C 1 1 14 9989 1 1 31 GLU CA C 0.629 -6.548 5.185 1.00 . A A . 28 GLU CA 1 1 14 9990 1 1 31 GLU CB C -0.568 -7.497 5.301 1.00 . A A . 28 GLU CB 1 1 14 9991 1 1 31 GLU CD C 0.618 -9.731 5.291 1.00 . A A . 28 GLU CD 1 1 14 9992 1 1 31 GLU CG C -0.382 -8.832 4.598 1.00 . A A . 28 GLU CG 1 1 14 9993 1 1 31 GLU H H -0.428 -5.302 6.524 1.00 . A A . 28 GLU H 1 1 14 9994 1 1 31 GLU HA H 1.498 -7.013 5.621 1.00 . A A . 28 GLU HA 1 1 14 9995 1 1 31 GLU HB2 H -0.755 -7.692 6.347 1.00 . A A . 28 GLU HB2 1 1 14 9996 1 1 31 GLU HB3 H -1.436 -7.011 4.878 1.00 . A A . 28 GLU HB3 1 1 14 9997 1 1 31 GLU HG2 H -1.333 -9.341 4.563 1.00 . A A . 28 GLU HG2 1 1 14 9998 1 1 31 GLU HG3 H -0.038 -8.646 3.590 1.00 . A A . 28 GLU HG3 1 1 14 9999 1 1 31 GLU N N 0.345 -5.319 5.921 1.00 . A A . 28 GLU N 1 1 14 10000 1 1 31 GLU O O 1.907 -6.677 3.154 1.00 . A A . 28 GLU O 1 1 14 10001 1 1 31 GLU OE1 O 0.259 -10.334 6.327 1.00 . A A . 28 GLU OE1 1 1 14 10002 1 1 31 GLU OE2 O 1.757 -9.855 4.802 1.00 . A A . 28 GLU OE2 1 1 14 10003 1 1 32 CYS C C 1.145 -4.021 1.481 1.00 . A A . 29 CYS C 1 1 14 10004 1 1 32 CYS CA C 0.133 -5.143 1.697 1.00 . A A . 29 CYS CA 1 1 14 10005 1 1 32 CYS CB C -1.234 -4.762 1.136 1.00 . A A . 29 CYS CB 1 1 14 10006 1 1 32 CYS H H -0.738 -5.118 3.611 1.00 . A A . 29 CYS H 1 1 14 10007 1 1 32 CYS HA H 0.480 -6.024 1.185 1.00 . A A . 29 CYS HA 1 1 14 10008 1 1 32 CYS HB2 H -1.757 -4.161 1.864 1.00 . A A . 29 CYS HB2 1 1 14 10009 1 1 32 CYS HB3 H -1.103 -4.189 0.234 1.00 . A A . 29 CYS HB3 1 1 14 10010 1 1 32 CYS N N 0.012 -5.479 3.102 1.00 . A A . 29 CYS N 1 1 14 10011 1 1 32 CYS O O 1.733 -3.906 0.406 1.00 . A A . 29 CYS O 1 1 14 10012 1 1 32 CYS SG S -2.283 -6.183 0.746 1.00 . A A . 29 CYS SG 1 1 14 10013 1 1 33 SER C C 3.740 -2.680 2.336 1.00 . A A . 30 SER C 1 1 14 10014 1 1 33 SER CA C 2.327 -2.120 2.424 1.00 . A A . 30 SER CA 1 1 14 10015 1 1 33 SER CB C 2.202 -1.194 3.635 1.00 . A A . 30 SER CB 1 1 14 10016 1 1 33 SER H H 0.853 -3.329 3.337 1.00 . A A . 30 SER H 1 1 14 10017 1 1 33 SER HA H 2.121 -1.556 1.526 1.00 . A A . 30 SER HA 1 1 14 10018 1 1 33 SER HB2 H 2.367 -1.763 4.538 1.00 . A A . 30 SER HB2 1 1 14 10019 1 1 33 SER HB3 H 2.943 -0.412 3.564 1.00 . A A . 30 SER HB3 1 1 14 10020 1 1 33 SER HG H 0.991 0.267 4.121 1.00 . A A . 30 SER HG 1 1 14 10021 1 1 33 SER N N 1.356 -3.202 2.505 1.00 . A A . 30 SER N 1 1 14 10022 1 1 33 SER O O 4.579 -2.168 1.602 1.00 . A A . 30 SER O 1 1 14 10023 1 1 33 SER OG O 0.916 -0.599 3.700 1.00 . A A . 30 SER OG 1 1 14 10024 1 1 34 LYS C C 5.418 -5.392 1.950 1.00 . A A . 31 LYS C 1 1 14 10025 1 1 34 LYS CA C 5.310 -4.368 3.075 1.00 . A A . 31 LYS CA 1 1 14 10026 1 1 34 LYS CB C 5.597 -5.035 4.422 1.00 . A A . 31 LYS CB 1 1 14 10027 1 1 34 LYS CD C 5.158 -6.954 5.977 1.00 . A A . 31 LYS CD 1 1 14 10028 1 1 34 LYS CE C 4.372 -8.235 6.190 1.00 . A A . 31 LYS CE 1 1 14 10029 1 1 34 LYS CG C 4.726 -6.246 4.707 1.00 . A A . 31 LYS CG 1 1 14 10030 1 1 34 LYS H H 3.286 -4.119 3.651 1.00 . A A . 31 LYS H 1 1 14 10031 1 1 34 LYS HA H 6.037 -3.594 2.905 1.00 . A A . 31 LYS HA 1 1 14 10032 1 1 34 LYS HB2 H 6.630 -5.349 4.442 1.00 . A A . 31 LYS HB2 1 1 14 10033 1 1 34 LYS HB3 H 5.435 -4.310 5.207 1.00 . A A . 31 LYS HB3 1 1 14 10034 1 1 34 LYS HD2 H 6.208 -7.195 5.904 1.00 . A A . 31 LYS HD2 1 1 14 10035 1 1 34 LYS HD3 H 4.994 -6.297 6.818 1.00 . A A . 31 LYS HD3 1 1 14 10036 1 1 34 LYS HE2 H 3.330 -7.985 6.326 1.00 . A A . 31 LYS HE2 1 1 14 10037 1 1 34 LYS HE3 H 4.481 -8.859 5.315 1.00 . A A . 31 LYS HE3 1 1 14 10038 1 1 34 LYS HG2 H 3.701 -5.922 4.819 1.00 . A A . 31 LYS HG2 1 1 14 10039 1 1 34 LYS HG3 H 4.800 -6.933 3.877 1.00 . A A . 31 LYS HG3 1 1 14 10040 1 1 34 LYS HZ1 H 4.768 -8.391 8.231 1.00 . A A . 31 LYS HZ1 1 1 14 10041 1 1 34 LYS HZ2 H 5.845 -9.253 7.254 1.00 . A A . 31 LYS HZ2 1 1 14 10042 1 1 34 LYS HZ3 H 4.284 -9.843 7.513 1.00 . A A . 31 LYS HZ3 1 1 14 10043 1 1 34 LYS N N 3.996 -3.747 3.079 1.00 . A A . 31 LYS N 1 1 14 10044 1 1 34 LYS NZ N 4.850 -8.982 7.380 1.00 . A A . 31 LYS NZ 1 1 14 10045 1 1 34 LYS O O 6.497 -5.920 1.677 1.00 . A A . 31 LYS O 1 1 14 10046 1 1 35 LYS C C 5.078 -6.208 -0.960 1.00 . A A . 32 LYS C 1 1 14 10047 1 1 35 LYS CA C 4.241 -6.648 0.230 1.00 . A A . 32 LYS CA 1 1 14 10048 1 1 35 LYS CB C 2.797 -6.878 -0.207 1.00 . A A . 32 LYS CB 1 1 14 10049 1 1 35 LYS CD C 2.455 -8.970 1.128 1.00 . A A . 32 LYS CD 1 1 14 10050 1 1 35 LYS CE C 1.978 -10.409 1.117 1.00 . A A . 32 LYS CE 1 1 14 10051 1 1 35 LYS CG C 2.397 -8.343 -0.255 1.00 . A A . 32 LYS CG 1 1 14 10052 1 1 35 LYS H H 3.481 -5.166 1.531 1.00 . A A . 32 LYS H 1 1 14 10053 1 1 35 LYS HA H 4.645 -7.572 0.617 1.00 . A A . 32 LYS HA 1 1 14 10054 1 1 35 LYS HB2 H 2.143 -6.374 0.484 1.00 . A A . 32 LYS HB2 1 1 14 10055 1 1 35 LYS HB3 H 2.657 -6.457 -1.191 1.00 . A A . 32 LYS HB3 1 1 14 10056 1 1 35 LYS HD2 H 3.472 -8.942 1.484 1.00 . A A . 32 LYS HD2 1 1 14 10057 1 1 35 LYS HD3 H 1.824 -8.397 1.793 1.00 . A A . 32 LYS HD3 1 1 14 10058 1 1 35 LYS HE2 H 0.932 -10.427 0.850 1.00 . A A . 32 LYS HE2 1 1 14 10059 1 1 35 LYS HE3 H 2.545 -10.954 0.378 1.00 . A A . 32 LYS HE3 1 1 14 10060 1 1 35 LYS HG2 H 1.389 -8.422 -0.636 1.00 . A A . 32 LYS HG2 1 1 14 10061 1 1 35 LYS HG3 H 3.075 -8.871 -0.909 1.00 . A A . 32 LYS HG3 1 1 14 10062 1 1 35 LYS HZ1 H 1.780 -10.450 3.201 1.00 . A A . 32 LYS HZ1 1 1 14 10063 1 1 35 LYS HZ2 H 3.158 -11.247 2.621 1.00 . A A . 32 LYS HZ2 1 1 14 10064 1 1 35 LYS HZ3 H 1.639 -11.967 2.461 1.00 . A A . 32 LYS HZ3 1 1 14 10065 1 1 35 LYS N N 4.296 -5.654 1.292 1.00 . A A . 32 LYS N 1 1 14 10066 1 1 35 LYS NZ N 2.151 -11.063 2.440 1.00 . A A . 32 LYS NZ 1 1 14 10067 1 1 35 LYS O O 5.863 -6.987 -1.498 1.00 . A A . 32 LYS O 1 1 14 10068 1 1 36 HIS C C 7.139 -4.191 -2.126 1.00 . A A . 33 HIS C 1 1 14 10069 1 1 36 HIS CA C 5.675 -4.432 -2.498 1.00 . A A . 33 HIS CA 1 1 14 10070 1 1 36 HIS CB C 5.025 -3.150 -3.059 1.00 . A A . 33 HIS CB 1 1 14 10071 1 1 36 HIS CD2 C 6.010 -1.374 -1.456 1.00 . A A . 33 HIS CD2 1 1 14 10072 1 1 36 HIS CE1 C 4.228 -0.271 -0.974 1.00 . A A . 33 HIS CE1 1 1 14 10073 1 1 36 HIS CG C 5.002 -1.976 -2.120 1.00 . A A . 33 HIS CG 1 1 14 10074 1 1 36 HIS H H 4.313 -4.360 -0.872 1.00 . A A . 33 HIS H 1 1 14 10075 1 1 36 HIS HA H 5.647 -5.193 -3.264 1.00 . A A . 33 HIS HA 1 1 14 10076 1 1 36 HIS HB2 H 5.563 -2.846 -3.942 1.00 . A A . 33 HIS HB2 1 1 14 10077 1 1 36 HIS HB3 H 4.003 -3.372 -3.333 1.00 . A A . 33 HIS HB3 1 1 14 10078 1 1 36 HIS HD1 H 2.957 -1.462 -2.111 1.00 . A A . 33 HIS HD1 1 1 14 10079 1 1 36 HIS HD2 H 7.041 -1.680 -1.476 1.00 . A A . 33 HIS HD2 1 1 14 10080 1 1 36 HIS HE1 H 3.539 0.430 -0.535 1.00 . A A . 33 HIS HE1 1 1 14 10081 1 1 36 HIS N N 4.932 -4.949 -1.355 1.00 . A A . 33 HIS N 1 1 14 10082 1 1 36 HIS ND1 N 3.869 -1.268 -1.799 1.00 . A A . 33 HIS ND1 1 1 14 10083 1 1 36 HIS NE2 N 5.526 -0.286 -0.739 1.00 . A A . 33 HIS NE2 1 1 14 10084 1 1 36 HIS O O 7.998 -4.056 -2.992 1.00 . A A . 33 HIS O 1 1 14 10085 1 1 37 LYS C C 9.647 -5.157 -0.522 1.00 . A A . 34 LYS C 1 1 14 10086 1 1 37 LYS CA C 8.775 -3.921 -0.349 1.00 . A A . 34 LYS CA 1 1 14 10087 1 1 37 LYS CB C 8.756 -3.505 1.127 1.00 . A A . 34 LYS CB 1 1 14 10088 1 1 37 LYS CD C 7.903 -1.930 2.890 1.00 . A A . 34 LYS CD 1 1 14 10089 1 1 37 LYS CE C 6.944 -0.791 3.192 1.00 . A A . 34 LYS CE 1 1 14 10090 1 1 37 LYS CG C 7.873 -2.303 1.416 1.00 . A A . 34 LYS CG 1 1 14 10091 1 1 37 LYS H H 6.710 -4.346 -0.180 1.00 . A A . 34 LYS H 1 1 14 10092 1 1 37 LYS HA H 9.191 -3.116 -0.935 1.00 . A A . 34 LYS HA 1 1 14 10093 1 1 37 LYS HB2 H 8.401 -4.335 1.718 1.00 . A A . 34 LYS HB2 1 1 14 10094 1 1 37 LYS HB3 H 9.764 -3.262 1.433 1.00 . A A . 34 LYS HB3 1 1 14 10095 1 1 37 LYS HD2 H 7.626 -2.790 3.480 1.00 . A A . 34 LYS HD2 1 1 14 10096 1 1 37 LYS HD3 H 8.904 -1.621 3.150 1.00 . A A . 34 LYS HD3 1 1 14 10097 1 1 37 LYS HE2 H 7.328 0.111 2.738 1.00 . A A . 34 LYS HE2 1 1 14 10098 1 1 37 LYS HE3 H 5.977 -1.025 2.767 1.00 . A A . 34 LYS HE3 1 1 14 10099 1 1 37 LYS HG2 H 8.223 -1.463 0.838 1.00 . A A . 34 LYS HG2 1 1 14 10100 1 1 37 LYS HG3 H 6.856 -2.537 1.133 1.00 . A A . 34 LYS HG3 1 1 14 10101 1 1 37 LYS HZ1 H 6.080 0.167 4.830 1.00 . A A . 34 LYS HZ1 1 1 14 10102 1 1 37 LYS HZ2 H 7.694 -0.261 5.068 1.00 . A A . 34 LYS HZ2 1 1 14 10103 1 1 37 LYS HZ3 H 6.491 -1.444 5.124 1.00 . A A . 34 LYS HZ3 1 1 14 10104 1 1 37 LYS N N 7.424 -4.176 -0.829 1.00 . A A . 34 LYS N 1 1 14 10105 1 1 37 LYS NZ N 6.793 -0.567 4.654 1.00 . A A . 34 LYS NZ 1 1 14 10106 1 1 37 LYS O O 10.861 -5.056 -0.684 1.00 . A A . 34 LYS O 1 1 14 10107 1 1 38 THR C C 9.856 -8.080 -2.024 1.00 . A A . 35 THR C 1 1 14 10108 1 1 38 THR CA C 9.748 -7.580 -0.583 1.00 . A A . 35 THR CA 1 1 14 10109 1 1 38 THR CB C 9.073 -8.658 0.295 1.00 . A A . 35 THR CB 1 1 14 10110 1 1 38 THR CG2 C 7.797 -9.178 -0.350 1.00 . A A . 35 THR CG2 1 1 14 10111 1 1 38 THR H H 8.038 -6.341 -0.451 1.00 . A A . 35 THR H 1 1 14 10112 1 1 38 THR HA H 10.742 -7.406 -0.200 1.00 . A A . 35 THR HA 1 1 14 10113 1 1 38 THR HB H 8.817 -8.210 1.244 1.00 . A A . 35 THR HB 1 1 14 10114 1 1 38 THR HG1 H 10.492 -9.907 -0.279 1.00 . A A . 35 THR HG1 1 1 14 10115 1 1 38 THR HG21 H 7.104 -8.362 -0.488 1.00 . A A . 35 THR HG21 1 1 14 10116 1 1 38 THR HG22 H 7.350 -9.926 0.288 1.00 . A A . 35 THR HG22 1 1 14 10117 1 1 38 THR HG23 H 8.031 -9.617 -1.309 1.00 . A A . 35 THR HG23 1 1 14 10118 1 1 38 THR N N 9.018 -6.324 -0.514 1.00 . A A . 35 THR N 1 1 14 10119 1 1 38 THR O O 10.471 -9.117 -2.287 1.00 . A A . 35 THR O 1 1 14 10120 1 1 38 THR OG1 O 9.971 -9.754 0.520 1.00 . A A . 35 THR OG1 1 1 14 10121 1 1 39 ARG C C 9.745 -6.629 -5.272 1.00 . A A . 36 ARG C 1 1 14 10122 1 1 39 ARG CA C 9.262 -7.750 -4.352 1.00 . A A . 36 ARG CA 1 1 14 10123 1 1 39 ARG CB C 7.865 -8.226 -4.767 1.00 . A A . 36 ARG CB 1 1 14 10124 1 1 39 ARG CD C 5.400 -7.742 -4.912 1.00 . A A . 36 ARG CD 1 1 14 10125 1 1 39 ARG CG C 6.767 -7.209 -4.510 1.00 . A A . 36 ARG CG 1 1 14 10126 1 1 39 ARG CZ C 3.739 -9.373 -4.080 1.00 . A A . 36 ARG CZ 1 1 14 10127 1 1 39 ARG H H 8.820 -6.508 -2.693 1.00 . A A . 36 ARG H 1 1 14 10128 1 1 39 ARG HA H 9.946 -8.578 -4.442 1.00 . A A . 36 ARG HA 1 1 14 10129 1 1 39 ARG HB2 H 7.876 -8.452 -5.822 1.00 . A A . 36 ARG HB2 1 1 14 10130 1 1 39 ARG HB3 H 7.629 -9.125 -4.218 1.00 . A A . 36 ARG HB3 1 1 14 10131 1 1 39 ARG HD2 H 4.677 -6.944 -4.823 1.00 . A A . 36 ARG HD2 1 1 14 10132 1 1 39 ARG HD3 H 5.444 -8.071 -5.939 1.00 . A A . 36 ARG HD3 1 1 14 10133 1 1 39 ARG HE H 5.640 -9.252 -3.465 1.00 . A A . 36 ARG HE 1 1 14 10134 1 1 39 ARG HG2 H 6.753 -6.975 -3.454 1.00 . A A . 36 ARG HG2 1 1 14 10135 1 1 39 ARG HG3 H 6.978 -6.314 -5.077 1.00 . A A . 36 ARG HG3 1 1 14 10136 1 1 39 ARG HH11 H 3.049 -8.145 -5.540 1.00 . A A . 36 ARG HH11 1 1 14 10137 1 1 39 ARG HH12 H 1.892 -9.272 -4.910 1.00 . A A . 36 ARG HH12 1 1 14 10138 1 1 39 ARG HH21 H 4.123 -10.758 -2.649 1.00 . A A . 36 ARG HH21 1 1 14 10139 1 1 39 ARG HH22 H 2.504 -10.764 -3.275 1.00 . A A . 36 ARG HH22 1 1 14 10140 1 1 39 ARG N N 9.262 -7.341 -2.953 1.00 . A A . 36 ARG N 1 1 14 10141 1 1 39 ARG NE N 4.972 -8.863 -4.072 1.00 . A A . 36 ARG NE 1 1 14 10142 1 1 39 ARG NH1 N 2.821 -8.893 -4.910 1.00 . A A . 36 ARG NH1 1 1 14 10143 1 1 39 ARG NH2 N 3.430 -10.378 -3.270 1.00 . A A . 36 ARG NH2 1 1 14 10144 1 1 39 ARG O O 10.324 -6.891 -6.327 1.00 . A A . 36 ARG O 1 1 14 10145 1 1 40 ASP C C 10.974 -3.403 -4.975 1.00 . A A . 37 ASP C 1 1 14 10146 1 1 40 ASP CA C 9.929 -4.241 -5.698 1.00 . A A . 37 ASP CA 1 1 14 10147 1 1 40 ASP CB C 8.736 -3.356 -6.068 1.00 . A A . 37 ASP CB 1 1 14 10148 1 1 40 ASP CG C 7.752 -4.042 -6.987 1.00 . A A . 37 ASP CG 1 1 14 10149 1 1 40 ASP H H 9.032 -5.214 -4.044 1.00 . A A . 37 ASP H 1 1 14 10150 1 1 40 ASP HA H 10.367 -4.632 -6.605 1.00 . A A . 37 ASP HA 1 1 14 10151 1 1 40 ASP HB2 H 8.215 -3.075 -5.166 1.00 . A A . 37 ASP HB2 1 1 14 10152 1 1 40 ASP HB3 H 9.099 -2.464 -6.560 1.00 . A A . 37 ASP HB3 1 1 14 10153 1 1 40 ASP N N 9.509 -5.380 -4.884 1.00 . A A . 37 ASP N 1 1 14 10154 1 1 40 ASP O O 11.493 -2.436 -5.536 1.00 . A A . 37 ASP O 1 1 14 10155 1 1 40 ASP OD1 O 8.035 -4.138 -8.201 1.00 . A A . 37 ASP OD1 1 1 14 10156 1 1 40 ASP OD2 O 6.687 -4.485 -6.505 1.00 . A A . 37 ASP OD2 1 1 14 10157 1 1 41 ASN C C 11.753 -1.650 -2.587 1.00 . A A . 38 ASN C 1 1 14 10158 1 1 41 ASN CA C 12.220 -3.079 -2.871 1.00 . A A . 38 ASN CA 1 1 14 10159 1 1 41 ASN CB C 13.620 -3.066 -3.495 1.00 . A A . 38 ASN CB 1 1 14 10160 1 1 41 ASN CG C 14.664 -2.465 -2.571 1.00 . A A . 38 ASN CG 1 1 14 10161 1 1 41 ASN H H 10.841 -4.599 -3.382 1.00 . A A . 38 ASN H 1 1 14 10162 1 1 41 ASN HA H 12.266 -3.613 -1.933 1.00 . A A . 38 ASN HA 1 1 14 10163 1 1 41 ASN HB2 H 13.914 -4.079 -3.727 1.00 . A A . 38 ASN HB2 1 1 14 10164 1 1 41 ASN HB3 H 13.595 -2.486 -4.405 1.00 . A A . 38 ASN HB3 1 1 14 10165 1 1 41 ASN HD21 H 15.681 -1.775 -4.130 1.00 . A A . 38 ASN HD21 1 1 14 10166 1 1 41 ASN HD22 H 16.356 -1.429 -2.576 1.00 . A A . 38 ASN HD22 1 1 14 10167 1 1 41 ASN N N 11.269 -3.792 -3.732 1.00 . A A . 38 ASN N 1 1 14 10168 1 1 41 ASN ND2 N 15.667 -1.826 -3.149 1.00 . A A . 38 ASN ND2 1 1 14 10169 1 1 41 ASN O O 11.847 -0.769 -3.439 1.00 . A A . 38 ASN O 1 1 14 10170 1 1 41 ASN OD1 O 14.570 -2.571 -1.345 1.00 . A A . 38 ASN OD1 1 1 14 10171 1 1 42 CYS C C 10.922 0.100 0.500 1.00 . A A . 39 CYS C 1 1 14 10172 1 1 42 CYS CA C 10.739 -0.119 -0.996 1.00 . A A . 39 CYS CA 1 1 14 10173 1 1 42 CYS CB C 9.259 0.005 -1.368 1.00 . A A . 39 CYS CB 1 1 14 10174 1 1 42 CYS H H 11.237 -2.157 -0.725 1.00 . A A . 39 CYS H 1 1 14 10175 1 1 42 CYS HA H 11.302 0.631 -1.531 1.00 . A A . 39 CYS HA 1 1 14 10176 1 1 42 CYS HB2 H 9.158 -0.064 -2.439 1.00 . A A . 39 CYS HB2 1 1 14 10177 1 1 42 CYS HB3 H 8.714 -0.806 -0.910 1.00 . A A . 39 CYS HB3 1 1 14 10178 1 1 42 CYS N N 11.251 -1.426 -1.382 1.00 . A A . 39 CYS N 1 1 14 10179 1 1 42 CYS O O 10.627 -0.780 1.306 1.00 . A A . 39 CYS O 1 1 14 10180 1 1 42 CYS SG S 8.484 1.554 -0.846 1.00 . A A . 39 CYS SG 1 1 14 10181 1 1 43 SER C C 10.358 2.116 2.920 1.00 . A A . 40 SER C 1 1 14 10182 1 1 43 SER CA C 11.634 1.582 2.274 1.00 . A A . 40 SER CA 1 1 14 10183 1 1 43 SER CB C 12.770 2.596 2.412 1.00 . A A . 40 SER CB 1 1 14 10184 1 1 43 SER H H 11.660 1.930 0.189 1.00 . A A . 40 SER H 1 1 14 10185 1 1 43 SER HA H 11.915 0.667 2.772 1.00 . A A . 40 SER HA 1 1 14 10186 1 1 43 SER HB2 H 12.422 3.569 2.101 1.00 . A A . 40 SER HB2 1 1 14 10187 1 1 43 SER HB3 H 13.090 2.638 3.444 1.00 . A A . 40 SER HB3 1 1 14 10188 1 1 43 SER HG H 13.807 1.284 1.390 1.00 . A A . 40 SER HG 1 1 14 10189 1 1 43 SER N N 11.418 1.271 0.871 1.00 . A A . 40 SER N 1 1 14 10190 1 1 43 SER O O 10.208 2.100 4.139 1.00 . A A . 40 SER O 1 1 14 10191 1 1 43 SER OG O 13.871 2.222 1.605 1.00 . A A . 40 SER OG 1 1 14 10192 1 1 44 GLY C C 8.176 4.145 3.543 1.00 . A A . 41 GLY C 1 1 14 10193 1 1 44 GLY CA C 8.126 3.032 2.513 1.00 . A A . 41 GLY CA 1 1 14 10194 1 1 44 GLY H H 9.650 2.597 1.111 1.00 . A A . 41 GLY H 1 1 14 10195 1 1 44 GLY HA2 H 7.574 3.385 1.654 1.00 . A A . 41 GLY HA2 1 1 14 10196 1 1 44 GLY HA3 H 7.599 2.191 2.937 1.00 . A A . 41 GLY HA3 1 1 14 10197 1 1 44 GLY N N 9.438 2.581 2.068 1.00 . A A . 41 GLY N 1 1 14 10198 1 1 44 GLY O O 7.310 4.225 4.408 1.00 . A A . 41 GLY O 1 1 14 10199 1 1 45 GLN C C 9.484 7.427 3.722 1.00 . A A . 42 GLN C 1 1 14 10200 1 1 45 GLN CA C 9.342 6.078 4.425 1.00 . A A . 42 GLN CA 1 1 14 10201 1 1 45 GLN CB C 10.569 5.778 5.294 1.00 . A A . 42 GLN CB 1 1 14 10202 1 1 45 GLN CD C 11.863 6.278 7.410 1.00 . A A . 42 GLN CD 1 1 14 10203 1 1 45 GLN CG C 10.646 6.607 6.567 1.00 . A A . 42 GLN CG 1 1 14 10204 1 1 45 GLN H H 9.788 4.955 2.687 1.00 . A A . 42 GLN H 1 1 14 10205 1 1 45 GLN HA H 8.461 6.101 5.050 1.00 . A A . 42 GLN HA 1 1 14 10206 1 1 45 GLN HB2 H 10.548 4.736 5.573 1.00 . A A . 42 GLN HB2 1 1 14 10207 1 1 45 GLN HB3 H 11.460 5.967 4.714 1.00 . A A . 42 GLN HB3 1 1 14 10208 1 1 45 GLN HE21 H 11.820 4.387 6.805 1.00 . A A . 42 GLN HE21 1 1 14 10209 1 1 45 GLN HE22 H 13.090 4.796 7.902 1.00 . A A . 42 GLN HE22 1 1 14 10210 1 1 45 GLN HG2 H 10.687 7.652 6.297 1.00 . A A . 42 GLN HG2 1 1 14 10211 1 1 45 GLN HG3 H 9.759 6.424 7.155 1.00 . A A . 42 GLN HG3 1 1 14 10212 1 1 45 GLN N N 9.166 5.019 3.439 1.00 . A A . 42 GLN N 1 1 14 10213 1 1 45 GLN NE2 N 12.301 5.030 7.368 1.00 . A A . 42 GLN NE2 1 1 14 10214 1 1 45 GLN O O 10.087 8.361 4.247 1.00 . A A . 42 GLN O 1 1 14 10215 1 1 45 GLN OE1 O 12.398 7.139 8.109 1.00 . A A . 42 GLN OE1 1 1 14 10216 1 1 46 THR C C 10.361 8.948 1.123 1.00 . A A . 43 THR C 1 1 14 10217 1 1 46 THR CA C 8.956 8.701 1.677 1.00 . A A . 43 THR CA 1 1 14 10218 1 1 46 THR CB C 8.481 9.973 2.408 1.00 . A A . 43 THR CB 1 1 14 10219 1 1 46 THR CG2 C 7.931 10.974 1.405 1.00 . A A . 43 THR CG2 1 1 14 10220 1 1 46 THR H H 8.416 6.728 2.201 1.00 . A A . 43 THR H 1 1 14 10221 1 1 46 THR HA H 8.289 8.530 0.843 1.00 . A A . 43 THR HA 1 1 14 10222 1 1 46 THR HB H 9.323 10.419 2.917 1.00 . A A . 43 THR HB 1 1 14 10223 1 1 46 THR HG1 H 7.875 9.487 4.220 1.00 . A A . 43 THR HG1 1 1 14 10224 1 1 46 THR HG21 H 7.591 11.856 1.925 1.00 . A A . 43 THR HG21 1 1 14 10225 1 1 46 THR HG22 H 7.105 10.528 0.871 1.00 . A A . 43 THR HG22 1 1 14 10226 1 1 46 THR HG23 H 8.707 11.244 0.706 1.00 . A A . 43 THR HG23 1 1 14 10227 1 1 46 THR N N 8.908 7.505 2.525 1.00 . A A . 43 THR N 1 1 14 10228 1 1 46 THR O O 10.536 9.073 -0.086 1.00 . A A . 43 THR O 1 1 14 10229 1 1 46 THR OG1 O 7.462 9.655 3.365 1.00 . A A . 43 THR OG1 1 1 14 10230 1 1 47 HIS C C 13.167 8.234 0.587 1.00 . A A . 44 HIS C 1 1 14 10231 1 1 47 HIS CA C 12.733 9.250 1.633 1.00 . A A . 44 HIS CA 1 1 14 10232 1 1 47 HIS CB C 13.642 9.162 2.866 1.00 . A A . 44 HIS CB 1 1 14 10233 1 1 47 HIS CD2 C 16.058 9.054 1.904 1.00 . A A . 44 HIS CD2 1 1 14 10234 1 1 47 HIS CE1 C 16.844 10.881 2.812 1.00 . A A . 44 HIS CE1 1 1 14 10235 1 1 47 HIS CG C 15.056 9.611 2.625 1.00 . A A . 44 HIS CG 1 1 14 10236 1 1 47 HIS H H 11.126 8.912 2.969 1.00 . A A . 44 HIS H 1 1 14 10237 1 1 47 HIS HA H 12.804 10.239 1.210 1.00 . A A . 44 HIS HA 1 1 14 10238 1 1 47 HIS HB2 H 13.230 9.779 3.649 1.00 . A A . 44 HIS HB2 1 1 14 10239 1 1 47 HIS HB3 H 13.672 8.136 3.204 1.00 . A A . 44 HIS HB3 1 1 14 10240 1 1 47 HIS HD1 H 15.103 11.389 3.757 1.00 . A A . 44 HIS HD1 1 1 14 10241 1 1 47 HIS HD2 H 15.999 8.146 1.323 1.00 . A A . 44 HIS HD2 1 1 14 10242 1 1 47 HIS HE1 H 17.507 11.685 3.095 1.00 . A A . 44 HIS HE1 1 1 14 10243 1 1 47 HIS HE2 H 18.071 9.619 1.768 1.00 . A A . 44 HIS HE2 1 1 14 10244 1 1 47 HIS N N 11.344 9.018 2.015 1.00 . A A . 44 HIS N 1 1 14 10245 1 1 47 HIS ND1 N 15.584 10.756 3.180 1.00 . A A . 44 HIS ND1 1 1 14 10246 1 1 47 HIS NE2 N 17.157 9.861 2.037 1.00 . A A . 44 HIS NE2 1 1 14 10247 1 1 47 HIS O O 12.995 7.027 0.771 1.00 . A A . 44 HIS O 1 1 14 10248 1 1 48 ASP C C 15.616 7.554 -1.486 1.00 . A A . 45 ASP C 1 1 14 10249 1 1 48 ASP CA C 14.135 7.884 -1.612 1.00 . A A . 45 ASP CA 1 1 14 10250 1 1 48 ASP CB C 13.857 8.578 -2.945 1.00 . A A . 45 ASP CB 1 1 14 10251 1 1 48 ASP CG C 14.217 7.722 -4.139 1.00 . A A . 45 ASP CG 1 1 14 10252 1 1 48 ASP H H 13.838 9.703 -0.579 1.00 . A A . 45 ASP H 1 1 14 10253 1 1 48 ASP HA H 13.567 6.967 -1.564 1.00 . A A . 45 ASP HA 1 1 14 10254 1 1 48 ASP HB2 H 12.807 8.819 -3.004 1.00 . A A . 45 ASP HB2 1 1 14 10255 1 1 48 ASP HB3 H 14.432 9.490 -2.994 1.00 . A A . 45 ASP HB3 1 1 14 10256 1 1 48 ASP N N 13.712 8.731 -0.509 1.00 . A A . 45 ASP N 1 1 14 10257 1 1 48 ASP O O 15.939 6.465 -0.969 1.00 . A A . 45 ASP O 1 1 14 10258 1 1 48 ASP OXT O 16.450 8.394 -1.872 1.00 . A A . 45 ASP OXT 1 1 14 10259 1 1 48 ASP OD1 O 13.420 6.829 -4.495 1.00 . A A . 45 ASP OD1 1 1 14 10260 1 1 48 ASP OD2 O 15.282 7.958 -4.746 1.00 . A A . 45 ASP OD2 1 1 14 10261 2 2 1 ZN ZN ZN -4.444 -5.454 0.461 1.00 . B A . 101 ZN ZN 1 1 14 10262 3 2 1 ZN ZN ZN 6.238 1.491 -1.329 1.00 . C A . 102 ZN ZN 1 1 15 10263 1 1 1 GLY C C -16.162 13.212 3.289 1.00 . A A . -2 GLY C 1 1 15 10264 1 1 1 GLY CA C -16.484 13.991 4.545 1.00 . A A . -2 GLY CA 1 1 15 10265 1 1 1 GLY H1 H -17.877 13.997 6.093 1.00 . A A . -2 GLY H1 1 1 15 10266 1 1 1 GLY H2 H -17.609 12.473 5.414 1.00 . A A . -2 GLY H2 1 1 15 10267 1 1 1 GLY H3 H -18.531 13.619 4.582 1.00 . A A . -2 GLY H3 1 1 15 10268 1 1 1 GLY HA2 H -16.624 15.030 4.287 1.00 . A A . -2 GLY HA2 1 1 15 10269 1 1 1 GLY HA3 H -15.657 13.909 5.234 1.00 . A A . -2 GLY HA3 1 1 15 10270 1 1 1 GLY N N -17.711 13.487 5.205 1.00 . A A . -2 GLY N 1 1 15 10271 1 1 1 GLY O O -17.040 12.547 2.736 1.00 . A A . -2 GLY O 1 1 15 10272 1 1 2 PRO C C -14.566 11.029 1.834 1.00 . A A . -1 PRO C 1 1 15 10273 1 1 2 PRO CA C -14.484 12.536 1.619 1.00 . A A . -1 PRO CA 1 1 15 10274 1 1 2 PRO CB C -13.027 12.972 1.417 1.00 . A A . -1 PRO CB 1 1 15 10275 1 1 2 PRO CD C -13.810 14.063 3.392 1.00 . A A . -1 PRO CD 1 1 15 10276 1 1 2 PRO CG C -12.586 13.484 2.743 1.00 . A A . -1 PRO CG 1 1 15 10277 1 1 2 PRO HA H -15.071 12.808 0.754 1.00 . A A . -1 PRO HA 1 1 15 10278 1 1 2 PRO HB2 H -12.435 12.124 1.105 1.00 . A A . -1 PRO HB2 1 1 15 10279 1 1 2 PRO HB3 H -12.984 13.743 0.663 1.00 . A A . -1 PRO HB3 1 1 15 10280 1 1 2 PRO HD2 H -13.767 13.932 4.463 1.00 . A A . -1 PRO HD2 1 1 15 10281 1 1 2 PRO HD3 H -13.914 15.108 3.142 1.00 . A A . -1 PRO HD3 1 1 15 10282 1 1 2 PRO HG2 H -12.195 12.672 3.339 1.00 . A A . -1 PRO HG2 1 1 15 10283 1 1 2 PRO HG3 H -11.836 14.249 2.611 1.00 . A A . -1 PRO HG3 1 1 15 10284 1 1 2 PRO N N -14.909 13.273 2.810 1.00 . A A . -1 PRO N 1 1 15 10285 1 1 2 PRO O O -13.849 10.472 2.666 1.00 . A A . -1 PRO O 1 1 15 10286 1 1 3 HIS C C -14.424 8.189 0.678 1.00 . A A . 0 HIS C 1 1 15 10287 1 1 3 HIS CA C -15.631 8.934 1.226 1.00 . A A . 0 HIS CA 1 1 15 10288 1 1 3 HIS CB C -16.905 8.473 0.513 1.00 . A A . 0 HIS CB 1 1 15 10289 1 1 3 HIS CD2 C -18.777 8.619 2.301 1.00 . A A . 0 HIS CD2 1 1 15 10290 1 1 3 HIS CE1 C -19.970 10.212 1.386 1.00 . A A . 0 HIS CE1 1 1 15 10291 1 1 3 HIS CG C -18.161 8.979 1.150 1.00 . A A . 0 HIS CG 1 1 15 10292 1 1 3 HIS H H -15.984 10.871 0.432 1.00 . A A . 0 HIS H 1 1 15 10293 1 1 3 HIS HA H -15.721 8.715 2.279 1.00 . A A . 0 HIS HA 1 1 15 10294 1 1 3 HIS HB2 H -16.886 8.825 -0.506 1.00 . A A . 0 HIS HB2 1 1 15 10295 1 1 3 HIS HB3 H -16.940 7.394 0.516 1.00 . A A . 0 HIS HB3 1 1 15 10296 1 1 3 HIS HD1 H -18.747 10.456 -0.239 1.00 . A A . 0 HIS HD1 1 1 15 10297 1 1 3 HIS HD2 H -18.446 7.856 2.993 1.00 . A A . 0 HIS HD2 1 1 15 10298 1 1 3 HIS HE1 H -20.745 10.942 1.209 1.00 . A A . 0 HIS HE1 1 1 15 10299 1 1 3 HIS HE2 H -20.491 9.425 3.208 1.00 . A A . 0 HIS HE2 1 1 15 10300 1 1 3 HIS N N -15.446 10.374 1.090 1.00 . A A . 0 HIS N 1 1 15 10301 1 1 3 HIS ND1 N -18.935 9.978 0.602 1.00 . A A . 0 HIS ND1 1 1 15 10302 1 1 3 HIS NE2 N -19.897 9.400 2.424 1.00 . A A . 0 HIS NE2 1 1 15 10303 1 1 3 HIS O O -14.091 7.103 1.148 1.00 . A A . 0 HIS O 1 1 15 10304 1 1 4 MET C C -12.774 6.852 -1.443 1.00 . A A . 1 MET C 1 1 15 10305 1 1 4 MET CA C -12.556 8.265 -0.913 1.00 . A A . 1 MET CA 1 1 15 10306 1 1 4 MET CB C -11.388 8.298 0.080 1.00 . A A . 1 MET CB 1 1 15 10307 1 1 4 MET CE C -9.110 9.909 -1.472 1.00 . A A . 1 MET CE 1 1 15 10308 1 1 4 MET CG C -11.017 9.699 0.536 1.00 . A A . 1 MET CG 1 1 15 10309 1 1 4 MET H H -14.132 9.649 -0.650 1.00 . A A . 1 MET H 1 1 15 10310 1 1 4 MET HA H -12.309 8.902 -1.750 1.00 . A A . 1 MET HA 1 1 15 10311 1 1 4 MET HB2 H -11.656 7.718 0.952 1.00 . A A . 1 MET HB2 1 1 15 10312 1 1 4 MET HB3 H -10.522 7.851 -0.385 1.00 . A A . 1 MET HB3 1 1 15 10313 1 1 4 MET HE1 H -9.402 8.924 -1.805 1.00 . A A . 1 MET HE1 1 1 15 10314 1 1 4 MET HE2 H -8.367 9.818 -0.693 1.00 . A A . 1 MET HE2 1 1 15 10315 1 1 4 MET HE3 H -8.695 10.462 -2.302 1.00 . A A . 1 MET HE3 1 1 15 10316 1 1 4 MET HG2 H -11.867 10.134 1.040 1.00 . A A . 1 MET HG2 1 1 15 10317 1 1 4 MET HG3 H -10.189 9.633 1.227 1.00 . A A . 1 MET HG3 1 1 15 10318 1 1 4 MET N N -13.774 8.802 -0.309 1.00 . A A . 1 MET N 1 1 15 10319 1 1 4 MET O O -13.363 6.678 -2.510 1.00 . A A . 1 MET O 1 1 15 10320 1 1 4 MET SD S -10.542 10.776 -0.832 1.00 . A A . 1 MET SD 1 1 15 10321 1 1 5 ALA C C -11.611 4.127 -2.284 1.00 . A A . 2 ALA C 1 1 15 10322 1 1 5 ALA CA C -12.426 4.450 -1.051 1.00 . A A . 2 ALA CA 1 1 15 10323 1 1 5 ALA CB C -13.879 4.032 -1.235 1.00 . A A . 2 ALA CB 1 1 15 10324 1 1 5 ALA H H -11.834 6.072 0.143 1.00 . A A . 2 ALA H 1 1 15 10325 1 1 5 ALA HA H -12.019 3.870 -0.232 1.00 . A A . 2 ALA HA 1 1 15 10326 1 1 5 ALA HB1 H -14.302 4.560 -2.076 1.00 . A A . 2 ALA HB1 1 1 15 10327 1 1 5 ALA HB2 H -14.438 4.267 -0.342 1.00 . A A . 2 ALA HB2 1 1 15 10328 1 1 5 ALA HB3 H -13.925 2.966 -1.421 1.00 . A A . 2 ALA HB3 1 1 15 10329 1 1 5 ALA N N -12.301 5.855 -0.688 1.00 . A A . 2 ALA N 1 1 15 10330 1 1 5 ALA O O -11.073 5.013 -2.956 1.00 . A A . 2 ALA O 1 1 15 10331 1 1 6 VAL C C -10.613 0.813 -3.363 1.00 . A A . 3 VAL C 1 1 15 10332 1 1 6 VAL CA C -10.642 2.314 -3.562 1.00 . A A . 3 VAL CA 1 1 15 10333 1 1 6 VAL CB C -9.213 2.873 -3.363 1.00 . A A . 3 VAL CB 1 1 15 10334 1 1 6 VAL CG1 C -8.443 2.026 -2.388 1.00 . A A . 3 VAL CG1 1 1 15 10335 1 1 6 VAL CG2 C -8.443 2.979 -4.651 1.00 . A A . 3 VAL CG2 1 1 15 10336 1 1 6 VAL H H -12.096 2.219 -2.060 1.00 . A A . 3 VAL H 1 1 15 10337 1 1 6 VAL HA H -11.003 2.568 -4.541 1.00 . A A . 3 VAL HA 1 1 15 10338 1 1 6 VAL HB H -9.300 3.865 -2.942 1.00 . A A . 3 VAL HB 1 1 15 10339 1 1 6 VAL HG11 H -7.606 2.592 -2.016 1.00 . A A . 3 VAL HG11 1 1 15 10340 1 1 6 VAL HG12 H -8.087 1.136 -2.888 1.00 . A A . 3 VAL HG12 1 1 15 10341 1 1 6 VAL HG13 H -9.092 1.746 -1.568 1.00 . A A . 3 VAL HG13 1 1 15 10342 1 1 6 VAL HG21 H -7.451 3.344 -4.425 1.00 . A A . 3 VAL HG21 1 1 15 10343 1 1 6 VAL HG22 H -8.942 3.664 -5.316 1.00 . A A . 3 VAL HG22 1 1 15 10344 1 1 6 VAL HG23 H -8.373 2.007 -5.107 1.00 . A A . 3 VAL HG23 1 1 15 10345 1 1 6 VAL N N -11.529 2.846 -2.558 1.00 . A A . 3 VAL N 1 1 15 10346 1 1 6 VAL O O -11.271 0.306 -2.451 1.00 . A A . 3 VAL O 1 1 15 10347 1 1 7 LEU C C -8.009 -1.379 -3.735 1.00 . A A . 4 LEU C 1 1 15 10348 1 1 7 LEU CA C -9.517 -1.248 -3.825 1.00 . A A . 4 LEU CA 1 1 15 10349 1 1 7 LEU CB C -10.104 -2.263 -4.807 1.00 . A A . 4 LEU CB 1 1 15 10350 1 1 7 LEU CD1 C -12.086 -3.508 -5.705 1.00 . A A . 4 LEU CD1 1 1 15 10351 1 1 7 LEU CD2 C -12.069 -2.761 -3.316 1.00 . A A . 4 LEU CD2 1 1 15 10352 1 1 7 LEU CG C -11.626 -2.431 -4.737 1.00 . A A . 4 LEU CG 1 1 15 10353 1 1 7 LEU H H -9.552 0.492 -5.022 1.00 . A A . 4 LEU H 1 1 15 10354 1 1 7 LEU HA H -9.925 -1.423 -2.837 1.00 . A A . 4 LEU HA 1 1 15 10355 1 1 7 LEU HB2 H -9.842 -1.955 -5.809 1.00 . A A . 4 LEU HB2 1 1 15 10356 1 1 7 LEU HB3 H -9.651 -3.223 -4.613 1.00 . A A . 4 LEU HB3 1 1 15 10357 1 1 7 LEU HD11 H -13.160 -3.611 -5.643 1.00 . A A . 4 LEU HD11 1 1 15 10358 1 1 7 LEU HD12 H -11.619 -4.447 -5.447 1.00 . A A . 4 LEU HD12 1 1 15 10359 1 1 7 LEU HD13 H -11.808 -3.232 -6.711 1.00 . A A . 4 LEU HD13 1 1 15 10360 1 1 7 LEU HD21 H -11.525 -3.626 -2.956 1.00 . A A . 4 LEU HD21 1 1 15 10361 1 1 7 LEU HD22 H -13.127 -2.976 -3.310 1.00 . A A . 4 LEU HD22 1 1 15 10362 1 1 7 LEU HD23 H -11.872 -1.916 -2.670 1.00 . A A . 4 LEU HD23 1 1 15 10363 1 1 7 LEU HG H -12.096 -1.502 -5.027 1.00 . A A . 4 LEU HG 1 1 15 10364 1 1 7 LEU N N -9.868 0.104 -4.175 1.00 . A A . 4 LEU N 1 1 15 10365 1 1 7 LEU O O -7.282 -0.958 -4.636 1.00 . A A . 4 LEU O 1 1 15 10366 1 1 8 CYS C C -5.316 -2.452 -3.492 1.00 . A A . 5 CYS C 1 1 15 10367 1 1 8 CYS CA C -6.166 -2.124 -2.270 1.00 . A A . 5 CYS CA 1 1 15 10368 1 1 8 CYS CB C -6.061 -3.255 -1.253 1.00 . A A . 5 CYS CB 1 1 15 10369 1 1 8 CYS H H -8.250 -2.237 -1.957 1.00 . A A . 5 CYS H 1 1 15 10370 1 1 8 CYS HA H -5.802 -1.214 -1.820 1.00 . A A . 5 CYS HA 1 1 15 10371 1 1 8 CYS HB2 H -6.648 -2.999 -0.389 1.00 . A A . 5 CYS HB2 1 1 15 10372 1 1 8 CYS HB3 H -6.464 -4.157 -1.693 1.00 . A A . 5 CYS HB3 1 1 15 10373 1 1 8 CYS N N -7.575 -1.938 -2.608 1.00 . A A . 5 CYS N 1 1 15 10374 1 1 8 CYS O O -5.514 -3.475 -4.132 1.00 . A A . 5 CYS O 1 1 15 10375 1 1 8 CYS SG S -4.386 -3.626 -0.687 1.00 . A A . 5 CYS SG 1 1 15 10376 1 1 9 GLY C C -2.771 -3.050 -5.012 1.00 . A A . 6 GLY C 1 1 15 10377 1 1 9 GLY CA C -3.528 -1.735 -4.967 1.00 . A A . 6 GLY CA 1 1 15 10378 1 1 9 GLY H H -4.207 -0.819 -3.179 1.00 . A A . 6 GLY H 1 1 15 10379 1 1 9 GLY HA2 H -4.155 -1.668 -5.837 1.00 . A A . 6 GLY HA2 1 1 15 10380 1 1 9 GLY HA3 H -2.815 -0.927 -4.994 1.00 . A A . 6 GLY HA3 1 1 15 10381 1 1 9 GLY N N -4.354 -1.584 -3.780 1.00 . A A . 6 GLY N 1 1 15 10382 1 1 9 GLY O O -2.368 -3.505 -6.081 1.00 . A A . 6 GLY O 1 1 15 10383 1 1 10 VAL C C -2.710 -6.136 -3.968 1.00 . A A . 7 VAL C 1 1 15 10384 1 1 10 VAL CA C -1.825 -4.903 -3.769 1.00 . A A . 7 VAL CA 1 1 15 10385 1 1 10 VAL CB C -1.086 -5.008 -2.420 1.00 . A A . 7 VAL CB 1 1 15 10386 1 1 10 VAL CG1 C -0.377 -6.345 -2.288 1.00 . A A . 7 VAL CG1 1 1 15 10387 1 1 10 VAL CG2 C -0.093 -3.868 -2.276 1.00 . A A . 7 VAL CG2 1 1 15 10388 1 1 10 VAL H H -2.968 -3.277 -3.042 1.00 . A A . 7 VAL H 1 1 15 10389 1 1 10 VAL HA H -1.083 -4.884 -4.554 1.00 . A A . 7 VAL HA 1 1 15 10390 1 1 10 VAL HB H -1.812 -4.928 -1.625 1.00 . A A . 7 VAL HB 1 1 15 10391 1 1 10 VAL HG11 H 0.102 -6.403 -1.322 1.00 . A A . 7 VAL HG11 1 1 15 10392 1 1 10 VAL HG12 H 0.369 -6.436 -3.064 1.00 . A A . 7 VAL HG12 1 1 15 10393 1 1 10 VAL HG13 H -1.097 -7.144 -2.384 1.00 . A A . 7 VAL HG13 1 1 15 10394 1 1 10 VAL HG21 H 0.637 -3.924 -3.070 1.00 . A A . 7 VAL HG21 1 1 15 10395 1 1 10 VAL HG22 H 0.407 -3.945 -1.322 1.00 . A A . 7 VAL HG22 1 1 15 10396 1 1 10 VAL HG23 H -0.617 -2.925 -2.334 1.00 . A A . 7 VAL HG23 1 1 15 10397 1 1 10 VAL N N -2.586 -3.666 -3.855 1.00 . A A . 7 VAL N 1 1 15 10398 1 1 10 VAL O O -2.528 -6.882 -4.927 1.00 . A A . 7 VAL O 1 1 15 10399 1 1 11 CYS C C -5.797 -7.360 -3.834 1.00 . A A . 8 CYS C 1 1 15 10400 1 1 11 CYS CA C -4.469 -7.571 -3.102 1.00 . A A . 8 CYS CA 1 1 15 10401 1 1 11 CYS CB C -4.712 -8.098 -1.683 1.00 . A A . 8 CYS CB 1 1 15 10402 1 1 11 CYS H H -3.842 -5.671 -2.387 1.00 . A A . 8 CYS H 1 1 15 10403 1 1 11 CYS HA H -3.898 -8.310 -3.648 1.00 . A A . 8 CYS HA 1 1 15 10404 1 1 11 CYS HB2 H -5.188 -9.063 -1.745 1.00 . A A . 8 CYS HB2 1 1 15 10405 1 1 11 CYS HB3 H -3.761 -8.207 -1.181 1.00 . A A . 8 CYS HB3 1 1 15 10406 1 1 11 CYS N N -3.670 -6.345 -3.069 1.00 . A A . 8 CYS N 1 1 15 10407 1 1 11 CYS O O -6.418 -8.304 -4.324 1.00 . A A . 8 CYS O 1 1 15 10408 1 1 11 CYS SG S -5.758 -7.042 -0.655 1.00 . A A . 8 CYS SG 1 1 15 10409 1 1 12 GLY C C -8.672 -6.341 -4.283 1.00 . A A . 9 GLY C 1 1 15 10410 1 1 12 GLY CA C -7.366 -5.683 -4.677 1.00 . A A . 9 GLY CA 1 1 15 10411 1 1 12 GLY H H -5.694 -5.414 -3.419 1.00 . A A . 9 GLY H 1 1 15 10412 1 1 12 GLY HA2 H -7.483 -4.615 -4.574 1.00 . A A . 9 GLY HA2 1 1 15 10413 1 1 12 GLY HA3 H -7.171 -5.905 -5.716 1.00 . A A . 9 GLY HA3 1 1 15 10414 1 1 12 GLY N N -6.208 -6.095 -3.897 1.00 . A A . 9 GLY N 1 1 15 10415 1 1 12 GLY O O -9.478 -6.656 -5.154 1.00 . A A . 9 GLY O 1 1 15 10416 1 1 13 ILE C C -10.968 -6.350 -1.585 1.00 . A A . 10 ILE C 1 1 15 10417 1 1 13 ILE CA C -10.142 -7.196 -2.563 1.00 . A A . 10 ILE CA 1 1 15 10418 1 1 13 ILE CB C -9.868 -8.599 -1.963 1.00 . A A . 10 ILE CB 1 1 15 10419 1 1 13 ILE CD1 C -9.030 -7.931 0.350 1.00 . A A . 10 ILE CD1 1 1 15 10420 1 1 13 ILE CG1 C -8.698 -8.574 -0.974 1.00 . A A . 10 ILE CG1 1 1 15 10421 1 1 13 ILE CG2 C -9.598 -9.604 -3.073 1.00 . A A . 10 ILE CG2 1 1 15 10422 1 1 13 ILE H H -8.254 -6.245 -2.318 1.00 . A A . 10 ILE H 1 1 15 10423 1 1 13 ILE HA H -10.739 -7.340 -3.453 1.00 . A A . 10 ILE HA 1 1 15 10424 1 1 13 ILE HB H -10.759 -8.916 -1.443 1.00 . A A . 10 ILE HB 1 1 15 10425 1 1 13 ILE HD11 H -8.132 -7.833 0.941 1.00 . A A . 10 ILE HD11 1 1 15 10426 1 1 13 ILE HD12 H -9.748 -8.540 0.878 1.00 . A A . 10 ILE HD12 1 1 15 10427 1 1 13 ILE HD13 H -9.454 -6.950 0.169 1.00 . A A . 10 ILE HD13 1 1 15 10428 1 1 13 ILE HG12 H -8.380 -9.586 -0.778 1.00 . A A . 10 ILE HG12 1 1 15 10429 1 1 13 ILE HG13 H -7.879 -8.025 -1.414 1.00 . A A . 10 ILE HG13 1 1 15 10430 1 1 13 ILE HG21 H -9.392 -10.572 -2.639 1.00 . A A . 10 ILE HG21 1 1 15 10431 1 1 13 ILE HG22 H -8.746 -9.280 -3.652 1.00 . A A . 10 ILE HG22 1 1 15 10432 1 1 13 ILE HG23 H -10.464 -9.673 -3.714 1.00 . A A . 10 ILE HG23 1 1 15 10433 1 1 13 ILE N N -8.910 -6.536 -2.988 1.00 . A A . 10 ILE N 1 1 15 10434 1 1 13 ILE O O -12.141 -6.637 -1.354 1.00 . A A . 10 ILE O 1 1 15 10435 1 1 14 LYS C C -10.599 -3.014 -0.150 1.00 . A A . 11 LYS C 1 1 15 10436 1 1 14 LYS CA C -11.087 -4.453 -0.075 1.00 . A A . 11 LYS CA 1 1 15 10437 1 1 14 LYS CB C -10.952 -4.962 1.367 1.00 . A A . 11 LYS CB 1 1 15 10438 1 1 14 LYS CD C -9.485 -5.223 3.401 1.00 . A A . 11 LYS CD 1 1 15 10439 1 1 14 LYS CE C -10.051 -4.084 4.238 1.00 . A A . 11 LYS CE 1 1 15 10440 1 1 14 LYS CG C -9.533 -4.899 1.915 1.00 . A A . 11 LYS CG 1 1 15 10441 1 1 14 LYS H H -9.441 -5.102 -1.241 1.00 . A A . 11 LYS H 1 1 15 10442 1 1 14 LYS HA H -12.130 -4.474 -0.351 1.00 . A A . 11 LYS HA 1 1 15 10443 1 1 14 LYS HB2 H -11.586 -4.366 2.005 1.00 . A A . 11 LYS HB2 1 1 15 10444 1 1 14 LYS HB3 H -11.283 -5.989 1.404 1.00 . A A . 11 LYS HB3 1 1 15 10445 1 1 14 LYS HD2 H -10.066 -6.113 3.585 1.00 . A A . 11 LYS HD2 1 1 15 10446 1 1 14 LYS HD3 H -8.459 -5.394 3.690 1.00 . A A . 11 LYS HD3 1 1 15 10447 1 1 14 LYS HE2 H -9.460 -3.198 4.062 1.00 . A A . 11 LYS HE2 1 1 15 10448 1 1 14 LYS HE3 H -11.069 -3.901 3.929 1.00 . A A . 11 LYS HE3 1 1 15 10449 1 1 14 LYS HG2 H -8.918 -5.608 1.385 1.00 . A A . 11 LYS HG2 1 1 15 10450 1 1 14 LYS HG3 H -9.146 -3.903 1.763 1.00 . A A . 11 LYS HG3 1 1 15 10451 1 1 14 LYS HZ1 H -10.410 -3.589 6.232 1.00 . A A . 11 LYS HZ1 1 1 15 10452 1 1 14 LYS HZ2 H -9.061 -4.582 6.005 1.00 . A A . 11 LYS HZ2 1 1 15 10453 1 1 14 LYS HZ3 H -10.618 -5.231 5.885 1.00 . A A . 11 LYS HZ3 1 1 15 10454 1 1 14 LYS N N -10.368 -5.307 -1.016 1.00 . A A . 11 LYS N 1 1 15 10455 1 1 14 LYS NZ N -10.034 -4.394 5.690 1.00 . A A . 11 LYS NZ 1 1 15 10456 1 1 14 LYS O O -9.636 -2.710 -0.862 1.00 . A A . 11 LYS O 1 1 15 10457 1 1 15 GLU C C -9.543 -0.503 1.220 1.00 . A A . 12 GLU C 1 1 15 10458 1 1 15 GLU CA C -10.943 -0.725 0.645 1.00 . A A . 12 GLU CA 1 1 15 10459 1 1 15 GLU CB C -11.982 0.008 1.502 1.00 . A A . 12 GLU CB 1 1 15 10460 1 1 15 GLU CD C -12.853 2.214 2.365 1.00 . A A . 12 GLU CD 1 1 15 10461 1 1 15 GLU CG C -11.927 1.523 1.386 1.00 . A A . 12 GLU CG 1 1 15 10462 1 1 15 GLU H H -11.999 -2.476 1.163 1.00 . A A . 12 GLU H 1 1 15 10463 1 1 15 GLU HA H -10.978 -0.342 -0.363 1.00 . A A . 12 GLU HA 1 1 15 10464 1 1 15 GLU HB2 H -12.968 -0.316 1.204 1.00 . A A . 12 GLU HB2 1 1 15 10465 1 1 15 GLU HB3 H -11.826 -0.257 2.537 1.00 . A A . 12 GLU HB3 1 1 15 10466 1 1 15 GLU HG2 H -10.916 1.849 1.580 1.00 . A A . 12 GLU HG2 1 1 15 10467 1 1 15 GLU HG3 H -12.210 1.805 0.384 1.00 . A A . 12 GLU HG3 1 1 15 10468 1 1 15 GLU N N -11.263 -2.146 0.604 1.00 . A A . 12 GLU N 1 1 15 10469 1 1 15 GLU O O -9.010 -1.347 1.945 1.00 . A A . 12 GLU O 1 1 15 10470 1 1 15 GLU OE1 O -14.086 2.161 2.171 1.00 . A A . 12 GLU OE1 1 1 15 10471 1 1 15 GLU OE2 O -12.352 2.825 3.332 1.00 . A A . 12 GLU OE2 1 1 15 10472 1 1 16 PHE C C -7.720 1.561 2.780 1.00 . A A . 13 PHE C 1 1 15 10473 1 1 16 PHE CA C -7.628 0.988 1.373 1.00 . A A . 13 PHE CA 1 1 15 10474 1 1 16 PHE CB C -6.959 2.010 0.448 1.00 . A A . 13 PHE CB 1 1 15 10475 1 1 16 PHE CD1 C -8.551 3.912 -0.057 1.00 . A A . 13 PHE CD1 1 1 15 10476 1 1 16 PHE CD2 C -6.758 4.302 1.468 1.00 . A A . 13 PHE CD2 1 1 15 10477 1 1 16 PHE CE1 C -8.977 5.214 0.104 1.00 . A A . 13 PHE CE1 1 1 15 10478 1 1 16 PHE CE2 C -7.183 5.608 1.633 1.00 . A A . 13 PHE CE2 1 1 15 10479 1 1 16 PHE CG C -7.436 3.437 0.623 1.00 . A A . 13 PHE CG 1 1 15 10480 1 1 16 PHE CZ C -8.295 6.063 0.951 1.00 . A A . 13 PHE CZ 1 1 15 10481 1 1 16 PHE H H -9.398 1.227 0.240 1.00 . A A . 13 PHE H 1 1 15 10482 1 1 16 PHE HA H -7.025 0.093 1.401 1.00 . A A . 13 PHE HA 1 1 15 10483 1 1 16 PHE HB2 H -5.896 1.996 0.611 1.00 . A A . 13 PHE HB2 1 1 15 10484 1 1 16 PHE HB3 H -7.154 1.719 -0.569 1.00 . A A . 13 PHE HB3 1 1 15 10485 1 1 16 PHE HD1 H -9.085 3.251 -0.737 1.00 . A A . 13 PHE HD1 1 1 15 10486 1 1 16 PHE HD2 H -5.889 3.947 2.003 1.00 . A A . 13 PHE HD2 1 1 15 10487 1 1 16 PHE HE1 H -9.848 5.566 -0.434 1.00 . A A . 13 PHE HE1 1 1 15 10488 1 1 16 PHE HE2 H -6.644 6.270 2.293 1.00 . A A . 13 PHE HE2 1 1 15 10489 1 1 16 PHE HZ H -8.629 7.082 1.079 1.00 . A A . 13 PHE HZ 1 1 15 10490 1 1 16 PHE N N -8.945 0.627 0.867 1.00 . A A . 13 PHE N 1 1 15 10491 1 1 16 PHE O O -8.759 2.071 3.191 1.00 . A A . 13 PHE O 1 1 15 10492 1 1 17 LYS C C -5.138 2.732 4.958 1.00 . A A . 14 LYS C 1 1 15 10493 1 1 17 LYS CA C -6.504 2.063 4.822 1.00 . A A . 14 LYS CA 1 1 15 10494 1 1 17 LYS CB C -6.695 0.976 5.883 1.00 . A A . 14 LYS CB 1 1 15 10495 1 1 17 LYS CD C -6.844 0.340 8.302 1.00 . A A . 14 LYS CD 1 1 15 10496 1 1 17 LYS CE C -6.709 0.810 9.740 1.00 . A A . 14 LYS CE 1 1 15 10497 1 1 17 LYS CG C -6.653 1.478 7.318 1.00 . A A . 14 LYS CG 1 1 15 10498 1 1 17 LYS H H -5.849 0.992 3.128 1.00 . A A . 14 LYS H 1 1 15 10499 1 1 17 LYS HA H -7.275 2.809 4.928 1.00 . A A . 14 LYS HA 1 1 15 10500 1 1 17 LYS HB2 H -7.652 0.503 5.723 1.00 . A A . 14 LYS HB2 1 1 15 10501 1 1 17 LYS HB3 H -5.917 0.237 5.762 1.00 . A A . 14 LYS HB3 1 1 15 10502 1 1 17 LYS HD2 H -7.828 -0.081 8.164 1.00 . A A . 14 LYS HD2 1 1 15 10503 1 1 17 LYS HD3 H -6.100 -0.416 8.109 1.00 . A A . 14 LYS HD3 1 1 15 10504 1 1 17 LYS HE2 H -5.750 1.289 9.860 1.00 . A A . 14 LYS HE2 1 1 15 10505 1 1 17 LYS HE3 H -7.495 1.521 9.948 1.00 . A A . 14 LYS HE3 1 1 15 10506 1 1 17 LYS HG2 H -5.694 1.940 7.500 1.00 . A A . 14 LYS HG2 1 1 15 10507 1 1 17 LYS HG3 H -7.440 2.205 7.461 1.00 . A A . 14 LYS HG3 1 1 15 10508 1 1 17 LYS HZ1 H -6.752 0.038 11.676 1.00 . A A . 14 LYS HZ1 1 1 15 10509 1 1 17 LYS HZ2 H -6.033 -0.991 10.546 1.00 . A A . 14 LYS HZ2 1 1 15 10510 1 1 17 LYS HZ3 H -7.717 -0.814 10.579 1.00 . A A . 14 LYS HZ3 1 1 15 10511 1 1 17 LYS N N -6.618 1.477 3.499 1.00 . A A . 14 LYS N 1 1 15 10512 1 1 17 LYS NZ N -6.810 -0.317 10.702 1.00 . A A . 14 LYS NZ 1 1 15 10513 1 1 17 LYS O O -4.889 3.512 5.882 1.00 . A A . 14 LYS O 1 1 15 10514 1 1 18 TYR C C -2.591 3.494 2.601 1.00 . A A . 15 TYR C 1 1 15 10515 1 1 18 TYR CA C -2.913 2.976 3.990 1.00 . A A . 15 TYR CA 1 1 15 10516 1 1 18 TYR CB C -1.878 1.916 4.376 1.00 . A A . 15 TYR CB 1 1 15 10517 1 1 18 TYR CD1 C -3.057 0.516 6.096 1.00 . A A . 15 TYR CD1 1 1 15 10518 1 1 18 TYR CD2 C -1.142 1.752 6.773 1.00 . A A . 15 TYR CD2 1 1 15 10519 1 1 18 TYR CE1 C -3.203 0.026 7.378 1.00 . A A . 15 TYR CE1 1 1 15 10520 1 1 18 TYR CE2 C -1.277 1.265 8.059 1.00 . A A . 15 TYR CE2 1 1 15 10521 1 1 18 TYR CG C -2.029 1.385 5.776 1.00 . A A . 15 TYR CG 1 1 15 10522 1 1 18 TYR CZ C -2.311 0.403 8.357 1.00 . A A . 15 TYR CZ 1 1 15 10523 1 1 18 TYR H H -4.521 1.806 3.301 1.00 . A A . 15 TYR H 1 1 15 10524 1 1 18 TYR HA H -2.869 3.792 4.694 1.00 . A A . 15 TYR HA 1 1 15 10525 1 1 18 TYR HB2 H -1.966 1.081 3.697 1.00 . A A . 15 TYR HB2 1 1 15 10526 1 1 18 TYR HB3 H -0.889 2.342 4.286 1.00 . A A . 15 TYR HB3 1 1 15 10527 1 1 18 TYR HD1 H -3.757 0.230 5.319 1.00 . A A . 15 TYR HD1 1 1 15 10528 1 1 18 TYR HD2 H -0.335 2.429 6.532 1.00 . A A . 15 TYR HD2 1 1 15 10529 1 1 18 TYR HE1 H -4.011 -0.651 7.607 1.00 . A A . 15 TYR HE1 1 1 15 10530 1 1 18 TYR HE2 H -0.574 1.559 8.824 1.00 . A A . 15 TYR HE2 1 1 15 10531 1 1 18 TYR HH H -2.662 -1.019 9.608 1.00 . A A . 15 TYR HH 1 1 15 10532 1 1 18 TYR N N -4.257 2.424 4.015 1.00 . A A . 15 TYR N 1 1 15 10533 1 1 18 TYR O O -3.407 3.386 1.685 1.00 . A A . 15 TYR O 1 1 15 10534 1 1 18 TYR OH O -2.457 -0.076 9.638 1.00 . A A . 15 TYR OH 1 1 15 10535 1 1 19 LYS C C 0.555 4.814 1.243 1.00 . A A . 16 LYS C 1 1 15 10536 1 1 19 LYS CA C -0.941 4.559 1.176 1.00 . A A . 16 LYS CA 1 1 15 10537 1 1 19 LYS CB C -1.689 5.853 0.850 1.00 . A A . 16 LYS CB 1 1 15 10538 1 1 19 LYS CD C -2.278 7.631 -0.814 1.00 . A A . 16 LYS CD 1 1 15 10539 1 1 19 LYS CE C -2.019 8.730 0.206 1.00 . A A . 16 LYS CE 1 1 15 10540 1 1 19 LYS CG C -1.421 6.406 -0.543 1.00 . A A . 16 LYS CG 1 1 15 10541 1 1 19 LYS H H -0.798 4.095 3.227 1.00 . A A . 16 LYS H 1 1 15 10542 1 1 19 LYS HA H -1.144 3.823 0.413 1.00 . A A . 16 LYS HA 1 1 15 10543 1 1 19 LYS HB2 H -2.749 5.670 0.940 1.00 . A A . 16 LYS HB2 1 1 15 10544 1 1 19 LYS HB3 H -1.405 6.604 1.571 1.00 . A A . 16 LYS HB3 1 1 15 10545 1 1 19 LYS HD2 H -2.049 8.007 -1.799 1.00 . A A . 16 LYS HD2 1 1 15 10546 1 1 19 LYS HD3 H -3.320 7.348 -0.767 1.00 . A A . 16 LYS HD3 1 1 15 10547 1 1 19 LYS HE2 H -2.317 8.375 1.181 1.00 . A A . 16 LYS HE2 1 1 15 10548 1 1 19 LYS HE3 H -0.964 8.956 0.213 1.00 . A A . 16 LYS HE3 1 1 15 10549 1 1 19 LYS HG2 H -0.379 6.684 -0.626 1.00 . A A . 16 LYS HG2 1 1 15 10550 1 1 19 LYS HG3 H -1.654 5.646 -1.274 1.00 . A A . 16 LYS HG3 1 1 15 10551 1 1 19 LYS HZ1 H -2.490 10.343 -1.030 1.00 . A A . 16 LYS HZ1 1 1 15 10552 1 1 19 LYS HZ2 H -2.595 10.691 0.620 1.00 . A A . 16 LYS HZ2 1 1 15 10553 1 1 19 LYS HZ3 H -3.798 9.770 -0.123 1.00 . A A . 16 LYS HZ3 1 1 15 10554 1 1 19 LYS N N -1.396 4.036 2.450 1.00 . A A . 16 LYS N 1 1 15 10555 1 1 19 LYS NZ N -2.778 9.968 -0.104 1.00 . A A . 16 LYS NZ 1 1 15 10556 1 1 19 LYS O O 0.991 5.813 1.812 1.00 . A A . 16 LYS O 1 1 15 10557 1 1 20 CYS C C 3.228 5.360 0.156 1.00 . A A . 17 CYS C 1 1 15 10558 1 1 20 CYS CA C 2.788 4.005 0.697 1.00 . A A . 17 CYS CA 1 1 15 10559 1 1 20 CYS CB C 3.434 2.888 -0.134 1.00 . A A . 17 CYS CB 1 1 15 10560 1 1 20 CYS H H 0.917 3.095 0.289 1.00 . A A . 17 CYS H 1 1 15 10561 1 1 20 CYS HA H 3.122 3.917 1.717 1.00 . A A . 17 CYS HA 1 1 15 10562 1 1 20 CYS HB2 H 3.192 1.935 0.308 1.00 . A A . 17 CYS HB2 1 1 15 10563 1 1 20 CYS HB3 H 3.051 2.924 -1.142 1.00 . A A . 17 CYS HB3 1 1 15 10564 1 1 20 CYS N N 1.334 3.885 0.695 1.00 . A A . 17 CYS N 1 1 15 10565 1 1 20 CYS O O 2.875 5.730 -0.958 1.00 . A A . 17 CYS O 1 1 15 10566 1 1 20 CYS SG S 5.237 3.026 -0.217 1.00 . A A . 17 CYS SG 1 1 15 10567 1 1 21 PRO C C 5.469 7.359 -0.655 1.00 . A A . 18 PRO C 1 1 15 10568 1 1 21 PRO CA C 4.515 7.437 0.536 1.00 . A A . 18 PRO CA 1 1 15 10569 1 1 21 PRO CB C 5.254 7.939 1.779 1.00 . A A . 18 PRO CB 1 1 15 10570 1 1 21 PRO CD C 4.493 5.737 2.285 1.00 . A A . 18 PRO CD 1 1 15 10571 1 1 21 PRO CG C 5.612 6.707 2.530 1.00 . A A . 18 PRO CG 1 1 15 10572 1 1 21 PRO HA H 3.701 8.108 0.300 1.00 . A A . 18 PRO HA 1 1 15 10573 1 1 21 PRO HB2 H 6.134 8.487 1.480 1.00 . A A . 