NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
551507 | 4a24 | 18004 | cing | 4-filtered-FRED | STAR | entry | full | 915 |
data_FRED_restraints_with_modified_coordinates_PDB_code_4a24 # This FRED archive file contains, for PDB entry <4a24>: # # - 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_4a24 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 4a24 _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 5393.66 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 $DEFORMED_EPIDERMAL_AUTOREGULATORY_FACTOR_1_HOMOLOG 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_DEFORMED_EPIDERMAL_AUTOREGULATORY_FACTOR_1_HOMOLOG _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "DEFORMED EPIDERMAL AUTOREGULATORY FACTOR 1 HOMOLOG" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GAMEQSCVNCGREAMSECTGCHKVNYCSTFCQRKDWKDHQHICGQSA _Entity.Number_of_monomers 47 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 ALA . 1 1 3 MET . 1 1 4 GLU . 1 1 5 GLN . 1 1 6 SER . 1 1 7 CYS . 1 1 8 VAL . 1 1 9 ASN . 1 1 10 CYS . 1 1 11 GLY . 1 1 12 ARG . 1 1 13 GLU . 1 1 14 ALA . 1 1 15 MET . 1 1 16 SER . 1 1 17 GLU . 1 1 18 CYS . 1 1 19 THR . 1 1 20 GLY . 1 1 21 CYS . 1 1 22 HIS . 1 1 23 LYS . 1 1 24 VAL . 1 1 25 ASN . 1 1 26 TYR . 1 1 27 CYS . 1 1 28 SER . 1 1 29 THR . 1 1 30 PHE . 1 1 31 CYS . 1 1 32 GLN . 1 1 33 ARG . 1 1 34 LYS . 1 1 35 ASP . 1 1 36 TRP . 1 1 37 LYS . 1 1 38 ASP . 1 1 39 HIS . 1 1 40 GLN . 1 1 41 HIS . 1 1 42 ILE . 1 1 43 CYS . 1 1 44 GLY . 1 1 45 GLN . 1 1 46 SER . 1 1 47 ALA . 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 ALA 2 2 1 1 MET 3 3 1 1 GLU 4 4 1 1 GLN 5 5 1 1 SER 6 6 1 1 CYS 7 7 1 1 VAL 8 8 1 1 ASN 9 9 1 1 CYS 10 10 1 1 GLY 11 11 1 1 ARG 12 12 1 1 GLU 13 13 1 1 ALA 14 14 1 1 MET 15 15 1 1 SER 16 16 1 1 GLU 17 17 1 1 CYS 18 18 1 1 THR 19 19 1 1 GLY 20 20 1 1 CYS 21 21 1 1 HIS 22 22 1 1 LYS 23 23 1 1 VAL 24 24 1 1 ASN 25 25 1 1 TYR 26 26 1 1 CYS 27 27 1 1 SER 28 28 1 1 THR 29 29 1 1 PHE 30 30 1 1 CYS 31 31 1 1 GLN 32 32 1 1 ARG 33 33 1 1 LYS 34 34 1 1 ASP 35 35 1 1 TRP 36 36 1 1 LYS 37 37 1 1 ASP 38 38 1 1 HIS 39 39 1 1 GLN 40 40 1 1 HIS 41 41 1 1 ILE 42 42 1 1 CYS 43 43 1 1 GLY 44 44 1 1 GLN 45 45 1 1 SER 46 46 1 1 ALA 47 47 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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 ALA MB A 499 . HB# 1 1 1 1 2 1 1 3 MET HA A 500 . HA 1 1 2 1 1 1 1 2 ALA MB A 499 . HB# 1 1 2 1 2 1 1 4 GLU H A 501 . HN 1 1 3 1 1 1 1 3 MET H A 500 . HN 1 1 3 1 2 1 1 3 MET QB A 500 . HB# 1 1 4 1 1 1 1 3 MET H A 500 . HN 1 1 4 1 2 1 1 3 MET QG A 500 . HG# 1 1 5 1 1 1 1 3 MET HA A 500 . HA 1 1 5 1 2 1 1 3 MET QB A 500 . HB# 1 1 6 1 1 1 1 3 MET QB A 500 . HB# 1 1 6 1 2 1 1 4 GLU H A 501 . HN 1 1 7 1 1 1 1 4 GLU H A 501 . HN 1 1 7 1 2 1 1 4 GLU QB A 501 . HB# 1 1 8 1 1 1 1 4 GLU H A 501 . HN 1 1 8 1 2 1 1 5 GLN H A 502 . HN 1 1 9 1 1 1 1 4 GLU HA A 501 . HA 1 1 9 1 2 1 1 4 GLU QG A 501 . HG# 1 1 10 1 1 1 1 4 GLU QB A 501 . HB# 1 1 10 1 2 1 1 5 GLN HE21 A 502 . HE21 1 1 11 1 1 1 1 4 GLU QB A 501 . HB# 1 1 11 1 2 1 1 5 GLN QE A 502 . HE2# 1 1 12 1 1 1 1 4 GLU QB A 501 . HB# 1 1 12 1 2 1 1 5 GLN HE22 A 502 . HE22 1 1 13 1 1 1 1 5 GLN H A 502 . HN 1 1 13 1 2 1 1 5 GLN HB2 A 502 . HB2 1 1 14 1 1 1 1 5 GLN H A 502 . HN 1 1 14 1 2 1 1 5 GLN QB A 502 . HB# 1 1 15 1 1 1 1 5 GLN H A 502 . HN 1 1 15 1 2 1 1 5 GLN HB3 A 502 . HB1 1 1 16 1 1 1 1 5 GLN H A 502 . HN 1 1 16 1 2 1 1 5 GLN QG A 502 . HG# 1 1 17 1 1 1 1 5 GLN H A 502 . HN 1 1 17 1 2 1 1 6 SER QB A 503 . HB# 1 1 18 1 1 1 1 5 GLN HA A 502 . HA 1 1 18 1 2 1 1 5 GLN QE A 502 . HE2# 1 1 19 1 1 1 1 5 GLN HA A 502 . HA 1 1 19 1 2 1 1 5 GLN QG A 502 . HG# 1 1 20 1 1 1 1 5 GLN HA A 502 . HA 1 1 20 1 2 1 1 6 SER H A 503 . HN 1 1 21 1 1 1 1 5 GLN HA A 502 . HA 1 1 21 1 2 1 1 14 ALA MB A 511 . HB# 1 1 22 1 1 1 1 5 GLN HA A 502 . HA 1 1 22 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 23 1 1 1 1 5 GLN HA A 502 . HA 1 1 23 1 2 1 1 25 ASN HD22 A 522 . HD22 1 1 24 1 1 1 1 5 GLN QB A 502 . HB# 1 1 24 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 25 1 1 1 1 5 GLN HB2 A 502 . HB2 1 1 25 1 2 1 1 6 SER H A 503 . HN 1 1 26 1 1 1 1 5 GLN HB2 A 502 . HB2 1 1 26 1 2 1 1 14 ALA MB A 511 . HB# 1 1 27 1 1 1 1 5 GLN HB3 A 502 . HB1 1 1 27 1 2 1 1 6 SER H A 503 . HN 1 1 28 1 1 1 1 5 GLN HB3 A 502 . HB1 1 1 28 1 2 1 1 14 ALA MB A 511 . HB# 1 1 29 1 1 1 1 5 GLN QG A 502 . HG# 1 1 29 1 2 1 1 6 SER H A 503 . HN 1 1 30 1 1 1 1 5 GLN QG A 502 . HG# 1 1 30 1 2 1 1 14 ALA MB A 511 . HB# 1 1 31 1 1 1 1 5 GLN QG A 502 . HG# 1 1 31 1 2 1 1 16 SER H A 513 . HN 1 1 32 1 1 1 1 6 SER H A 503 . HN 1 1 32 1 2 1 1 6 SER QB A 503 . HB# 1 1 33 1 1 1 1 6 SER H A 503 . HN 1 1 33 1 2 1 1 7 CYS H A 504 . HN 1 1 34 1 1 1 1 6 SER H A 503 . HN 1 1 34 1 2 1 1 14 ALA MB A 511 . HB# 1 1 35 1 1 1 1 6 SER H A 503 . HN 1 1 35 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 36 1 1 1 1 6 SER H A 503 . HN 1 1 36 1 2 1 1 25 ASN HD22 A 522 . HD22 1 1 37 1 1 1 1 6 SER HA A 503 . HA 1 1 37 1 2 1 1 7 CYS H A 504 . HN 1 1 38 1 1 1 1 6 SER HA A 503 . HA 1 1 38 1 2 1 1 13 GLU H A 510 . HN 1 1 39 1 1 1 1 6 SER HA A 503 . HA 1 1 39 1 2 1 1 14 ALA H A 511 . HN 1 1 40 1 1 1 1 6 SER HA A 503 . HA 1 1 40 1 2 1 1 14 ALA MB A 511 . HB# 1 1 41 1 1 1 1 6 SER HA A 503 . HA 1 1 41 1 2 1 1 25 ASN HB2 A 522 . HB2 1 1 42 1 1 1 1 6 SER QB A 503 . HB# 1 1 42 1 2 1 1 7 CYS H A 504 . HN 1 1 43 1 1 1 1 6 SER HB2 A 503 . HB2 1 1 43 1 2 1 1 14 ALA MB A 511 . HB# 1 1 44 1 1 1 1 6 SER HB3 A 503 . HB1 1 1 44 1 2 1 1 14 ALA MB A 511 . HB# 1 1 45 1 1 1 1 7 CYS H A 504 . HN 1 1 45 1 2 1 1 7 CYS HB2 A 504 . HB2 1 1 46 1 1 1 1 7 CYS H A 504 . HN 1 1 46 1 2 1 1 7 CYS HB3 A 504 . HB1 1 1 47 1 1 1 1 7 CYS H A 504 . HN 1 1 47 1 2 1 1 8 VAL