18 PRO HB2 1 1 15 10574 1 1 21 PRO HB3 H 4.604 8.578 2.357 1.00 . A A . 18 PRO HB3 1 1 15 10575 1 1 21 PRO HD2 H 4.864 4.722 2.297 1.00 . A A . 18 PRO HD2 1 1 15 10576 1 1 21 PRO HD3 H 3.711 5.865 3.019 1.00 . A A . 18 PRO HD3 1 1 15 10577 1 1 21 PRO HG2 H 6.543 6.306 2.155 1.00 . A A . 18 PRO HG2 1 1 15 10578 1 1 21 PRO HG3 H 5.696 6.927 3.582 1.00 . A A . 18 PRO HG3 1 1 15 10579 1 1 21 PRO N N 4.020 6.113 0.939 1.00 . A A . 18 PRO N 1 1 15 10580 1 1 21 PRO O O 5.790 8.369 -1.277 1.00 . A A . 18 PRO O 1 1 15 10581 1 1 22 ARG C C 5.988 5.472 -3.312 1.00 . A A . 19 ARG C 1 1 15 10582 1 1 22 ARG CA C 6.790 5.923 -2.102 1.00 . A A . 19 ARG CA 1 1 15 10583 1 1 22 ARG CB C 7.836 4.857 -1.787 1.00 . A A . 19 ARG CB 1 1 15 10584 1 1 22 ARG CD C 10.284 4.463 -2.059 1.00 . A A . 19 ARG CD 1 1 15 10585 1 1 22 ARG CG C 9.221 5.409 -1.523 1.00 . A A . 19 ARG CG 1 1 15 10586 1 1 22 ARG CZ C 10.220 2.784 -3.871 1.00 . A A . 19 ARG CZ 1 1 15 10587 1 1 22 ARG H H 5.667 5.393 -0.388 1.00 . A A . 19 ARG H 1 1 15 10588 1 1 22 ARG HA H 7.289 6.850 -2.335 1.00 . A A . 19 ARG HA 1 1 15 10589 1 1 22 ARG HB2 H 7.520 4.308 -0.913 1.00 . A A . 19 ARG HB2 1 1 15 10590 1 1 22 ARG HB3 H 7.899 4.176 -2.623 1.00 . A A . 19 ARG HB3 1 1 15 10591 1 1 22 ARG HD2 H 11.232 4.979 -2.083 1.00 . A A . 19 ARG HD2 1 1 15 10592 1 1 22 ARG HD3 H 10.353 3.608 -1.405 1.00 . A A . 19 ARG HD3 1 1 15 10593 1 1 22 ARG HE H 9.460 4.631 -3.988 1.00 . A A . 19 ARG HE 1 1 15 10594 1 1 22 ARG HG2 H 9.322 6.369 -2.005 1.00 . A A . 19 ARG HG2 1 1 15 10595 1 1 22 ARG HG3 H 9.354 5.517 -0.452 1.00 . A A . 19 ARG HG3 1 1 15 10596 1 1 22 ARG HH11 H 11.384 2.259 -2.301 1.00 . A A . 19 ARG HH11 1 1 15 10597 1 1 22 ARG HH12 H 11.197 1.043 -3.522 1.00 . A A . 19 ARG HH12 1 1 15 10598 1 1 22 ARG HH21 H 9.199 3.038 -5.600 1.00 . A A . 19 ARG HH21 1 1 15 10599 1 1 22 ARG HH22 H 9.911 1.466 -5.386 1.00 . A A . 19 ARG HH22 1 1 15 10600 1 1 22 ARG N N 5.924 6.151 -0.956 1.00 . A A . 19 ARG N 1 1 15 10601 1 1 22 ARG NE N 9.954 4.005 -3.410 1.00 . A A . 19 ARG NE 1 1 15 10602 1 1 22 ARG NH1 N 10.995 1.964 -3.176 1.00 . A A . 19 ARG NH1 1 1 15 10603 1 1 22 ARG NH2 N 9.748 2.406 -5.049 1.00 . A A . 19 ARG NH2 1 1 15 10604 1 1 22 ARG O O 6.018 6.100 -4.367 1.00 . A A . 19 ARG O 1 1 15 10605 1 1 23 CYS C C 3.218 4.337 -4.521 1.00 . A A . 20 CYS C 1 1 15 10606 1 1 23 CYS CA C 4.589 3.724 -4.255 1.00 . A A . 20 CYS CA 1 1 15 10607 1 1 23 CYS CB C 4.444 2.230 -3.958 1.00 . A A . 20 CYS CB 1 1 15 10608 1 1 23 CYS H H 5.161 4.011 -2.242 1.00 . A A . 20 CYS H 1 1 15 10609 1 1 23 CYS HA H 5.202 3.852 -5.133 1.00 . A A . 20 CYS HA 1 1 15 10610 1 1 23 CYS HB2 H 3.774 2.103 -3.123 1.00 . A A . 20 CYS HB2 1 1 15 10611 1 1 23 CYS HB3 H 4.030 1.737 -4.824 1.00 . A A . 20 CYS HB3 1 1 15 10612 1 1 23 CYS N N 5.259 4.381 -3.142 1.00 . A A . 20 CYS N 1 1 15 10613 1 1 23 CYS O O 2.599 4.080 -5.556 1.00 . A A . 20 CYS O 1 1 15 10614 1 1 23 CYS SG S 5.998 1.404 -3.544 1.00 . A A . 20 CYS SG 1 1 15 10615 1 1 24 LEU C C 0.342 4.717 -3.712 1.00 . A A . 21 LEU C 1 1 15 10616 1 1 24 LEU CA C 1.440 5.763 -3.593 1.00 . A A . 21 LEU CA 1 1 15 10617 1 1 24 LEU CB C 1.320 6.793 -4.722 1.00 . A A . 21 LEU CB 1 1 15 10618 1 1 24 LEU CD1 C 1.722 9.181 -5.333 1.00 . A A . 21 LEU CD1 1 1 15 10619 1 1 24 LEU CD2 C 2.736 8.266 -3.244 1.00 . A A . 21 LEU CD2 1 1 15 10620 1 1 24 LEU CG C 2.319 7.954 -4.673 1.00 . A A . 21 LEU CG 1 1 15 10621 1 1 24 LEU H H 3.345 5.333 -2.800 1.00 . A A . 21 LEU H 1 1 15 10622 1 1 24 LEU HA H 1.311 6.275 -2.650 1.00 . A A . 21 LEU HA 1 1 15 10623 1 1 24 LEU HB2 H 1.449 6.276 -5.661 1.00 . A A . 21 LEU HB2 1 1 15 10624 1 1 24 LEU HB3 H 0.323 7.206 -4.694 1.00 . A A . 21 LEU HB3 1 1 15 10625 1 1 24 LEU HD11 H 0.828 9.473 -4.798 1.00 . A A . 21 LEU HD11 1 1 15 10626 1 1 24 LEU HD12 H 1.470 8.953 -6.358 1.00 . A A . 21 LEU HD12 1 1 15 10627 1 1 24 LEU HD13 H 2.436 9.990 -5.306 1.00 . A A . 21 LEU HD13 1 1 15 10628 1 1 24 LEU HD21 H 1.861 8.491 -2.654 1.00 . A A . 21 LEU HD21 1 1 15 10629 1 1 24 LEU HD22 H 3.400 9.117 -3.241 1.00 . A A . 21 LEU HD22 1 1 15 10630 1 1 24 LEU HD23 H 3.245 7.410 -2.824 1.00 . A A . 21 LEU HD23 1 1 15 10631 1 1 24 LEU HG H 3.205 7.679 -5.227 1.00 . A A . 21 LEU HG 1 1 15 10632 1 1 24 LEU N N 2.762 5.139 -3.564 1.00 . A A . 21 LEU N 1 1 15 10633 1 1 24 LEU O O -0.774 5.016 -4.134 1.00 . A A . 21 LEU O 1 1 15 10634 1 1 25 VAL C C -1.175 2.402 -2.161 1.00 . A A . 22 VAL C 1 1 15 10635 1 1 25 VAL CA C -0.291 2.412 -3.399 1.00 . A A . 22 VAL CA 1 1 15 10636 1 1 25 VAL CB C 0.401 1.038 -3.589 1.00 . A A . 22 VAL CB 1 1 15 10637 1 1 25 VAL CG1 C 1.332 0.710 -2.433 1.00 . A A . 22 VAL CG1 1 1 15 10638 1 1 25 VAL CG2 C -0.631 -0.061 -3.771 1.00 . A A . 22 VAL CG2 1 1 15 10639 1 1 25 VAL H H 1.548 3.324 -2.962 1.00 . A A . 22 VAL H 1 1 15 10640 1 1 25 VAL HA H -0.916 2.594 -4.262 1.00 . A A . 22 VAL HA 1 1 15 10641 1 1 25 VAL HB H 0.997 1.088 -4.489 1.00 . A A . 22 VAL HB 1 1 15 10642 1 1 25 VAL HG11 H 1.803 -0.246 -2.610 1.00 . A A . 22 VAL HG11 1 1 15 10643 1 1 25 VAL HG12 H 0.763 0.665 -1.517 1.00 . A A . 22 VAL HG12 1 1 15 10644 1 1 25 VAL HG13 H 2.088 1.474 -2.349 1.00 . A A . 22 VAL HG13 1 1 15 10645 1 1 25 VAL HG21 H -1.285 -0.087 -2.912 1.00 . A A . 22 VAL HG21 1 1 15 10646 1 1 25 VAL HG22 H -0.132 -1.012 -3.872 1.00 . A A . 22 VAL HG22 1 1 15 10647 1 1 25 VAL HG23 H -1.211 0.136 -4.659 1.00 . A A . 22 VAL HG23 1 1 15 10648 1 1 25 VAL N N 0.660 3.494 -3.319 1.00 . A A . 22 VAL N 1 1 15 10649 1 1 25 VAL O O -0.699 2.290 -1.026 1.00 . A A . 22 VAL O 1 1 15 10650 1 1 26 GLN C C -3.650 1.091 -0.891 1.00 . A A . 23 GLN C 1 1 15 10651 1 1 26 GLN CA C -3.446 2.533 -1.334 1.00 . A A . 23 GLN CA 1 1 15 10652 1 1 26 GLN CB C -4.753 3.151 -1.829 1.00 . A A . 23 GLN CB 1 1 15 10653 1 1 26 GLN CD C -5.814 5.128 -3.004 1.00 . A A . 23 GLN CD 1 1 15 10654 1 1 26 GLN CG C -4.611 4.611 -2.237 1.00 . A A . 23 GLN CG 1 1 15 10655 1 1 26 GLN H H -2.753 2.744 -3.314 1.00 . A A . 23 GLN H 1 1 15 10656 1 1 26 GLN HA H -3.073 3.104 -0.492 1.00 . A A . 23 GLN HA 1 1 15 10657 1 1 26 GLN HB2 H -5.105 2.590 -2.682 1.00 . A A . 23 GLN HB2 1 1 15 10658 1 1 26 GLN HB3 H -5.488 3.091 -1.042 1.00 . A A . 23 GLN HB3 1 1 15 10659 1 1 26 GLN HE21 H -6.678 5.725 -1.320 1.00 . A A . 23 GLN HE21 1 1 15 10660 1 1 26 GLN HE22 H -7.574 6.015 -2.769 1.00 . A A . 23 GLN HE22 1 1 15 10661 1 1 26 GLN HG2 H -4.490 5.209 -1.347 1.00 . A A . 23 GLN HG2 1 1 15 10662 1 1 26 GLN HG3 H -3.735 4.713 -2.859 1.00 . A A . 23 GLN HG3 1 1 15 10663 1 1 26 GLN N N -2.458 2.578 -2.393 1.00 . A A . 23 GLN N 1 1 15 10664 1 1 26 GLN NE2 N -6.784 5.678 -2.292 1.00 . A A . 23 GLN NE2 1 1 15 10665 1 1 26 GLN O O -4.350 0.314 -1.544 1.00 . A A . 23 GLN O 1 1 15 10666 1 1 26 GLN OE1 O -5.864 5.040 -4.233 1.00 . A A . 23 GLN OE1 1 1 15 10667 1 1 27 THR C C -4.127 -0.768 1.771 1.00 . A A . 24 THR C 1 1 15 10668 1 1 27 THR CA C -3.041 -0.620 0.716 1.00 . A A . 24 THR CA 1 1 15 10669 1 1 27 THR CB C -1.680 -1.015 1.316 1.00 . A A . 24 THR CB 1 1 15 10670 1 1 27 THR CG2 C -0.694 -1.382 0.225 1.00 . A A . 24 THR CG2 1 1 15 10671 1 1 27 THR H H -2.482 1.411 0.687 1.00 . A A . 24 THR H 1 1 15 10672 1 1 27 THR HA H -3.255 -1.286 -0.107 1.00 . A A . 24 THR HA 1 1 15 10673 1 1 27 THR HB H -1.823 -1.875 1.955 1.00 . A A . 24 THR HB 1 1 15 10674 1 1 27 THR HG1 H -0.314 0.344 1.730 1.00 . A A . 24 THR HG1 1 1 15 10675 1 1 27 THR HG21 H 0.243 -1.678 0.672 1.00 . A A . 24 THR HG21 1 1 15 10676 1 1 27 THR HG22 H -0.534 -0.531 -0.418 1.00 . A A . 24 THR HG22 1 1 15 10677 1 1 27 THR HG23 H -1.091 -2.203 -0.351 1.00 . A A . 24 THR HG23 1 1 15 10678 1 1 27 THR N N -3.000 0.734 0.201 1.00 . A A . 24 THR N 1 1 15 10679 1 1 27 THR O O -4.504 0.194 2.435 1.00 . A A . 24 THR O 1 1 15 10680 1 1 27 THR OG1 O -1.158 0.062 2.096 1.00 . A A . 24 THR OG1 1 1 15 10681 1 1 28 CYS C C -5.176 -2.396 4.255 1.00 . A A . 25 CYS C 1 1 15 10682 1 1 28 CYS CA C -5.712 -2.267 2.835 1.00 . A A . 25 CYS CA 1 1 15 10683 1 1 28 CYS CB C -6.437 -3.550 2.415 1.00 . A A . 25 CYS CB 1 1 15 10684 1 1 28 CYS H H -4.281 -2.704 1.351 1.00 . A A . 25 CYS H 1 1 15 10685 1 1 28 CYS HA H -6.409 -1.442 2.799 1.00 . A A . 25 CYS HA 1 1 15 10686 1 1 28 CYS HB2 H -7.320 -3.679 3.019 1.00 . A A . 25 CYS HB2 1 1 15 10687 1 1 28 CYS HB3 H -6.734 -3.460 1.384 1.00 . A A . 25 CYS HB3 1 1 15 10688 1 1 28 CYS N N -4.634 -1.983 1.903 1.00 . A A . 25 CYS N 1 1 15 10689 1 1 28 CYS O O -5.877 -2.097 5.222 1.00 . A A . 25 CYS O 1 1 15 10690 1 1 28 CYS SG S -5.444 -5.052 2.566 1.00 . A A . 25 CYS SG 1 1 15 10691 1 1 29 SER C C -1.787 -3.032 5.557 1.00 . A A . 26 SER C 1 1 15 10692 1 1 29 SER CA C -3.305 -3.026 5.685 1.00 . A A . 26 SER CA 1 1 15 10693 1 1 29 SER CB C -3.784 -4.333 6.328 1.00 . A A . 26 SER CB 1 1 15 10694 1 1 29 SER H H -3.396 -3.022 3.568 1.00 . A A . 26 SER H 1 1 15 10695 1 1 29 SER HA H -3.598 -2.198 6.313 1.00 . A A . 26 SER HA 1 1 15 10696 1 1 29 SER HB2 H -3.536 -5.162 5.682 1.00 . A A . 26 SER HB2 1 1 15 10697 1 1 29 SER HB3 H -3.293 -4.463 7.281 1.00 . A A . 26 SER HB3 1 1 15 10698 1 1 29 SER HG H -5.553 -3.490 6.199 1.00 . A A . 26 SER HG 1 1 15 10699 1 1 29 SER N N -3.924 -2.834 4.378 1.00 . A A . 26 SER N 1 1 15 10700 1 1 29 SER O O -1.263 -3.006 4.437 1.00 . A A . 26 SER O 1 1 15 10701 1 1 29 SER OG O -5.188 -4.322 6.534 1.00 . A A . 26 SER OG 1 1 15 10702 1 1 30 LEU C C 0.917 -4.293 5.920 1.00 . A A . 27 LEU C 1 1 15 10703 1 1 30 LEU CA C 0.376 -3.080 6.672 1.00 . A A . 27 LEU CA 1 1 15 10704 1 1 30 LEU CB C 0.936 -3.052 8.097 1.00 . A A . 27 LEU CB 1 1 15 10705 1 1 30 LEU CD1 C 1.253 -1.852 10.270 1.00 . A A . 27 LEU CD1 1 1 15 10706 1 1 30 LEU CD2 C 1.609 -0.634 8.119 1.00 . A A . 27 LEU CD2 1 1 15 10707 1 1 30 LEU CG C 0.800 -1.715 8.826 1.00 . A A . 27 LEU CG 1 1 15 10708 1 1 30 LEU H H -1.556 -3.108 7.547 1.00 . A A . 27 LEU H 1 1 15 10709 1 1 30 LEU HA H 0.696 -2.189 6.157 1.00 . A A . 27 LEU HA 1 1 15 10710 1 1 30 LEU HB2 H 0.426 -3.808 8.675 1.00 . A A . 27 LEU HB2 1 1 15 10711 1 1 30 LEU HB3 H 1.983 -3.304 8.052 1.00 . A A . 27 LEU HB3 1 1 15 10712 1 1 30 LEU HD11 H 0.638 -2.585 10.772 1.00 . A A . 27 LEU HD11 1 1 15 10713 1 1 30 LEU HD12 H 1.157 -0.900 10.769 1.00 . A A . 27 LEU HD12 1 1 15 10714 1 1 30 LEU HD13 H 2.284 -2.171 10.294 1.00 . A A . 27 LEU HD13 1 1 15 10715 1 1 30 LEU HD21 H 1.227 -0.493 7.119 1.00 . A A . 27 LEU HD21 1 1 15 10716 1 1 30 LEU HD22 H 2.645 -0.935 8.070 1.00 . A A . 27 LEU HD22 1 1 15 10717 1 1 30 LEU HD23 H 1.529 0.292 8.669 1.00 . A A . 27 LEU HD23 1 1 15 10718 1 1 30 LEU HG H -0.238 -1.413 8.826 1.00 . A A . 27 LEU HG 1 1 15 10719 1 1 30 LEU N N -1.083 -3.078 6.685 1.00 . A A . 27 LEU N 1 1 15 10720 1 1 30 LEU O O 1.953 -4.205 5.262 1.00 . A A . 27 LEU O 1 1 15 10721 1 1 31 GLU C C 0.827 -6.350 3.817 1.00 . A A . 28 GLU C 1 1 15 10722 1 1 31 GLU CA C 0.565 -6.634 5.296 1.00 . A A . 28 GLU CA 1 1 15 10723 1 1 31 GLU CB C -0.552 -7.670 5.438 1.00 . A A . 28 GLU CB 1 1 15 10724 1 1 31 GLU CD C 1.026 -9.634 5.528 1.00 . A A . 28 GLU CD 1 1 15 10725 1 1 31 GLU CG C -0.200 -9.035 4.874 1.00 . A A . 28 GLU CG 1 1 15 10726 1 1 31 GLU H H -0.591 -5.418 6.588 1.00 . A A . 28 GLU H 1 1 15 10727 1 1 31 GLU HA H 1.465 -7.024 5.743 1.00 . A A . 28 GLU HA 1 1 15 10728 1 1 31 GLU HB2 H -0.788 -7.787 6.484 1.00 . A A . 28 GLU HB2 1 1 15 10729 1 1 31 GLU HB3 H -1.429 -7.306 4.920 1.00 . A A . 28 GLU HB3 1 1 15 10730 1 1 31 GLU HG2 H -1.035 -9.703 5.030 1.00 . A A . 28 GLU HG2 1 1 15 10731 1 1 31 GLU HG3 H -0.013 -8.935 3.815 1.00 . A A . 28 GLU HG3 1 1 15 10732 1 1 31 GLU N N 0.199 -5.409 6.008 1.00 . A A . 28 GLU N 1 1 15 10733 1 1 31 GLU O O 1.819 -6.805 3.248 1.00 . A A . 28 GLU O 1 1 15 10734 1 1 31 GLU OE1 O 0.948 -10.015 6.715 1.00 . A A . 28 GLU OE1 1 1 15 10735 1 1 31 GLU OE2 O 2.073 -9.736 4.854 1.00 . A A . 28 GLU OE2 1 1 15 10736 1 1 32 CYS C C 1.057 -4.071 1.622 1.00 . A A . 29 CYS C 1 1 15 10737 1 1 32 CYS CA C 0.078 -5.224 1.808 1.00 . A A . 29 CYS CA 1 1 15 10738 1 1 32 CYS CB C -1.289 -4.862 1.243 1.00 . A A . 29 CYS CB 1 1 15 10739 1 1 32 CYS H H -0.815 -5.226 3.714 1.00 . A A . 29 CYS H 1 1 15 10740 1 1 32 CYS HA H 0.455 -6.088 1.284 1.00 . A A . 29 CYS HA 1 1 15 10741 1 1 32 CYS HB2 H -1.821 -4.269 1.972 1.00 . A A . 29 CYS HB2 1 1 15 10742 1 1 32 CYS HB3 H -1.164 -4.283 0.345 1.00 . A A . 29 CYS HB3 1 1 15 10743 1 1 32 CYS N N -0.055 -5.575 3.208 1.00 . A A . 29 CYS N 1 1 15 10744 1 1 32 CYS O O 1.715 -3.963 0.590 1.00 . A A . 29 CYS O 1 1 15 10745 1 1 32 CYS SG S -2.322 -6.291 0.849 1.00 . A A . 29 CYS SG 1 1 15 10746 1 1 33 SER C C 3.517 -2.543 2.599 1.00 . A A . 30 SER C 1 1 15 10747 1 1 33 SER CA C 2.064 -2.080 2.589 1.00 . A A . 30 SER CA 1 1 15 10748 1 1 33 SER CB C 1.793 -1.143 3.771 1.00 . A A . 30 SER CB 1 1 15 10749 1 1 33 SER H H 0.623 -3.369 3.441 1.00 . A A . 30 SER H 1 1 15 10750 1 1 33 SER HA H 1.878 -1.548 1.669 1.00 . A A . 30 SER HA 1 1 15 10751 1 1 33 SER HB2 H 0.740 -0.908 3.807 1.00 . A A . 30 SER HB2 1 1 15 10752 1 1 33 SER HB3 H 2.082 -1.635 4.688 1.00 . A A . 30 SER HB3 1 1 15 10753 1 1 33 SER HG H 3.406 -0.121 3.301 1.00 . A A . 30 SER HG 1 1 15 10754 1 1 33 SER N N 1.163 -3.223 2.637 1.00 . A A . 30 SER N 1 1 15 10755 1 1 33 SER O O 4.409 -1.821 2.165 1.00 . A A . 30 SER O 1 1 15 10756 1 1 33 SER OG O 2.524 0.067 3.654 1.00 . A A . 30 SER OG 1 1 15 10757 1 1 34 LYS C C 5.229 -5.446 2.126 1.00 . A A . 31 LYS C 1 1 15 10758 1 1 34 LYS CA C 5.091 -4.309 3.135 1.00 . A A . 31 LYS CA 1 1 15 10759 1 1 34 LYS CB C 5.422 -4.812 4.541 1.00 . A A . 31 LYS CB 1 1 15 10760 1 1 34 LYS CD C 4.978 -6.476 6.364 1.00 . A A . 31 LYS CD 1 1 15 10761 1 1 34 LYS CE C 4.248 -7.753 6.738 1.00 . A A . 31 LYS CE 1 1 15 10762 1 1 34 LYS CG C 4.585 -6.000 4.978 1.00 . A A . 31 LYS CG 1 1 15 10763 1 1 34 LYS H H 3.005 -4.265 3.478 1.00 . A A . 31 LYS H 1 1 15 10764 1 1 34 LYS HA H 5.781 -3.525 2.871 1.00 . A A . 31 LYS HA 1 1 15 10765 1 1 34 LYS HB2 H 6.462 -5.101 4.574 1.00 . A A . 31 LYS HB2 1 1 15 10766 1 1 34 LYS HB3 H 5.259 -4.008 5.244 1.00 . A A . 31 LYS HB3 1 1 15 10767 1 1 34 LYS HD2 H 6.041 -6.660 6.383 1.00 . A A . 31 LYS HD2 1 1 15 10768 1 1 34 LYS HD3 H 4.731 -5.706 7.081 1.00 . A A . 31 LYS HD3 1 1 15 10769 1 1 34 LYS HE2 H 4.520 -8.022 7.745 1.00 . A A . 31 LYS HE2 1 1 15 10770 1 1 34 LYS HE3 H 3.185 -7.572 6.690 1.00 . A A . 31 LYS HE3 1 1 15 10771 1 1 34 LYS HG2 H 3.546 -5.709 4.991 1.00 . A A . 31 LYS HG2 1 1 15 10772 1 1 34 LYS HG3 H 4.727 -6.807 4.275 1.00 . A A . 31 LYS HG3 1 1 15 10773 1 1 34 LYS HZ1 H 4.445 -8.600 4.841 1.00 . A A . 31 LYS HZ1 1 1 15 10774 1 1 34 LYS HZ2 H 3.988 -9.701 6.038 1.00 . A A . 31 LYS HZ2 1 1 15 10775 1 1 34 LYS HZ3 H 5.586 -9.152 5.960 1.00 . A A . 31 LYS HZ3 1 1 15 10776 1 1 34 LYS N N 3.750 -3.748 3.102 1.00 . A A . 31 LYS N 1 1 15 10777 1 1 34 LYS NZ N 4.591 -8.879 5.830 1.00 . A A . 31 LYS NZ 1 1 15 10778 1 1 34 LYS O O 6.293 -6.051 1.996 1.00 . A A . 31 LYS O 1 1 15 10779 1 1 35 LYS C C 4.886 -6.430 -0.820 1.00 . A A . 32 LYS C 1 1 15 10780 1 1 35 LYS CA C 4.144 -6.822 0.448 1.00 . A A . 32 LYS CA 1 1 15 10781 1 1 35 LYS CB C 2.712 -7.222 0.117 1.00 . A A . 32 LYS CB 1 1 15 10782 1 1 35 LYS CD C 1.177 -9.104 -0.474 1.00 . A A . 32 LYS CD 1 1 15 10783 1 1 35 LYS CE C 1.066 -10.514 -1.035 1.00 . A A . 32 LYS CE 1 1 15 10784 1 1 35 LYS CG C 2.602 -8.589 -0.532 1.00 . A A . 32 LYS CG 1 1 15 10785 1 1 35 LYS H H 3.343 -5.184 1.517 1.00 . A A . 32 LYS H 1 1 15 10786 1 1 35 LYS HA H 4.646 -7.662 0.900 1.00 . A A . 32 LYS HA 1 1 15 10787 1 1 35 LYS HB2 H 2.134 -7.231 1.028 1.00 . A A . 32 LYS HB2 1 1 15 10788 1 1 35 LYS HB3 H 2.296 -6.489 -0.561 1.00 . A A . 32 LYS HB3 1 1 15 10789 1 1 35 LYS HD2 H 0.856 -9.109 0.556 1.00 . A A . 32 LYS HD2 1 1 15 10790 1 1 35 LYS HD3 H 0.546 -8.445 -1.048 1.00 . A A . 32 LYS HD3 1 1 15 10791 1 1 35 LYS HE2 H 0.032 -10.824 -0.992 1.00 . A A . 32 LYS HE2 1 1 15 10792 1 1 35 LYS HE3 H 1.395 -10.506 -2.063 1.00 . A A . 32 LYS HE3 1 1 15 10793 1 1 35 LYS HG2 H 2.908 -8.514 -1.564 1.00 . A A . 32 LYS HG2 1 1 15 10794 1 1 35 LYS HG3 H 3.247 -9.280 -0.011 1.00 . A A . 32 LYS HG3 1 1 15 10795 1 1 35 LYS HZ1 H 1.565 -11.537 0.716 1.00 . A A . 32 LYS HZ1 1 1 15 10796 1 1 35 LYS HZ2 H 2.889 -11.189 -0.274 1.00 . A A . 32 LYS HZ2 1 1 15 10797 1 1 35 LYS HZ3 H 1.824 -12.430 -0.697 1.00 . A A . 32 LYS HZ3 1 1 15 10798 1 1 35 LYS N N 4.153 -5.725 1.403 1.00 . A A . 32 LYS N 1 1 15 10799 1 1 35 LYS NZ N 1.893 -11.484 -0.268 1.00 . A A . 32 LYS NZ 1 1 15 10800 1 1 35 LYS O O 5.584 -7.242 -1.424 1.00 . A A . 32 LYS O 1 1 15 10801 1 1 36 HIS C C 6.898 -4.444 -2.125 1.00 . A A . 33 HIS C 1 1 15 10802 1 1 36 HIS CA C 5.412 -4.669 -2.396 1.00 . A A . 33 HIS CA 1 1 15 10803 1 1 36 HIS CB C 4.745 -3.373 -2.887 1.00 . A A . 33 HIS CB 1 1 15 10804 1 1 36 HIS CD2 C 5.920 -1.621 -1.374 1.00 . A A . 33 HIS CD2 1 1 15 10805 1 1 36 HIS CE1 C 4.209 -0.489 -0.723 1.00 . A A . 33 HIS CE1 1 1 15 10806 1 1 36 HIS CG C 4.838 -2.201 -1.944 1.00 . A A . 33 HIS CG 1 1 15 10807 1 1 36 HIS H H 4.172 -4.571 -0.683 1.00 . A A . 33 HIS H 1 1 15 10808 1 1 36 HIS HA H 5.316 -5.422 -3.165 1.00 . A A . 33 HIS HA 1 1 15 10809 1 1 36 HIS HB2 H 5.200 -3.076 -3.818 1.00 . A A . 33 HIS HB2 1 1 15 10810 1 1 36 HIS HB3 H 3.695 -3.572 -3.058 1.00 . A A . 33 HIS HB3 1 1 15 10811 1 1 36 HIS HD1 H 2.817 -1.644 -1.756 1.00 . A A . 33 HIS HD1 1 1 15 10812 1 1 36 HIS HD2 H 6.940 -1.948 -1.491 1.00 . A A . 33 HIS HD2 1 1 15 10813 1 1 36 HIS HE1 H 3.571 0.214 -0.210 1.00 . A A . 33 HIS HE1 1 1 15 10814 1 1 36 HIS N N 4.745 -5.173 -1.206 1.00 . A A . 33 HIS N 1 1 15 10815 1 1 36 HIS ND1 N 3.756 -1.475 -1.517 1.00 . A A . 33 HIS ND1 1 1 15 10816 1 1 36 HIS NE2 N 5.528 -0.527 -0.609 1.00 . A A . 33 HIS NE2 1 1 15 10817 1 1 36 HIS O O 7.711 -4.384 -3.046 1.00 . A A . 33 HIS O 1 1 15 10818 1 1 37 LYS C C 9.560 -5.166 -0.792 1.00 . A A . 34 LYS C 1 1 15 10819 1 1 37 LYS CA C 8.608 -4.033 -0.442 1.00 . A A . 34 LYS CA 1 1 15 10820 1 1 37 LYS CB C 8.661 -3.742 1.061 1.00 . A A . 34 LYS CB 1 1 15 10821 1 1 37 LYS CD C 7.959 -2.232 2.960 1.00 . A A . 34 LYS CD 1 1 15 10822 1 1 37 LYS CE C 7.153 -0.998 3.344 1.00 . A A . 34 LYS CE 1 1 15 10823 1 1 37 LYS CG C 7.820 -2.544 1.477 1.00 . A A . 34 LYS CG 1 1 15 10824 1 1 37 LYS H H 6.572 -4.518 -0.156 1.00 . A A . 34 LYS H 1 1 15 10825 1 1 37 LYS HA H 8.912 -3.147 -0.980 1.00 . A A . 34 LYS HA 1 1 15 10826 1 1 37 LYS HB2 H 8.304 -4.610 1.598 1.00 . A A . 34 LYS HB2 1 1 15 10827 1 1 37 LYS HB3 H 9.686 -3.552 1.345 1.00 . A A . 34 LYS HB3 1 1 15 10828 1 1 37 LYS HD2 H 7.606 -3.076 3.533 1.00 . A A . 34 LYS HD2 1 1 15 10829 1 1 37 LYS HD3 H 9.001 -2.054 3.183 1.00 . A A . 34 LYS HD3 1 1 15 10830 1 1 37 LYS HE2 H 7.550 -0.146 2.813 1.00 . A A . 34 LYS HE2 1 1 15 10831 1 1 37 LYS HE3 H 6.123 -1.151 3.051 1.00 . A A . 34 LYS HE3 1 1 15 10832 1 1 37 LYS HG2 H 8.141 -1.683 0.912 1.00 . A A . 34 LYS HG2 1 1 15 10833 1 1 37 LYS HG3 H 6.783 -2.752 1.256 1.00 . A A . 34 LYS HG3 1 1 15 10834 1 1 37 LYS HZ1 H 8.189 -0.566 5.108 1.00 . A A . 34 LYS HZ1 1 1 15 10835 1 1 37 LYS HZ2 H 6.816 -1.525 5.338 1.00 . A A . 34 LYS HZ2 1 1 15 10836 1 1 37 LYS HZ3 H 6.648 0.127 5.027 1.00 . A A . 34 LYS HZ3 1 1 15 10837 1 1 37 LYS N N 7.248 -4.354 -0.846 1.00 . A A . 34 LYS N 1 1 15 10838 1 1 37 LYS NZ N 7.207 -0.722 4.805 1.00 . A A . 34 LYS NZ 1 1 15 10839 1 1 37 LYS O O 10.747 -4.940 -1.011 1.00 . A A . 34 LYS O 1 1 15 10840 1 1 38 THR C C 10.078 -7.798 -2.600 1.00 . A A . 35 THR C 1 1 15 10841 1 1 38 THR CA C 9.832 -7.556 -1.107 1.00 . A A . 35 THR CA 1 1 15 10842 1 1 38 THR CB C 9.156 -8.797 -0.476 1.00 . A A . 35 THR CB 1 1 15 10843 1 1 38 THR CG2 C 7.989 -9.282 -1.325 1.00 . A A . 35 THR CG2 1 1 15 10844 1 1 38 THR H H 8.048 -6.468 -0.799 1.00 . A A . 35 THR H 1 1 15 10845 1 1 38 THR HA H 10.781 -7.400 -0.619 1.00 . A A . 35 THR HA 1 1 15 10846 1 1 38 THR HB H 8.774 -8.515 0.493 1.00 . A A . 35 THR HB 1 1 15 10847 1 1 38 THR HG1 H 10.979 -9.560 -0.586 1.00 . A A . 35 THR HG1 1 1 15 10848 1 1 38 THR HG21 H 7.542 -10.148 -0.862 1.00 . A A . 35 THR HG21 1 1 15 10849 1 1 38 THR HG22 H 8.345 -9.545 -2.310 1.00 . A A . 35 THR HG22 1 1 15 10850 1 1 38 THR HG23 H 7.252 -8.496 -1.408 1.00 . A A . 35 THR HG23 1 1 15 10851 1 1 38 THR N N 9.021 -6.372 -0.886 1.00 . A A . 35 THR N 1 1 15 10852 1 1 38 THR O O 10.788 -8.731 -2.978 1.00 . A A . 35 THR O 1 1 15 10853 1 1 38 THR OG1 O 10.100 -9.865 -0.315 1.00 . A A . 35 THR OG1 1 1 15 10854 1 1 39 ARG C C 10.070 -5.827 -5.565 1.00 . A A . 36 ARG C 1 1 15 10855 1 1 39 ARG CA C 9.640 -7.127 -4.887 1.00 . A A . 36 ARG CA 1 1 15 10856 1 1 39 ARG CB C 8.334 -7.643 -5.500 1.00 . A A . 36 ARG CB 1 1 15 10857 1 1 39 ARG CD C 5.887 -7.269 -5.922 1.00 . A A . 36 ARG CD 1 1 15 10858 1 1 39 ARG CG C 7.137 -6.746 -5.234 1.00 . A A . 36 ARG CG 1 1 15 10859 1 1 39 ARG CZ C 3.506 -6.618 -6.081 1.00 . A A . 36 ARG CZ 1 1 15 10860 1 1 39 ARG H H 8.959 -6.217 -3.097 1.00 . A A . 36 ARG H 1 1 15 10861 1 1 39 ARG HA H 10.410 -7.867 -5.048 1.00 . A A . 36 ARG HA 1 1 15 10862 1 1 39 ARG HB2 H 8.463 -7.726 -6.569 1.00 . A A . 36 ARG HB2 1 1 15 10863 1 1 39 ARG HB3 H 8.122 -8.621 -5.095 1.00 . A A . 36 ARG HB3 1 1 15 10864 1 1 39 ARG HD2 H 6.116 -7.467 -6.958 1.00 . A A . 36 ARG HD2 1 1 15 10865 1 1 39 ARG HD3 H 5.583 -8.185 -5.440 1.00 . A A . 36 ARG HD3 1 1 15 10866 1 1 39 ARG HE H 5.013 -5.376 -5.637 1.00 . A A . 36 ARG HE 1 1 15 10867 1 1 39 ARG HG2 H 6.962 -6.710 -4.167 1.00 . A A . 36 ARG HG2 1 1 15 10868 1 1 39 ARG HG3 H 7.354 -5.754 -5.600 1.00 . A A . 36 ARG HG3 1 1 15 10869 1 1 39 ARG HH11 H 3.859 -8.577 -6.477 1.00 . A A . 36 ARG HH11 1 1 15 10870 1 1 39 ARG HH12 H 2.195 -8.090 -6.568 1.00 . A A . 36 ARG HH12 1 1 15 10871 1 1 39 ARG HH21 H 2.837 -4.730 -5.774 1.00 . A A . 36 ARG HH21 1 1 15 10872 1 1 39 ARG HH22 H 1.614 -5.898 -6.166 1.00 . A A . 36 ARG HH22 1 1 15 10873 1 1 39 ARG N N 9.495 -6.959 -3.446 1.00 . A A . 36 ARG N 1 1 15 10874 1 1 39 ARG NE N 4.785 -6.310 -5.855 1.00 . A A . 36 ARG NE 1 1 15 10875 1 1 39 ARG NH1 N 3.160 -7.861 -6.401 1.00 . A A . 36 ARG NH1 1 1 15 10876 1 1 39 ARG NH2 N 2.578 -5.673 -6.000 1.00 . A A . 36 ARG NH2 1 1 15 10877 1 1 39 ARG O O 10.743 -5.852 -6.596 1.00 . A A . 36 ARG O 1 1 15 10878 1 1 40 ASP C C 11.212 -2.772 -4.851 1.00 . A A . 37 ASP C 1 1 15 10879 1 1 40 ASP CA C 10.027 -3.401 -5.576 1.00 . A A . 37 ASP CA 1 1 15 10880 1 1 40 ASP CB C 8.821 -2.451 -5.529 1.00 . A A . 37 ASP CB 1 1 15 10881 1 1 40 ASP CG C 9.062 -1.156 -6.287 1.00 . A A . 37 ASP CG 1 1 15 10882 1 1 40 ASP H H 9.163 -4.722 -4.165 1.00 . A A . 37 ASP H 1 1 15 10883 1 1 40 ASP HA H 10.301 -3.567 -6.607 1.00 . A A . 37 ASP HA 1 1 15 10884 1 1 40 ASP HB2 H 7.966 -2.946 -5.964 1.00 . A A . 37 ASP HB2 1 1 15 10885 1 1 40 ASP HB3 H 8.605 -2.208 -4.499 1.00 . A A . 37 ASP HB3 1 1 15 10886 1 1 40 ASP N N 9.689 -4.693 -4.990 1.00 . A A . 37 ASP N 1 1 15 10887 1 1 40 ASP O O 11.790 -1.794 -5.327 1.00 . A A . 37 ASP O 1 1 15 10888 1 1 40 ASP OD1 O 8.783 -1.116 -7.506 1.00 . A A . 37 ASP OD1 1 1 15 10889 1 1 40 ASP OD2 O 9.535 -0.175 -5.679 1.00 . A A . 37 ASP OD2 1 1 15 10890 1 1 41 ASN C C 12.178 -1.449 -2.333 1.00 . A A . 38 ASN C 1 1 15 10891 1 1 41 ASN CA C 12.630 -2.811 -2.849 1.00 . A A . 38 ASN CA 1 1 15 10892 1 1 41 ASN CB C 13.969 -2.696 -3.598 1.00 . A A . 38 ASN CB 1 1 15 10893 1 1 41 ASN CG C 15.139 -2.345 -2.690 1.00 . A A . 38 ASN CG 1 1 15 10894 1 1 41 ASN H H 11.154 -4.207 -3.451 1.00 . A A . 38 ASN H 1 1 15 10895 1 1 41 ASN HA H 12.750 -3.478 -2.008 1.00 . A A . 38 ASN HA 1 1 15 10896 1 1 41 ASN HB2 H 14.184 -3.638 -4.077 1.00 . A A . 38 ASN HB2 1 1 15 10897 1 1 41 ASN HB3 H 13.882 -1.928 -4.354 1.00 . A A . 38 ASN HB3 1 1 15 10898 1 1 41 ASN HD21 H 16.407 -3.228 -3.940 1.00 . A A . 38 ASN HD21 1 1 15 10899 1 1 41 ASN HD22 H 17.107 -2.526 -2.522 1.00 . A A . 38 ASN HD22 1 1 15 10900 1 1 41 ASN N N 11.587 -3.366 -3.714 1.00 . A A . 38 ASN N 1 1 15 10901 1 1 41 ASN ND2 N 16.337 -2.738 -3.091 1.00 . A A . 38 ASN ND2 1 1 15 10902 1 1 41 ASN O O 12.508 -0.407 -2.903 1.00 . A A . 38 ASN O 1 1 15 10903 1 1 41 ASN OD1 O 14.975 -1.715 -1.647 1.00 . A A . 38 ASN OD1 1 1 15 10904 1 1 42 CYS C C 10.857 -0.254 0.789 1.00 . A A . 39 CYS C 1 1 15 10905 1 1 42 CYS CA C 10.796 -0.258 -0.737 1.00 . A A . 39 CYS CA 1 1 15 10906 1 1 42 CYS CB C 9.338 -0.163 -1.221 1.00 . A A . 39 CYS CB 1 1 15 10907 1 1 42 CYS H H 11.251 -2.317 -0.796 1.00 . A A . 39 CYS H 1 1 15 10908 1 1 42 CYS HA H 11.351 0.587 -1.114 1.00 . A A . 39 CYS HA 1 1 15 10909 1 1 42 CYS HB2 H 9.322 -0.221 -2.298 1.00 . A A . 39 CYS HB2 1 1 15 10910 1 1 42 CYS HB3 H 8.779 -0.992 -0.815 1.00 . A A . 39 CYS HB3 1 1 15 10911 1 1 42 CYS N N 11.403 -1.467 -1.261 1.00 . A A . 39 CYS N 1 1 15 10912 1 1 42 CYS O O 10.652 -1.284 1.430 1.00 . A A . 39 CYS O 1 1 15 10913 1 1 42 CYS SG S 8.485 1.361 -0.746 1.00 . A A . 39 CYS SG 1 1 15 10914 1 1 43 SER C C 9.852 1.749 3.236 1.00 . A A . 40 SER C 1 1 15 10915 1 1 43 SER CA C 11.137 1.047 2.816 1.00 . A A . 40 SER CA 1 1 15 10916 1 1 43 SER CB C 12.354 1.827 3.313 1.00 . A A . 40 SER CB 1 1 15 10917 1 1 43 SER H H 11.452 1.655 0.814 1.00 . A A . 40 SER H 1 1 15 10918 1 1 43 SER HA H 11.151 0.058 3.251 1.00 . A A . 40 SER HA 1 1 15 10919 1 1 43 SER HB2 H 12.353 2.814 2.875 1.00 . A A . 40 SER HB2 1 1 15 10920 1 1 43 SER HB3 H 12.311 1.912 4.388 1.00 . A A . 40 SER HB3 1 1 15 10921 1 1 43 SER HG H 14.027 0.909 3.759 1.00 . A A . 40 SER HG 1 1 15 10922 1 1 43 SER N N 11.175 0.895 1.369 1.00 . A A . 40 SER N 1 1 15 10923 1 1 43 SER O O 9.441 1.695 4.395 1.00 . A A . 40 SER O 1 1 15 10924 1 1 43 SER OG O 13.559 1.171 2.954 1.00 . A A . 40 SER OG 1 1 15 10925 1 1 44 GLY C C 8.124 4.391 3.192 1.00 . A A . 41 GLY C 1 1 15 10926 1 1 44 GLY CA C 7.955 3.061 2.499 1.00 . A A . 41 GLY CA 1 1 15 10927 1 1 44 GLY H H 9.621 2.428 1.370 1.00 . A A . 41 GLY H 1 1 15 10928 1 1 44 GLY HA2 H 7.463 3.221 1.550 1.00 . A A . 41 GLY HA2 1 1 15 10929 1 1 44 GLY HA3 H 7.339 2.428 3.106 1.00 . A A . 41 GLY HA3 1 1 15 10930 1 1 44 GLY N N 9.217 2.396 2.262 1.00 . A A . 41 GLY N 1 1 15 10931 1 1 44 GLY O O 7.553 4.624 4.251 1.00 . A A . 41 GLY O 1 1 15 10932 1 1 45 GLN C C 9.535 7.501 1.974 1.00 . A A . 42 GLN C 1 1 15 10933 1 1 45 GLN CA C 9.167 6.585 3.124 1.00 . A A . 42 GLN CA 1 1 15 10934 1 1 45 GLN CB C 10.298 6.531 4.156 1.00 . A A . 42 GLN CB 1 1 15 10935 1 1 45 GLN CD C 12.680 5.858 4.662 1.00 . A A . 42 GLN CD 1 1 15 10936 1 1 45 GLN CG C 11.582 5.918 3.622 1.00 . A A . 42 GLN CG 1 1 15 10937 1 1 45 GLN H H 9.333 5.019 1.733 1.00 . A A . 42 GLN H 1 1 15 10938 1 1 45 GLN HA H 8.262 6.944 3.592 1.00 . A A . 42 GLN HA 1 1 15 10939 1 1 45 GLN HB2 H 10.514 7.536 4.489 1.00 . A A . 42 GLN HB2 1 1 15 10940 1 1 45 GLN HB3 H 9.969 5.945 5.003 1.00 . A A . 42 GLN HB3 1 1 15 10941 1 1 45 GLN HE21 H 13.323 7.652 4.116 1.00 . A A . 42 GLN HE21 1 1 15 10942 1 1 45 GLN HE22 H 14.205 6.895 5.396 1.00 . A A . 42 GLN HE22 1 1 15 10943 1 1 45 GLN HG2 H 11.373 4.915 3.285 1.00 . A A . 42 GLN HG2 1 1 15 10944 1 1 45 GLN HG3 H 11.928 6.511 2.788 1.00 . A A . 42 GLN HG3 1 1 15 10945 1 1 45 GLN N N 8.910 5.264 2.585 1.00 . A A . 42 GLN N 1 1 15 10946 1 1 45 GLN NE2 N 13.482 6.906 4.732 1.00 . A A . 42 GLN NE2 1 1 15 10947 1 1 45 GLN O O 10.032 7.034 0.952 1.00 . A A . 42 GLN O 1 1 15 10948 1 1 45 GLN OE1 O 12.805 4.877 5.396 1.00 . A A . 42 GLN OE1 1 1 15 10949 1 1 46 THR C C 11.074 9.969 0.950 1.00 . A A . 43 THR C 1 1 15 10950 1 1 46 THR CA C 9.574 9.721 1.051 1.00 . A A . 43 THR CA 1 1 15 10951 1 1 46 THR CB C 8.832 11.053 1.255 1.00 . A A . 43 THR CB 1 1 15 10952 1 1 46 THR CG2 C 7.439 11.004 0.646 1.00 . A A . 43 THR CG2 1 1 15 10953 1 1 46 THR H H 8.884 9.116 2.953 1.00 . A A . 43 THR H 1 1 15 10954 1 1 46 THR HA H 9.232 9.275 0.129 1.00 . A A . 43 THR HA 1 1 15 10955 1 1 46 THR HB H 9.394 11.837 0.767 1.00 . A A . 43 THR HB 1 1 15 10956 1 1 46 THR HG1 H 9.558 11.804 2.939 1.00 . A A . 43 THR HG1 1 1 15 10957 1 1 46 THR HG21 H 6.963 11.967 0.757 1.00 . A A . 43 THR HG21 1 1 15 10958 1 1 46 THR HG22 H 6.852 10.254 1.153 1.00 . A A . 43 THR HG22 1 1 15 10959 1 1 46 THR HG23 H 7.513 10.756 -0.402 1.00 . A A . 43 THR HG23 1 1 15 10960 1 1 46 THR N N 9.275 8.786 2.116 1.00 . A A . 43 THR N 1 1 15 10961 1 1 46 THR O O 11.804 9.807 1.930 1.00 . A A . 43 THR O 1 1 15 10962 1 1 46 THR OG1 O 8.741 11.352 2.656 1.00 . A A . 43 THR OG1 1 1 15 10963 1 1 47 HIS C C 13.378 11.903 0.142 1.00 . A A . 44 HIS C 1 1 15 10964 1 1 47 HIS CA C 12.944 10.584 -0.487 1.00 . A A . 44 HIS CA 1 1 15 10965 1 1 47 HIS CB C 13.246 10.605 -1.991 1.00 . A A . 44 HIS CB 1 1 15 10966 1 1 47 HIS CD2 C 13.741 8.167 -2.728 1.00 . A A . 44 HIS CD2 1 1 15 10967 1 1 47 HIS CE1 C 11.965 7.841 -3.967 1.00 . A A . 44 HIS CE1 1 1 15 10968 1 1 47 HIS CG C 13.003 9.301 -2.688 1.00 . A A . 44 HIS CG 1 1 15 10969 1 1 47 HIS H H 10.887 10.459 -0.978 1.00 . A A . 44 HIS H 1 1 15 10970 1 1 47 HIS HA H 13.499 9.780 -0.029 1.00 . A A . 44 HIS HA 1 1 15 10971 1 1 47 HIS HB2 H 12.626 11.351 -2.463 1.00 . A A . 44 HIS HB2 1 1 15 10972 1 1 47 HIS HB3 H 14.284 10.869 -2.134 1.00 . A A . 44 HIS HB3 1 1 15 10973 1 1 47 HIS HD1 H 11.166 9.699 -3.648 1.00 . A A . 44 HIS HD1 1 1 15 10974 1 1 47 HIS HD2 H 14.682 7.996 -2.224 1.00 . A A . 44 HIS HD2 1 1 15 10975 1 1 47 HIS HE1 H 11.237 7.382 -4.619 1.00 . A A . 44 HIS HE1 1 1 15 10976 1 1 47 HIS HE2 H 13.300 6.326 -3.633 1.00 . A A . 44 HIS HE2 1 1 15 10977 1 1 47 HIS N N 11.526 10.341 -0.243 1.00 . A A . 44 HIS N 1 1 15 10978 1 1 47 HIS ND1 N 11.897 9.063 -3.475 1.00 . A A . 44 HIS ND1 1 1 15 10979 1 1 47 HIS NE2 N 13.073 7.276 -3.531 1.00 . A A . 44 HIS NE2 1 1 15 10980 1 1 47 HIS O O 13.522 12.914 -0.549 1.00 . A A . 44 HIS O 1 1 15 10981 1 1 48 ASP C C 15.488 12.979 2.463 1.00 . A A . 45 ASP C 1 1 15 10982 1 1 48 ASP CA C 13.997 13.062 2.188 1.00 . A A . 45 ASP CA 1 1 15 10983 1 1 48 ASP CB C 13.232 13.196 3.509 1.00 . A A . 45 ASP CB 1 1 15 10984 1 1 48 ASP CG C 11.754 13.451 3.311 1.00 . A A . 45 ASP CG 1 1 15 10985 1 1 48 ASP H H 13.393 11.051 1.942 1.00 . A A . 45 ASP H 1 1 15 10986 1 1 48 ASP HA H 13.802 13.929 1.575 1.00 . A A . 45 ASP HA 1 1 15 10987 1 1 48 ASP HB2 H 13.347 12.286 4.076 1.00 . A A . 45 ASP HB2 1 1 15 10988 1 1 48 ASP HB3 H 13.648 14.018 4.073 1.00 . A A . 45 ASP HB3 1 1 15 10989 1 1 48 ASP N N 13.561 11.885 1.453 1.00 . A A . 45 ASP N 1 1 15 10990 1 1 48 ASP O O 16.267 13.600 1.709 1.00 . A A . 45 ASP O 1 1 15 10991 1 1 48 ASP OXT O 15.883 12.268 3.413 1.00 . A A . 45 ASP OXT 1 1 15 10992 1 1 48 ASP OD1 O 11.370 14.617 3.076 1.00 . A A . 45 ASP OD1 1 1 15 10993 1 1 48 ASP OD2 O 10.963 12.491 3.400 1.00 . A A . 45 ASP OD2 1 1 15 10994 2 2 1 ZN ZN ZN -4.476 -5.559 0.544 1.00 . B A . 101 ZN ZN 1 1 15 10995 3 2 1 ZN ZN ZN 6.241 1.232 -1.262 1.00 . C A . 102 ZN ZN 1 1 16 10996 1 1 1 GLY C C -18.117 11.486 0.882 1.00 . A A . -2 GLY C 1 1 16 10997 1 1 1 GLY CA C -17.397 11.518 2.211 1.00 . A A . -2 GLY CA 1 1 16 10998 1 1 1 GLY H1 H -18.905 10.655 3.351 1.00 . A A . -2 GLY H1 1 1 16 10999 1 1 1 GLY H2 H -18.986 12.338 3.270 1.00 . A A . -2 GLY H2 1 1 16 11000 1 1 1 GLY H3 H -17.824 11.597 4.245 1.00 . A A . -2 GLY H3 1 1 16 11001 1 1 1 GLY HA2 H -16.782 12.403 2.255 1.00 . A A . -2 GLY HA2 1 1 16 11002 1 1 1 GLY HA3 H -16.763 10.647 2.287 1.00 . A A . -2 GLY HA3 1 1 16 11003 1 1 1 GLY N N -18.342 11.527 3.350 1.00 . A A . -2 GLY N 1 1 16 11004 1 1 1 GLY O O -19.341 11.370 0.846 1.00 . A A . -2 GLY O 1 1 16 11005 1 1 2 PRO C C -18.307 10.154 -2.054 1.00 . A A . -1 PRO C 1 1 16 11006 1 1 2 PRO CA C -17.975 11.566 -1.574 1.00 . A A . -1 PRO CA 1 1 16 11007 1 1 2 PRO CB C -16.876 12.181 -2.437 1.00 . A A . -1 PRO CB 1 1 16 11008 1 1 2 PRO CD C -15.915 11.729 -0.285 1.00 . A A . -1 PRO CD 1 1 16 11009 1 1 2 PRO CG C -15.607 11.787 -1.759 1.00 . A A . -1 PRO CG 1 1 16 11010 1 1 2 PRO HA H -18.862 12.181 -1.623 1.00 . A A . -1 PRO HA 1 1 16 11011 1 1 2 PRO HB2 H -16.932 11.780 -3.438 1.00 . A A . -1 PRO HB2 1 1 16 11012 1 1 2 PRO HB3 H -16.991 13.254 -2.464 1.00 . A A . -1 PRO HB3 1 1 16 11013 1 1 2 PRO HD2 H -15.428 10.878 0.166 1.00 . A A . -1 PRO HD2 1 1 16 11014 1 1 2 PRO HD3 H -15.603 12.642 0.200 1.00 . A A . -1 PRO HD3 1 1 16 11015 1 1 2 PRO HG2 H -15.292 10.817 -2.113 1.00 . A A . -1 PRO HG2 1 1 16 11016 1 1 2 PRO HG3 H -14.842 12.523 -1.954 1.00 . A A . -1 PRO HG3 1 1 16 11017 1 1 2 PRO N N -17.383 11.581 -0.236 1.00 . A A . -1 PRO N 1 1 16 11018 1 1 2 PRO O O -18.598 9.940 -3.231 1.00 . A A . -1 PRO O 1 1 16 11019 1 1 3 HIS C C -17.633 7.220 -2.474 1.00 . A A . 0 HIS C 1 1 16 11020 1 1 3 HIS CA C -18.565 7.794 -1.413 1.00 . A A . 0 HIS CA 1 1 16 11021 1 1 3 HIS CB C -20.027 7.642 -1.856 1.00 . A A . 0 HIS CB 1 1 16 11022 1 1 3 HIS CD2 C -21.539 9.077 -0.309 1.00 . A A . 0 HIS CD2 1 1 16 11023 1 1 3 HIS CE1 C -22.448 7.451 0.844 1.00 . A A . 0 HIS CE1 1 1 16 11024 1 1 3 HIS CG C -21.024 7.912 -0.771 1.00 . A A . 0 HIS CG 1 1 16 11025 1 1 3 HIS H H -17.957 9.434 -0.221 1.00 . A A . 0 HIS H 1 1 16 11026 1 1 3 HIS HA H -18.423 7.238 -0.499 1.00 . A A . 0 HIS HA 1 1 16 11027 1 1 3 HIS HB2 H -20.222 8.333 -2.661 1.00 . A A . 0 HIS HB2 1 1 16 11028 1 1 3 HIS HB3 H -20.183 6.635 -2.209 1.00 . A A . 0 HIS HB3 1 1 16 11029 1 1 3 HIS HD1 H -21.442 5.949 -0.115 1.00 . A A . 0 HIS HD1 1 1 16 11030 1 1 3 HIS HD2 H -21.302 10.069 -0.664 1.00 . A A . 0 HIS HD2 1 1 16 11031 1 1 3 HIS HE1 H -23.051 6.910 1.558 1.00 . A A . 0 HIS HE1 1 1 16 11032 1 1 3 HIS HE2 H -23.030 9.392 1.138 1.00 . A A . 0 HIS HE2 1 1 16 11033 1 1 3 HIS N N -18.242 9.193 -1.129 1.00 . A A . 0 HIS N 1 1 16 11034 1 1 3 HIS ND1 N -21.614 6.914 -0.025 1.00 . A A . 0 HIS ND1 1 1 16 11035 1 1 3 HIS NE2 N -22.421 8.760 0.693 1.00 . A A . 0 HIS NE2 1 1 16 11036 1 1 3 HIS O O -18.033 6.386 -3.288 1.00 . A A . 0 HIS O 1 1 16 11037 1 1 4 MET C C -14.373 6.316 -2.784 1.00 . A A . 1 MET C 1 1 16 11038 1 1 4 MET CA C -15.406 7.221 -3.435 1.00 . A A . 1 MET CA 1 1 16 11039 1 1 4 MET CB C -14.714 8.416 -4.094 1.00 . A A . 1 MET CB 1 1 16 11040 1 1 4 MET CE C -17.474 9.776 -6.910 1.00 . A A . 1 MET CE 1 1 16 11041 1 1 4 MET CG C -15.653 9.317 -4.879 1.00 . A A . 1 MET CG 1 1 16 11042 1 1 4 MET H H -16.114 8.302 -1.762 1.00 . A A . 1 MET H 1 1 16 11043 1 1 4 MET HA H -15.930 6.659 -4.194 1.00 . A A . 1 MET HA 1 1 16 11044 1 1 4 MET HB2 H -14.239 9.008 -3.327 1.00 . A A . 1 MET HB2 1 1 16 11045 1 1 4 MET HB3 H -13.957 8.048 -4.770 1.00 . A A . 1 MET HB3 1 1 16 11046 1 1 4 MET HE1 H -18.115 10.217 -6.162 1.00 . A A . 1 MET HE1 1 1 16 11047 1 1 4 MET HE2 H -18.077 9.393 -7.720 1.00 . A A . 1 MET HE2 1 1 16 11048 1 1 4 MET HE3 H -16.794 10.524 -7.289 1.00 . A A . 1 MET HE3 1 1 16 11049 1 1 4 MET HG2 H -16.375 9.742 -4.196 1.00 . A A . 1 MET HG2 1 1 16 11050 1 1 4 MET HG3 H -15.076 10.110 -5.330 1.00 . A A . 1 MET HG3 1 1 16 11051 1 1 4 MET N N -16.386 7.666 -2.457 1.00 . A A . 1 MET N 1 1 16 11052 1 1 4 MET O O -13.206 6.688 -2.633 1.00 . A A . 1 MET O 1 1 16 11053 1 1 4 MET SD S -16.539 8.435 -6.179 1.00 . A A . 1 MET SD 1 1 16 11054 1 1 5 ALA C C -13.048 3.523 -2.855 1.00 . A A . 2 ALA C 1 1 16 11055 1 1 5 ALA CA C -13.918 4.161 -1.789 1.00 . A A . 2 ALA CA 1 1 16 11056 1 1 5 ALA CB C -14.701 3.101 -1.039 1.00 . A A . 2 ALA CB 1 1 16 11057 1 1 5 ALA H H -15.748 4.902 -2.504 1.00 . A A . 2 ALA H 1 1 16 11058 1 1 5 ALA HA H -13.284 4.679 -1.083 1.00 . A A . 2 ALA HA 1 1 16 11059 1 1 5 ALA HB1 H -14.013 2.412 -0.570 1.00 . A A . 2 ALA HB1 1 1 16 11060 1 1 5 ALA HB2 H -15.332 2.563 -1.729 1.00 . A A . 2 ALA HB2 1 1 16 11061 1 1 5 ALA HB3 H -15.311 3.571 -0.283 1.00 . A A . 2 ALA HB3 1 1 16 11062 1 1 5 ALA N N -14.809 5.131 -2.386 1.00 . A A . 2 ALA N 1 1 16 11063 1 1 5 ALA O O -13.465 3.354 -4.003 1.00 . A A . 2 ALA O 1 1 16 11064 1 1 6 VAL C C -10.390 1.261 -2.849 1.00 . A A . 3 VAL C 1 1 16 11065 1 1 6 VAL CA C -10.879 2.599 -3.386 1.00 . A A . 3 VAL CA 1 1 16 11066 1 1 6 VAL CB C -9.672 3.539 -3.599 1.00 . A A . 3 VAL CB 1 1 16 11067 1 1 6 VAL CG1 C -8.656 2.921 -4.546 1.00 . A A . 3 VAL CG1 1 1 16 11068 1 1 6 VAL CG2 C -10.128 4.894 -4.116 1.00 . A A . 3 VAL CG2 1 1 16 11069 1 1 6 VAL H H -11.588 3.326 -1.538 1.00 . A A . 3 VAL H 1 1 16 11070 1 1 6 VAL HA H -11.369 2.445 -4.337 1.00 . A A . 3 VAL HA 1 1 16 11071 1 1 6 VAL HB H -9.190 3.689 -2.644 1.00 . A A . 3 VAL HB 1 1 16 11072 1 1 6 VAL HG11 H -9.113 2.756 -5.510 1.00 . A A . 3 VAL HG11 1 1 16 11073 1 1 6 VAL HG12 H -8.316 1.979 -4.141 1.00 . A A . 3 VAL HG12 1 1 16 11074 1 1 6 VAL HG13 H -7.813 3.589 -4.657 1.00 . A A . 3 VAL HG13 1 1 16 11075 1 1 6 VAL HG21 H -10.596 4.771 -5.081 1.00 . A A . 3 VAL HG21 1 1 16 11076 1 1 6 VAL HG22 H -9.277 5.549 -4.209 1.00 . A A . 3 VAL HG22 1 1 16 11077 1 1 6 VAL HG23 H -10.838 5.322 -3.424 1.00 . A A . 3 VAL HG23 1 1 16 11078 1 1 6 VAL N N -11.841 3.185 -2.470 1.00 . A A . 3 VAL N 1 1 16 11079 1 1 6 VAL O O -10.137 1.118 -1.652 1.00 . A A . 3 VAL O 1 1 16 11080 1 1 7 LEU C C -8.251 -0.990 -3.253 1.00 . A A . 4 LEU C 1 1 16 11081 1 1 7 LEU CA C -9.768 -1.023 -3.366 1.00 . A A . 4 LEU CA 1 1 16 11082 1 1 7 LEU CB C -10.189 -2.080 -4.392 1.00 . A A . 4 LEU CB 1 1 16 11083 1 1 7 LEU CD1 C -11.984 -3.413 -5.517 1.00 . A A . 4 LEU CD1 1 1 16 11084 1 1 7 LEU CD2 C -12.004 -3.152 -3.033 1.00 . A A . 4 LEU CD2 1 1 16 11085 1 1 7 LEU CG C -11.663 -2.483 -4.358 1.00 . A A . 4 LEU CG 1 1 16 11086 1 1 7 LEU H H -10.551 0.446 -4.661 1.00 . A A . 4 LEU H 1 1 16 11087 1 1 7 LEU HA H -10.181 -1.283 -2.403 1.00 . A A . 4 LEU HA 1 1 16 11088 1 1 7 LEU HB2 H -9.966 -1.699 -5.377 1.00 . A A . 4 LEU HB2 1 1 16 11089 1 1 7 LEU HB3 H -9.594 -2.966 -4.226 1.00 . A A . 4 LEU HB3 1 1 16 11090 1 1 7 LEU HD11 H -11.403 -4.317 -5.423 1.00 . A A . 4 LEU HD11 1 1 16 11091 1 1 7 LEU HD12 H -11.741 -2.923 -6.449 1.00 . A A . 4 LEU HD12 1 1 16 11092 1 1 7 LEU HD13 H -13.036 -3.656 -5.502 1.00 . A A . 4 LEU HD13 1 1 16 11093 1 1 7 LEU HD21 H -13.031 -3.485 -3.053 1.00 . A A . 4 LEU HD21 1 1 16 11094 1 1 7 LEU HD22 H -11.871 -2.447 -2.228 1.00 . A A . 4 LEU HD22 1 1 16 11095 1 1 7 LEU HD23 H -11.353 -4.003 -2.878 1.00 . A A . 4 LEU HD23 1 1 16 11096 1 1 7 LEU HG H -12.277 -1.598 -4.457 1.00 . A A . 4 LEU HG 1 1 16 11097 1 1 7 LEU N N -10.282 0.283 -3.734 1.00 . A A . 4 LEU N 1 1 16 11098 1 1 7 LEU O O -7.582 -0.181 -3.902 1.00 . A A . 4 LEU O 1 1 16 11099 1 1 8 CYS C C -5.549 -2.131 -3.516 1.00 . A A . 5 CYS C 1 1 16 11100 1 1 8 CYS CA C -6.304 -2.029 -2.194 1.00 . A A . 5 CYS CA 1 1 16 11101 1 1 8 CYS CB C -6.085 -3.294 -1.373 1.00 . A A . 5 CYS CB 1 1 16 11102 1 1 8 CYS H H -8.354 -2.436 -1.896 1.00 . A A . 5 CYS H 1 1 16 11103 1 1 8 CYS HA H -5.945 -1.177 -1.639 1.00 . A A . 5 CYS HA 1 1 16 11104 1 1 8 CYS HB2 H -6.718 -3.256 -0.504 1.00 . A A . 5 CYS HB2 1 1 16 11105 1 1 8 CYS HB3 H -6.373 -4.145 -1.972 1.00 . A A . 5 CYS HB3 1 1 16 11106 1 1 8 CYS N N -7.736 -1.871 -2.411 1.00 . A A . 5 CYS N 1 1 16 11107 1 1 8 CYS O O -5.946 -2.865 -4.418 1.00 . A A . 5 CYS O 1 1 16 11108 1 1 8 CYS SG S -4.393 -3.577 -0.805 1.00 . A A . 5 CYS SG 1 1 16 11109 1 1 9 GLY C C -2.871 -2.678 -4.998 1.00 . A A . 6 GLY C 1 1 16 11110 1 1 9 GLY CA C -3.656 -1.394 -4.823 1.00 . A A . 6 GLY CA 1 1 16 11111 1 1 9 GLY H H -4.203 -0.810 -2.862 1.00 . A A . 6 GLY H 1 1 16 11112 1 1 9 GLY HA2 H -4.304 -1.266 -5.675 1.00 . A A . 6 GLY HA2 1 1 16 11113 1 1 9 GLY HA3 H -2.965 -0.566 -4.785 1.00 . A A . 6 GLY HA3 1 1 16 11114 1 1 9 GLY N N -4.458 -1.387 -3.617 1.00 . A A . 6 GLY N 1 1 16 11115 1 1 9 GLY O O -2.473 -3.021 -6.107 1.00 . A A . 6 GLY O 1 1 16 11116 1 1 10 VAL C C -2.806 -5.835 -4.187 1.00 . A A . 7 VAL C 1 1 16 11117 1 1 10 VAL CA C -1.892 -4.634 -3.954 1.00 . A A . 7 VAL CA 1 1 16 11118 1 1 10 VAL CB C -1.063 -4.851 -2.669 1.00 . A A . 7 VAL CB 1 1 16 11119 1 1 10 VAL CG1 C -0.372 -6.207 -2.688 1.00 . A A . 7 VAL CG1 1 1 16 11120 1 1 10 VAL CG2 C -0.037 -3.742 -2.505 1.00 . A A . 7 VAL CG2 1 1 16 11121 1 1 10 VAL H H -3.002 -3.074 -3.048 1.00 . A A . 7 VAL H 1 1 16 11122 1 1 10 VAL HA H -1.204 -4.561 -4.784 1.00 . A A . 7 VAL HA 1 1 16 11123 1 1 10 VAL HB H -1.732 -4.823 -1.821 1.00 . A A . 7 VAL HB 1 1 16 11124 1 1 10 VAL HG11 H 0.200 -6.333 -1.781 1.00 . A A . 7 VAL HG11 1 1 16 11125 1 1 10 VAL HG12 H 0.289 -6.262 -3.541 1.00 . A A . 7 VAL HG12 1 1 16 11126 1 1 10 VAL HG13 H -1.116 -6.988 -2.756 1.00 . A A . 7 VAL HG13 1 1 16 11127 1 1 10 VAL HG21 H 0.531 -3.906 -1.601 1.00 . A A . 7 VAL HG21 1 1 16 11128 1 1 10 VAL HG22 H -0.543 -2.789 -2.445 1.00 . A A . 7 VAL HG22 1 1 16 11129 1 1 10 VAL HG23 H 0.630 -3.742 -3.355 1.00 . A A . 7 VAL HG23 1 1 16 11130 1 1 10 VAL N N -2.650 -3.391 -3.903 1.00 . A A . 7 VAL N 1 1 16 11131 1 1 10 VAL O O -2.822 -6.402 -5.279 1.00 . A A . 7 VAL O 1 1 16 11132 1 1 11 CYS C C -5.723 -7.123 -3.956 1.00 . A A . 8 CYS C 1 1 16 11133 1 1 11 CYS CA C -4.400 -7.412 -3.248 1.00 . A A . 8 CYS CA 1 1 16 11134 1 1 11 CYS CB C -4.647 -8.002 -1.852 1.00 . A A . 8 CYS CB 1 1 16 11135 1 1 11 CYS H H -3.585 -5.673 -2.356 1.00 . A A . 8 CYS H 1 1 16 11136 1 1 11 CYS HA H -3.854 -8.136 -3.837 1.00 . A A . 8 CYS HA 1 1 16 11137 1 1 11 CYS HB2 H -5.121 -8.965 -1.958 1.00 . A A . 8 CYS HB2 1 1 16 11138 1 1 11 CYS HB3 H -3.697 -8.130 -1.353 1.00 . A A . 8 CYS HB3 1 1 16 11139 1 1 11 CYS N N -3.576 -6.209 -3.168 1.00 . A A . 8 CYS N 1 1 16 11140 1 1 11 CYS O O -6.242 -7.946 -4.707 1.00 . A A . 8 CYS O 1 1 16 11141 1 1 11 CYS SG S -5.699 -6.992 -0.781 1.00 . A A . 8 CYS SG 1 1 16 11142 1 1 12 GLY C C -8.701 -6.140 -4.084 1.00 . A A . 9 GLY C 1 1 16 11143 1 1 12 GLY CA C -7.405 -5.433 -4.424 1.00 . A A . 9 GLY CA 1 1 16 11144 1 1 12 GLY H H -5.819 -5.362 -3.037 1.00 . A A . 9 GLY H 1 1 16 11145 1 1 12 GLY HA2 H -7.523 -4.385 -4.201 1.00 . A A . 9 GLY HA2 1 1 16 11146 1 1 12 GLY HA3 H -7.223 -5.541 -5.483 1.00 . A A . 9 GLY HA3 1 1 16 11147 1 1 12 GLY N N -6.243 -5.925 -3.709 1.00 . A A . 9 GLY N 1 1 16 11148 1 1 12 GLY O O -9.600 -6.195 -4.919 1.00 . A A . 9 GLY O 1 1 16 11149 1 1 13 ILE C C -10.837 -6.677 -1.418 1.00 . A A . 10 ILE C 1 1 16 11150 1 1 13 ILE CA C -10.027 -7.398 -2.495 1.00 . A A . 10 ILE CA 1 1 16 11151 1 1 13 ILE CB C -9.696 -8.844 -2.048 1.00 . A A . 10 ILE CB 1 1 16 11152 1 1 13 ILE CD1 C -8.756 -8.339 0.274 1.00 . A A . 10 ILE CD1 1 1 16 11153 1 1 13 ILE CG1 C -8.483 -8.876 -1.112 1.00 . A A . 10 ILE CG1 1 1 16 11154 1 1 13 ILE CG2 C -9.449 -9.728 -3.261 1.00 . A A . 10 ILE CG2 1 1 16 11155 1 1 13 ILE H H -8.100 -6.541 -2.212 1.00 . A A . 10 ILE H 1 1 16 11156 1 1 13 ILE HA H -10.641 -7.464 -3.382 1.00 . A A . 10 ILE HA 1 1 16 11157 1 1 13 ILE HB H -10.555 -9.235 -1.523 1.00 . A A . 10 ILE HB 1 1 16 11158 1 1 13 ILE HD11 H -7.840 -8.326 0.845 1.00 . A A . 10 ILE HD11 1 1 16 11159 1 1 13 ILE HD12 H -9.480 -8.968 0.769 1.00 . A A . 10 ILE HD12 1 1 16 11160 1 1 13 ILE HD13 H -9.147 -7.332 0.194 1.00 . A A . 10 ILE HD13 1 1 16 11161 1 1 13 ILE HG12 H -8.144 -9.894 -1.011 1.00 . A A . 10 ILE HG12 1 1 16 11162 1 1 13 ILE HG13 H -7.690 -8.284 -1.546 1.00 . A A . 10 ILE HG13 1 1 16 11163 1 1 13 ILE HG21 H -10.330 -9.739 -3.886 1.00 . A A . 10 ILE HG21 1 1 16 11164 1 1 13 ILE HG22 H -9.228 -10.733 -2.935 1.00 . A A . 10 ILE HG22 1 1 16 11165 1 1 13 ILE HG23 H -8.613 -9.341 -3.826 1.00 . A A . 10 ILE HG23 1 1 16 11166 1 1 13 ILE N N -8.823 -6.656 -2.867 1.00 . A A . 10 ILE N 1 1 16 11167 1 1 13 ILE O O -11.978 -7.046 -1.132 1.00 . A A . 10 ILE O 1 1 16 11168 1 1 14 LYS C C -10.508 -3.396 0.086 1.00 . A A . 11 LYS C 1 1 16 11169 1 1 14 LYS CA C -10.934 -4.852 0.183 1.00 . A A . 11 LYS CA 1 1 16 11170 1 1 14 LYS CB C -10.663 -5.391 1.594 1.00 . A A . 11 LYS CB 1 1 16 11171 1 1 14 LYS CD C -9.014 -5.758 3.466 1.00 . A A . 11 LYS CD 1 1 16 11172 1 1 14 LYS CE C -9.690 -4.831 4.464 1.00 . A A . 11 LYS CE 1 1 16 11173 1 1 14 LYS CG C -9.211 -5.283 2.032 1.00 . A A . 11 LYS CG 1 1 16 11174 1 1 14 LYS H H -9.340 -5.401 -1.087 1.00 . A A . 11 LYS H 1 1 16 11175 1 1 14 LYS HA H -11.993 -4.915 -0.018 1.00 . A A . 11 LYS HA 1 1 16 11176 1 1 14 LYS HB2 H -11.267 -4.840 2.297 1.00 . A A . 11 LYS HB2 1 1 16 11177 1 1 14 LYS HB3 H -10.947 -6.432 1.628 1.00 . A A . 11 LYS HB3 1 1 16 11178 1 1 14 LYS HD2 H -9.436 -6.747 3.569 1.00 . A A . 11 LYS HD2 1 1 16 11179 1 1 14 LYS HD3 H -7.956 -5.794 3.681 1.00 . A A . 11 LYS HD3 1 1 16 11180 1 1 14 LYS HE2 H -9.297 -3.835 4.333 1.00 . A A . 11 LYS HE2 1 1 16 11181 1 1 14 LYS HE3 H -10.752 -4.826 4.270 1.00 . A A . 11 LYS HE3 1 1 16 11182 1 1 14 LYS HG2 H -8.602 -5.886 1.378 1.00 . A A . 11 LYS HG2 1 1 16 11183 1 1 14 LYS HG3 H -8.904 -4.250 1.960 1.00 . A A . 11 LYS HG3 1 1 16 11184 1 1 14 LYS HZ1 H -8.440 -5.330 6.061 1.00 . A A . 11 LYS HZ1 1 1 16 11185 1 1 14 LYS HZ2 H -9.901 -6.181 6.044 1.00 . A A . 11 LYS HZ2 1 1 16 11186 1 1 14 LYS HZ3 H -9.870 -4.562 6.524 1.00 . A A . 11 LYS HZ3 1 1 16 11187 1 1 14 LYS N N -10.249 -5.645 -0.828 1.00 . A A . 11 LYS N 1 1 16 11188 1 1 14 LYS NZ N -9.459 -5.257 5.870 1.00 . A A . 11 LYS NZ 1 1 16 11189 1 1 14 LYS O O -9.546 -3.072 -0.622 1.00 . A A . 11 LYS O 1 1 16 11190 1 1 15 GLU C C -9.578 -0.788 1.331 1.00 . A A . 12 GLU C 1 1 16 11191 1 1 15 GLU CA C -10.966 -1.101 0.774 1.00 . A A . 12 GLU CA 1 1 16 11192 1 1 15 GLU CB C -12.036 -0.377 1.594 1.00 . A A . 12 GLU CB 1 1 16 11193 1 1 15 GLU CD C -12.992 1.827 2.354 1.00 . A A . 12 GLU CD 1 1 16 11194 1 1 15 GLU CG C -12.022 1.133 1.427 1.00 . A A . 12 GLU CG 1 1 16 11195 1 1 15 GLU H H -11.948 -2.876 1.361 1.00 . A A . 12 GLU H 1 1 16 11196 1 1 15 GLU HA H -11.018 -0.766 -0.251 1.00 . A A . 12 GLU HA 1 1 16 11197 1 1 15 GLU HB2 H -13.008 -0.740 1.294 1.00 . A A . 12 GLU HB2 1 1 16 11198 1 1 15 GLU HB3 H -11.886 -0.603 2.640 1.00 . A A . 12 GLU HB3 1 1 16 11199 1 1 15 GLU HG2 H -11.026 1.497 1.635 1.00 . A A . 12 GLU HG2 1 1 16 11200 1 1 15 GLU HG3 H -12.286 1.371 0.408 1.00 . A A . 12 GLU HG3 1 1 16 11201 1 1 15 GLU N N -11.220 -2.535 0.798 1.00 . A A . 12 GLU N 1 1 16 11202 1 1 15 GLU O O -9.057 -1.512 2.183 1.00 . A A . 12 GLU O 1 1 16 11203 1 1 15 GLU OE1 O -14.204 1.838 2.060 1.00 . A A . 12 GLU OE1 1 1 16 11204 1 1 15 GLU OE2 O -12.546 2.373 3.384 1.00 . A A . 12 GLU OE2 1 1 16 11205 1 1 16 PHE C C -7.705 1.398 2.611 1.00 . A A . 13 PHE C 1 1 16 11206 1 1 16 PHE CA C -7.655 0.698 1.257 1.00 . A A . 13 PHE CA 1 1 16 11207 1 1 16 PHE CB C -7.029 1.640 0.224 1.00 . A A . 13 PHE CB 1 1 16 11208 1 1 16 PHE CD1 C -8.719 3.455 -0.198 1.00 . A A . 13 PHE CD1 1 1 16 11209 1 1 16 PHE CD2 C -6.715 4.019 0.967 1.00 . A A . 13 PHE CD2 1 1 16 11210 1 1 16 PHE CE1 C -9.149 4.765 -0.098 1.00 . A A . 13 PHE CE1 1 1 16 11211 1 1 16 PHE CE2 C -7.138 5.329 1.069 1.00 . A A . 13 PHE CE2 1 1 16 11212 1 1 16 PHE CG C -7.501 3.067 0.332 1.00 . A A . 13 PHE CG 1 1 16 11213 1 1 16 PHE CZ C -8.357 5.703 0.537 1.00 . A A . 13 PHE CZ 1 1 16 11214 1 1 16 PHE H H -9.455 0.819 0.153 1.00 . A A . 13 PHE H 1 1 16 11215 1 1 16 PHE HA H -7.044 -0.186 1.341 1.00 . A A . 13 PHE HA 1 1 16 11216 1 1 16 PHE HB2 H -5.957 1.636 0.350 1.00 . A A . 13 PHE HB2 1 1 16 11217 1 1 16 PHE HB3 H -7.270 1.284 -0.767 1.00 . A A . 13 PHE HB3 1 1 16 11218 1 1 16 PHE HD1 H -9.338 2.722 -0.696 1.00 . A A . 13 PHE HD1 1 1 16 11219 1 1 16 PHE HD2 H -5.764 3.724 1.389 1.00 . A A . 13 PHE HD2 1 1 16 11220 1 1 16 PHE HE1 H -10.101 5.054 -0.515 1.00 . A A . 13 PHE HE1 1 1 16 11221 1 1 16 PHE HE2 H -6.514 6.061 1.565 1.00 . A A . 13 PHE HE2 1 1 16 11222 1 1 16 PHE HZ H -8.690 6.726 0.617 1.00 . A A . 13 PHE HZ 1 1 16 11223 1 1 16 PHE N N -8.984 0.287 0.833 1.00 . A A . 13 PHE N 1 1 16 11224 1 1 16 PHE O O -8.768 1.830 3.065 1.00 . A A . 13 PHE O 1 1 16 11225 1 1 17 LYS C C -5.091 2.923 4.633 1.00 . A A . 14 LYS C 1 1 16 11226 1 1 17 LYS CA C -6.434 2.196 4.520 1.00 . A A . 14 LYS CA 1 1 16 11227 1 1 17 LYS CB C -6.600 1.164 5.640 1.00 . A A . 14 LYS CB 1 1 16 11228 1 1 17 LYS CD C -6.700 0.655 8.091 1.00 . A A . 14 LYS CD 1 1 16 11229 1 1 17 LYS CE C -6.391 1.157 9.491 1.00 . A A . 14 LYS CE 1 1 16 11230 1 1 17 LYS CG C -6.435 1.721 7.044 1.00 . A A . 14 LYS CG 1 1 16 11231 1 1 17 LYS H H -5.740 1.151 2.822 1.00 . A A . 14 LYS H 1 1 16 11232 1 1 17 LYS HA H -7.226 2.921 4.585 1.00 . A A . 14 LYS HA 1 1 16 11233 1 1 17 LYS HB2 H -7.586 0.733 5.565 1.00 . A A . 14 LYS HB2 1 1 16 11234 1 1 17 LYS HB3 H -5.868 0.383 5.498 1.00 . A A . 14 LYS HB3 1 1 16 11235 1 1 17 LYS HD2 H -7.741 0.370 8.044 1.00 . A A . 14 LYS HD2 1 1 16 11236 1 1 17 LYS HD3 H -6.080 -0.204 7.881 1.00 . A A . 14 LYS HD3 1 1 16 11237 1 1 17 LYS HE2 H -5.351 1.443 9.533 1.00 . A A . 14 LYS HE2 1 1 16 11238 1 1 17 LYS HE3 H -7.008 2.020 9.696 1.00 . A A . 14 LYS HE3 1 1 16 11239 1 1 17 LYS HG2 H -5.423 2.081 7.161 1.00 . A A . 14 LYS HG2 1 1 16 11240 1 1 17 LYS HG3 H -7.130 2.535 7.184 1.00 . A A . 14 LYS HG3 1 1 16 11241 1 1 17 LYS HZ1 H -6.062 -0.719 10.340 1.00 . A A . 14 LYS HZ1 1 1 16 11242 1 1 17 LYS HZ2 H -7.646 -0.162 10.512 1.00 . A A . 14 LYS HZ2 1 1 16 11243 1 1 17 LYS HZ3 H -6.413 0.491 11.468 1.00 . A A . 14 LYS HZ3 1 1 16 11244 1 1 17 LYS N N -6.548 1.528 3.235 1.00 . A A . 14 LYS N 1 1 16 11245 1 1 17 LYS NZ N -6.647 0.120 10.524 1.00 . A A . 14 LYS NZ 1 1 16 11246 1 1 17 LYS O O -4.924 3.829 5.452 1.00 . A A . 14 LYS O 1 1 16 11247 1 1 18 TYR C C -2.443 3.626 2.420 1.00 . A A . 15 TYR C 1 1 16 11248 1 1 18 TYR CA C -2.809 3.115 3.805 1.00 . A A . 15 TYR CA 1 1 16 11249 1 1 18 TYR CB C -1.765 2.080 4.230 1.00 . A A . 15 TYR CB 1 1 16 11250 1 1 18 TYR CD1 C -3.004 0.611 5.863 1.00 . A A . 15 TYR CD1 1 1 16 11251 1 1 18 TYR CD2 C -1.113 1.825 6.648 1.00 . A A . 15 TYR CD2 1 1 16 11252 1 1 18 TYR CE1 C -3.183 0.068 7.118 1.00 . A A . 15 TYR CE1 1 1 16 11253 1 1 18 TYR CE2 C -1.282 1.282 7.905 1.00 . A A . 15 TYR CE2 1 1 16 11254 1 1 18 TYR CG C -1.969 1.499 5.608 1.00 . A A . 15 TYR CG 1 1 16 11255 1 1 18 TYR CZ C -2.318 0.405 8.135 1.00 . A A . 15 TYR CZ 1 1 16 11256 1 1 18 TYR H H -4.341 1.820 3.146 1.00 . A A . 15 TYR H 1 1 16 11257 1 1 18 TYR HA H -2.804 3.938 4.503 1.00 . A A . 15 TYR HA 1 1 16 11258 1 1 18 TYR HB2 H -1.781 1.263 3.527 1.00 . A A . 15 TYR HB2 1 1 16 11259 1 1 18 TYR HB3 H -0.789 2.543 4.208 1.00 . A A . 15 TYR HB3 1 1 16 11260 1 1 18 TYR HD1 H -3.682 0.351 5.059 1.00 . A A . 15 TYR HD1 1 1 16 11261 1 1 18 TYR HD2 H -0.301 2.514 6.463 1.00 . A A . 15 TYR HD2 1 1 16 11262 1 1 18 TYR HE1 H -3.994 -0.619 7.298 1.00 . A A . 15 TYR HE1 1 1 16 11263 1 1 18 TYR HE2 H -0.605 1.546 8.703 1.00 . A A . 15 TYR HE2 1 1 16 11264 1 1 18 TYR HH H -2.309 0.533 10.055 1.00 . A A . 15 TYR HH 1 1 16 11265 1 1 18 TYR N N -4.142 2.528 3.795 1.00 . A A . 15 TYR N 1 1 16 11266 1 1 18 TYR O O -3.145 3.359 1.445 1.00 . A A . 15 TYR O 1 1 16 11267 1 1 18 TYR OH O -2.489 -0.141 9.385 1.00 . A A . 15 TYR OH 1 1 16 11268 1 1 19 LYS C C 0.702 5.022 1.211 1.00 . A A . 16 LYS C 1 1 16 11269 1 1 19 LYS CA C -0.796 4.799 1.069 1.00 . A A . 16 LYS CA 1 1 16 11270 1 1 19 LYS CB C -1.493 6.085 0.606 1.00 . A A . 16 LYS CB 1 1 16 11271 1 1 19 LYS CD C -2.088 7.572 -1.341 1.00 . A A . 16 LYS CD 1 1 16 11272 1 1 19 LYS CE C -2.007 8.863 -0.541 1.00 . A A . 16 LYS CE 1 1 16 11273 1 1 19 LYS CG C -1.135 6.506 -0.816 1.00 . A A . 16 LYS CG 1 1 16 11274 1 1 19 LYS H H -0.863 4.584 3.169 1.00 . A A . 16 LYS H 1 1 16 11275 1 1 19 LYS HA H -0.966 4.022 0.340 1.00 . A A . 16 LYS HA 1 1 16 11276 1 1 19 LYS HB2 H -2.561 5.938 0.655 1.00 . A A . 16 LYS HB2 1 1 16 11277 1 1 19 LYS HB3 H -1.219 6.888 1.276 1.00 . A A . 16 LYS HB3 1 1 16 11278 1 1 19 LYS HD2 H -1.840 7.786 -2.370 1.00 . A A . 16 LYS HD2 1 1 16 11279 1 1 19 LYS HD3 H -3.098 7.190 -1.287 1.00 . A A . 16 LYS HD3 1 1 16 11280 1 1 19 LYS HE2 H -2.791 9.528 -0.872 1.00 . A A . 16 LYS HE2 1 1 16 11281 1 1 19 LYS HE3 H -2.152 8.632 0.503 1.00 . A A . 16 LYS HE3 1 1 16 11282 1 1 19 LYS HG2 H -0.123 6.899 -0.833 1.00 . A A . 16 LYS HG2 1 1 16 11283 1 1 19 LYS HG3 H -1.193 5.640 -1.457 1.00 . A A . 16 LYS HG3 1 1 16 11284 1 1 19 LYS HZ1 H 0.062 8.955 -0.318 1.00 . A A . 16 LYS HZ1 1 1 16 11285 1 1 19 LYS HZ2 H -0.704 10.455 -0.211 1.00 . A A . 16 LYS HZ2 1 1 16 11286 1 1 19 LYS HZ3 H -0.510 9.714 -1.715 1.00 . A A . 16 LYS HZ3 1 1 16 11287 1 1 19 LYS N N -1.335 4.345 2.341 1.00 . A A . 16 LYS N 1 1 16 11288 1 1 19 LYS NZ N -0.699 9.543 -0.707 1.00 . A A . 16 LYS NZ 1 1 16 11289 1 1 19 LYS O O 1.135 6.012 1.801 1.00 . A A . 16 LYS O 1 1 16 11290 1 1 20 CYS C C 3.466 5.495 0.329 1.00 . A A . 17 CYS C 1 1 16 11291 1 1 20 CYS CA C 2.938 4.137 0.782 1.00 . A A . 17 CYS CA 1 1 16 11292 1 1 20 CYS CB C 3.576 3.041 -0.073 1.00 . A A . 17 CYS CB 1 1 16 11293 1 1 20 CYS H H 1.064 3.302 0.263 1.00 . A A . 17 CYS H 1 1 16 11294 1 1 20 CYS HA H 3.216 3.982 1.812 1.00 . A A . 17 CYS HA 1 1 16 11295 1 1 20 CYS HB2 H 3.278 2.078 0.309 1.00 . A A . 17 CYS HB2 1 1 16 11296 1 1 20 CYS HB3 H 3.239 3.142 -1.093 1.00 . A A . 17 CYS HB3 1 1 16 11297 1 1 20 CYS N N 1.482 4.072 0.701 1.00 . A A . 17 CYS N 1 1 16 11298 1 1 20 CYS O O 3.104 5.982 -0.736 1.00 . A A . 17 CYS O 1 1 16 11299 1 1 20 CYS SG S 5.383 3.108 -0.074 1.00 . A A . 17 CYS SG 1 1 16 11300 1 1 21 PRO C C 5.810 7.352 -0.442 1.00 . A A . 18 PRO C 1 1 16 11301 1 1 21 PRO CA C 4.951 7.409 0.818 1.00 . A A . 18 PRO CA 1 1 16 11302 1 1 21 PRO CB C 5.821 7.723 2.039 1.00 . A A . 18 PRO CB 1 1 16 11303 1 1 21 PRO CD C 4.787 5.610 2.453 1.00 . A A . 18 PRO CD 1 1 16 11304 1 1 21 PRO CG C 6.014 6.426 2.734 1.00 . A A . 18 PRO CG 1 1 16 11305 1 1 21 PRO HA H 4.201 8.177 0.701 1.00 . A A . 18 PRO HA 1 1 16 11306 1 1 21 PRO HB2 H 6.768 8.130 1.712 1.00 . A A . 18 PRO HB2 1 1 16 11307 1 1 21 PRO HB3 H 5.314 8.437 2.671 1.00 . A A . 18 PRO HB3 1 1 16 11308 1 1 21 PRO HD2 H 5.036 4.560 2.400 1.00 . A A . 18 PRO HD2 1 1 16 11309 1 1 21 PRO HD3 H 4.036 5.784 3.210 1.00 . A A . 18 PRO HD3 1 1 16 11310 1 1 21 PRO HG2 H 6.892 5.934 2.341 1.00 . A A . 18 PRO HG2 1 1 16 11311 1 1 21 PRO HG3 H 6.121 6.592 3.797 1.00 . A A . 18 PRO HG3 1 1 16 11312 1 1 21 PRO N N 4.339 6.115 1.142 1.00 . A A . 18 PRO N 1 1 16 11313 1 1 21 PRO O O 6.127 8.381 -1.034 1.00 . A A . 18 PRO O 1 1 16 11314 1 1 22 ARG C C 6.113 5.532 -3.224 1.00 . A A . 19 ARG C 1 1 16 11315 1 1 22 ARG CA C 6.982 5.965 -2.051 1.00 . A A . 19 ARG CA 1 1 16 11316 1 1 22 ARG CB C 8.074 4.916 -1.848 1.00 . A A . 19 ARG CB 1 1 16 11317 1 1 22 ARG CD C 10.425 4.468 -1.117 1.00 . A A . 19 ARG CD 1 1 16 11318 1 1 22 ARG CG C 9.191 5.335 -0.908 1.00 . A A . 19 ARG CG 1 1 16 11319 1 1 22 ARG CZ C 12.817 4.532 -0.516 1.00 . A A . 19 ARG CZ 1 1 16 11320 1 1 22 ARG H H 5.936 5.362 -0.311 1.00 . A A . 19 ARG H 1 1 16 11321 1 1 22 ARG HA H 7.444 6.911 -2.289 1.00 . A A . 19 ARG HA 1 1 16 11322 1 1 22 ARG HB2 H 7.616 4.023 -1.451 1.00 . A A . 19 ARG HB2 1 1 16 11323 1 1 22 ARG HB3 H 8.511 4.684 -2.809 1.00 . A A . 19 ARG HB3 1 1 16 11324 1 1 22 ARG HD2 H 10.179 3.448 -0.867 1.00 . A A . 19 ARG HD2 1 1 16 11325 1 1 22 ARG HD3 H 10.711 4.522 -2.157 1.00 . A A . 19 ARG HD3 1 1 16 11326 1 1 22 ARG HE H 11.358 5.488 0.474 1.00 . A A . 19 ARG HE 1 1 16 11327 1 1 22 ARG HG2 H 9.446 6.365 -1.097 1.00 . A A . 19 ARG HG2 1 1 16 11328 1 1 22 ARG HG3 H 8.853 5.222 0.114 1.00 . A A . 19 ARG HG3 1 1 16 11329 1 1 22 ARG HH11 H 12.384 3.420 -2.154 1.00 . A A . 19 ARG HH11 1 1 16 11330 1 1 22 ARG HH12 H 14.064 3.472 -1.714 1.00 . A A . 19 ARG HH12 1 1 16 11331 1 1 22 ARG HH21 H 13.570 5.542 1.073 1.00 . A A . 19 ARG HH21 1 1 16 11332 1 1 22 ARG HH22 H 14.738 4.679 0.125 1.00 . A A . 19 ARG HH22 1 1 16 11333 1 1 22 ARG N N 6.192 6.146 -0.843 1.00 . A A . 19 ARG N 1 1 16 11334 1 1 22 ARG NE N 11.554 4.896 -0.294 1.00 . A A . 19 ARG NE 1 1 16 11335 1 1 22 ARG NH1 N 13.111 3.746 -1.543 1.00 . A A . 19 ARG NH1 1 1 16 11336 1 1 22 ARG NH2 N 13.785 4.953 0.290 1.00 . A A . 19 ARG NH2 1 1 16 11337 1 1 22 ARG O O 6.263 6.034 -4.333 1.00 . A A . 19 ARG O 1 1 16 11338 1 1 23 CYS C C 3.091 4.488 -4.261 1.00 . A A . 20 CYS C 1 1 16 11339 1 1 23 CYS CA C 4.492 3.943 -4.062 1.00 . A A . 20 CYS CA 1 1 16 11340 1 1 23 CYS CB C 4.424 2.434 -3.819 1.00 . A A . 20 CYS CB 1 1 16 11341 1 1 23 CYS H H 5.006 4.354 -2.046 1.00 . A A . 20 CYS H 1 1 16 11342 1 1 23 CYS HA H 5.045 4.133 -4.963 1.00 . A A . 20 CYS HA 1 1 16 11343 1 1 23 CYS HB2 H 3.794 2.247 -2.965 1.00 . A A . 20 CYS HB2 1 1 16 11344 1 1 23 CYS HB3 H 3.993 1.956 -4.687 1.00 . A A . 20 CYS HB3 1 1 16 11345 1 1 23 CYS N N 5.204 4.600 -2.972 1.00 . A A . 20 CYS N 1 1 16 11346 1 1 23 CYS O O 2.467 4.230 -5.289 1.00 . A A . 20 CYS O 1 1 16 11347 1 1 23 CYS SG S 6.019 1.649 -3.493 1.00 . A A . 20 CYS SG 1 1 16 11348 1 1 24 LEU C C 0.178 4.773 -3.484 1.00 . A A . 21 LEU C 1 1 16 11349 1 1 24 LEU CA C 1.262 5.826 -3.301 1.00 . A A . 21 LEU CA 1 1 16 11350 1 1 24 LEU CB C 1.168 6.878 -4.389 1.00 . A A . 21 LEU CB 1 1 16 11351 1 1 24 LEU CD1 C 2.501 8.389 -2.883 1.00 . A A . 21 LEU CD1 1 1 16 11352 1 1 24 LEU CD2 C 3.520 7.528 -4.987 1.00 . A A . 21 LEU CD2 1 1 16 11353 1 1 24 LEU CG C 2.236 7.962 -4.316 1.00 . A A . 21 LEU CG 1 1 16 11354 1 1 24 LEU H H 3.201 5.497 -2.543 1.00 . A A . 21 LEU H 1 1 16 11355 1 1 24 LEU HA H 1.106 6.307 -2.349 1.00 . A A . 21 LEU HA 1 1 16 11356 1 1 24 LEU HB2 H 1.247 6.383 -5.348 1.00 . A A . 21 LEU HB2 1 1 16 11357 1 1 24 LEU HB3 H 0.200 7.351 -4.325 1.00 . A A . 21 LEU HB3 1 1 16 11358 1 1 24 LEU HD11 H 2.925 7.555 -2.338 1.00 . A A . 21 LEU HD11 1 1 16 11359 1 1 24 LEU HD12 H 1.575 8.692 -2.418 1.00 . A A . 21 LEU HD12 1 1 16 11360 1 1 24 LEU HD13 H 3.197 9.214 -2.876 1.00 . A A . 21 LEU HD13 1 1 16 11361 1 1 24 LEU HD21 H 3.895 6.648 -4.487 1.00 . A A . 21 LEU HD21 1 1 16 11362 1 1 24 LEU HD22 H 4.247 8.323 -4.918 1.00 . A A . 21 LEU HD22 1 1 16 11363 1 1 24 LEU HD23 H 3.326 7.301 -6.024 1.00 . A A . 21 LEU HD23 1 1 16 11364 1 1 24 LEU HG H 1.877 8.795 -4.834 1.00 . A A . 21 LEU HG 1 1 16 11365 1 1 24 LEU N N 2.609 5.250 -3.281 1.00 . A A . 21 LEU N 1 1 16 11366 1 1 24 LEU O O -1.001 5.089 -3.656 1.00 . A A . 21 LEU O 1 1 16 11367 1 1 25 VAL C C -1.178 2.375 -2.281 1.00 . A A . 22 VAL C 1 1 16 11368 1 1 25 VAL CA C -0.300 2.404 -3.522 1.00 . A A . 22 VAL CA 1 1 16 11369 1 1 25 VAL CB C 0.460 1.062 -3.688 1.00 . A A . 22 VAL CB 1 1 16 11370 1 1 25 VAL CG1 C 1.405 0.804 -2.527 1.00 . A A . 22 VAL CG1 1 1 16 11371 1 1 25 VAL CG2 C -0.516 -0.090 -3.846 1.00 . A A . 22 VAL CG2 1 1 16 11372 1 1 25 VAL H H 1.556 3.379 -3.432 1.00 . A A . 22 VAL H 1 1 16 11373 1 1 25 VAL HA H -0.934 2.542 -4.387 1.00 . A A . 22 VAL HA 1 1 16 11374 1 1 25 VAL HB H 1.052 1.122 -4.589 1.00 . A A . 22 VAL HB 1 1 16 11375 1 1 25 VAL HG11 H 1.994 -0.079 -2.729 1.00 . A A . 22 VAL HG11 1 1 16 11376 1 1 25 VAL HG12 H 0.831 0.652 -1.626 1.00 . A A . 22 VAL HG12 1 1 16 11377 1 1 25 VAL HG13 H 2.058 1.652 -2.397 1.00 . A A . 22 VAL HG13 1 1 16 11378 1 1 25 VAL HG21 H -1.075 0.036 -4.761 1.00 . A A . 22 VAL HG21 1 1 16 11379 1 1 25 VAL HG22 H -1.197 -0.103 -3.007 1.00 . A A . 22 VAL HG22 1 1 16 11380 1 1 25 VAL HG23 H 0.029 -1.023 -3.883 1.00 . A A . 22 VAL HG23 1 1 16 11381 1 1 25 VAL N N 0.600 3.531 -3.459 1.00 . A A . 22 VAL N 1 1 16 11382 1 1 25 VAL O O -0.694 2.294 -1.144 1.00 . A A . 22 VAL O 1 1 16 11383 1 1 26 GLN C C -3.650 1.084 -0.941 1.00 . A A . 23 GLN C 1 1 16 11384 1 1 26 GLN CA C -3.445 2.502 -1.449 1.00 . A A . 23 GLN CA 1 1 16 11385 1 1 26 GLN CB C -4.751 3.113 -1.959 1.00 . A A . 23 GLN CB 1 1 16 11386 1 1 26 GLN CD C -5.829 5.074 -3.162 1.00 . A A . 23 GLN CD 1 1 16 11387 1 1 26 GLN CG C -4.552 4.478 -2.604 1.00 . A A . 23 GLN CG 1 1 16 11388 1 1 26 GLN H H -2.766 2.589 -3.442 1.00 . A A . 23 GLN H 1 1 16 11389 1 1 26 GLN HA H -3.060 3.108 -0.639 1.00 . A A . 23 GLN HA 1 1 16 11390 1 1 26 GLN HB2 H -5.189 2.449 -2.691 1.00 . A A . 23 GLN HB2 1 1 16 11391 1 1 26 GLN HB3 H -5.434 3.226 -1.130 1.00 . A A . 23 GLN HB3 1 1 16 11392 1 1 26 GLN HE21 H -6.887 4.283 -1.687 1.00 . A A . 23 GLN HE21 1 1 16 11393 1 1 26 GLN HE22 H -7.778 5.212 -2.836 1.00 . A A . 23 GLN HE22 1 1 16 11394 1 1 26 GLN HG2 H -4.156 5.153 -1.861 1.00 . A A . 23 GLN HG2 1 1 16 11395 1 1 26 GLN HG3 H -3.839 4.376 -3.410 1.00 . A A . 23 GLN HG3 1 1 16 11396 1 1 26 GLN N N -2.464 2.498 -2.514 1.00 . A A . 23 GLN N 1 1 16 11397 1 1 26 GLN NE2 N -6.942 4.830 -2.497 1.00 . A A . 23 GLN NE2 1 1 16 11398 1 1 26 GLN O O -4.456 0.322 -1.474 1.00 . A A . 23 GLN O 1 1 16 11399 1 1 26 GLN OE1 O -5.809 5.773 -4.175 1.00 . A A . 23 GLN OE1 1 1 16 11400 1 1 27 THR C C -3.994 -0.741 1.679 1.00 . A A . 24 THR C 1 1 16 11401 1 1 27 THR CA C -2.905 -0.607 0.626 1.00 . A A . 24 THR CA 1 1 16 11402 1 1 27 THR CB C -1.537 -0.963 1.236 1.00 . A A . 24 THR CB 1 1 16 11403 1 1 27 THR CG2 C -0.558 -1.370 0.153 1.00 . A A . 24 THR CG2 1 1 16 11404 1 1 27 THR H H -2.294 1.401 0.473 1.00 . A A . 24 THR H 1 1 16 11405 1 1 27 THR HA H -3.107 -1.299 -0.178 1.00 . A A . 24 THR HA 1 1 16 11406 1 1 27 THR HB H -1.666 -1.795 1.913 1.00 . A A . 24 THR HB 1 1 16 11407 1 1 27 THR HG1 H -0.508 0.716 1.365 1.00 . A A . 24 THR HG1 1 1 16 11408 1 1 27 THR HG21 H -0.451 -0.566 -0.558 1.00 . A A . 24 THR HG21 1 1 16 11409 1 1 27 THR HG22 H -0.929 -2.251 -0.349 1.00 . A A . 24 THR HG22 1 1 16 11410 1 1 27 THR HG23 H 0.400 -1.587 0.599 1.00 . A A . 24 THR HG23 1 1 16 11411 1 1 27 THR N N -2.884 0.730 0.072 1.00 . A A . 24 THR N 1 1 16 11412 1 1 27 THR O O -4.381 0.234 2.317 1.00 . A A . 24 THR O 1 1 16 11413 1 1 27 THR OG1 O -1.011 0.153 1.962 1.00 . A A . 24 THR OG1 1 1 16 11414 1 1 28 CYS C C -5.069 -2.371 4.178 1.00 . A A . 25 CYS C 1 1 16 11415 1 1 28 CYS CA C -5.592 -2.218 2.758 1.00 . A A . 25 CYS CA 1 1 16 11416 1 1 28 CYS CB C -6.349 -3.480 2.329 1.00 . A A . 25 CYS CB 1 1 16 11417 1 1 28 CYS H H -4.132 -2.691 1.312 1.00 . A A . 25 CYS H 1 1 16 11418 1 1 28 CYS HA H -6.265 -1.376 2.725 1.00 . A A . 25 CYS HA 1 1 16 11419 1 1 28 CYS HB2 H -7.231 -3.594 2.939 1.00 . A A . 25 CYS HB2 1 1 16 11420 1 1 28 CYS HB3 H -6.649 -3.370 1.302 1.00 . A A . 25 CYS HB3 1 1 16 11421 1 1 28 CYS N N -4.500 -1.955 1.835 1.00 . A A . 25 CYS N 1 1 16 11422 1 1 28 CYS O O -5.772 -2.084 5.143 1.00 . A A . 25 CYS O 1 1 16 11423 1 1 28 CYS SG S -5.395 -5.011 2.458 1.00 . A A . 25 CYS SG 1 1 16 11424 1 1 29 SER C C -1.701 -3.059 5.457 1.00 . A A . 26 SER C 1 1 16 11425 1 1 29 SER CA C -3.216 -3.040 5.597 1.00 . A A . 26 SER CA 1 1 16 11426 1 1 29 SER CB C -3.707 -4.357 6.211 1.00 . A A . 26 SER CB 1 1 16 11427 1 1 29 SER H H -3.298 -2.996 3.488 1.00 . A A . 26 SER H 1 1 16 11428 1 1 29 SER HA H -3.500 -2.219 6.240 1.00 . A A . 26 SER HA 1 1 16 11429 1 1 29 SER HB2 H -3.454 -5.172 5.552 1.00 . A A . 26 SER HB2 1 1 16 11430 1 1 29 SER HB3 H -3.226 -4.506 7.167 1.00 . A A . 26 SER HB3 1 1 16 11431 1 1 29 SER HG H -5.477 -3.502 6.104 1.00 . A A . 26 SER HG 1 1 16 11432 1 1 29 SER N N -3.827 -2.820 4.298 1.00 . A A . 26 SER N 1 1 16 11433 1 1 29 SER O O -1.191 -3.136 4.334 1.00 . A A . 26 SER O 1 1 16 11434 1 1 29 SER OG O -5.115 -4.350 6.404 1.00 . A A . 26 SER OG 1 1 16 11435 1 1 30 LEU C C 1.013 -4.266 5.881 1.00 . A A . 27 LEU C 1 1 16 11436 1 1 30 LEU CA C 0.475 -3.017 6.573 1.00 . A A . 27 LEU CA 1 1 16 11437 1 1 30 LEU CB C 1.019 -2.934 7.999 1.00 . A A . 27 LEU CB 1 1 16 11438 1 1 30 LEU CD1 C 1.186 -1.688 10.160 1.00 . A A . 27 LEU CD1 1 1 16 11439 1 1 30 LEU CD2 C 1.669 -0.513 8.013 1.00 . A A . 27 LEU CD2 1 1 16 11440 1 1 30 LEU CG C 0.825 -1.585 8.690 1.00 . A A . 27 LEU CG 1 1 16 11441 1 1 30 LEU H H -1.460 -2.960 7.443 1.00 . A A . 27 LEU H 1 1 16 11442 1 1 30 LEU HA H 0.803 -2.147 6.024 1.00 . A A . 27 LEU HA 1 1 16 11443 1 1 30 LEU HB2 H 0.530 -3.693 8.592 1.00 . A A . 27 LEU HB2 1 1 16 11444 1 1 30 LEU HB3 H 2.076 -3.150 7.970 1.00 . A A . 27 LEU HB3 1 1 16 11445 1 1 30 LEU HD11 H 0.535 -2.403 10.641 1.00 . A A . 27 LEU HD11 1 1 16 11446 1 1 30 LEU HD12 H 1.067 -0.724 10.626 1.00 . A A . 27 LEU HD12 1 1 16 11447 1 1 30 LEU HD13 H 2.210 -2.012 10.257 1.00 . A A . 27 LEU HD13 1 1 16 11448 1 1 30 LEU HD21 H 1.362 -0.407 6.983 1.00 . A A . 27 LEU HD21 1 1 16 11449 1 1 30 LEU HD22 H 2.710 -0.798 8.051 1.00 . A A . 27 LEU HD22 1 1 16 11450 1 1 30 LEU HD23 H 1.536 0.428 8.527 1.00 . A A . 27 LEU HD23 1 1 16 11451 1 1 30 LEU HG H -0.212 -1.293 8.618 1.00 . A A . 27 LEU HG 1 1 16 11452 1 1 30 LEU N N -0.990 -3.006 6.582 1.00 . A A . 27 LEU N 1 1 16 11453 1 1 30 LEU O O 2.093 -4.247 5.289 1.00 . A A . 27 LEU O 1 1 16 11454 1 1 31 GLU C C 0.804 -6.350 3.783 1.00 . A A . 28 GLU C 1 1 16 11455 1 1 31 GLU CA C 0.565 -6.590 5.276 1.00 . A A . 28 GLU CA 1 1 16 11456 1 1 31 GLU CB C -0.581 -7.580 5.470 1.00 . A A . 28 GLU CB 1 1 16 11457 1 1 31 GLU CD C -1.546 -9.835 4.946 1.00 . A A . 28 GLU CD 1 1 16 11458 1 1 31 GLU CG C -0.336 -8.939 4.843 1.00 . A A . 28 GLU CG 1 1 16 11459 1 1 31 GLU H H -0.565 -5.305 6.516 1.00 . A A . 28 GLU H 1 1 16 11460 1 1 31 GLU HA H 1.462 -6.994 5.717 1.00 . A A . 28 GLU HA 1 1 16 11461 1 1 31 GLU HB2 H -0.740 -7.722 6.528 1.00 . A A . 28 GLU HB2 1 1 16 11462 1 1 31 GLU HB3 H -1.476 -7.163 5.034 1.00 . A A . 28 GLU HB3 1 1 16 11463 1 1 31 GLU HG2 H -0.092 -8.804 3.800 1.00 . A A . 28 GLU HG2 1 1 16 11464 1 1 31 GLU HG3 H 0.492 -9.413 5.349 1.00 . A A . 28 GLU HG3 1 1 16 11465 1 1 31 GLU N N 0.243 -5.344 5.960 1.00 . A A . 28 GLU N 1 1 16 11466 1 1 31 GLU O O 1.727 -6.908 3.191 1.00 . A A . 28 GLU O 1 1 16 11467 1 1 31 GLU OE1 O -2.423 -9.756 4.060 1.00 . A A . 28 GLU OE1 1 1 16 11468 1 1 31 GLU OE2 O -1.636 -10.612 5.919 1.00 . A A . 28 GLU OE2 1 1 16 11469 1 1 32 CYS C C 1.116 -4.025 1.594 1.00 . A A . 29 CYS C 1 1 16 11470 1 1 32 CYS CA C 0.121 -5.167 1.780 1.00 . A A . 29 CYS CA 1 1 16 11471 1 1 32 CYS CB C -1.234 -4.799 1.182 1.00 . A A . 29 CYS CB 1 1 16 11472 1 1 32 CYS H H -0.745 -5.090 3.702 1.00 . A A . 29 CYS H 1 1 16 11473 1 1 32 CYS HA H 0.500 -6.041 1.271 1.00 . A A . 29 CYS HA 1 1 16 11474 1 1 32 CYS HB2 H -1.790 -4.224 1.908 1.00 . A A . 29 CYS HB2 1 1 16 11475 1 1 32 CYS HB3 H -1.081 -4.197 0.302 1.00 . A A . 29 CYS HB3 1 1 16 11476 1 1 32 CYS N N -0.024 -5.504 3.183 1.00 . A A . 29 CYS N 1 1 16 11477 1 1 32 CYS O O 1.721 -3.881 0.532 1.00 . A A . 29 CYS O 1 1 16 11478 1 1 32 CYS SG S -2.252 -6.218 0.718 1.00 . A A . 29 CYS SG 1 1 16 11479 1 1 33 SER C C 3.659 -2.630 2.499 1.00 . A A . 30 SER C 1 1 16 11480 1 1 33 SER CA C 2.229 -2.108 2.595 1.00 . A A . 30 SER CA 1 1 16 11481 1 1 33 SER CB C 2.067 -1.236 3.842 1.00 . A A . 30 SER CB 1 1 16 11482 1 1 33 SER H H 0.761 -3.365 3.449 1.00 . A A . 30 SER H 1 1 16 11483 1 1 33 SER HA H 2.015 -1.515 1.721 1.00 . A A . 30 SER HA 1 1 16 11484 1 1 33 SER HB2 H 2.453 -1.764 4.700 1.00 . A A . 30 SER HB2 1 1 16 11485 1 1 33 SER HB3 H 2.616 -0.315 3.708 1.00 . A A . 30 SER HB3 1 1 16 11486 1 1 33 SER HG H 0.332 -0.487 3.296 1.00 . A A . 30 SER HG 1 1 16 11487 1 1 33 SER N N 1.286 -3.216 2.634 1.00 . A A . 30 SER N 1 1 16 11488 1 1 33 SER O O 4.538 -1.965 1.952 1.00 . A A . 30 SER O 1 1 16 11489 1 1 33 SER OG O 0.702 -0.923 4.073 1.00 . A A . 30 SER OG 1 1 16 11490 1 1 34 LYS C C 5.269 -5.456 1.827 1.00 . A A . 31 LYS C 1 1 16 11491 1 1 34 LYS CA C 5.191 -4.457 2.977 1.00 . A A . 31 LYS CA 1 1 16 11492 1 1 34 LYS CB C 5.498 -5.168 4.295 1.00 . A A . 31 LYS CB 1 1 16 11493 1 1 34 LYS CD C 5.035 -7.124 5.809 1.00 . A A . 31 LYS CD 1 1 16 11494 1 1 34 LYS CE C 4.949 -6.268 7.059 1.00 . A A . 31 LYS CE 1 1 16 11495 1 1 34 LYS CG C 4.591 -6.358 4.575 1.00 . A A . 31 LYS CG 1 1 16 11496 1 1 34 LYS H H 3.145 -4.291 3.485 1.00 . A A . 31 LYS H 1 1 16 11497 1 1 34 LYS HA H 5.925 -3.684 2.815 1.00 . A A . 31 LYS HA 1 1 16 11498 1 1 34 LYS HB2 H 6.520 -5.517 4.274 1.00 . A A . 31 LYS HB2 1 1 16 11499 1 1 34 LYS HB3 H 5.385 -4.460 5.102 1.00 . A A . 31 LYS HB3 1 1 16 11500 1 1 34 LYS HD2 H 4.397 -7.985 5.933 1.00 . A A . 31 LYS HD2 1 1 16 11501 1 1 34 LYS HD3 H 6.056 -7.445 5.673 1.00 . A A . 31 LYS HD3 1 1 16 11502 1 1 34 LYS HE2 H 5.493 -5.352 6.893 1.00 . A A . 31 LYS HE2 1 1 16 11503 1 1 34 LYS HE3 H 3.911 -6.041 7.252 1.00 . A A . 31 LYS HE3 1 1 16 11504 1 1 34 LYS HG2 H 3.583 -6.002 4.730 1.00 . A A . 31 LYS HG2 1 1 16 11505 1 1 34 LYS HG3 H 4.611 -7.023 3.724 1.00 . A A . 31 LYS HG3 1 1 16 11506 1 1 34 LYS HZ1 H 5.492 -6.334 9.072 1.00 . A A . 31 LYS HZ1 1 1 16 11507 1 1 34 LYS HZ2 H 6.508 -7.231 8.059 1.00 . A A . 31 LYS HZ2 1 1 16 11508 1 1 34 LYS HZ3 H 4.972 -7.819 8.453 1.00 . A A . 31 LYS HZ3 1 1 16 11509 1 1 34 LYS N N 3.881 -3.827 3.030 1.00 . A A . 31 LYS N 1 1 16 11510 1 1 34 LYS NZ N 5.520 -6.961 8.243 1.00 . A A . 31 LYS NZ 1 1 16 11511 1 1 34 LYS O O 6.350 -5.931 1.475 1.00 . A A . 31 LYS O 1 1 16 11512 1 1 35 LYS C C 4.870 -6.320 -1.027 1.00 . A A . 32 LYS C 1 1 16 11513 1 1 35 LYS CA C 4.038 -6.751 0.172 1.00 . A A . 32 LYS CA 1 1 16 11514 1 1 35 LYS CB C 2.584 -6.952 -0.255 1.00 . A A . 32 LYS CB 1 1 16 11515 1 1 35 LYS CD C 2.654 -9.438 -0.648 1.00 . A A . 32 LYS CD 1 1 16 11516 1 1 35 LYS CE C 2.499 -10.548 -1.674 1.00 . A A . 32 LYS CE 1 1 16 11517 1 1 35 LYS CG C 2.386 -8.075 -1.263 1.00 . A A . 32 LYS CG 1 1 16 11518 1 1 35 LYS H H 3.304 -5.303 1.528 1.00 . A A . 32 LYS H 1 1 16 11519 1 1 35 LYS HA H 4.428 -7.682 0.552 1.00 . A A . 32 LYS HA 1 1 16 11520 1 1 35 LYS HB2 H 1.996 -7.175 0.619 1.00 . A A . 32 LYS HB2 1 1 16 11521 1 1 35 LYS HB3 H 2.222 -6.035 -0.696 1.00 . A A . 32 LYS HB3 1 1 16 11522 1 1 35 LYS HD2 H 3.660 -9.458 -0.259 1.00 . A A . 32 LYS HD2 1 1 16 11523 1 1 35 LYS HD3 H 1.951 -9.601 0.154 1.00 . A A . 32 LYS HD3 1 1 16 11524 1 1 35 LYS HE2 H 1.503 -10.501 -2.088 1.00 . A A . 32 LYS HE2 1 1 16 11525 1 1 35 LYS HE3 H 3.221 -10.394 -2.461 1.00 . A A . 32 LYS HE3 1 1 16 11526 1 1 35 LYS HG2 H 1.368 -8.049 -1.620 1.00 . A A . 32 LYS HG2 1 1 16 11527 1 1 35 LYS HG3 H 3.063 -7.924 -2.091 1.00 . A A . 32 LYS HG3 1 1 16 11528 1 1 35 LYS HZ1 H 3.667 -11.966 -0.679 1.00 . A A . 32 LYS HZ1 1 1 16 11529 1 1 35 LYS HZ2 H 2.600 -12.625 -1.807 1.00 . A A . 32 LYS HZ2 1 1 16 11530 1 1 35 LYS HZ3 H 2.016 -12.067 -0.325 1.00 . A A . 32 LYS HZ3 1 1 16 11531 1 1 35 LYS N N 4.120 -5.760 1.238 1.00 . A A . 32 LYS N 1 1 16 11532 1 1 35 LYS NZ N 2.710 -11.894 -1.079 1.00 . A A . 32 LYS NZ 1 1 16 11533 1 1 35 LYS O O 5.576 -7.124 -1.633 1.00 . A A . 32 LYS O 1 1 16 11534 1 1 36 HIS C C 7.007 -4.288 -2.152 1.00 . A A . 33 HIS C 1 1 16 11535 1 1 36 HIS CA C 5.531 -4.512 -2.498 1.00 . A A . 33 HIS CA 1 1 16 11536 1 1 36 HIS CB C 4.886 -3.208 -3.008 1.00 . A A . 33 HIS CB 1 1 16 11537 1 1 36 HIS CD2 C 5.997 -1.498 -1.418 1.00 . A A . 33 HIS CD2 1 1 16 11538 1 1 36 HIS CE1 C 4.272 -0.371 -0.804 1.00 . A A . 33 HIS CE1 1 1 16 11539 1 1 36 HIS CG C 4.938 -2.058 -2.040 1.00 . A A . 33 HIS CG 1 1 16 11540 1 1 36 HIS H H 4.226 -4.441 -0.827 1.00 . A A . 33 HIS H 1 1 16 11541 1 1 36 HIS HA H 5.478 -5.251 -3.283 1.00 . A A . 33 HIS HA 1 1 16 11542 1 1 36 HIS HB2 H 5.393 -2.899 -3.908 1.00 . A A . 33 HIS HB2 1 1 16 11543 1 1 36 HIS HB3 H 3.849 -3.400 -3.239 1.00 . A A . 33 HIS HB3 1 1 16 11544 1 1 36 HIS HD1 H 2.909 -1.501 -1.902 1.00 . A A . 33 HIS HD1 1 1 16 11545 1 1 36 HIS HD2 H 7.018 -1.828 -1.505 1.00 . A A . 33 HIS HD2 1 1 16 11546 1 1 36 HIS HE1 H 3.625 0.320 -0.289 1.00 . A A . 33 HIS HE1 1 1 16 11547 1 1 36 HIS N N 4.796 -5.040 -1.357 1.00 . A A . 33 HIS N 1 1 16 11548 1 1 36 HIS ND1 N 3.841 -1.335 -1.636 1.00 . A A . 33 HIS ND1 1 1 16 11549 1 1 36 HIS NE2 N 5.581 -0.422 -0.645 1.00 . A A . 33 HIS NE2 1 1 16 11550 1 1 36 HIS O O 7.828 -4.019 -3.028 1.00 . A A . 33 HIS O 1 1 16 11551 1 1 37 LYS C C 9.639 -5.275 -0.744 1.00 . A A . 34 LYS C 1 1 16 11552 1 1 37 LYS CA C 8.701 -4.124 -0.430 1.00 . A A . 34 LYS CA 1 1 16 11553 1 1 37 LYS CB C 8.721 -3.820 1.068 1.00 . A A . 34 LYS CB 1 1 16 11554 1 1 37 LYS CD C 8.048 -2.275 2.929 1.00 . A A . 34 LYS CD 1 1 16 11555 1 1 37 LYS CE C 7.205 -1.073 3.314 1.00 . A A . 34 LYS CE 1 1 16 11556 1 1 37 LYS CG C 7.913 -2.592 1.450 1.00 . A A . 34 LYS CG 1 1 16 11557 1 1 37 LYS H H 6.693 -4.765 -0.231 1.00 . A A . 34 LYS H 1 1 16 11558 1 1 37 LYS HA H 9.036 -3.251 -0.968 1.00 . A A . 34 LYS HA 1 1 16 11559 1 1 37 LYS HB2 H 8.319 -4.669 1.600 1.00 . A A . 34 LYS HB2 1 1 16 11560 1 1 37 LYS HB3 H 9.743 -3.663 1.377 1.00 . A A . 34 LYS HB3 1 1 16 11561 1 1 37 LYS HD2 H 7.726 -3.130 3.504 1.00 . A A . 34 LYS HD2 1 1 16 11562 1 1 37 LYS HD3 H 9.084 -2.061 3.148 1.00 . A A . 34 LYS HD3 1 1 16 11563 1 1 37 LYS HE2 H 7.527 -0.222 2.732 1.00 . A A . 34 LYS HE2 1 1 16 11564 1 1 37 LYS HE3 H 6.168 -1.287 3.086 1.00 . A A . 34 LYS HE3 1 1 16 11565 1 1 37 LYS HG2 H 8.268 -1.748 0.878 1.00 . A A . 34 LYS HG2 1 1 16 11566 1 1 37 LYS HG3 H 6.873 -2.772 1.221 1.00 . A A . 34 LYS HG3 1 1 16 11567 1 1 37 LYS HZ1 H 8.317 -0.511 4.992 1.00 . A A . 34 LYS HZ1 1 1 16 11568 1 1 37 LYS HZ2 H 7.038 -1.561 5.339 1.00 . A A . 34 LYS HZ2 1 1 16 11569 1 1 37 LYS HZ3 H 6.727 0.064 4.999 1.00 . A A . 34 LYS HZ3 1 1 16 11570 1 1 37 LYS N N 7.351 -4.427 -0.878 1.00 . A A . 34 LYS N 1 1 16 11571 1 1 37 LYS NZ N 7.330 -0.748 4.760 1.00 . A A . 34 LYS NZ 1 1 16 11572 1 1 37 LYS O O 10.803 -5.069 -1.077 1.00 . A A . 34 LYS O 1 1 16 11573 1 1 38 THR C C 10.177 -7.842 -2.419 1.00 . A A . 35 THR C 1 1 16 11574 1 1 38 THR CA C 9.905 -7.677 -0.922 1.00 . A A . 35 THR CA 1 1 16 11575 1 1 38 THR CB C 9.196 -8.932 -0.363 1.00 . A A . 35 THR CB 1 1 16 11576 1 1 38 THR CG2 C 7.883 -9.191 -1.087 1.00 . A A . 35 THR CG2 1 1 16 11577 1 1 38 THR H H 8.168 -6.584 -0.428 1.00 . A A . 35 THR H 1 1 16 11578 1 1 38 THR HA H 10.848 -7.563 -0.407 1.00 . A A . 35 THR HA 1 1 16 11579 1 1 38 THR HB H 8.980 -8.759 0.681 1.00 . A A . 35 THR HB 1 1 16 11580 1 1 38 THR HG1 H 10.716 -10.065 0.212 1.00 . A A . 35 THR HG1 1 1 16 11581 1 1 38 THR HG21 H 7.239 -8.329 -0.983 1.00 . A A . 35 THR HG21 1 1 16 11582 1 1 38 THR HG22 H 7.400 -10.055 -0.657 1.00 . A A . 35 THR HG22 1 1 16 11583 1 1 38 THR HG23 H 8.078 -9.371 -2.134 1.00 . A A . 35 THR HG23 1 1 16 11584 1 1 38 THR N N 9.113 -6.487 -0.669 1.00 . A A . 35 THR N 1 1 16 11585 1 1 38 THR O O 11.134 -8.506 -2.820 1.00 . A A . 35 THR O 1 1 16 11586 1 1 38 THR OG1 O 10.042 -10.085 -0.482 1.00 . A A . 35 THR OG1 1 1 16 11587 1 1 39 ARG C C 10.113 -6.124 -5.342 1.00 . A A . 36 ARG C 1 1 16 11588 1 1 39 ARG CA C 9.456 -7.340 -4.691 1.00 . A A . 36 ARG CA 1 1 16 11589 1 1 39 ARG CB C 8.071 -7.578 -5.303 1.00 . A A . 36 ARG CB 1 1 16 11590 1 1 39 ARG CD C 5.648 -6.890 -5.378 1.00 . A A . 36 ARG CD 1 1 16 11591 1 1 39 ARG CG C 6.962 -6.792 -4.623 1.00 . A A . 36 ARG CG 1 1 16 11592 1 1 39 ARG CZ C 4.619 -5.949 -7.409 1.00 . A A . 36 ARG CZ 1 1 16 11593 1 1 39 ARG H H 8.656 -6.628 -2.864 1.00 . A A . 36 ARG H 1 1 16 11594 1 1 39 ARG HA H 10.071 -8.206 -4.889 1.00 . A A . 36 ARG HA 1 1 16 11595 1 1 39 ARG HB2 H 8.098 -7.294 -6.344 1.00 . A A . 36 ARG HB2 1 1 16 11596 1 1 39 ARG HB3 H 7.834 -8.629 -5.231 1.00 . A A . 36 ARG HB3 1 1 16 11597 1 1 39 ARG HD2 H 5.525 -7.905 -5.728 1.00 . A A . 36 ARG HD2 1 1 16 11598 1 1 39 ARG HD3 H 4.840 -6.641 -4.708 1.00 . A A . 36 ARG HD3 1 1 16 11599 1 1 39 ARG HE H 6.374 -5.361 -6.638 1.00 . A A . 36 ARG HE 1 1 16 11600 1 1 39 ARG HG2 H 6.820 -7.179 -3.625 1.00 . A A . 36 ARG HG2 1 1 16 11601 1 1 39 ARG HG3 H 7.256 -5.753 -4.567 1.00 . A A . 36 ARG HG3 1 1 16 11602 1 1 39 ARG HH11 H 3.515 -7.384 -6.492 1.00 . A A . 36 ARG HH11 1 1 16 11603 1 1 39 ARG HH12 H 2.824 -6.726 -7.940 1.00 . A A . 36 ARG HH12 1 1 16 11604 1 1 39 ARG HH21 H 5.457 -4.485 -8.532 1.00 . A A . 36 ARG HH21 1 1 16 11605 1 1 39 ARG HH22 H 3.922 -5.067 -9.096 1.00 . A A . 36 ARG HH22 1 1 16 11606 1 1 39 ARG N N 9.353 -7.203 -3.241 1.00 . A A . 36 ARG N 1 1 16 11607 1 1 39 ARG NE N 5.610 -5.986 -6.525 1.00 . A A . 36 ARG NE 1 1 16 11608 1 1 39 ARG NH1 N 3.568 -6.749 -7.269 1.00 . A A . 36 ARG NH1 1 1 16 11609 1 1 39 ARG NH2 N 4.669 -5.100 -8.427 1.00 . A A . 36 ARG NH2 1 1 16 11610 1 1 39 ARG O O 10.849 -6.260 -6.318 1.00 . A A . 36 ARG O 1 1 16 11611 1 1 40 ASP C C 11.368 -2.999 -4.545 1.00 . A A . 37 ASP C 1 1 16 11612 1 1 40 ASP CA C 10.357 -3.712 -5.430 1.00 . A A . 37 ASP CA 1 1 16 11613 1 1 40 ASP CB C 9.204 -2.766 -5.771 1.00 . A A . 37 ASP CB 1 1 16 11614 1 1 40 ASP CG C 8.326 -3.289 -6.890 1.00 . A A . 37 ASP CG 1 1 16 11615 1 1 40 ASP H H 9.325 -4.875 -3.987 1.00 . A A . 37 ASP H 1 1 16 11616 1 1 40 ASP HA H 10.850 -3.996 -6.347 1.00 . A A . 37 ASP HA 1 1 16 11617 1 1 40 ASP HB2 H 8.589 -2.627 -4.894 1.00 . A A . 37 ASP HB2 1 1 16 11618 1 1 40 ASP HB3 H 9.609 -1.812 -6.074 1.00 . A A . 37 ASP HB3 1 1 16 11619 1 1 40 ASP N N 9.860 -4.936 -4.807 1.00 . A A . 37 ASP N 1 1 16 11620 1 1 40 ASP O O 11.741 -1.855 -4.815 1.00 . A A . 37 ASP O 1 1 16 11621 1 1 40 ASP OD1 O 8.684 -3.102 -8.073 1.00 . A A . 37 ASP OD1 1 1 16 11622 1 1 40 ASP OD2 O 7.268 -3.881 -6.599 1.00 . A A . 37 ASP OD2 1 1 16 11623 1 1 41 ASN C C 12.491 -1.806 -2.011 1.00 . A A . 38 ASN C 1 1 16 11624 1 1 41 ASN CA C 12.835 -3.179 -2.582 1.00 . A A . 38 ASN CA 1 1 16 11625 1 1 41 ASN CB C 14.184 -3.135 -3.300 1.00 . A A . 38 ASN CB 1 1 16 11626 1 1 41 ASN CG C 14.832 -4.503 -3.408 1.00 . A A . 38 ASN CG 1 1 16 11627 1 1 41 ASN H H 11.406 -4.559 -3.302 1.00 . A A . 38 ASN H 1 1 16 11628 1 1 41 ASN HA H 12.909 -3.876 -1.761 1.00 . A A . 38 ASN HA 1 1 16 11629 1 1 41 ASN HB2 H 14.036 -2.748 -4.298 1.00 . A A . 38 ASN HB2 1 1 16 11630 1 1 41 ASN HB3 H 14.849 -2.481 -2.760 1.00 . A A . 38 ASN HB3 1 1 16 11631 1 1 41 ASN HD21 H 16.641 -3.681 -3.379 1.00 . A A . 38 ASN HD21 1 1 16 11632 1 1 41 ASN HD22 H 16.595 -5.407 -3.513 1.00 . A A . 38 ASN HD22 1 1 16 11633 1 1 41 ASN N N 11.795 -3.681 -3.483 1.00 . A A . 38 ASN N 1 1 16 11634 1 1 41 ASN ND2 N 16.154 -4.534 -3.435 1.00 . A A . 38 ASN ND2 1 1 16 11635 1 1 41 ASN O O 13.350 -0.929 -1.899 1.00 . A A . 38 ASN O 1 1 16 11636 1 1 41 ASN OD1 O 14.150 -5.526 -3.454 1.00 . A A . 38 ASN OD1 1 1 16 11637 1 1 42 CYS C C 10.923 -0.426 0.459 1.00 . A A . 39 CYS C 1 1 16 11638 1 1 42 CYS CA C 10.766 -0.387 -1.059 1.00 . A A . 39 CYS CA 1 1 16 11639 1 1 42 CYS CB C 9.302 -0.161 -1.443 1.00 . A A . 39 CYS CB 1 1 16 11640 1 1 42 CYS H H 10.601 -2.372 -1.751 1.00 . A A . 39 CYS H 1 1 16 11641 1 1 42 CYS HA H 11.367 0.416 -1.456 1.00 . A A . 39 CYS HA 1 1 16 11642 1 1 42 CYS HB2 H 9.223 -0.123 -2.519 1.00 . A A . 39 CYS HB2 1 1 16 11643 1 1 42 CYS HB3 H 8.716 -0.991 -1.077 1.00 . A A . 39 CYS HB3 1 1 16 11644 1 1 42 CYS N N 11.234 -1.634 -1.639 1.00 . A A . 39 CYS N 1 1 16 11645 1 1 42 CYS O O 10.874 -1.496 1.068 1.00 . A A . 39 CYS O 1 1 16 11646 1 1 42 CYS SG S 8.570 1.359 -0.790 1.00 . A A . 39 CYS SG 1 1 16 11647 1 1 43 SER C C 9.976 1.303 3.146 1.00 . A A . 40 SER C 1 1 16 11648 1 1 43 SER CA C 11.276 0.833 2.504 1.00 . A A . 40 SER CA 1 1 16 11649 1 1 43 SER CB C 12.402 1.803 2.844 1.00 . A A . 40 SER CB 1 1 16 11650 1 1 43 SER H H 11.214 1.548 0.518 1.00 . A A . 40 SER H 1 1 16 11651 1 1 43 SER HA H 11.524 -0.146 2.884 1.00 . A A . 40 SER HA 1 1 16 11652 1 1 43 SER HB2 H 12.435 1.959 3.912 1.00 . A A . 40 SER HB2 1 1 16 11653 1 1 43 SER HB3 H 13.344 1.395 2.507 1.00 . A A . 40 SER HB3 1 1 16 11654 1 1 43 SER HG H 12.868 3.675 2.486 1.00 . A A . 40 SER HG 1 1 16 11655 1 1 43 SER N N 11.135 0.735 1.060 1.00 . A A . 40 SER N 1 1 16 11656 1 1 43 SER O O 9.748 1.106 4.339 1.00 . A A . 40 SER O 1 1 16 11657 1 1 43 SER OG O 12.188 3.049 2.204 1.00 . A A . 40 SER OG 1 1 16 11658 1 1 44 GLY C C 8.115 3.771 3.583 1.00 . A A . 41 GLY C 1 1 16 11659 1 1 44 GLY CA C 7.880 2.472 2.846 1.00 . A A . 41 GLY CA 1 1 16 11660 1 1 44 GLY H H 9.318 1.967 1.377 1.00 . A A . 41 GLY H 1 1 16 11661 1 1 44 GLY HA2 H 7.208 2.653 2.019 1.00 . A A . 41 GLY HA2 1 1 16 11662 1 1 44 GLY HA3 H 7.425 1.765 3.518 1.00 . A A . 41 GLY HA3 1 1 16 11663 1 1 44 GLY N N 9.115 1.909 2.334 1.00 . A A . 41 GLY N 1 1 16 11664 1 1 44 GLY O O 7.375 4.121 4.498 1.00 . A A . 41 GLY O 1 1 16 11665 1 1 45 GLN C C 9.952 6.678 2.662 1.00 . A A . 42 GLN C 1 1 16 11666 1 1 45 GLN CA C 9.530 5.747 3.779 1.00 . A A . 42 GLN CA 1 1 16 11667 1 1 45 GLN CB C 10.679 5.541 4.776 1.00 . A A . 42 GLN CB 1 1 16 11668 1 1 45 GLN CD C 11.498 4.358 6.863 1.00 . A A . 42 GLN CD 1 1 16 11669 1 1 45 GLN CG C 10.323 4.631 5.945 1.00 . A A . 42 GLN CG 1 1 16 11670 1 1 45 GLN H H 9.658 4.178 2.395 1.00 . A A . 42 GLN H 1 1 16 11671 1 1 45 GLN HA H 8.671 6.159 4.288 1.00 . A A . 42 GLN HA 1 1 16 11672 1 1 45 GLN HB2 H 11.518 5.105 4.254 1.00 . A A . 42 GLN HB2 1 1 16 11673 1 1 45 GLN HB3 H 10.974 6.501 5.172 1.00 . A A . 42 GLN HB3 1 1 16 11674 1 1 45 GLN HE21 H 11.022 5.927 7.982 1.00 . A A . 42 GLN HE21 1 1 16 11675 1 1 45 GLN HE22 H 12.418 5.040 8.484 1.00 . A A . 42 GLN HE22 1 1 16 11676 1 1 45 GLN HG2 H 9.538 5.098 6.521 1.00 . A A . 42 GLN HG2 1 1 16 11677 1 1 45 GLN HG3 H 9.965 3.690 5.552 1.00 . A A . 42 GLN HG3 1 1 16 11678 1 1 45 GLN N N 9.146 4.489 3.167 1.00 . A A . 42 GLN N 1 1 16 11679 1 1 45 GLN NE2 N 11.660 5.189 7.879 1.00 . A A . 42 GLN NE2 1 1 16 11680 1 1 45 GLN O O 10.746 6.283 1.813 1.00 . A A . 42 GLN O 1 1 16 11681 1 1 45 GLN OE1 O 12.245 3.398 6.669 1.00 . A A . 42 GLN OE1 1 1 16 11682 1 1 46 THR C C 10.978 8.916 1.044 1.00 . A A . 43 THR C 1 1 16 11683 1 1 46 THR CA C 9.524 8.767 1.489 1.00 . A A . 43 THR CA 1 1 16 11684 1 1 46 THR CB C 8.932 10.153 1.793 1.00 . A A . 43 THR CB 1 1 16 11685 1 1 46 THR CG2 C 8.377 10.781 0.525 1.00 . A A . 43 THR CG2 1 1 16 11686 1 1 46 THR H H 8.893 8.191 3.424 1.00 . A A . 43 THR H 1 1 16 11687 1 1 46 THR HA H 8.959 8.325 0.683 1.00 . A A . 43 THR HA 1 1 16 11688 1 1 46 THR HB H 9.707 10.792 2.192 1.00 . A A . 43 THR HB 1 1 16 11689 1 1 46 THR HG1 H 7.085 10.476 2.429 1.00 . A A . 43 THR HG1 1 1 16 11690 1 1 46 THR HG21 H 9.166 10.871 -0.206 1.00 . A A . 43 THR HG21 1 1 16 11691 1 1 46 THR HG22 H 7.979 11.758 0.750 1.00 . A A . 43 THR HG22 1 1 16 11692 1 1 46 THR HG23 H 7.591 10.151 0.131 1.00 . A A . 43 THR HG23 1 1 16 11693 1 1 46 THR N N 9.399 7.883 2.643 1.00 . A A . 43 THR N 1 1 16 11694 1 1 46 THR O O 11.316 8.645 -0.110 1.00 . A A . 43 THR O 1 1 16 11695 1 1 46 THR OG1 O 7.875 10.023 2.757 1.00 . A A . 43 THR OG1 1 1 16 11696 1 1 47 HIS C C 14.009 8.726 2.835 1.00 . A A . 44 HIS C 1 1 16 11697 1 1 47 HIS CA C 13.261 9.394 1.694 1.00 . A A . 44 HIS CA 1 1 16 11698 1 1 47 HIS CB C 13.713 10.849 1.530 1.00 . A A . 44 HIS CB 1 1 16 11699 1 1 47 HIS CD2 C 16.302 11.003 1.677 1.00 . A A . 44 HIS CD2 1 1 16 11700 1 1 47 HIS CE1 C 16.727 11.257 -0.454 1.00 . A A . 44 HIS CE1 1 1 16 11701 1 1 47 HIS CG C 15.117 10.993 1.023 1.00 . A A . 44 HIS CG 1 1 16 11702 1 1 47 HIS H H 11.502 9.577 2.852 1.00 . A A . 44 HIS H 1 1 16 11703 1 1 47 HIS HA H 13.458 8.852 0.780 1.00 . A A . 44 HIS HA 1 1 16 11704 1 1 47 HIS HB2 H 13.057 11.346 0.832 1.00 . A A . 44 HIS HB2 1 1 16 11705 1 1 47 HIS HB3 H 13.654 11.346 2.488 1.00 . A A . 44 HIS HB3 1 1 16 11706 1 1 47 HIS HD1 H 14.770 11.183 -1.050 1.00 . A A . 44 HIS HD1 1 1 16 11707 1 1 47 HIS HD2 H 16.446 10.897 2.743 1.00 . A A . 44 HIS HD2 1 1 16 11708 1 1 47 HIS HE1 H 17.250 11.393 -1.388 1.00 . A A . 44 HIS HE1 1 1 16 11709 1 1 47 HIS HE2 H 18.246 11.028 0.896 1.00 . A A . 44 HIS HE2 1 1 16 11710 1 1 47 HIS N N 11.835 9.323 1.963 1.00 . A A . 44 HIS N 1 1 16 11711 1 1 47 HIS ND1 N 15.420 11.153 -0.311 1.00 . A A . 44 HIS ND1 1 1 16 11712 1 1 47 HIS NE2 N 17.287 11.171 0.737 1.00 . A A . 44 HIS NE2 1 1 16 11713 1 1 47 HIS O O 14.736 7.756 2.639 1.00 . A A . 44 HIS O 1 1 16 11714 1 1 48 ASP C C 13.447 8.943 6.408 1.00 . A A . 45 ASP C 1 1 16 11715 1 1 48 ASP CA C 14.377 8.685 5.237 1.00 . A A . 45 ASP CA 1 1 16 11716 1 1 48 ASP CB C 15.758 9.280 5.516 1.00 . A A . 45 ASP CB 1 1 16 11717 1 1 48 ASP CG C 16.334 8.810 6.840 1.00 . A A . 45 ASP CG 1 1 16 11718 1 1 48 ASP H H 13.228 10.042 4.110 1.00 . A A . 45 ASP H 1 1 16 11719 1 1 48 ASP HA H 14.470 7.619 5.092 1.00 . A A . 45 ASP HA 1 1 16 11720 1 1 48 ASP HB2 H 16.434 8.987 4.727 1.00 . A A . 45 ASP HB2 1 1 16 11721 1 1 48 ASP HB3 H 15.681 10.355 5.537 1.00 . A A . 45 ASP HB3 1 1 16 11722 1 1 48 ASP N N 13.799 9.249 4.030 1.00 . A A . 45 ASP N 1 1 16 11723 1 1 48 ASP O O 12.913 7.970 6.972 1.00 . A A . 45 ASP O 1 1 16 11724 1 1 48 ASP OXT O 13.208 10.127 6.721 1.00 . A A . 45 ASP OXT 1 1 16 11725 1 1 48 ASP OD1 O 16.599 7.599 6.984 1.00 . A A . 45 ASP OD1 1 1 16 11726 1 1 48 ASP OD2 O 16.531 9.652 7.741 1.00 . A A . 45 ASP OD2 1 1 16 11727 2 2 1 ZN ZN ZN -4.425 -5.507 0.434 1.00 . B A . 101 ZN ZN 1 1 16 11728 3 2 1 ZN ZN ZN 6.316 1.350 -1.232 1.00 . C A . 102 ZN ZN 1 1 17 11729 1 1 1 GLY C C -10.225 11.137 -8.445 1.00 . A A . -2 GLY C 1 1 17 11730 1 1 1 GLY CA C -9.034 12.032 -8.713 1.00 . A A . -2 GLY CA 1 1 17 11731 1 1 1 GLY H1 H -8.282 13.886 -8.136 1.00 . A A . -2 GLY H1 1 1 17 11732 1 1 1 GLY H2 H -9.126 13.077 -6.915 1.00 . A A . -2 GLY H2 1 1 17 11733 1 1 1 GLY H3 H -9.969 13.811 -8.181 1.00 . A A . -2 GLY H3 1 1 17 11734 1 1 1 GLY HA2 H -9.008 12.272 -9.764 1.00 . A A . -2 GLY HA2 1 1 17 11735 1 1 1 GLY HA3 H -8.129 11.505 -8.449 1.00 . A A . -2 GLY HA3 1 1 17 11736 1 1 1 GLY N N -9.106 13.289 -7.934 1.00 . A A . -2 GLY N 1 1 17 11737 1 1 1 GLY O O -11.370 11.565 -8.612 1.00 . A A . -2 GLY O 1 1 17 11738 1 1 2 PRO C C -11.739 9.311 -6.372 1.00 . A A . -1 PRO C 1 1 17 11739 1 1 2 PRO CA C -11.067 8.954 -7.697 1.00 . A A . -1 PRO CA 1 1 17 11740 1 1 2 PRO CB C -10.359 7.601 -7.605 1.00 . A A . -1 PRO CB 1 1 17 11741 1 1 2 PRO CD C -8.657 9.275 -7.860 1.00 . A A . -1 PRO CD 1 1 17 11742 1 1 2 PRO CG C -8.949 7.929 -7.249 1.00 . A A . -1 PRO CG 1 1 17 11743 1 1 2 PRO HA H -11.813 8.921 -8.477 1.00 . A A . -1 PRO HA 1 1 17 11744 1 1 2 PRO HB2 H -10.829 6.996 -6.842 1.00 . A A . -1 PRO HB2 1 1 17 11745 1 1 2 PRO HB3 H -10.415 7.096 -8.558 1.00 . A A . -1 PRO HB3 1 1 17 11746 1 1 2 PRO HD2 H -8.050 9.866 -7.191 1.00 . A A . -1 PRO HD2 1 1 17 11747 1 1 2 PRO HD3 H -8.164 9.157 -8.814 1.00 . A A . -1 PRO HD3 1 1 17 11748 1 1 2 PRO HG2 H -8.845 7.976 -6.174 1.00 . A A . -1 PRO HG2 1 1 17 11749 1 1 2 PRO HG3 H -8.285 7.180 -7.657 1.00 . A A . -1 PRO HG3 1 1 17 11750 1 1 2 PRO N N -9.991 9.882 -8.030 1.00 . A A . -1 PRO N 1 1 17 11751 1 1 2 PRO O O -11.317 8.864 -5.302 1.00 . A A . -1 PRO O 1 1 17 11752 1 1 3 HIS C C -14.532 9.456 -4.857 1.00 . A A . 