H A 505 . HN 1 1 48 1 1 1 1 7 CYS H A 504 . HN 1 1 48 1 2 1 1 10 CYS H A 507 . HN 1 1 49 1 1 1 1 7 CYS H A 504 . HN 1 1 49 1 2 1 1 11 GLY H A 508 . HN 1 1 50 1 1 1 1 7 CYS H A 504 . HN 1 1 50 1 2 1 1 12 ARG H A 509 . HN 1 1 51 1 1 1 1 7 CYS H A 504 . HN 1 1 51 1 2 1 1 12 ARG HA A 509 . HA 1 1 52 1 1 1 1 7 CYS H A 504 . HN 1 1 52 1 2 1 1 13 GLU H A 510 . HN 1 1 53 1 1 1 1 7 CYS H A 504 . HN 1 1 53 1 2 1 1 13 GLU HA A 510 . HA 1 1 54 1 1 1 1 7 CYS H A 504 . HN 1 1 54 1 2 1 1 14 ALA H A 511 . HN 1 1 55 1 1 1 1 7 CYS H A 504 . HN 1 1 55 1 2 1 1 14 ALA HA A 511 . HA 1 1 56 1 1 1 1 7 CYS H A 504 . HN 1 1 56 1 2 1 1 14 ALA MB A 511 . HB# 1 1 57 1 1 1 1 7 CYS H A 504 . HN 1 1 57 1 2 1 1 26 TYR HA A 523 . HA 1 1 58 1 1 1 1 7 CYS H A 504 . HN 1 1 58 1 2 1 1 27 CYS H A 524 . HN 1 1 59 1 1 1 1 7 CYS HA A 504 . HA 1 1 59 1 2 1 1 8 VAL H A 505 . HN 1 1 60 1 1 1 1 7 CYS HA A 504 . HA 1 1 60 1 2 1 1 8 VAL QG A 505 . HG# 1 1 61 1 1 1 1 7 CYS HA A 504 . HA 1 1 61 1 2 1 1 9 ASN H A 506 . HN 1 1 62 1 1 1 1 7 CYS HA A 504 . HA 1 1 62 1 2 1 1 10 CYS H A 507 . HN 1 1 63 1 1 1 1 7 CYS HA A 504 . HA 1 1 63 1 2 1 1 11 GLY H A 508 . HN 1 1 64 1 1 1 1 7 CYS HA A 504 . HA 1 1 64 1 2 1 1 14 ALA MB A 511 . HB# 1 1 65 1 1 1 1 7 CYS HA A 504 . HA 1 1 65 1 2 1 1 25 ASN H A 522 . HN 1 1 66 1 1 1 1 7 CYS HA A 504 . HA 1 1 66 1 2 1 1 25 ASN HB2 A 522 . HB2 1 1 67 1 1 1 1 7 CYS HA A 504 . HA 1 1 67 1 2 1 1 25 ASN HB3 A 522 . HB1 1 1 68 1 1 1 1 7 CYS HA A 504 . HA 1 1 68 1 2 1 1 26 TYR H A 523 . HN 1 1 69 1 1 1 1 7 CYS HA A 504 . HA 1 1 69 1 2 1 1 26 TYR HA A 523 . HA 1 1 70 1 1 1 1 7 CYS HA A 504 . HA 1 1 70 1 2 1 1 27 CYS H A 524 . HN 1 1 71 1 1 1 1 7 CYS HA A 504 . HA 1 1 71 1 2 1 1 28 SER H A 525 . HN 1 1 72 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 72 1 2 1 1 8 VAL H A 505 . HN 1 1 73 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 73 1 2 1 1 9 ASN H A 506 . HN 1 1 74 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 74 1 2 1 1 11 GLY H A 508 . HN 1 1 75 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 75 1 2 1 1 14 ALA H A 511 . HN 1 1 76 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 76 1 2 1 1 14 ALA HA A 511 . HA 1 1 77 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 77 1 2 1 1 14 ALA MB A 511 . HB# 1 1 78 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 78 1 2 1 1 15 MET H A 512 . HN 1 1 79 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 79 1 2 1 1 26 TYR HA A 523 . HA 1 1 80 1 1 1 1 7 CYS HB2 A 504 . HB2 1 1 80 1 2 1 1 27 CYS H A 524 . HN 1 1 81 1 1 1 1 7 CYS HB3 A 504 . HB1 1 1 81 1 2 1 1 8 VAL H A 505 . HN 1 1 82 1 1 1 1 7 CYS HB3 A 504 . HB1 1 1 82 1 2 1 1 9 ASN H A 506 . HN 1 1 83 1 1 1 1 7 CYS HB3 A 504 . HB1 1 1 83 1 2 1 1 10 CYS H A 507 . HN 1 1 84 1 1 1 1 7 CYS HB3 A 504 . HB1 1 1 84 1 2 1 1 11 GLY H A 508 . HN 1 1 85 1 1 1 1 7 CYS HB3 A 504 . HB1 1 1 85 1 2 1 1 14 ALA MB A 511 . HB# 1 1 86 1 1 1 1 7 CYS HB3 A 504 . HB1 1 1 86 1 2 1 1 27 CYS H A 524 . HN 1 1 87 1 1 1 1 8 VAL H A 505 . HN 1 1 87 1 2 1 1 8 VAL HB A 505 . HB 1 1 88 1 1 1 1 8 VAL H A 505 . HN 1 1 88 1 2 1 1 8 VAL QG A 505 . HG# 1 1 89 1 1 1 1 8 VAL H A 505 . HN 1 1 89 1 2 1 1 9 ASN H A 506 . HN 1 1 90 1 1 1 1 8 VAL H A 505 . HN 1 1 90 1 2 1 1 10 CYS H A 507 . HN 1 1 91 1 1 1 1 8 VAL H A 505 . HN 1 1 91 1 2 1 1 24 VAL HB A 521 . HB 1 1 92 1 1 1 1 8 VAL H A 505 . HN 1 1 92 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 93 1 1 1 1 8 VAL H A 505 . HN 1 1 93 1 2 1 1 26 TYR HA A 523 . HA 1 1 94 1 1 1 1 8 VAL H A 505 . HN 1 1 94 1 2 1 1 26 TYR QD A 523 . HD# 1 1 95 1 1 1 1 8 VAL H A 505 . HN 1 1 95 1 2 1 1 27 CYS H A 524 . HN 1 1 96 1 1 1 1 8 VAL HA A 505 . HA 1 1 96 1 2 1 1 8 VAL QG A 505 . HG# 1 1 97 1 1 1 1 8 VAL HA A 505 . HA 1 1 97 1 2 1 1 10 CYS H A 507 . HN 1 1 98 1 1 1 1 8 VAL HB A 505 . HB 1 1 98 1 2 1 1 9 ASN H A 506 . HN 1 1 99 1 1 1 1 8 VAL HB A 505 . HB 1 1 99 1 2 1 1 24 VAL HB A 521 . HB 1 1 100 1 1 1 1 8 VAL HB A 505 . HB 1 1 100 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 101 1 1 1 1 8 VAL QG A 505 . HG# 1 1 101 1 2 1 1 9 ASN H A 506 . HN 1 1 102 1 1 1 1 8 VAL QG A 505 . HG# 1 1 102 1 2 1 1 9 ASN HA A 506 . HA 1 1 103 1 1 1 1 8 VAL QG A 505 . HG# 1 1 103 1 2 1 1 9 ASN HB2 A 506 . HB2 1 1 104 1 1 1 1 8 VAL QG A 505 . HG# 1 1 104 1 2 1 1 9 ASN HB3 A 506 . HB1 1 1 105 1 1 1 1 8 VAL QG A 505 . HG# 1 1 105 1 2 1 1 10 CYS H A 507 . HN 1 1 106 1 1 1 1 8 VAL QG A 505 . HG# 1 1 106 1 2 1 1 24 VAL HA A 521 . HA 1 1 107 1 1 1 1 8 VAL QG A 505 . HG# 1 1 107 1 2 1 1 24 VAL HB A 521 . HB 1 1 108 1 1 1 1 8 VAL QG A 505 . HG# 1 1 108 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 109 1 1 1 1 8 VAL QG A 505 . HG# 1 1 109 1 2 1 1 25 ASN H A 522 . HN 1 1 110 1 1 1 1 8 VAL QG A 505 . HG# 1 1 110 1 2 1 1 26 TYR HA A 523 . HA 1 1 111 1 1 1 1 8 VAL QG A 505 . HG# 1 1 111 1 2 1 1 26 TYR QD A 523 . HD# 1 1 112 1 1 1 1 8 VAL QG A 505 . HG# 1 1 112 1 2 1 1 26 TYR QE A 523 . HE# 1 1 113 1 1 1 1 8 VAL QG A 505 . HG# 1 1 113 1 2 1 1 35 ASP HB2 A 532 . HB2 1 1 114 1 1 1 1 8 VAL QG A 505 . HG# 1 1 114 1 2 1 1 35 ASP HB3 A 532 . HB1 1 1 115 1 1 1 1 8 VAL MG1 A 505 . HG1# 1 1 115 1 2 1 1 9 ASN H A 506 . HN 1 1 116 1 1 1 1 8 VAL MG1 A 505 . HG1# 1 1 116 1 2 1 1 9 ASN HA A 506 . HA 1 1 117 1 1 1 1 8 VAL MG1 A 505 . HG1# 1 1 117 1 2 1 1 9 ASN HB2 A 506 . HB2 1 1 118 1 1 1 1 8 VAL MG1 A 505 . HG1# 1 1 118 1 2 1 1 9 ASN HB3 A 506 . HB1 1 1 119 1 1 1 1 8 VAL MG1 A 505 . HG1# 1 1 119 1 2 1 1 10 CYS H A 507 . HN 1 1 120 1 1 1 1 8 VAL MG1 A 505 . HG1# 1 1 120 1 2 1 1 25 ASN H A 522 . HN 1 1 121 1 1 1 1 8 VAL MG1 A 505 . HG1# 1 1 121 1 2 1 1 35 ASP HB2 A 532 . HB2 1 1 122 1 1 1 1 8 VAL MG2 A 505 . HG2# 1 1 122 1 2 1 1 9 ASN H A 506 . HN 1 1 123 1 1 1 1 8 VAL MG2 A 505 . HG2# 1 1 