0 HIS C 1 1 17 11753 1 1 3 HIS CA C -13.537 10.538 -5.273 1.00 . A A . 0 HIS CA 1 1 17 11754 1 1 3 HIS CB C -14.251 11.878 -5.519 1.00 . A A . 0 HIS CB 1 1 17 11755 1 1 3 HIS CD2 C -14.809 12.190 -8.035 1.00 . A A . 0 HIS CD2 1 1 17 11756 1 1 3 HIS CE1 C -16.961 11.820 -7.939 1.00 . A A . 0 HIS CE1 1 1 17 11757 1 1 3 HIS CG C -15.116 11.919 -6.746 1.00 . A A . 0 HIS CG 1 1 17 11758 1 1 3 HIS H H -13.067 10.439 -7.337 1.00 . A A . 0 HIS H 1 1 17 11759 1 1 3 HIS HA H -12.825 10.667 -4.470 1.00 . A A . 0 HIS HA 1 1 17 11760 1 1 3 HIS HB2 H -14.881 12.098 -4.670 1.00 . A A . 0 HIS HB2 1 1 17 11761 1 1 3 HIS HB3 H -13.507 12.656 -5.612 1.00 . A A . 0 HIS HB3 1 1 17 11762 1 1 3 HIS HD1 H -17.002 11.464 -5.924 1.00 . A A . 0 HIS HD1 1 1 17 11763 1 1 3 HIS HD2 H -13.826 12.415 -8.425 1.00 . A A . 0 HIS HD2 1 1 17 11764 1 1 3 HIS HE1 H -17.997 11.698 -8.219 1.00 . A A . 0 HIS HE1 1 1 17 11765 1 1 3 HIS HE2 H -16.094 12.479 -9.663 1.00 . A A . 0 HIS HE2 1 1 17 11766 1 1 3 HIS N N -12.786 10.118 -6.454 1.00 . A A . 0 HIS N 1 1 17 11767 1 1 3 HIS ND1 N -16.472 11.691 -6.721 1.00 . A A . 0 HIS ND1 1 1 17 11768 1 1 3 HIS NE2 N -15.973 12.124 -8.756 1.00 . A A . 0 HIS NE2 1 1 17 11769 1 1 3 HIS O O -15.731 9.699 -4.715 1.00 . A A . 0 HIS O 1 1 17 11770 1 1 4 MET C C -13.977 6.193 -3.401 1.00 . A A . 1 MET C 1 1 17 11771 1 1 4 MET CA C -14.807 7.105 -4.290 1.00 . A A . 1 MET CA 1 1 17 11772 1 1 4 MET CB C -15.249 6.350 -5.548 1.00 . A A . 1 MET CB 1 1 17 11773 1 1 4 MET CE C -13.039 4.583 -8.621 1.00 . A A . 1 MET CE 1 1 17 11774 1 1 4 MET CG C -14.086 5.863 -6.403 1.00 . A A . 1 MET CG 1 1 17 11775 1 1 4 MET H H -13.032 8.154 -4.737 1.00 . A A . 1 MET H 1 1 17 11776 1 1 4 MET HA H -15.674 7.444 -3.744 1.00 . A A . 1 MET HA 1 1 17 11777 1 1 4 MET HB2 H -15.836 5.493 -5.253 1.00 . A A . 1 MET HB2 1 1 17 11778 1 1 4 MET HB3 H -15.861 7.005 -6.150 1.00 . A A . 1 MET HB3 1 1 17 11779 1 1 4 MET HE1 H -13.197 4.046 -9.544 1.00 . A A . 1 MET HE1 1 1 17 11780 1 1 4 MET HE2 H -12.459 3.973 -7.946 1.00 . A A . 1 MET HE2 1 1 17 11781 1 1 4 MET HE3 H -12.505 5.501 -8.824 1.00 . A A . 1 MET HE3 1 1 17 11782 1 1 4 MET HG2 H -13.507 6.719 -6.716 1.00 . A A . 1 MET HG2 1 1 17 11783 1 1 4 MET HG3 H -13.465 5.213 -5.804 1.00 . A A . 1 MET HG3 1 1 17 11784 1 1 4 MET N N -14.008 8.261 -4.653 1.00 . A A . 1 MET N 1 1 17 11785 1 1 4 MET O O -12.831 6.517 -3.083 1.00 . A A . 1 MET O 1 1 17 11786 1 1 4 MET SD S -14.621 4.964 -7.870 1.00 . A A . 1 MET SD 1 1 17 11787 1 1 5 ALA C C -12.833 3.355 -3.143 1.00 . A A . 2 ALA C 1 1 17 11788 1 1 5 ALA CA C -13.790 4.094 -2.233 1.00 . A A . 2 ALA CA 1 1 17 11789 1 1 5 ALA CB C -14.705 3.117 -1.525 1.00 . A A . 2 ALA CB 1 1 17 11790 1 1 5 ALA H H -15.473 4.880 -3.227 1.00 . A A . 2 ALA H 1 1 17 11791 1 1 5 ALA HA H -13.219 4.628 -1.486 1.00 . A A . 2 ALA HA 1 1 17 11792 1 1 5 ALA HB1 H -15.357 3.655 -0.857 1.00 . A A . 2 ALA HB1 1 1 17 11793 1 1 5 ALA HB2 H -14.106 2.416 -0.961 1.00 . A A . 2 ALA HB2 1 1 17 11794 1 1 5 ALA HB3 H -15.293 2.583 -2.254 1.00 . A A . 2 ALA HB3 1 1 17 11795 1 1 5 ALA N N -14.540 5.065 -2.999 1.00 . A A . 2 ALA N 1 1 17 11796 1 1 5 ALA O O -13.200 2.913 -4.235 1.00 . A A . 2 ALA O 1 1 17 11797 1 1 6 VAL C C -10.177 1.271 -2.918 1.00 . A A . 3 VAL C 1 1 17 11798 1 1 6 VAL CA C -10.559 2.631 -3.485 1.00 . A A . 3 VAL CA 1 1 17 11799 1 1 6 VAL CB C -9.318 3.545 -3.537 1.00 . A A . 3 VAL CB 1 1 17 11800 1 1 6 VAL CG1 C -8.194 2.903 -4.331 1.00 . A A . 3 VAL CG1 1 1 17 11801 1 1 6 VAL CG2 C -9.685 4.902 -4.120 1.00 . A A . 3 VAL CG2 1 1 17 11802 1 1 6 VAL H H -11.397 3.576 -1.802 1.00 . A A . 3 VAL H 1 1 17 11803 1 1 6 VAL HA H -10.930 2.503 -4.491 1.00 . A A . 3 VAL HA 1 1 17 11804 1 1 6 VAL HB H -8.970 3.699 -2.525 1.00 . A A . 3 VAL HB 1 1 17 11805 1 1 6 VAL HG11 H -7.341 3.565 -4.347 1.00 . A A . 3 VAL HG11 1 1 17 11806 1 1 6 VAL HG12 H -8.527 2.719 -5.340 1.00 . A A . 3 VAL HG12 1 1 17 11807 1 1 6 VAL HG13 H -7.914 1.969 -3.866 1.00 . A A . 3 VAL HG13 1 1 17 11808 1 1 6 VAL HG21 H -8.811 5.534 -4.144 1.00 . A A . 3 VAL HG21 1 1 17 11809 1 1 6 VAL HG22 H -10.447 5.363 -3.508 1.00 . A A . 3 VAL HG22 1 1 17 11810 1 1 6 VAL HG23 H -10.063 4.771 -5.124 1.00 . A A . 3 VAL HG23 1 1 17 11811 1 1 6 VAL N N -11.607 3.241 -2.695 1.00 . A A . 3 VAL N 1 1 17 11812 1 1 6 VAL O O -9.911 1.141 -1.721 1.00 . A A . 3 VAL O 1 1 17 11813 1 1 7 LEU C C -8.217 -1.101 -3.306 1.00 . A A . 4 LEU C 1 1 17 11814 1 1 7 LEU CA C -9.737 -1.067 -3.391 1.00 . A A . 4 LEU CA 1 1 17 11815 1 1 7 LEU CB C -10.226 -2.114 -4.395 1.00 . A A . 4 LEU CB 1 1 17 11816 1 1 7 LEU CD1 C -12.114 -3.361 -5.473 1.00 . A A . 4 LEU CD1 1 1 17 11817 1 1 7 LEU CD2 C -12.033 -3.139 -2.988 1.00 . A A . 4 LEU CD2 1 1 17 11818 1 1 7 LEU CG C -11.714 -2.461 -4.314 1.00 . A A . 4 LEU CG 1 1 17 11819 1 1 7 LEU H H -10.512 0.410 -4.688 1.00 . A A . 4 LEU H 1 1 17 11820 1 1 7 LEU HA H -10.147 -1.291 -2.418 1.00 . A A . 4 LEU HA 1 1 17 11821 1 1 7 LEU HB2 H -10.018 -1.749 -5.390 1.00 . A A . 4 LEU HB2 1 1 17 11822 1 1 7 LEU HB3 H -9.660 -3.021 -4.240 1.00 . A A . 4 LEU HB3 1 1 17 11823 1 1 7 LEU HD11 H -11.533 -4.270 -5.441 1.00 . A A . 4 LEU HD11 1 1 17 11824 1 1 7 LEU HD12 H -11.932 -2.849 -6.406 1.00 . A A . 4 LEU HD12 1 1 17 11825 1 1 7 LEU HD13 H -13.163 -3.603 -5.395 1.00 . A A . 4 LEU HD13 1 1 17 11826 1 1 7 LEU HD21 H -13.071 -3.437 -2.975 1.00 . A A . 4 LEU HD21 1 1 17 11827 1 1 7 LEU HD22 H -11.849 -2.449 -2.177 1.00 . A A . 4 LEU HD22 1 1 17 11828 1 1 7 LEU HD23 H -11.406 -4.013 -2.865 1.00 . A A . 4 LEU HD23 1 1 17 11829 1 1 7 LEU HG H -12.296 -1.553 -4.378 1.00 . A A . 4 LEU HG 1 1 17 11830 1 1 7 LEU N N -10.188 0.260 -3.774 1.00 . A A . 4 LEU N 1 1 17 11831 1 1 7 LEU O O -7.529 -0.374 -4.022 1.00 . A A . 4 LEU O 1 1 17 11832 1 1 8 CYS C C -5.533 -2.298 -3.511 1.00 . A A . 5 CYS C 1 1 17 11833 1 1 8 CYS CA C -6.290 -2.122 -2.195 1.00 . A A . 5 CYS CA 1 1 17 11834 1 1 8 CYS CB C -6.088 -3.349 -1.313 1.00 . A A . 5 CYS CB 1 1 17 11835 1 1 8 CYS H H -8.347 -2.464 -1.866 1.00 . A A . 5 CYS H 1 1 17 11836 1 1 8 CYS HA H -5.913 -1.251 -1.682 1.00 . A A . 5 CYS HA 1 1 17 11837 1 1 8 CYS HB2 H -6.690 -3.240 -0.429 1.00 . A A . 5 CYS HB2 1 1 17 11838 1 1 8 CYS HB3 H -6.420 -4.224 -1.854 1.00 . A A . 5 CYS HB3 1 1 17 11839 1 1 8 CYS N N -7.720 -1.943 -2.413 1.00 . A A . 5 CYS N 1 1 17 11840 1 1 8 CYS O O -5.896 -3.128 -4.343 1.00 . A A . 5 CYS O 1 1 17 11841 1 1 8 CYS SG S -4.387 -3.651 -0.778 1.00 . A A . 5 CYS SG 1 1 17 11842 1 1 9 GLY C C -2.893 -2.870 -5.018 1.00 . A A . 6 GLY C 1 1 17 11843 1 1 9 GLY CA C -3.681 -1.579 -4.894 1.00 . A A . 6 GLY CA 1 1 17 11844 1 1 9 GLY H H -4.241 -0.869 -2.978 1.00 . A A . 6 GLY H 1 1 17 11845 1 1 9 GLY HA2 H -4.337 -1.491 -5.745 1.00 . A A . 6 GLY HA2 1 1 17 11846 1 1 9 GLY HA3 H -2.991 -0.749 -4.900 1.00 . A A . 6 GLY HA3 1 1 17 11847 1 1 9 GLY N N -4.476 -1.517 -3.681 1.00 . A A . 6 GLY N 1 1 17 11848 1 1 9 GLY O O -2.469 -3.243 -6.109 1.00 . A A . 6 GLY O 1 1 17 11849 1 1 10 VAL C C -2.849 -6.012 -4.110 1.00 . A A . 7 VAL C 1 1 17 11850 1 1 10 VAL CA C -1.938 -4.801 -3.906 1.00 . A A . 7 VAL CA 1 1 17 11851 1 1 10 VAL CB C -1.118 -4.974 -2.609 1.00 . A A . 7 VAL CB 1 1 17 11852 1 1 10 VAL CG1 C -0.436 -6.334 -2.570 1.00 . A A . 7 VAL CG1 1 1 17 11853 1 1 10 VAL CG2 C -0.084 -3.864 -2.483 1.00 . A A . 7 VAL CG2 1 1 17 11854 1 1 10 VAL H H -3.060 -3.216 -3.059 1.00 . A A . 7 VAL H 1 1 17 11855 1 1 10 VAL HA H -1.244 -4.753 -4.733 1.00 . A A . 7 VAL HA 1 1 17 11856 1 1 10 VAL HB H -1.792 -4.907 -1.767 1.00 . A A . 7 VAL HB 1 1 17 11857 1 1 10 VAL HG11 H 0.129 -6.425 -1.653 1.00 . A A . 7 VAL HG11 1 1 17 11858 1 1 10 VAL HG12 H 0.229 -6.428 -3.413 1.00 . A A . 7 VAL HG12 1 1 17 11859 1 1 10 VAL HG13 H -1.183 -7.113 -2.611 1.00 . A A . 7 VAL HG13 1 1 17 11860 1 1 10 VAL HG21 H -0.582 -2.907 -2.462 1.00 . A A . 7 VAL HG21 1 1 17 11861 1 1 10 VAL HG22 H 0.588 -3.902 -3.327 1.00 . A A . 7 VAL HG22 1 1 17 11862 1 1 10 VAL HG23 H 0.479 -3.998 -1.570 1.00 . A A . 7 VAL HG23 1 1 17 11863 1 1 10 VAL N N -2.695 -3.556 -3.900 1.00 . A A . 7 VAL N 1 1 17 11864 1 1 10 VAL O O -2.828 -6.635 -5.169 1.00 . A A . 7 VAL O 1 1 17 11865 1 1 11 CYS C C -5.815 -7.311 -3.838 1.00 . A A . 8 CYS C 1 1 17 11866 1 1 11 CYS CA C -4.468 -7.551 -3.150 1.00 . A A . 8 CYS CA 1 1 17 11867 1 1 11 CYS CB C -4.675 -8.112 -1.737 1.00 . A A . 8 CYS CB 1 1 17 11868 1 1 11 CYS H H -3.728 -5.736 -2.339 1.00 . A A . 8 CYS H 1 1 17 11869 1 1 11 CYS HA H -3.918 -8.277 -3.730 1.00 . A A . 8 CYS HA 1 1 17 11870 1 1 11 CYS HB2 H -5.155 -9.076 -1.808 1.00 . A A . 8 CYS HB2 1 1 17 11871 1 1 11 CYS HB3 H -3.712 -8.231 -1.262 1.00 . A A . 8 CYS HB3 1 1 17 11872 1 1 11 CYS N N -3.665 -6.329 -3.108 1.00 . A A . 8 CYS N 1 1 17 11873 1 1 11 CYS O O -6.374 -8.199 -4.480 1.00 . A A . 8 CYS O 1 1 17 11874 1 1 11 CYS SG S -5.694 -7.076 -0.659 1.00 . A A . 8 CYS SG 1 1 17 11875 1 1 12 GLY C C -8.776 -6.365 -4.006 1.00 . A A . 9 GLY C 1 1 17 11876 1 1 12 GLY CA C -7.502 -5.644 -4.398 1.00 . A A . 9 GLY CA 1 1 17 11877 1 1 12 GLY H H -5.852 -5.462 -3.099 1.00 . A A . 9 GLY H 1 1 17 11878 1 1 12 GLY HA2 H -7.638 -4.591 -4.216 1.00 . A A . 9 GLY HA2 1 1 17 11879 1 1 12 GLY HA3 H -7.339 -5.790 -5.455 1.00 . A A . 9 GLY HA3 1 1 17 11880 1 1 12 GLY N N -6.314 -6.085 -3.689 1.00 . A A . 9 GLY N 1 1 17 11881 1 1 12 GLY O O -9.650 -6.562 -4.850 1.00 . A A . 9 GLY O 1 1 17 11882 1 1 13 ILE C C -10.904 -6.702 -1.251 1.00 . A A . 10 ILE C 1 1 17 11883 1 1 13 ILE CA C -10.095 -7.468 -2.300 1.00 . A A . 10 ILE CA 1 1 17 11884 1 1 13 ILE CB C -9.738 -8.879 -1.772 1.00 . A A . 10 ILE CB 1 1 17 11885 1 1 13 ILE CD1 C -8.827 -8.227 0.527 1.00 . A A . 10 ILE CD1 1 1 17 11886 1 1 13 ILE CG1 C -8.533 -8.837 -0.825 1.00 . A A . 10 ILE CG1 1 1 17 11887 1 1 13 ILE CG2 C -9.464 -9.821 -2.932 1.00 . A A . 10 ILE CG2 1 1 17 11888 1 1 13 ILE H H -8.198 -6.538 -2.095 1.00 . A A . 10 ILE H 1 1 17 11889 1 1 13 ILE HA H -10.723 -7.598 -3.170 1.00 . A A . 10 ILE HA 1 1 17 11890 1 1 13 ILE HB H -10.595 -9.259 -1.233 1.00 . A A . 10 ILE HB 1 1 17 11891 1 1 13 ILE HD11 H -9.567 -8.823 1.039 1.00 . A A . 10 ILE HD11 1 1 17 11892 1 1 13 ILE HD12 H -9.206 -7.222 0.390 1.00 . A A . 10 ILE HD12 1 1 17 11893 1 1 13 ILE HD13 H -7.921 -8.194 1.113 1.00 . A A . 10 ILE HD13 1 1 17 11894 1 1 13 ILE HG12 H -8.180 -9.842 -0.663 1.00 . A A . 10 ILE HG12 1 1 17 11895 1 1 13 ILE HG13 H -7.746 -8.258 -1.286 1.00 . A A . 10 ILE HG13 1 1 17 11896 1 1 13 ILE HG21 H -9.186 -10.792 -2.549 1.00 . A A . 10 ILE HG21 1 1 17 11897 1 1 13 ILE HG22 H -8.659 -9.427 -3.533 1.00 . A A . 10 ILE HG22 1 1 17 11898 1 1 13 ILE HG23 H -10.353 -9.914 -3.538 1.00 . A A . 10 ILE HG23 1 1 17 11899 1 1 13 ILE N N -8.909 -6.739 -2.739 1.00 . A A . 10 ILE N 1 1 17 11900 1 1 13 ILE O O -11.965 -7.160 -0.827 1.00 . A A . 10 ILE O 1 1 17 11901 1 1 14 LYS C C -10.615 -3.290 0.122 1.00 . A A . 11 LYS C 1 1 17 11902 1 1 14 LYS CA C -11.119 -4.729 0.150 1.00 . A A . 11 LYS CA 1 1 17 11903 1 1 14 LYS CB C -10.993 -5.325 1.562 1.00 . A A . 11 LYS CB 1 1 17 11904 1 1 14 LYS CD C -9.464 -6.022 3.440 1.00 . A A . 11 LYS CD 1 1 17 11905 1 1 14 LYS CE C -10.532 -5.751 4.495 1.00 . A A . 11 LYS CE 1 1 17 11906 1 1 14 LYS CG C -9.625 -5.142 2.205 1.00 . A A . 11 LYS CG 1 1 17 11907 1 1 14 LYS H H -9.560 -5.219 -1.195 1.00 . A A . 11 LYS H 1 1 17 11908 1 1 14 LYS HA H -12.163 -4.727 -0.131 1.00 . A A . 11 LYS HA 1 1 17 11909 1 1 14 LYS HB2 H -11.726 -4.860 2.200 1.00 . A A . 11 LYS HB2 1 1 17 11910 1 1 14 LYS HB3 H -11.200 -6.384 1.507 1.00 . A A . 11 LYS HB3 1 1 17 11911 1 1 14 LYS HD2 H -9.528 -7.056 3.141 1.00 . A A . 11 LYS HD2 1 1 17 11912 1 1 14 LYS HD3 H -8.492 -5.834 3.873 1.00 . A A . 11 LYS HD3 1 1 17 11913 1 1 14 LYS HE2 H -11.503 -5.891 4.046 1.00 . A A . 11 LYS HE2 1 1 17 11914 1 1 14 LYS HE3 H -10.406 -6.458 5.302 1.00 . A A . 11 LYS HE3 1 1 17 11915 1 1 14 LYS HG2 H -8.862 -5.405 1.487 1.00 . A A . 11 LYS HG2 1 1 17 11916 1 1 14 LYS HG3 H -9.509 -4.108 2.494 1.00 . A A . 11 LYS HG3 1 1 17 11917 1 1 14 LYS HZ1 H -10.616 -3.671 4.296 1.00 . A A . 11 LYS HZ1 1 1 17 11918 1 1 14 LYS HZ2 H -9.507 -4.202 5.455 1.00 . A A . 11 LYS HZ2 1 1 17 11919 1 1 14 LYS HZ3 H -11.160 -4.239 5.791 1.00 . A A . 11 LYS HZ3 1 1 17 11920 1 1 14 LYS N N -10.408 -5.543 -0.831 1.00 . A A . 11 LYS N 1 1 17 11921 1 1 14 LYS NZ N -10.449 -4.371 5.045 1.00 . A A . 11 LYS NZ 1 1 17 11922 1 1 14 LYS O O -9.632 -2.987 -0.565 1.00 . A A . 11 LYS O 1 1 17 11923 1 1 15 GLU C C -9.585 -0.717 1.391 1.00 . A A . 12 GLU C 1 1 17 11924 1 1 15 GLU CA C -10.995 -0.991 0.867 1.00 . A A . 12 GLU CA 1 1 17 11925 1 1 15 GLU CB C -12.026 -0.253 1.724 1.00 . A A . 12 GLU CB 1 1 17 11926 1 1 15 GLU CD C -12.909 1.965 2.545 1.00 . A A . 12 GLU CD 1 1 17 11927 1 1 15 GLU CG C -11.967 1.261 1.593 1.00 . A A . 12 GLU CG 1 1 17 11928 1 1 15 GLU H H -12.006 -2.754 1.452 1.00 . A A . 12 GLU H 1 1 17 11929 1 1 15 GLU HA H -11.065 -0.639 -0.151 1.00 . A A . 12 GLU HA 1 1 17 11930 1 1 15 GLU HB2 H -13.015 -0.577 1.434 1.00 . A A . 12 GLU HB2 1 1 17 11931 1 1 15 GLU HB3 H -11.864 -0.510 2.761 1.00 . A A . 12 GLU HB3 1 1 17 11932 1 1 15 GLU HG2 H -10.959 1.588 1.801 1.00 . A A . 12 GLU HG2 1 1 17 11933 1 1 15 GLU HG3 H -12.231 1.531 0.581 1.00 . A A . 12 GLU HG3 1 1 17 11934 1 1 15 GLU N N -11.288 -2.421 0.869 1.00 . A A . 12 GLU N 1 1 17 11935 1 1 15 GLU O O -9.045 -1.482 2.194 1.00 . A A . 12 GLU O 1 1 17 11936 1 1 15 GLU OE1 O -14.077 2.206 2.170 1.00 . A A . 12 GLU OE1 1 1 17 11937 1 1 15 GLU OE2 O -12.485 2.289 3.674 1.00 . A A . 12 GLU OE2 1 1 17 11938 1 1 16 PHE C C -7.702 1.456 2.696 1.00 . A A . 13 PHE C 1 1 17 11939 1 1 16 PHE CA C -7.657 0.762 1.338 1.00 . A A . 13 PHE CA 1 1 17 11940 1 1 16 PHE CB C -7.033 1.709 0.310 1.00 . A A . 13 PHE CB 1 1 17 11941 1 1 16 PHE CD1 C -8.715 3.539 -0.079 1.00 . A A . 13 PHE CD1 1 1 17 11942 1 1 16 PHE CD2 C -6.709 4.072 1.096 1.00 . A A . 13 PHE CD2 1 1 17 11943 1 1 16 PHE CE1 C -9.140 4.848 0.049 1.00 . A A . 13 PHE CE1 1 1 17 11944 1 1 16 PHE CE2 C -7.128 5.382 1.227 1.00 . A A . 13 PHE CE2 1 1 17 11945 1 1 16 PHE CG C -7.497 3.136 0.443 1.00 . A A . 13 PHE CG 1 1 17 11946 1 1 16 PHE CZ C -8.345 5.770 0.703 1.00 . A A . 13 PHE CZ 1 1 17 11947 1 1 16 PHE H H -9.464 0.918 0.254 1.00 . A A . 13 PHE H 1 1 17 11948 1 1 16 PHE HA H -7.052 -0.126 1.413 1.00 . A A . 13 PHE HA 1 1 17 11949 1 1 16 PHE HB2 H -5.960 1.698 0.425 1.00 . A A . 13 PHE HB2 1 1 17 11950 1 1 16 PHE HB3 H -7.286 1.367 -0.683 1.00 . A A . 13 PHE HB3 1 1 17 11951 1 1 16 PHE HD1 H -9.335 2.819 -0.591 1.00 . A A . 13 PHE HD1 1 1 17 11952 1 1 16 PHE HD2 H -5.757 3.765 1.512 1.00 . A A . 13 PHE HD2 1 1 17 11953 1 1 16 PHE HE1 H -10.093 5.150 -0.361 1.00 . A A . 13 PHE HE1 1 1 17 11954 1 1 16 PHE HE2 H -6.503 6.100 1.736 1.00 . A A . 13 PHE HE2 1 1 17 11955 1 1 16 PHE HZ H -8.675 6.794 0.804 1.00 . A A . 13 PHE HZ 1 1 17 11956 1 1 16 PHE N N -8.991 0.368 0.916 1.00 . A A . 13 PHE N 1 1 17 11957 1 1 16 PHE O O -8.746 1.952 3.126 1.00 . A A . 13 PHE O 1 1 17 11958 1 1 17 LYS C C -5.067 2.923 4.660 1.00 . A A . 14 LYS C 1 1 17 11959 1 1 17 LYS CA C -6.418 2.215 4.612 1.00 . A A . 14 LYS CA 1 1 17 11960 1 1 17 LYS CB C -6.564 1.248 5.791 1.00 . A A . 14 LYS CB 1 1 17 11961 1 1 17 LYS CD C -6.536 0.915 8.286 1.00 . A A . 14 LYS CD 1 1 17 11962 1 1 17 LYS CE C -6.318 1.582 9.635 1.00 . A A . 14 LYS CE 1 1 17 11963 1 1 17 LYS CG C -6.336 1.897 7.146 1.00 . A A . 14 LYS CG 1 1 17 11964 1 1 17 LYS H H -5.778 1.032 2.985 1.00 . A A . 14 LYS H 1 1 17 11965 1 1 17 LYS HA H -7.201 2.955 4.661 1.00 . A A . 14 LYS HA 1 1 17 11966 1 1 17 LYS HB2 H -7.561 0.835 5.777 1.00 . A A . 14 LYS HB2 1 1 17 11967 1 1 17 LYS HB3 H -5.851 0.447 5.674 1.00 . A A . 14 LYS HB3 1 1 17 11968 1 1 17 LYS HD2 H -7.543 0.528 8.244 1.00 . A A . 14 LYS HD2 1 1 17 11969 1 1 17 LYS HD3 H -5.833 0.102 8.178 1.00 . A A . 14 LYS HD3 1 1 17 11970 1 1 17 LYS HE2 H -6.346 0.827 10.406 1.00 . A A . 14 LYS HE2 1 1 17 11971 1 1 17 LYS HE3 H -5.347 2.054 9.632 1.00 . A A . 14 LYS HE3 1 1 17 11972 1 1 17 LYS HG2 H -5.324 2.270 7.185 1.00 . A A . 14 LYS HG2 1 1 17 11973 1 1 17 LYS HG3 H -7.028 2.717 7.263 1.00 . A A . 14 LYS HG3 1 1 17 11974 1 1 17 LYS HZ1 H -7.152 3.072 10.837 1.00 . A A . 14 LYS HZ1 1 1 17 11975 1 1 17 LYS HZ2 H -8.293 2.164 9.984 1.00 . A A . 14 LYS HZ2 1 1 17 11976 1 1 17 LYS HZ3 H -7.371 3.331 9.179 1.00 . A A . 14 LYS HZ3 1 1 17 11977 1 1 17 LYS N N -6.558 1.500 3.356 1.00 . A A . 14 LYS N 1 1 17 11978 1 1 17 LYS NZ N -7.355 2.609 9.927 1.00 . A A . 14 LYS NZ 1 1 17 11979 1 1 17 LYS O O -4.907 3.950 5.317 1.00 . A A . 14 LYS O 1 1 17 11980 1 1 18 TYR C C -2.454 3.498 2.543 1.00 . A A . 15 TYR C 1 1 17 11981 1 1 18 TYR CA C -2.756 2.911 3.912 1.00 . A A . 15 TYR CA 1 1 17 11982 1 1 18 TYR CB C -1.730 1.814 4.214 1.00 . A A . 15 TYR CB 1 1 17 11983 1 1 18 TYR CD1 C -2.978 0.522 5.985 1.00 . A A . 15 TYR CD1 1 1 17 11984 1 1 18 TYR CD2 C -0.783 1.287 6.489 1.00 . A A . 15 TYR CD2 1 1 17 11985 1 1 18 TYR CE1 C -3.074 -0.047 7.239 1.00 . A A . 15 TYR CE1 1 1 17 11986 1 1 18 TYR CE2 C -0.868 0.719 7.745 1.00 . A A . 15 TYR CE2 1 1 17 11987 1 1 18 TYR CG C -1.835 1.199 5.590 1.00 . A A . 15 TYR CG 1 1 17 11988 1 1 18 TYR CZ C -2.017 0.054 8.115 1.00 . A A . 15 TYR CZ 1 1 17 11989 1 1 18 TYR H H -4.306 1.579 3.403 1.00 . A A . 15 TYR H 1 1 17 11990 1 1 18 TYR HA H -2.681 3.687 4.658 1.00 . A A . 15 TYR HA 1 1 17 11991 1 1 18 TYR HB2 H -1.852 1.020 3.494 1.00 . A A . 15 TYR HB2 1 1 17 11992 1 1 18 TYR HB3 H -0.738 2.229 4.112 1.00 . A A . 15 TYR HB3 1 1 17 11993 1 1 18 TYR HD1 H -3.804 0.442 5.290 1.00 . A A . 15 TYR HD1 1 1 17 11994 1 1 18 TYR HD2 H 0.115 1.810 6.195 1.00 . A A . 15 TYR HD2 1 1 17 11995 1 1 18 TYR HE1 H -3.973 -0.570 7.526 1.00 . A A . 15 TYR HE1 1 1 17 11996 1 1 18 TYR HE2 H -0.033 0.791 8.428 1.00 . A A . 15 TYR HE2 1 1 17 11997 1 1 18 TYR HH H -1.743 0.093 10.023 1.00 . A A . 15 TYR HH 1 1 17 11998 1 1 18 TYR N N -4.104 2.372 3.942 1.00 . A A . 15 TYR N 1 1 17 11999 1 1 18 TYR O O -3.248 3.371 1.611 1.00 . A A . 15 TYR O 1 1 17 12000 1 1 18 TYR OH O -2.112 -0.511 9.366 1.00 . A A . 15 TYR OH 1 1 17 12001 1 1 19 LYS C C 0.677 4.863 1.260 1.00 . A A . 16 LYS C 1 1 17 12002 1 1 19 LYS CA C -0.823 4.665 1.172 1.00 . A A . 16 LYS CA 1 1 17 12003 1 1 19 LYS CB C -1.522 5.994 0.859 1.00 . A A . 16 LYS CB 1 1 17 12004 1 1 19 LYS CD C -1.952 7.842 -0.804 1.00 . A A . 16 LYS CD 1 1 17 12005 1 1 19 LYS CE C -1.753 8.940 0.232 1.00 . A A . 16 LYS CE 1 1 17 12006 1 1 19 LYS CG C -1.131 6.600 -0.486 1.00 . A A . 16 LYS CG 1 1 17 12007 1 1 19 LYS H H -0.723 4.202 3.228 1.00 . A A . 16 LYS H 1 1 17 12008 1 1 19 LYS HA H -1.038 3.952 0.390 1.00 . A A . 16 LYS HA 1 1 17 12009 1 1 19 LYS HB2 H -2.589 5.833 0.858 1.00 . A A . 16 LYS HB2 1 1 17 12010 1 1 19 LYS HB3 H -1.276 6.704 1.634 1.00 . A A . 16 LYS HB3 1 1 17 12011 1 1 19 LYS HD2 H -1.655 8.219 -1.771 1.00 . A A . 16 LYS HD2 1 1 17 12012 1 1 19 LYS HD3 H -2.998 7.570 -0.829 1.00 . A A . 16 LYS HD3 1 1 17 12013 1 1 19 LYS HE2 H -2.378 9.779 -0.030 1.00 . A A . 16 LYS HE2 1 1 17 12014 1 1 19 LYS HE3 H -2.049 8.561 1.199 1.00 . A A . 16 LYS HE3 1 1 17 12015 1 1 19 LYS HG2 H -0.084 6.873 -0.462 1.00 . A A . 16 LYS HG2 1 1 17 12016 1 1 19 LYS HG3 H -1.293 5.865 -1.261 1.00 . A A . 16 LYS HG3 1 1 17 12017 1 1 19 LYS HZ1 H -0.040 9.777 -0.616 1.00 . A A . 16 LYS HZ1 1 1 17 12018 1 1 19 LYS HZ2 H 0.284 8.612 0.565 1.00 . A A . 16 LYS HZ2 1 1 17 12019 1 1 19 LYS HZ3 H -0.246 10.150 1.018 1.00 . A A . 16 LYS HZ3 1 1 17 12020 1 1 19 LYS N N -1.294 4.115 2.430 1.00 . A A . 16 LYS N 1 1 17 12021 1 1 19 LYS NZ N -0.340 9.400 0.303 1.00 . A A . 16 LYS NZ 1 1 17 12022 1 1 19 LYS O O 1.141 5.798 1.912 1.00 . A A . 16 LYS O 1 1 17 12023 1 1 20 CYS C C 3.386 5.405 0.324 1.00 . A A . 17 CYS C 1 1 17 12024 1 1 20 CYS CA C 2.885 4.016 0.690 1.00 . A A . 17 CYS CA 1 1 17 12025 1 1 20 CYS CB C 3.521 2.984 -0.249 1.00 . A A . 17 CYS CB 1 1 17 12026 1 1 20 CYS H H 0.994 3.241 0.131 1.00 . A A . 17 CYS H 1 1 17 12027 1 1 20 CYS HA H 3.184 3.796 1.703 1.00 . A A . 17 CYS HA 1 1 17 12028 1 1 20 CYS HB2 H 3.230 1.995 0.065 1.00 . A A . 17 CYS HB2 1 1 17 12029 1 1 20 CYS HB3 H 3.177 3.158 -1.257 1.00 . A A . 17 CYS HB3 1 1 17 12030 1 1 20 CYS N N 1.430 3.959 0.638 1.00 . A A . 17 CYS N 1 1 17 12031 1 1 20 CYS O O 3.053 5.930 -0.732 1.00 . A A . 17 CYS O 1 1 17 12032 1 1 20 CYS SG S 5.331 3.062 -0.256 1.00 . A A . 17 CYS SG 1 1 17 12033 1 1 21 PRO C C 5.687 7.379 -0.246 1.00 . A A . 18 PRO C 1 1 17 12034 1 1 21 PRO CA C 4.761 7.348 0.965 1.00 . A A . 18 PRO CA 1 1 17 12035 1 1 21 PRO CB C 5.551 7.641 2.245 1.00 . A A . 18 PRO CB 1 1 17 12036 1 1 21 PRO CD C 4.614 5.458 2.496 1.00 . A A . 18 PRO CD 1 1 17 12037 1 1 21 PRO CG C 5.782 6.315 2.879 1.00 . A A . 18 PRO CG 1 1 17 12038 1 1 21 PRO HA H 3.985 8.087 0.839 1.00 . A A . 18 PRO HA 1 1 17 12039 1 1 21 PRO HB2 H 6.486 8.121 1.992 1.00 . A A . 18 PRO HB2 1 1 17 12040 1 1 21 PRO HB3 H 4.972 8.289 2.889 1.00 . A A . 18 PRO HB3 1 1 17 12041 1 1 21 PRO HD2 H 4.923 4.427 2.393 1.00 . A A . 18 PRO HD2 1 1 17 12042 1 1 21 PRO HD3 H 3.824 5.547 3.225 1.00 . A A . 18 PRO HD3 1 1 17 12043 1 1 21 PRO HG2 H 6.700 5.886 2.505 1.00 . A A . 18 PRO HG2 1 1 17 12044 1 1 21 PRO HG3 H 5.829 6.424 3.952 1.00 . A A . 18 PRO HG3 1 1 17 12045 1 1 21 PRO N N 4.198 6.014 1.199 1.00 . A A . 18 PRO N 1 1 17 12046 1 1 21 PRO O O 6.053 8.446 -0.734 1.00 . A A . 18 PRO O 1 1 17 12047 1 1 22 ARG C C 6.223 5.608 -3.111 1.00 . A A . 19 ARG C 1 1 17 12048 1 1 22 ARG CA C 6.956 6.094 -1.867 1.00 . A A . 19 ARG CA 1 1 17 12049 1 1 22 ARG CB C 8.122 5.162 -1.544 1.00 . A A . 19 ARG CB 1 1 17 12050 1 1 22 ARG CD C 10.373 4.941 -0.408 1.00 . A A . 19 ARG CD 1 1 17 12051 1 1 22 ARG CG C 9.104 5.765 -0.549 1.00 . A A . 19 ARG CG 1 1 17 12052 1 1 22 ARG CZ C 12.589 5.681 0.411 1.00 . A A . 19 ARG CZ 1 1 17 12053 1 1 22 ARG H H 5.734 5.385 -0.293 1.00 . A A . 19 ARG H 1 1 17 12054 1 1 22 ARG HA H 7.349 7.080 -2.066 1.00 . A A . 19 ARG HA 1 1 17 12055 1 1 22 ARG HB2 H 7.728 4.247 -1.122 1.00 . A A . 19 ARG HB2 1 1 17 12056 1 1 22 ARG HB3 H 8.645 4.929 -2.458 1.00 . A A . 19 ARG HB3 1 1 17 12057 1 1 22 ARG HD2 H 10.105 3.937 -0.110 1.00 . A A . 19 ARG HD2 1 1 17 12058 1 1 22 ARG HD3 H 10.876 4.911 -1.361 1.00 . A A . 19 ARG HD3 1 1 17 12059 1 1 22 ARG HE H 10.889 5.775 1.463 1.00 . A A . 19 ARG HE 1 1 17 12060 1 1 22 ARG HG2 H 9.371 6.756 -0.881 1.00 . A A . 19 ARG HG2 1 1 17 12061 1 1 22 ARG HG3 H 8.621 5.828 0.416 1.00 . A A . 19 ARG HG3 1 1 17 12062 1 1 22 ARG HH11 H 12.597 5.003 -1.499 1.00 . A A . 19 ARG HH11 1 1 17 12063 1 1 22 ARG HH12 H 14.136 5.503 -0.884 1.00 . A A . 19 ARG HH12 1 1 17 12064 1 1 22 ARG HH21 H 12.917 6.419 2.272 1.00 . A A . 19 ARG HH21 1 1 17 12065 1 1 22 ARG HH22 H 14.322 6.305 1.261 1.00 . A A . 19 ARG HH22 1 1 17 12066 1 1 22 ARG N N 6.066 6.201 -0.724 1.00 . A A . 19 ARG N 1 1 17 12067 1 1 22 ARG NE N 11.280 5.509 0.595 1.00 . A A . 19 ARG NE 1 1 17 12068 1 1 22 ARG NH1 N 13.151 5.370 -0.750 1.00 . A A . 19 ARG NH1 1 1 17 12069 1 1 22 ARG NH2 N 13.335 6.174 1.392 1.00 . A A . 19 ARG NH2 1 1 17 12070 1 1 22 ARG O O 6.401 6.159 -4.195 1.00 . A A . 19 ARG O 1 1 17 12071 1 1 23 CYS C C 3.363 4.694 -4.358 1.00 . A A . 20 CYS C 1 1 17 12072 1 1 23 CYS CA C 4.701 4.011 -4.113 1.00 . A A . 20 CYS CA 1 1 17 12073 1 1 23 CYS CB C 4.460 2.512 -3.924 1.00 . A A . 20 CYS CB 1 1 17 12074 1 1 23 CYS H H 5.231 4.220 -2.066 1.00 . A A . 20 CYS H 1 1 17 12075 1 1 23 CYS HA H 5.327 4.163 -4.974 1.00 . A A . 20 CYS HA 1 1 17 12076 1 1 23 CYS HB2 H 3.806 2.367 -3.080 1.00 . A A . 20 CYS HB2 1 1 17 12077 1 1 23 CYS HB3 H 3.984 2.128 -4.808 1.00 . A A . 20 CYS HB3 1 1 17 12078 1 1 23 CYS N N 5.390 4.586 -2.961 1.00 . A A . 20 CYS N 1 1 17 12079 1 1 23 CYS O O 2.823 4.646 -5.460 1.00 . A A . 20 CYS O 1 1 17 12080 1 1 23 CYS SG S 5.940 1.523 -3.634 1.00 . A A . 20 CYS SG 1 1 17 12081 1 1 24 LEU C C 0.411 4.899 -3.502 1.00 . A A . 21 LEU C 1 1 17 12082 1 1 24 LEU CA C 1.514 5.936 -3.317 1.00 . A A . 21 LEU CA 1 1 17 12083 1 1 24 LEU CB C 1.406 7.022 -4.392 1.00 . A A . 21 LEU CB 1 1 17 12084 1 1 24 LEU CD1 C 1.998 9.349 -5.083 1.00 . A A . 21 LEU CD1 1 1 17 12085 1 1 24 LEU CD2 C 2.816 8.467 -2.890 1.00 . A A . 21 LEU CD2 1 1 17 12086 1 1 24 LEU CG C 2.470 8.119 -4.331 1.00 . A A . 21 LEU CG 1 1 17 12087 1 1 24 LEU H H 3.365 5.363 -2.481 1.00 . A A . 21 LEU H 1 1 17 12088 1 1 24 LEU HA H 1.375 6.398 -2.350 1.00 . A A . 21 LEU HA 1 1 17 12089 1 1 24 LEU HB2 H 1.468 6.546 -5.360 1.00 . A A . 21 LEU HB2 1 1 17 12090 1 1 24 LEU HB3 H 0.436 7.489 -4.303 1.00 . A A . 21 LEU HB3 1 1 17 12091 1 1 24 LEU HD11 H 1.091 9.718 -4.626 1.00 . A A . 21 LEU HD11 1 1 17 12092 1 1 24 LEU HD12 H 1.805 9.089 -6.112 1.00 . A A . 21 LEU HD12 1 1 17 12093 1 1 24 LEU HD13 H 2.760 10.113 -5.039 1.00 . A A . 21 LEU HD13 1 1 17 12094 1 1 24 LEU HD21 H 3.271 7.606 -2.417 1.00 . A A . 21 LEU HD21 1 1 17 12095 1 1 24 LEU HD22 H 1.917 8.740 -2.356 1.00 . A A . 21 LEU HD22 1 1 17 12096 1 1 24 LEU HD23 H 3.511 9.294 -2.875 1.00 . A A . 21 LEU HD23 1 1 17 12097 1 1 24 LEU HG H 3.369 7.763 -4.814 1.00 . A A . 21 LEU HG 1 1 17 12098 1 1 24 LEU N N 2.836 5.308 -3.306 1.00 . A A . 21 LEU N 1 1 17 12099 1 1 24 LEU O O -0.750 5.246 -3.705 1.00 . A A . 21 LEU O 1 1 17 12100 1 1 25 VAL C C -1.033 2.468 -2.289 1.00 . A A . 22 VAL C 1 1 17 12101 1 1 25 VAL CA C -0.179 2.551 -3.546 1.00 . A A . 22 VAL CA 1 1 17 12102 1 1 25 VAL CB C 0.500 1.187 -3.846 1.00 . A A . 22 VAL CB 1 1 17 12103 1 1 25 VAL CG1 C 1.404 0.740 -2.706 1.00 . A A . 22 VAL CG1 1 1 17 12104 1 1 25 VAL CG2 C -0.543 0.124 -4.147 1.00 . A A . 22 VAL CG2 1 1 17 12105 1 1 25 VAL H H 1.714 3.411 -3.265 1.00 . A A . 22 VAL H 1 1 17 12106 1 1 25 VAL HA H -0.823 2.795 -4.380 1.00 . A A . 22 VAL HA 1 1 17 12107 1 1 25 VAL HB H 1.115 1.307 -4.727 1.00 . A A . 22 VAL HB 1 1 17 12108 1 1 25 VAL HG11 H 1.901 -0.179 -2.980 1.00 . A A . 22 VAL HG11 1 1 17 12109 1 1 25 VAL HG12 H 0.809 0.575 -1.821 1.00 . A A . 22 VAL HG12 1 1 17 12110 1 1 25 VAL HG13 H 2.141 1.503 -2.507 1.00 . A A . 22 VAL HG13 1 1 17 12111 1 1 25 VAL HG21 H -1.200 0.014 -3.296 1.00 . A A . 22 VAL HG21 1 1 17 12112 1 1 25 VAL HG22 H -0.052 -0.817 -4.346 1.00 . A A . 22 VAL HG22 1 1 17 12113 1 1 25 VAL HG23 H -1.121 0.420 -5.010 1.00 . A A . 22 VAL HG23 1 1 17 12114 1 1 25 VAL N N 0.780 3.625 -3.415 1.00 . A A . 22 VAL N 1 1 17 12115 1 1 25 VAL O O -0.527 2.329 -1.167 1.00 . A A . 22 VAL O 1 1 17 12116 1 1 26 GLN C C -3.525 1.121 -0.987 1.00 . A A . 23 GLN C 1 1 17 12117 1 1 26 GLN CA C -3.282 2.565 -1.399 1.00 . A A . 23 GLN CA 1 1 17 12118 1 1 26 GLN CB C -4.577 3.261 -1.825 1.00 . A A . 23 GLN CB 1 1 17 12119 1 1 26 GLN CD C -5.610 5.414 -2.706 1.00 . A A . 23 GLN CD 1 1 17 12120 1 1 26 GLN CG C -4.363 4.727 -2.181 1.00 . A A . 23 GLN CG 1 1 17 12121 1 1 26 GLN H H -2.646 2.758 -3.401 1.00 . A A . 23 GLN H 1 1 17 12122 1 1 26 GLN HA H -2.857 3.094 -0.554 1.00 . A A . 23 GLN HA 1 1 17 12123 1 1 26 GLN HB2 H -4.981 2.753 -2.688 1.00 . A A . 23 GLN HB2 1 1 17 12124 1 1 26 GLN HB3 H -5.288 3.208 -1.015 1.00 . A A . 23 GLN HB3 1 1 17 12125 1 1 26 GLN HE21 H -6.771 4.243 -1.604 1.00 . A A . 23 GLN HE21 1 1 17 12126 1 1 26 GLN HE22 H -7.588 5.410 -2.580 1.00 . A A . 23 GLN HE22 1 1 17 12127 1 1 26 GLN HG2 H -4.033 5.251 -1.298 1.00 . A A . 23 GLN HG2 1 1 17 12128 1 1 26 GLN HG3 H -3.594 4.788 -2.938 1.00 . A A . 23 GLN HG3 1 1 17 12129 1 1 26 GLN N N -2.324 2.613 -2.485 1.00 . A A . 23 GLN N 1 1 17 12130 1 1 26 GLN NE2 N -6.772 4.979 -2.249 1.00 . A A . 23 GLN NE2 1 1 17 12131 1 1 26 GLN O O -4.212 0.360 -1.672 1.00 . A A . 23 GLN O 1 1 17 12132 1 1 26 GLN OE1 O -5.526 6.339 -3.512 1.00 . A A . 23 GLN OE1 1 1 17 12133 1 1 27 THR C C -4.048 -0.773 1.683 1.00 . A A . 24 THR C 1 1 17 12134 1 1 27 THR CA C -2.969 -0.612 0.617 1.00 . A A . 24 THR CA 1 1 17 12135 1 1 27 THR CB C -1.595 -1.011 1.187 1.00 . A A . 24 THR CB 1 1 17 12136 1 1 27 THR CG2 C -0.646 -1.430 0.081 1.00 . A A . 24 THR CG2 1 1 17 12137 1 1 27 THR H H -2.451 1.426 0.656 1.00 . A A . 24 THR H 1 1 17 12138 1 1 27 THR HA H -3.195 -1.262 -0.216 1.00 . A A . 24 THR HA 1 1 17 12139 1 1 27 THR HB H -1.728 -1.846 1.861 1.00 . A A . 24 THR HB 1 1 17 12140 1 1 27 THR HG1 H -0.595 0.684 1.288 1.00 . A A . 24 THR HG1 1 1 17 12141 1 1 27 THR HG21 H -0.545 -0.626 -0.633 1.00 . A A . 24 THR HG21 1 1 17 12142 1 1 27 THR HG22 H -1.037 -2.306 -0.411 1.00 . A A . 24 THR HG22 1 1 17 12143 1 1 27 THR HG23 H 0.324 -1.657 0.505 1.00 . A A . 24 THR HG23 1 1 17 12144 1 1 27 THR N N -2.927 0.750 0.128 1.00 . A A . 24 THR N 1 1 17 12145 1 1 27 THR O O -4.399 0.179 2.375 1.00 . A A . 24 THR O 1 1 17 12146 1 1 27 THR OG1 O -1.026 0.085 1.906 1.00 . A A . 24 THR OG1 1 1 17 12147 1 1 28 CYS C C -5.141 -2.319 4.157 1.00 . A A . 25 CYS C 1 1 17 12148 1 1 28 CYS CA C -5.664 -2.262 2.732 1.00 . A A . 25 CYS CA 1 1 17 12149 1 1 28 CYS CB C -6.354 -3.585 2.378 1.00 . A A . 25 CYS CB 1 1 17 12150 1 1 28 CYS H H -4.248 -2.701 1.226 1.00 . A A . 25 CYS H 1 1 17 12151 1 1 28 CYS HA H -6.383 -1.462 2.658 1.00 . A A . 25 CYS HA 1 1 17 12152 1 1 28 CYS HB2 H -7.201 -3.728 3.029 1.00 . A A . 25 CYS HB2 1 1 17 12153 1 1 28 CYS HB3 H -6.700 -3.538 1.361 1.00 . A A . 25 CYS HB3 1 1 17 12154 1 1 28 CYS N N -4.583 -1.982 1.794 1.00 . A A . 25 CYS N 1 1 17 12155 1 1 28 CYS O O -5.840 -1.956 5.101 1.00 . A A . 25 CYS O 1 1 17 12156 1 1 28 CYS SG S -5.294 -5.042 2.533 1.00 . A A . 25 CYS SG 1 1 17 12157 1 1 29 SER C C -1.792 -3.006 5.489 1.00 . A A . 26 SER C 1 1 17 12158 1 1 29 SER CA C -3.305 -2.957 5.609 1.00 . A A . 26 SER CA 1 1 17 12159 1 1 29 SER CB C -3.830 -4.241 6.266 1.00 . A A . 26 SER CB 1 1 17 12160 1 1 29 SER H H -3.357 -2.940 3.501 1.00 . A A . 26 SER H 1 1 17 12161 1 1 29 SER HA H -3.577 -2.111 6.223 1.00 . A A . 26 SER HA 1 1 17 12162 1 1 29 SER HB2 H -3.662 -5.076 5.603 1.00 . A A . 26 SER HB2 1 1 17 12163 1 1 29 SER HB3 H -3.308 -4.408 7.195 1.00 . A A . 26 SER HB3 1 1 17 12164 1 1 29 SER HG H -5.537 -3.268 6.271 1.00 . A A . 26 SER HG 1 1 17 12165 1 1 29 SER N N -3.900 -2.762 4.301 1.00 . A A . 26 SER N 1 1 17 12166 1 1 29 SER O O -1.267 -3.081 4.371 1.00 . A A . 26 SER O 1 1 17 12167 1 1 29 SER OG O -5.221 -4.148 6.533 1.00 . A A . 26 SER OG 1 1 17 12168 1 1 30 LEU C C 0.965 -4.121 5.913 1.00 . A A . 27 LEU C 1 1 17 12169 1 1 30 LEU CA C 0.356 -2.922 6.637 1.00 . A A . 27 LEU CA 1 1 17 12170 1 1 30 LEU CB C 0.871 -2.867 8.075 1.00 . A A . 27 LEU CB 1 1 17 12171 1 1 30 LEU CD1 C 2.159 -0.713 8.077 1.00 . A A . 27 LEU CD1 1 1 17 12172 1 1 30 LEU CD2 C 2.843 -2.576 9.594 1.00 . A A . 27 LEU CD2 1 1 17 12173 1 1 30 LEU CG C 2.246 -2.221 8.244 1.00 . A A . 27 LEU CG 1 1 17 12174 1 1 30 LEU H H -1.582 -3.044 7.477 1.00 . A A . 27 LEU H 1 1 17 12175 1 1 30 LEU HA H 0.647 -2.019 6.123 1.00 . A A . 27 LEU HA 1 1 17 12176 1 1 30 LEU HB2 H 0.159 -2.317 8.671 1.00 . A A . 27 LEU HB2 1 1 17 12177 1 1 30 LEU HB3 H 0.925 -3.879 8.448 1.00 . A A . 27 LEU HB3 1 1 17 12178 1 1 30 LEU HD11 H 1.715 -0.481 7.120 1.00 . A A . 27 LEU HD11 1 1 17 12179 1 1 30 LEU HD12 H 3.149 -0.288 8.126 1.00 . A A . 27 LEU HD12 1 1 17 12180 1 1 30 LEU HD13 H 1.550 -0.299 8.866 1.00 . A A . 27 LEU HD13 1 1 17 12181 1 1 30 LEU HD21 H 2.181 -2.242 10.380 1.00 . A A . 27 LEU HD21 1 1 17 12182 1 1 30 LEU HD22 H 3.802 -2.091 9.703 1.00 . A A . 27 LEU HD22 1 1 17 12183 1 1 30 LEU HD23 H 2.972 -3.645 9.662 1.00 . A A . 27 LEU HD23 1 1 17 12184 1 1 30 LEU HG H 2.903 -2.592 7.479 1.00 . A A . 27 LEU HG 1 1 17 12185 1 1 30 LEU N N -1.101 -2.995 6.622 1.00 . A A . 27 LEU N 1 1 17 12186 1 1 30 LEU O O 2.039 -4.020 5.321 1.00 . A A . 27 LEU O 1 1 17 12187 1 1 31 GLU C C 0.939 -6.203 3.793 1.00 . A A . 28 GLU C 1 1 17 12188 1 1 31 GLU CA C 0.677 -6.455 5.273 1.00 . A A . 28 GLU CA 1 1 17 12189 1 1 31 GLU CB C -0.406 -7.503 5.425 1.00 . A A . 28 GLU CB 1 1 17 12190 1 1 31 GLU CD C -2.852 -8.035 5.137 1.00 . A A . 28 GLU CD 1 1 17 12191 1 1 31 GLU CG C -1.808 -6.951 5.286 1.00 . A A . 28 GLU CG 1 1 17 12192 1 1 31 GLU H H -0.549 -5.284 6.498 1.00 . A A . 28 GLU H 1 1 17 12193 1 1 31 GLU HA H 1.576 -6.815 5.734 1.00 . A A . 28 GLU HA 1 1 17 12194 1 1 31 GLU HB2 H -0.266 -8.232 4.663 1.00 . A A . 28 GLU HB2 1 1 17 12195 1 1 31 GLU HB3 H -0.314 -7.968 6.394 1.00 . A A . 28 GLU HB3 1 1 17 12196 1 1 31 GLU HG2 H -2.034 -6.369 6.166 1.00 . A A . 28 GLU HG2 1 1 17 12197 1 1 31 GLU HG3 H -1.842 -6.313 4.418 1.00 . A A . 28 GLU HG3 1 1 17 12198 1 1 31 GLU N N 0.268 -5.250 5.963 1.00 . A A . 28 GLU N 1 1 17 12199 1 1 31 GLU O O 1.945 -6.642 3.243 1.00 . A A . 28 GLU O 1 1 17 12200 1 1 31 GLU OE1 O -3.360 -8.522 6.167 1.00 . A A . 28 GLU OE1 1 1 17 12201 1 1 31 GLU OE2 O -3.167 -8.404 3.988 1.00 . A A . 28 GLU OE2 1 1 17 12202 1 1 32 CYS C C 1.129 -4.002 1.571 1.00 . A A . 29 CYS C 1 1 17 12203 1 1 32 CYS CA C 0.160 -5.163 1.755 1.00 . A A . 29 CYS CA 1 1 17 12204 1 1 32 CYS CB C -1.214 -4.822 1.190 1.00 . A A . 29 CYS CB 1 1 17 12205 1 1 32 CYS H H -0.749 -5.161 3.652 1.00 . A A . 29 CYS H 1 1 17 12206 1 1 32 CYS HA H 0.548 -6.030 1.245 1.00 . A A . 29 CYS HA 1 1 17 12207 1 1 32 CYS HB2 H -1.770 -4.292 1.947 1.00 . A A . 29 CYS HB2 1 1 17 12208 1 1 32 CYS HB3 H -1.099 -4.187 0.327 1.00 . A A . 29 CYS HB3 1 1 17 12209 1 1 32 CYS N N 0.030 -5.488 3.158 1.00 . A A . 29 CYS N 1 1 17 12210 1 1 32 CYS O O 1.781 -3.878 0.534 1.00 . A A . 29 CYS O 1 1 17 12211 1 1 32 CYS SG S -2.204 -6.254 0.707 1.00 . A A . 29 CYS SG 1 1 17 12212 1 1 33 SER C C 3.595 -2.539 2.578 1.00 . A A . 30 SER C 1 1 17 12213 1 1 33 SER CA C 2.153 -2.039 2.576 1.00 . A A . 30 SER CA 1 1 17 12214 1 1 33 SER CB C 1.911 -1.145 3.792 1.00 . A A . 30 SER CB 1 1 17 12215 1 1 33 SER H H 0.658 -3.301 3.383 1.00 . A A . 30 SER H 1 1 17 12216 1 1 33 SER HA H 1.977 -1.470 1.676 1.00 . A A . 30 SER HA 1 1 17 12217 1 1 33 SER HB2 H 2.304 -1.629 4.674 1.00 . A A . 30 SER HB2 1 1 17 12218 1 1 33 SER HB3 H 2.412 -0.201 3.646 1.00 . A A . 30 SER HB3 1 1 17 12219 1 1 33 SER HG H 0.166 -0.454 3.210 1.00 . A A . 30 SER HG 1 1 17 12220 1 1 33 SER N N 1.227 -3.163 2.592 1.00 . A A . 30 SER N 1 1 17 12221 1 1 33 SER O O 4.489 -1.894 2.034 1.00 . A A . 30 SER O 1 1 17 12222 1 1 33 SER OG O 0.528 -0.906 3.982 1.00 . A A . 30 SER OG 1 1 17 12223 1 1 34 LYS C C 5.317 -5.360 2.208 1.00 . A A . 31 LYS C 1 1 17 12224 1 1 34 LYS CA C 5.138 -4.288 3.278 1.00 . A A . 31 LYS CA 1 1 17 12225 1 1 34 LYS CB C 5.359 -4.901 4.665 1.00 . A A . 31 LYS CB 1 1 17 12226 1 1 34 LYS CD C 4.681 -6.674 6.333 1.00 . A A . 31 LYS CD 1 1 17 12227 1 1 34 LYS CE C 4.083 -5.753 7.385 1.00 . A A . 31 LYS CE 1 1 17 12228 1 1 34 LYS CG C 4.495 -6.125 4.928 1.00 . A A . 31 LYS CG 1 1 17 12229 1 1 34 LYS H H 3.053 -4.154 3.620 1.00 . A A . 31 LYS H 1 1 17 12230 1 1 34 LYS HA H 5.862 -3.507 3.115 1.00 . A A . 31 LYS HA 1 1 17 12231 1 1 34 LYS HB2 H 6.397 -5.192 4.757 1.00 . A A . 31 LYS HB2 1 1 17 12232 1 1 34 LYS HB3 H 5.134 -4.158 5.415 1.00 . A A . 31 LYS HB3 1 1 17 12233 1 1 34 LYS HD2 H 4.199 -7.637 6.398 1.00 . A A . 31 LYS HD2 1 1 17 12234 1 1 34 LYS HD3 H 5.737 -6.786 6.526 1.00 . A A . 31 LYS HD3 1 1 17 12235 1 1 34 LYS HE2 H 4.591 -4.802 7.345 1.00 . A A . 31 LYS HE2 1 1 17 12236 1 1 34 LYS HE3 H 3.035 -5.610 7.167 1.00 . A A . 31 LYS HE3 1 1 17 12237 1 1 34 LYS HG2 H 3.459 -5.853 4.797 1.00 . A A . 31 LYS HG2 1 1 17 12238 1 1 34 LYS HG3 H 4.757 -6.894 4.214 1.00 . A A . 31 LYS HG3 1 1 17 12239 1 1 34 LYS HZ1 H 3.740 -7.239 8.807 1.00 . A A . 31 LYS HZ1 1 1 17 12240 1 1 34 LYS HZ2 H 3.794 -5.679 9.450 1.00 . A A . 31 LYS HZ2 1 1 17 12241 1 1 34 LYS HZ3 H 5.224 -6.451 8.988 1.00 . A A . 31 LYS HZ3 1 1 17 12242 1 1 34 LYS N N 3.810 -3.694 3.195 1.00 . A A . 31 LYS N 1 1 17 12243 1 1 34 LYS NZ N 4.219 -6.319 8.752 1.00 . A A . 31 LYS NZ 1 1 17 12244 1 1 34 LYS O O 6.416 -5.879 2.012 1.00 . A A . 31 LYS O 1 1 17 12245 1 1 35 LYS C C 5.007 -6.355 -0.717 1.00 . A A . 32 LYS C 1 1 17 12246 1 1 35 LYS CA C 4.255 -6.763 0.542 1.00 . A A . 32 LYS CA 1 1 17 12247 1 1 35 LYS CB C 2.837 -7.178 0.193 1.00 . A A . 32 LYS CB 1 1 17 12248 1 1 35 LYS CD C 1.340 -9.018 -0.568 1.00 . A A . 32 LYS CD 1 1 17 12249 1 1 35 LYS CE C 1.261 -10.385 -1.223 1.00 . A A . 32 LYS CE 1 1 17 12250 1 1 35 LYS CG C 2.767 -8.533 -0.474 1.00 . A A . 32 LYS CG 1 1 17 12251 1 1 35 LYS H H 3.405 -5.188 1.661 1.00 . A A . 32 LYS H 1 1 17 12252 1 1 35 LYS HA H 4.759 -7.606 0.991 1.00 . A A . 32 LYS HA 1 1 17 12253 1 1 35 LYS HB2 H 2.247 -7.210 1.097 1.00 . A A . 32 LYS HB2 1 1 17 12254 1 1 35 LYS HB3 H 2.415 -6.444 -0.481 1.00 . A A . 32 LYS HB3 1 1 17 12255 1 1 35 LYS HD2 H 0.933 -9.079 0.429 1.00 . A A . 32 LYS HD2 1 1 17 12256 1 1 35 LYS HD3 H 0.770 -8.313 -1.151 1.00 . A A . 32 LYS HD3 1 1 17 12257 1 1 35 LYS HE2 H 1.784 -11.099 -0.604 1.00 . A A . 32 LYS HE2 1 1 17 12258 1 1 35 LYS HE3 H 0.224 -10.672 -1.303 1.00 . A A . 32 LYS HE3 1 1 17 12259 1 1 35 LYS HG2 H 3.180 -8.458 -1.469 1.00 . A A . 32 LYS HG2 1 1 17 12260 1 1 35 LYS HG3 H 3.342 -9.240 0.105 1.00 . A A . 32 LYS HG3 1 1 17 12261 1 1 35 LYS HZ1 H 1.755 -11.318 -3.023 1.00 . A A . 32 LYS HZ1 1 1 17 12262 1 1 35 LYS HZ2 H 2.884 -10.169 -2.518 1.00 . A A . 32 LYS HZ2 1 1 17 12263 1 1 35 LYS HZ3 H 1.409 -9.672 -3.177 1.00 . A A . 32 LYS HZ3 1 1 17 12264 1 1 35 LYS N N 4.238 -5.684 1.513 1.00 . A A . 32 LYS N 1 1 17 12265 1 1 35 LYS NZ N 1.869 -10.386 -2.579 1.00 . A A . 32 LYS NZ 1 1 17 12266 1 1 35 LYS O O 5.808 -7.122 -1.249 1.00 . A A . 32 LYS O 1 1 17 12267 1 1 36 HIS C C 6.914 -4.442 -2.173 1.00 . A A . 33 HIS C 1 1 17 12268 1 1 36 HIS CA C 5.416 -4.653 -2.399 1.00 . A A . 33 HIS CA 1 1 17 12269 1 1 36 HIS CB C 4.748 -3.360 -2.908 1.00 . A A . 33 HIS CB 1 1 17 12270 1 1 36 HIS CD2 C 5.971 -1.572 -1.482 1.00 . A A . 33 HIS CD2 1 1 17 12271 1 1 36 HIS CE1 C 4.275 -0.459 -0.757 1.00 . A A . 33 HIS CE1 1 1 17 12272 1 1 36 HIS CG C 4.871 -2.172 -1.993 1.00 . A A . 33 HIS CG 1 1 17 12273 1 1 36 HIS H H 4.154 -4.543 -0.692 1.00 . A A . 33 HIS H 1 1 17 12274 1 1 36 HIS HA H 5.294 -5.423 -3.147 1.00 . A A . 33 HIS HA 1 1 17 12275 1 1 36 HIS HB2 H 5.192 -3.090 -3.854 1.00 . A A . 33 HIS HB2 1 1 17 12276 1 1 36 HIS HB3 H 3.694 -3.554 -3.058 1.00 . A A . 33 HIS HB3 1 1 17 12277 1 1 36 HIS HD1 H 2.853 -1.648 -1.698 1.00 . A A . 33 HIS HD1 1 1 17 12278 1 1 36 HIS HD2 H 6.988 -1.887 -1.648 1.00 . A A . 33 HIS HD2 1 1 17 12279 1 1 36 HIS HE1 H 3.653 0.232 -0.213 1.00 . A A . 33 HIS HE1 1 1 17 12280 1 1 36 HIS N N 4.773 -5.132 -1.178 1.00 . A A . 33 HIS N 1 1 17 12281 1 1 36 HIS ND1 N 3.800 -1.456 -1.519 1.00 . A A . 33 HIS ND1 1 1 17 12282 1 1 36 HIS NE2 N 5.599 -0.478 -0.706 1.00 . A A . 33 HIS NE2 1 1 17 12283 1 1 36 HIS O O 7.680 -4.248 -3.118 1.00 . A A . 33 HIS O 1 1 17 12284 1 1 37 LYS C C 9.599 -5.445 -0.900 1.00 . A A . 34 LYS C 1 1 17 12285 1 1 37 LYS CA C 8.710 -4.258 -0.550 1.00 . A A . 34 LYS CA 1 1 17 12286 1 1 37 LYS CB C 8.808 -3.940 0.942 1.00 . A A . 34 LYS CB 1 1 17 12287 1 1 37 LYS CD C 8.147 -2.390 2.815 1.00 . A A . 34 LYS CD 1 1 17 12288 1 1 37 LYS CE C 7.277 -1.206 3.200 1.00 . A A . 34 LYS CE 1 1 17 12289 1 1 37 LYS CG C 7.946 -2.759 1.355 1.00 . A A . 34 LYS CG 1 1 17 12290 1 1 37 LYS H H 6.688 -4.764 -0.217 1.00 . A A . 34 LYS H 1 1 17 12291 1 1 37 LYS HA H 9.044 -3.399 -1.113 1.00 . A A . 34 LYS HA 1 1 17 12292 1 1 37 LYS HB2 H 8.493 -4.805 1.505 1.00 . A A . 34 LYS HB2 1 1 17 12293 1 1 37 LYS HB3 H 9.835 -3.714 1.185 1.00 . A A . 34 LYS HB3 1 1 17 12294 1 1 37 LYS HD2 H 7.886 -3.236 3.433 1.00 . A A . 34 LYS HD2 1 1 17 12295 1 1 37 LYS HD3 H 9.185 -2.131 2.973 1.00 . A A . 34 LYS HD3 1 1 17 12296 1 1 37 LYS HE2 H 7.507 -0.385 2.540 1.00 . A A . 34 LYS HE2 1 1 17 12297 1 1 37 LYS HE3 H 6.239 -1.481 3.075 1.00 . A A . 34 LYS HE3 1 1 17 12298 1 1 37 LYS HG2 H 8.205 -1.908 0.742 1.00 . A A . 34 LYS HG2 1 1 17 12299 1 1 37 LYS HG3 H 6.908 -3.013 1.197 1.00 . A A . 34 LYS HG3 1 1 17 12300 1 1 37 LYS HZ1 H 6.844 -0.010 4.854 1.00 . A A . 34 LYS HZ1 1 1 17 12301 1 1 37 LYS HZ2 H 8.475 -0.434 4.725 1.00 . A A . 34 LYS HZ2 1 1 17 12302 1 1 37 LYS HZ3 H 7.345 -1.575 5.256 1.00 . A A . 34 LYS HZ3 1 1 17 12303 1 1 37 LYS N N 7.330 -4.517 -0.917 1.00 . A A . 34 LYS N 1 1 17 12304 1 1 37 LYS NZ N 7.501 -0.776 4.605 1.00 . A A . 34 LYS NZ 1 1 17 12305 1 1 37 LYS O O 10.814 -5.311 -0.989 1.00 . A A . 34 LYS O 1 1 17 12306 1 1 38 THR C C 10.008 -7.881 -2.955 1.00 . A A . 35 THR C 1 1 17 12307 1 1 38 THR CA C 9.753 -7.795 -1.449 1.00 . A A . 35 THR CA 1 1 17 12308 1 1 38 THR CB C 9.041 -9.074 -0.951 1.00 . A A . 35 THR CB 1 1 17 12309 1 1 38 THR CG2 C 7.811 -9.388 -1.792 1.00 . A A . 35 THR CG2 1 1 17 12310 1 1 38 THR H H 8.011 -6.658 -1.052 1.00 . A A . 35 THR H 1 1 17 12311 1 1 38 THR HA H 10.704 -7.721 -0.943 1.00 . A A . 35 THR HA 1 1 17 12312 1 1 38 THR HB H 8.725 -8.911 0.069 1.00 . A A . 35 THR HB 1 1 17 12313 1 1 38 THR HG1 H 10.837 -9.883 -0.782 1.00 . A A . 35 THR HG1 1 1 17 12314 1 1 38 THR HG21 H 7.107 -8.574 -1.718 1.00 . A A . 35 THR HG21 1 1 17 12315 1 1 38 THR HG22 H 7.350 -10.296 -1.432 1.00 . A A . 35 THR HG22 1 1 17 12316 1 1 38 THR HG23 H 8.103 -9.519 -2.824 1.00 . A A . 35 THR HG23 1 1 17 12317 1 1 38 THR N N 8.990 -6.602 -1.121 1.00 . A A . 35 THR N 1 1 17 12318 1 1 38 THR O O 10.854 -8.650 -3.413 1.00 . A A . 35 THR O 1 1 17 12319 1 1 38 THR OG1 O 9.943 -10.188 -0.990 1.00 . A A . 35 THR OG1 1 1 17 12320 1 1 39 ARG C C 10.121 -5.764 -5.636 1.00 . A A . 36 ARG C 1 1 17 12321 1 1 39 ARG CA C 9.436 -7.051 -5.172 1.00 . A A . 36 ARG CA 1 1 17 12322 1 1 39 ARG CB C 8.074 -7.214 -5.866 1.00 . A A . 36 ARG CB 1 1 17 12323 1 1 39 ARG CD C 5.675 -6.445 -6.070 1.00 . A A . 36 ARG CD 1 1 17 12324 1 1 39 ARG CG C 6.975 -6.336 -5.284 1.00 . A A . 36 ARG CG 1 1 17 12325 1 1 39 ARG CZ C 4.711 -5.205 -7.981 1.00 . A A . 36 ARG CZ 1 1 17 12326 1 1 39 ARG H H 8.630 -6.477 -3.299 1.00 . A A . 36 ARG H 1 1 17 12327 1 1 39 ARG HA H 10.064 -7.886 -5.443 1.00 . A A . 36 ARG HA 1 1 17 12328 1 1 39 ARG HB2 H 8.186 -6.966 -6.911 1.00 . A A . 36 ARG HB2 1 1 17 12329 1 1 39 ARG HB3 H 7.763 -8.244 -5.783 1.00 . A A . 36 ARG HB3 1 1 17 12330 1 1 39 ARG HD2 H 5.454 -7.490 -6.228 1.00 . A A . 36 ARG HD2 1 1 17 12331 1 1 39 ARG HD3 H 4.882 -5.995 -5.491 1.00 . A A . 36 ARG HD3 1 1 17 12332 1 1 39 ARG HE H 6.635 -5.746 -7.809 1.00 . A A . 36 ARG HE 1 1 17 12333 1 1 39 ARG HG2 H 6.790 -6.639 -4.265 1.00 . A A . 36 ARG HG2 1 1 17 12334 1 1 39 ARG HG3 H 7.308 -5.308 -5.298 1.00 . A A . 36 ARG HG3 1 1 17 12335 1 1 39 ARG HH11 H 3.359 -5.702 -6.553 1.00 . A A . 36 ARG HH11 1 1 17 12336 1 1 39 ARG HH12 H 2.724 -4.809 -7.896 1.00 . A A . 36 ARG HH12 1 1 17 12337 1 1 39 ARG HH21 H 5.788 -4.555 -9.571 1.00 . A A . 36 ARG HH21 1 1 17 12338 1 1 39 ARG HH22 H 4.096 -4.172 -9.614 1.00 . A A . 36 ARG HH22 1 1 17 12339 1 1 39 ARG N N 9.283 -7.071 -3.721 1.00 . A A . 36 ARG N 1 1 17 12340 1 1 39 ARG NE N 5.753 -5.777 -7.369 1.00 . A A . 36 ARG NE 1 1 17 12341 1 1 39 ARG NH1 N 3.503 -5.243 -7.432 1.00 . A A . 36 ARG NH1 1 1 17 12342 1 1 39 ARG NH2 N 4.878 -4.596 -9.146 1.00 . A A . 36 ARG NH2 1 1 17 12343 1 1 39 ARG O O 10.936 -5.784 -6.558 1.00 . A A . 36 ARG O 1 1 17 12344 1 1 40 ASP C C 11.521 -2.952 -4.489 1.00 . A A . 37 ASP C 1 1 17 12345 1 1 40 ASP CA C 10.344 -3.351 -5.379 1.00 . A A . 37 ASP CA 1 1 17 12346 1 1 40 ASP CB C 9.246 -2.284 -5.313 1.00 . A A . 37 ASP CB 1 1 17 12347 1 1 40 ASP CG C 9.703 -0.928 -5.822 1.00 . A A . 37 ASP CG 1 1 17 12348 1 1 40 ASP H H 9.166 -4.697 -4.237 1.00 . A A . 37 ASP H 1 1 17 12349 1 1 40 ASP HA H 10.692 -3.433 -6.397 1.00 . A A . 37 ASP HA 1 1 17 12350 1 1 40 ASP HB2 H 8.406 -2.605 -5.913 1.00 . A A . 37 ASP HB2 1 1 17 12351 1 1 40 ASP HB3 H 8.926 -2.172 -4.288 1.00 . A A . 37 ASP HB3 1 1 17 12352 1 1 40 ASP N N 9.798 -4.651 -4.987 1.00 . A A . 37 ASP N 1 1 17 12353 1 1 40 ASP O O 12.270 -2.030 -4.808 1.00 . A A . 37 ASP O 1 1 17 12354 1 1 40 ASP OD1 O 9.932 -0.796 -7.044 1.00 . A A . 37 ASP OD1 1 1 17 12355 1 1 40 ASP OD2 O 9.829 0.009 -5.008 1.00 . A A . 37 ASP OD2 1 1 17 12356 1 1 41 ASN C C 12.457 -2.041 -1.705 1.00 . A A . 38 ASN C 1 1 17 12357 1 1 41 ASN CA C 12.721 -3.390 -2.380 1.00 . A A . 38 ASN CA 1 1 17 12358 1 1 41 ASN CB C 14.114 -3.430 -3.031 1.00 . A A . 38 ASN CB 1 1 17 12359 1 1 41 ASN CG C 15.242 -3.547 -2.024 1.00 . A A . 38 ASN CG 1 1 17 12360 1 1 41 ASN H H 11.072 -4.422 -3.215 1.00 . A A . 38 ASN H 1 1 17 12361 1 1 41 ASN HA H 12.665 -4.163 -1.627 1.00 . A A . 38 ASN HA 1 1 17 12362 1 1 41 ASN HB2 H 14.169 -4.279 -3.692 1.00 . A A . 38 ASN HB2 1 1 17 12363 1 1 41 ASN HB3 H 14.259 -2.526 -3.603 1.00 . A A . 38 ASN HB3 1 1 17 12364 1 1 41 ASN HD21 H 15.539 -1.583 -2.070 1.00 . A A . 38 ASN HD21 1 1 17 12365 1 1 41 ASN HD22 H 16.584 -2.482 -1.031 1.00 . A A . 38 ASN HD22 1 1 17 12366 1 1 41 ASN N N 11.675 -3.670 -3.373 1.00 . A A . 38 ASN N 1 1 17 12367 1 1 41 ASN ND2 N 15.848 -2.426 -1.671 1.00 . A A . 38 ASN ND2 1 1 17 12368 1 1 41 ASN O O 13.322 -1.469 -1.043 1.00 . A A . 38 ASN O 1 1 17 12369 1 1 41 ASN OD1 O 15.581 -4.647 -1.585 1.00 . A A . 38 ASN OD1 1 1 17 12370 1 1 42 CYS C C 10.917 -0.286 0.207 1.00 . A A . 39 CYS C 1 1 17 12371 1 1 42 CYS CA C 10.788 -0.297 -1.315 1.00 . A A . 39 CYS CA 1 1 17 12372 1 1 42 CYS CB C 9.331 -0.068 -1.725 1.00 . A A . 39 CYS CB 1 1 17 12373 1 1 42 CYS H H 10.599 -2.085 -2.402 1.00 . A A . 39 CYS H 1 1 17 12374 1 1 42 CYS HA H 11.399 0.488 -1.729 1.00 . A A . 39 CYS HA 1 1 17 12375 1 1 42 CYS HB2 H 9.283 0.050 -2.796 1.00 . A A . 39 CYS HB2 1 1 17 12376 1 1 42 CYS HB3 H 8.750 -0.932 -1.440 1.00 . A A . 39 CYS HB3 1 1 17 12377 1 1 42 CYS N N 11.232 -1.563 -1.874 1.00 . A A . 39 CYS N 1 1 17 12378 1 1 42 CYS O O 10.627 -1.279 0.875 1.00 . A A . 39 CYS O 1 1 17 12379 1 1 42 CYS SG S 8.549 1.384 -0.986 1.00 . A A . 39 CYS SG 1 1 17 12380 1 1 43 SER C C 10.104 1.374 2.766 1.00 . A A . 40 SER C 1 1 17 12381 1 1 43 SER CA C 11.470 1.011 2.183 1.00 . A A . 40 SER CA 1 1 17 12382 1 1 43 SER CB C 12.503 2.094 2.518 1.00 . A A . 40 SER CB 1 1 17 12383 1 1 43 SER H H 11.667 1.563 0.151 1.00 . A A . 40 SER H 1 1 17 12384 1 1 43 SER HA H 11.791 0.072 2.610 1.00 . A A . 40 SER HA 1 1 17 12385 1 1 43 SER HB2 H 13.459 1.813 2.106 1.00 . A A . 40 SER HB2 1 1 17 12386 1 1 43 SER HB3 H 12.188 3.033 2.086 1.00 . A A . 40 SER HB3 1 1 17 12387 1 1 43 SER HG H 13.061 1.472 4.293 1.00 . A A . 40 SER HG 1 1 17 12388 1 1 43 SER N N 11.372 0.837 0.744 1.00 . A A . 40 SER N 1 1 17 12389 1 1 43 SER O O 9.784 1.048 3.909 1.00 . A A . 40 SER O 1 1 17 12390 1 1 43 SER OG O 12.643 2.260 3.918 1.00 . A A . 40 SER OG 1 1 17 12391 1 1 44 GLY C C 7.866 3.438 3.399 1.00 . A A . 41 GLY C 1 1 17 12392 1 1 44 GLY CA C 7.938 2.385 2.318 1.00 . A A . 41 GLY CA 1 1 17 12393 1 1 44 GLY H H 9.622 2.270 1.046 1.00 . A A . 41 GLY H 1 1 17 12394 1 1 44 GLY HA2 H 7.419 2.752 1.445 1.00 . A A . 41 GLY HA2 1 1 17 12395 1 1 44 GLY HA3 H 7.437 1.498 2.668 1.00 . A A . 41 GLY HA3 1 1 17 12396 1 1 44 GLY N N 9.295 2.035 1.940 1.00 . A A . 41 GLY N 1 1 17 12397 1 1 44 GLY O O 6.947 3.431 4.214 1.00 . A A . 41 GLY O 1 1 17 12398 1 1 45 GLN C C 9.619 6.586 3.841 1.00 . A A . 42 GLN C 1 1 17 12399 1 1 45 GLN CA C 8.854 5.405 4.398 1.00 . A A . 42 GLN CA 1 1 17 12400 1 1 45 GLN CB C 9.512 4.899 5.686 1.00 . A A . 42 GLN CB 1 1 17 12401 1 1 45 GLN CD C 9.997 5.333 8.137 1.00 . A A . 42 GLN CD 1 1 17 12402 1 1 45 GLN CG C 9.481 5.905 6.829 1.00 . A A . 42 GLN CG 1 1 17 12403 1 1 45 GLN H H 9.508 4.346 2.709 1.00 . A A . 42 GLN H 1 1 17 12404 1 1 45 GLN HA H 7.838 5.706 4.608 1.00 . A A . 42 GLN HA 1 1 17 12405 1 1 45 GLN HB2 H 9.004 4.003 6.010 1.00 . A A . 42 GLN HB2 1 1 17 12406 1 1 45 GLN HB3 H 10.544 4.659 5.477 1.00 . A A . 42 GLN HB3 1 1 17 12407 1 1 45 GLN HE21 H 11.208 4.095 7.166 1.00 . A A . 42 GLN HE21 1 1 17 12408 1 1 45 GLN HE22 H 11.258 4.002 8.889 1.00 . A A . 42 GLN HE22 1 1 17 12409 1 1 45 GLN HG2 H 10.093 6.753 6.561 1.00 . A A . 42 GLN HG2 1 1 17 12410 1 1 45 GLN HG3 H 8.461 6.233 6.974 1.00 . A A . 42 GLN HG3 1 1 17 12411 1 1 45 GLN N N 8.816 4.358 3.402 1.00 . A A . 42 GLN N 1 1 17 12412 1 1 45 GLN NE2 N 10.911 4.381 8.056 1.00 . A A . 42 GLN NE2 1 1 17 12413 1 1 45 GLN O O 10.599 6.405 3.118 1.00 . A A . 42 GLN O 1 1 17 12414 1 1 45 GLN OE1 O 9.570 5.743 9.216 1.00 . A A . 42 GLN OE1 1 1 17 12415 1 1 46 THR C C 9.941 9.941 4.900 1.00 . A A . 43 THR C 1 1 17 12416 1 1 46 THR CA C 9.841 8.980 3.723 1.00 . A A . 43 THR CA 1 1 17 12417 1 1 46 THR CB C 9.133 9.688 2.549 1.00 . A A . 43 THR CB 1 1 17 12418 1 1 46 THR CG2 C 9.288 8.903 1.257 1.00 . A A . 43 THR CG2 1 1 17 12419 1 1 46 THR H H 8.307 7.862 4.628 1.00 . A A . 43 THR H 1 1 17 12420 1 1 46 THR HA H 10.831 8.689 3.405 1.00 . A A . 43 THR HA 1 1 17 12421 1 1 46 THR HB H 9.584 10.662 2.415 1.00 . A A . 43 THR HB 1 1 17 12422 1 1 46 THR HG1 H 7.266 10.082 2.034 1.00 . A A . 43 THR HG1 1 1 17 12423 1 1 46 THR HG21 H 10.336 8.830 1.003 1.00 . A A . 43 THR HG21 1 1 17 12424 1 1 46 THR HG22 H 8.762 9.410 0.462 1.00 . A A . 43 THR HG22 1 1 17 12425 1 1 46 THR HG23 H 8.879 7.912 1.386 1.00 . A A . 43 THR HG23 1 1 17 12426 1 1 46 THR N N 9.146 7.779 4.127 1.00 . A A . 43 THR N 1 1 17 12427 1 1 46 THR O O 9.126 9.883 5.823 1.00 . A A . 43 THR O 1 1 17 12428 1 1 46 THR OG1 O 7.741 9.861 2.846 1.00 . A A . 43 THR OG1 1 1 17 12429 1 1 47 HIS C C 10.794 13.192 5.275 1.00 . A A . 44 HIS C 1 1 17 12430 1 1 47 HIS CA C 11.064 11.831 5.900 1.00 . A A . 44 HIS CA 1 1 17 12431 1 1 47 HIS CB C 12.454 11.793 6.540 1.00 . A A . 44 HIS CB 1 1 17 12432 1 1 47 HIS CD2 C 13.075 13.880 7.957 1.00 . A A . 44 HIS CD2 1 1 17 12433 1 1 47 HIS CE1 C 12.383 13.159 9.905 1.00 . A A . 44 HIS CE1 1 1 17 12434 1 1 47 HIS CG C 12.573 12.636 7.774 1.00 . A A . 44 HIS CG 1 1 17 12435 1 1 47 HIS H H 11.601 10.762 4.155 1.00 . A A . 44 HIS H 1 1 17 12436 1 1 47 HIS HA H 10.318 11.641 6.657 1.00 . A A . 44 HIS HA 1 1 17 12437 1 1 47 HIS HB2 H 12.689 10.775 6.813 1.00 . A A . 44 HIS HB2 1 1 17 12438 1 1 47 HIS HB3 H 13.181 12.146 5.825 1.00 . A A . 44 HIS HB3 1 1 17 12439 1 1 47 HIS HD1 H 11.718 11.348 9.214 1.00 . A A . 44 HIS HD1 1 1 17 12440 1 1 47 HIS HD2 H 13.500 14.517 7.195 1.00 . A A . 44 HIS HD2 1 1 17 12441 1 1 47 HIS HE1 H 12.155 13.104 10.960 1.00 . A A . 44 HIS HE1 1 1 17 12442 1 1 47 HIS HE2 H 13.272 14.996 9.728 1.00 . A A . 44 HIS HE2 1 1 17 12443 1 1 47 HIS N N 10.937 10.806 4.879 1.00 . A A . 44 HIS N 1 1 17 12444 1 1 47 HIS ND1 N 12.146 12.214 9.015 1.00 . A A . 44 HIS ND1 1 1 17 12445 1 1 47 HIS NE2 N 12.945 14.178 9.289 1.00 . A A . 44 HIS NE2 1 1 17 12446 1 1 47 HIS O O 11.675 13.777 4.647 1.00 . A A . 44 HIS O 1 1 17 12447 1 1 48 ASP C C 9.106 14.771 3.309 1.00 . A A . 45 ASP C 1 1 17 12448 1 1 48 ASP CA C 9.103 14.910 4.824 1.00 . A A . 45 ASP CA 1 1 17 12449 1 1 48 ASP CB C 9.955 16.113 5.253 1.00 . A A . 45 ASP CB 1 1 17 12450 1 1 48 ASP CG C 9.755 16.476 6.706 1.00 . A A . 45 ASP CG 1 1 17 12451 1 1 48 ASP H H 8.942 13.171 6.016 1.00 . A A . 45 ASP H 1 1 17 12452 1 1 48 ASP HA H 8.086 15.073 5.149 1.00 . A A . 45 ASP HA 1 1 17 12453 1 1 48 ASP HB2 H 10.997 15.878 5.101 1.00 . A A . 45 ASP HB2 1 1 17 12454 1 1 48 ASP HB3 H 9.691 16.967 4.646 1.00 . A A . 45 ASP HB3 1 1 17 12455 1 1 48 ASP N N 9.567 13.671 5.449 1.00 . A A . 45 ASP N 1 1 17 12456 1 1 48 ASP O O 8.208 14.080 2.781 1.00 . A A . 45 ASP O 1 1 17 12457 1 1 48 ASP OXT O 9.998 15.343 2.646 1.00 . A A . 45 ASP OXT 1 1 17 12458 1 1 48 ASP OD1 O 8.730 17.114 7.025 1.00 . A A . 45 ASP OD1 1 1 17 12459 1 1 48 ASP OD2 O 10.620 16.133 7.539 1.00 . A A . 45 ASP OD2 1 1 17 12460 2 2 1 ZN ZN ZN -4.387 -5.568 0.485 1.00 . B A . 101 ZN ZN 1 1 17 12461 3 2 1 ZN ZN ZN 6.288 1.290 -1.377 1.00 . C A . 102 ZN ZN 1 1 18 12462 1 1 1 GLY C C -21.330 2.696 -7.154 1.00 . A A . -2 GLY C 1 1 18 12463 1 1 1 GLY CA C -22.275 1.522 -7.019 1.00 . A A . -2 GLY CA 1 1 18 12464 1 1 1 GLY H1 H -23.623 2.097 -8.497 1.00 . A A . -2 GLY H1 1 1 18 12465 1 1 1 GLY H2 H -23.636 0.439 -8.167 1.00 . A A . -2 GLY H2 1 1 18 12466 1 1 1 GLY H3 H -22.367 1.114 -9.057 1.00 . A A . -2 GLY H3 1 1 18 12467 1 1 1 GLY HA2 H -22.975 1.725 -6.223 1.00 . A A . -2 GLY HA2 1 1 18 12468 1 1 1 GLY HA3 H -21.706 0.638 -6.770 1.00 . A A . -2 GLY HA3 1 1 18 12469 1 1 1 GLY N N -23.028 1.274 -8.270 1.00 . A A . -2 GLY N 1 1 18 12470 1 1 1 GLY O O -20.664 2.837 -8.178 1.00 . A A . -2 GLY O 1 1 18 12471 1 1 2 PRO C C -18.901 4.326 -5.991 1.00 . A A . -1 PRO C 1 1 18 12472 1 1 2 PRO CA C -20.363 4.727 -6.166 1.00 . A A . -1 PRO CA 1 1 18 12473 1 1 2 PRO CB C -20.839 5.565 -4.978 1.00 . A A . -1 PRO CB 1 1 18 12474 1 1 2 PRO CD C -22.029 3.492 -4.883 1.00 . A A . -1 PRO CD 1 1 18 12475 1 1 2 PRO CG C -21.424 4.576 -4.032 1.00 . A A . -1 PRO CG 1 1 18 12476 1 1 2 PRO HA H -20.473 5.292 -7.079 1.00 . A A . -1 PRO HA 1 1 18 12477 1 1 2 PRO HB2 H -19.998 6.085 -4.541 1.00 . A A . -1 PRO HB2 1 1 18 12478 1 1 2 PRO HB3 H -21.577 6.279 -5.310 1.00 . A A . -1 PRO HB3 1 1 18 12479 1 1 2 PRO HD2 H -21.905 2.529 -4.411 1.00 . A A . -1 PRO HD2 1 1 18 12480 1 1 2 PRO HD3 H -23.074 3.694 -5.064 1.00 . A A . -1 PRO HD3 1 1 18 12481 1 1 2 PRO HG2 H -20.648 4.167 -3.401 1.00 . A A . -1 PRO HG2 1 1 18 12482 1 1 2 PRO HG3 H -22.187 5.050 -3.431 1.00 . A A . -1 PRO HG3 1 1 18 12483 1 1 2 PRO N N -21.254 3.567 -6.138 1.00 . A A . -1 PRO N 1 1 18 12484 1 1 2 PRO O O -18.601 3.190 -5.620 1.00 . A A . -1 PRO O 1 1 18 12485 1 1 3 HIS C C -15.953 5.880 -5.058 1.00 . A A . 0 HIS C 1 1 18 12486 1 1 3 HIS CA C -16.569 4.979 -6.125 1.00 . A A . 0 HIS CA 1 1 18 12487 1 1 3 HIS CB C -15.846 5.146 -7.477 1.00 . A A . 0 HIS CB 1 1 18 12488 1 1 3 HIS CD2 C -16.979 7.079 -8.791 1.00 . A A . 0 HIS CD2 1 1 18 12489 1 1 3 HIS CE1 C -15.352 8.539 -8.688 1.00 . A A . 0 HIS CE1 1 1 18 12490 1 1 3 HIS CG C -15.968 6.510 -8.096 1.00 . A A . 0 HIS CG 1 1 18 12491 1 1 3 HIS H H -18.291 6.150 -6.522 1.00 . A A . 0 HIS H 1 1 18 12492 1 1 3 HIS HA H -16.466 3.953 -5.802 1.00 . A A . 0 HIS HA 1 1 18 12493 1 1 3 HIS HB2 H -14.794 4.946 -7.335 1.00 . A A . 0 HIS HB2 1 1 18 12494 1 1 3 HIS HB3 H -16.248 4.427 -8.177 1.00 . A A . 0 HIS HB3 1 1 18 12495 1 1 3 HIS HD1 H -14.087 7.339 -7.614 1.00 . A A . 0 HIS HD1 1 1 18 12496 1 1 3 HIS HD2 H -17.931 6.625 -9.023 1.00 . A A . 0 HIS HD2 1 1 18 12497 1 1 3 HIS HE1 H -14.768 9.439 -8.817 1.00 . A A . 0 HIS HE1 1 1 18 12498 1 1 3 HIS HE2 H -17.164 9.050 -9.484 1.00 . A A . 0 HIS HE2 1 1 18 12499 1 1 3 HIS N N -17.995 5.253 -6.252 1.00 . A A . 0 HIS N 1 1 18 12500 1 1 3 HIS ND1 N -14.963 7.452 -8.050 1.00 . A A . 0 HIS ND1 1 1 18 12501 1 1 3 HIS NE2 N -16.572 8.340 -9.148 1.00 . A A . 0 HIS NE2 1 1 18 12502 1 1 3 HIS O O -14.897 6.481 -5.261 1.00 . A A . 0 HIS O 1 1 18 12503 1 1 4 MET C C -14.928 6.229 -2.179 1.00 . A A . 1 MET C 1 1 18 12504 1 1 4 MET CA C -16.180 6.809 -2.818 1.00 . A A . 1 MET CA 1 1 18 12505 1 1 4 MET CB C -17.283 6.951 -1.765 1.00 . A A . 1 MET CB 1 1 18 12506 1 1 4 MET CE C -20.041 6.046 -0.453 1.00 . A A . 1 MET CE 1 1 18 12507 1 1 4 MET CG C -18.586 7.504 -2.316 1.00 . A A . 1 MET CG 1 1 18 12508 1 1 4 MET H H -17.429 5.406 -3.795 1.00 . A A . 1 MET H 1 1 18 12509 1 1 4 MET HA H -15.951 7.783 -3.224 1.00 . A A . 1 MET HA 1 1 18 12510 1 1 4 MET HB2 H -17.481 5.980 -1.338 1.00 . A A . 1 MET HB2 1 1 18 12511 1 1 4 MET HB3 H -16.938 7.613 -0.985 1.00 . A A . 1 MET HB3 1 1 18 12512 1 1 4 MET HE1 H -20.329 5.406 -1.274 1.00 . A A . 1 MET HE1 1 1 18 12513 1 1 4 MET HE2 H -20.806 6.019 0.309 1.00 . A A . 1 MET HE2 1 1 18 12514 1 1 4 MET HE3 H -19.107 5.699 -0.037 1.00 . A A . 1 MET HE3 1 1 18 12515 1 1 4 MET HG2 H -18.389 8.458 -2.780 1.00 . A A . 1 MET HG2 1 1 18 12516 1 1 4 MET HG3 H -18.963 6.818 -3.059 1.00 . A A . 1 MET HG3 1 1 18 12517 1 1 4 MET N N -16.624 5.956 -3.915 1.00 . A A . 1 MET N 1 1 18 12518 1 1 4 MET O O -14.005 6.958 -1.804 1.00 . A A . 1 MET O 1 1 18 12519 1 1 4 MET SD S -19.848 7.727 -1.045 1.00 . A A . 1 MET SD 1 1 18 12520 1 1 5 ALA C C -12.901 3.667 -2.628 1.00 . A A . 2 ALA C 1 1 18 12521 1 1 5 ALA CA C -13.767 4.213 -1.509 1.00 . A A . 2 ALA CA 1 1 18 12522 1 1 5 ALA CB C -14.223 3.085 -0.599 1.00 . A A . 2 ALA CB 1 1 18 12523 1 1 5 ALA H H -15.676 4.395 -2.369 1.00 . A A . 2 ALA H 1 1 18 12524 1 1 5 ALA HA H -13.191 4.914 -0.924 1.00 . A A . 2 ALA HA 1 1 18 12525 1 1 5 ALA HB1 H -14.862 3.482 0.173 1.00 . A A . 2 ALA HB1 1 1 18 12526 1 1 5 ALA HB2 H -13.359 2.618 -0.148 1.00 . A A . 2 ALA HB2 1 1 18 12527 1 1 5 ALA HB3 H -14.766 2.352 -1.177 1.00 . A A . 2 ALA HB3 1 1 18 12528 1 1 5 ALA N N -14.907 4.913 -2.062 1.00 . A A . 2 ALA N 1 1 18 12529 1 1 5 ALA O O -13.305 3.655 -3.793 1.00 . A A . 2 ALA O 1 1 18 12530 1 1 6 VAL C C -10.305 1.297 -2.776 1.00 . A A . 3 VAL C 1 1 18 12531 1 1 6 VAL CA C -10.788 2.663 -3.241 1.00 . A A . 3 VAL CA 1 1 18 12532 1 1 6 VAL CB C -9.575 3.593 -3.465 1.00 . A A . 3 VAL CB 1 1 18 12533 1 1 6 VAL CG1 C -8.583 2.969 -4.433 1.00 . A A . 3 VAL CG1 1 1 18 12534 1 1 6 VAL CG2 C -10.031 4.952 -3.977 1.00 . A A . 3 VAL CG2 1 1 18 12535 1 1 6 VAL H H -11.457 3.252 -1.331 1.00 . A A . 3 VAL H 1 1 18 12536 1 1 6 VAL HA H -11.310 2.552 -4.179 1.00 . A A . 3 VAL HA 1 1 18 12537 1 1 6 VAL HB H -9.077 3.739 -2.519 1.00 . A A . 3 VAL HB 1 1 18 12538 1 1 6 VAL HG11 H -7.740 3.630 -4.558 1.00 . A A . 3 VAL HG11 1 1 18 12539 1 1 6 VAL HG12 H -9.062 2.810 -5.387 1.00 . A A . 3 VAL HG12 1 1 18 12540 1 1 6 VAL HG13 H -8.243 2.024 -4.037 1.00 . A A . 3 VAL HG13 1 1 18 12541 1 1 6 VAL HG21 H -10.694 5.405 -3.255 1.00 . A A . 3 VAL HG21 1 1 18 12542 1 1 6 VAL HG22 H -10.552 4.827 -4.915 1.00 . A A . 3 VAL HG22 1 1 18 12543 1 1 6 VAL HG23 H -9.171 5.587 -4.126 1.00 . A A . 3 VAL HG23 1 1 18 12544 1 1 6 VAL N N -11.715 3.219 -2.274 1.00 . A A . 3 VAL N 1 1 18 12545 1 1 6 VAL O O -10.013 1.103 -1.594 1.00 . A A . 3 VAL O 1 1 18 12546 1 1 7 LEU C C -8.242 -0.986 -3.321 1.00 . A A . 4 LEU C 1 1 18 12547 1 1 7 LEU CA C -9.758 -0.982 -3.410 1.00 . A A . 4 LEU CA 1 1 18 12548 1 1 7 LEU CB C -10.218 -1.982 -4.474 1.00 . A A . 4 LEU CB 1 1 18 12549 1 1 7 LEU CD1 C -12.040 -3.325 -5.545 1.00 . A A . 4 LEU CD1 1 1 18 12550 1 1 7 LEU CD2 C -11.908 -3.177 -3.051 1.00 . A A . 4 LEU CD2 1 1 18 12551 1 1 7 LEU CG C -11.675 -2.438 -4.364 1.00 . A A . 4 LEU CG 1 1 18 12552 1 1 7 LEU H H -10.544 0.561 -4.617 1.00 . A A . 4 LEU H 1 1 18 12553 1 1 7 LEU HA H -10.161 -1.279 -2.455 1.00 . A A . 4 LEU HA 1 1 18 12554 1 1 7 LEU HB2 H -10.078 -1.529 -5.444 1.00 . A A . 4 LEU HB2 1 1 18 12555 1 1 7 LEU HB3 H -9.586 -2.856 -4.411 1.00 . A A . 4 LEU HB3 1 1 18 12556 1 1 7 LEU HD11 H -11.942 -2.762 -6.461 1.00 . A A . 4 LEU HD11 1 1 18 12557 1 1 7 LEU HD12 H -13.058 -3.666 -5.438 1.00 . A A . 4 LEU HD12 1 1 18 12558 1 1 7 LEU HD13 H -11.377 -4.177 -5.573 1.00 . A A . 4 LEU HD13 1 1 18 12559 1 1 7 LEU HD21 H -12.918 -3.558 -3.027 1.00 . A A . 4 LEU HD21 1 1 18 12560 1 1 7 LEU HD22 H -11.763 -2.498 -2.224 1.00 . A A . 4 LEU HD22 1 1 18 12561 1 1 7 LEU HD23 H -11.211 -4.001 -2.967 1.00 . A A . 4 LEU HD23 1 1 18 12562 1 1 7 LEU HG H -12.320 -1.573 -4.383 1.00 . A A . 4 LEU HG 1 1 18 12563 1 1 7 LEU N N -10.252 0.351 -3.704 1.00 . A A . 4 LEU N 1 1 18 12564 1 1 7 LEU O O -7.560 -0.204 -3.984 1.00 . A A . 4 LEU O 1 1 18 12565 1 1 8 CYS C C -5.556 -2.251 -3.564 1.00 . A A . 5 CYS C 1 1 18 12566 1 1 8 CYS CA C -6.317 -2.046 -2.254 1.00 . A A . 5 CYS CA 1 1 18 12567 1 1 8 CYS CB C -6.130 -3.255 -1.346 1.00 . A A . 5 CYS CB 1 1 18 12568 1 1 8 CYS H H -8.368 -2.430 -1.968 1.00 . A A . 5 CYS H 1 1 18 12569 1 1 8 CYS HA H -5.938 -1.168 -1.753 1.00 . A A . 5 CYS HA 1 1 18 12570 1 1 8 CYS HB2 H -6.705 -3.107 -0.450 1.00 . A A . 5 CYS HB2 1 1 18 12571 1 1 8 CYS HB3 H -6.505 -4.133 -1.855 1.00 . A A . 5 CYS HB3 1 1 18 12572 1 1 8 CYS N N -7.741 -1.871 -2.477 1.00 . A A . 5 CYS N 1 1 18 12573 1 1 8 CYS O O -5.898 -3.122 -4.360 1.00 . A A . 5 CYS O 1 1 18 12574 1 1 8 CYS SG S -4.431 -3.600 -0.850 1.00 . A A . 5 CYS SG 1 1 18 12575 1 1 9 GLY C C -2.951 -2.842 -5.094 1.00 . A A . 6 GLY C 1 1 18 12576 1 1 9 GLY CA C -3.714 -1.536 -4.973 1.00 . A A . 6 GLY CA 1 1 18 12577 1 1 9 GLY H H -4.304 -0.768 -3.086 1.00 . A A . 6 GLY H 1 1 18 12578 1 1 9 GLY HA2 H -4.359 -1.430 -5.827 1.00 . A A . 6 GLY HA2 1 1 18 12579 1 1 9 GLY HA3 H -3.005 -0.722 -4.973 1.00 . A A . 6 GLY HA3 1 1 18 12580 1 1 9 GLY N N -4.517 -1.450 -3.764 1.00 . A A . 6 GLY N 1 1 18 12581 1 1 9 GLY O O -2.556 -3.236 -6.189 1.00 . A A . 6 GLY O 1 1 18 12582 1 1 10 VAL C C -2.897 -5.979 -4.192 1.00 . A A . 7 VAL C 1 1 18 12583 1 1 10 VAL CA C -1.989 -4.768 -3.967 1.00 . A A . 7 VAL CA 1 1 18 12584 1 1 10 VAL CB C -1.200 -4.953 -2.652 1.00 . A A . 7 VAL CB 1 1 18 12585 1 1 10 VAL CG1 C -0.548 -6.328 -2.595 1.00 . A A . 7 VAL CG1 1 1 18 12586 1 1 10 VAL CG2 C -0.153 -3.862 -2.504 1.00 . A A . 7 VAL CG2 1 1 18 12587 1 1 10 VAL H H -3.088 -3.163 -3.129 1.00 . A A . 7 VAL H 1 1 18 12588 1 1 10 VAL HA H -1.276 -4.721 -4.778 1.00 . A A . 7 VAL HA 1 1 18 12589 1 1 10 VAL HB H -1.892 -4.873 -1.826 1.00 . A A . 7 VAL HB 1 1 18 12590 1 1 10 VAL HG11 H -1.313 -7.087 -2.667 1.00 . A A . 7 VAL HG11 1 1 18 12591 1 1 10 VAL HG12 H -0.017 -6.439 -1.661 1.00 . A A . 7 VAL HG12 1 1 18 12592 1 1 10 VAL HG13 H 0.144 -6.434 -3.418 1.00 . A A . 7 VAL HG13 1 1 18 12593 1 1 10 VAL HG21 H 0.531 -3.903 -3.337 1.00 . A A . 7 VAL HG21 1 1 18 12594 1 1 10 VAL HG22 H 0.393 -4.009 -1.583 1.00 . A A . 7 VAL HG22 1 1 18 12595 1 1 10 VAL HG23 H -0.639 -2.898 -2.483 1.00 . A A . 7 VAL HG23 1 1 18 12596 1 1 10 VAL N N -2.738 -3.517 -3.970 1.00 . A A . 7 VAL N 1 1 18 12597 1 1 10 VAL O O -2.769 -6.681 -5.192 1.00 . A A . 7 VAL O 1 1 18 12598 1 1 11 CYS C C -5.981 -7.128 -3.995 1.00 . A A . 8 CYS C 1 1 18 12599 1 1 11 CYS CA C -4.639 -7.426 -3.329 1.00 . A A . 8 CYS CA 1 1 18 12600 1 1 11 CYS CB C -4.845 -8.015 -1.933 1.00 . A A . 8 CYS CB 1 1 18 12601 1 1 11 CYS H H -3.924 -5.600 -2.525 1.00 . A A . 8 CYS H 1 1 18 12602 1 1 11 CYS HA H -4.114 -8.149 -3.934 1.00 . A A . 8 CYS HA 1 1 18 12603 1 1 11 CYS HB2 H -5.348 -8.965 -2.023 1.00 . A A . 8 CYS HB2 1 1 18 12604 1 1 11 CYS HB3 H -3.881 -8.168 -1.470 1.00 . A A . 8 CYS HB3 1 1 18 12605 1 1 11 CYS N N -3.808 -6.227 -3.260 1.00 . A A . 8 CYS N 1 1 18 12606 1 1 11 CYS O O -6.535 -7.955 -4.715 1.00 . A A . 8 CYS O 1 1 18 12607 1 1 11 CYS SG S -5.828 -6.978 -0.825 1.00 . A A . 8 CYS SG 1 1 18 12608 1 1 12 GLY C C -8.955 -6.134 -3.950 1.00 . A A . 9 GLY C 1 1 18 12609 1 1 12 GLY CA C -7.686 -5.447 -4.403 1.00 . A A . 9 GLY CA 1 1 18 12610 1 1 12 GLY H H -6.007 -5.337 -3.129 1.00 . A A . 9 GLY H 1 1 18 12611 1 1 12 GLY HA2 H -7.785 -4.390 -4.213 1.00 . A A . 9 GLY HA2 1 1 18 12612 1 1 12 GLY HA3 H -7.577 -5.596 -5.466 1.00 . A A . 9 GLY HA3 1 1 18 12613 1 1 12 GLY N N -6.479 -5.923 -3.748 1.00 . A A . 9 GLY N 1 1 18 12614 1 1 12 GLY O O -9.945 -6.136 -4.676 1.00 . A A . 9 GLY O 1 1 18 12615 1 1 13 ILE C C -10.909 -6.677 -1.229 1.00 . A A . 10 ILE C 1 1 18 12616 1 1 13 ILE CA C -10.120 -7.439 -2.287 1.00 . A A . 10 ILE CA 1 1 18 12617 1 1 13 ILE CB C -9.740 -8.845 -1.769 1.00 . A A . 10 ILE CB 1 1 18 12618 1 1 13 ILE CD1 C -8.734 -8.205 0.489 1.00 . A A . 10 ILE CD1 1 1 18 12619 1 1 13 ILE CG1 C -8.494 -8.799 -0.880 1.00 . A A . 10 ILE CG1 1 1 18 12620 1 1 13 ILE CG2 C -9.516 -9.790 -2.938 1.00 . A A . 10 ILE CG2 1 1 18 12621 1 1 13 ILE H H -8.167 -6.614 -2.169 1.00 . A A . 10 ILE H 1 1 18 12622 1 1 13 ILE HA H -10.764 -7.575 -3.144 1.00 . A A . 10 ILE HA 1 1 18 12623 1 1 13 ILE HB H -10.570 -9.224 -1.191 1.00 . A A . 10 ILE HB 1 1 18 12624 1 1 13 ILE HD11 H -7.808 -8.197 1.046 1.00 . A A . 10 ILE HD11 1 1 18 12625 1 1 13 ILE HD12 H -9.467 -8.796 1.015 1.00 . A A . 10 ILE HD12 1 1 18 12626 1 1 13 ILE HD13 H -9.098 -7.190 0.380 1.00 . A A . 10 ILE HD13 1 1 18 12627 1 1 13 ILE HG12 H -8.121 -9.799 -0.748 1.00 . A A . 10 ILE HG12 1 1 18 12628 1 1 13 ILE HG13 H -7.737 -8.202 -1.371 1.00 . A A . 10 ILE HG13 1 1 18 12629 1 1 13 ILE HG21 H -9.216 -10.757 -2.566 1.00 . A A . 10 ILE HG21 1 1 18 12630 1 1 13 ILE HG22 H -8.742 -9.393 -3.579 1.00 . A A . 10 ILE HG22 1 1 18 12631 1 1 13 ILE HG23 H -10.433 -9.890 -3.500 1.00 . A A . 10 ILE HG23 1 1 18 12632 1 1 13 ILE N N -8.955 -6.695 -2.750 1.00 . A A . 10 ILE N 1 1 18 12633 1 1 13 ILE O O -12.036 -7.048 -0.905 1.00 . A A . 10 ILE O 1 1 18 12634 1 1 14 LYS C C -10.517 -3.351 0.209 1.00 . A A . 11 LYS C 1 1 18 12635 1 1 14 LYS CA C -11.014 -4.786 0.284 1.00 . A A . 11 LYS CA 1 1 18 12636 1 1 14 LYS CB C -10.852 -5.352 1.705 1.00 . A A . 11 LYS CB 1 1 18 12637 1 1 14 LYS CD C -9.302 -6.209 3.451 1.00 . A A . 11 LYS CD 1 1 18 12638 1 1 14 LYS CE C -7.966 -6.079 4.157 1.00 . A A . 11 LYS CE 1 1 18 12639 1 1 14 LYS CG C -9.460 -5.232 2.299 1.00 . A A . 11 LYS CG 1 1 18 12640 1 1 14 LYS H H -9.424 -5.365 -0.981 1.00 . A A . 11 LYS H 1 1 18 12641 1 1 14 LYS HA H -12.061 -4.794 0.027 1.00 . A A . 11 LYS HA 1 1 18 12642 1 1 14 LYS HB2 H -11.534 -4.837 2.361 1.00 . A A . 11 LYS HB2 1 1 18 12643 1 1 14 LYS HB3 H -11.113 -6.399 1.689 1.00 . A A . 11 LYS HB3 1 1 18 12644 1 1 14 LYS HD2 H -10.087 -6.030 4.165 1.00 . A A . 11 LYS HD2 1 1 18 12645 1 1 14 LYS HD3 H -9.391 -7.210 3.059 1.00 . A A . 11 LYS HD3 1 1 18 12646 1 1 14 LYS HE2 H -7.753 -7.008 4.660 1.00 . A A . 11 LYS HE2 1 1 18 12647 1 1 14 LYS HE3 H -7.208 -5.893 3.413 1.00 . A A . 11 LYS HE3 1 1 18 12648 1 1 14 LYS HG2 H -8.727 -5.457 1.538 1.00 . A A . 11 LYS HG2 1 1 18 12649 1 1 14 LYS HG3 H -9.316 -4.227 2.663 1.00 . A A . 11 LYS HG3 1 1 18 12650 1 1 14 LYS HZ1 H -7.006 -4.902 5.592 1.00 . A A . 11 LYS HZ1 1 1 18 12651 1 1 14 LYS HZ2 H -8.647 -5.158 5.905 1.00 . A A . 11 LYS HZ2 1 1 18 12652 1 1 14 LYS HZ3 H -8.180 -4.072 4.701 1.00 . A A . 11 LYS HZ3 1 1 18 12653 1 1 14 LYS N N -10.325 -5.611 -0.696 1.00 . A A . 11 LYS N 1 1 18 12654 1 1 14 LYS NZ N -7.949 -4.975 5.155 1.00 . A A . 11 LYS NZ 1 1 18 12655 1 1 14 LYS O O -9.531 -3.069 -0.483 1.00 . A A . 11 LYS O 1 1 18 12656 1 1 15 GLU C C -9.454 -0.777 1.340 1.00 . A A . 12 GLU C 1 1 18 12657 1 1 15 GLU CA C -10.889 -1.037 0.911 1.00 . A A . 12 GLU CA 1 1 18 12658 1 1 15 GLU CB C -11.838 -0.301 1.848 1.00 . A A . 12 GLU CB 1 1 18 12659 1 1 15 GLU CD C -14.243 0.195 2.386 1.00 . A A . 12 GLU CD 1 1 18 12660 1 1 15 GLU CG C -13.252 -0.201 1.316 1.00 . A A . 12 GLU CG 1 1 18 12661 1 1 15 GLU H H -11.972 -2.772 1.443 1.00 . A A . 12 GLU H 1 1 18 12662 1 1 15 GLU HA H -11.028 -0.663 -0.092 1.00 . A A . 12 GLU HA 1 1 18 12663 1 1 15 GLU HB2 H -11.868 -0.821 2.795 1.00 . A A . 12 GLU HB2 1 1 18 12664 1 1 15 GLU HB3 H -11.465 0.699 2.008 1.00 . A A . 12 GLU HB3 1 1 18 12665 1 1 15 GLU HG2 H -13.271 0.542 0.531 1.00 . A A . 12 GLU HG2 1 1 18 12666 1 1 15 GLU HG3 H -13.540 -1.160 0.912 1.00 . A A . 12 GLU HG3 1 1 18 12667 1 1 15 GLU N N -11.209 -2.461 0.908 1.00 . A A . 12 GLU N 1 1 18 12668 1 1 15 GLU O O -8.819 -1.606 1.998 1.00 . A A . 12 GLU O 1 1 18 12669 1 1 15 GLU OE1 O -14.416 1.410 2.624 1.00 . A A . 12 GLU OE1 1 1 18 12670 1 1 15 GLU OE2 O -14.841 -0.709 3.009 1.00 . A A . 12 GLU OE2 1 1 18 12671 1 1 16 PHE C C -7.620 1.441 2.695 1.00 . A A . 13 PHE C 1 1 18 12672 1 1 16 PHE CA C -7.606 0.778 1.326 1.00 . A A . 13 PHE CA 1 1 18 12673 1 1 16 PHE CB C -7.011 1.733 0.286 1.00 . A A . 13 PHE CB 1 1 18 12674 1 1 16 PHE CD1 C -8.666 3.586 -0.106 1.00 . A A . 13 PHE CD1 1 1 18 12675 1 1 16 PHE CD2 C -6.667 4.084 1.096 1.00 . A A . 13 PHE CD2 1 1 18 12676 1 1 16 PHE CE1 C -9.074 4.900 0.025 1.00 . A A . 13 PHE CE1 1 1 18 12677 1 1 16 PHE CE2 C -7.069 5.398 1.230 1.00 . A A . 13 PHE CE2 1 1 18 12678 1 1 16 PHE CG C -7.461 3.164 0.428 1.00 . A A . 13 PHE CG 1 1 18 12679 1 1 16 PHE CZ C -8.274 5.808 0.692 1.00 . A A . 13 PHE CZ 1 1 18 12680 1 1 16 PHE H H -9.497 0.978 0.400 1.00 . A A . 13 PHE H 1 1 18 12681 1 1 16 PHE HA H -6.997 -0.111 1.375 1.00 . A A . 13 PHE HA 1 1 18 12682 1 1 16 PHE HB2 H -5.935 1.717 0.370 1.00 . A A . 13 PHE HB2 1 1 18 12683 1 1 16 PHE HB3 H -7.292 1.393 -0.701 1.00 . A A . 13 PHE HB3 1 1 18 12684 1 1 16 PHE HD1 H -9.292 2.877 -0.629 1.00 . A A . 13 PHE HD1 1 1 18 12685 1 1 16 PHE HD2 H -5.724 3.763 1.520 1.00 . A A . 13 PHE HD2 1 1 18 12686 1 1 16 PHE HE1 H -10.016 5.218 -0.397 1.00 . A A . 13 PHE HE1 1 1 18 12687 1 1 16 PHE HE2 H -6.439 6.105 1.751 1.00 . A A . 13 PHE HE2 1 1 18 12688 1 1 16 PHE HZ H -8.591 6.835 0.795 1.00 . A A . 13 PHE HZ 1 1 18 12689 1 1 16 PHE N N -8.948 0.379 0.954 1.00 . A A . 13 PHE N 1 1 18 12690 1 1 16 PHE O O -8.674 1.852 3.189 1.00 . A A . 13 PHE O 1 1 18 12691 1 1 17 LYS C C -4.954 2.871 4.687 1.00 . A A . 14 LYS C 1 1 18 12692 1 1 17 LYS CA C -6.305 2.168 4.597 1.00 . A A . 14 LYS CA 1 1 18 12693 1 1 17 LYS CB C -6.441 1.107 5.690 1.00 . A A . 14 LYS CB 1 1 18 12694 1 1 17 LYS CD C -6.560 0.546 8.130 1.00 . A A . 14 LYS CD 1 1 18 12695 1 1 17 LYS CE C -7.957 -0.045 8.037 1.00 . A A . 14 LYS CE 1 1 18 12696 1 1 17 LYS CG C -6.346 1.647 7.106 1.00 . A A . 14 LYS CG 1 1 18 12697 1 1 17 LYS H H -5.659 1.165 2.860 1.00 . A A . 14 LYS H 1 1 18 12698 1 1 17 LYS HA H -7.091 2.898 4.709 1.00 . A A . 14 LYS HA 1 1 18 12699 1 1 17 LYS HB2 H -7.398 0.623 5.579 1.00 . A A . 14 LYS HB2 1 1 18 12700 1 1 17 LYS HB3 H -5.663 0.372 5.555 1.00 . A A . 14 LYS HB3 1 1 18 12701 1 1 17 LYS HD2 H -5.841 -0.238 7.952 1.00 . A A . 14 LYS HD2 1 1 18 12702 1 1 17 LYS HD3 H -6.416 0.954 9.119 1.00 . A A . 14 LYS HD3 1 1 18 12703 1 1 17 LYS HE2 H -8.678 0.740 8.205 1.00 . A A . 14 LYS HE2 1 1 18 12704 1 1 17 LYS HE3 H -8.095 -0.454 7.048 1.00 . A A . 14 LYS HE3 1 1 18 12705 1 1 17 LYS HG2 H -5.362 2.070 7.250 1.00 . A A . 14 LYS HG2 1 1 18 12706 1 1 17 LYS HG3 H -7.095 2.412 7.245 1.00 . A A . 14 LYS HG3 1 1 18 12707 1 1 17 LYS HZ1 H -9.120 -1.530 8.924 1.00 . A A . 14 LYS HZ1 1 1 18 12708 1 1 17 LYS HZ2 H -8.084 -0.741 9.999 1.00 . A A . 14 LYS HZ2 1 1 18 12709 1 1 17 LYS HZ3 H -7.464 -1.874 8.909 1.00 . A A . 14 LYS HZ3 1 1 18 12710 1 1 17 LYS N N -6.452 1.540 3.298 1.00 . A A . 14 LYS N 1 1 18 12711 1 1 17 LYS NZ N -8.171 -1.121 9.037 1.00 . A A . 14 LYS NZ 1 1 18 12712 1 1 17 LYS O O -4.768 3.791 5.479 1.00 . A A . 14 LYS O 1 1 18 12713 1 1 18 TYR C C -2.364 3.543 2.452 1.00 . A A . 15 TYR C 1 1 18 12714 1 1 18 TYR CA C -2.682 2.999 3.835 1.00 . A A . 15 TYR CA 1 1 18 12715 1 1 18 TYR CB C -1.637 1.937 4.188 1.00 . A A . 15 TYR CB 1 1 18 12716 1 1 18 TYR CD1 C -2.863 0.514 5.864 1.00 . A A . 15 TYR CD1 1 1 18 12717 1 1 18 TYR CD2 C -0.836 1.557 6.546 1.00 . A A . 15 TYR CD2 1 1 18 12718 1 1 18 TYR CE1 C -2.999 -0.052 7.114 1.00 . A A . 15 TYR CE1 1 1 18 12719 1 1 18 TYR CE2 C -0.960 0.991 7.799 1.00 . A A . 15 TYR CE2 1 1 18 12720 1 1 18 TYR CG C -1.784 1.328 5.561 1.00 . A A . 15 TYR CG 1 1 18 12721 1 1 18 TYR CZ C -2.046 0.187 8.078 1.00 . A A . 15 TYR CZ 1 1 18 12722 1 1 18 TYR H H -4.234 1.706 3.235 1.00 . A A . 15 TYR H 1 1 18 12723 1 1 18 TYR HA H -2.640 3.798 4.557 1.00 . A A . 15 TYR HA 1 1 18 12724 1 1 18 TYR HB2 H -1.704 1.136 3.469 1.00 . A A . 15 TYR HB2 1 1 18 12725 1 1 18 TYR HB3 H -0.654 2.382 4.127 1.00 . A A . 15 TYR HB3 1 1 18 12726 1 1 18 TYR HD1 H -3.607 0.331 5.101 1.00 . A A . 15 TYR HD1 1 1 18 12727 1 1 18 TYR HD2 H 0.010 2.190 6.322 1.00 . A A . 15 TYR HD2 1 1 18 12728 1 1 18 TYR HE1 H -3.851 -0.680 7.331 1.00 . A A . 15 TYR HE1 1 1 18 12729 1 1 18 TYR HE2 H -0.209 1.177 8.554 1.00 . A A . 15 TYR HE2 1 1 18 12730 1 1 18 TYR HH H -2.034 0.292 9.999 1.00 . A A . 15 TYR HH 1 1 18 12731 1 1 18 TYR N N -4.020 2.433 3.857 1.00 . A A . 15 TYR N 1 1 18 12732 1 1 18 TYR O O -3.060 3.243 1.482 1.00 . A A . 15 TYR O 1 1 18 12733 1 1 18 TYR OH O -2.176 -0.383 9.322 1.00 . A A . 15 TYR OH 1 1 18 12734 1 1 19 LYS C C 0.704 4.991 1.199 1.00 . A A . 16 LYS C 1 1 18 12735 1 1 19 LYS CA C -0.802 4.805 1.095 1.00 . A A . 16 LYS CA 1 1 18 12736 1 1 19 LYS CB C -1.488 6.118 0.696 1.00 . A A . 16 LYS CB 1 1 18 12737 1 1 19 LYS CD C -2.052 7.722 -1.166 1.00 . A A . 16 LYS CD 1 1 18 12738 1 1 19 LYS CE C -1.923 8.966 -0.297 1.00 . A A . 16 LYS CE 1 1 18 12739 1 1 19 LYS CG C -1.129 6.601 -0.705 1.00 . A A . 16 LYS CG 1 1 18 12740 1 1 19 LYS H H -0.848 4.599 3.194 1.00 . A A . 16 LYS H 1 1 18 12741 1 1 19 LYS HA H -1.011 4.052 0.349 1.00 . A A . 16 LYS HA 1 1 18 12742 1 1 19 LYS HB2 H -2.558 5.977 0.742 1.00 . A A . 16 LYS HB2 1 1 18 12743 1 1 19 LYS HB3 H -1.205 6.885 1.402 1.00 . A A . 16 LYS HB3 1 1 18 12744 1 1 19 LYS HD2 H -1.802 7.982 -2.184 1.00 . A A . 16 LYS HD2 1 1 18 12745 1 1 19 LYS HD3 H -3.073 7.369 -1.125 1.00 . A A . 16 LYS HD3 1 1 18 12746 1 1 19 LYS HE2 H -2.689 9.670 -0.586 1.00 . A A . 16 LYS HE2 1 1 18 12747 1 1 19 LYS HE3 H -2.070 8.682 0.734 1.00 . A A . 16 LYS HE3 1 1 18 12748 1 1 19 LYS HG2 H -0.113 6.966 -0.704 1.00 . A A . 16 LYS HG2 1 1 18 12749 1 1 19 LYS HG3 H -1.215 5.772 -1.392 1.00 . A A . 16 LYS HG3 1 1 18 12750 1 1 19 LYS HZ1 H -0.442 9.912 -1.420 1.00 . A A . 16 LYS HZ1 1 1 18 12751 1 1 19 LYS HZ2 H 0.158 8.966 -0.157 1.00 . A A . 16 LYS HZ2 1 1 18 12752 1 1 19 LYS HZ3 H -0.548 10.462 0.173 1.00 . A A . 16 LYS HZ3 1 1 18 12753 1 1 19 LYS N N -1.306 4.326 2.369 1.00 . A A . 16 LYS N 1 1 18 12754 1 1 19 LYS NZ N -0.596 9.620 -0.436 1.00 . A A . 16 LYS NZ 1 1 18 12755 1 1 19 LYS O O 1.172 5.935 1.834 1.00 . A A . 16 LYS O 1 1 18 12756 1 1 20 CYS C C 3.422 5.468 0.155 1.00 . A A . 17 CYS C 1 1 18 12757 1 1 20 CYS CA C 2.912 4.120 0.655 1.00 . A A . 17 CYS CA 1 1 18 12758 1 1 20 CYS CB C 3.537 2.997 -0.182 1.00 . A A . 17 CYS CB 1 1 18 12759 1 1 20 CYS H H 1.016 3.324 0.141 1.00 . A A . 17 CYS H 1 1 18 12760 1 1 20 CYS HA H 3.212 3.996 1.684 1.00 . A A . 17 CYS HA 1 1 18 12761 1 1 20 CYS HB2 H 3.247 2.044 0.233 1.00 . A A . 17 CYS HB2 1 1 18 12762 1 1 20 CYS HB3 H 3.185 3.069 -1.199 1.00 . A A . 17 CYS HB3 1 1 18 12763 1 1 20 CYS N N 1.454 4.063 0.610 1.00 . A A . 17 CYS N 1 1 18 12764 1 1 20 CYS O O 3.091 5.887 -0.948 1.00 . A A . 17 CYS O 1 1 18 12765 1 1 20 CYS SG S 5.344 3.070 -0.208 1.00 . A A . 17 CYS SG 1 1 18 12766 1 1 21 PRO C C 5.665 7.436 -0.644 1.00 . A A . 18 PRO C 1 1 18 12767 1 1 21 PRO CA C 4.802 7.472 0.616 1.00 . A A . 18 PRO CA 1 1 18 12768 1 1 21 PRO CB C 5.657 7.849 1.833 1.00 . A A . 18 PRO CB 1 1 18 12769 1 1 21 PRO CD C 4.681 5.718 2.303 1.00 . A A . 18 PRO CD 1 1 18 12770 1 1 21 PRO CG C 5.883 6.575 2.570 1.00 . A A . 18 PRO CG 1 1 18 12771 1 1 21 PRO HA H 4.020 8.204 0.485 1.00 . A A . 18 PRO HA 1 1 18 12772 1 1 21 PRO HB2 H 6.590 8.278 1.500 1.00 . A A . 18 PRO HB2 1 1 18 12773 1 1 21 PRO HB3 H 5.126 8.565 2.442 1.00 . A A . 18 PRO HB3 1 1 18 12774 1 1 21 PRO HD2 H 4.958 4.674 2.299 1.00 . A A . 18 PRO HD2 1 1 18 12775 1 1 21 PRO HD3 H 3.912 5.904 3.039 1.00 . A A . 18 PRO HD3 1 1 18 12776 1 1 21 PRO HG2 H 6.776 6.091 2.202 1.00 . A A . 18 PRO HG2 1 1 18 12777 1 1 21 PRO HG3 H 5.973 6.773 3.628 1.00 . A A . 18 PRO HG3 1 1 18 12778 1 1 21 PRO N N 4.246 6.157 0.966 1.00 . A A . 18 PRO N 1 1 18 12779 1 1 21 PRO O O 5.942 8.475 -1.243 1.00 . A A . 18 PRO O 1 1 18 12780 1 1 22 ARG C C 6.086 5.574 -3.410 1.00 . A A . 19 ARG C 1 1 18 12781 1 1 22 ARG CA C 6.911 6.082 -2.235 1.00 . A A . 19 ARG CA 1 1 18 12782 1 1 22 ARG CB C 8.072 5.116 -1.987 1.00 . A A . 19 ARG CB 1 1 18 12783 1 1 22 ARG CD C 10.456 4.938 -1.235 1.00 . A A . 19 ARG CD 1 1 18 12784 1 1 22 ARG CG C 9.124 5.642 -1.026 1.00 . A A . 19 ARG CG 1 1 18 12785 1 1 22 ARG CZ C 12.112 4.660 -3.051 1.00 . A A . 19 ARG CZ 1 1 18 12786 1 1 22 ARG H H 5.852 5.452 -0.510 1.00 . A A . 19 ARG H 1 1 18 12787 1 1 22 ARG HA H 7.313 7.051 -2.489 1.00 . A A . 19 ARG HA 1 1 18 12788 1 1 22 ARG HB2 H 7.678 4.196 -1.581 1.00 . A A . 19 ARG HB2 1 1 18 12789 1 1 22 ARG HB3 H 8.552 4.902 -2.929 1.00 . A A . 19 ARG HB3 1 1 18 12790 1 1 22 ARG HD2 H 11.197 5.399 -0.599 1.00 . A A . 19 ARG HD2 1 1 18 12791 1 1 22 ARG HD3 H 10.345 3.898 -0.967 1.00 . A A . 19 ARG HD3 1 1 18 12792 1 1 22 ARG HE H 10.258 5.363 -3.285 1.00 . A A . 19 ARG HE 1 1 18 12793 1 1 22 ARG HG2 H 9.253 6.701 -1.190 1.00 . A A . 19 ARG HG2 1 1 18 12794 1 1 22 ARG HG3 H 8.789 5.466 -0.012 1.00 . A A . 19 ARG HG3 1 1 18 12795 1 1 22 ARG HH11 H 12.812 4.155 -1.219 1.00 . A A . 19 ARG HH11 1 1 18 12796 1 1 22 ARG HH12 H 13.931 3.947 -2.524 1.00 . A A . 19 ARG HH12 1 1 18 12797 1 1 22 ARG HH21 H 11.721 5.075 -4.996 1.00 . A A . 19 ARG HH21 1 1 18 12798 1 1 22 ARG HH22 H 13.313 4.468 -4.671 1.00 . A A . 19 ARG HH22 1 1 18 12799 1 1 22 ARG N N 6.094 6.241 -1.037 1.00 . A A . 19 ARG N 1 1 18 12800 1 1 22 ARG NE N 10.905 5.024 -2.625 1.00 . A A . 19 ARG NE 1 1 18 12801 1 1 22 ARG NH1 N 13.023 4.218 -2.195 1.00 . A A . 19 ARG NH1 1 1 18 12802 1 1 22 ARG NH2 N 12.406 4.739 -4.341 1.00 . A A . 19 ARG NH2 1 1 18 12803 1 1 22 ARG O O 6.170 6.102 -4.515 1.00 . A A . 19 ARG O 1 1 18 12804 1 1 23 CYS C C 3.201 4.480 -4.492 1.00 . A A . 20 CYS C 1 1 18 12805 1 1 23 CYS CA C 4.577 3.870 -4.249 1.00 . A A . 20 CYS CA 1 1 18 12806 1 1 23 CYS CB C 4.441 2.377 -3.936 1.00 . A A . 20 CYS CB 1 1 18 12807 1 1 23 CYS H H 5.157 4.244 -2.246 1.00 . A A . 20 CYS H 1 1 18 12808 1 1 23 CYS HA H 5.164 3.989 -5.144 1.00 . A A . 20 CYS HA 1 1 18 12809 1 1 23 CYS HB2 H 3.812 2.257 -3.068 1.00 . A A . 20 CYS HB2 1 1 18 12810 1 1 23 CYS HB3 H 3.981 1.880 -4.777 1.00 . A A . 20 CYS HB3 1 1 18 12811 1 1 23 CYS N N 5.283 4.546 -3.167 1.00 . A A . 20 CYS N 1 1 18 12812 1 1 23 CYS O O 2.595 4.278 -5.543 1.00 . A A . 20 CYS O 1 1 18 12813 1 1 23 CYS SG S 6.009 1.544 -3.594 1.00 . A A . 20 CYS SG 1 1 18 12814 1 1 24 LEU C C 0.296 4.816 -3.666 1.00 . A A . 21 LEU C 1 1 18 12815 1 1 24 LEU CA C 1.402 5.854 -3.520 1.00 . A A . 21 LEU CA 1 1 18 12816 1 1 24 LEU CB C 1.300 6.904 -4.632 1.00 . A A . 21 LEU CB 1 1 18 12817 1 1 24 LEU CD1 C 1.920 9.206 -5.400 1.00 . A A . 21 LEU CD1 1 1 18 12818 1 1 24 LEU CD2 C 2.735 8.385 -3.182 1.00 . A A . 21 LEU CD2 1 1 18 12819 1 1 24 LEU CG C 2.378 7.993 -4.610 1.00 . A A . 21 LEU CG 1 1 18 12820 1 1 24 LEU H H 3.290 5.371 -2.709 1.00 . A A . 21 LEU H 1 1 18 12821 1 1 24 LEU HA H 1.271 6.349 -2.569 1.00 . A A . 21 LEU HA 1 1 18 12822 1 1 24 LEU HB2 H 1.355 6.394 -5.582 1.00 . A A . 21 LEU HB2 1 1 18 12823 1 1 24 LEU HB3 H 0.337 7.383 -4.556 1.00 . A A . 21 LEU HB3 1 1 18 12824 1 1 24 LEU HD11 H 2.693 9.959 -5.386 1.00 . A A . 21 LEU HD11 1 1 18 12825 1 1 24 LEU HD12 H 1.021 9.605 -4.953 1.00 . A A . 21 LEU HD12 1 1 18 12826 1 1 24 LEU HD13 H 1.718 8.916 -6.420 1.00 . A A . 21 LEU HD13 1 1 18 12827 1 1 24 LEU HD21 H 3.435 9.206 -3.198 1.00 . A A . 21 LEU HD21 1 1 18 12828 1 1 24 LEU HD22 H 3.186 7.536 -2.686 1.00 . A A . 21 LEU HD22 1 1 18 12829 1 1 24 LEU HD23 H 1.840 8.680 -2.653 1.00 . A A . 21 LEU HD23 1 1 18 12830 1 1 24 LEU HG H 3.271 7.611 -5.083 1.00 . A A . 21 LEU HG 1 1 18 12831 1 1 24 LEU N N 2.724 5.223 -3.496 1.00 . A A . 21 LEU N 1 1 18 12832 1 1 24 LEU O O -0.847 5.148 -3.988 1.00 . A A . 21 LEU O 1 1 18 12833 1 1 25 VAL C C -1.204 2.448 -2.275 1.00 . A A . 22 VAL C 1 1 18 12834 1 1 25 VAL CA C -0.308 2.479 -3.504 1.00 . A A . 22 VAL CA 1 1 18 12835 1 1 25 VAL CB C 0.389 1.108 -3.709 1.00 . A A . 22 VAL CB 1 1 18 12836 1 1 25 VAL CG1 C 1.312 0.764 -2.548 1.00 . A A . 22 VAL CG1 1 1 18 12837 1 1 25 VAL CG2 C -0.644 0.013 -3.913 1.00 . A A . 22 VAL CG2 1 1 18 12838 1 1 25 VAL H H 1.549 3.371 -3.120 1.00 . A A . 22 VAL H 1 1 18 12839 1 1 25 VAL HA H -0.925 2.673 -4.370 1.00 . A A . 22 VAL HA 1 1 18 12840 1 1 25 VAL HB H 0.991 1.169 -4.605 1.00 . A A . 22 VAL HB 1 1 18 12841 1 1 25 VAL HG11 H 0.731 0.682 -1.642 1.00 . A A . 22 VAL HG11 1 1 18 12842 1 1 25 VAL HG12 H 2.053 1.540 -2.432 1.00 . A A . 22 VAL HG12 1 1 18 12843 1 1 25 VAL HG13 H 1.806 -0.178 -2.745 1.00 . A A . 22 VAL HG13 1 1 18 12844 1 1 25 VAL HG21 H -0.145 -0.937 -4.035 1.00 . A A . 22 VAL HG21 1 1 18 12845 1 1 25 VAL HG22 H -1.226 0.229 -4.796 1.00 . A A . 22 VAL HG22 1 1 18 12846 1 1 25 VAL HG23 H -1.297 -0.031 -3.054 1.00 . A A . 22 VAL HG23 1 1 18 12847 1 1 25 VAL N N 0.640 3.563 -3.397 1.00 . A A . 22 VAL N 1 1 18 12848 1 1 25 VAL O O -0.734 2.377 -1.132 1.00 . A A . 22 VAL O 1 1 18 12849 1 1 26 GLN C C -3.667 1.062 -1.017 1.00 . A A . 23 GLN C 1 1 18 12850 1 1 26 GLN CA C -3.493 2.501 -1.484 1.00 . A A . 23 GLN CA 1 1 18 12851 1 1 26 GLN CB C -4.807 3.079 -2.013 1.00 . A A . 23 GLN CB 1 1 18 12852 1 1 26 GLN CD C -5.931 5.040 -3.151 1.00 . A A . 23 GLN CD 1 1 18 12853 1 1 26 GLN CG C -4.681 4.526 -2.466 1.00 . A A . 23 GLN CG 1 1 18 12854 1 1 26 GLN H H -2.774 2.681 -3.458 1.00 . A A . 23 GLN H 1 1 18 12855 1 1 26 GLN HA H -3.150 3.099 -0.650 1.00 . A A . 23 GLN HA 1 1 18 12856 1 1 26 GLN HB2 H -5.138 2.486 -2.852 1.00 . A A . 23 GLN HB2 1 1 18 12857 1 1 26 GLN HB3 H -5.551 3.032 -1.232 1.00 . A A . 23 GLN HB3 1 1 18 12858 1 1 26 GLN HE21 H -6.663 5.664 -1.416 1.00 . A A . 23 GLN HE21 1 1 18 12859 1 1 26 GLN HE22 H -7.662 5.944 -2.797 1.00 . A A . 23 GLN HE22 1 1 18 12860 1 1 26 GLN HG2 H -4.483 5.143 -1.603 1.00 . A A . 23 GLN HG2 1 1 18 12861 1 1 26 GLN HG3 H -3.853 4.601 -3.157 1.00 . A A . 23 GLN HG3 1 1 18 12862 1 1 26 GLN N N -2.488 2.557 -2.527 1.00 . A A . 23 GLN N 1 1 18 12863 1 1 26 GLN NE2 N -6.842 5.606 -2.378 1.00 . A A . 23 GLN NE2 1 1 18 12864 1 1 26 GLN O O -4.390 0.273 -1.623 1.00 . A A . 23 GLN O 1 1 18 12865 1 1 26 GLN OE1 O -6.075 4.934 -4.368 1.00 . A A . 23 GLN OE1 1 1 18 12866 1 1 27 THR C C -4.029 -0.786 1.656 1.00 . A A . 24 THR C 1 1 18 12867 1 1 27 THR CA C -2.966 -0.624 0.576 1.00 . A A . 24 THR CA 1 1 18 12868 1 1 27 THR CB C -1.575 -0.974 1.139 1.00 . A A . 24 THR CB 1 1 18 12869 1 1 27 THR CG2 C -0.637 -1.408 0.031 1.00 . A A . 24 THR CG2 1 1 18 12870 1 1 27 THR H H -2.454 1.420 0.514 1.00 . A A . 24 THR H 1 1 18 12871 1 1 27 THR HA H -3.184 -1.299 -0.238 1.00 . A A . 24 THR HA 1 1 18 12872 1 1 27 THR HB H -1.680 -1.788 1.842 1.00 . A A . 24 THR HB 1 1 18 12873 1 1 27 THR HG1 H -0.630 0.757 1.166 1.00 . A A . 24 THR HG1 1 1 18 12874 1 1 27 THR HG21 H -0.586 -0.638 -0.723 1.00 . A A . 24 THR HG21 1 1 18 12875 1 1 27 THR HG22 H -1.004 -2.323 -0.409 1.00 . A A . 24 THR HG22 1 1 18 12876 1 1 27 THR HG23 H 0.350 -1.575 0.440 1.00 . A A . 24 THR HG23 1 1 18 12877 1 1 27 THR N N -2.970 0.727 0.050 1.00 . A A . 24 THR N 1 1 18 12878 1 1 27 THR O O -4.352 0.158 2.369 1.00 . A A . 24 THR O 1 1 18 12879 1 1 27 THR OG1 O -1.016 0.157 1.813 1.00 . A A . 24 THR OG1 1 1 18 12880 1 1 28 CYS C C -5.131 -2.386 4.105 1.00 . A A . 25 CYS C 1 1 18 12881 1 1 28 CYS CA C -5.665 -2.269 2.689 1.00 . A A . 25 CYS CA 1 1 18 12882 1 1 28 CYS CB C -6.394 -3.565 2.317 1.00 . A A . 25 CYS CB 1 1 18 12883 1 1 28 CYS H H -4.249 -2.710 1.181 1.00 . A A . 25 CYS H 1 1 18 12884 1 1 28 CYS HA H -6.362 -1.448 2.646 1.00 . A A . 25 CYS HA 1 1 18 12885 1 1 28 CYS HB2 H -7.227 -3.703 2.986 1.00 . A A . 25 CYS HB2 1 1 18 12886 1 1 28 CYS HB3 H -6.769 -3.495 1.313 1.00 . A A . 25 CYS HB3 1 1 18 12887 1 1 28 CYS N N -4.581 -1.992 1.752 1.00 . A A . 25 CYS N 1 1 18 12888 1 1 28 CYS O O -5.830 -2.087 5.072 1.00 . A A . 25 CYS O 1 1 18 12889 1 1 28 CYS SG S -5.369 -5.047 2.420 1.00 . A A . 25 CYS SG 1 1 18 12890 1 1 29 SER C C -1.758 -3.074 5.355 1.00 . A A . 26 SER C 1 1 18 12891 1 1 29 SER CA C -3.270 -3.063 5.507 1.00 . A A . 26 SER CA 1 1 18 12892 1 1 29 SER CB C -3.758 -4.387 6.114 1.00 . A A . 26 SER CB 1 1 18 12893 1 1 29 SER H H -3.365 -3.010 3.401 1.00 . A A . 26 SER H 1 1 18 12894 1 1 29 SER HA H -3.552 -2.249 6.158 1.00 . A A . 26 SER HA 1 1 18 12895 1 1 29 SER HB2 H -3.527 -5.195 5.437 1.00 . A A . 26 SER HB2 1 1 18 12896 1 1 29 SER HB3 H -3.259 -4.555 7.057 1.00 . A A . 26 SER HB3 1 1 18 12897 1 1 29 SER HG H -5.478 -3.449 6.279 1.00 . A A . 26 SER HG 1 1 18 12898 1 1 29 SER N N -3.889 -2.836 4.216 1.00 . A A . 26 SER N 1 1 18 12899 1 1 29 SER O O -1.255 -3.106 4.226 1.00 . A A . 26 SER O 1 1 18 12900 1 1 29 SER OG O -5.162 -4.365 6.335 1.00 . A A . 26 SER OG 1 1 18 12901 1 1 30 LEU C C 0.946 -4.278 5.726 1.00 . A A . 27 LEU C 1 1 18 12902 1 1 30 LEU CA C 0.416 -3.033 6.441 1.00 . A A . 27 LEU CA 1 1 18 12903 1 1 30 LEU CB C 0.969 -2.938 7.871 1.00 . A A . 27 LEU CB 1 1 18 12904 1 1 30 LEU CD1 C 3.449 -2.876 7.393 1.00 . A A . 27 LEU CD1 1 1 18 12905 1 1 30 LEU CD2 C 2.149 -0.751 7.472 1.00 . A A . 27 LEU CD2 1 1 18 12906 1 1 30 LEU CG C 2.282 -2.156 8.042 1.00 . A A . 27 LEU CG 1 1 18 12907 1 1 30 LEU H H -1.503 -3.074 7.337 1.00 . A A . 27 LEU H 1 1 18 12908 1 1 30 LEU HA H 0.715 -2.159 5.884 1.00 . A A . 27 LEU HA 1 1 18 12909 1 1 30 LEU HB2 H 0.218 -2.471 8.490 1.00 . A A . 