123 1 2 1 1 9 ASN HA A 506 . HA 1 1 124 1 1 1 1 8 VAL MG2 A 505 . HG2# 1 1 124 1 2 1 1 9 ASN HB2 A 506 . HB2 1 1 125 1 1 1 1 8 VAL MG2 A 505 . HG2# 1 1 125 1 2 1 1 9 ASN HB3 A 506 . HB1 1 1 126 1 1 1 1 8 VAL MG2 A 505 . HG2# 1 1 126 1 2 1 1 10 CYS H A 507 . HN 1 1 127 1 1 1 1 8 VAL MG2 A 505 . HG2# 1 1 127 1 2 1 1 25 ASN H A 522 . HN 1 1 128 1 1 1 1 8 VAL MG2 A 505 . HG2# 1 1 128 1 2 1 1 35 ASP HB2 A 532 . HB2 1 1 129 1 1 1 1 9 ASN H A 506 . HN 1 1 129 1 2 1 1 9 ASN HB2 A 506 . HB2 1 1 130 1 1 1 1 9 ASN H A 506 . HN 1 1 130 1 2 1 1 9 ASN HB3 A 506 . HB1 1 1 131 1 1 1 1 9 ASN H A 506 . HN 1 1 131 1 2 1 1 10 CYS H A 507 . HN 1 1 132 1 1 1 1 9 ASN H A 506 . HN 1 1 132 1 2 1 1 11 GLY H A 508 . HN 1 1 133 1 1 1 1 9 ASN H A 506 . HN 1 1 133 1 2 1 1 26 TYR HA A 523 . HA 1 1 134 1 1 1 1 9 ASN H A 506 . HN 1 1 134 1 2 1 1 26 TYR QD A 523 . HD# 1 1 135 1 1 1 1 9 ASN H A 506 . HN 1 1 135 1 2 1 1 27 CYS H A 524 . HN 1 1 136 1 1 1 1 9 ASN H A 506 . HN 1 1 136 1 2 1 1 31 CYS HB3 A 528 . HB1 1 1 137 1 1 1 1 9 ASN HA A 506 . HA 1 1 137 1 2 1 1 9 ASN HD21 A 506 . HD21 1 1 138 1 1 1 1 9 ASN HA A 506 . HA 1 1 138 1 2 1 1 9 ASN HD22 A 506 . HD22 1 1 139 1 1 1 1 9 ASN HB2 A 506 . HB2 1 1 139 1 2 1 1 10 CYS H A 507 . HN 1 1 140 1 1 1 1 9 ASN HB2 A 506 . HB2 1 1 140 1 2 1 1 26 TYR QD A 523 . HD# 1 1 141 1 1 1 1 9 ASN HB2 A 506 . HB2 1 1 141 1 2 1 1 31 CYS HA A 528 . HA 1 1 142 1 1 1 1 9 ASN HB2 A 506 . HB2 1 1 142 1 2 1 1 31 CYS HB3 A 528 . HB1 1 1 143 1 1 1 1 9 ASN HB3 A 506 . HB1 1 1 143 1 2 1 1 10 CYS H A 507 . HN 1 1 144 1 1 1 1 9 ASN HB3 A 506 . HB1 1 1 144 1 2 1 1 31 CYS HA A 528 . HA 1 1 145 1 1 1 1 9 ASN HB3 A 506 . HB1 1 1 145 1 2 1 1 31 CYS HB2 A 528 . HB2 1 1 146 1 1 1 1 9 ASN HB3 A 506 . HB1 1 1 146 1 2 1 1 31 CYS HB3 A 528 . HB1 1 1 147 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 147 1 2 1 1 10 CYS H A 507 . HN 1 1 148 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 148 1 2 1 1 10 CYS HA A 507 . HA 1 1 149 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 149 1 2 1 1 10 CYS HB2 A 507 . HB2 1 1 150 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 150 1 2 1 1 10 CYS QB A 507 . HB# 1 1 151 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 151 1 2 1 1 10 CYS HB3 A 507 . HB1 1 1 152 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 152 1 2 1 1 26 TYR QD A 523 . HD# 1 1 153 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 153 1 2 1 1 31 CYS H A 528 . HN 1 1 154 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 154 1 2 1 1 31 CYS HA A 528 . HA 1 1 155 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 155 1 2 1 1 31 CYS HB2 A 528 . HB2 1 1 156 1 1 1 1 9 ASN HD21 A 506 . HD21 1 1 156 1 2 1 1 31 CYS HB3 A 528 . HB1 1 1 157 1 1 1 1 9 ASN HD22 A 506 . HD22 1 1 157 1 2 1 1 10 CYS H A 507 . HN 1 1 158 1 1 1 1 9 ASN HD22 A 506 . HD22 1 1 158 1 2 1 1 10 CYS HA A 507 . HA 1 1 159 1 1 1 1 9 ASN HD22 A 506 . HD22 1 1 159 1 2 1 1 31 CYS HA A 528 . HA 1 1 160 1 1 1 1 10 CYS H A 507 . HN 1 1 160 1 2 1 1 10 CYS HB2 A 507 . HB2 1 1 161 1 1 1 1 10 CYS H A 507 . HN 1 1 161 1 2 1 1 10 CYS HB3 A 507 . HB1 1 1 162 1 1 1 1 10 CYS H A 507 . HN 1 1 162 1 2 1 1 11 GLY H A 508 . HN 1 1 163 1 1 1 1 11 GLY QA A 508 . HA# 1 1 163 1 2 1 1 12 ARG QB A 509 . HB# 1 1 164 1 1 1 1 12 ARG H A 509 . HN 1 1 164 1 2 1 1 12 ARG HB2 A 509 . HB2 1 1 165 1 1 1 1 12 ARG H A 509 . HN 1 1 165 1 2 1 1 12 ARG HB3 A 509 . HB1 1 1 166 1 1 1 1 12 ARG H A 509 . HN 1 1 166 1 2 1 1 12 ARG QD A 509 . HD# 1 1 167 1 1 1 1 12 ARG H A 509 . HN 1 1 167 1 2 1 1 12 ARG QG A 509 . HG# 1 1 168 1 1 1 1 12 ARG H A 509 . HN 1 1 168 1 2 1 1 13 GLU H A 510 . HN 1 1 169 1 1 1 1 12 ARG HA A 509 . HA 1 1 169 1 2 1 1 12 ARG QD A 509 . HD# 1 1 170 1 1 1 1 12 ARG HA A 509 . HA 1 1 170 1 2 1 1 12 ARG QG A 509 . HG# 1 1 171 1 1 1 1 12 ARG HA A 509 . HA 1 1 171 1 2 1 1 13 GLU H A 510 . HN 1 1 172 1 1 1 1 12 ARG HA A 509 . HA 1 1 172 1 2 1 1 13 GLU HA A 510 . HA 1 1 173 1 1 1 1 12 ARG HA A 509 . HA 1 1 173 1 2 1 1 14 ALA H A 511 . HN 1 1 174 1 1 1 1 12 ARG QB A 509 . HB# 1 1 174 1 2 1 1 12 ARG QD A 509 . HD# 1 1 175 1 1 1 1 12 ARG QB A 509 . HB# 1 1 175 1 2 1 1 13 GLU H A 510 . HN 1 1 176 1 1 1 1 12 ARG HB2 A 509 . HB2 1 1 176 1 2 1 1 12 ARG QD A 509 . HD# 1 1 177 1 1 1 1 12 ARG HB3 A 509 . HB1 1 1 177 1 2 1 1 12 ARG QD A 509 . HD# 1 1 178 1 1 1 1 12 ARG QD A 509 . HD# 1 1 178 1 2 1 1 13 GLU H A 510 . HN 1 1 179 1 1 1 1 12 ARG QG A 509 . HG# 1 1 179 1 2 1 1 13 GLU H A 510 . HN 1 1 180 1 1 1 1 13 GLU H A 510 . HN 1 1 180 1 2 1 1 13 GLU HB2 A 510 . HB2 1 1 181 1 1 1 1 13 GLU H A 510 . HN 1 1 181 1 2 1 1 13 GLU QB A 510 . HB# 1 1 182 1 1 1 1 13 GLU H A 510 . HN 1 1 182 1 2 1 1 13 GLU HB3 A 510 . HB1 1 1 183 1 1 1 1 13 GLU H A 510 . HN 1 1 183 1 2 1 1 13 GLU QG A 510 . HG# 1 1 184 1 1 1 1 13 GLU H A 510 . HN 1 1 184 1 2 1 1 14 ALA H A 511 . HN 1 1 185 1 1 1 1 13 GLU HA A 510 . HA 1 1 185 1 2 1 1 13 GLU QG A 510 . HG# 1 1 186 1 1 1 1 13 GLU HA A 510 . HA 1 1 186 1 2 1 1 14 ALA H A 511 . HN 1 1 187 1 1 1 1 13 GLU HA A 510 . HA 1 1 187 1 2 1 1 14 ALA MB A 511 . HB# 1 1 188 1 1 1 1 13 GLU QB A 510 . HB# 1 1 188 1 2 1 1 14 ALA H A 511 . HN 1 1 189 1 1 1 1 13 GLU QG A 510 . HG# 1 1 189 1 2 1 1 14 ALA H A 511 . HN 1 1 190 1 1 1 1 14 ALA H A 511 . HN 1 1 190 1 2 1 1 14 ALA MB A 511 . HB# 1 1 191 1 1 1 1 14 ALA H A 511 . HN 1 1 191 1 2 1 1 27 CYS HB2 A 524 . HB2 1 1 192 1 1 1 1 14 ALA H A 511 . HN 1 1 192 1 2 1 1 27 CYS QB A 524 . HB# 1 1 193 1 1 1 1 14 ALA H A 511 . HN 1 1 193 1 2 1 1 27 CYS HB3 A 524 . HB1 1 1 194 1 1 1 1 14 ALA HA A 511 . HA 1 1 194 1 2 1 1 15 MET H A 512 . HN 1 1 195 1 1 1 1 14 ALA HA A 511 . HA 1 1 195 1 2 1 1 15 MET QB A 512 . HB# 1 1 196 1 1 1 1 14 ALA HA A 511 . HA 1 1 196 1 2 1 1 16 SER H A 513 . HN 1 1 197 1 1 1 1 14 ALA HA A 511 . HA 1 1 197 1 2 1 1 27 CYS H A 524 . HN 1 1 198 1 1 1 1 14 ALA HA A 511 . HA 1 1 198 1 2 1 1 27 CYS HA A 524 . HA 1 1 199 1 1 1 1 14 ALA HA A 511 . HA 1 1 199 1 2 1 1 27 CYS HB2 A 524 . HB2 1 1 200 1 1 1 1 14 ALA HA A 511 . HA 1 1 200 1 2 1 1 27 CYS QB A 524 . HB# 1 1 201 1 1 1 1 14 ALA HA A 511 . HA 1 1 201 1 2 1 1 27 CYS HB3 A 524 . HB1 1 1 202 1 1 1 1 14 ALA MB A 511 . HB# 1 1 202 1 2 1 1 15 MET H A 512 . HN 1 1 203 1 1 1 1 14 ALA MB A 511 . HB# 1 1 203 1 2 1 1 15 MET HA A 512 . HA 1 1 204 1 1 1 1 14 ALA MB A 511 . HB# 1 1 204 1 2 1 1 16 SER H A 513 . HN 1 1 205 1 1 1 1 14 ALA MB A 511 . HB# 1 1 205 1 2 1 1 16 SER QB A 513 . HB# 1 1 206 1 1 1 1 14 ALA MB A 511 . HB# 1 1 206 1 2 1 1 25 ASN HA A 522 . HA 1 1 207 1 1 1 1 14 ALA MB A 511 . HB# 1 1 207 1 2 1 1 25 ASN HB2 A 522 . HB2 1 1 208 1 1 1 1 14 ALA MB A 511 . HB# 1 1 208 1 2 1 1 25 ASN HB3 A 522 . HB1 1 1 209 1 1 1 1 14 ALA MB A 511 . HB# 1 1 209 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 210 1 1 1 1 14 ALA MB A 511 . HB# 1 1 210 1 2 1 1 25 ASN HD22 A 522 . HD22 1 1 211 1 1 1 1 14 ALA MB A 511 . HB# 1 1 211 1 2 1 1 26 TYR H A 523 . HN 1 1 212 1 1 1 1 14 ALA MB A 511 . HB# 1 1 212 1 2 1 1 26 TYR HA A 523 . HA 1 1 213 1 1 1 1 14 ALA MB A 511 . HB# 1 1 213 1 2 1 1 26 TYR HB3 A 523 . HB1 1 1 214 1 1 1 1 14 ALA MB A 511 . HB# 1 1 214 1 2 1 1 27 CYS H A 524 . HN 1 1 215 1 1 1 1 14 ALA MB A 511 . HB# 1 1 215 1 2 1 1 27 CYS HA A 524 . HA 1 1 216 1 1 1 1 14 ALA MB A 511 . HB# 1 1 216 1 2 1 1 27 CYS HB2 A 524 . HB2 1 1 217 1 1 1 1 14 ALA MB A 511 . HB# 1 1 217 1 2 1 1 27 CYS QB A 524 . HB# 1 1 218 1 1 1 1 14 ALA MB A 511 . HB# 1 1 218 1 2 1 1 27 CYS HB3 A 524 . HB1 1 1 219 1 1 1 1 14 ALA MB A 511 . HB# 1 1 219 1 2 1 1 28 SER H A 525 . HN 1 1 220 1 1 1 1 15 MET H A 512 . HN 1 1 220 1 2 1 1 15 MET HB2 A 512 . HB2 1 1 221 1 1 1 1 15 MET H A 512 . HN 1 1 221 1 2 1 1 15 MET QB A 512 . HB# 1 1 222 1 1 1 1 15 MET H A 512 . HN 1 1 222 1 2 1 1 15 MET HB3 A 512 . HB1 1 1 223 1 1 1 1 15 MET H A 512 . HN 1 1 223 1 2 1 1 15 MET QG A 512 . HG# 1 1 224 1 1 1 1 15 MET H A 512 . HN 1 1 224 1 2 1 1 16 SER H A 513 . HN 1 1 225 1 1 1 1 15 MET H A 512 . HN 1 1 225 1 2 1 1 27 CYS H A 524 . HN 1 1 226 1 1 1 1 15 MET H A 512 . HN 1 1 226 1 2 1 1 27 CYS HA A 524 . HA 1 1 227 1 1 1 1 15 MET H A 512 . HN 1 1 227 1 2 1 1 27 CYS QB A 524 . HB# 1 1 228 1 1 1 1 15 MET H A 512 . HN 1 1 228 1 2 1 1 28 SER H A 525 . HN 1 1 229 1 1 1 1 15 MET HA A 512 . HA 1 1 229 1 2 1 1 15 MET QG A 512 . HG# 1 1 230 1 1 1 1 15 MET QB A 512 . HB# 1 1 230 1 2 1 1 16 SER H A 513 . HN 1 1 231 1 1 1 1 15 MET HB2 A 512 . HB2 1 1 231 1 2 1 1 16 SER H A 513 . HN 1 1 232 1 1 1 1 15 MET HB3 A 512 . HB1 1 1 232 1 2 1 1 16 SER H A 513 . HN 1 1 233 1 1 1 1 15 MET QG A 512 . HG# 1 1 233 1 2 1 1 16 SER H A 513 . HN 1 1 234 1 1 1 1 16 SER H A 513 . HN 1 1 234 1 2 1 1 16 SER QB A 513 . HB# 1 1 235 1 1 1 1 16 SER H A 513 . HN 1 1 235 1 2 1 1 17 GLU H A 514 . HN 1 1 236 1 1 1 1 16 SER H A 513 . HN 1 1 236 1 2 1 1 26 TYR H A 523 . HN 1 1 237 1 1 1 1 16 SER H A 513 . HN 1 1 237 1 2 1 1 26 TYR HB2 A 523 . HB2 1 1 238 1 1 1 1 16 SER H A 513 . HN 1 1 238 1 2 1 1 26 TYR HB3 A 523 . HB1 1 1 239 1 1 1 1 16 SER H A 513 . HN 1 1 239 1 2 1 1 27 CYS HA A 524 . HA 1 1 240 1 1 1 1 16 SER H A 513 . HN 1 1 240 1 2 1 1 27 CYS QB A 524 . HB# 1 1 241 1 1 1 1 16 SER HA A 513 . HA 1 1 241 1 2 1 1 16 SER QB A 513 . HB# 1 1 242 1 1 1 1 16 SER HA A 513 . HA 1 1 242 1 2 1 1 17 GLU H A 514 . HN 1 1 243 1 1 1 1 16 SER QB A 513 . HB# 1 1 243 1 2 1 1 17 GLU H A 514 . HN 1 1 244 1 1 1 1 16 SER QB A 513 . HB# 1 1 244 1 2 1 1 26 TYR H A 523 . HN 1 1 245 1 1 1 1 17 GLU H A 514 . HN 1 1 245 1 2 1 1 17 GLU QB A 514 . HB# 1 1 246 1 1 1 1 17 GLU H A 514 . HN 1 1 246 1 2 1 1 17 GLU HG2 A 514 . HG2 1 1 247 1 1 1 1 17 GLU H A 514 . HN 1 1 247 1 2 1 1 17 GLU QG A 514 . HG# 1 1 248 1 1 1 1 17 GLU H A 514 . HN 1 1 248 1 2 1 1 17 GLU HG3 A 514 . HG1 1 1 249 1 1 1 1 17 GLU H A 514 . HN 1 1 249 1 2 1 1 18 CYS H A 515 . HN 1 1 250 1 1 1 1 17 GLU H A 514 . HN 1 1 250 1 2 1 1 25 ASN HA A 522 . HA 1 1 251 1 1 1 1 17 GLU HA A 514 . HA 1 1 251 1 2 1 1 17 GLU QG A 514 . HG# 1 1 252 1 1 1 1 17 GLU HA A 514 . HA 1 1 252 1 2 1 1 18 CYS H A 515 . HN 1 1 253 1 1 1 1 17 GLU HA A 514 . HA 1 1 253 1 2 1 1 18 CYS HB2 A 515 . HB2 1 1 254 1 1 1 1 17 GLU HA A 514 . HA 1 1 254 1 2 1 1 18 CYS HB3 A 515 . HB1 1 1 255 1 1 1 1 17 GLU HA A 514 . HA 1 1 255 1 2 1 1 25 ASN H A 522 . HN 1 1 256 1 1 1 1 17 GLU HA A 514 . HA 1 1 256 1 2 1 1 25 ASN HA A 522 . HA 1 1 257 1 1 1 1 17 GLU HA A 514 . HA 1 1 257 1 2 1 1 25 ASN HB2 A 522 . HB2 1 1 258 1 1 1 1 17 GLU HA A 514 . HA 1 1 258 1 2 1 1 26 TYR H A 523 . HN 1 1 259 1 1 1 1 17 GLU QB A 514 . HB# 1 1 259 1 2 1 1 18 CYS H A 515 . HN 1 1 260 1 1 1 1 17 GLU QB A 514 . HB# 1 1 260 1 2 1 1 19 THR H A 516 . HN 1 1 261 1 1 1 1 17 GLU QB A 514 . HB# 1 1 261 1 2 1 1 22 HIS HA A 519 . HA 1 1 262 1 1 1 1 17 GLU QB A 514 . HB# 1 1 262 1 2 1 1 22 HIS HB3 A 519 . HB1 1 1 263 1 1 1 1 17 GLU QB A 514 . HB# 1 1 263 1 2 1 1 22 HIS HE1 A 519 . HE1 1 1 264 1 1 1 1 17 GLU QB A 514 . HB# 1 1 264 1 2 1 1 25 ASN HA A 522 . HA 1 1 265 1 1 1 1 17 GLU QB A 514 . HB# 1 1 265 1 2 1 1 26 TYR H A 523 . HN 1 1 266 1 1 1 1 17 GLU QG A 514 . HG# 1 1 266 1 2 1 1 18 CYS H A 515 . HN 1 1 267 1 1 1 1 17 GLU QG A 514 . HG# 1 1 267 1 2 1 1 19 THR H A 516 . HN 1 1 268 1 1 1 1 17 GLU HG2 A 514 . HG2 1 1 268 1 2 1 1 18 CYS H A 515 . HN 1 1 269 1 1 1 1 17 GLU HG3 A 514 . HG1 1 1 269 1 2 1 1 18 CYS H A 515 . HN 1 1 270 1 1 1 1 18 CYS H A 515 . HN 1 1 270 1 2 1 1 18 CYS HB2 A 515 . HB2 1 1 271 1 1 1 1 18 CYS H A 515 . HN 1 1 271 1 2 1 1 18 CYS HB3 A 515 . HB1 1 1 272 1 1 1 1 18 CYS H A 515 . HN 1 1 272 1 2 1 1 19 