27 LEU HB2 1 1 18 12910 1 1 30 LEU HB3 H 1.130 -3.941 8.234 1.00 . A A . 27 LEU HB3 1 1 18 12911 1 1 30 LEU HD11 H 4.345 -2.287 7.512 1.00 . A A . 27 LEU HD11 1 1 18 12912 1 1 30 LEU HD12 H 3.246 -3.016 6.342 1.00 . A A . 27 LEU HD12 1 1 18 12913 1 1 30 LEU HD13 H 3.585 -3.838 7.865 1.00 . A A . 27 LEU HD13 1 1 18 12914 1 1 30 LEU HD21 H 1.306 -0.256 7.930 1.00 . A A . 27 LEU HD21 1 1 18 12915 1 1 30 LEU HD22 H 1.998 -0.806 6.404 1.00 . A A . 27 LEU HD22 1 1 18 12916 1 1 30 LEU HD23 H 3.049 -0.194 7.678 1.00 . A A . 27 LEU HD23 1 1 18 12917 1 1 30 LEU HG H 2.498 -2.065 9.096 1.00 . A A . 27 LEU HG 1 1 18 12918 1 1 30 LEU N N -1.041 -3.062 6.471 1.00 . A A . 27 LEU N 1 1 18 12919 1 1 30 LEU O O 1.983 -4.233 5.071 1.00 . A A . 27 LEU O 1 1 18 12920 1 1 31 GLU C C 0.750 -6.389 3.648 1.00 . A A . 28 GLU C 1 1 18 12921 1 1 31 GLU CA C 0.531 -6.620 5.145 1.00 . A A . 28 GLU CA 1 1 18 12922 1 1 31 GLU CB C -0.593 -7.636 5.363 1.00 . A A . 28 GLU CB 1 1 18 12923 1 1 31 GLU CD C -1.513 -9.931 4.882 1.00 . A A . 28 GLU CD 1 1 18 12924 1 1 31 GLU CG C -0.400 -8.944 4.614 1.00 . A A . 28 GLU CG 1 1 18 12925 1 1 31 GLU H H -0.588 -5.350 6.416 1.00 . A A . 28 GLU H 1 1 18 12926 1 1 31 GLU HA H 1.443 -7.008 5.574 1.00 . A A . 28 GLU HA 1 1 18 12927 1 1 31 GLU HB2 H -0.660 -7.860 6.417 1.00 . A A . 28 GLU HB2 1 1 18 12928 1 1 31 GLU HB3 H -1.524 -7.196 5.039 1.00 . A A . 28 GLU HB3 1 1 18 12929 1 1 31 GLU HG2 H -0.371 -8.736 3.555 1.00 . A A . 28 GLU HG2 1 1 18 12930 1 1 31 GLU HG3 H 0.536 -9.383 4.920 1.00 . A A . 28 GLU HG3 1 1 18 12931 1 1 31 GLU N N 0.202 -5.374 5.834 1.00 . A A . 28 GLU N 1 1 18 12932 1 1 31 GLU O O 1.675 -6.938 3.052 1.00 . A A . 28 GLU O 1 1 18 12933 1 1 31 GLU OE1 O -1.464 -10.625 5.923 1.00 . A A . 28 GLU OE1 1 1 18 12934 1 1 31 GLU OE2 O -2.448 -10.015 4.059 1.00 . A A . 28 GLU OE2 1 1 18 12935 1 1 32 CYS C C 1.056 -4.116 1.432 1.00 . A A . 29 CYS C 1 1 18 12936 1 1 32 CYS CA C 0.048 -5.239 1.642 1.00 . A A . 29 CYS CA 1 1 18 12937 1 1 32 CYS CB C -1.303 -4.863 1.056 1.00 . A A . 29 CYS CB 1 1 18 12938 1 1 32 CYS H H -0.809 -5.147 3.567 1.00 . A A . 29 CYS H 1 1 18 12939 1 1 32 CYS HA H 0.409 -6.122 1.141 1.00 . A A . 29 CYS HA 1 1 18 12940 1 1 32 CYS HB2 H -1.862 -4.308 1.794 1.00 . A A . 29 CYS HB2 1 1 18 12941 1 1 32 CYS HB3 H -1.155 -4.244 0.188 1.00 . A A . 29 CYS HB3 1 1 18 12942 1 1 32 CYS N N -0.087 -5.559 3.049 1.00 . A A . 29 CYS N 1 1 18 12943 1 1 32 CYS O O 1.655 -4.000 0.363 1.00 . A A . 29 CYS O 1 1 18 12944 1 1 32 CYS SG S -2.313 -6.276 0.564 1.00 . A A . 29 CYS SG 1 1 18 12945 1 1 33 SER C C 3.640 -2.856 2.348 1.00 . A A . 30 SER C 1 1 18 12946 1 1 33 SER CA C 2.246 -2.239 2.393 1.00 . A A . 30 SER CA 1 1 18 12947 1 1 33 SER CB C 2.117 -1.314 3.604 1.00 . A A . 30 SER CB 1 1 18 12948 1 1 33 SER H H 0.705 -3.394 3.265 1.00 . A A . 30 SER H 1 1 18 12949 1 1 33 SER HA H 2.083 -1.671 1.491 1.00 . A A . 30 SER HA 1 1 18 12950 1 1 33 SER HB2 H 2.445 -1.838 4.490 1.00 . A A . 30 SER HB2 1 1 18 12951 1 1 33 SER HB3 H 2.736 -0.441 3.454 1.00 . A A . 30 SER HB3 1 1 18 12952 1 1 33 SER HG H 0.398 -0.616 2.951 1.00 . A A . 30 SER HG 1 1 18 12953 1 1 33 SER N N 1.247 -3.292 2.452 1.00 . A A . 30 SER N 1 1 18 12954 1 1 33 SER O O 4.529 -2.360 1.664 1.00 . A A . 30 SER O 1 1 18 12955 1 1 33 SER OG O 0.775 -0.896 3.794 1.00 . A A . 30 SER OG 1 1 18 12956 1 1 34 LYS C C 5.167 -5.692 1.986 1.00 . A A . 31 LYS C 1 1 18 12957 1 1 34 LYS CA C 5.087 -4.658 3.102 1.00 . A A . 31 LYS CA 1 1 18 12958 1 1 34 LYS CB C 5.310 -5.298 4.482 1.00 . A A . 31 LYS CB 1 1 18 12959 1 1 34 LYS CD C 4.601 -7.731 4.381 1.00 . A A . 31 LYS CD 1 1 18 12960 1 1 34 LYS CE C 3.586 -8.755 4.863 1.00 . A A . 31 LYS CE 1 1 18 12961 1 1 34 LYS CG C 4.271 -6.336 4.895 1.00 . A A . 31 LYS CG 1 1 18 12962 1 1 34 LYS H H 3.063 -4.302 3.605 1.00 . A A . 31 LYS H 1 1 18 12963 1 1 34 LYS HA H 5.858 -3.924 2.938 1.00 . A A . 31 LYS HA 1 1 18 12964 1 1 34 LYS HB2 H 6.277 -5.774 4.489 1.00 . A A . 31 LYS HB2 1 1 18 12965 1 1 34 LYS HB3 H 5.304 -4.511 5.222 1.00 . A A . 31 LYS HB3 1 1 18 12966 1 1 34 LYS HD2 H 4.598 -7.715 3.303 1.00 . A A . 31 LYS HD2 1 1 18 12967 1 1 34 LYS HD3 H 5.581 -8.012 4.738 1.00 . A A . 31 LYS HD3 1 1 18 12968 1 1 34 LYS HE2 H 3.569 -8.745 5.942 1.00 . A A . 31 LYS HE2 1 1 18 12969 1 1 34 LYS HE3 H 2.612 -8.480 4.486 1.00 . A A . 31 LYS HE3 1 1 18 12970 1 1 34 LYS HG2 H 4.225 -6.366 5.970 1.00 . A A . 31 LYS HG2 1 1 18 12971 1 1 34 LYS HG3 H 3.308 -6.038 4.504 1.00 . A A . 31 LYS HG3 1 1 18 12972 1 1 34 LYS HZ1 H 4.840 -10.421 4.768 1.00 . A A . 31 LYS HZ1 1 1 18 12973 1 1 34 LYS HZ2 H 3.940 -10.163 3.361 1.00 . A A . 31 LYS HZ2 1 1 18 12974 1 1 34 LYS HZ3 H 3.193 -10.802 4.738 1.00 . A A . 31 LYS HZ3 1 1 18 12975 1 1 34 LYS N N 3.813 -3.958 3.069 1.00 . A A . 31 LYS N 1 1 18 12976 1 1 34 LYS NZ N 3.913 -10.130 4.401 1.00 . A A . 31 LYS NZ 1 1 18 12977 1 1 34 LYS O O 6.216 -6.295 1.755 1.00 . A A . 31 LYS O 1 1 18 12978 1 1 35 LYS C C 4.827 -6.415 -0.978 1.00 . A A . 32 LYS C 1 1 18 12979 1 1 35 LYS CA C 3.979 -6.852 0.208 1.00 . A A . 32 LYS CA 1 1 18 12980 1 1 35 LYS CB C 2.526 -7.039 -0.231 1.00 . A A . 32 LYS CB 1 1 18 12981 1 1 35 LYS CD C 2.599 -9.522 -0.555 1.00 . A A . 32 LYS CD 1 1 18 12982 1 1 35 LYS CE C 2.403 -10.672 -1.527 1.00 . A A . 32 LYS CE 1 1 18 12983 1 1 35 LYS CG C 2.316 -8.183 -1.207 1.00 . A A . 32 LYS CG 1 1 18 12984 1 1 35 LYS H H 3.269 -5.333 1.492 1.00 . A A . 32 LYS H 1 1 18 12985 1 1 35 LYS HA H 4.357 -7.790 0.584 1.00 . A A . 32 LYS HA 1 1 18 12986 1 1 35 LYS HB2 H 1.923 -7.226 0.643 1.00 . A A . 32 LYS HB2 1 1 18 12987 1 1 35 LYS HB3 H 2.186 -6.128 -0.701 1.00 . A A . 32 LYS HB3 1 1 18 12988 1 1 35 LYS HD2 H 3.619 -9.534 -0.203 1.00 . A A . 32 LYS HD2 1 1 18 12989 1 1 35 LYS HD3 H 1.926 -9.650 0.279 1.00 . A A . 32 LYS HD3 1 1 18 12990 1 1 35 LYS HE2 H 2.966 -10.466 -2.424 1.00 . A A . 32 LYS HE2 1 1 18 12991 1 1 35 LYS HE3 H 2.772 -11.579 -1.071 1.00 . A A . 32 LYS HE3 1 1 18 12992 1 1 35 LYS HG2 H 1.292 -8.170 -1.549 1.00 . A A . 32 LYS HG2 1 1 18 12993 1 1 35 LYS HG3 H 2.981 -8.053 -2.048 1.00 . A A . 32 LYS HG3 1 1 18 12994 1 1 35 LYS HZ1 H 0.602 -10.004 -2.346 1.00 . A A . 32 LYS HZ1 1 1 18 12995 1 1 35 LYS HZ2 H 0.411 -11.063 -1.041 1.00 . A A . 32 LYS HZ2 1 1 18 12996 1 1 35 LYS HZ3 H 0.879 -11.660 -2.552 1.00 . A A . 32 LYS HZ3 1 1 18 12997 1 1 35 LYS N N 4.058 -5.874 1.282 1.00 . A A . 32 LYS N 1 1 18 12998 1 1 35 LYS NZ N 0.975 -10.862 -1.891 1.00 . A A . 32 LYS NZ 1 1 18 12999 1 1 35 LYS O O 5.580 -7.208 -1.542 1.00 . A A . 32 LYS O 1 1 18 13000 1 1 36 HIS C C 6.942 -4.423 -2.129 1.00 . A A . 33 HIS C 1 1 18 13001 1 1 36 HIS CA C 5.470 -4.624 -2.483 1.00 . A A . 33 HIS CA 1 1 18 13002 1 1 36 HIS CB C 4.856 -3.308 -3.005 1.00 . A A . 33 HIS CB 1 1 18 13003 1 1 36 HIS CD2 C 5.975 -1.563 -1.440 1.00 . A A . 33 HIS CD2 1 1 18 13004 1 1 36 HIS CE1 C 4.245 -0.415 -0.872 1.00 . A A . 33 HIS CE1 1 1 18 13005 1 1 36 HIS CG C 4.916 -2.138 -2.056 1.00 . A A . 33 HIS CG 1 1 18 13006 1 1 36 HIS H H 4.117 -4.548 -0.848 1.00 . A A . 33 HIS H 1 1 18 13007 1 1 36 HIS HA H 5.412 -5.363 -3.268 1.00 . A A . 33 HIS HA 1 1 18 13008 1 1 36 HIS HB2 H 5.376 -3.018 -3.905 1.00 . A A . 33 HIS HB2 1 1 18 13009 1 1 36 HIS HB3 H 3.818 -3.484 -3.244 1.00 . A A . 33 HIS HB3 1 1 18 13010 1 1 36 HIS HD1 H 2.892 -1.568 -1.960 1.00 . A A . 33 HIS HD1 1 1 18 13011 1 1 36 HIS HD2 H 6.994 -1.897 -1.513 1.00 . A A . 33 HIS HD2 1 1 18 13012 1 1 36 HIS HE1 H 3.591 0.297 -0.395 1.00 . A A . 33 HIS HE1 1 1 18 13013 1 1 36 HIS N N 4.719 -5.143 -1.345 1.00 . A A . 33 HIS N 1 1 18 13014 1 1 36 HIS ND1 N 3.822 -1.401 -1.681 1.00 . A A . 33 HIS ND1 1 1 18 13015 1 1 36 HIS NE2 N 5.559 -0.463 -0.698 1.00 . A A . 33 HIS NE2 1 1 18 13016 1 1 36 HIS O O 7.786 -4.262 -3.008 1.00 . A A . 33 HIS O 1 1 18 13017 1 1 37 LYS C C 9.559 -5.285 -0.672 1.00 . A A . 34 LYS C 1 1 18 13018 1 1 37 LYS CA C 8.594 -4.146 -0.379 1.00 . A A . 34 LYS CA 1 1 18 13019 1 1 37 LYS CB C 8.578 -3.833 1.118 1.00 . A A . 34 LYS CB 1 1 18 13020 1 1 37 LYS CD C 7.810 -2.282 2.944 1.00 . A A . 34 LYS CD 1 1 18 13021 1 1 37 LYS CE C 6.840 -1.170 3.311 1.00 . A A . 34 LYS CE 1 1 18 13022 1 1 37 LYS CG C 7.712 -2.634 1.470 1.00 . A A . 34 LYS CG 1 1 18 13023 1 1 37 LYS H H 6.573 -4.740 -0.192 1.00 . A A . 34 LYS H 1 1 18 13024 1 1 37 LYS HA H 8.924 -3.269 -0.913 1.00 . A A . 34 LYS HA 1 1 18 13025 1 1 37 LYS HB2 H 8.200 -4.693 1.650 1.00 . A A . 34 LYS HB2 1 1 18 13026 1 1 37 LYS HB3 H 9.586 -3.631 1.443 1.00 . A A . 34 LYS HB3 1 1 18 13027 1 1 37 LYS HD2 H 7.581 -3.158 3.533 1.00 . A A . 34 LYS HD2 1 1 18 13028 1 1 37 LYS HD3 H 8.817 -1.955 3.160 1.00 . A A . 34 LYS HD3 1 1 18 13029 1 1 37 LYS HE2 H 7.083 -0.292 2.730 1.00 . A A . 34 LYS HE2 1 1 18 13030 1 1 37 LYS HE3 H 5.836 -1.491 3.072 1.00 . A A . 34 LYS HE3 1 1 18 13031 1 1 37 LYS HG2 H 8.039 -1.785 0.888 1.00 . A A . 34 LYS HG2 1 1 18 13032 1 1 37 LYS HG3 H 6.684 -2.862 1.230 1.00 . A A . 34 LYS HG3 1 1 18 13033 1 1 37 LYS HZ1 H 6.171 -0.135 4.994 1.00 . A A . 34 LYS HZ1 1 1 18 13034 1 1 37 LYS HZ2 H 7.836 -0.413 4.986 1.00 . A A . 34 LYS HZ2 1 1 18 13035 1 1 37 LYS HZ3 H 6.770 -1.677 5.335 1.00 . A A . 34 LYS HZ3 1 1 18 13036 1 1 37 LYS N N 7.254 -4.467 -0.842 1.00 . A A . 34 LYS N 1 1 18 13037 1 1 37 LYS NZ N 6.908 -0.826 4.756 1.00 . A A . 34 LYS NZ 1 1 18 13038 1 1 37 LYS O O 10.754 -5.065 -0.846 1.00 . A A . 34 LYS O 1 1 18 13039 1 1 38 THR C C 10.151 -7.865 -2.475 1.00 . A A . 35 THR C 1 1 18 13040 1 1 38 THR CA C 9.845 -7.672 -0.991 1.00 . A A . 35 THR CA 1 1 18 13041 1 1 38 THR CB C 9.156 -8.938 -0.438 1.00 . A A . 35 THR CB 1 1 18 13042 1 1 38 THR CG2 C 7.913 -9.290 -1.244 1.00 . A A . 35 THR CG2 1 1 18 13043 1 1 38 THR H H 8.052 -6.594 -0.684 1.00 . A A . 35 THR H 1 1 18 13044 1 1 38 THR HA H 10.774 -7.533 -0.459 1.00 . A A . 35 THR HA 1 1 18 13045 1 1 38 THR HB H 8.857 -8.740 0.579 1.00 . A A . 35 THR HB 1 1 18 13046 1 1 38 THR HG1 H 10.939 -9.737 -0.744 1.00 . A A . 35 THR HG1 1 1 18 13047 1 1 38 THR HG21 H 7.467 -10.189 -0.845 1.00 . A A . 35 THR HG21 1 1 18 13048 1 1 38 THR HG22 H 8.188 -9.452 -2.277 1.00 . A A . 35 THR HG22 1 1 18 13049 1 1 38 THR HG23 H 7.203 -8.479 -1.184 1.00 . A A . 35 THR HG23 1 1 18 13050 1 1 38 THR N N 9.024 -6.492 -0.769 1.00 . A A . 35 THR N 1 1 18 13051 1 1 38 THR O O 10.861 -8.793 -2.855 1.00 . A A . 35 THR O 1 1 18 13052 1 1 38 THR OG1 O 10.066 -10.047 -0.456 1.00 . A A . 35 THR OG1 1 1 18 13053 1 1 39 ARG C C 10.231 -5.790 -5.380 1.00 . A A . 36 ARG C 1 1 18 13054 1 1 39 ARG CA C 9.816 -7.115 -4.750 1.00 . A A . 36 ARG CA 1 1 18 13055 1 1 39 ARG CB C 8.542 -7.647 -5.405 1.00 . A A . 36 ARG CB 1 1 18 13056 1 1 39 ARG CD C 6.062 -7.481 -5.680 1.00 . A A . 36 ARG CD 1 1 18 13057 1 1 39 ARG CG C 7.298 -6.845 -5.073 1.00 . A A . 36 ARG CG 1 1 18 13058 1 1 39 ARG CZ C 3.624 -7.228 -5.432 1.00 . A A . 36 ARG CZ 1 1 18 13059 1 1 39 ARG H H 9.079 -6.250 -2.961 1.00 . A A . 36 ARG H 1 1 18 13060 1 1 39 ARG HA H 10.608 -7.831 -4.905 1.00 . A A . 36 ARG HA 1 1 18 13061 1 1 39 ARG HB2 H 8.673 -7.637 -6.476 1.00 . A A . 36 ARG HB2 1 1 18 13062 1 1 39 ARG HB3 H 8.383 -8.665 -5.081 1.00 . A A . 36 ARG HB3 1 1 18 13063 1 1 39 ARG HD2 H 6.198 -7.550 -6.748 1.00 . A A . 36 ARG HD2 1 1 18 13064 1 1 39 ARG HD3 H 5.946 -8.471 -5.269 1.00 . A A . 36 ARG HD3 1 1 18 13065 1 1 39 ARG HE H 4.958 -5.754 -5.204 1.00 . A A . 36 ARG HE 1 1 18 13066 1 1 39 ARG HG2 H 7.183 -6.805 -3.999 1.00 . A A . 36 ARG HG2 1 1 18 13067 1 1 39 ARG HG3 H 7.409 -5.844 -5.464 1.00 . A A . 36 ARG HG3 1 1 18 13068 1 1 39 ARG HH11 H 4.229 -9.096 -5.939 1.00 . A A . 36 ARG HH11 1 1 18 13069 1 1 39 ARG HH12 H 2.515 -8.892 -5.754 1.00 . A A . 36 ARG HH12 1 1 18 13070 1 1 39 ARG HH21 H 2.704 -5.482 -4.966 1.00 . A A . 36 ARG HH21 1 1 18 13071 1 1 39 ARG HH22 H 1.650 -6.845 -5.191 1.00 . A A . 36 ARG HH22 1 1 18 13072 1 1 39 ARG N N 9.619 -6.988 -3.313 1.00 . A A . 36 ARG N 1 1 18 13073 1 1 39 ARG NE N 4.852 -6.712 -5.408 1.00 . A A . 36 ARG NE 1 1 18 13074 1 1 39 ARG NH1 N 3.442 -8.508 -5.730 1.00 . A A . 36 ARG NH1 1 1 18 13075 1 1 39 ARG NH2 N 2.576 -6.457 -5.175 1.00 . A A . 36 ARG NH2 1 1 18 13076 1 1 39 ARG O O 10.487 -5.717 -6.581 1.00 . A A . 36 ARG O 1 1 18 13077 1 1 40 ASP C C 11.817 -2.843 -4.222 1.00 . A A . 37 ASP C 1 1 18 13078 1 1 40 ASP CA C 10.691 -3.429 -5.066 1.00 . A A . 37 ASP CA 1 1 18 13079 1 1 40 ASP CB C 9.485 -2.486 -5.070 1.00 . A A . 37 ASP CB 1 1 18 13080 1 1 40 ASP CG C 9.773 -1.169 -5.764 1.00 . A A . 37 ASP CG 1 1 18 13081 1 1 40 ASP H H 10.077 -4.853 -3.624 1.00 . A A . 37 ASP H 1 1 18 13082 1 1 40 ASP HA H 11.045 -3.550 -6.078 1.00 . A A . 37 ASP HA 1 1 18 13083 1 1 40 ASP HB2 H 8.665 -2.965 -5.582 1.00 . A A . 37 ASP HB2 1 1 18 13084 1 1 40 ASP HB3 H 9.195 -2.279 -4.050 1.00 . A A . 37 ASP HB3 1 1 18 13085 1 1 40 ASP N N 10.302 -4.745 -4.569 1.00 . A A . 37 ASP N 1 1 18 13086 1 1 40 ASP O O 12.408 -1.826 -4.579 1.00 . A A . 37 ASP O 1 1 18 13087 1 1 40 ASP OD1 O 9.806 -1.146 -7.013 1.00 . A A . 37 ASP OD1 1 1 18 13088 1 1 40 ASP OD2 O 9.950 -0.146 -5.069 1.00 . A A . 37 ASP OD2 1 1 18 13089 1 1 41 ASN C C 12.686 -1.782 -1.451 1.00 . A A . 38 ASN C 1 1 18 13090 1 1 41 ASN CA C 13.134 -3.061 -2.151 1.00 . A A . 38 ASN CA 1 1 18 13091 1 1 41 ASN CB C 14.495 -2.847 -2.822 1.00 . A A . 38 ASN CB 1 1 18 13092 1 1 41 ASN CG C 15.048 -4.110 -3.454 1.00 . A A . 38 ASN CG 1 1 18 13093 1 1 41 ASN H H 11.661 -4.360 -2.929 1.00 . A A . 38 ASN H 1 1 18 13094 1 1 41 ASN HA H 13.237 -3.835 -1.403 1.00 . A A . 38 ASN HA 1 1 18 13095 1 1 41 ASN HB2 H 14.396 -2.098 -3.592 1.00 . A A . 38 ASN HB2 1 1 18 13096 1 1 41 ASN HB3 H 15.197 -2.503 -2.081 1.00 . A A . 38 ASN HB3 1 1 18 13097 1 1 41 ASN HD21 H 14.241 -3.623 -5.203 1.00 . A A . 38 ASN HD21 1 1 18 13098 1 1 41 ASN HD22 H 15.118 -5.111 -5.168 1.00 . A A . 38 ASN HD22 1 1 18 13099 1 1 41 ASN N N 12.122 -3.517 -3.109 1.00 . A A . 38 ASN N 1 1 18 13100 1 1 41 ASN ND2 N 14.776 -4.301 -4.736 1.00 . A A . 38 ASN ND2 1 1 18 13101 1 1 41 ASN O O 13.481 -1.102 -0.801 1.00 . A A . 38 ASN O 1 1 18 13102 1 1 41 ASN OD1 O 15.731 -4.898 -2.801 1.00 . A A . 38 ASN OD1 1 1 18 13103 1 1 42 CYS C C 10.808 -0.471 0.567 1.00 . A A . 39 CYS C 1 1 18 13104 1 1 42 CYS CA C 10.814 -0.301 -0.951 1.00 . A A . 39 CYS CA 1 1 18 13105 1 1 42 CYS CB C 9.382 -0.103 -1.475 1.00 . A A . 39 CYS CB 1 1 18 13106 1 1 42 CYS H H 10.833 -2.049 -2.128 1.00 . A A . 39 CYS H 1 1 18 13107 1 1 42 CYS HA H 11.411 0.560 -1.209 1.00 . A A . 39 CYS HA 1 1 18 13108 1 1 42 CYS HB2 H 9.410 -0.030 -2.552 1.00 . A A . 39 CYS HB2 1 1 18 13109 1 1 42 CYS HB3 H 8.787 -0.960 -1.195 1.00 . A A . 39 CYS HB3 1 1 18 13110 1 1 42 CYS N N 11.403 -1.472 -1.584 1.00 . A A . 39 CYS N 1 1 18 13111 1 1 42 CYS O O 10.733 -1.592 1.072 1.00 . A A . 39 CYS O 1 1 18 13112 1 1 42 CYS SG S 8.549 1.375 -0.849 1.00 . A A . 39 CYS SG 1 1 18 13113 1 1 43 SER C C 9.537 1.234 3.224 1.00 . A A . 40 SER C 1 1 18 13114 1 1 43 SER CA C 10.836 0.587 2.746 1.00 . A A . 40 SER CA 1 1 18 13115 1 1 43 SER CB C 12.044 1.287 3.372 1.00 . A A . 40 SER CB 1 1 18 13116 1 1 43 SER H H 11.074 1.490 0.845 1.00 . A A . 40 SER H 1 1 18 13117 1 1 43 SER HA H 10.836 -0.450 3.044 1.00 . A A . 40 SER HA 1 1 18 13118 1 1 43 SER HB2 H 11.967 2.350 3.211 1.00 . A A . 40 SER HB2 1 1 18 13119 1 1 43 SER HB3 H 12.063 1.083 4.432 1.00 . A A . 40 SER HB3 1 1 18 13120 1 1 43 SER HG H 13.295 -0.137 2.860 1.00 . A A . 40 SER HG 1 1 18 13121 1 1 43 SER N N 10.919 0.631 1.293 1.00 . A A . 40 SER N 1 1 18 13122 1 1 43 SER O O 9.134 1.086 4.379 1.00 . A A . 40 SER O 1 1 18 13123 1 1 43 SER OG O 13.256 0.825 2.795 1.00 . A A . 40 SER OG 1 1 18 13124 1 1 44 GLY C C 7.782 3.782 3.516 1.00 . A A . 41 GLY C 1 1 18 13125 1 1 44 GLY CA C 7.617 2.586 2.605 1.00 . A A . 41 GLY CA 1 1 18 13126 1 1 44 GLY H H 9.255 2.007 1.401 1.00 . A A . 41 GLY H 1 1 18 13127 1 1 44 GLY HA2 H 7.166 2.913 1.680 1.00 . A A . 41 GLY HA2 1 1 18 13128 1 1 44 GLY HA3 H 6.961 1.875 3.078 1.00 . A A . 41 GLY HA3 1 1 18 13129 1 1 44 GLY N N 8.877 1.934 2.304 1.00 . A A . 41 GLY N 1 1 18 13130 1 1 44 GLY O O 6.996 3.980 4.438 1.00 . A A . 41 GLY O 1 1 18 13131 1 1 45 GLN C C 9.953 6.718 3.245 1.00 . A A . 42 GLN C 1 1 18 13132 1 1 45 GLN CA C 9.099 5.752 4.052 1.00 . A A . 42 GLN CA 1 1 18 13133 1 1 45 GLN CB C 9.814 5.337 5.343 1.00 . A A . 42 GLN CB 1 1 18 13134 1 1 45 GLN CD C 11.666 3.967 6.384 1.00 . A A . 42 GLN CD 1 1 18 13135 1 1 45 GLN CG C 11.096 4.552 5.109 1.00 . A A . 42 GLN CG 1 1 18 13136 1 1 45 GLN H H 9.366 4.389 2.470 1.00 . A A . 42 GLN H 1 1 18 13137 1 1 45 GLN HA H 8.164 6.233 4.302 1.00 . A A . 42 GLN HA 1 1 18 13138 1 1 45 GLN HB2 H 10.060 6.226 5.904 1.00 . A A . 42 GLN HB2 1 1 18 13139 1 1 45 GLN HB3 H 9.145 4.725 5.930 1.00 . A A . 42 GLN HB3 1 1 18 13140 1 1 45 GLN HE21 H 12.697 5.629 6.712 1.00 . A A . 42 GLN HE21 1 1 18 13141 1 1 45 GLN HE22 H 12.884 4.382 7.896 1.00 . A A . 42 GLN HE22 1 1 18 13142 1 1 45 GLN HG2 H 10.886 3.744 4.424 1.00 . A A . 42 GLN HG2 1 1 18 13143 1 1 45 GLN HG3 H 11.832 5.211 4.672 1.00 . A A . 42 GLN HG3 1 1 18 13144 1 1 45 GLN N N 8.798 4.583 3.245 1.00 . A A . 42 GLN N 1 1 18 13145 1 1 45 GLN NE2 N 12.499 4.735 7.066 1.00 . A A . 42 GLN NE2 1 1 18 13146 1 1 45 GLN O O 10.866 6.300 2.531 1.00 . A A . 42 GLN O 1 1 18 13147 1 1 45 GLN OE1 O 11.354 2.832 6.753 1.00 . A A . 42 GLN OE1 1 1 18 13148 1 1 46 THR C C 11.039 10.000 3.495 1.00 . A A . 43 THR C 1 1 18 13149 1 1 46 THR CA C 10.365 8.998 2.571 1.00 . A A . 43 THR CA 1 1 18 13150 1 1 46 THR CB C 9.425 9.760 1.617 1.00 . A A . 43 THR CB 1 1 18 13151 1 1 46 THR CG2 C 9.084 8.922 0.396 1.00 . A A . 43 THR CG2 1 1 18 13152 1 1 46 THR H H 8.886 8.275 3.896 1.00 . A A . 43 THR H 1 1 18 13153 1 1 46 THR HA H 11.114 8.492 1.981 1.00 . A A . 43 THR HA 1 1 18 13154 1 1 46 THR HB H 9.928 10.659 1.288 1.00 . A A . 43 THR HB 1 1 18 13155 1 1 46 THR HG1 H 8.174 11.088 2.386 1.00 . A A . 43 THR HG1 1 1 18 13156 1 1 46 THR HG21 H 8.614 8.002 0.711 1.00 . A A . 43 THR HG21 1 1 18 13157 1 1 46 THR HG22 H 9.987 8.696 -0.149 1.00 . A A . 43 THR HG22 1 1 18 13158 1 1 46 THR HG23 H 8.407 9.472 -0.241 1.00 . A A . 43 THR HG23 1 1 18 13159 1 1 46 THR N N 9.636 7.995 3.324 1.00 . A A . 43 THR N 1 1 18 13160 1 1 46 THR O O 11.592 10.999 3.029 1.00 . A A . 43 THR O 1 1 18 13161 1 1 46 THR OG1 O 8.223 10.126 2.311 1.00 . A A . 43 THR OG1 1 1 18 13162 1 1 47 HIS C C 10.433 11.828 5.897 1.00 . A A . 44 HIS C 1 1 18 13163 1 1 47 HIS CA C 11.419 10.661 5.838 1.00 . A A . 44 HIS CA 1 1 18 13164 1 1 47 HIS CB C 12.851 11.162 5.591 1.00 . A A . 44 HIS CB 1 1 18 13165 1 1 47 HIS CD2 C 13.199 13.268 7.076 1.00 . A A . 44 HIS CD2 1 1 18 13166 1 1 47 HIS CE1 C 14.661 12.430 8.477 1.00 . A A . 44 HIS CE1 1 1 18 13167 1 1 47 HIS CG C 13.417 11.980 6.715 1.00 . A A . 44 HIS CG 1 1 18 13168 1 1 47 HIS H H 10.661 8.837 5.076 1.00 . A A . 44 HIS H 1 1 18 13169 1 1 47 HIS HA H 11.388 10.139 6.784 1.00 . A A . 44 HIS HA 1 1 18 13170 1 1 47 HIS HB2 H 13.499 10.313 5.443 1.00 . A A . 44 HIS HB2 1 1 18 13171 1 1 47 HIS HB3 H 12.860 11.771 4.700 1.00 . A A . 44 HIS HB3 1 1 18 13172 1 1 47 HIS HD1 H 14.710 10.574 7.611 1.00 . A A . 44 HIS HD1 1 1 18 13173 1 1 47 HIS HD2 H 12.531 13.965 6.592 1.00 . A A . 44 HIS HD2 1 1 18 13174 1 1 47 HIS HE1 H 15.362 12.329 9.291 1.00 . A A . 44 HIS HE1 1 1 18 13175 1 1 47 HIS HE2 H 14.073 14.389 8.623 1.00 . A A . 44 HIS HE2 1 1 18 13176 1 1 47 HIS N N 10.991 9.718 4.800 1.00 . A A . 44 HIS N 1 1 18 13177 1 1 47 HIS ND1 N 14.339 11.485 7.612 1.00 . A A . 44 HIS ND1 1 1 18 13178 1 1 47 HIS NE2 N 13.983 13.519 8.171 1.00 . A A . 44 HIS NE2 1 1 18 13179 1 1 47 HIS O O 9.793 12.063 6.921 1.00 . A A . 44 HIS O 1 1 18 13180 1 1 48 ASP C C 8.661 13.465 3.273 1.00 . A A . 45 ASP C 1 1 18 13181 1 1 48 ASP CA C 9.317 13.586 4.640 1.00 . A A . 45 ASP CA 1 1 18 13182 1 1 48 ASP CB C 9.941 14.973 4.811 1.00 . A A . 45 ASP CB 1 1 18 13183 1 1 48 ASP CG C 8.934 16.084 4.581 1.00 . A A . 45 ASP CG 1 1 18 13184 1 1 48 ASP H H 10.908 12.344 4.032 1.00 . A A . 45 ASP H 1 1 18 13185 1 1 48 ASP HA H 8.564 13.439 5.401 1.00 . A A . 45 ASP HA 1 1 18 13186 1 1 48 ASP HB2 H 10.331 15.066 5.814 1.00 . A A . 45 ASP HB2 1 1 18 13187 1 1 48 ASP HB3 H 10.747 15.089 4.102 1.00 . A A . 45 ASP HB3 1 1 18 13188 1 1 48 ASP N N 10.312 12.539 4.790 1.00 . A A . 45 ASP N 1 1 18 13189 1 1 48 ASP O O 9.256 13.929 2.279 1.00 . A A . 45 ASP O 1 1 18 13190 1 1 48 ASP OXT O 7.568 12.869 3.190 1.00 . A A . 45 ASP OXT 1 1 18 13191 1 1 48 ASP OD1 O 7.902 16.110 5.284 1.00 . A A . 45 ASP OD1 1 1 18 13192 1 1 48 ASP OD2 O 9.174 16.940 3.703 1.00 . A A . 45 ASP OD2 1 1 18 13193 2 2 1 ZN ZN ZN -4.476 -5.542 0.360 1.00 . B A . 101 ZN ZN 1 1 18 13194 3 2 1 ZN ZN ZN 6.298 1.294 -1.326 1.00 . C A . 102 ZN ZN 1 1 19 13195 1 1 1 GLY C C -14.002 12.403 -4.309 1.00 . A A . -2 GLY C 1 1 19 13196 1 1 1 GLY CA C -15.130 11.920 -5.197 1.00 . A A . -2 GLY CA 1 1 19 13197 1 1 1 GLY H1 H -14.161 12.247 -7.010 1.00 . A A . -2 GLY H1 1 1 19 13198 1 1 1 GLY H2 H -15.426 11.128 -7.100 1.00 . A A . -2 GLY H2 1 1 19 13199 1 1 1 GLY H3 H -13.955 10.687 -6.394 1.00 . A A . -2 GLY H3 1 1 19 13200 1 1 1 GLY HA2 H -15.831 12.727 -5.344 1.00 . A A . -2 GLY HA2 1 1 19 13201 1 1 1 GLY HA3 H -15.634 11.100 -4.709 1.00 . A A . -2 GLY HA3 1 1 19 13202 1 1 1 GLY N N -14.636 11.463 -6.516 1.00 . A A . -2 GLY N 1 1 19 13203 1 1 1 GLY O O -12.954 12.818 -4.805 1.00 . A A . -2 GLY O 1 1 19 13204 1 1 2 PRO C C -12.154 11.629 -1.757 1.00 . A A . -1 PRO C 1 1 19 13205 1 1 2 PRO CA C -13.156 12.754 -2.020 1.00 . A A . -1 PRO CA 1 1 19 13206 1 1 2 PRO CB C -13.953 13.065 -0.741 1.00 . A A . -1 PRO CB 1 1 19 13207 1 1 2 PRO CD C -15.412 11.959 -2.300 1.00 . A A . -1 PRO CD 1 1 19 13208 1 1 2 PRO CG C -15.394 12.830 -1.079 1.00 . A A . -1 PRO CG 1 1 19 13209 1 1 2 PRO HA H -12.627 13.638 -2.344 1.00 . A A . -1 PRO HA 1 1 19 13210 1 1 2 PRO HB2 H -13.625 12.410 0.053 1.00 . A A . -1 PRO HB2 1 1 19 13211 1 1 2 PRO HB3 H -13.780 14.092 -0.453 1.00 . A A . -1 PRO HB3 1 1 19 13212 1 1 2 PRO HD2 H -15.381 10.915 -2.026 1.00 . A A . -1 PRO HD2 1 1 19 13213 1 1 2 PRO HD3 H -16.279 12.170 -2.907 1.00 . A A . -1 PRO HD3 1 1 19 13214 1 1 2 PRO HG2 H -15.886 12.330 -0.257 1.00 . A A . -1 PRO HG2 1 1 19 13215 1 1 2 PRO HG3 H -15.879 13.774 -1.285 1.00 . A A . -1 PRO HG3 1 1 19 13216 1 1 2 PRO N N -14.184 12.361 -2.981 1.00 . A A . -1 PRO N 1 1 19 13217 1 1 2 PRO O O -11.544 11.569 -0.685 1.00 . A A . -1 PRO O 1 1 19 13218 1 1 3 HIS C C -11.512 8.695 -1.467 1.00 . A A . 0 HIS C 1 1 19 13219 1 1 3 HIS CA C -11.121 9.577 -2.643 1.00 . A A . 0 HIS CA 1 1 19 13220 1 1 3 HIS CB C -9.650 9.991 -2.534 1.00 . A A . 0 HIS CB 1 1 19 13221 1 1 3 HIS CD2 C -9.100 11.750 -4.356 1.00 . A A . 0 HIS CD2 1 1 19 13222 1 1 3 HIS CE1 C -8.018 10.448 -5.744 1.00 . A A . 0 HIS CE1 1 1 19 13223 1 1 3 HIS CG C -9.081 10.511 -3.817 1.00 . A A . 0 HIS CG 1 1 19 13224 1 1 3 HIS H H -12.509 10.874 -3.574 1.00 . A A . 0 HIS H 1 1 19 13225 1 1 3 HIS HA H -11.248 9.001 -3.548 1.00 . A A . 0 HIS HA 1 1 19 13226 1 1 3 HIS HB2 H -9.558 10.770 -1.792 1.00 . A A . 0 HIS HB2 1 1 19 13227 1 1 3 HIS HB3 H -9.063 9.137 -2.229 1.00 . A A . 0 HIS HB3 1 1 19 13228 1 1 3 HIS HD1 H -8.208 8.758 -4.606 1.00 . A A . 0 HIS HD1 1 1 19 13229 1 1 3 HIS HD2 H -9.556 12.629 -3.924 1.00 . A A . 0 HIS HD2 1 1 19 13230 1 1 3 HIS HE1 H -7.465 10.093 -6.600 1.00 . A A . 0 HIS HE1 1 1 19 13231 1 1 3 HIS HE2 H -8.438 12.387 -6.241 1.00 . A A . 0 HIS HE2 1 1 19 13232 1 1 3 HIS N N -12.003 10.742 -2.743 1.00 . A A . 0 HIS N 1 1 19 13233 1 1 3 HIS ND1 N -8.394 9.718 -4.712 1.00 . A A . 0 HIS ND1 1 1 19 13234 1 1 3 HIS NE2 N -8.434 11.685 -5.554 1.00 . A A . 0 HIS NE2 1 1 19 13235 1 1 3 HIS O O -10.661 8.096 -0.810 1.00 . A A . 0 HIS O 1 1 19 13236 1 1 4 MET C C -13.508 6.364 -0.630 1.00 . A A . 1 MET C 1 1 19 13237 1 1 4 MET CA C -13.321 7.786 -0.135 1.00 . A A . 1 MET CA 1 1 19 13238 1 1 4 MET CB C -14.646 8.338 0.397 1.00 . A A . 1 MET CB 1 1 19 13239 1 1 4 MET CE C -15.571 11.795 2.540 1.00 . A A . 1 MET CE 1 1 19 13240 1 1 4 MET CG C -14.519 9.691 1.076 1.00 . A A . 1 MET CG 1 1 19 13241 1 1 4 MET H H -13.439 9.112 -1.777 1.00 . A A . 1 MET H 1 1 19 13242 1 1 4 MET HA H -12.592 7.786 0.660 1.00 . A A . 1 MET HA 1 1 19 13243 1 1 4 MET HB2 H -15.336 8.437 -0.427 1.00 . A A . 1 MET HB2 1 1 19 13244 1 1 4 MET HB3 H -15.050 7.638 1.112 1.00 . A A . 1 MET HB3 1 1 19 13245 1 1 4 MET HE1 H -16.425 12.269 3.000 1.00 . A A . 1 MET HE1 1 1 19 13246 1 1 4 MET HE2 H -15.143 12.458 1.804 1.00 . A A . 1 MET HE2 1 1 19 13247 1 1 4 MET HE3 H -14.833 11.571 3.294 1.00 . A A . 1 MET HE3 1 1 19 13248 1 1 4 MET HG2 H -13.806 9.611 1.883 1.00 . A A . 1 MET HG2 1 1 19 13249 1 1 4 MET HG3 H -14.163 10.408 0.351 1.00 . A A . 1 MET HG3 1 1 19 13250 1 1 4 MET N N -12.809 8.615 -1.212 1.00 . A A . 1 MET N 1 1 19 13251 1 1 4 MET O O -14.332 6.119 -1.515 1.00 . A A . 1 MET O 1 1 19 13252 1 1 4 MET SD S -16.090 10.277 1.743 1.00 . A A . 1 MET SD 1 1 19 13253 1 1 5 ALA C C -12.039 3.858 -1.797 1.00 . A A . 2 ALA C 1 1 19 13254 1 1 5 ALA CA C -12.730 4.046 -0.461 1.00 . A A . 2 ALA CA 1 1 19 13255 1 1 5 ALA CB C -14.137 3.462 -0.485 1.00 . A A . 2 ALA CB 1 1 19 13256 1 1 5 ALA H H -12.085 5.730 0.620 1.00 . A A . 2 ALA H 1 1 19 13257 1 1 5 ALA HA H -12.159 3.503 0.281 1.00 . A A . 2 ALA HA 1 1 19 13258 1 1 5 ALA HB1 H -14.589 3.572 0.490 1.00 . A A . 2 ALA HB1 1 1 19 13259 1 1 5 ALA HB2 H -14.088 2.412 -0.743 1.00 . A A . 2 ALA HB2 1 1 19 13260 1 1 5 ALA HB3 H -14.731 3.985 -1.219 1.00 . A A . 2 ALA HB3 1 1 19 13261 1 1 5 ALA N N -12.720 5.448 -0.070 1.00 . A A . 2 ALA N 1 1 19 13262 1 1 5 ALA O O -11.676 4.823 -2.480 1.00 . A A . 2 ALA O 1 1 19 13263 1 1 6 VAL C C -10.932 0.696 -3.194 1.00 . A A . 3 VAL C 1 1 19 13264 1 1 6 VAL CA C -11.052 2.206 -3.273 1.00 . A A . 3 VAL CA 1 1 19 13265 1 1 6 VAL CB C -9.642 2.833 -3.159 1.00 . A A . 3 VAL CB 1 1 19 13266 1 1 6 VAL CG1 C -8.742 1.977 -2.305 1.00 . A A . 3 VAL CG1 1 1 19 13267 1 1 6 VAL CG2 C -8.996 3.063 -4.503 1.00 . A A . 3 VAL CG2 1 1 19 13268 1 1 6 VAL H H -12.320 1.905 -1.632 1.00 . A A . 3 VAL H 1 1 19 13269 1 1 6 VAL HA H -11.518 2.513 -4.189 1.00 . A A . 3 VAL HA 1 1 19 13270 1 1 6 VAL HB H -9.745 3.793 -2.672 1.00 . A A . 3 VAL HB 1 1 19 13271 1 1 6 VAL HG11 H -8.442 1.102 -2.860 1.00 . A A . 3 VAL HG11 1 1 19 13272 1 1 6 VAL HG12 H -9.280 1.672 -1.417 1.00 . A A . 3 VAL HG12 1 1 19 13273 1 1 6 VAL HG13 H -7.870 2.549 -2.027 1.00 . A A . 3 VAL HG13 1 1 19 13274 1 1 6 VAL HG21 H -8.007 3.468 -4.343 1.00 . A A . 3 VAL HG21 1 1 19 13275 1 1 6 VAL HG22 H -9.588 3.758 -5.076 1.00 . A A . 3 VAL HG22 1 1 19 13276 1 1 6 VAL HG23 H -8.918 2.126 -5.030 1.00 . A A . 3 VAL HG23 1 1 19 13277 1 1 6 VAL N N -11.869 2.605 -2.151 1.00 . A A . 3 VAL N 1 1 19 13278 1 1 6 VAL O O -11.582 0.077 -2.349 1.00 . A A . 3 VAL O 1 1 19 13279 1 1 7 LEU C C -8.152 -1.285 -3.732 1.00 . A A . 4 LEU C 1 1 19 13280 1 1 7 LEU CA C -9.669 -1.240 -3.763 1.00 . A A . 4 LEU CA 1 1 19 13281 1 1 7 LEU CB C -10.242 -2.249 -4.762 1.00 . A A . 4 LEU CB 1 1 19 13282 1 1 7 LEU CD1 C -12.202 -3.544 -5.638 1.00 . A A . 4 LEU CD1 1 1 19 13283 1 1 7 LEU CD2 C -12.078 -2.972 -3.206 1.00 . A A . 4 LEU CD2 1 1 19 13284 1 1 7 LEU CG C -11.744 -2.512 -4.621 1.00 . A A . 4 LEU CG 1 1 19 13285 1 1 7 LEU H H -9.829 0.557 -4.854 1.00 . A A . 4 LEU H 1 1 19 13286 1 1 7 LEU HA H -10.024 -1.478 -2.768 1.00 . A A . 4 LEU HA 1 1 19 13287 1 1 7 LEU HB2 H -10.051 -1.883 -5.759 1.00 . A A . 4 LEU HB2 1 1 19 13288 1 1 7 LEU HB3 H -9.721 -3.186 -4.634 1.00 . A A . 4 LEU HB3 1 1 19 13289 1 1 7 LEU HD11 H -12.012 -3.177 -6.635 1.00 . A A . 4 LEU HD11 1 1 19 13290 1 1 7 LEU HD12 H -13.261 -3.725 -5.516 1.00 . A A . 4 LEU HD12 1 1 19 13291 1 1 7 LEU HD13 H -11.660 -4.465 -5.485 1.00 . A A . 4 LEU HD13 1 1 19 13292 1 1 7 LEU HD21 H -11.868 -2.171 -2.506 1.00 . A A . 4 LEU HD21 1 1 19 13293 1 1 7 LEU HD22 H -11.477 -3.835 -2.952 1.00 . A A . 4 LEU HD22 1 1 19 13294 1 1 7 LEU HD23 H -13.124 -3.234 -3.148 1.00 . A A . 4 LEU HD23 1 1 19 13295 1 1 7 LEU HG H -12.283 -1.596 -4.812 1.00 . A A . 4 LEU HG 1 1 19 13296 1 1 7 LEU N N -10.120 0.099 -4.037 1.00 . A A . 4 LEU N 1 1 19 13297 1 1 7 LEU O O -7.478 -0.696 -4.577 1.00 . A A . 4 LEU O 1 1 19 13298 1 1 8 CYS C C -5.408 -2.363 -3.684 1.00 . A A . 5 CYS C 1 1 19 13299 1 1 8 CYS CA C -6.226 -2.101 -2.423 1.00 . A A . 5 CYS CA 1 1 19 13300 1 1 8 CYS CB C -6.062 -3.258 -1.446 1.00 . A A . 5 CYS CB 1 1 19 13301 1 1 8 CYS H H -8.287 -2.381 -2.083 1.00 . A A . 5 CYS H 1 1 19 13302 1 1 8 CYS HA H -5.879 -1.193 -1.955 1.00 . A A . 5 CYS HA 1 1 19 13303 1 1 8 CYS HB2 H -6.677 -3.070 -0.582 1.00 . A A . 5 CYS HB2 1 1 19 13304 1 1 8 CYS HB3 H -6.407 -4.164 -1.926 1.00 . A A . 5 CYS HB3 1 1 19 13305 1 1 8 CYS N N -7.651 -1.958 -2.703 1.00 . A A . 5 CYS N 1 1 19 13306 1 1 8 CYS O O -5.672 -3.308 -4.416 1.00 . A A . 5 CYS O 1 1 19 13307 1 1 8 CYS SG S -4.382 -3.561 -0.861 1.00 . A A . 5 CYS SG 1 1 19 13308 1 1 9 GLY C C -2.776 -2.943 -5.154 1.00 . A A . 6 GLY C 1 1 19 13309 1 1 9 GLY CA C -3.571 -1.650 -5.095 1.00 . A A . 6 GLY CA 1 1 19 13310 1 1 9 GLY H H -4.215 -0.814 -3.256 1.00 . A A . 6 GLY H 1 1 19 13311 1 1 9 GLY HA2 H -4.207 -1.598 -5.962 1.00 . A A . 6 GLY HA2 1 1 19 13312 1 1 9 GLY HA3 H -2.882 -0.819 -5.121 1.00 . A A . 6 GLY HA3 1 1 19 13313 1 1 9 GLY N N -4.396 -1.533 -3.905 1.00 . A A . 6 GLY N 1 1 19 13314 1 1 9 GLY O O -2.318 -3.347 -6.224 1.00 . A A . 6 GLY O 1 1 19 13315 1 1 10 VAL C C -2.701 -6.066 -4.154 1.00 . A A . 7 VAL C 1 1 19 13316 1 1 10 VAL CA C -1.828 -4.827 -3.959 1.00 . A A . 7 VAL CA 1 1 19 13317 1 1 10 VAL CB C -1.051 -4.949 -2.633 1.00 . A A . 7 VAL CB 1 1 19 13318 1 1 10 VAL CG1 C -0.316 -6.281 -2.555 1.00 . A A . 7 VAL CG1 1 1 19 13319 1 1 10 VAL CG2 C -0.074 -3.793 -2.479 1.00 . A A . 7 VAL CG2 1 1 19 13320 1 1 10 VAL H H -3.012 -3.243 -3.197 1.00 . A A . 7 VAL H 1 1 19 13321 1 1 10 VAL HA H -1.107 -4.788 -4.763 1.00 . A A . 7 VAL HA 1 1 19 13322 1 1 10 VAL HB H -1.760 -4.905 -1.818 1.00 . A A . 7 VAL HB 1 1 19 13323 1 1 10 VAL HG11 H 0.393 -6.348 -3.368 1.00 . A A . 7 VAL HG11 1 1 19 13324 1 1 10 VAL HG12 H -1.030 -7.087 -2.632 1.00 . A A . 7 VAL HG12 1 1 19 13325 1 1 10 VAL HG13 H 0.207 -6.349 -1.613 1.00 . A A . 7 VAL HG13 1 1 19 13326 1 1 10 VAL HG21 H 0.630 -3.805 -3.297 1.00 . A A . 7 VAL HG21 1 1 19 13327 1 1 10 VAL HG22 H 0.457 -3.892 -1.544 1.00 . A A . 7 VAL HG22 1 1 19 13328 1 1 10 VAL HG23 H -0.618 -2.860 -2.487 1.00 . A A . 7 VAL HG23 1 1 19 13329 1 1 10 VAL N N -2.608 -3.596 -4.014 1.00 . A A . 7 VAL N 1 1 19 13330 1 1 10 VAL O O -2.537 -6.795 -5.131 1.00 . A A . 7 VAL O 1 1 19 13331 1 1 11 CYS C C -5.743 -7.329 -3.994 1.00 . A A . 8 CYS C 1 1 19 13332 1 1 11 CYS CA C -4.419 -7.533 -3.260 1.00 . A A . 8 CYS CA 1 1 19 13333 1 1 11 CYS CB C -4.667 -8.050 -1.838 1.00 . A A . 8 CYS CB 1 1 19 13334 1 1 11 CYS H H -3.785 -5.647 -2.529 1.00 . A A . 8 CYS H 1 1 19 13335 1 1 11 CYS HA H -3.843 -8.272 -3.798 1.00 . A A . 8 CYS HA 1 1 19 13336 1 1 11 CYS HB2 H -5.141 -9.017 -1.894 1.00 . A A . 8 CYS HB2 1 1 19 13337 1 1 11 CYS HB3 H -3.719 -8.150 -1.331 1.00 . A A . 8 CYS HB3 1 1 19 13338 1 1 11 CYS N N -3.630 -6.304 -3.230 1.00 . A A . 8 CYS N 1 1 19 13339 1 1 11 CYS O O -6.352 -8.277 -4.491 1.00 . A A . 8 CYS O 1 1 19 13340 1 1 11 CYS SG S -5.721 -6.985 -0.830 1.00 . A A . 8 CYS SG 1 1 19 13341 1 1 12 GLY C C -8.635 -6.323 -4.392 1.00 . A A . 9 GLY C 1 1 19 13342 1 1 12 GLY CA C -7.336 -5.670 -4.820 1.00 . A A . 9 GLY CA 1 1 19 13343 1 1 12 GLY H H -5.658 -5.382 -3.575 1.00 . A A . 9 GLY H 1 1 19 13344 1 1 12 GLY HA2 H -7.452 -4.601 -4.734 1.00 . A A . 9 GLY HA2 1 1 19 13345 1 1 12 GLY HA3 H -7.155 -5.911 -5.856 1.00 . A A . 9 GLY HA3 1 1 19 13346 1 1 12 GLY N N -6.169 -6.068 -4.048 1.00 . A A . 9 GLY N 1 1 19 13347 1 1 12 GLY O O -9.490 -6.583 -5.234 1.00 . A A . 9 GLY O 1 1 19 13348 1 1 13 ILE C C -10.837 -6.459 -1.628 1.00 . A A . 10 ILE C 1 1 19 13349 1 1 13 ILE CA C -10.031 -7.256 -2.658 1.00 . A A . 10 ILE CA 1 1 19 13350 1 1 13 ILE CB C -9.736 -8.684 -2.126 1.00 . A A . 10 ILE CB 1 1 19 13351 1 1 13 ILE CD1 C -8.863 -8.099 0.201 1.00 . A A . 10 ILE CD1 1 1 19 13352 1 1 13 ILE CG1 C -8.554 -8.695 -1.152 1.00 . A A . 10 ILE CG1 1 1 19 13353 1 1 13 ILE CG2 C -9.472 -9.635 -3.283 1.00 . A A . 10 ILE CG2 1 1 19 13354 1 1 13 ILE H H -8.133 -6.313 -2.442 1.00 . A A . 10 ILE H 1 1 19 13355 1 1 13 ILE HA H -10.651 -7.368 -3.534 1.00 . A A . 10 ILE HA 1 1 19 13356 1 1 13 ILE HB H -10.618 -9.033 -1.608 1.00 . A A . 10 ILE HB 1 1 19 13357 1 1 13 ILE HD11 H -7.970 -8.095 0.807 1.00 . A A . 10 ILE HD11 1 1 19 13358 1 1 13 ILE HD12 H -9.627 -8.686 0.686 1.00 . A A . 10 ILE HD12 1 1 19 13359 1 1 13 ILE HD13 H -9.216 -7.085 0.069 1.00 . A A . 10 ILE HD13 1 1 19 13360 1 1 13 ILE HG12 H -8.235 -9.713 -0.998 1.00 . A A . 10 ILE HG12 1 1 19 13361 1 1 13 ILE HG13 H -7.739 -8.132 -1.584 1.00 . A A . 10 ILE HG13 1 1 19 13362 1 1 13 ILE HG21 H -8.610 -9.294 -3.839 1.00 . A A . 10 ILE HG21 1 1 19 13363 1 1 13 ILE HG22 H -10.333 -9.659 -3.934 1.00 . A A . 10 ILE HG22 1 1 19 13364 1 1 13 ILE HG23 H -9.282 -10.626 -2.899 1.00 . A A . 10 ILE HG23 1 1 19 13365 1 1 13 ILE N N -8.818 -6.575 -3.099 1.00 . A A . 10 ILE N 1 1 19 13366 1 1 13 ILE O O -11.976 -6.819 -1.327 1.00 . A A . 10 ILE O 1 1 19 13367 1 1 14 LYS C C -10.497 -3.128 -0.106 1.00 . A A . 11 LYS C 1 1 19 13368 1 1 14 LYS CA C -10.989 -4.569 -0.113 1.00 . A A . 11 LYS CA 1 1 19 13369 1 1 14 LYS CB C -10.868 -5.171 1.294 1.00 . A A . 11 LYS CB 1 1 19 13370 1 1 14 LYS CD C -9.418 -5.731 3.272 1.00 . A A . 11 LYS CD 1 1 19 13371 1 1 14 LYS CE C -10.298 -5.001 4.276 1.00 . A A . 11 LYS CE 1 1 19 13372 1 1 14 LYS CG C -9.473 -5.084 1.894 1.00 . A A . 11 LYS CG 1 1 19 13373 1 1 14 LYS H H -9.376 -5.109 -1.380 1.00 . A A . 11 LYS H 1 1 19 13374 1 1 14 LYS HA H -12.029 -4.569 -0.397 1.00 . A A . 11 LYS HA 1 1 19 13375 1 1 14 LYS HB2 H -11.548 -4.650 1.949 1.00 . A A . 11 LYS HB2 1 1 19 13376 1 1 14 LYS HB3 H -11.154 -6.212 1.250 1.00 . A A . 11 LYS HB3 1 1 19 13377 1 1 14 LYS HD2 H -9.754 -6.755 3.192 1.00 . A A . 11 LYS HD2 1 1 19 13378 1 1 14 LYS HD3 H -8.396 -5.715 3.625 1.00 . A A . 11 LYS HD3 1 1 19 13379 1 1 14 LYS HE2 H -9.921 -3.999 4.401 1.00 . A A . 11 LYS HE2 1 1 19 13380 1 1 14 LYS HE3 H -11.304 -4.959 3.889 1.00 . A A . 11 LYS HE3 1 1 19 13381 1 1 14 LYS HG2 H -8.777 -5.588 1.243 1.00 . A A . 11 LYS HG2 1 1 19 13382 1 1 14 LYS HG3 H -9.196 -4.045 1.984 1.00 . A A . 11 LYS HG3 1 1 19 13383 1 1 14 LYS HZ1 H -10.674 -6.649 5.502 1.00 . A A . 11 LYS HZ1 1 1 19 13384 1 1 14 LYS HZ2 H -10.938 -5.160 6.252 1.00 . A A . 11 LYS HZ2 1 1 19 13385 1 1 14 LYS HZ3 H -9.361 -5.708 6.001 1.00 . A A . 11 LYS HZ3 1 1 19 13386 1 1 14 LYS N N -10.271 -5.377 -1.096 1.00 . A A . 11 LYS N 1 1 19 13387 1 1 14 LYS NZ N -10.317 -5.676 5.600 1.00 . A A . 11 LYS NZ 1 1 19 13388 1 1 14 LYS O O -9.543 -2.787 -0.815 1.00 . A A . 11 LYS O 1 1 19 13389 1 1 15 GLU C C -9.414 -0.634 1.285 1.00 . A A . 12 GLU C 1 1 19 13390 1 1 15 GLU CA C -10.836 -0.875 0.802 1.00 . A A . 12 GLU CA 1 1 19 13391 1 1 15 GLU CB C -11.797 -0.180 1.761 1.00 . A A . 12 GLU CB 1 1 19 13392 1 1 15 GLU CD C -14.113 0.682 2.200 1.00 . A A . 12 GLU CD 1 1 19 13393 1 1 15 GLU CG C -13.182 0.043 1.193 1.00 . A A . 12 GLU CG 1 1 19 13394 1 1 15 GLU H H -11.891 -2.653 1.247 1.00 . A A . 12 GLU H 1 1 19 13395 1 1 15 GLU HA H -10.950 -0.439 -0.178 1.00 . A A . 12 GLU HA 1 1 19 13396 1 1 15 GLU HB2 H -11.892 -0.781 2.651 1.00 . A A . 12 GLU HB2 1 1 19 13397 1 1 15 GLU HB3 H -11.384 0.779 2.029 1.00 . A A . 12 GLU HB3 1 1 19 13398 1 1 15 GLU HG2 H -13.101 0.691 0.333 1.00 . A A . 12 GLU HG2 1 1 19 13399 1 1 15 GLU HG3 H -13.595 -0.908 0.893 1.00 . A A . 12 GLU HG3 1 1 19 13400 1 1 15 GLU N N -11.156 -2.297 0.700 1.00 . A A . 12 GLU N 1 1 19 13401 1 1 15 GLU O O -8.807 -1.472 1.958 1.00 . A A . 12 GLU O 1 1 19 13402 1 1 15 GLU OE1 O -13.969 1.896 2.468 1.00 . A A . 12 GLU OE1 1 1 19 13403 1 1 15 GLU OE2 O -14.987 -0.027 2.738 1.00 . A A . 12 GLU OE2 1 1 19 13404 1 1 16 PHE C C -7.639 1.582 2.753 1.00 . A A . 13 PHE C 1 1 19 13405 1 1 16 PHE CA C -7.575 0.951 1.369 1.00 . A A . 13 PHE CA 1 1 19 13406 1 1 16 PHE CB C -6.968 1.944 0.373 1.00 . A A . 13 PHE CB 1 1 19 13407 1 1 16 PHE CD1 C -8.556 3.875 -0.005 1.00 . A A . 13 PHE CD1 1 1 19 13408 1 1 16 PHE CD2 C -6.604 4.250 1.313 1.00 . A A . 13 PHE CD2 1 1 19 13409 1 1 16 PHE CE1 C -8.926 5.193 0.162 1.00 . A A . 13 PHE CE1 1 1 19 13410 1 1 16 PHE CE2 C -6.971 5.569 1.485 1.00 . A A . 13 PHE CE2 1 1 19 13411 1 1 16 PHE CG C -7.389 3.384 0.567 1.00 . A A . 13 PHE CG 1 1 19 13412 1 1 16 PHE CZ C -8.132 6.042 0.906 1.00 . A A . 13 PHE CZ 1 1 19 13413 1 1 16 PHE H H -9.420 1.118 0.346 1.00 . A A . 13 PHE H 1 1 19 13414 1 1 16 PHE HA H -6.949 0.074 1.413 1.00 . A A . 13 PHE HA 1 1 19 13415 1 1 16 PHE HB2 H -5.896 1.905 0.439 1.00 . A A . 13 PHE HB2 1 1 19 13416 1 1 16 PHE HB3 H -7.261 1.646 -0.619 1.00 . A A . 13 PHE HB3 1 1 19 13417 1 1 16 PHE HD1 H -9.178 3.210 -0.604 1.00 . A A . 13 PHE HD1 1 1 19 13418 1 1 16 PHE HD2 H -5.697 3.879 1.770 1.00 . A A . 13 PHE HD2 1 1 19 13419 1 1 16 PHE HE1 H -9.836 5.559 -0.294 1.00 . A A . 13 PHE HE1 1 1 19 13420 1 1 16 PHE HE2 H -6.346 6.233 2.063 1.00 . A A . 13 PHE HE2 1 1 19 13421 1 1 16 PHE HZ H -8.419 7.074 1.038 1.00 . A A . 13 PHE HZ 1 1 19 13422 1 1 16 PHE N N -8.897 0.530 0.931 1.00 . A A . 13 PHE N 1 1 19 13423 1 1 16 PHE O O -8.677 2.095 3.171 1.00 . A A . 13 PHE O 1 1 19 13424 1 1 17 LYS C C -5.031 2.836 4.867 1.00 . A A . 14 LYS C 1 1 19 13425 1 1 17 LYS CA C -6.392 2.155 4.757 1.00 . A A . 14 LYS CA 1 1 19 13426 1 1 17 LYS CB C -6.567 1.088 5.842 1.00 . A A . 14 LYS CB 1 1 19 13427 1 1 17 LYS CD C -6.843 0.510 8.265 1.00 . A A . 14 LYS CD 1 1 19 13428 1 1 17 LYS CE C -6.762 0.997 9.702 1.00 . A A . 14 LYS CE 1 1 19 13429 1 1 17 LYS CG C -6.521 1.612 7.268 1.00 . A A . 14 LYS CG 1 1 19 13430 1 1 17 LYS H H -5.748 1.060 3.073 1.00 . A A . 14 LYS H 1 1 19 13431 1 1 17 LYS HA H -7.167 2.897 4.856 1.00 . A A . 14 LYS HA 1 1 19 13432 1 1 17 LYS HB2 H -7.521 0.604 5.695 1.00 . A A . 14 LYS HB2 1 1 19 13433 1 1 17 LYS HB3 H -5.785 0.353 5.727 1.00 . A A . 14 LYS HB3 1 1 19 13434 1 1 17 LYS HD2 H -7.843 0.151 8.075 1.00 . A A . 14 LYS HD2 1 1 19 13435 1 1 17 LYS HD3 H -6.139 -0.299 8.129 1.00 . A A . 14 LYS HD3 1 1 19 13436 1 1 17 LYS HE2 H -7.346 1.899 9.796 1.00 . A A . 14 LYS HE2 1 1 19 13437 1 1 17 LYS HE3 H -7.172 0.237 10.350 1.00 . A A . 14 LYS HE3 1 1 19 13438 1 1 17 LYS HG2 H -5.531 1.992 7.472 1.00 . A A . 14 LYS HG2 1 1 19 13439 1 1 17 LYS HG3 H -7.245 2.407 7.376 1.00 . A A . 14 LYS HG3 1 1 19 13440 1 1 17 LYS HZ1 H -4.953 2.030 9.524 1.00 . A A . 14 LYS HZ1 1 1 19 13441 1 1 17 LYS HZ2 H -4.781 0.427 10.038 1.00 . A A . 14 LYS HZ2 1 1 19 13442 1 1 17 LYS HZ3 H -5.344 1.603 11.111 1.00 . A A . 14 LYS HZ3 1 1 19 13443 1 1 17 LYS N N -6.521 1.537 3.449 1.00 . A A . 14 LYS N 1 1 19 13444 1 1 17 LYS NZ N -5.363 1.285 10.120 1.00 . A A . 14 LYS NZ 1 1 19 13445 1 1 17 LYS O O -4.775 3.612 5.788 1.00 . A A . 14 LYS O 1 1 19 13446 1 1 18 TYR C C -2.496 3.620 2.505 1.00 . A A . 15 TYR C 1 1 19 13447 1 1 18 TYR CA C -2.820 3.093 3.886 1.00 . A A . 15 TYR CA 1 1 19 13448 1 1 18 TYR CB C -1.781 2.034 4.262 1.00 . A A . 15 TYR CB 1 1 19 13449 1 1 18 TYR CD1 C -2.925 0.619 5.992 1.00 . A A . 15 TYR CD1 1 1 19 13450 1 1 18 TYR CD2 C -1.030 1.894 6.656 1.00 . A A . 15 TYR CD2 1 1 19 13451 1 1 18 TYR CE1 C -3.055 0.130 7.277 1.00 . A A . 15 TYR CE1 1 1 19 13452 1 1 18 TYR CE2 C -1.149 1.412 7.943 1.00 . A A . 15 TYR CE2 1 1 19 13453 1 1 18 TYR CG C -1.915 1.506 5.664 1.00 . A A . 15 TYR CG 1 1 19 13454 1 1 18 TYR CZ C -2.163 0.531 8.249 1.00 . A A . 15 TYR CZ 1 1 19 13455 1 1 18 TYR H H -4.432 1.928 3.196 1.00 . A A . 15 TYR H 1 1 19 13456 1 1 18 TYR HA H -2.775 3.906 4.596 1.00 . A A . 15 TYR HA 1 1 19 13457 1 1 18 TYR HB2 H -1.875 1.197 3.586 1.00 . A A . 15 TYR HB2 1 1 19 13458 1 1 18 TYR HB3 H -0.794 2.460 4.160 1.00 . A A . 15 TYR HB3 1 1 19 13459 1 1 18 TYR HD1 H -3.623 0.315 5.220 1.00 . A A . 15 TYR HD1 1 1 19 13460 1 1 18 TYR HD2 H -0.237 2.586 6.406 1.00 . A A . 15 TYR HD2 1 1 19 13461 1 1 18 TYR HE1 H -3.847 -0.562 7.516 1.00 . A A . 15 TYR HE1 1 1 19 13462 1 1 18 TYR HE2 H -0.447 1.722 8.704 1.00 . A A . 15 TYR HE2 1 1 19 13463 1 1 18 TYR HH H -2.165 0.779 10.159 1.00 . A A . 15 TYR HH 1 1 19 13464 1 1 18 TYR N N -4.162 2.538 3.912 1.00 . A A . 15 TYR N 1 1 19 13465 1 1 18 TYR O O -3.246 3.402 1.551 1.00 . A A . 15 TYR O 1 1 19 13466 1 1 18 TYR OH O -2.290 0.053 9.533 1.00 . A A . 15 TYR OH 1 1 19 13467 1 1 19 LYS C C 0.621 4.962 1.204 1.00 . A A . 16 LYS C 1 1 19 13468 1 1 19 LYS CA C -0.891 4.811 1.138 1.00 . A A . 16 LYS CA 1 1 19 13469 1 1 19 LYS CB C -1.561 6.159 0.845 1.00 . A A . 16 LYS CB 1 1 19 13470 1 1 19 LYS CD C -2.010 8.022 -0.779 1.00 . A A . 16 LYS CD 1 1 19 13471 1 1 19 LYS CE C -1.736 9.060 0.298 1.00 . A A . 16 LYS CE 1 1 19 13472 1 1 19 LYS CG C -1.235 6.738 -0.524 1.00 . A A . 16 LYS CG 1 1 19 13473 1 1 19 LYS H H -0.827 4.438 3.210 1.00 . A A . 16 LYS H 1 1 19 13474 1 1 19 LYS HA H -1.146 4.107 0.360 1.00 . A A . 16 LYS HA 1 1 19 13475 1 1 19 LYS HB2 H -2.632 6.033 0.912 1.00 . A A . 16 LYS HB2 1 1 19 13476 1 1 19 LYS HB3 H -1.246 6.869 1.596 1.00 . A A . 16 LYS HB3 1 1 19 13477 1 1 19 LYS HD2 H -1.717 8.426 -1.736 1.00 . A A . 16 LYS HD2 1 1 19 13478 1 1 19 LYS HD3 H -3.067 7.798 -0.788 1.00 . A A . 16 LYS HD3 1 1 19 13479 1 1 19 LYS HE2 H -2.130 8.695 1.234 1.00 . A A . 16 LYS HE2 1 1 19 13480 1 1 19 LYS HE3 H -0.669 9.195 0.386 1.00 . A A . 16 LYS HE3 1 1 19 13481 1 1 19 LYS HG2 H -0.178 6.954 -0.576 1.00 . A A . 16 LYS HG2 1 1 19 13482 1 1 19 LYS HG3 H -1.495 6.015 -1.283 1.00 . A A . 16 LYS HG3 1 1 19 13483 1 1 19 LYS HZ1 H -2.016 10.729 -0.923 1.00 . A A . 16 LYS HZ1 1 1 19 13484 1 1 19 LYS HZ2 H -2.143 11.059 0.730 1.00 . A A . 16 LYS HZ2 1 1 19 13485 1 1 19 LYS HZ3 H -3.400 10.264 -0.070 1.00 . A A . 16 LYS HZ3 1 1 19 13486 1 1 19 LYS N N -1.365 4.287 2.402 1.00 . A A . 16 LYS N 1 1 19 13487 1 1 19 LYS NZ N -2.369 10.369 -0.012 1.00 . A A . 16 LYS NZ 1 1 19 13488 1 1 19 LYS O O 1.125 5.885 1.844 1.00 . A A . 16 LYS O 1 1 19 13489 1 1 20 CYS C C 3.332 5.421 0.201 1.00 . A A . 17 CYS C 1 1 19 13490 1 1 20 CYS CA C 2.799 4.044 0.583 1.00 . A A . 17 CYS CA 1 1 19 13491 1 1 20 CYS CB C 3.369 2.996 -0.383 1.00 . A A . 17 CYS CB 1 1 19 13492 1 1 20 CYS H H 0.867 3.298 0.122 1.00 . A A . 