THR H A 516 . HN 1 1 273 1 1 1 1 18 CYS H A 515 . HN 1 1 273 1 2 1 1 19 THR HA A 516 . HA 1 1 274 1 1 1 1 18 CYS H A 515 . HN 1 1 274 1 2 1 1 20 GLY H A 517 . HN 1 1 275 1 1 1 1 18 CYS H A 515 . HN 1 1 275 1 2 1 1 24 VAL H A 521 . HN 1 1 276 1 1 1 1 18 CYS H A 515 . HN 1 1 276 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 277 1 1 1 1 18 CYS H A 515 . HN 1 1 277 1 2 1 1 25 ASN HA A 522 . HA 1 1 278 1 1 1 1 18 CYS H A 515 . HN 1 1 278 1 2 1 1 26 TYR QD A 523 . HD# 1 1 279 1 1 1 1 18 CYS H A 515 . HN 1 1 279 1 2 1 1 26 TYR QE A 523 . HE# 1 1 280 1 1 1 1 18 CYS HA A 515 . HA 1 1 280 1 2 1 1 19 THR H A 516 . HN 1 1 281 1 1 1 1 18 CYS HA A 515 . HA 1 1 281 1 2 1 1 26 TYR QE A 523 . HE# 1 1 282 1 1 1 1 18 CYS HA A 515 . HA 1 1 282 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 283 1 1 1 1 18 CYS HA A 515 . HA 1 1 283 1 2 1 1 32 GLN QE A 529 . HE2# 1 1 284 1 1 1 1 18 CYS HB2 A 515 . HB2 1 1 284 1 2 1 1 19 THR H A 516 . HN 1 1 285 1 1 1 1 18 CYS HB2 A 515 . HB2 1 1 285 1 2 1 1 19 THR HA A 516 . HA 1 1 286 1 1 1 1 18 CYS HB2 A 515 . HB2 1 1 286 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 287 1 1 1 1 18 CYS HB2 A 515 . HB2 1 1 287 1 2 1 1 26 TYR QE A 523 . HE# 1 1 288 1 1 1 1 18 CYS HB2 A 515 . HB2 1 1 288 1 2 1 1 36 TRP HE3 A 533 . HE3 1 1 289 1 1 1 1 18 CYS HB2 A 515 . HB2 1 1 289 1 2 1 1 39 HIS HD2 A 536 . HD2 1 1 290 1 1 1 1 18 CYS HB3 A 515 . HB1 1 1 290 1 2 1 1 19 THR H A 516 . HN 1 1 291 1 1 1 1 18 CYS HB3 A 515 . HB1 1 1 291 1 2 1 1 21 CYS H A 518 . HN 1 1 292 1 1 1 1 18 CYS HB3 A 515 . HB1 1 1 292 1 2 1 1 24 VAL H A 521 . HN 1 1 293 1 1 1 1 18 CYS HB3 A 515 . HB1 1 1 293 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 294 1 1 1 1 18 CYS HB3 A 515 . HB1 1 1 294 1 2 1 1 26 TYR QD A 523 . HD# 1 1 295 1 1 1 1 18 CYS HB3 A 515 . HB1 1 1 295 1 2 1 1 26 TYR QE A 523 . HE# 1 1 296 1 1 1 1 19 THR H A 516 . HN 1 1 296 1 2 1 1 19 THR HB A 516 . HB 1 1 297 1 1 1 1 19 THR H A 516 . HN 1 1 297 1 2 1 1 19 THR MG A 516 . HG2# 1 1 298 1 1 1 1 19 THR H A 516 . HN 1 1 298 1 2 1 1 20 GLY QA A 517 . HA# 1 1 299 1 1 1 1 19 THR H A 516 . HN 1 1 299 1 2 1 1 21 CYS H A 518 . HN 1 1 300 1 1 1 1 19 THR H A 516 . HN 1 1 300 1 2 1 1 32 GLN QE A 529 . HE2# 1 1 301 1 1 1 1 19 THR HA A 516 . HA 1 1 301 1 2 1 1 19 THR MG A 516 . HG2# 1 1 302 1 1 1 1 19 THR HA A 516 . HA 1 1 302 1 2 1 1 21 CYS H A 518 . HN 1 1 303 1 1 1 1 19 THR HB A 516 . HB 1 1 303 1 2 1 1 20 GLY H A 517 . HN 1 1 304 1 1 1 1 19 THR MG A 516 . HG2# 1 1 304 1 2 1 1 20 GLY H A 517 . HN 1 1 305 1 1 1 1 19 THR MG A 516 . HG2# 1 1 305 1 2 1 1 20 GLY QA A 517 . HA# 1 1 306 1 1 1 1 20 GLY H A 517 . HN 1 1 306 1 2 1 1 21 CYS H A 518 . HN 1 1 307 1 1 1 1 20 GLY H A 517 . HN 1 1 307 1 2 1 1 21 CYS HA A 518 . HA 1 1 308 1 1 1 1 20 GLY H A 517 . HN 1 1 308 1 2 1 1 21 CYS HB3 A 518 . HB1 1 1 309 1 1 1 1 20 GLY H A 517 . HN 1 1 309 1 2 1 1 22 HIS HD2 A 519 . HD2 1 1 310 1 1 1 1 20 GLY QA A 517 . HA# 1 1 310 1 2 1 1 21 CYS HA A 518 . HA 1 1 311 1 1 1 1 20 GLY QA A 517 . HA# 1 1 311 1 2 1 1 21 CYS HB3 A 518 . HB1 1 1 312 1 1 1 1 21 CYS H A 518 . HN 1 1 312 1 2 1 1 21 CYS HB2 A 518 . HB2 1 1 313 1 1 1 1 21 CYS H A 518 . HN 1 1 313 1 2 1 1 21 CYS HB3 A 518 . HB1 1 1 314 1 1 1 1 21 CYS H A 518 . HN 1 1 314 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 315 1 1 1 1 21 CYS HA A 518 . HA 1 1 315 1 2 1 1 22 HIS HD2 A 519 . HD2 1 1 316 1 1 1 1 21 CYS HA A 518 . HA 1 1 316 1 2 1 1 23 LYS H A 520 . HN 1 1 317 1 1 1 1 21 CYS HA A 518 . HA 1 1 317 1 2 1 1 24 VAL H A 521 . HN 1 1 318 1 1 1 1 21 CYS HA A 518 . HA 1 1 318 1 2 1 1 43 CYS HA A 540 . HA 1 1 319 1 1 1 1 21 CYS HA A 518 . HA 1 1 319 1 2 1 1 44 GLY H A 541 . HN 1 1 320 1 1 1 1 21 CYS HB2 A 518 . HB2 1 1 320 1 2 1 1 23 LYS QB A 520 . HB# 1 1 321 1 1 1 1 21 CYS HB2 A 518 . HB2 1 1 321 1 2 1 1 23 LYS QD A 520 . HD# 1 1 322 1 1 1 1 21 CYS HB2 A 518 . HB2 1 1 322 1 2 1 1 23 LYS QG A 520 . HG# 1 1 323 1 1 1 1 21 CYS HB2 A 518 . HB2 1 1 323 1 2 1 1 44 GLY H A 541 . HN 1 1 324 1 1 1 1 21 CYS HB3 A 518 . HB1 1 1 324 1 2 1 1 22 HIS H A 519 . HN 1 1 325 1 1 1 1 21 CYS HB3 A 518 . HB1 1 1 325 1 2 1 1 23 LYS H A 520 . HN 1 1 326 1 1 1 1 21 CYS HB3 A 518 . HB1 1 1 326 1 2 1 1 23 LYS QD A 520 . HD# 1 1 327 1 1 1 1 21 CYS HB3 A 518 . HB1 1 1 327 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 328 1 1 1 1 21 CYS HB3 A 518 . HB1 1 1 328 1 2 1 1 43 CYS H A 540 . HN 1 1 329 1 1 1 1 21 CYS HB3 A 518 . HB1 1 1 329 1 2 1 1 43 CYS HA A 540 . HA 1 1 330 1 1 1 1 21 CYS HB3 A 518 . HB1 1 1 330 1 2 1 1 44 GLY H A 541 . HN 1 1 331 1 1 1 1 22 HIS H A 519 . HN 1 1 331 1 2 1 1 22 HIS HB3 A 519 . HB1 1 1 332 1 1 1 1 22 HIS H A 519 . HN 1 1 332 1 2 1 1 22 HIS HD2 A 519 . HD2 1 1 333 1 1 1 1 22 HIS H A 519 . HN 1 1 333 1 2 1 1 23 LYS H A 520 . HN 1 1 334 1 1 1 1 22 HIS H A 519 . HN 1 1 334 1 2 1 1 23 LYS QB A 520 . HB# 1 1 335 1 1 1 1 22 HIS H A 519 . HN 1 1 335 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 336 1 1 1 1 22 HIS HA A 519 . HA 1 1 336 1 2 1 1 22 HIS HD2 A 519 . HD2 1 1 337 1 1 1 1 22 HIS HA A 519 . HA 1 1 337 1 2 1 1 24 VAL H A 521 . HN 1 1 338 1 1 1 1 22 HIS HB2 A 519 . HB2 1 1 338 1 2 1 1 22 HIS HD2 A 519 . HD2 1 1 339 1 1 1 1 22 HIS HB2 A 519 . HB2 1 1 339 1 2 1 1 23 LYS H A 520 . HN 1 1 340 1 1 1 1 22 HIS HB3 A 519 . HB1 1 1 340 1 2 1 1 22 HIS HE1 A 519 . HE1 1 1 341 1 1 1 1 22 HIS HB3 A 519 . HB1 1 1 341 1 2 1 1 23 LYS H A 520 . HN 1 1 342 1 1 1 1 22 HIS HD2 A 519 . HD2 1 1 342 1 2 1 1 23 LYS H A 520 . HN 1 1 343 1 1 1 1 23 LYS H A 520 . HN 1 1 343 1 2 1 1 23 LYS QB A 520 . HB# 1 1 344 1 1 1 1 23 LYS H A 520 . HN 1 1 344 1 2 1 1 23 LYS QD A 520 . HD# 1 1 345 1 1 1 1 23 LYS H A 520 . HN 1 1 345 1 2 1 1 23 LYS QG A 520 . HG# 1 1 346 1 1 1 1 23 LYS H A 520 . HN 1 1 346 1 