17 CYS H 1 1 19 13493 1 1 20 CYS HA H 3.129 3.810 1.584 1.00 . A A . 17 CYS HA 1 1 19 13494 1 1 20 CYS HB2 H 3.073 2.013 -0.055 1.00 . A A . 17 CYS HB2 1 1 19 13495 1 1 20 CYS HB3 H 2.981 3.178 -1.374 1.00 . A A . 17 CYS HB3 1 1 19 13496 1 1 20 CYS N N 1.337 4.023 0.584 1.00 . A A . 17 CYS N 1 1 19 13497 1 1 20 CYS O O 2.957 5.971 -0.827 1.00 . A A . 17 CYS O 1 1 19 13498 1 1 20 CYS SG S 5.179 3.036 -0.475 1.00 . A A . 17 CYS SG 1 1 19 13499 1 1 21 PRO C C 5.708 7.279 -0.486 1.00 . A A . 18 PRO C 1 1 19 13500 1 1 21 PRO CA C 4.825 7.297 0.759 1.00 . A A . 18 PRO CA 1 1 19 13501 1 1 21 PRO CB C 5.671 7.566 2.007 1.00 . A A . 18 PRO CB 1 1 19 13502 1 1 21 PRO CD C 4.686 5.412 2.299 1.00 . A A . 18 PRO CD 1 1 19 13503 1 1 21 PRO CG C 5.901 6.230 2.621 1.00 . A A . 18 PRO CG 1 1 19 13504 1 1 21 PRO HA H 4.074 8.067 0.655 1.00 . A A . 18 PRO HA 1 1 19 13505 1 1 21 PRO HB2 H 6.603 8.028 1.717 1.00 . A A . 18 PRO HB2 1 1 19 13506 1 1 21 PRO HB3 H 5.134 8.220 2.675 1.00 . A A . 18 PRO HB3 1 1 19 13507 1 1 21 PRO HD2 H 4.954 4.372 2.176 1.00 . A A . 18 PRO HD2 1 1 19 13508 1 1 21 PRO HD3 H 3.940 5.523 3.071 1.00 . A A . 18 PRO HD3 1 1 19 13509 1 1 21 PRO HG2 H 6.782 5.778 2.192 1.00 . A A . 18 PRO HG2 1 1 19 13510 1 1 21 PRO HG3 H 6.011 6.332 3.690 1.00 . A A . 18 PRO HG3 1 1 19 13511 1 1 21 PRO N N 4.218 5.989 1.028 1.00 . A A . 18 PRO N 1 1 19 13512 1 1 21 PRO O O 6.061 8.323 -1.029 1.00 . A A . 18 PRO O 1 1 19 13513 1 1 22 ARG C C 6.103 5.533 -3.335 1.00 . A A . 19 ARG C 1 1 19 13514 1 1 22 ARG CA C 6.915 5.921 -2.102 1.00 . A A . 19 ARG CA 1 1 19 13515 1 1 22 ARG CB C 7.991 4.870 -1.831 1.00 . A A . 19 ARG CB 1 1 19 13516 1 1 22 ARG CD C 10.126 4.277 -0.626 1.00 . A A . 19 ARG CD 1 1 19 13517 1 1 22 ARG CG C 9.038 5.321 -0.821 1.00 . A A . 19 ARG CG 1 1 19 13518 1 1 22 ARG CZ C 11.998 3.328 -1.925 1.00 . A A . 19 ARG CZ 1 1 19 13519 1 1 22 ARG H H 5.747 5.284 -0.455 1.00 . A A . 19 ARG H 1 1 19 13520 1 1 22 ARG HA H 7.395 6.869 -2.289 1.00 . A A . 19 ARG HA 1 1 19 13521 1 1 22 ARG HB2 H 7.515 3.979 -1.447 1.00 . A A . 19 ARG HB2 1 1 19 13522 1 1 22 ARG HB3 H 8.485 4.631 -2.760 1.00 . A A . 19 ARG HB3 1 1 19 13523 1 1 22 ARG HD2 H 10.850 4.660 0.076 1.00 . A A . 19 ARG HD2 1 1 19 13524 1 1 22 ARG HD3 H 9.675 3.383 -0.221 1.00 . A A . 19 ARG HD3 1 1 19 13525 1 1 22 ARG HE H 10.364 4.174 -2.716 1.00 . A A . 19 ARG HE 1 1 19 13526 1 1 22 ARG HG2 H 9.492 6.237 -1.169 1.00 . A A . 19 ARG HG2 1 1 19 13527 1 1 22 ARG HG3 H 8.550 5.499 0.131 1.00 . A A . 19 ARG HG3 1 1 19 13528 1 1 22 ARG HH11 H 12.210 3.162 0.090 1.00 . A A . 19 ARG HH11 1 1 19 13529 1 1 22 ARG HH12 H 13.520 2.522 -0.852 1.00 . A A . 19 ARG HH12 1 1 19 13530 1 1 22 ARG HH21 H 12.072 3.318 -3.947 1.00 . A A . 19 ARG HH21 1 1 19 13531 1 1 22 ARG HH22 H 13.439 2.609 -3.150 1.00 . A A . 19 ARG HH22 1 1 19 13532 1 1 22 ARG N N 6.064 6.081 -0.932 1.00 . A A . 19 ARG N 1 1 19 13533 1 1 22 ARG NE N 10.813 3.937 -1.871 1.00 . A A . 19 ARG NE 1 1 19 13534 1 1 22 ARG NH1 N 12.627 2.976 -0.807 1.00 . A A . 19 ARG NH1 1 1 19 13535 1 1 22 ARG NH2 N 12.548 3.064 -3.099 1.00 . A A . 19 ARG NH2 1 1 19 13536 1 1 22 ARG O O 6.260 6.120 -4.405 1.00 . A A . 19 ARG O 1 1 19 13537 1 1 23 CYS C C 3.152 4.793 -4.493 1.00 . A A . 20 CYS C 1 1 19 13538 1 1 23 CYS CA C 4.459 4.034 -4.314 1.00 . A A . 20 CYS CA 1 1 19 13539 1 1 23 CYS CB C 4.133 2.551 -4.129 1.00 . A A . 20 CYS CB 1 1 19 13540 1 1 23 CYS H H 5.087 4.166 -2.291 1.00 . A A . 20 CYS H 1 1 19 13541 1 1 23 CYS HA H 5.057 4.159 -5.198 1.00 . A A . 20 CYS HA 1 1 19 13542 1 1 23 CYS HB2 H 3.503 2.437 -3.262 1.00 . A A . 20 CYS HB2 1 1 19 13543 1 1 23 CYS HB3 H 3.598 2.207 -4.997 1.00 . A A . 20 CYS HB3 1 1 19 13544 1 1 23 CYS N N 5.226 4.549 -3.181 1.00 . A A . 20 CYS N 1 1 19 13545 1 1 23 CYS O O 2.543 4.771 -5.563 1.00 . A A . 20 CYS O 1 1 19 13546 1 1 23 CYS SG S 5.557 1.470 -3.904 1.00 . A A . 20 CYS SG 1 1 19 13547 1 1 24 LEU C C 0.307 5.077 -3.505 1.00 . A A . 21 LEU C 1 1 19 13548 1 1 24 LEU CA C 1.425 6.098 -3.335 1.00 . A A . 21 LEU CA 1 1 19 13549 1 1 24 LEU CB C 1.287 7.223 -4.369 1.00 . A A . 21 LEU CB 1 1 19 13550 1 1 24 LEU CD1 C 1.956 9.527 -5.073 1.00 . A A . 21 LEU CD1 1 1 19 13551 1 1 24 LEU CD2 C 2.895 8.567 -2.967 1.00 . A A . 21 LEU CD2 1 1 19 13552 1 1 24 LEU CG C 2.414 8.259 -4.378 1.00 . A A . 21 LEU CG 1 1 19 13553 1 1 24 LEU H H 3.326 5.507 -2.640 1.00 . A A . 21 LEU H 1 1 19 13554 1 1 24 LEU HA H 1.343 6.526 -2.347 1.00 . A A . 21 LEU HA 1 1 19 13555 1 1 24 LEU HB2 H 1.234 6.773 -5.348 1.00 . A A . 21 LEU HB2 1 1 19 13556 1 1 24 LEU HB3 H 0.357 7.740 -4.181 1.00 . A A . 21 LEU HB3 1 1 19 13557 1 1 24 LEU HD11 H 1.111 9.939 -4.542 1.00 . A A . 21 LEU HD11 1 1 19 13558 1 1 24 LEU HD12 H 1.668 9.297 -6.088 1.00 . A A . 21 LEU HD12 1 1 19 13559 1 1 24 LEU HD13 H 2.762 10.245 -5.080 1.00 . A A . 21 LEU HD13 1 1 19 13560 1 1 24 LEU HD21 H 3.638 9.349 -3.003 1.00 . A A . 21 LEU HD21 1 1 19 13561 1 1 24 LEU HD22 H 3.333 7.675 -2.539 1.00 . A A . 21 LEU HD22 1 1 19 13562 1 1 24 LEU HD23 H 2.060 8.886 -2.361 1.00 . A A . 21 LEU HD23 1 1 19 13563 1 1 24 LEU HG H 3.250 7.862 -4.936 1.00 . A A . 21 LEU HG 1 1 19 13564 1 1 24 LEU N N 2.729 5.445 -3.416 1.00 . A A . 21 LEU N 1 1 19 13565 1 1 24 LEU O O -0.836 5.430 -3.794 1.00 . A A . 21 LEU O 1 1 19 13566 1 1 25 VAL C C -1.200 2.620 -2.247 1.00 . A A . 22 VAL C 1 1 19 13567 1 1 25 VAL CA C -0.305 2.731 -3.472 1.00 . A A . 22 VAL CA 1 1 19 13568 1 1 25 VAL CB C 0.388 1.372 -3.772 1.00 . A A . 22 VAL CB 1 1 19 13569 1 1 25 VAL CG1 C 1.253 0.904 -2.610 1.00 . A A . 22 VAL CG1 1 1 19 13570 1 1 25 VAL CG2 C -0.643 0.311 -4.131 1.00 . A A . 22 VAL CG2 1 1 19 13571 1 1 25 VAL H H 1.553 3.599 -3.025 1.00 . A A . 22 VAL H 1 1 19 13572 1 1 25 VAL HA H -0.923 2.983 -4.321 1.00 . A A . 22 VAL HA 1 1 19 13573 1 1 25 VAL HB H 1.031 1.509 -4.627 1.00 . A A . 22 VAL HB 1 1 19 13574 1 1 25 VAL HG11 H 1.962 1.673 -2.354 1.00 . A A . 22 VAL HG11 1 1 19 13575 1 1 25 VAL HG12 H 1.784 0.005 -2.893 1.00 . A A . 22 VAL HG12 1 1 19 13576 1 1 25 VAL HG13 H 0.625 0.695 -1.757 1.00 . A A . 22 VAL HG13 1 1 19 13577 1 1 25 VAL HG21 H -1.331 0.184 -3.308 1.00 . A A . 22 VAL HG21 1 1 19 13578 1 1 25 VAL HG22 H -0.142 -0.626 -4.328 1.00 . A A . 22 VAL HG22 1 1 19 13579 1 1 25 VAL HG23 H -1.187 0.621 -5.011 1.00 . A A . 22 VAL HG23 1 1 19 13580 1 1 25 VAL N N 0.646 3.807 -3.301 1.00 . A A . 22 VAL N 1 1 19 13581 1 1 25 VAL O O -0.730 2.501 -1.109 1.00 . A A . 22 VAL O 1 1 19 13582 1 1 26 GLN C C -3.626 1.143 -1.029 1.00 . A A . 23 GLN C 1 1 19 13583 1 1 26 GLN CA C -3.497 2.598 -1.464 1.00 . A A . 23 GLN CA 1 1 19 13584 1 1 26 GLN CB C -4.830 3.134 -1.995 1.00 . A A . 23 GLN CB 1 1 19 13585 1 1 26 GLN CD C -6.000 5.023 -3.210 1.00 . A A . 23 GLN CD 1 1 19 13586 1 1 26 GLN CG C -4.753 4.578 -2.468 1.00 . A A . 23 GLN CG 1 1 19 13587 1 1 26 GLN H H -2.770 2.861 -3.427 1.00 . A A . 23 GLN H 1 1 19 13588 1 1 26 GLN HA H -3.183 3.189 -0.609 1.00 . A A . 23 GLN HA 1 1 19 13589 1 1 26 GLN HB2 H -5.148 2.521 -2.825 1.00 . A A . 23 GLN HB2 1 1 19 13590 1 1 26 GLN HB3 H -5.569 3.075 -1.210 1.00 . A A . 23 GLN HB3 1 1 19 13591 1 1 26 GLN HE21 H -6.815 5.690 -1.527 1.00 . A A . 23 GLN HE21 1 1 19 13592 1 1 26 GLN HE22 H -7.778 5.872 -2.953 1.00 . A A . 23 GLN HE22 1 1 19 13593 1 1 26 GLN HG2 H -4.614 5.217 -1.609 1.00 . A A . 23 GLN HG2 1 1 19 13594 1 1 26 GLN HG3 H -3.904 4.678 -3.130 1.00 . A A . 23 GLN HG3 1 1 19 13595 1 1 26 GLN N N -2.486 2.711 -2.500 1.00 . A A . 23 GLN N 1 1 19 13596 1 1 26 GLN NE2 N -6.958 5.586 -2.491 1.00 . A A . 23 GLN NE2 1 1 19 13597 1 1 26 GLN O O -4.225 0.319 -1.724 1.00 . A A . 23 GLN O 1 1 19 13598 1 1 26 GLN OE1 O -6.094 4.880 -4.428 1.00 . A A . 23 GLN OE1 1 1 19 13599 1 1 27 THR C C -4.076 -0.716 1.693 1.00 . A A . 24 THR C 1 1 19 13600 1 1 27 THR CA C -3.018 -0.525 0.619 1.00 . A A . 24 THR CA 1 1 19 13601 1 1 27 THR CB C -1.629 -0.875 1.178 1.00 . A A . 24 THR CB 1 1 19 13602 1 1 27 THR CG2 C -0.710 -1.348 0.068 1.00 . A A . 24 THR CG2 1 1 19 13603 1 1 27 THR H H -2.628 1.547 0.644 1.00 . A A . 24 THR H 1 1 19 13604 1 1 27 THR HA H -3.231 -1.192 -0.205 1.00 . A A . 24 THR HA 1 1 19 13605 1 1 27 THR HB H -1.738 -1.674 1.897 1.00 . A A . 24 THR HB 1 1 19 13606 1 1 27 THR HG1 H -0.698 0.865 1.168 1.00 . A A . 24 THR HG1 1 1 19 13607 1 1 27 THR HG21 H 0.265 -1.569 0.478 1.00 . A A . 24 THR HG21 1 1 19 13608 1 1 27 THR HG22 H -0.620 -0.576 -0.681 1.00 . A A . 24 THR HG22 1 1 19 13609 1 1 27 THR HG23 H -1.122 -2.240 -0.379 1.00 . A A . 24 THR HG23 1 1 19 13610 1 1 27 THR N N -3.041 0.832 0.112 1.00 . A A . 24 THR N 1 1 19 13611 1 1 27 THR O O -4.420 0.216 2.416 1.00 . A A . 24 THR O 1 1 19 13612 1 1 27 THR OG1 O -1.055 0.263 1.830 1.00 . A A . 24 THR OG1 1 1 19 13613 1 1 28 CYS C C -5.186 -2.366 4.116 1.00 . A A . 25 CYS C 1 1 19 13614 1 1 28 CYS CA C -5.692 -2.242 2.687 1.00 . A A . 25 CYS CA 1 1 19 13615 1 1 28 CYS CB C -6.394 -3.535 2.258 1.00 . A A . 25 CYS CB 1 1 19 13616 1 1 28 CYS H H -4.250 -2.636 1.197 1.00 . A A . 25 CYS H 1 1 19 13617 1 1 28 CYS HA H -6.401 -1.429 2.643 1.00 . A A . 25 CYS HA 1 1 19 13618 1 1 28 CYS HB2 H -7.273 -3.685 2.864 1.00 . A A . 25 CYS HB2 1 1 19 13619 1 1 28 CYS HB3 H -6.692 -3.444 1.227 1.00 . A A . 25 CYS HB3 1 1 19 13620 1 1 28 CYS N N -4.601 -1.932 1.773 1.00 . A A . 25 CYS N 1 1 19 13621 1 1 28 CYS O O -5.907 -2.057 5.064 1.00 . A A . 25 CYS O 1 1 19 13622 1 1 28 CYS SG S -5.375 -5.017 2.401 1.00 . A A . 25 CYS SG 1 1 19 13623 1 1 29 SER C C -1.829 -3.075 5.457 1.00 . A A . 26 SER C 1 1 19 13624 1 1 29 SER CA C -3.346 -3.011 5.579 1.00 . A A . 26 SER CA 1 1 19 13625 1 1 29 SER CB C -3.877 -4.292 6.244 1.00 . A A . 26 SER CB 1 1 19 13626 1 1 29 SER H H -3.406 -3.015 3.464 1.00 . A A . 26 SER H 1 1 19 13627 1 1 29 SER HA H -3.610 -2.161 6.189 1.00 . A A . 26 SER HA 1 1 19 13628 1 1 29 SER HB2 H -3.675 -5.137 5.604 1.00 . A A . 26 SER HB2 1 1 19 13629 1 1 29 SER HB3 H -3.379 -4.433 7.191 1.00 . A A . 26 SER HB3 1 1 19 13630 1 1 29 SER HG H -5.609 -3.371 6.128 1.00 . A A . 26 SER HG 1 1 19 13631 1 1 29 SER N N -3.944 -2.818 4.265 1.00 . A A . 26 SER N 1 1 19 13632 1 1 29 SER O O -1.311 -3.159 4.339 1.00 . A A . 26 SER O 1 1 19 13633 1 1 29 SER OG O -5.277 -4.216 6.470 1.00 . A A . 26 SER OG 1 1 19 13634 1 1 30 LEU C C 0.860 -4.322 5.854 1.00 . A A . 27 LEU C 1 1 19 13635 1 1 30 LEU CA C 0.335 -3.091 6.591 1.00 . A A . 27 LEU CA 1 1 19 13636 1 1 30 LEU CB C 0.869 -3.071 8.025 1.00 . A A . 27 LEU CB 1 1 19 13637 1 1 30 LEU CD1 C 1.112 -1.893 10.222 1.00 . A A . 27 LEU CD1 1 1 19 13638 1 1 30 LEU CD2 C 1.579 -0.667 8.096 1.00 . A A . 27 LEU CD2 1 1 19 13639 1 1 30 LEU CG C 0.723 -1.737 8.760 1.00 . A A . 27 LEU CG 1 1 19 13640 1 1 30 LEU H H -1.607 -3.016 7.447 1.00 . A A . 27 LEU H 1 1 19 13641 1 1 30 LEU HA H 0.682 -2.208 6.078 1.00 . A A . 27 LEU HA 1 1 19 13642 1 1 30 LEU HB2 H 0.349 -3.829 8.592 1.00 . A A . 27 LEU HB2 1 1 19 13643 1 1 30 LEU HB3 H 1.917 -3.324 7.997 1.00 . A A . 27 LEU HB3 1 1 19 13644 1 1 30 LEU HD11 H 0.467 -2.621 10.690 1.00 . A A . 27 LEU HD11 1 1 19 13645 1 1 30 LEU HD12 H 1.008 -0.942 10.724 1.00 . A A . 27 LEU HD12 1 1 19 13646 1 1 30 LEU HD13 H 2.139 -2.225 10.288 1.00 . A A . 27 LEU HD13 1 1 19 13647 1 1 30 LEU HD21 H 1.244 -0.515 7.082 1.00 . A A . 27 LEU HD21 1 1 19 13648 1 1 30 LEU HD22 H 2.612 -0.984 8.091 1.00 . A A . 27 LEU HD22 1 1 19 13649 1 1 30 LEU HD23 H 1.489 0.258 8.647 1.00 . A A . 27 LEU HD23 1 1 19 13650 1 1 30 LEU HG H -0.308 -1.418 8.719 1.00 . A A . 27 LEU HG 1 1 19 13651 1 1 30 LEU N N -1.129 -3.055 6.588 1.00 . A A . 27 LEU N 1 1 19 13652 1 1 30 LEU O O 1.934 -4.285 5.253 1.00 . A A . 27 LEU O 1 1 19 13653 1 1 31 GLU C C 0.712 -6.348 3.715 1.00 . A A . 28 GLU C 1 1 19 13654 1 1 31 GLU CA C 0.404 -6.634 5.183 1.00 . A A . 28 GLU CA 1 1 19 13655 1 1 31 GLU CB C -0.774 -7.605 5.281 1.00 . A A . 28 GLU CB 1 1 19 13656 1 1 31 GLU CD C 0.536 -9.734 5.579 1.00 . A A . 28 GLU CD 1 1 19 13657 1 1 31 GLU CG C -0.479 -8.992 4.739 1.00 . A A . 28 GLU CG 1 1 19 13658 1 1 31 GLU H H -0.731 -5.370 6.447 1.00 . A A . 28 GLU H 1 1 19 13659 1 1 31 GLU HA H 1.269 -7.075 5.647 1.00 . A A . 28 GLU HA 1 1 19 13660 1 1 31 GLU HB2 H -1.057 -7.703 6.316 1.00 . A A . 28 GLU HB2 1 1 19 13661 1 1 31 GLU HB3 H -1.607 -7.196 4.726 1.00 . A A . 28 GLU HB3 1 1 19 13662 1 1 31 GLU HG2 H -1.397 -9.561 4.723 1.00 . A A . 28 GLU HG2 1 1 19 13663 1 1 31 GLU HG3 H -0.095 -8.899 3.734 1.00 . A A . 28 GLU HG3 1 1 19 13664 1 1 31 GLU N N 0.082 -5.400 5.897 1.00 . A A . 28 GLU N 1 1 19 13665 1 1 31 GLU O O 1.676 -6.865 3.155 1.00 . A A . 28 GLU O 1 1 19 13666 1 1 31 GLU OE1 O 0.170 -10.204 6.676 1.00 . A A . 28 GLU OE1 1 1 19 13667 1 1 31 GLU OE2 O 1.701 -9.847 5.150 1.00 . A A . 28 GLU OE2 1 1 19 13668 1 1 32 CYS C C 1.043 -3.995 1.551 1.00 . A A . 29 CYS C 1 1 19 13669 1 1 32 CYS CA C 0.066 -5.151 1.712 1.00 . A A . 29 CYS CA 1 1 19 13670 1 1 32 CYS CB C -1.281 -4.796 1.106 1.00 . A A . 29 CYS CB 1 1 19 13671 1 1 32 CYS H H -0.831 -5.093 3.617 1.00 . A A . 29 CYS H 1 1 19 13672 1 1 32 CYS HA H 0.461 -6.014 1.201 1.00 . A A . 29 CYS HA 1 1 19 13673 1 1 32 CYS HB2 H -1.852 -4.236 1.832 1.00 . A A . 29 CYS HB2 1 1 19 13674 1 1 32 CYS HB3 H -1.130 -4.184 0.235 1.00 . A A . 29 CYS HB3 1 1 19 13675 1 1 32 CYS N N -0.102 -5.503 3.107 1.00 . A A . 29 CYS N 1 1 19 13676 1 1 32 CYS O O 1.674 -3.848 0.505 1.00 . A A . 29 CYS O 1 1 19 13677 1 1 32 CYS SG S -2.274 -6.221 0.620 1.00 . A A . 29 CYS SG 1 1 19 13678 1 1 33 SER C C 3.525 -2.567 2.481 1.00 . A A . 30 SER C 1 1 19 13679 1 1 33 SER CA C 2.090 -2.059 2.567 1.00 . A A . 30 SER CA 1 1 19 13680 1 1 33 SER CB C 1.903 -1.197 3.819 1.00 . A A . 30 SER CB 1 1 19 13681 1 1 33 SER H H 0.626 -3.334 3.394 1.00 . A A . 30 SER H 1 1 19 13682 1 1 33 SER HA H 1.877 -1.465 1.692 1.00 . A A . 30 SER HA 1 1 19 13683 1 1 33 SER HB2 H 2.262 -1.739 4.681 1.00 . A A . 30 SER HB2 1 1 19 13684 1 1 33 SER HB3 H 2.464 -0.281 3.709 1.00 . A A . 30 SER HB3 1 1 19 13685 1 1 33 SER HG H 0.187 -0.437 3.231 1.00 . A A . 30 SER HG 1 1 19 13686 1 1 33 SER N N 1.167 -3.179 2.590 1.00 . A A . 30 SER N 1 1 19 13687 1 1 33 SER O O 4.376 -1.948 1.849 1.00 . A A . 30 SER O 1 1 19 13688 1 1 33 SER OG O 0.534 -0.876 4.017 1.00 . A A . 30 SER OG 1 1 19 13689 1 1 34 LYS C C 5.228 -5.369 2.012 1.00 . A A . 31 LYS C 1 1 19 13690 1 1 34 LYS CA C 5.101 -4.310 3.104 1.00 . A A . 31 LYS CA 1 1 19 13691 1 1 34 LYS CB C 5.401 -4.923 4.475 1.00 . A A . 31 LYS CB 1 1 19 13692 1 1 34 LYS CD C 4.795 -6.603 6.243 1.00 . A A . 31 LYS CD 1 1 19 13693 1 1 34 LYS CE C 3.892 -7.766 6.614 1.00 . A A . 31 LYS CE 1 1 19 13694 1 1 34 LYS CG C 4.503 -6.093 4.842 1.00 . A A . 31 LYS CG 1 1 19 13695 1 1 34 LYS H H 3.050 -4.160 3.593 1.00 . A A . 31 LYS H 1 1 19 13696 1 1 34 LYS HA H 5.814 -3.526 2.909 1.00 . A A . 31 LYS HA 1 1 19 13697 1 1 34 LYS HB2 H 6.423 -5.267 4.484 1.00 . A A . 31 LYS HB2 1 1 19 13698 1 1 34 LYS HB3 H 5.281 -4.159 5.228 1.00 . A A . 31 LYS HB3 1 1 19 13699 1 1 34 LYS HD2 H 5.823 -6.929 6.290 1.00 . A A . 31 LYS HD2 1 1 19 13700 1 1 34 LYS HD3 H 4.637 -5.800 6.946 1.00 . A A . 31 LYS HD3 1 1 19 13701 1 1 34 LYS HE2 H 2.866 -7.438 6.566 1.00 . A A . 31 LYS HE2 1 1 19 13702 1 1 34 LYS HE3 H 4.047 -8.567 5.908 1.00 . A A . 31 LYS HE3 1 1 19 13703 1 1 34 LYS HG2 H 3.472 -5.773 4.795 1.00 . A A . 31 LYS HG2 1 1 19 13704 1 1 34 LYS HG3 H 4.666 -6.895 4.137 1.00 . A A . 31 LYS HG3 1 1 19 13705 1 1 34 LYS HZ1 H 5.134 -8.652 8.036 1.00 . A A . 31 LYS HZ1 1 1 19 13706 1 1 34 LYS HZ2 H 3.496 -9.020 8.233 1.00 . A A . 31 LYS HZ2 1 1 19 13707 1 1 34 LYS HZ3 H 4.077 -7.498 8.676 1.00 . A A . 31 LYS HZ3 1 1 19 13708 1 1 34 LYS N N 3.776 -3.713 3.105 1.00 . A A . 31 LYS N 1 1 19 13709 1 1 34 LYS NZ N 4.168 -8.269 7.984 1.00 . A A . 31 LYS NZ 1 1 19 13710 1 1 34 LYS O O 6.328 -5.824 1.699 1.00 . A A . 31 LYS O 1 1 19 13711 1 1 35 LYS C C 4.895 -6.398 -0.810 1.00 . A A . 32 LYS C 1 1 19 13712 1 1 35 LYS CA C 4.057 -6.781 0.405 1.00 . A A . 32 LYS CA 1 1 19 13713 1 1 35 LYS CB C 2.613 -7.038 -0.030 1.00 . A A . 32 LYS CB 1 1 19 13714 1 1 35 LYS CD C 2.489 -9.542 -0.046 1.00 . A A . 32 LYS CD 1 1 19 13715 1 1 35 LYS CE C 2.449 -10.794 -0.906 1.00 . A A . 32 LYS CE 1 1 19 13716 1 1 35 LYS CG C 2.444 -8.280 -0.889 1.00 . A A . 32 LYS CG 1 1 19 13717 1 1 35 LYS H H 3.267 -5.279 1.665 1.00 . A A . 32 LYS H 1 1 19 13718 1 1 35 LYS HA H 4.462 -7.682 0.841 1.00 . A A . 32 LYS HA 1 1 19 13719 1 1 35 LYS HB2 H 2.002 -7.153 0.851 1.00 . A A . 32 LYS HB2 1 1 19 13720 1 1 35 LYS HB3 H 2.261 -6.186 -0.594 1.00 . A A . 32 LYS HB3 1 1 19 13721 1 1 35 LYS HD2 H 3.400 -9.544 0.532 1.00 . A A . 32 LYS HD2 1 1 19 13722 1 1 35 LYS HD3 H 1.638 -9.547 0.620 1.00 . A A . 32 LYS HD3 1 1 19 13723 1 1 35 LYS HE2 H 2.332 -11.654 -0.263 1.00 . A A . 32 LYS HE2 1 1 19 13724 1 1 35 LYS HE3 H 1.603 -10.730 -1.575 1.00 . A A . 32 LYS HE3 1 1 19 13725 1 1 35 LYS HG2 H 1.492 -8.230 -1.396 1.00 . A A . 32 LYS HG2 1 1 19 13726 1 1 35 LYS HG3 H 3.241 -8.315 -1.617 1.00 . A A . 32 LYS HG3 1 1 19 13727 1 1 35 LYS HZ1 H 3.636 -11.825 -2.279 1.00 . A A . 32 LYS HZ1 1 1 19 13728 1 1 35 LYS HZ2 H 4.518 -11.022 -1.083 1.00 . A A . 32 LYS HZ2 1 1 19 13729 1 1 35 LYS HZ3 H 3.815 -10.145 -2.348 1.00 . A A . 32 LYS HZ3 1 1 19 13730 1 1 35 LYS N N 4.099 -5.730 1.417 1.00 . A A . 32 LYS N 1 1 19 13731 1 1 35 LYS NZ N 3.690 -10.958 -1.710 1.00 . A A . 32 LYS NZ 1 1 19 13732 1 1 35 LYS O O 5.675 -7.202 -1.319 1.00 . A A . 32 LYS O 1 1 19 13733 1 1 36 HIS C C 6.916 -4.388 -2.129 1.00 . A A . 33 HIS C 1 1 19 13734 1 1 36 HIS CA C 5.452 -4.697 -2.448 1.00 . A A . 33 HIS CA 1 1 19 13735 1 1 36 HIS CB C 4.758 -3.461 -3.057 1.00 . A A . 33 HIS CB 1 1 19 13736 1 1 36 HIS CD2 C 5.847 -1.595 -1.633 1.00 . A A . 33 HIS CD2 1 1 19 13737 1 1 36 HIS CE1 C 4.102 -0.466 -1.081 1.00 . A A . 33 HIS CE1 1 1 19 13738 1 1 36 HIS CG C 4.793 -2.227 -2.194 1.00 . A A . 33 HIS CG 1 1 19 13739 1 1 36 HIS H H 4.141 -4.545 -0.789 1.00 . A A . 33 HIS H 1 1 19 13740 1 1 36 HIS HA H 5.424 -5.498 -3.172 1.00 . A A . 33 HIS HA 1 1 19 13741 1 1 36 HIS HB2 H 5.239 -3.218 -3.993 1.00 . A A . 33 HIS HB2 1 1 19 13742 1 1 36 HIS HB3 H 3.721 -3.702 -3.248 1.00 . A A . 33 HIS HB3 1 1 19 13743 1 1 36 HIS HD1 H 2.754 -1.705 -2.077 1.00 . A A . 33 HIS HD1 1 1 19 13744 1 1 36 HIS HD2 H 6.872 -1.902 -1.715 1.00 . A A . 33 HIS HD2 1 1 19 13745 1 1 36 HIS HE1 H 3.446 0.255 -0.622 1.00 . A A . 33 HIS HE1 1 1 19 13746 1 1 36 HIS N N 4.743 -5.159 -1.260 1.00 . A A . 33 HIS N 1 1 19 13747 1 1 36 HIS ND1 N 3.686 -1.501 -1.832 1.00 . A A . 33 HIS ND1 1 1 19 13748 1 1 36 HIS NE2 N 5.417 -0.476 -0.938 1.00 . A A . 33 HIS NE2 1 1 19 13749 1 1 36 HIS O O 7.738 -4.227 -3.029 1.00 . A A . 33 HIS O 1 1 19 13750 1 1 37 LYS C C 9.577 -5.039 -0.675 1.00 . A A . 34 LYS C 1 1 19 13751 1 1 37 LYS CA C 8.579 -3.922 -0.427 1.00 . A A . 34 LYS CA 1 1 19 13752 1 1 37 LYS CB C 8.586 -3.528 1.052 1.00 . A A . 34 LYS CB 1 1 19 13753 1 1 37 LYS CD C 7.784 -1.961 2.843 1.00 . A A . 34 LYS CD 1 1 19 13754 1 1 37 LYS CE C 6.853 -0.806 3.180 1.00 . A A . 34 LYS CE 1 1 19 13755 1 1 37 LYS CG C 7.711 -2.327 1.370 1.00 . A A . 34 LYS CG 1 1 19 13756 1 1 37 LYS H H 6.586 -4.584 -0.164 1.00 . A A . 34 LYS H 1 1 19 13757 1 1 37 LYS HA H 8.863 -3.065 -1.019 1.00 . A A . 34 LYS HA 1 1 19 13758 1 1 37 LYS HB2 H 8.235 -4.366 1.636 1.00 . A A . 34 LYS HB2 1 1 19 13759 1 1 37 LYS HB3 H 9.598 -3.296 1.345 1.00 . A A . 34 LYS HB3 1 1 19 13760 1 1 37 LYS HD2 H 7.509 -2.820 3.436 1.00 . A A . 34 LYS HD2 1 1 19 13761 1 1 37 LYS HD3 H 8.798 -1.672 3.078 1.00 . A A . 34 LYS HD3 1 1 19 13762 1 1 37 LYS HE2 H 7.223 0.089 2.701 1.00 . A A . 34 LYS HE2 1 1 19 13763 1 1 37 LYS HE3 H 5.866 -1.031 2.799 1.00 . A A . 34 LYS HE3 1 1 19 13764 1 1 37 LYS HG2 H 8.044 -1.484 0.782 1.00 . A A . 34 LYS HG2 1 1 19 13765 1 1 37 LYS HG3 H 6.687 -2.562 1.116 1.00 . A A . 34 LYS HG3 1 1 19 13766 1 1 37 LYS HZ1 H 6.139 0.236 4.842 1.00 . A A . 34 LYS HZ1 1 1 19 13767 1 1 37 LYS HZ2 H 7.707 -0.361 5.036 1.00 . A A . 34 LYS HZ2 1 1 19 13768 1 1 37 LYS HZ3 H 6.386 -1.411 5.125 1.00 . A A . 34 LYS HZ3 1 1 19 13769 1 1 37 LYS N N 7.246 -4.327 -0.845 1.00 . A A . 34 LYS N 1 1 19 13770 1 1 37 LYS NZ N 6.766 -0.569 4.645 1.00 . A A . 34 LYS NZ 1 1 19 13771 1 1 37 LYS O O 10.718 -4.792 -1.058 1.00 . A A . 34 LYS O 1 1 19 13772 1 1 38 THR C C 10.230 -7.784 -2.096 1.00 . A A . 35 THR C 1 1 19 13773 1 1 38 THR CA C 9.989 -7.425 -0.626 1.00 . A A . 35 THR CA 1 1 19 13774 1 1 38 THR CB C 9.385 -8.636 0.120 1.00 . A A . 35 THR CB 1 1 19 13775 1 1 38 THR CG2 C 8.150 -9.165 -0.594 1.00 . A A . 35 THR CG2 1 1 19 13776 1 1 38 THR H H 8.180 -6.400 -0.256 1.00 . A A . 35 THR H 1 1 19 13777 1 1 38 THR HA H 10.936 -7.185 -0.166 1.00 . A A . 35 THR HA 1 1 19 13778 1 1 38 THR HB H 9.092 -8.313 1.109 1.00 . A A . 35 THR HB 1 1 19 13779 1 1 38 THR HG1 H 11.203 -9.384 -0.120 1.00 . A A . 35 THR HG1 1 1 19 13780 1 1 38 THR HG21 H 8.416 -9.472 -1.595 1.00 . A A . 35 THR HG21 1 1 19 13781 1 1 38 THR HG22 H 7.402 -8.386 -0.643 1.00 . A A . 35 THR HG22 1 1 19 13782 1 1 38 THR HG23 H 7.753 -10.011 -0.052 1.00 . A A . 35 THR HG23 1 1 19 13783 1 1 38 THR N N 9.124 -6.267 -0.495 1.00 . A A . 35 THR N 1 1 19 13784 1 1 38 THR O O 11.107 -8.588 -2.411 1.00 . A A . 35 THR O 1 1 19 13785 1 1 38 THR OG1 O 10.355 -9.686 0.239 1.00 . A A . 35 THR OG1 1 1 19 13786 1 1 39 ARG C C 10.061 -6.309 -5.234 1.00 . A A . 36 ARG C 1 1 19 13787 1 1 39 ARG CA C 9.557 -7.495 -4.414 1.00 . A A . 36 ARG CA 1 1 19 13788 1 1 39 ARG CB C 8.201 -7.964 -4.949 1.00 . A A . 36 ARG CB 1 1 19 13789 1 1 39 ARG CD C 5.762 -7.451 -5.276 1.00 . A A . 36 ARG CD 1 1 19 13790 1 1 39 ARG CG C 7.049 -7.046 -4.580 1.00 . A A . 36 ARG CG 1 1 19 13791 1 1 39 ARG CZ C 4.810 -7.400 -7.556 1.00 . A A . 36 ARG CZ 1 1 19 13792 1 1 39 ARG H H 8.812 -6.506 -2.691 1.00 . A A . 36 ARG H 1 1 19 13793 1 1 39 ARG HA H 10.265 -8.304 -4.516 1.00 . A A . 36 ARG HA 1 1 19 13794 1 1 39 ARG HB2 H 8.253 -8.025 -6.026 1.00 . A A . 36 ARG HB2 1 1 19 13795 1 1 39 ARG HB3 H 7.991 -8.946 -4.550 1.00 . A A . 36 ARG HB3 1 1 19 13796 1 1 39 ARG HD2 H 5.578 -8.496 -5.083 1.00 . A A . 36 ARG HD2 1 1 19 13797 1 1 39 ARG HD3 H 4.950 -6.861 -4.877 1.00 . A A . 36 ARG HD3 1 1 19 13798 1 1 39 ARG HE H 6.705 -6.959 -7.091 1.00 . A A . 36 ARG HE 1 1 19 13799 1 1 39 ARG HG2 H 6.898 -7.088 -3.511 1.00 . A A . 36 ARG HG2 1 1 19 13800 1 1 39 ARG HG3 H 7.301 -6.035 -4.868 1.00 . A A . 36 ARG HG3 1 1 19 13801 1 1 39 ARG HH11 H 3.494 -7.959 -6.116 1.00 . A A . 36 ARG HH11 1 1 19 13802 1 1 39 ARG HH12 H 2.852 -7.908 -7.726 1.00 . A A . 36 ARG HH12 1 1 19 13803 1 1 39 ARG HH21 H 5.870 -6.876 -9.202 1.00 . A A . 36 ARG HH21 1 1 19 13804 1 1 39 ARG HH22 H 4.204 -7.281 -9.489 1.00 . A A . 36 ARG HH22 1 1 19 13805 1 1 39 ARG N N 9.460 -7.176 -2.992 1.00 . A A . 36 ARG N 1 1 19 13806 1 1 39 ARG NE N 5.836 -7.243 -6.722 1.00 . A A . 36 ARG NE 1 1 19 13807 1 1 39 ARG NH1 N 3.623 -7.785 -7.096 1.00 . A A . 36 ARG NH1 1 1 19 13808 1 1 39 ARG NH2 N 4.974 -7.170 -8.852 1.00 . A A . 36 ARG NH2 1 1 19 13809 1 1 39 ARG O O 10.582 -6.488 -6.336 1.00 . A A . 36 ARG O 1 1 19 13810 1 1 40 ASP C C 11.336 -3.097 -4.648 1.00 . A A . 37 ASP C 1 1 19 13811 1 1 40 ASP CA C 10.314 -3.904 -5.430 1.00 . A A . 37 ASP CA 1 1 19 13812 1 1 40 ASP CB C 9.104 -3.026 -5.759 1.00 . A A . 37 ASP CB 1 1 19 13813 1 1 40 ASP CG C 8.380 -3.475 -7.010 1.00 . A A . 37 ASP CG 1 1 19 13814 1 1 40 ASP H H 9.507 -5.013 -3.816 1.00 . A A . 37 ASP H 1 1 19 13815 1 1 40 ASP HA H 10.769 -4.223 -6.355 1.00 . A A . 37 ASP HA 1 1 19 13816 1 1 40 ASP HB2 H 8.409 -3.060 -4.933 1.00 . A A . 37 ASP HB2 1 1 19 13817 1 1 40 ASP HB3 H 9.435 -2.009 -5.901 1.00 . A A . 37 ASP HB3 1 1 19 13818 1 1 40 ASP N N 9.908 -5.103 -4.704 1.00 . A A . 37 ASP N 1 1 19 13819 1 1 40 ASP O O 11.685 -1.981 -5.036 1.00 . A A . 37 ASP O 1 1 19 13820 1 1 40 ASP OD1 O 7.506 -4.363 -6.917 1.00 . A A . 37 ASP OD1 1 1 19 13821 1 1 40 ASP OD2 O 8.679 -2.937 -8.098 1.00 . A A . 37 ASP OD2 1 1 19 13822 1 1 41 ASN C C 12.356 -1.691 -2.188 1.00 . A A . 38 ASN C 1 1 19 13823 1 1 41 ASN CA C 12.824 -3.045 -2.701 1.00 . A A . 38 ASN CA 1 1 19 13824 1 1 41 ASN CB C 14.138 -2.884 -3.471 1.00 . A A . 38 ASN CB 1 1 19 13825 1 1 41 ASN CG C 14.826 -4.206 -3.749 1.00 . A A . 38 ASN CG 1 1 19 13826 1 1 41 ASN H H 11.467 -4.551 -3.289 1.00 . A A . 38 ASN H 1 1 19 13827 1 1 41 ASN HA H 12.996 -3.692 -1.854 1.00 . A A . 38 ASN HA 1 1 19 13828 1 1 41 ASN HB2 H 13.931 -2.407 -4.417 1.00 . A A . 38 ASN HB2 1 1 19 13829 1 1 41 ASN HB3 H 14.805 -2.263 -2.898 1.00 . A A . 38 ASN HB3 1 1 19 13830 1 1 41 ASN HD21 H 16.608 -3.332 -3.673 1.00 . A A . 38 ASN HD21 1 1 19 13831 1 1 41 ASN HD22 H 16.615 -5.032 -3.995 1.00 . A A . 38 ASN HD22 1 1 19 13832 1 1 41 ASN N N 11.808 -3.672 -3.543 1.00 . A A . 38 ASN N 1 1 19 13833 1 1 41 ASN ND2 N 16.148 -4.188 -3.811 1.00 . A A . 38 ASN ND2 1 1 19 13834 1 1 41 ASN O O 13.110 -0.720 -2.186 1.00 . A A . 38 ASN O 1 1 19 13835 1 1 41 ASN OD1 O 14.175 -5.239 -3.896 1.00 . A A . 38 ASN OD1 1 1 19 13836 1 1 42 CYS C C 10.561 -0.284 0.220 1.00 . A A . 39 CYS C 1 1 19 13837 1 1 42 CYS CA C 10.529 -0.379 -1.300 1.00 . A A . 39 CYS CA 1 1 19 13838 1 1 42 CYS CB C 9.089 -0.240 -1.808 1.00 . A A . 39 CYS CB 1 1 19 13839 1 1 42 CYS H H 10.571 -2.446 -1.729 1.00 . A A . 39 CYS H 1 1 19 13840 1 1 42 CYS HA H 11.121 0.426 -1.703 1.00 . A A . 39 CYS HA 1 1 19 13841 1 1 42 CYS HB2 H 9.073 -0.396 -2.876 1.00 . A A . 39 CYS HB2 1 1 19 13842 1 1 42 CYS HB3 H 8.477 -0.987 -1.330 1.00 . A A . 39 CYS HB3 1 1 19 13843 1 1 42 CYS N N 11.109 -1.630 -1.754 1.00 . A A . 39 CYS N 1 1 19 13844 1 1 42 CYS O O 10.854 -1.258 0.917 1.00 . A A . 39 CYS O 1 1 19 13845 1 1 42 CYS SG S 8.346 1.376 -1.475 1.00 . A A . 39 CYS SG 1 1 19 13846 1 1 43 SER C C 9.099 2.232 2.355 1.00 . A A . 40 SER C 1 1 19 13847 1 1 43 SER CA C 10.167 1.166 2.124 1.00 . A A . 40 SER CA 1 1 19 13848 1 1 43 SER CB C 11.520 1.633 2.656 1.00 . A A . 40 SER CB 1 1 19 13849 1 1 43 SER H H 10.106 1.641 0.092 1.00 . A A . 40 SER H 1 1 19 13850 1 1 43 SER HA H 9.878 0.254 2.618 1.00 . A A . 40 SER HA 1 1 19 13851 1 1 43 SER HB2 H 11.409 1.947 3.679 1.00 . A A . 40 SER HB2 1 1 19 13852 1 1 43 SER HB3 H 12.225 0.819 2.600 1.00 . A A . 40 SER HB3 1 1 19 13853 1 1 43 SER HG H 12.981 2.774 2.009 1.00 . A A . 40 SER HG 1 1 19 13854 1 1 43 SER N N 10.267 0.904 0.712 1.00 . A A . 40 SER N 1 1 19 13855 1 1 43 SER O O 8.515 2.747 1.401 1.00 . A A . 40 SER O 1 1 19 13856 1 1 43 SER OG O 12.021 2.725 1.898 1.00 . A A . 40 SER OG 1 1 19 13857 1 1 44 GLY C C 8.536 4.684 4.743 1.00 . A A . 41 GLY C 1 1 19 13858 1 1 44 GLY CA C 7.896 3.614 3.899 1.00 . A A . 41 GLY CA 1 1 19 13859 1 1 44 GLY H H 9.264 2.060 4.336 1.00 . A A . 41 GLY H 1 1 19 13860 1 1 44 GLY HA2 H 7.559 4.050 2.970 1.00 . A A . 41 GLY HA2 1 1 19 13861 1 1 44 GLY HA3 H 7.050 3.209 4.423 1.00 . A A . 41 GLY HA3 1 1 19 13862 1 1 44 GLY N N 8.830 2.551 3.603 1.00 . A A . 41 GLY N 1 1 19 13863 1 1 44 GLY O O 8.024 5.046 5.803 1.00 . A A . 41 GLY O 1 1 19 13864 1 1 45 GLN C C 10.885 7.307 4.158 1.00 . A A . 42 GLN C 1 1 19 13865 1 1 45 GLN CA C 10.461 6.133 5.029 1.00 . A A . 42 GLN CA 1 1 19 13866 1 1 45 GLN CB C 11.696 5.436 5.608 1.00 . A A . 42 GLN CB 1 1 19 13867 1 1 45 GLN CD C 12.600 3.652 7.149 1.00 . A A . 42 GLN CD 1 1 19 13868 1 1 45 GLN CG C 11.364 4.306 6.571 1.00 . A A . 42 GLN CG 1 1 19 13869 1 1 45 GLN H H 9.970 4.923 3.377 1.00 . A A . 42 GLN H 1 1 19 13870 1 1 45 GLN HA H 9.853 6.503 5.841 1.00 . A A . 42 GLN HA 1 1 19 13871 1 1 45 GLN HB2 H 12.276 5.026 4.794 1.00 . A A . 42 GLN HB2 1 1 19 13872 1 1 45 GLN HB3 H 12.295 6.163 6.132 1.00 . A A . 42 GLN HB3 1 1 19 13873 1 1 45 GLN HE21 H 12.587 4.923 8.678 1.00 . A A . 42 GLN HE21 1 1 19 13874 1 1 45 GLN HE22 H 13.861 3.750 8.672 1.00 . A A . 42 GLN HE22 1 1 19 13875 1 1 45 GLN HG2 H 10.774 4.704 7.383 1.00 . A A . 42 GLN HG2 1 1 19 13876 1 1 45 GLN HG3 H 10.791 3.557 6.043 1.00 . A A . 42 GLN HG3 1 1 19 13877 1 1 45 GLN N N 9.667 5.188 4.269 1.00 . A A . 42 GLN N 1 1 19 13878 1 1 45 GLN NE2 N 13.064 4.157 8.278 1.00 . A A . 42 GLN NE2 1 1 19 13879 1 1 45 GLN O O 12.070 7.509 3.901 1.00 . A A . 42 GLN O 1 1 19 13880 1 1 45 GLN OE1 O 13.134 2.697 6.585 1.00 . A A . 42 GLN OE1 1 1 19 13881 1 1 46 THR C C 10.439 10.433 3.881 1.00 . A A . 43 THR C 1 1 19 13882 1 1 46 THR CA C 10.201 9.273 2.925 1.00 . A A . 43 THR CA 1 1 19 13883 1 1 46 THR CB C 9.049 9.620 1.969 1.00 . A A . 43 THR CB 1 1 19 13884 1 1 46 THR CG2 C 8.999 8.640 0.807 1.00 . A A . 43 THR CG2 1 1 19 13885 1 1 46 THR H H 8.978 7.823 3.858 1.00 . A A . 43 THR H 1 1 19 13886 1 1 46 THR HA H 11.092 9.097 2.343 1.00 . A A . 43 THR HA 1 1 19 13887 1 1 46 THR HB H 9.211 10.613 1.579 1.00 . A A . 43 THR HB 1 1 19 13888 1 1 46 THR HG1 H 7.114 9.975 2.133 1.00 . A A . 43 THR HG1 1 1 19 13889 1 1 46 THR HG21 H 8.839 7.640 1.185 1.00 . A A . 43 THR HG21 1 1 19 13890 1 1 46 THR HG22 H 9.933 8.674 0.267 1.00 . A A . 43 THR HG22 1 1 19 13891 1 1 46 THR HG23 H 8.190 8.909 0.144 1.00 . A A . 43 THR HG23 1 1 19 13892 1 1 46 THR N N 9.913 8.068 3.685 1.00 . A A . 43 THR N 1 1 19 13893 1 1 46 THR O O 11.326 11.266 3.677 1.00 . A A . 43 THR O 1 1 19 13894 1 1 46 THR OG1 O 7.807 9.593 2.683 1.00 . A A . 43 THR OG1 1 1 19 13895 1 1 47 HIS C C 10.248 10.740 7.263 1.00 . A A . 44 HIS C 1 1 19 13896 1 1 47 HIS CA C 9.799 11.447 5.991 1.00 . A A . 44 HIS CA 1 1 19 13897 1 1 47 HIS CB C 8.485 12.201 6.222 1.00 . A A . 44 HIS CB 1 1 19 13898 1 1 47 HIS CD2 C 9.023 14.654 6.865 1.00 . A A . 44 HIS CD2 1 1 19 13899 1 1 47 HIS CE1 C 8.547 14.541 8.999 1.00 . A A . 44 HIS CE1 1 1 19 13900 1 1 47 HIS CG C 8.621 13.390 7.125 1.00 . A A . 44 HIS CG 1 1 19 13901 1 1 47 HIS H H 8.922 9.800 5.010 1.00 . A A . 44 HIS H 1 1 19 13902 1 1 47 HIS HA H 10.563 12.144 5.687 1.00 . A A . 44 HIS HA 1 1 19 13903 1 1 47 HIS HB2 H 8.105 12.549 5.273 1.00 . A A . 44 HIS HB2 1 1 19 13904 1 1 47 HIS HB3 H 7.766 11.527 6.665 1.00 . A A . 44 HIS HB3 1 1 19 13905 1 1 47 HIS HD1 H 8.011 12.566 8.969 1.00 . A A . 44 HIS HD1 1 1 19 13906 1 1 47 HIS HD2 H 9.329 15.046 5.905 1.00 . A A . 44 HIS HD2 1 1 19 13907 1 1 47 HIS HE1 H 8.407 14.807 10.037 1.00 . A A . 44 HIS HE1 1 1 19 13908 1 1 47 HIS HE2 H 9.295 16.266 8.184 1.00 . A A . 44 HIS HE2 1 1 19 13909 1 1 47 HIS N N 9.642 10.465 4.938 1.00 . A A . 44 HIS N 1 1 19 13910 1 1 47 HIS ND1 N 8.329 13.353 8.471 1.00 . A A . 44 HIS ND1 1 1 19 13911 1 1 47 HIS NE2 N 8.969 15.348 8.046 1.00 . A A . 44 HIS NE2 1 1 19 13912 1 1 47 HIS O O 9.500 10.639 8.235 1.00 . A A . 44 HIS O 1 1 19 13913 1 1 48 ASP C C 13.128 10.276 9.009 1.00 . A A . 45 ASP C 1 1 19 13914 1 1 48 ASP CA C 12.010 9.482 8.359 1.00 . A A . 45 ASP CA 1 1 19 13915 1 1 48 ASP CB C 12.533 8.120 7.905 1.00 . A A . 45 ASP CB 1 1 19 13916 1 1 48 ASP CG C 13.023 7.273 9.063 1.00 . A A . 45 ASP CG 1 1 19 13917 1 1 48 ASP H H 12.020 10.354 6.437 1.00 . A A . 45 ASP H 1 1 19 13918 1 1 48 ASP HA H 11.218 9.337 9.078 1.00 . A A . 45 ASP HA 1 1 19 13919 1 1 48 ASP HB2 H 11.737 7.587 7.407 1.00 . A A . 45 ASP HB2 1 1 19 13920 1 1 48 ASP HB3 H 13.351 8.266 7.216 1.00 . A A . 45 ASP HB3 1 1 19 13921 1 1 48 ASP N N 11.464 10.223 7.233 1.00 . A A . 45 ASP N 1 1 19 13922 1 1 48 ASP O O 14.196 10.418 8.378 1.00 . A A . 45 ASP O 1 1 19 13923 1 1 48 ASP OXT O 12.925 10.771 10.136 1.00 . A A . 45 ASP OXT 1 1 19 13924 1 1 48 ASP OD1 O 14.215 7.366 9.420 1.00 . A A . 45 ASP OD1 1 1 19 13925 1 1 48 ASP OD2 O 12.220 6.500 9.621 1.00 . A A . 45 ASP OD2 1 1 19 13926 2 2 1 ZN ZN ZN -4.435 -5.501 0.362 1.00 . B A . 101 ZN ZN 1 1 19 13927 3 2 1 ZN ZN ZN 6.062 1.272 -1.672 1.00 . C A . 102 ZN ZN 1 1 20 13928 1 1 1 GLY C C -12.537 8.959 6.549 1.00 . A A . -2 GLY C 1 1 20 13929 1 1 1 GLY CA C -12.497 7.591 7.197 1.00 . A A . -2 GLY CA 1 1 20 13930 1 1 1 GLY H1 H -12.926 6.690 9.025 1.00 . A A . -2 GLY H1 1 1 20 13931 1 1 1 GLY H2 H -13.965 7.960 8.623 1.00 . A A . -2 GLY H2 1 1 20 13932 1 1 1 GLY H3 H -12.397 8.291 9.154 1.00 . A A . -2 GLY H3 1 1 20 13933 1 1 1 GLY HA2 H -11.482 7.227 7.183 1.00 . A A . -2 GLY HA2 1 1 20 13934 1 1 1 GLY HA3 H -13.121 6.915 6.633 1.00 . A A . -2 GLY HA3 1 1 20 13935 1 1 1 GLY N N -12.978 7.635 8.597 1.00 . A A . -2 GLY N 1 1 20 13936 1 1 1 GLY O O -13.485 9.712 6.763 1.00 . A A . -2 GLY O 1 1 20 13937 1 1 2 PRO C C -12.334 10.713 3.852 1.00 . A A . -1 PRO C 1 1 20 13938 1 1 2 PRO CA C -11.442 10.619 5.088 1.00 . A A . -1 PRO CA 1 1 20 13939 1 1 2 PRO CB C -9.970 10.717 4.689 1.00 . A A . -1 PRO CB 1 1 20 13940 1 1 2 PRO CD C -10.358 8.460 5.418 1.00 . A A . -1 PRO CD 1 1 20 13941 1 1 2 PRO CG C -9.540 9.306 4.475 1.00 . A A . -1 PRO CG 1 1 20 13942 1 1 2 PRO HA H -11.688 11.419 5.769 1.00 . A A . -1 PRO HA 1 1 20 13943 1 1 2 PRO HB2 H -9.878 11.298 3.782 1.00 . A A . -1 PRO HB2 1 1 20 13944 1 1 2 PRO HB3 H -9.407 11.185 5.483 1.00 . A A . -1 PRO HB3 1 1 20 13945 1 1 2 PRO HD2 H -10.674 7.551 4.927 1.00 . A A . -1 PRO HD2 1 1 20 13946 1 1 2 PRO HD3 H -9.789 8.231 6.306 1.00 . A A . -1 PRO HD3 1 1 20 13947 1 1 2 PRO HG2 H -9.731 9.017 3.453 1.00 . A A . -1 PRO HG2 1 1 20 13948 1 1 2 PRO HG3 H -8.488 9.206 4.702 1.00 . A A . -1 PRO HG3 1 1 20 13949 1 1 2 PRO N N -11.521 9.310 5.744 1.00 . A A . -1 PRO N 1 1 20 13950 1 1 2 PRO O O -11.977 11.363 2.870 1.00 . A A . -1 PRO O 1 1 20 13951 1 1 3 HIS C C -13.698 9.515 1.548 1.00 . A A . 0 HIS C 1 1 20 13952 1 1 3 HIS CA C -14.429 9.984 2.801 1.00 . A A . 0 HIS CA 1 1 20 13953 1 1 3 HIS CB C -15.111 11.338 2.571 1.00 . A A . 0 HIS CB 1 1 20 13954 1 1 3 HIS CD2 C -17.459 10.729 1.641 1.00 . A A . 0 HIS CD2 1 1 20 13955 1 1 3 HIS CE1 C -17.273 11.671 -0.325 1.00 . A A . 0 HIS CE1 1 1 20 13956 1 1 3 HIS CG C -16.229 11.289 1.571 1.00 . A A . 0 HIS CG 1 1 20 13957 1 1 3 HIS H H -13.732 9.612 4.763 1.00 . A A . 0 HIS H 1 1 20 13958 1 1 3 HIS HA H -15.182 9.250 3.053 1.00 . A A . 0 HIS HA 1 1 20 13959 1 1 3 HIS HB2 H -15.519 11.690 3.504 1.00 . A A . 0 HIS HB2 1 1 20 13960 1 1 3 HIS HB3 H -14.378 12.046 2.215 1.00 . A A . 0 HIS HB3 1 1 20 13961 1 1 3 HIS HD1 H -15.371 12.361 -0.028 1.00 . A A . 0 HIS HD1 1 1 20 13962 1 1 3 HIS HD2 H -17.868 10.184 2.480 1.00 . A A . 0 HIS HD2 1 1 20 13963 1 1 3 HIS HE1 H -17.494 12.015 -1.325 1.00 . A A . 0 HIS HE1 1 1 20 13964 1 1 3 HIS HE2 H -18.936 10.578 0.157 1.00 . A A . 0 HIS HE2 1 1 20 13965 1 1 3 HIS N N -13.495 10.058 3.921 1.00 . A A . 0 HIS N 1 1 20 13966 1 1 3 HIS ND1 N -16.146 11.871 0.326 1.00 . A A . 0 HIS ND1 1 1 20 13967 1 1 3 HIS NE2 N -18.087 10.982 0.450 1.00 . A A . 0 HIS NE2 1 1 20 13968 1 1 3 HIS O O -13.730 10.165 0.504 1.00 . A A . 0 HIS O 1 1 20 13969 1 1 4 MET C C -12.395 6.337 0.515 1.00 . A A . 1 MET C 1 1 20 13970 1 1 4 MET CA C -12.227 7.845 0.583 1.00 . A A . 1 MET CA 1 1 20 13971 1 1 4 MET CB C -10.749 8.194 0.766 1.00 . A A . 1 MET CB 1 1 20 13972 1 1 4 MET CE C -9.458 9.010 -2.017 1.00 . A A . 1 MET CE 1 1 20 13973 1 1 4 MET CG C -10.418 9.656 0.507 1.00 . A A . 1 MET CG 1 1 20 13974 1 1 4 MET H H -13.061 7.898 2.523 1.00 . A A . 1 MET H 1 1 20 13975 1 1 4 MET HA H -12.582 8.279 -0.338 1.00 . A A . 1 MET HA 1 1 20 13976 1 1 4 MET HB2 H -10.460 7.959 1.779 1.00 . A A . 1 MET HB2 1 1 20 13977 1 1 4 MET HB3 H -10.167 7.592 0.088 1.00 . A A . 1 MET HB3 1 1 20 13978 1 1 4 MET HE1 H -9.765 7.987 -1.856 1.00 . A A . 1 MET HE1 1 1 20 13979 1 1 4 MET HE2 H -8.476 9.161 -1.595 1.00 . A A . 1 MET HE2 1 1 20 13980 1 1 4 MET HE3 H -9.429 9.214 -3.077 1.00 . A A . 1 MET HE3 1 1 20 13981 1 1 4 MET HG2 H -11.072 10.270 1.108 1.00 . A A . 1 MET HG2 1 1 20 13982 1 1 4 MET HG3 H -9.394 9.836 0.795 1.00 . A A . 1 MET HG3 1 1 20 13983 1 1 4 MET N N -13.019 8.389 1.672 1.00 . A A . 1 MET N 1 1 20 13984 1 1 4 MET O O -12.597 5.683 1.536 1.00 . A A . 1 MET O 1 1 20 13985 1 1 4 MET SD S -10.625 10.118 -1.227 1.00 . A A . 1 MET SD 1 1 20 13986 1 1 5 ALA C C -11.759 3.972 -2.171 1.00 . A A . 2 ALA C 1 1 20 13987 1 1 5 ALA CA C -12.472 4.374 -0.905 1.00 . A A . 2 ALA CA 1 1 20 13988 1 1 5 ALA CB C -13.944 4.008 -0.993 1.00 . A A . 2 ALA CB 1 1 20 13989 1 1 5 ALA H H -12.053 6.357 -1.448 1.00 . A A . 2 ALA H 1 1 20 13990 1 1 5 ALA HA H -12.030 3.839 -0.075 1.00 . A A . 2 ALA HA 1 1 20 13991 1 1 5 ALA HB1 H -14.430 4.244 -0.057 1.00 . A A . 2 ALA HB1 1 1 20 13992 1 1 5 ALA HB2 H -14.040 2.948 -1.192 1.00 . A A . 2 ALA HB2 1 1 20 13993 1 1 5 ALA HB3 H -14.408 4.567 -1.791 1.00 . A A . 2 ALA HB3 1 1 20 13994 1 1 5 ALA N N -12.291 5.793 -0.685 1.00 . A A . 2 ALA N 1 1 20 13995 1 1 5 ALA O O -11.283 4.827 -2.920 1.00 . A A . 2 ALA O 1 1 20 13996 1 1 6 VAL C C -10.869 0.622 -3.245 1.00 . A A . 3 VAL C 1 1 20 13997 1 1 6 VAL CA C -10.917 2.120 -3.472 1.00 . A A . 3 VAL CA 1 1 20 13998 1 1 6 VAL CB C -9.477 2.679 -3.412 1.00 . A A . 3 VAL CB 1 1 20 13999 1 1 6 VAL CG1 C -8.641 1.884 -2.445 1.00 . A A . 3 VAL CG1 1 1 20 14000 1 1 6 VAL CG2 C -8.803 2.702 -4.759 1.00 . A A . 3 VAL CG2 1 1 20 14001 1 1 6 VAL H H -12.225 2.073 -1.834 1.00 . A A . 3 VAL H 1 1 20 14002 1 1 6 VAL HA H -11.365 2.356 -4.420 1.00 . A A . 3 VAL HA 1 1 20 14003 1 1 6 VAL HB H -9.528 3.695 -3.047 1.00 . A A . 3 VAL HB 1 1 20 14004 1 1 6 VAL HG11 H -7.778 2.464 -2.163 1.00 . A A . 3 VAL HG11 1 1 20 14005 1 1 6 VAL HG12 H -8.324 0.966 -2.916 1.00 . A A . 3 VAL HG12 1 1 20 14006 1 1 6 VAL HG13 H -9.233 1.656 -1.569 1.00 . A A . 3 VAL HG13 1 1 20 14007 1 1 6 VAL HG21 H -7.773 3.003 -4.620 1.00 . A A . 3 VAL HG21 1 1 20 14008 1 1 6 VAL HG22 H -9.305 3.406 -5.402 1.00 . A A . 3 VAL HG22 1 1 20 14009 1 1 6 VAL HG23 H -8.835 1.718 -5.193 1.00 . A A . 3 VAL HG23 1 1 20 14010 1 1 6 VAL N N -11.709 2.681 -2.404 1.00 . A A . 3 VAL N 1 1 20 14011 1 1 6 VAL O O -11.487 0.128 -2.302 1.00 . A A . 3 VAL O 1 1 20 14012 1 1 7 LEU C C -8.212 -1.463 -3.681 1.00 . A A . 4 LEU C 1 1 20 14013 1 1 7 LEU CA C -9.727 -1.414 -3.708 1.00 . A A . 4 LEU CA 1 1 20 14014 1 1 7 LEU CB C -10.288 -2.488 -4.639 1.00 . A A . 4 LEU CB 1 1 20 14015 1 1 7 LEU CD1 C -12.208 -3.892 -5.411 1.00 . A A . 4 LEU CD1 1 1 20 14016 1 1 7 LEU CD2 C -12.247 -2.894 -3.117 1.00 . A A . 4 LEU CD2 1 1 20 14017 1 1 7 LEU CG C -11.801 -2.701 -4.561 1.00 . A A . 4 LEU CG 1 1 20 14018 1 1 7 LEU H H -9.914 0.270 -4.958 1.00 . A A . 4 LEU H 1 1 20 14019 1 1 7 LEU HA H -10.085 -1.581 -2.700 1.00 . A A . 4 LEU HA 1 1 20 14020 1 1 7 LEU HB2 H -10.037 -2.218 -5.653 1.00 . A A . 4 LEU HB2 1 1 20 14021 1 1 7 LEU HB3 H -9.805 -3.424 -4.404 1.00 . A A . 4 LEU HB3 1 1 20 14022 1 1 7 LEU HD11 H -11.960 -3.698 -6.444 1.00 . A A . 4 LEU HD11 1 1 20 14023 1 1 7 LEU HD12 H -13.271 -4.055 -5.320 1.00 . A A . 4 LEU HD12 1 1 20 14024 1 1 7 LEU HD13 H -11.679 -4.772 -5.075 1.00 . A A . 4 LEU HD13 1 1 20 14025 1 1 7 LEU HD21 H -13.296 -3.147 -3.096 1.00 . A A . 4 LEU HD21 1 1 20 14026 1 1 7 LEU HD22 H -12.090 -1.977 -2.565 1.00 . A A . 4 LEU HD22 1 1 20 14027 1 1 7 LEU HD23 H -11.673 -3.694 -2.662 1.00 . A A . 4 LEU HD23 1 1 20 14028 1 1 7 LEU HG H -12.302 -1.826 -4.952 1.00 . A A . 4 LEU HG 1 1 20 14029 1 1 7 LEU N N -10.154 -0.093 -4.081 1.00 . A A . 4 LEU N 1 1 20 14030 1 1 7 LEU O O -7.545 -0.957 -4.589 1.00 . A A . 4 LEU O 1 1 20 14031 1 1 8 CYS C C -5.462 -2.478 -3.582 1.00 . A A . 5 CYS C 1 1 20 14032 1 1 8 CYS CA C -6.270 -2.155 -2.333 1.00 . A A . 5 CYS CA 1 1 20 14033 1 1 8 CYS CB C -6.073 -3.241 -1.288 1.00 . A A . 5 CYS CB 1 1 20 14034 1 1 8 CYS H H -8.325 -2.442 -1.954 1.00 . A A . 5 CYS H 1 1 20 14035 1 1 8 CYS HA H -5.934 -1.214 -1.928 1.00 . A A . 5 CYS HA 1 1 20 14036 1 1 8 CYS HB2 H -6.582 -2.943 -0.389 1.00 . A A . 5 CYS HB2 1 1 20 14037 1 1 8 CYS HB3 H -6.517 -4.156 -1.653 1.00 . A A . 5 CYS HB3 1 1 20 14038 1 1 8 CYS N N -7.699 -2.052 -2.606 1.00 . A A . 5 CYS N 1 1 20 14039 1 1 8 CYS O O -5.737 -3.449 -4.278 1.00 . A A . 5 CYS O 1 1 20 14040 1 1 8 CYS SG S -4.361 -3.602 -0.847 1.00 . A A . 5 CYS SG 1 1 20 14041 1 1 9 GLY C C -2.895 -3.099 -5.134 1.00 . A A . 6 GLY C 1 1 20 14042 1 1 9 GLY CA C -3.655 -1.787 -5.046 1.00 . A A . 6 GLY CA 1 1 20 14043 1 1 9 GLY H H -4.244 -0.942 -3.197 1.00 . A A . 6 GLY H 1 1 20 14044 1 1 9 GLY HA2 H -4.306 -1.709 -5.898 1.00 . A A . 6 GLY HA2 1 1 20 14045 1 1 9 GLY HA3 H -2.945 -0.974 -5.078 1.00 . A A . 6 GLY HA3 1 1 20 14046 1 1 9 GLY N N -4.450 -1.658 -3.838 1.00 . A A . 6 GLY N 1 1 20 14047 1 1 9 GLY O O -2.582 -3.564 -6.227 1.00 . A A . 6 GLY O 1 1 20 14048 1 1 10 VAL C C -2.673 -6.169 -4.163 1.00 . A A . 7 VAL C 1 1 20 14049 1 1 10 VAL CA C -1.806 -4.923 -3.973 1.00 . A A . 7 VAL CA 1 1 20 14050 1 1 10 VAL CB C -0.988 -5.047 -2.672 1.00 . A A . 7 VAL CB 1 1 20 14051 1 1 10 VAL CG1 C -0.229 -6.364 -2.633 1.00 . A A . 7 VAL CG1 1 1 20 14052 1 1 10 VAL CG2 C -0.024 -3.878 -2.540 1.00 . A A . 7 VAL CG2 1 1 20 14053 1 1 10 VAL H H -2.920 -3.317 -3.150 1.00 . A A . 7 VAL H 1 1 20 14054 1 1 10 VAL HA H -1.109 -4.866 -4.798 1.00 . A A . 7 VAL HA 1 1 20 14055 1 1 10 VAL HB H -1.670 -5.022 -1.835 1.00 . A A . 7 VAL HB 1 1 20 14056 1 1 10 VAL HG11 H 0.331 -6.429 -1.711 1.00 . A A . 7 VAL HG11 1 1 20 14057 1 1 10 VAL HG12 H 0.450 -6.411 -3.470 1.00 . A A . 7 VAL HG12 1 1 20 14058 1 1 10 VAL HG13 H -0.929 -7.185 -2.689 1.00 . A A . 7 VAL HG13 1 1 20 14059 1 1 10 VAL HG21 H 0.656 -3.873 -3.379 1.00 . A A . 7 VAL HG21 1 1 20 14060 1 1 10 VAL HG22 H 0.540 -3.978 -1.624 1.00 . A A . 7 VAL HG22 1 1 20 14061 1 1 10 VAL HG23 H -0.580 -2.953 -2.521 1.00 . A A . 7 VAL HG23 1 1 20 14062 1 1 10 VAL N N -2.601 -3.702 -3.992 1.00 . A A . 7 VAL N 1 1 20 14063 1 1 10 VAL O O -2.535 -6.880 -5.156 1.00 . A A . 7 VAL O 1 1 20 14064 1 1 11 CYS C C -5.663 -7.455 -4.057 1.00 . A A . 8 CYS C 1 1 20 14065 1 1 11 CYS CA C -4.370 -7.655 -3.263 1.00 . A A . 8 CYS CA 1 1 20 14066 1 1 11 CYS CB C -4.678 -8.152 -1.846 1.00 . A A . 8 CYS CB 1 1 20 14067 1 1 11 CYS H H -3.717 -5.786 -2.504 1.00 . A A . 8 CYS H 1 1 20 14068 1 1 11 CYS HA H -3.777 -8.404 -3.767 1.00 . A A . 8 CYS HA 1 1 20 14069 1 1 11 CYS HB2 H -5.204 -9.092 -1.912 1.00 . A A . 8 CYS HB2 1 1 20 14070 1 1 11 CYS HB3 H -3.752 -8.303 -1.315 1.00 . A A . 8 CYS HB3 1 1 20 14071 1 1 11 CYS N N -3.577 -6.427 -3.223 1.00 . A A . 8 CYS N 1 1 20 14072 1 1 11 CYS O O -6.351 -8.417 -4.400 1.00 . A A . 8 CYS O 1 1 20 14073 1 1 11 CYS SG S -5.696 -7.031 -0.868 1.00 . A A . 8 CYS SG 1 1 20 14074 1 1 12 GLY C C -8.470 -6.077 -4.494 1.00 . A A . 9 GLY C 1 1 20 14075 1 1 12 GLY CA C -7.129 -5.893 -5.181 1.00 . A A . 9 GLY CA 1 1 20 14076 1 1 12 GLY H H -5.438 -5.471 -3.987 1.00 . A A . 9 GLY H 1 1 20 14077 1 1 12 GLY HA2 H -7.050 -4.866 -5.506 1.00 . A A . 9 GLY HA2 1 1 20 14078 1 1 12 GLY HA3 H -7.096 -6.531 -6.052 1.00 . A A . 