2 1 1 24 VAL H A 521 . HN 1 1 347 1 1 1 1 23 LYS H A 520 . HN 1 1 347 1 2 1 1 24 VAL HA A 521 . HA 1 1 348 1 1 1 1 23 LYS H A 520 . HN 1 1 348 1 2 1 1 24 VAL MG1 A 521 . HG1# 1 1 349 1 1 1 1 23 LYS H A 520 . HN 1 1 349 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 350 1 1 1 1 23 LYS H A 520 . HN 1 1 350 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 351 1 1 1 1 23 LYS HA A 520 . HA 1 1 351 1 2 1 1 23 LYS QB A 520 . HB# 1 1 352 1 1 1 1 23 LYS HA A 520 . HA 1 1 352 1 2 1 1 23 LYS QD A 520 . HD# 1 1 353 1 1 1 1 23 LYS HA A 520 . HA 1 1 353 1 2 1 1 23 LYS QE A 520 . HE# 1 1 354 1 1 1 1 23 LYS HA A 520 . HA 1 1 354 1 2 1 1 23 LYS HG2 A 520 . HG2 1 1 355 1 1 1 1 23 LYS HA A 520 . HA 1 1 355 1 2 1 1 23 LYS QG A 520 . HG# 1 1 356 1 1 1 1 23 LYS HA A 520 . HA 1 1 356 1 2 1 1 23 LYS HG3 A 520 . HG1 1 1 357 1 1 1 1 23 LYS QB A 520 . HB# 1 1 357 1 2 1 1 23 LYS QD A 520 . HD# 1 1 358 1 1 1 1 23 LYS QB A 520 . HB# 1 1 358 1 2 1 1 23 LYS QE A 520 . HE# 1 1 359 1 1 1 1 23 LYS QB A 520 . HB# 1 1 359 1 2 1 1 24 VAL H A 521 . HN 1 1 360 1 1 1 1 23 LYS QB A 520 . HB# 1 1 360 1 2 1 1 24 VAL MG1 A 521 . HG1# 1 1 361 1 1 1 1 23 LYS QB A 520 . HB# 1 1 361 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 362 1 1 1 1 23 LYS QB A 520 . HB# 1 1 362 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 363 1 1 1 1 23 LYS QD A 520 . HD# 1 1 363 1 2 1 1 24 VAL H A 521 . HN 1 1 364 1 1 1 1 23 LYS QD A 520 . HD# 1 1 364 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 365 1 1 1 1 23 LYS QD A 520 . HD# 1 1 365 1 2 1 1 42 ILE MD A 539 . HD1# 1 1 366 1 1 1 1 23 LYS QD A 520 . HD# 1 1 366 1 2 1 1 42 ILE HG12 A 539 . HG12 1 1 367 1 1 1 1 23 LYS QD A 520 . HD# 1 1 367 1 2 1 1 43 CYS HA A 540 . HA 1 1 368 1 1 1 1 23 LYS QE A 520 . HE# 1 1 368 1 2 1 1 23 LYS HG2 A 520 . HG2 1 1 369 1 1 1 1 23 LYS QE A 520 . HE# 1 1 369 1 2 1 1 23 LYS QG A 520 . HG# 1 1 370 1 1 1 1 23 LYS QE A 520 . HE# 1 1 370 1 2 1 1 23 LYS HG3 A 520 . HG1 1 1 371 1 1 1 1 23 LYS QG A 520 . HG# 1 1 371 1 2 1 1 24 VAL H A 521 . HN 1 1 372 1 1 1 1 23 LYS QG A 520 . HG# 1 1 372 1 2 1 1 24 VAL MG1 A 521 . HG1# 1 1 373 1 1 1 1 23 LYS QG A 520 . HG# 1 1 373 1 2 1 1 42 ILE MD A 539 . HD1# 1 1 374 1 1 1 1 24 VAL H A 521 . HN 1 1 374 1 2 1 1 24 VAL MG1 A 521 . HG1# 1 1 375 1 1 1 1 24 VAL H A 521 . HN 1 1 375 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 376 1 1 1 1 24 VAL H A 521 . HN 1 1 376 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 377 1 1 1 1 24 VAL HA A 521 . HA 1 1 377 1 2 1 1 24 VAL MG1 A 521 . HG1# 1 1 378 1 1 1 1 24 VAL HA A 521 . HA 1 1 378 1 2 1 1 24 VAL MG2 A 521 . HG2# 1 1 379 1 1 1 1 24 VAL HA A 521 . HA 1 1 379 1 2 1 1 25 ASN H A 522 . HN 1 1 380 1 1 1 1 24 VAL HA A 521 . HA 1 1 380 1 2 1 1 25 ASN HA A 522 . HA 1 1 381 1 1 1 1 24 VAL HA A 521 . HA 1 1 381 1 2 1 1 25 ASN HB2 A 522 . HB2 1 1 382 1 1 1 1 24 VAL HA A 521 . HA 1 1 382 1 2 1 1 25 ASN HB3 A 522 . HB1 1 1 383 1 1 1 1 24 VAL HA A 521 . HA 1 1 383 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 384 1 1 1 1 24 VAL HA A 521 . HA 1 1 384 1 2 1 1 25 ASN HD22 A 522 . HD22 1 1 385 1 1 1 1 24 VAL HB A 521 . HB 1 1 385 1 2 1 1 25 ASN H A 522 . HN 1 1 386 1 1 1 1 24 VAL HB A 521 . HB 1 1 386 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 387 1 1 1 1 24 VAL MG1 A 521 . HG1# 1 1 387 1 2 1 1 25 ASN H A 522 . HN 1 1 388 1 1 1 1 24 VAL MG1 A 521 . HG1# 1 1 388 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 389 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 389 1 2 1 1 25 ASN H A 522 . HN 1 1 390 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 390 1 2 1 1 25 ASN HA A 522 . HA 1 1 391 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 391 1 2 1 1 25 ASN HB3 A 522 . HB1 1 1 392 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 392 1 2 1 1 26 TYR H A 523 . HN 1 1 393 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 393 1 2 1 1 26 TYR QD A 523 . HD# 1 1 394 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 394 1 2 1 1 26 TYR QE A 523 . HE# 1 1 395 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 395 1 2 1 1 39 HIS HD2 A 536 . HD2 1 1 396 1 1 1 1 24 VAL MG2 A 521 . HG2# 1 1 396 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 397 1 1 1 1 25 ASN H A 522 . HN 1 1 397 1 2 1 1 25 ASN HB2 A 522 . HB2 1 1 398 1 1 1 1 25 ASN H A 522 . HN 1 1 398 1 2 1 1 25 ASN HB3 A 522 . HB1 1 1 399 1 1 1 1 25 ASN H A 522 . HN 1 1 399 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 400 1 1 1 1 25 ASN H A 522 . HN 1 1 400 1 2 1 1 25 ASN HD22 A 522 . HD22 1 1 401 1 1 1 1 25 ASN H A 522 . HN 1 1 401 1 2 1 1 26 TYR HA A 523 . HA 1 1 402 1 1 1 1 25 ASN HA A 522 . HA 1 1 402 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 403 1 1 1 1 25 ASN HA A 522 . HA 1 1 403 1 2 1 1 25 ASN HD22 A 522 . HD22 1 1 404 1 1 1 1 25 ASN HA A 522 . HA 1 1 404 1 2 1 1 26 TYR H A 523 . HN 1 1 405 1 1 1 1 25 ASN HB2 A 522 . HB2 1 1 405 1 2 1 1 25 ASN HD21 A 522 . HD21 1 1 406 1 1 1 1 25 ASN HB2 A 522 . HB2 1 1 406 1 2 1 1 25 ASN HD22 A 522 . HD22 1 1 407 1 1 1 1 25 ASN HB2 A 522 . HB2 1 1 407 1 2 1 1 26 TYR H A 523 . HN 1 1 408 1 1 1 1 25 ASN HB3 A 522 . HB1 1 1 408 1 2 1 1 26 TYR H A 523 . HN 1 1 409 1 1 1 1 25 ASN HD21 A 522 . HD21 1 1 409 1 2 1 1 26 TYR H A 523 . HN 1 1 410 1 1 1 1 25 ASN HD21 A 522 . HD21 1 1 410 1 2 1 1 26 TYR HA A 523 . HA 1 1 411 1 1 1 1 25 ASN HD22 A 522 . HD22 1 1 411 1 2 1 1 26 TYR H A 523 . HN 1 1 412 1 1 1 1 26 TYR H A 523 . HN 1 1 412 1 2 1 1 26 TYR HB2 A 523 . HB2 1 1 413 1 1 1 1 26 TYR H A 523 . HN 1 1 413 1 2 1 1 26 TYR HB3 A 523 . HB1 1 1 414 1 1 1 1 26 TYR H A 523 . HN 1 1 414 1 2 1 1 26 TYR QD A 523 . HD# 1 1 415 1 1 1 1 26 TYR H A 523 . HN 1 1 415 1 2 1 1 27 CYS H A 524 . HN 1 1 416 1 1 1 1 26 TYR H A 523 . HN 1 1 416 1 2 1 1 28 SER H A 525 . HN 1 1 417 1 1 1 1 26 TYR HA A 523 . HA 1 1 417 1 2 1 1 26 TYR QD A 523 . HD# 1 1 418 1 1 1 1 26 TYR HA A 523 . HA 1 1 418 1 2 1 1 27 CYS H A 524 . HN 1 1 419 1 1 1 1 26 TYR HA A 523 . HA 1 1 419 1 2 1 1 27 CYS QB A 524 . HB# 1 1 420 1 1 1 1 26 TYR HA A 523 . HA 1 1 420 1 2 1 1 28 SER H A 525 . HN 1 1 421 1 1 1 1 26 TYR HA A 523 . HA 1 1 421 1 2 1 1 32 GLN H A 529 . HN 1 1 422 1 1 1 1 26 TYR HB2 A 523 . HB2 1 1 422 1 2 1 1 26 TYR QE A 523 . HE# 1 1 423 1 1 1 1 26 TYR HB2 A 523 . HB2 1 1 423 1 2 1 1 27 CYS H A 524 . HN 1 1 424 1 1 1 1 26 TYR HB2 A 523 . HB2 1 1 424 1 2 1 1 28 SER H A 525 . HN 1 1 425 1 1 1 1 26 TYR HB2 A 523 . HB2 1 1 425 1 2 1 1 32 GLN H A 529 . HN 1 1 426 1 1 1 1 26 TYR HB2 A 523 . HB2 1 1 426 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 427 1 1 1 1 26 TYR HB3 A 523 . HB1 1 1 427 1 2 1 1 27 CYS H A 524 . HN 1 1 428 1 1 1 1 26 TYR HB3 A 523 . HB1 1 1 428 1 2 1 1 28 SER H A 525 . HN 1 1 429 1 1 1 1 26 TYR HB3 A 523 . HB1 1 1 429 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 430 1 1 1 1 26 TYR QD A 523 . HD# 1 1 430 1 2 1 1 27 CYS H A 524 . HN 1 1 431 1 1 1 1 26 TYR QD A 523 . HD# 1 1 431 1 2 1 1 31 CYS HB2 A 528 . HB2 1 1 432 1 1 1 1 26 TYR QD A 523 . HD# 1 1 432 1 2 1 1 31 CYS HB3 A 528 . HB1 1 1 433 1 1 1 1 26 TYR QD A 523 . HD# 1 1 433 1 2 1 1 32 GLN H A 529 . HN 1 1 434 1 1 1 1 26 TYR QD A 523 . HD# 1 1 434 1 2 1 1 32 GLN HA A 529 . HA 1 1 435 1 1 1 1 26 TYR QD A 523 . HD# 1 1 435 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 436 1 1 1 1 26 TYR QD A 523 . HD# 1 1 436 1 2 1 1 32 GLN HB3 A 529 . HB1 1 1 437 1 1 1 1 26 TYR QE A 523 . HE# 1 1 437 1 2 1 1 32 GLN HA A 529 . HA 1 1 438 1 1 1 1 26 TYR QE A 523 . HE# 1 1 438 1 2 1 1 32 GLN QG A 529 . HG# 1 1 439 1 1 1 1 26 TYR QE A 523 . HE# 1 1 439 1 2 1 1 35 ASP H A 532 . HN 1 1 440 1 1 1 1 26 TYR QE A 523 . HE# 1 1 440 1 2 1 1 35 ASP HB2 A 532 . HB2 1 1 441 1 1 1 1 26 TYR QE A 523 . HE# 1 1 441 1 2 1 1 35 ASP HB3 A 532 . HB1 1 1 442 1 1 1 1 26 TYR QE A 523 . HE# 1 1 442 1 2 1 1 36 TRP HE3 A 533 . HE3 1 1 443 1 1 1 1 27 CYS H A 524 . HN 1 1 443 1 2 1 1 27 CYS QB A 524 . HB# 1 1 444 1 1 1 1 27 CYS H A 524 . HN 1 1 444 1 2 1 1 28 SER H A 525 . HN 1 1 445 1 1 1 1 27 CYS H A 524 . HN 1 1 445 1 2 1 1 31 CYS HB2 A 528 . HB2 1 1 446 1 1 1 1 27 CYS H A 524 . HN 1 1 446 1 2 1 1 31 CYS HB3 A 528 . HB1 1 1 447 1 1 1 1 27 CYS H A 524 . HN 1 1 447 1 2 1 1 32 GLN HA A 529 . HA 1 1 448 1 1 1 1 28 SER H A 525 . HN 1 1 448 1 2 1 1 31 CYS H A 528 . HN 1 1 449 1 1 1 1 28 SER H A 525 . HN 1 1 449 1 2 1 1 31 CYS HB2 A 528 . HB2 1 1 450 1 1 1 1 28 SER H A 525 . HN 1 1 450 1 2 1 1 31 CYS HB3 A 528 . HB1 1 1 451 1 1 1 1 28 SER H A 525 . HN 1 1 451 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 452 1 1 1 1 28 SER QB A 525 . HB# 1 1 452 1 2 1 1 30 PHE QD A 527 . HD# 1 1 453 1 1 1 1 28 SER QB A 525 . HB# 1 1 453 1 2 1 1 31 CYS H A 528 . HN 1 1 454 1 1 1 1 28 SER QB A 525 . HB# 1 1 454 1 2 1 1 32 GLN H A 529 . HN 1 1 455 1 1 1 1 28 SER HB2 A 525 . HB2 1 1 455 1 2 1 1 30 PHE H A 527 . HN 1 1 456 1 1 1 1 28 SER HB2 A 525 . HB2 1 1 456 1 2 1 1 30 PHE QB A 527 . HB# 1 1 457 1 1 1 1 28 SER HB3 A 525 . HB1 1 1 457 1 2 1 1 30 PHE H A 527 . HN 1 1 458 1 1 1 1 28 SER HB3 A 525 . HB1 1 1 458 1 2 1 1 30 PHE QB A 527 . HB# 1 1 459 1 1 1 1 29 THR HA A 526 . HA 1 1 459 1 2 1 1 29 THR MG A 526 . HG2# 1 1 460 1 1 1 1 29 THR HA A 526 . HA 1 1 460 1 2 1 1 32 GLN H A 529 . HN 1 1 461 1 1 1 1 29 THR HA A 526 . HA 1 1 461 1 2 1 1 32 GLN HA A 529 . HA 1 1 462 1 1 1 1 29 THR HA A 526 . HA 1 1 462 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 463 1 1 1 1 29 THR HA A 526 . HA 1 1 463 1 2 1 1 32 GLN HB3 A 529 . HB1 1 1 464 1 1 1 1 29 THR HA A 526 . HA 1 1 464 1 2 1 1 32 GLN QG A 529 . HG# 1 1 465 1 1 1 1 29 THR HA A 526 . HA 1 1 465 1 2 1 1 33 ARG H A 530 . HN 1 1 466 1 1 1 1 29 THR HB A 526 . HB 1 1 466 1 2 1 1 30 PHE H A 527 . HN 1 1 467 1 1 1 1 29 THR HB A 526 . HB 1 1 467 1 2 1 1 30 PHE QB A 527 . HB# 1 1 468 1 1 1 1 29 THR HB A 526 . HB 1 1 468 1 2 1 1 32 GLN HB3 A 529 . HB1 1 1 469 1 1 1 1 29 THR MG A 526 . HG2# 1 1 469 1 2 1 1 30 PHE H A 527 . HN 1 1 470 1 1 1 1 29 THR MG A 526 . HG2# 1 1 470 1 2 1 1 30 PHE HA A 527 . HA 1 1 471 1 1 1 1 29 THR MG A 526 . HG2# 1 1 471 1 2 1 1 30 PHE QB A 527 . HB# 1 1 472 1 1 1 1 29 THR MG A 526 . HG2# 1 1 472 1 2 1 1 31 CYS H A 528 . HN 1 1 473 1 1 1 1 29 THR MG A 526 . HG2# 1 1 473 1 2 1 1 32 GLN QG A 529 . HG# 1 1 474 1 1 1 1 29 THR MG A 526 . HG2# 1 1 474 1 2 1 1 33 ARG H A 530 . HN 1 1 475 1 1 1 1 29 THR MG A 526 . HG2# 1 1 475 1 2 1 1 33 ARG QD A 530 . HD# 1 1 476 1 1 1 1 30 PHE H A 527 . HN 1 1 476 1 2 1 1 30 PHE QB A 527 . HB# 1 1 477 1 1 1 1 30 PHE H A 527 . HN 1 1 477 1 2 1 1 30 PHE QD A 527 . HD# 1 1 478 1 1 1 1 30 PHE H A 527 . HN 1 1 478 1 2 1 1 31 CYS H A 528 . HN 1 1 479 1 1 1 1 30 PHE H A 527 . HN 1 1 479 1 2 1 1 32 GLN H A 529 . HN 1 1 480 1 1 1 1 30 PHE HA A 527 . HA 1 1 480 1 2 1 1 30 PHE QD A 527 . HD# 1 1 481 1 1 1 1 30 PHE HA A 527 . HA 1 1 481 1 2 1 1 32 GLN H A 529 . HN 1 1 482 1 1 1 1 30 PHE HA A 527 . HA 1 1 482 1 2 1 1 33 ARG QB A 530 . HB# 1 1 483 1 1 1 1 30 PHE QB A 527 . HB# 1 1 483 1 2 1 1 31 CYS H A 528 . HN 1 1 484 1 1 1 1 30 PHE QB A 527 . HB# 1 1 484 1 2 1 1 33 ARG H A 530 . HN 1 1 485 1 1 1 1 30 PHE QB A 527 . HB# 1 1 485 1 2 1 1 34 LYS H A 531 . HN 1 1 486 1 1 1 1 30 PHE QD A 527 . HD# 1 1 486 1 2 1 1 31 CYS H A 528 . HN 1 1 487 1 1 1 1 30 PHE QD A 527 . HD# 1 1 487 1 2 1 1 31 CYS HA A 528 . HA 1 1 488 1 1 1 1 30 PHE QD A 527 . HD# 1 1 488 1 2 1 1 34 LYS H A 531 . HN 1 1 489 1 1 1 1 30 PHE QD A 527 . HD# 1 1 489 1 2 1 1 34 LYS QB A 531 . HB# 1 1 490 1 1 1 1 30 PHE QD A 527 . HD# 1 1 490 1 2 1 