9 GLY HA3 1 1 20 14079 1 1 12 GLY N N -5.987 -6.201 -4.341 1.00 . A A . 9 GLY N 1 1 20 14080 1 1 12 GLY O O -9.495 -6.170 -5.167 1.00 . A A . 9 GLY O 1 1 20 14081 1 1 13 ILE C C -9.857 -5.358 -1.279 1.00 . A A . 10 ILE C 1 1 20 14082 1 1 13 ILE CA C -9.733 -6.334 -2.444 1.00 . A A . 10 ILE CA 1 1 20 14083 1 1 13 ILE CB C -9.871 -7.798 -1.940 1.00 . A A . 10 ILE CB 1 1 20 14084 1 1 13 ILE CD1 C -8.969 -7.837 0.439 1.00 . A A . 10 ILE CD1 1 1 20 14085 1 1 13 ILE CG1 C -8.719 -8.187 -1.011 1.00 . A A . 10 ILE CG1 1 1 20 14086 1 1 13 ILE CG2 C -9.951 -8.764 -3.113 1.00 . A A . 10 ILE CG2 1 1 20 14087 1 1 13 ILE H H -7.655 -6.006 -2.656 1.00 . A A . 10 ILE H 1 1 20 14088 1 1 13 ILE HA H -10.542 -6.143 -3.135 1.00 . A A . 10 ILE HA 1 1 20 14089 1 1 13 ILE HB H -10.798 -7.871 -1.392 1.00 . A A . 10 ILE HB 1 1 20 14090 1 1 13 ILE HD11 H -9.215 -6.786 0.511 1.00 . A A . 10 ILE HD11 1 1 20 14091 1 1 13 ILE HD12 H -8.082 -8.042 1.019 1.00 . A A . 10 ILE HD12 1 1 20 14092 1 1 13 ILE HD13 H -9.793 -8.425 0.815 1.00 . A A . 10 ILE HD13 1 1 20 14093 1 1 13 ILE HG12 H -8.550 -9.252 -1.074 1.00 . A A . 10 ILE HG12 1 1 20 14094 1 1 13 ILE HG13 H -7.824 -7.668 -1.327 1.00 . A A . 10 ILE HG13 1 1 20 14095 1 1 13 ILE HG21 H -10.024 -9.774 -2.742 1.00 . A A . 10 ILE HG21 1 1 20 14096 1 1 13 ILE HG22 H -9.063 -8.667 -3.719 1.00 . A A . 10 ILE HG22 1 1 20 14097 1 1 13 ILE HG23 H -10.822 -8.535 -3.710 1.00 . A A . 10 ILE HG23 1 1 20 14098 1 1 13 ILE N N -8.486 -6.125 -3.164 1.00 . A A . 10 ILE N 1 1 20 14099 1 1 13 ILE O O -8.849 -4.824 -0.809 1.00 . A A . 10 ILE O 1 1 20 14100 1 1 14 LYS C C -10.969 -2.823 0.114 1.00 . A A . 11 LYS C 1 1 20 14101 1 1 14 LYS CA C -11.479 -4.260 0.277 1.00 . A A . 11 LYS CA 1 1 20 14102 1 1 14 LYS CB C -11.042 -4.840 1.636 1.00 . A A . 11 LYS CB 1 1 20 14103 1 1 14 LYS CD C -9.205 -5.303 3.306 1.00 . A A . 11 LYS CD 1 1 20 14104 1 1 14 LYS CE C -9.490 -4.444 4.535 1.00 . A A . 11 LYS CE 1 1 20 14105 1 1 14 LYS CG C -9.584 -4.605 2.002 1.00 . A A . 11 LYS CG 1 1 20 14106 1 1 14 LYS H H -11.831 -5.615 -1.311 1.00 . A A . 11 LYS H 1 1 20 14107 1 1 14 LYS HA H -12.559 -4.216 0.274 1.00 . A A . 11 LYS HA 1 1 20 14108 1 1 14 LYS HB2 H -11.653 -4.398 2.407 1.00 . A A . 11 LYS HB2 1 1 20 14109 1 1 14 LYS HB3 H -11.218 -5.906 1.625 1.00 . A A . 11 LYS HB3 1 1 20 14110 1 1 14 LYS HD2 H -9.772 -6.217 3.386 1.00 . A A . 11 LYS HD2 1 1 20 14111 1 1 14 LYS HD3 H -8.150 -5.538 3.281 1.00 . A A . 11 LYS HD3 1 1 20 14112 1 1 14 LYS HE2 H -9.100 -4.951 5.404 1.00 . A A . 11 LYS HE2 1 1 20 14113 1 1 14 LYS HE3 H -8.984 -3.496 4.418 1.00 . A A . 11 LYS HE3 1 1 20 14114 1 1 14 LYS HG2 H -8.957 -4.982 1.209 1.00 . A A . 11 LYS HG2 1 1 20 14115 1 1 14 LYS HG3 H -9.421 -3.543 2.114 1.00 . A A . 11 LYS HG3 1 1 20 14116 1 1 14 LYS HZ1 H -11.459 -5.093 4.772 1.00 . A A . 11 LYS HZ1 1 1 20 14117 1 1 14 LYS HZ2 H -11.320 -3.616 3.966 1.00 . A A . 11 LYS HZ2 1 1 20 14118 1 1 14 LYS HZ3 H -11.092 -3.690 5.636 1.00 . A A . 11 LYS HZ3 1 1 20 14119 1 1 14 LYS N N -11.106 -5.145 -0.846 1.00 . A A . 11 LYS N 1 1 20 14120 1 1 14 LYS NZ N -10.941 -4.194 4.739 1.00 . A A . 11 LYS NZ 1 1 20 14121 1 1 14 LYS O O -10.057 -2.533 -0.666 1.00 . A A . 11 LYS O 1 1 20 14122 1 1 15 GLU C C -9.857 -0.308 1.455 1.00 . A A . 12 GLU C 1 1 20 14123 1 1 15 GLU CA C -11.221 -0.514 0.825 1.00 . A A . 12 GLU CA 1 1 20 14124 1 1 15 GLU CB C -12.266 0.331 1.544 1.00 . A A . 12 GLU CB 1 1 20 14125 1 1 15 GLU CD C -14.663 1.103 1.552 1.00 . A A . 12 GLU CD 1 1 20 14126 1 1 15 GLU CG C -13.526 0.539 0.728 1.00 . A A . 12 GLU CG 1 1 20 14127 1 1 15 GLU H H -12.341 -2.199 1.423 1.00 . A A . 12 GLU H 1 1 20 14128 1 1 15 GLU HA H -11.174 -0.206 -0.209 1.00 . A A . 12 GLU HA 1 1 20 14129 1 1 15 GLU HB2 H -12.535 -0.156 2.467 1.00 . A A . 12 GLU HB2 1 1 20 14130 1 1 15 GLU HB3 H -11.842 1.298 1.765 1.00 . A A . 12 GLU HB3 1 1 20 14131 1 1 15 GLU HG2 H -13.304 1.227 -0.074 1.00 . A A . 12 GLU HG2 1 1 20 14132 1 1 15 GLU HG3 H -13.832 -0.411 0.315 1.00 . A A . 12 GLU HG3 1 1 20 14133 1 1 15 GLU N N -11.599 -1.916 0.850 1.00 . A A . 12 GLU N 1 1 20 14134 1 1 15 GLU O O -9.472 -1.011 2.396 1.00 . A A . 12 GLU O 1 1 20 14135 1 1 15 GLU OE1 O -14.737 2.337 1.713 1.00 . A A . 12 GLU OE1 1 1 20 14136 1 1 15 GLU OE2 O -15.489 0.308 2.049 1.00 . A A . 12 GLU OE2 1 1 20 14137 1 1 16 PHE C C -7.781 1.539 2.766 1.00 . A A . 13 PHE C 1 1 20 14138 1 1 16 PHE CA C -7.783 0.945 1.364 1.00 . A A . 13 PHE CA 1 1 20 14139 1 1 16 PHE CB C -7.094 1.895 0.377 1.00 . A A . 13 PHE CB 1 1 20 14140 1 1 16 PHE CD1 C -6.766 4.184 1.368 1.00 . A A . 13 PHE CD1 1 1 20 14141 1 1 16 PHE CD2 C -8.535 3.881 -0.202 1.00 . A A . 13 PHE CD2 1 1 20 14142 1 1 16 PHE CE1 C -7.104 5.515 1.494 1.00 . A A . 13 PHE CE1 1 1 20 14143 1 1 16 PHE CE2 C -8.875 5.209 -0.082 1.00 . A A . 13 PHE CE2 1 1 20 14144 1 1 16 PHE CG C -7.477 3.349 0.520 1.00 . A A . 13 PHE CG 1 1 20 14145 1 1 16 PHE CZ C -8.159 6.029 0.769 1.00 . A A . 13 PHE CZ 1 1 20 14146 1 1 16 PHE H H -9.532 1.203 0.209 1.00 . A A . 13 PHE H 1 1 20 14147 1 1 16 PHE HA H -7.241 0.010 1.384 1.00 . A A . 13 PHE HA 1 1 20 14148 1 1 16 PHE HB2 H -6.029 1.823 0.487 1.00 . A A . 13 PHE HB2 1 1 20 14149 1 1 16 PHE HB3 H -7.354 1.588 -0.621 1.00 . A A . 13 PHE HB3 1 1 20 14150 1 1 16 PHE HD1 H -5.940 3.781 1.937 1.00 . A A . 13 PHE HD1 1 1 20 14151 1 1 16 PHE HD2 H -9.096 3.237 -0.880 1.00 . A A . 13 PHE HD2 1 1 20 14152 1 1 16 PHE HE1 H -6.542 6.155 2.159 1.00 . A A . 13 PHE HE1 1 1 20 14153 1 1 16 PHE HE2 H -9.703 5.607 -0.655 1.00 . A A . 13 PHE HE2 1 1 20 14154 1 1 16 PHE HZ H -8.422 7.073 0.866 1.00 . A A . 13 PHE HZ 1 1 20 14155 1 1 16 PHE N N -9.138 0.662 0.924 1.00 . A A . 13 PHE N 1 1 20 14156 1 1 16 PHE O O -8.773 2.112 3.217 1.00 . A A . 13 PHE O 1 1 20 14157 1 1 17 LYS C C -5.176 2.664 4.893 1.00 . A A . 14 LYS C 1 1 20 14158 1 1 17 LYS CA C -6.502 1.920 4.786 1.00 . A A . 14 LYS CA 1 1 20 14159 1 1 17 LYS CB C -6.579 0.778 5.801 1.00 . A A . 14 LYS CB 1 1 20 14160 1 1 17 LYS CD C -6.808 0.063 8.205 1.00 . A A . 14 LYS CD 1 1 20 14161 1 1 17 LYS CE C -8.104 -0.687 7.918 1.00 . A A . 14 LYS CE 1 1 20 14162 1 1 17 LYS CG C -6.597 1.231 7.251 1.00 . A A . 14 LYS CG 1 1 20 14163 1 1 17 LYS H H -5.914 0.904 3.033 1.00 . A A . 14 LYS H 1 1 20 14164 1 1 17 LYS HA H -7.306 2.613 4.969 1.00 . A A . 14 LYS HA 1 1 20 14165 1 1 17 LYS HB2 H -7.477 0.210 5.614 1.00 . A A . 14 LYS HB2 1 1 20 14166 1 1 17 LYS HB3 H -5.724 0.132 5.659 1.00 . A A . 14 LYS HB3 1 1 20 14167 1 1 17 LYS HD2 H -5.982 -0.623 8.104 1.00 . A A . 14 LYS HD2 1 1 20 14168 1 1 17 LYS HD3 H -6.839 0.442 9.217 1.00 . A A . 14 LYS HD3 1 1 20 14169 1 1 17 LYS HE2 H -8.024 -1.161 6.953 1.00 . A A . 14 LYS HE2 1 1 20 14170 1 1 17 LYS HE3 H -8.241 -1.443 8.678 1.00 . A A . 14 LYS HE3 1 1 20 14171 1 1 17 LYS HG2 H -5.651 1.697 7.480 1.00 . A A . 14 LYS HG2 1 1 20 14172 1 1 17 LYS HG3 H -7.396 1.945 7.386 1.00 . A A . 14 LYS HG3 1 1 20 14173 1 1 17 LYS HZ1 H -10.165 -0.347 7.867 1.00 . A A . 14 LYS HZ1 1 1 20 14174 1 1 17 LYS HZ2 H -9.258 0.849 7.095 1.00 . A A . 14 LYS HZ2 1 1 20 14175 1 1 17 LYS HZ3 H -9.307 0.787 8.783 1.00 . A A . 14 LYS HZ3 1 1 20 14176 1 1 17 LYS N N -6.662 1.390 3.446 1.00 . A A . 14 LYS N 1 1 20 14177 1 1 17 LYS NZ N -9.290 0.214 7.916 1.00 . A A . 14 LYS NZ 1 1 20 14178 1 1 17 LYS O O -4.983 3.505 5.773 1.00 . A A . 14 LYS O 1 1 20 14179 1 1 18 TYR C C -2.653 3.532 2.583 1.00 . A A . 15 TYR C 1 1 20 14180 1 1 18 TYR CA C -2.951 2.964 3.958 1.00 . A A . 15 TYR CA 1 1 20 14181 1 1 18 TYR CB C -1.872 1.935 4.310 1.00 . A A . 15 TYR CB 1 1 20 14182 1 1 18 TYR CD1 C -2.998 0.413 5.968 1.00 . A A . 15 TYR CD1 1 1 20 14183 1 1 18 TYR CD2 C -1.128 1.690 6.700 1.00 . A A . 15 TYR CD2 1 1 20 14184 1 1 18 TYR CE1 C -3.121 -0.141 7.226 1.00 . A A . 15 TYR CE1 1 1 20 14185 1 1 18 TYR CE2 C -1.241 1.140 7.961 1.00 . A A . 15 TYR CE2 1 1 20 14186 1 1 18 TYR CG C -2.004 1.336 5.686 1.00 . A A . 15 TYR CG 1 1 20 14187 1 1 18 TYR CZ C -2.239 0.224 8.219 1.00 . A A . 15 TYR CZ 1 1 20 14188 1 1 18 TYR H H -4.498 1.705 3.276 1.00 . A A . 15 TYR H 1 1 20 14189 1 1 18 TYR HA H -2.937 3.761 4.684 1.00 . A A . 15 TYR HA 1 1 20 14190 1 1 18 TYR HB2 H -1.915 1.127 3.596 1.00 . A A . 15 TYR HB2 1 1 20 14191 1 1 18 TYR HB3 H -0.903 2.409 4.245 1.00 . A A . 15 TYR HB3 1 1 20 14192 1 1 18 TYR HD1 H -3.689 0.133 5.183 1.00 . A A . 15 TYR HD1 1 1 20 14193 1 1 18 TYR HD2 H -0.348 2.409 6.491 1.00 . A A . 15 TYR HD2 1 1 20 14194 1 1 18 TYR HE1 H -3.903 -0.858 7.428 1.00 . A A . 15 TYR HE1 1 1 20 14195 1 1 18 TYR HE2 H -0.549 1.425 8.738 1.00 . A A . 15 TYR HE2 1 1 20 14196 1 1 18 TYR HH H -2.203 0.351 10.136 1.00 . A A . 15 TYR HH 1 1 20 14197 1 1 18 TYR N N -4.270 2.356 3.975 1.00 . A A . 15 TYR N 1 1 20 14198 1 1 18 TYR O O -3.473 3.435 1.669 1.00 . A A . 15 TYR O 1 1 20 14199 1 1 18 TYR OH O -2.358 -0.330 9.472 1.00 . A A . 15 TYR OH 1 1 20 14200 1 1 19 LYS C C 0.500 4.848 1.253 1.00 . A A . 16 LYS C 1 1 20 14201 1 1 19 LYS CA C -1.002 4.627 1.171 1.00 . A A . 16 LYS CA 1 1 20 14202 1 1 19 LYS CB C -1.720 5.937 0.807 1.00 . A A . 16 LYS CB 1 1 20 14203 1 1 19 LYS CD C -2.268 7.631 -0.979 1.00 . A A . 16 LYS CD 1 1 20 14204 1 1 19 LYS CE C -2.086 8.829 -0.058 1.00 . A A . 16 LYS CE 1 1 20 14205 1 1 19 LYS CG C -1.375 6.464 -0.581 1.00 . A A . 16 LYS CG 1 1 20 14206 1 1 19 LYS H H -0.903 4.218 3.237 1.00 . A A . 16 LYS H 1 1 20 14207 1 1 19 LYS HA H -1.208 3.884 0.415 1.00 . A A . 16 LYS HA 1 1 20 14208 1 1 19 LYS HB2 H -2.786 5.772 0.850 1.00 . A A . 16 LYS HB2 1 1 20 14209 1 1 19 LYS HB3 H -1.452 6.691 1.532 1.00 . A A . 16 LYS HB3 1 1 20 14210 1 1 19 LYS HD2 H -2.023 7.928 -1.987 1.00 . A A . 16 LYS HD2 1 1 20 14211 1 1 19 LYS HD3 H -3.298 7.311 -0.939 1.00 . A A . 16 LYS HD3 1 1 20 14212 1 1 19 LYS HE2 H -2.394 8.551 0.938 1.00 . A A . 16 LYS HE2 1 1 20 14213 1 1 19 LYS HE3 H -1.042 9.105 -0.047 1.00 . A A . 16 LYS HE3 1 1 20 14214 1 1 19 LYS HG2 H -0.347 6.797 -0.589 1.00 . A A . 16 LYS HG2 1 1 20 14215 1 1 19 LYS HG3 H -1.503 5.666 -1.299 1.00 . A A . 16 LYS HG3 1 1 20 14216 1 1 19 LYS HZ1 H -2.718 10.811 0.118 1.00 . A A . 16 LYS HZ1 1 1 20 14217 1 1 19 LYS HZ2 H -3.905 9.766 -0.475 1.00 . A A . 16 LYS HZ2 1 1 20 14218 1 1 19 LYS HZ3 H -2.637 10.258 -1.479 1.00 . A A . 16 LYS HZ3 1 1 20 14219 1 1 19 LYS N N -1.478 4.119 2.447 1.00 . A A . 16 LYS N 1 1 20 14220 1 1 19 LYS NZ N -2.892 9.996 -0.504 1.00 . A A . 16 LYS NZ 1 1 20 14221 1 1 19 LYS O O 0.949 5.809 1.874 1.00 . A A . 16 LYS O 1 1 20 14222 1 1 20 CYS C C 3.189 5.431 0.321 1.00 . A A . 17 CYS C 1 1 20 14223 1 1 20 CYS CA C 2.730 4.019 0.665 1.00 . A A . 17 CYS CA 1 1 20 14224 1 1 20 CYS CB C 3.346 3.024 -0.330 1.00 . A A . 17 CYS CB 1 1 20 14225 1 1 20 CYS H H 0.837 3.161 0.227 1.00 . A A . 17 CYS H 1 1 20 14226 1 1 20 CYS HA H 3.073 3.775 1.658 1.00 . A A . 17 CYS HA 1 1 20 14227 1 1 20 CYS HB2 H 3.094 2.021 -0.024 1.00 . A A . 17 CYS HB2 1 1 20 14228 1 1 20 CYS HB3 H 2.941 3.210 -1.314 1.00 . A A . 17 CYS HB3 1 1 20 14229 1 1 20 CYS N N 1.268 3.927 0.665 1.00 . A A . 17 CYS N 1 1 20 14230 1 1 20 CYS O O 2.814 5.974 -0.714 1.00 . A A . 17 CYS O 1 1 20 14231 1 1 20 CYS SG S 5.154 3.134 -0.442 1.00 . A A . 17 CYS SG 1 1 20 14232 1 1 21 PRO C C 5.346 7.533 -0.279 1.00 . A A . 18 PRO C 1 1 20 14233 1 1 21 PRO CA C 4.517 7.402 0.996 1.00 . A A . 18 PRO CA 1 1 20 14234 1 1 21 PRO CB C 5.392 7.653 2.229 1.00 . A A . 18 PRO CB 1 1 20 14235 1 1 21 PRO CD C 4.502 5.446 2.449 1.00 . A A . 18 PRO CD 1 1 20 14236 1 1 21 PRO CG C 5.683 6.304 2.791 1.00 . A A . 18 PRO CG 1 1 20 14237 1 1 21 PRO HA H 3.711 8.122 0.971 1.00 . A A . 18 PRO HA 1 1 20 14238 1 1 21 PRO HB2 H 6.301 8.155 1.931 1.00 . A A . 18 PRO HB2 1 1 20 14239 1 1 21 PRO HB3 H 4.853 8.265 2.937 1.00 . A A . 18 PRO HB3 1 1 20 14240 1 1 21 PRO HD2 H 4.811 4.423 2.299 1.00 . A A . 18 PRO HD2 1 1 20 14241 1 1 21 PRO HD3 H 3.751 5.508 3.223 1.00 . A A . 18 PRO HD3 1 1 20 14242 1 1 21 PRO HG2 H 6.578 5.904 2.339 1.00 . A A . 18 PRO HG2 1 1 20 14243 1 1 21 PRO HG3 H 5.800 6.371 3.862 1.00 . A A . 18 PRO HG3 1 1 20 14244 1 1 21 PRO N N 4.010 6.039 1.193 1.00 . A A . 18 PRO N 1 1 20 14245 1 1 21 PRO O O 5.599 8.636 -0.759 1.00 . A A . 18 PRO O 1 1 20 14246 1 1 22 ARG C C 5.726 5.953 -3.239 1.00 . A A . 19 ARG C 1 1 20 14247 1 1 22 ARG CA C 6.554 6.383 -2.036 1.00 . A A . 19 ARG CA 1 1 20 14248 1 1 22 ARG CB C 7.752 5.456 -1.874 1.00 . A A . 19 ARG CB 1 1 20 14249 1 1 22 ARG CD C 10.131 5.324 -1.101 1.00 . A A . 19 ARG CD 1 1 20 14250 1 1 22 ARG CG C 8.778 5.968 -0.878 1.00 . A A . 19 ARG CG 1 1 20 14251 1 1 22 ARG CZ C 11.552 4.858 -3.064 1.00 . A A . 19 ARG CZ 1 1 20 14252 1 1 22 ARG H H 5.515 5.551 -0.395 1.00 . A A . 19 ARG H 1 1 20 14253 1 1 22 ARG HA H 6.912 7.388 -2.206 1.00 . A A . 19 ARG HA 1 1 20 14254 1 1 22 ARG HB2 H 7.400 4.492 -1.532 1.00 . A A . 19 ARG HB2 1 1 20 14255 1 1 22 ARG HB3 H 8.232 5.333 -2.833 1.00 . A A . 19 ARG HB3 1 1 20 14256 1 1 22 ARG HD2 H 10.821 5.704 -0.362 1.00 . A A . 19 ARG HD2 1 1 20 14257 1 1 22 ARG HD3 H 10.033 4.255 -0.987 1.00 . A A . 19 ARG HD3 1 1 20 14258 1 1 22 ARG HE H 10.314 6.422 -2.886 1.00 . A A . 19 ARG HE 1 1 20 14259 1 1 22 ARG HG2 H 8.875 7.036 -0.991 1.00 . A A . 19 ARG HG2 1 1 20 14260 1 1 22 ARG HG3 H 8.439 5.738 0.125 1.00 . A A . 19 ARG HG3 1 1 20 14261 1 1 22 ARG HH11 H 11.757 3.536 -1.544 1.00 . A A . 19 ARG HH11 1 1 20 14262 1 1 22 ARG HH12 H 12.718 3.205 -2.949 1.00 . A A . 19 ARG HH12 1 1 20 14263 1 1 22 ARG HH21 H 11.612 6.014 -4.731 1.00 . A A . 19 ARG HH21 1 1 20 14264 1 1 22 ARG HH22 H 12.644 4.620 -4.756 1.00 . A A . 19 ARG HH22 1 1 20 14265 1 1 22 ARG N N 5.759 6.398 -0.823 1.00 . A A . 19 ARG N 1 1 20 14266 1 1 22 ARG NE N 10.656 5.615 -2.435 1.00 . A A . 19 ARG NE 1 1 20 14267 1 1 22 ARG NH1 N 12.049 3.781 -2.471 1.00 . A A . 19 ARG NH1 1 1 20 14268 1 1 22 ARG NH2 N 11.968 5.190 -4.280 1.00 . A A . 19 ARG NH2 1 1 20 14269 1 1 22 ARG O O 5.592 6.702 -4.207 1.00 . A A . 19 ARG O 1 1 20 14270 1 1 23 CYS C C 3.076 4.911 -4.469 1.00 . A A . 20 CYS C 1 1 20 14271 1 1 23 CYS CA C 4.407 4.200 -4.290 1.00 . A A . 20 CYS CA 1 1 20 14272 1 1 23 CYS CB C 4.132 2.708 -4.086 1.00 . A A . 20 CYS CB 1 1 20 14273 1 1 23 CYS H H 5.237 4.238 -2.340 1.00 . A A . 20 CYS H 1 1 20 14274 1 1 23 CYS HA H 4.995 4.335 -5.181 1.00 . A A . 20 CYS HA 1 1 20 14275 1 1 23 CYS HB2 H 3.529 2.584 -3.204 1.00 . A A . 20 CYS HB2 1 1 20 14276 1 1 23 CYS HB3 H 3.588 2.343 -4.938 1.00 . A A . 20 CYS HB3 1 1 20 14277 1 1 23 CYS N N 5.157 4.755 -3.166 1.00 . A A . 20 CYS N 1 1 20 14278 1 1 23 CYS O O 2.514 4.944 -5.562 1.00 . A A . 20 CYS O 1 1 20 14279 1 1 23 CYS SG S 5.591 1.668 -3.888 1.00 . A A . 20 CYS SG 1 1 20 14280 1 1 24 LEU C C 0.175 5.046 -3.513 1.00 . A A . 21 LEU C 1 1 20 14281 1 1 24 LEU CA C 1.265 6.086 -3.303 1.00 . A A . 21 LEU CA 1 1 20 14282 1 1 24 LEU CB C 1.124 7.221 -4.321 1.00 . A A . 21 LEU CB 1 1 20 14283 1 1 24 LEU CD1 C 1.773 9.527 -5.010 1.00 . A A . 21 LEU CD1 1 1 20 14284 1 1 24 LEU CD2 C 2.668 8.586 -2.879 1.00 . A A . 21 LEU CD2 1 1 20 14285 1 1 24 LEU CG C 2.235 8.272 -4.301 1.00 . A A . 21 LEU CG 1 1 20 14286 1 1 24 LEU H H 3.135 5.464 -2.555 1.00 . A A . 21 LEU H 1 1 20 14287 1 1 24 LEU HA H 1.152 6.496 -2.311 1.00 . A A . 21 LEU HA 1 1 20 14288 1 1 24 LEU HB2 H 1.093 6.786 -5.309 1.00 . A A . 21 LEU HB2 1 1 20 14289 1 1 24 LEU HB3 H 0.186 7.721 -4.139 1.00 . A A . 21 LEU HB3 1 1 20 14290 1 1 24 LEU HD11 H 0.898 9.917 -4.513 1.00 . A A . 21 LEU HD11 1 1 20 14291 1 1 24 LEU HD12 H 1.533 9.293 -6.036 1.00 . A A . 21 LEU HD12 1 1 20 14292 1 1 24 LEU HD13 H 2.560 10.265 -4.984 1.00 . A A . 21 LEU HD13 1 1 20 14293 1 1 24 LEU HD21 H 3.422 9.357 -2.896 1.00 . A A . 21 LEU HD21 1 1 20 14294 1 1 24 LEU HD22 H 3.078 7.693 -2.427 1.00 . A A . 21 LEU HD22 1 1 20 14295 1 1 24 LEU HD23 H 1.816 8.923 -2.307 1.00 . A A . 21 LEU HD23 1 1 20 14296 1 1 24 LEU HG H 3.092 7.887 -4.835 1.00 . A A . 21 LEU HG 1 1 20 14297 1 1 24 LEU N N 2.583 5.462 -3.366 1.00 . A A . 21 LEU N 1 1 20 14298 1 1 24 LEU O O -0.984 5.383 -3.758 1.00 . A A . 21 LEU O 1 1 20 14299 1 1 25 VAL C C -1.213 2.570 -2.266 1.00 . A A . 22 VAL C 1 1 20 14300 1 1 25 VAL CA C -0.390 2.690 -3.539 1.00 . A A . 22 VAL CA 1 1 20 14301 1 1 25 VAL CB C 0.305 1.343 -3.877 1.00 . A A . 22 VAL CB 1 1 20 14302 1 1 25 VAL CG1 C 1.247 0.895 -2.767 1.00 . A A . 22 VAL CG1 1 1 20 14303 1 1 25 VAL CG2 C -0.728 0.263 -4.167 1.00 . A A . 22 VAL CG2 1 1 20 14304 1 1 25 VAL H H 1.485 3.575 -3.221 1.00 . A A . 22 VAL H 1 1 20 14305 1 1 25 VAL HA H -1.055 2.940 -4.354 1.00 . A A . 22 VAL HA 1 1 20 14306 1 1 25 VAL HB H 0.894 1.486 -4.770 1.00 . A A . 22 VAL HB 1 1 20 14307 1 1 25 VAL HG11 H 0.679 0.712 -1.867 1.00 . A A . 22 VAL HG11 1 1 20 14308 1 1 25 VAL HG12 H 1.974 1.669 -2.579 1.00 . A A . 22 VAL HG12 1 1 20 14309 1 1 25 VAL HG13 H 1.756 -0.011 -3.065 1.00 . A A . 22 VAL HG13 1 1 20 14310 1 1 25 VAL HG21 H -1.374 0.142 -3.310 1.00 . A A . 22 VAL HG21 1 1 20 14311 1 1 25 VAL HG22 H -0.226 -0.671 -4.374 1.00 . A A . 22 VAL HG22 1 1 20 14312 1 1 25 VAL HG23 H -1.320 0.552 -5.024 1.00 . A A . 22 VAL HG23 1 1 20 14313 1 1 25 VAL N N 0.553 3.777 -3.402 1.00 . A A . 22 VAL N 1 1 20 14314 1 1 25 VAL O O -0.680 2.409 -1.163 1.00 . A A . 22 VAL O 1 1 20 14315 1 1 26 GLN C C -3.645 1.156 -0.946 1.00 . A A . 23 GLN C 1 1 20 14316 1 1 26 GLN CA C -3.436 2.615 -1.323 1.00 . A A . 23 GLN CA 1 1 20 14317 1 1 26 GLN CB C -4.750 3.297 -1.699 1.00 . A A . 23 GLN CB 1 1 20 14318 1 1 26 GLN CD C -5.849 5.465 -2.438 1.00 . A A . 23 GLN CD 1 1 20 14319 1 1 26 GLN CG C -4.592 4.794 -1.920 1.00 . A A . 23 GLN CG 1 1 20 14320 1 1 26 GLN H H -2.850 2.907 -3.326 1.00 . A A . 23 GLN H 1 1 20 14321 1 1 26 GLN HA H -3.004 3.129 -0.476 1.00 . A A . 23 GLN HA 1 1 20 14322 1 1 26 GLN HB2 H -5.130 2.852 -2.606 1.00 . A A . 23 GLN HB2 1 1 20 14323 1 1 26 GLN HB3 H -5.466 3.146 -0.905 1.00 . A A . 23 GLN HB3 1 1 20 14324 1 1 26 GLN HE21 H -6.349 3.835 -3.445 1.00 . A A . 23 GLN HE21 1 1 20 14325 1 1 26 GLN HE22 H -7.441 5.170 -3.585 1.00 . A A . 23 GLN HE22 1 1 20 14326 1 1 26 GLN HG2 H -4.324 5.254 -0.982 1.00 . A A . 23 GLN HG2 1 1 20 14327 1 1 26 GLN HG3 H -3.798 4.955 -2.635 1.00 . A A . 23 GLN HG3 1 1 20 14328 1 1 26 GLN N N -2.507 2.717 -2.428 1.00 . A A . 23 GLN N 1 1 20 14329 1 1 26 GLN NE2 N -6.624 4.750 -3.233 1.00 . A A . 23 GLN NE2 1 1 20 14330 1 1 26 GLN O O -4.361 0.412 -1.621 1.00 . A A . 23 GLN O 1 1 20 14331 1 1 26 GLN OE1 O -6.112 6.630 -2.138 1.00 . A A . 23 GLN OE1 1 1 20 14332 1 1 27 THR C C -4.102 -0.803 1.642 1.00 . A A . 24 THR C 1 1 20 14333 1 1 27 THR CA C -3.018 -0.615 0.589 1.00 . A A . 24 THR CA 1 1 20 14334 1 1 27 THR CB C -1.659 -1.017 1.181 1.00 . A A . 24 THR CB 1 1 20 14335 1 1 27 THR CG2 C -0.675 -1.390 0.086 1.00 . A A . 24 THR CG2 1 1 20 14336 1 1 27 THR H H -2.432 1.405 0.611 1.00 . A A . 24 THR H 1 1 20 14337 1 1 27 THR HA H -3.227 -1.258 -0.254 1.00 . A A . 24 THR HA 1 1 20 14338 1 1 27 THR HB H -1.800 -1.872 1.826 1.00 . A A . 24 THR HB 1 1 20 14339 1 1 27 THR HG1 H -0.343 -0.226 2.428 1.00 . A A . 24 THR HG1 1 1 20 14340 1 1 27 THR HG21 H -1.124 -2.127 -0.563 1.00 . A A . 24 THR HG21 1 1 20 14341 1 1 27 THR HG22 H 0.217 -1.805 0.534 1.00 . A A . 24 THR HG22 1 1 20 14342 1 1 27 THR HG23 H -0.416 -0.512 -0.486 1.00 . A A . 24 THR HG23 1 1 20 14343 1 1 27 THR N N -2.976 0.752 0.118 1.00 . A A . 24 THR N 1 1 20 14344 1 1 27 THR O O -4.559 0.157 2.263 1.00 . A A . 24 THR O 1 1 20 14345 1 1 27 THR OG1 O -1.136 0.067 1.951 1.00 . A A . 24 THR OG1 1 1 20 14346 1 1 28 CYS C C -5.018 -2.548 4.174 1.00 . A A . 25 CYS C 1 1 20 14347 1 1 28 CYS CA C -5.573 -2.371 2.766 1.00 . A A . 25 CYS CA 1 1 20 14348 1 1 28 CYS CB C -6.290 -3.648 2.316 1.00 . A A . 25 CYS CB 1 1 20 14349 1 1 28 CYS H H -4.086 -2.765 1.326 1.00 . A A . 25 CYS H 1 1 20 14350 1 1 28 CYS HA H -6.277 -1.553 2.766 1.00 . A A . 25 CYS HA 1 1 20 14351 1 1 28 CYS HB2 H -7.158 -3.808 2.929 1.00 . A A . 25 CYS HB2 1 1 20 14352 1 1 28 CYS HB3 H -6.605 -3.528 1.295 1.00 . A A . 25 CYS HB3 1 1 20 14353 1 1 28 CYS N N -4.508 -2.048 1.833 1.00 . A A . 25 CYS N 1 1 20 14354 1 1 28 CYS O O -5.722 -2.334 5.160 1.00 . A A . 25 CYS O 1 1 20 14355 1 1 28 CYS SG S -5.275 -5.137 2.401 1.00 . A A . 25 CYS SG 1 1 20 14356 1 1 29 SER C C -1.600 -3.041 5.438 1.00 . A A . 26 SER C 1 1 20 14357 1 1 29 SER CA C -3.117 -3.176 5.553 1.00 . A A . 26 SER CA 1 1 20 14358 1 1 29 SER CB C -3.476 -4.570 6.084 1.00 . A A . 26 SER CB 1 1 20 14359 1 1 29 SER H H -3.227 -3.071 3.443 1.00 . A A . 26 SER H 1 1 20 14360 1 1 29 SER HA H -3.483 -2.430 6.243 1.00 . A A . 26 SER HA 1 1 20 14361 1 1 29 SER HB2 H -3.032 -5.320 5.447 1.00 . A A . 26 SER HB2 1 1 20 14362 1 1 29 SER HB3 H -3.092 -4.679 7.087 1.00 . A A . 26 SER HB3 1 1 20 14363 1 1 29 SER HG H -5.325 -3.921 5.984 1.00 . A A . 26 SER HG 1 1 20 14364 1 1 29 SER N N -3.751 -2.941 4.264 1.00 . A A . 26 SER N 1 1 20 14365 1 1 29 SER O O -1.077 -2.814 4.340 1.00 . A A . 26 SER O 1 1 20 14366 1 1 29 SER OG O -4.879 -4.770 6.111 1.00 . A A . 26 SER OG 1 1 20 14367 1 1 30 LEU C C 1.144 -4.275 5.749 1.00 . A A . 27 LEU C 1 1 20 14368 1 1 30 LEU CA C 0.560 -3.126 6.560 1.00 . A A . 27 LEU CA 1 1 20 14369 1 1 30 LEU CB C 1.106 -3.172 7.991 1.00 . A A . 27 LEU CB 1 1 20 14370 1 1 30 LEU CD1 C 1.301 -2.157 10.267 1.00 . A A . 27 LEU CD1 1 1 20 14371 1 1 30 LEU CD2 C 1.591 -0.725 8.245 1.00 . A A . 27 LEU CD2 1 1 20 14372 1 1 30 LEU CG C 0.857 -1.921 8.833 1.00 . A A . 27 LEU CG 1 1 20 14373 1 1 30 LEU H H -1.374 -3.329 7.406 1.00 . A A . 27 LEU H 1 1 20 14374 1 1 30 LEU HA H 0.854 -2.195 6.102 1.00 . A A . 27 LEU HA 1 1 20 14375 1 1 30 LEU HB2 H 0.659 -4.014 8.496 1.00 . A A . 27 LEU HB2 1 1 20 14376 1 1 30 LEU HB3 H 2.172 -3.331 7.937 1.00 . A A . 27 LEU HB3 1 1 20 14377 1 1 30 LEU HD11 H 0.734 -2.973 10.689 1.00 . A A . 27 LEU HD11 1 1 20 14378 1 1 30 LEU HD12 H 1.132 -1.263 10.849 1.00 . A A . 27 LEU HD12 1 1 20 14379 1 1 30 LEU HD13 H 2.352 -2.403 10.282 1.00 . A A . 27 LEU HD13 1 1 20 14380 1 1 30 LEU HD21 H 2.649 -0.935 8.208 1.00 . A A . 27 LEU HD21 1 1 20 14381 1 1 30 LEU HD22 H 1.420 0.143 8.864 1.00 . A A . 27 LEU HD22 1 1 20 14382 1 1 30 LEU HD23 H 1.226 -0.533 7.248 1.00 . A A . 27 LEU HD23 1 1 20 14383 1 1 30 LEU HG H -0.200 -1.699 8.840 1.00 . A A . 27 LEU HG 1 1 20 14384 1 1 30 LEU N N -0.899 -3.182 6.558 1.00 . A A . 27 LEU N 1 1 20 14385 1 1 30 LEU O O 2.178 -4.121 5.102 1.00 . A A . 27 LEU O 1 1 20 14386 1 1 31 GLU C C 1.105 -6.240 3.549 1.00 . A A . 28 GLU C 1 1 20 14387 1 1 31 GLU CA C 0.887 -6.593 5.018 1.00 . A A . 28 GLU CA 1 1 20 14388 1 1 31 GLU CB C -0.155 -7.708 5.146 1.00 . A A . 28 GLU CB 1 1 20 14389 1 1 31 GLU CD C 1.552 -9.558 4.989 1.00 . A A . 28 GLU CD 1 1 20 14390 1 1 31 GLU CG C 0.248 -9.003 4.459 1.00 . A A . 28 GLU CG 1 1 20 14391 1 1 31 GLU H H -0.339 -5.481 6.340 1.00 . A A . 28 GLU H 1 1 20 14392 1 1 31 GLU HA H 1.823 -6.937 5.435 1.00 . A A . 28 GLU HA 1 1 20 14393 1 1 31 GLU HB2 H -0.313 -7.918 6.193 1.00 . A A . 28 GLU HB2 1 1 20 14394 1 1 31 GLU HB3 H -1.083 -7.368 4.712 1.00 . A A . 28 GLU HB3 1 1 20 14395 1 1 31 GLU HG2 H -0.528 -9.737 4.615 1.00 . A A . 28 GLU HG2 1 1 20 14396 1 1 31 GLU HG3 H 0.357 -8.814 3.400 1.00 . A A . 28 GLU HG3 1 1 20 14397 1 1 31 GLU N N 0.464 -5.420 5.777 1.00 . A A . 28 GLU N 1 1 20 14398 1 1 31 GLU O O 2.177 -6.474 2.999 1.00 . A A . 28 GLU O 1 1 20 14399 1 1 31 GLU OE1 O 1.542 -10.186 6.067 1.00 . A A . 28 GLU OE1 1 1 20 14400 1 1 31 GLU OE2 O 2.598 -9.357 4.338 1.00 . A A . 28 GLU OE2 1 1 20 14401 1 1 32 CYS C C 1.165 -4.099 1.337 1.00 . A A . 29 CYS C 1 1 20 14402 1 1 32 CYS CA C 0.183 -5.249 1.535 1.00 . A A . 29 CYS CA 1 1 20 14403 1 1 32 CYS CB C -1.197 -4.870 1.015 1.00 . A A . 29 CYS CB 1 1 20 14404 1 1 32 CYS H H -0.725 -5.460 3.421 1.00 . A A . 29 CYS H 1 1 20 14405 1 1 32 CYS HA H 0.536 -6.103 0.980 1.00 . A A . 29 CYS HA 1 1 20 14406 1 1 32 CYS HB2 H -1.731 -4.343 1.794 1.00 . A A . 29 CYS HB2 1 1 20 14407 1 1 32 CYS HB3 H -1.091 -4.222 0.161 1.00 . A A . 29 CYS HB3 1 1 20 14408 1 1 32 CYS N N 0.097 -5.641 2.930 1.00 . A A . 29 CYS N 1 1 20 14409 1 1 32 CYS O O 1.732 -3.935 0.259 1.00 . A A . 29 CYS O 1 1 20 14410 1 1 32 CYS SG S -2.208 -6.282 0.522 1.00 . A A . 29 CYS SG 1 1 20 14411 1 1 33 SER C C 3.726 -2.684 2.241 1.00 . A A . 30 SER C 1 1 20 14412 1 1 33 SER CA C 2.288 -2.188 2.313 1.00 . A A . 30 SER CA 1 1 20 14413 1 1 33 SER CB C 2.099 -1.276 3.525 1.00 . A A . 30 SER CB 1 1 20 14414 1 1 33 SER H H 0.904 -3.497 3.222 1.00 . A A . 30 SER H 1 1 20 14415 1 1 33 SER HA H 2.067 -1.632 1.415 1.00 . A A . 30 SER HA 1 1 20 14416 1 1 33 SER HB2 H 2.338 -1.823 4.424 1.00 . A A . 30 SER HB2 1 1 20 14417 1 1 33 SER HB3 H 2.753 -0.421 3.436 1.00 . A A . 30 SER HB3 1 1 20 14418 1 1 33 SER HG H 0.219 -1.493 4.049 1.00 . A A . 30 SER HG 1 1 20 14419 1 1 33 SER N N 1.369 -3.312 2.382 1.00 . A A . 30 SER N 1 1 20 14420 1 1 33 SER O O 4.559 -2.102 1.557 1.00 . A A . 30 SER O 1 1 20 14421 1 1 33 SER OG O 0.757 -0.821 3.611 1.00 . A A . 30 SER OG 1 1 20 14422 1 1 34 LYS C C 5.467 -5.445 1.892 1.00 . A A . 31 LYS C 1 1 20 14423 1 1 34 LYS CA C 5.348 -4.342 2.938 1.00 . A A . 31 LYS CA 1 1 20 14424 1 1 34 LYS CB C 5.715 -4.864 4.330 1.00 . A A . 31 LYS CB 1 1 20 14425 1 1 34 LYS CD C 5.264 -6.437 6.221 1.00 . A A . 31 LYS CD 1 1 20 14426 1 1 34 LYS CE C 4.491 -7.654 6.707 1.00 . A A . 31 LYS CE 1 1 20 14427 1 1 34 LYS CG C 4.874 -6.036 4.808 1.00 . A A . 31 LYS CG 1 1 20 14428 1 1 34 LYS H H 3.303 -4.204 3.472 1.00 . A A . 31 LYS H 1 1 20 14429 1 1 34 LYS HA H 6.030 -3.551 2.673 1.00 . A A . 31 LYS HA 1 1 20 14430 1 1 34 LYS HB2 H 6.748 -5.174 4.322 1.00 . A A . 31 LYS HB2 1 1 20 14431 1 1 34 LYS HB3 H 5.597 -4.057 5.039 1.00 . A A . 31 LYS HB3 1 1 20 14432 1 1 34 LYS HD2 H 6.318 -6.665 6.239 1.00 . A A . 31 LYS HD2 1 1 20 14433 1 1 34 LYS HD3 H 5.064 -5.609 6.884 1.00 . A A . 31 LYS HD3 1 1 20 14434 1 1 34 LYS HE2 H 4.804 -7.882 7.714 1.00 . A A . 31 LYS HE2 1 1 20 14435 1 1 34 LYS HE3 H 3.437 -7.416 6.706 1.00 . A A . 31 LYS HE3 1 1 20 14436 1 1 34 LYS HG2 H 3.832 -5.752 4.797 1.00 . A A . 31 LYS HG2 1 1 20 14437 1 1 34 LYS HG3 H 5.029 -6.876 4.147 1.00 . A A . 31 LYS HG3 1 1 20 14438 1 1 34 LYS HZ1 H 4.490 -9.716 6.384 1.00 . A A . 31 LYS HZ1 1 1 20 14439 1 1 34 LYS HZ2 H 5.708 -8.897 5.544 1.00 . A A . 31 LYS HZ2 1 1 20 14440 1 1 34 LYS HZ3 H 4.101 -8.812 5.007 1.00 . A A . 31 LYS HZ3 1 1 20 14441 1 1 34 LYS N N 4.009 -3.775 2.939 1.00 . A A . 31 LYS N 1 1 20 14442 1 1 34 LYS NZ N 4.717 -8.851 5.851 1.00 . A A . 31 LYS NZ 1 1 20 14443 1 1 34 LYS O O 6.559 -5.943 1.616 1.00 . A A . 31 LYS O 1 1 20 14444 1 1 35 LYS C C 5.083 -6.359 -0.967 1.00 . A A . 32 LYS C 1 1 20 14445 1 1 35 LYS CA C 4.300 -6.807 0.249 1.00 . A A . 32 LYS CA 1 1 20 14446 1 1 35 LYS CB C 2.868 -7.110 -0.149 1.00 . A A . 32 LYS CB 1 1 20 14447 1 1 35 LYS CD C 0.979 -8.746 -0.064 1.00 . A A . 32 LYS CD 1 1 20 14448 1 1 35 LYS CE C 0.520 -10.107 0.430 1.00 . A A . 32 LYS CE 1 1 20 14449 1 1 35 LYS CG C 2.402 -8.460 0.353 1.00 . A A . 32 LYS CG 1 1 20 14450 1 1 35 LYS H H 3.499 -5.382 1.587 1.00 . A A . 32 LYS H 1 1 20 14451 1 1 35 LYS HA H 4.744 -7.709 0.637 1.00 . A A . 32 LYS HA 1 1 20 14452 1 1 35 LYS HB2 H 2.227 -6.349 0.266 1.00 . A A . 32 LYS HB2 1 1 20 14453 1 1 35 LYS HB3 H 2.789 -7.091 -1.226 1.00 . A A . 32 LYS HB3 1 1 20 14454 1 1 35 LYS HD2 H 0.336 -7.986 0.348 1.00 . A A . 32 LYS HD2 1 1 20 14455 1 1 35 LYS HD3 H 0.924 -8.725 -1.141 1.00 . A A . 32 LYS HD3 1 1 20 14456 1 1 35 LYS HE2 H 0.675 -10.156 1.497 1.00 . A A . 32 LYS HE2 1 1 20 14457 1 1 35 LYS HE3 H -0.531 -10.219 0.214 1.00 . A A . 32 LYS HE3 1 1 20 14458 1 1 35 LYS HG2 H 3.044 -9.225 -0.054 1.00 . A A . 32 LYS HG2 1 1 20 14459 1 1 35 LYS HG3 H 2.462 -8.473 1.432 1.00 . A A . 32 LYS HG3 1 1 20 14460 1 1 35 LYS HZ1 H 2.283 -11.140 0.004 1.00 . A A . 32 LYS HZ1 1 1 20 14461 1 1 35 LYS HZ2 H 1.145 -11.182 -1.244 1.00 . A A . 32 LYS HZ2 1 1 20 14462 1 1 35 LYS HZ3 H 0.919 -12.131 0.136 1.00 . A A . 32 LYS HZ3 1 1 20 14463 1 1 35 LYS N N 4.337 -5.801 1.300 1.00 . A A . 32 LYS N 1 1 20 14464 1 1 35 LYS NZ N 1.269 -11.216 -0.213 1.00 . A A . 32 LYS NZ 1 1 20 14465 1 1 35 LYS O O 5.867 -7.124 -1.530 1.00 . A A . 32 LYS O 1 1 20 14466 1 1 36 HIS C C 7.043 -4.271 -2.134 1.00 . A A . 33 HIS C 1 1 20 14467 1 1 36 HIS CA C 5.598 -4.595 -2.518 1.00 . A A . 33 HIS CA 1 1 20 14468 1 1 36 HIS CB C 4.875 -3.373 -3.116 1.00 . A A . 33 HIS CB 1 1 20 14469 1 1 36 HIS CD2 C 5.869 -1.491 -1.634 1.00 . A A . 33 HIS CD2 1 1 20 14470 1 1 36 HIS CE1 C 4.084 -0.378 -1.193 1.00 . A A . 33 HIS CE1 1 1 20 14471 1 1 36 HIS CG C 4.856 -2.138 -2.253 1.00 . A A . 33 HIS CG 1 1 20 14472 1 1 36 HIS H H 4.242 -4.542 -0.894 1.00 . A A . 33 HIS H 1 1 20 14473 1 1 36 HIS HA H 5.616 -5.380 -3.261 1.00 . A A . 33 HIS HA 1 1 20 14474 1 1 36 HIS HB2 H 5.345 -3.111 -4.049 1.00 . A A . 33 HIS HB2 1 1 20 14475 1 1 36 HIS HB3 H 3.846 -3.653 -3.309 1.00 . A A . 33 HIS HB3 1 1 20 14476 1 1 36 HIS HD1 H 2.811 -1.634 -2.256 1.00 . A A . 33 HIS HD1 1 1 20 14477 1 1 36 HIS HD2 H 6.898 -1.793 -1.649 1.00 . A A . 33 HIS HD2 1 1 20 14478 1 1 36 HIS HE1 H 3.392 0.340 -0.788 1.00 . A A . 33 HIS HE1 1 1 20 14479 1 1 36 HIS N N 4.884 -5.115 -1.372 1.00 . A A . 33 HIS N 1 1 20 14480 1 1 36 HIS ND1 N 3.723 -1.421 -1.959 1.00 . A A . 33 HIS ND1 1 1 20 14481 1 1 36 HIS NE2 N 5.388 -0.369 -0.970 1.00 . A A . 33 HIS NE2 1 1 20 14482 1 1 36 HIS O O 7.915 -4.158 -2.986 1.00 . A A . 33 HIS O 1 1 20 14483 1 1 37 LYS C C 9.558 -5.032 -0.457 1.00 . A A . 34 LYS C 1 1 20 14484 1 1 37 LYS CA C 8.633 -3.828 -0.348 1.00 . A A . 34 LYS CA 1 1 20 14485 1 1 37 LYS CB C 8.579 -3.351 1.107 1.00 . A A . 34 LYS CB 1 1 20 14486 1 1 37 LYS CD C 7.739 -1.665 2.775 1.00 . A A . 34 LYS CD 1 1 20 14487 1 1 37 LYS CE C 6.804 -0.488 3.001 1.00 . A A . 34 LYS CE 1 1 20 14488 1 1 37 LYS CG C 7.757 -2.088 1.313 1.00 . A A . 34 LYS CG 1 1 20 14489 1 1 37 LYS H H 6.581 -4.325 -0.187 1.00 . A A . 34 LYS H 1 1 20 14490 1 1 37 LYS HA H 9.021 -3.032 -0.966 1.00 . A A . 34 LYS HA 1 1 20 14491 1 1 37 LYS HB2 H 8.150 -4.134 1.715 1.00 . A A . 34 LYS HB2 1 1 20 14492 1 1 37 LYS HB3 H 9.586 -3.157 1.446 1.00 . A A . 34 LYS HB3 1 1 20 14493 1 1 37 LYS HD2 H 7.412 -2.495 3.381 1.00 . A A . 34 LYS HD2 1 1 20 14494 1 1 37 LYS HD3 H 8.738 -1.378 3.067 1.00 . A A . 34 LYS HD3 1 1 20 14495 1 1 37 LYS HE2 H 7.211 0.378 2.501 1.00 . A A . 34 LYS HE2 1 1 20 14496 1 1 37 LYS HE3 H 5.838 -0.725 2.576 1.00 . A A . 34 LYS HE3 1 1 20 14497 1 1 37 LYS HG2 H 8.186 -1.291 0.724 1.00 . A A . 34 LYS HG2 1 1 20 14498 1 1 37 LYS HG3 H 6.745 -2.274 0.987 1.00 . A A . 34 LYS HG3 1 1 20 14499 1 1 37 LYS HZ1 H 6.158 -0.963 4.930 1.00 . A A . 34 LYS HZ1 1 1 20 14500 1 1 37 LYS HZ2 H 6.060 0.681 4.562 1.00 . A A . 34 LYS HZ2 1 1 20 14501 1 1 37 LYS HZ3 H 7.560 -0.022 4.892 1.00 . A A . 34 LYS HZ3 1 1 20 14502 1 1 37 LYS N N 7.301 -4.164 -0.834 1.00 . A A . 34 LYS N 1 1 20 14503 1 1 37 LYS NZ N 6.634 -0.176 4.445 1.00 . A A . 34 LYS NZ 1 1 20 14504 1 1 37 LYS O O 10.747 -4.894 -0.736 1.00 . A A . 34 LYS O 1 1 20 14505 1 1 38 THR C C 10.067 -7.963 -1.638 1.00 . A A . 35 THR C 1 1 20 14506 1 1 38 THR CA C 9.778 -7.435 -0.229 1.00 . A A . 35 THR CA 1 1 20 14507 1 1 38 THR CB C 9.054 -8.515 0.610 1.00 . A A . 35 THR CB 1 1 20 14508 1 1 38 THR CG2 C 7.816 -9.038 -0.105 1.00 . A A . 35 THR CG2 1 1 20 14509 1 1 38 THR H H 8.022 -6.262 -0.129 1.00 . A A . 35 THR H 1 1 20 14510 1 1 38 THR HA H 10.717 -7.206 0.252 1.00 . A A . 35 THR HA 1 1 20 14511 1 1 38 THR HB H 8.742 -8.063 1.540 1.00 . A A . 35 THR HB 1 1 20 14512 1 1 38 THR HG1 H 10.832 -9.271 1.023 1.00 . A A . 35 THR HG1 1 1 20 14513 1 1 38 THR HG21 H 8.097 -9.432 -1.070 1.00 . A A . 35 THR HG21 1 1 20 14514 1 1 38 THR HG22 H 7.106 -8.233 -0.237 1.00 . A A . 35 THR HG22 1 1 20 14515 1 1 38 THR HG23 H 7.364 -9.820 0.485 1.00 . A A . 35 THR HG23 1 1 20 14516 1 1 38 THR N N 8.994 -6.212 -0.266 1.00 . A A . 35 THR N 1 1 20 14517 1 1 38 THR O O 10.768 -8.962 -1.809 1.00 . A A . 35 THR O 1 1 20 14518 1 1 38 THR OG1 O 9.936 -9.609 0.893 1.00 . A A . 35 THR OG1 1 1 20 14519 1 1 39 ARG C C 10.195 -6.579 -4.926 1.00 . A A . 36 ARG C 1 1 20 14520 1 1 39 ARG CA C 9.736 -7.725 -4.028 1.00 . A A . 36 ARG CA 1 1 20 14521 1 1 39 ARG CB C 8.451 -8.355 -4.569 1.00 . A A . 36 ARG CB 1 1 20 14522 1 1 39 ARG CD C 5.960 -8.211 -4.850 1.00 . A A . 36 ARG CD 1 1 20 14523 1 1 39 ARG CG C 7.218 -7.481 -4.410 1.00 . A A . 36 ARG CG 1 1 20 14524 1 1 39 ARG CZ C 4.880 -10.384 -4.397 1.00 . A A . 36 ARG CZ 1 1 20 14525 1 1 39 ARG H H 9.010 -6.485 -2.467 1.00 . A A . 36 ARG H 1 1 20 14526 1 1 39 ARG HA H 10.509 -8.477 -4.019 1.00 . A A . 36 ARG HA 1 1 20 14527 1 1 39 ARG HB2 H 8.582 -8.564 -5.619 1.00 . A A . 36 ARG HB2 1 1 20 14528 1 1 39 ARG HB3 H 8.275 -9.285 -4.047 1.00 . A A . 36 ARG HB3 1 1 20 14529 1 1 39 ARG HD2 H 5.121 -7.538 -4.765 1.00 . A A . 36 ARG HD2 1 1 20 14530 1 1 39 ARG HD3 H 6.076 -8.513 -5.881 1.00 . A A . 36 ARG HD3 1 1 20 14531 1 1 39 ARG HE H 6.166 -9.464 -3.172 1.00 . A A . 36 ARG HE 1 1 20 14532 1 1 39 ARG HG2 H 7.117 -7.205 -3.370 1.00 . A A . 36 ARG HG2 1 1 20 14533 1 1 39 ARG HG3 H 7.339 -6.592 -5.011 1.00 . A A . 36 ARG HG3 1 1 20 14534 1 1 39 ARG HH11 H 4.333 -9.524 -6.152 1.00 . A A . 36 ARG HH11 1 1 20 14535 1 1 39 ARG HH12 H 3.600 -11.058 -5.820 1.00 . A A . 36 ARG HH12 1 1 20 14536 1 1 39 ARG HH21 H 5.202 -11.482 -2.721 1.00 . A A . 36 ARG HH21 1 1 20 14537 1 1 39 ARG HH22 H 4.099 -12.176 -3.867 1.00 . A A . 36 ARG HH22 1 1 20 14538 1 1 39 ARG N N 9.539 -7.287 -2.650 1.00 . A A . 36 ARG N 1 1 20 14539 1 1 39 ARG NE N 5.700 -9.398 -4.036 1.00 . A A . 36 ARG NE 1 1 20 14540 1 1 39 ARG NH1 N 4.219 -10.316 -5.548 1.00 . A A . 36 ARG NH1 1 1 20 14541 1 1 39 ARG NH2 N 4.712 -11.431 -3.600 1.00 . A A . 36 ARG NH2 1 1 20 14542 1 1 39 ARG O O 10.959 -6.788 -5.870 1.00 . A A . 36 ARG O 1 1 20 14543 1 1 40 ASP C C 11.156 -3.379 -4.697 1.00 . A A . 37 ASP C 1 1 20 14544 1 1 40 ASP CA C 10.095 -4.201 -5.422 1.00 . A A . 37 ASP CA 1 1 20 14545 1 1 40 ASP CB C 8.840 -3.360 -5.699 1.00 . A A . 37 ASP CB 1 1 20 14546 1 1 40 ASP CG C 9.088 -2.183 -6.621 1.00 . A A . 37 ASP CG 1 1 20 14547 1 1 40 ASP H H 9.152 -5.255 -3.854 1.00 . A A . 37 ASP H 1 1 20 14548 1 1 40 ASP HA H 10.501 -4.548 -6.359 1.00 . A A . 37 ASP HA 1 1 20 14549 1 1 40 ASP HB2 H 8.090 -3.990 -6.154 1.00 . A A . 37 ASP HB2 1 1 20 14550 1 1 40 ASP HB3 H 8.458 -2.983 -4.761 1.00 . A A . 37 ASP HB3 1 1 20 14551 1 1 40 ASP N N 9.742 -5.371 -4.626 1.00 . A A . 37 ASP N 1 1 20 14552 1 1 40 ASP O O 11.600 -2.340 -5.182 1.00 . A A . 37 ASP O 1 1 20 14553 1 1 40 ASP OD1 O 9.377 -2.404 -7.814 1.00 . A A . 37 ASP OD1 1 1 20 14554 1 1 40 ASP OD2 O 8.973 -1.027 -6.159 1.00 . A A . 37 ASP OD2 1 1 20 14555 1 1 41 ASN C C 12.278 -1.833 -2.315 1.00 . A A . 38 ASN C 1 1 20 14556 1 1 41 ASN CA C 12.629 -3.255 -2.737 1.00 . A A . 38 ASN CA 1 1 20 14557 1 1 41 ASN CB C 13.946 -3.271 -3.515 1.00 . A A . 38 ASN CB 1 1 20 14558 1 1 41 ASN CG C 14.608 -4.635 -3.520 1.00 . A A . 38 ASN CG 1 1 20 14559 1 1 41 ASN H H 11.139 -4.683 -3.182 1.00 . A A . 38 ASN H 1 1 20 14560 1 1 41 ASN HA H 12.754 -3.851 -1.845 1.00 . A A . 38 ASN HA 1 1 20 14561 1 1 41 ASN HB2 H 13.750 -2.986 -4.538 1.00 . A A . 38 ASN HB2 1 1 20 14562 1 1 41 ASN HB3 H 14.625 -2.562 -3.072 1.00 . A A . 38 ASN HB3 1 1 20 14563 1 1 41 ASN HD21 H 16.396 -3.789 -3.694 1.00 . A A . 38 ASN HD21 1 1 20 14564 1 1 41 ASN HD22 H 16.383 -5.519 -3.622 1.00 . A A . 38 ASN HD22 1 1 20 14565 1 1 41 ASN N N 11.561 -3.871 -3.524 1.00 . A A . 38 ASN N 1 1 20 14566 1 1 41 ASN ND2 N 15.926 -4.649 -3.624 1.00 . A A . 38 ASN ND2 1 1 20 14567 1 1 41 ASN O O 13.146 -0.967 -2.216 1.00 . A A . 38 ASN O 1 1 20 14568 1 1 41 ASN OD1 O 13.939 -5.668 -3.437 1.00 . A A . 38 ASN OD1 1 1 20 14569 1 1 42 CYS C C 10.666 -0.241 -0.062 1.00 . A A . 39 CYS C 1 1 20 14570 1 1 42 CYS CA C 10.537 -0.312 -1.579 1.00 . A A . 39 CYS CA 1 1 20 14571 1 1 42 CYS CB C 9.079 -0.087 -2.005 1.00 . A A . 39 CYS CB 1 1 20 14572 1 1 42 CYS H H 10.353 -2.323 -2.193 1.00 . A A . 39 CYS H 1 1 20 14573 1 1 42 CYS HA H 11.157 0.453 -2.014 1.00 . A A . 39 CYS HA 1 1 20 14574 1 1 42 CYS HB2 H 9.024 -0.093 -3.082 1.00 . A A . 39 CYS HB2 1 1 20 14575 1 1 42 CYS HB3 H 8.479 -0.893 -1.617 1.00 . A A . 39 CYS HB3 1 1 20 14576 1 1 42 CYS N N 11.001 -1.603 -2.058 1.00 . A A . 39 CYS N 1 1 20 14577 1 1 42 CYS O O 10.956 -1.244 0.597 1.00 . A A . 39 CYS O 1 1 20 14578 1 1 42 CYS SG S 8.347 1.469 -1.430 1.00 . A A . 39 CYS SG 1 1 20 14579 1 1 43 SER C C 9.567 2.380 2.180 1.00 . A A . 40 SER C 1 1 20 14580 1 1 43 SER CA C 10.417 1.148 1.903 1.00 . A A . 40 SER CA 1 1 20 14581 1 1 43 SER CB C 11.826 1.308 2.485 1.00 . A A . 40 SER CB 1 1 20 14582 1 1 43 SER H H 10.347 1.720 -0.113 1.00 . A A . 40 SER H 1 1 20 14583 1 1 43 SER HA H 9.943 0.285 2.341 1.00 . A A . 40 SER HA 1 1 20 14584 1 1 43 SER HB2 H 12.478 0.564 2.054 1.00 . A A . 40 SER HB2 1 1 20 14585 1 1 43 SER HB3 H 12.199 2.293 2.251 1.00 . A A . 40 SER HB3 1 1 20 14586 1 1 43 SER HG H 12.694 0.840 4.178 1.00 . A A . 40 SER HG 1 1 20 14587 1 1 43 SER N N 10.471 0.945 0.477 1.00 . A A . 40 SER N 1 1 20 14588 1 1 43 SER O O 9.467 3.273 1.336 1.00 . A A . 40 SER O 1 1 20 14589 1 1 43 SER OG O 11.823 1.147 3.896 1.00 . A A . 40 SER OG 1 1 20 14590 1 1 44 GLY C C 8.854 4.672 4.293 1.00 . A A . 41 GLY C 1 1 20 14591 1 1 44 GLY CA C 8.078 3.538 3.667 1.00 . A A . 41 GLY CA 1 1 20 14592 1 1 44 GLY H H 9.071 1.699 3.988 1.00 . A A . 41 GLY H 1 1 20 14593 1 1 44 GLY HA2 H 7.606 3.893 2.763 1.00 . A A . 41 GLY HA2 1 1 20 14594 1 1 44 GLY HA3 H 7.318 3.211 4.354 1.00 . A A . 41 GLY HA3 1 1 20 14595 1 1 44 GLY N N 8.937 2.422 3.340 1.00 . A A . 41 GLY N 1 1 20 14596 1 1 44 GLY O O 8.628 5.033 5.449 1.00 . A A . 41 GLY O 1 1 20 14597 1 1 45 GLN C C 10.590 7.445 3.004 1.00 . A A . 42 GLN C 1 1 20 14598 1 1 45 GLN CA C 10.620 6.306 4.002 1.00 . A A . 42 GLN CA 1 1 20 14599 1 1 45 GLN CB C 12.059 5.825 4.206 1.00 . A A . 42 GLN CB 1 1 20 14600 1 1 45 GLN CD C 13.634 4.330 5.483 1.00 . A A . 42 GLN CD 1 1 20 14601 1 1 45 GLN CG C 12.190 4.679 5.196 1.00 . A A . 42 GLN CG 1 1 20 14602 1 1 45 GLN H H 9.886 4.912 2.603 1.00 . A A . 42 GLN H 1 1 20 14603 1 1 45 GLN HA H 10.223 6.652 4.944 1.00 . A A . 42 GLN HA 1 1 20 14604 1 1 45 GLN HB2 H 12.453 5.498 3.256 1.00 . A A . 42 GLN HB2 1 1 20 14605 1 1 45 GLN HB3 H 12.654 6.653 4.565 1.00 . A A . 42 GLN HB3 1 1 20 14606 1 1 45 GLN HE21 H 13.663 5.630 6.980 1.00 . A A . 42 GLN HE21 1 1 20 14607 1 1 45 GLN HE22 H 15.139 4.774 6.695 1.00 . A A . 42 GLN HE22 1 1 20 14608 1 1 45 GLN HG2 H 11.713 4.963 6.121 1.00 . A A . 42 GLN HG2 1 1 20 14609 1 1 45 GLN HG3 H 11.697 3.809 4.789 1.00 . A A . 42 GLN HG3 1 1 20 14610 1 1 45 GLN N N 9.778 5.227 3.528 1.00 . A A . 42 GLN N 1 1 20 14611 1 1 45 GLN NE2 N 14.203 4.974 6.486 1.00 . A A . 42 GLN NE2 1 1 20 14612 1 1 45 GLN O O 11.299 7.419 1.993 1.00 . A A . 42 GLN O 1 1 20 14613 1 1 45 GLN OE1 O 14.234 3.492 4.807 1.00 . A A . 42 GLN OE1 1 1 20 14614 1 1 46 THR C C 10.886 10.425 2.475 1.00 . A A . 43 THR C 1 1 20 14615 1 1 46 THR CA C 9.623 9.573 2.401 1.00 . A A . 43 THR CA 1 1 20 14616 1 1 46 THR CB C 8.403 10.422 2.793 1.00 . A A . 43 THR CB 1 1 20 14617 1 1 46 THR CG2 C 7.709 10.970 1.556 1.00 . A A . 43 THR CG2 1 1 20 14618 1 1 46 THR H H 9.182 8.373 4.070 1.00 . A A . 43 THR H 1 1 20 14619 1 1 46 THR HA H 9.488 9.217 1.391 1.00 . A A . 43 THR HA 1 1 20 14620 1 1 46 THR HB H 8.733 11.248 3.405 1.00 . A A . 43 THR HB 1 1 20 14621 1 1 46 THR HG1 H 7.023 10.169 4.181 1.00 . A A . 43 THR HG1 1 1 20 14622 1 1 46 THR HG21 H 6.854 11.559 1.854 1.00 . A A . 43 THR HG21 1 1 20 14623 1 1 46 THR HG22 H 7.382 10.151 0.933 1.00 . A A . 43 THR HG22 1 1 20 14624 1 1 46 THR HG23 H 8.397 11.592 1.001 1.00 . A A . 43 THR HG23 1 1 20 14625 1 1 46 THR N N 9.745 8.424 3.269 1.00 . A A . 43 THR N 1 1 20 14626 1 1 46 THR O O 11.040 11.255 3.370 1.00 . A A . 43 THR O 1 1 20 14627 1 1 46 THR OG1 O 7.481 9.616 3.541 1.00 . A A . 43 THR OG1 1 1 20 14628 1 1 47 HIS C C 13.049 12.069 0.574 1.00 . A A . 44 HIS C 1 1 20 14629 1 1 47 HIS CA C 13.074 10.888 1.534 1.00 . A A . 44 HIS CA 1 1 20 14630 1 1 47 HIS CB C 14.212 9.917 1.179 1.00 . A A . 44 HIS CB 1 1 20 14631 1 1 47 HIS CD2 C 14.328 9.378 -1.364 1.00 . A A . 44 HIS CD2 1 1 20 14632 1 1 47 HIS CE1 C 13.319 7.436 -1.321 1.00 . A A . 44 HIS CE1 1 1 20 14633 1 1 47 HIS CG C 13.989 9.124 -0.076 1.00 . A A . 44 HIS CG 1 1 20 14634 1 1 47 HIS H H 11.588 9.554 0.827 1.00 . A A . 44 HIS H 1 1 20 14635 1 1 47 HIS HA H 13.242 11.266 2.532 1.00 . A A . 44 HIS HA 1 1 20 14636 1 1 47 HIS HB2 H 15.125 10.479 1.053 1.00 . A A . 44 HIS HB2 1 1 20 14637 1 1 47 HIS HB3 H 14.341 9.217 1.993 1.00 . A A . 44 HIS HB3 1 1 20 14638 1 1 47 HIS HD1 H 12.987 7.434 0.701 1.00 . A A . 44 HIS HD1 1 1 20 14639 1 1 47 HIS HD2 H 14.841 10.257 -1.730 1.00 . A A . 44 HIS HD2 1 1 20 14640 1 1 47 HIS HE1 H 12.885 6.497 -1.629 1.00 . A A . 44 HIS HE1 1 1 20 14641 1 1 47 HIS HE2 H 13.934 8.252 -3.098 1.00 . A A . 44 HIS HE2 1 1 20 14642 1 1 47 HIS N N 11.792 10.199 1.540 1.00 . A A . 44 HIS N 1 1 20 14643 1 1 47 HIS ND1 N 13.356 7.900 -0.086 1.00 . A A . 44 HIS ND1 1 1 20 14644 1 1 47 HIS NE2 N 13.901 8.313 -2.114 1.00 . A A . 44 HIS NE2 1 1 20 14645 1 1 47 HIS O O 14.003 12.308 -0.165 1.00 . A A . 44 HIS O 1 1 20 14646 1 1 48 ASP C C 11.739 15.231 0.594 1.00 . A A . 45 ASP C 1 1 20 14647 1 1 48 ASP CA C 11.787 13.971 -0.254 1.00 . A A . 45 ASP CA 1 1 20 14648 1 1 48 ASP CB C 10.508 13.849 -1.091 1.00 . A A . 45 ASP CB 1 1 20 14649 1 1 48 ASP CG C 10.615 12.795 -2.170 1.00 . A A . 45 ASP CG 1 1 20 14650 1 1 48 ASP H H 11.232 12.570 1.227 1.00 . A A . 45 ASP H 1 1 20 14651 1 1 48 ASP HA H 12.639 14.024 -0.913 1.00 . A A . 45 ASP HA 1 1 20 14652 1 1 48 ASP HB2 H 9.685 13.588 -0.443 1.00 . A A . 45 ASP HB2 1 1 20 14653 1 1 48 ASP HB3 H 10.301 14.799 -1.560 1.00 . A A . 45 ASP HB3 1 1 20 14654 1 1 48 ASP N N 11.951 12.806 0.600 1.00 . A A . 45 ASP N 1 1 20 14655 1 1 48 ASP O O 12.801 15.654 1.093 1.00 . A A . 45 ASP O 1 1 20 14656 1 1 48 ASP OXT O 10.636 15.791 0.768 1.00 . A A . 45 ASP OXT 1 1 20 14657 1 1 48 ASP OD1 O 11.090 13.121 -3.279 1.00 . A A . 45 ASP OD1 1 1 20 14658 1 1 48 ASP OD2 O 10.226 11.636 -1.924 1.00 . A A . 45 ASP OD2 1 1 20 14659 2 2 1 ZN ZN ZN -4.382 -5.571 0.328 1.00 . B A . 101 ZN ZN 1 1 20 14660 3 2 1 ZN ZN ZN 6.060 1.394 -1.656 1.00 . C A . 102 ZN ZN 1 1 stop_ save_
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