1 34 LYS QG A 531 . HG# 1 1 491 1 1 1 1 30 PHE QE A 527 . HE# 1 1 491 1 2 1 1 31 CYS H A 528 . HN 1 1 492 1 1 1 1 30 PHE QE A 527 . HE# 1 1 492 1 2 1 1 31 CYS HA A 528 . HA 1 1 493 1 1 1 1 30 PHE QE A 527 . HE# 1 1 493 1 2 1 1 34 LYS QB A 531 . HB# 1 1 494 1 1 1 1 30 PHE QE A 527 . HE# 1 1 494 1 2 1 1 34 LYS QD A 531 . HD# 1 1 495 1 1 1 1 30 PHE QE A 527 . HE# 1 1 495 1 2 1 1 34 LYS QE A 531 . HE# 1 1 496 1 1 1 1 30 PHE QE A 527 . HE# 1 1 496 1 2 1 1 34 LYS QG A 531 . HG# 1 1 497 1 1 1 1 31 CYS H A 528 . HN 1 1 497 1 2 1 1 31 CYS HB2 A 528 . HB2 1 1 498 1 1 1 1 31 CYS H A 528 . HN 1 1 498 1 2 1 1 32 GLN H A 529 . HN 1 1 499 1 1 1 1 31 CYS H A 528 . HN 1 1 499 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 500 1 1 1 1 31 CYS H A 528 . HN 1 1 500 1 2 1 1 32 GLN HB3 A 529 . HB1 1 1 501 1 1 1 1 31 CYS H A 528 . HN 1 1 501 1 2 1 1 33 ARG H A 530 . HN 1 1 502 1 1 1 1 31 CYS HA A 528 . HA 1 1 502 1 2 1 1 33 ARG H A 530 . HN 1 1 503 1 1 1 1 31 CYS HA A 528 . HA 1 1 503 1 2 1 1 34 LYS QB A 531 . HB# 1 1 504 1 1 1 1 31 CYS HB2 A 528 . HB2 1 1 504 1 2 1 1 32 GLN H A 529 . HN 1 1 505 1 1 1 1 31 CYS HB2 A 528 . HB2 1 1 505 1 2 1 1 32 GLN HA A 529 . HA 1 1 506 1 1 1 1 31 CYS HB3 A 528 . HB1 1 1 506 1 2 1 1 32 GLN H A 529 . HN 1 1 507 1 1 1 1 32 GLN H A 529 . HN 1 1 507 1 2 1 1 32 GLN HB2 A 529 . HB2 1 1 508 1 1 1 1 32 GLN H A 529 . HN 1 1 508 1 2 1 1 32 GLN HB3 A 529 . HB1 1 1 509 1 1 1 1 32 GLN H A 529 . HN 1 1 509 1 2 1 1 33 ARG H A 530 . HN 1 1 510 1 1 1 1 32 GLN H A 529 . HN 1 1 510 1 2 1 1 33 ARG QB A 530 . HB# 1 1 511 1 1 1 1 32 GLN H A 529 . HN 1 1 511 1 2 1 1 34 LYS H A 531 . HN 1 1 512 1 1 1 1 32 GLN H A 529 . HN 1 1 512 1 2 1 1 35 ASP H A 532 . HN 1 1 513 1 1 1 1 32 GLN HA A 529 . HA 1 1 513 1 2 1 1 32 GLN QE A 529 . HE2# 1 1 514 1 1 1 1 32 GLN HB2 A 529 . HB2 1 1 514 1 2 1 1 32 GLN QE A 529 . HE2# 1 1 515 1 1 1 1 32 GLN HB2 A 529 . HB2 1 1 515 1 2 1 1 33 ARG H A 530 . HN 1 1 516 1 1 1 1 32 GLN HB3 A 529 . HB1 1 1 516 1 2 1 1 33 ARG H A 530 . HN 1 1 517 1 1 1 1 32 GLN QE A 529 . HE2# 1 1 517 1 2 1 1 32 GLN QG A 529 . HG# 1 1 518 1 1 1 1 32 GLN QE A 529 . HE2# 1 1 518 1 2 1 1 33 ARG H A 530 . HN 1 1 519 1 1 1 1 32 GLN QE A 529 . HE2# 1 1 519 1 2 1 1 33 ARG HA A 530 . HA 1 1 520 1 1 1 1 32 GLN QE A 529 . HE2# 1 1 520 1 2 1 1 35 ASP HB3 A 532 . HB1 1 1 521 1 1 1 1 32 GLN QE A 529 . HE2# 1 1 521 1 2 1 1 36 TRP HA A 533 . HA 1 1 522 1 1 1 1 32 GLN QE A 529 . HE2# 1 1 522 1 2 1 1 36 TRP HB2 A 533 . HB2 1 1 523 1 1 1 1 32 GLN QE A 529 . HE2# 1 1 523 1 2 1 1 36 TRP HE3 A 533 . HE3 1 1 524 1 1 1 1 32 GLN QG A 529 . HG# 1 1 524 1 2 1 1 33 ARG H A 530 . HN 1 1 525 1 1 1 1 33 ARG H A 530 . HN 1 1 525 1 2 1 1 33 ARG QB A 530 . HB# 1 1 526 1 1 1 1 33 ARG H A 530 . HN 1 1 526 1 2 1 1 33 ARG QD A 530 . HD# 1 1 527 1 1 1 1 33 ARG H A 530 . HN 1 1 527 1 2 1 1 33 ARG HG2 A 530 . HG2 1 1 528 1 1 1 1 33 ARG H A 530 . HN 1 1 528 1 2 1 1 33 ARG QG A 530 . HG# 1 1 529 1 1 1 1 33 ARG H A 530 . HN 1 1 529 1 2 1 1 33 ARG HG3 A 530 . HG1 1 1 530 1 1 1 1 33 ARG H A 530 . HN 1 1 530 1 2 1 1 36 TRP H A 533 . HN 1 1 531 1 1 1 1 33 ARG H A 530 . HN 1 1 531 1 2 1 1 36 TRP HB2 A 533 . HB2 1 1 532 1 1 1 1 33 ARG HA A 530 . HA 1 1 532 1 2 1 1 33 ARG QD A 530 . HD# 1 1 533 1 1 1 1 33 ARG HA A 530 . HA 1 1 533 1 2 1 1 33 ARG HG2 A 530 . HG2 1 1 534 1 1 1 1 33 ARG HA A 530 . HA 1 1 534 1 2 1 1 33 ARG QG A 530 . HG# 1 1 535 1 1 1 1 33 ARG HA A 530 . HA 1 1 535 1 2 1 1 33 ARG HG3 A 530 . HG1 1 1 536 1 1 1 1 33 ARG HA A 530 . HA 1 1 536 1 2 1 1 36 TRP H A 533 . HN 1 1 537 1 1 1 1 33 ARG HA A 530 . HA 1 1 537 1 2 1 1 36 TRP HA A 533 . HA 1 1 538 1 1 1 1 33 ARG HA A 530 . HA 1 1 538 1 2 1 1 36 TRP HB2 A 533 . HB2 1 1 539 1 1 1 1 33 ARG HA A 530 . HA 1 1 539 1 2 1 1 36 TRP HB3 A 533 . HB1 1 1 540 1 1 1 1 33 ARG QB A 530 . HB# 1 1 540 1 2 1 1 33 ARG QD A 530 . HD# 1 1 541 1 1 1 1 33 ARG QB A 530 . HB# 1 1 541 1 2 1 1 34 LYS H A 531 . HN 1 1 542 1 1 1 1 33 ARG QB A 530 . HB# 1 1 542 1 2 1 1 36 TRP H A 533 . HN 1 1 543 1 1 1 1 33 ARG QD A 530 . HD# 1 1 543 1 2 1 1 34 LYS H A 531 . HN 1 1 544 1 1 1 1 33 ARG HG2 A 530 . HG2 1 1 544 1 2 1 1 34 LYS H A 531 . HN 1 1 545 1 1 1 1 33 ARG HG3 A 530 . HG1 1 1 545 1 2 1 1 34 LYS H A 531 . HN 1 1 546 1 1 1 1 34 LYS H A 531 . HN 1 1 546 1 2 1 1 34 LYS HB2 A 531 . HB2 1 1 547 1 1 1 1 34 LYS H A 531 . HN 1 1 547 1 2 1 1 34 LYS QB A 531 . HB# 1 1 548 1 1 1 1 34 LYS H A 531 . HN 1 1 548 1 2 1 1 34 LYS HB3 A 531 . HB1 1 1 549 1 1 1 1 34 LYS H A 531 . HN 1 1 549 1 2 1 1 34 LYS QG A 531 . HG# 1 1 550 1 1 1 1 34 LYS H A 531 . HN 1 1 550 1 2 1 1 35 ASP H A 532 . HN 1 1 551 1 1 1 1 34 LYS H A 531 . HN 1 1 551 1 2 1 1 35 ASP HB2 A 532 . HB2 1 1 552 1 1 1 1 34 LYS H A 531 . HN 1 1 552 1 2 1 1 35 ASP HB3 A 532 . HB1 1 1 553 1 1 1 1 34 LYS H A 531 . HN 1 1 553 1 2 1 1 36 TRP H A 533 . HN 1 1 554 1 1 1 1 34 LYS HA A 531 . HA 1 1 554 1 2 1 1 36 TRP H A 533 . HN 1 1 555 1 1 1 1 34 LYS QB A 531 . HB# 1 1 555 1 2 1 1 34 LYS QE A 531 . HE# 1 1 556 1 1 1 1 34 LYS QB A 531 . HB# 1 1 556 1 2 1 1 35 ASP H A 532 . HN 1 1 557 1 1 1 1 34 LYS QB A 531 . HB# 1 1 557 1 2 1 1 35 ASP HA A 532 . HA 1 1 558 1 1 1 1 34 LYS QB A 531 . HB# 1 1 558 1 2 1 1 36 TRP H A 533 . HN 1 1 559 1 1 1 1 34 LYS HB2 A 531 . HB2 1 1 559 1 2 1 1 35 ASP H A 532 . HN 1 1 560 1 1 1 1 34 LYS HB2 A 531 . HB2 1 1 560 1 2 1 1 36 TRP H A 533 . HN 1 1 561 1 1 1 1 34 LYS HB3 A 531 . HB1 1 1 561 1 2 1 1 35 ASP H A 532 . HN 1 1 562 1 1 1 1 34 LYS HB3 A 531 . HB1 1 1 562 1 2 1 1 36 TRP H A 533 . HN 1 1 563 1 1 1 1 34 LYS QD A 531 . HD# 1 1 563 1 2 1 1 35 ASP H A 532 . HN 1 1 564 1 1 1 1 34 LYS QD A 531 . HD# 1 1 564 1 2 1 1 35 ASP HB2 A 532 . HB2 1 1 565 1 1 1 1 34 LYS QD A 531 . HD# 1 1 565 1 2 1 1 35 ASP HB3 A 532 . HB1 1 1 566 1 1 1 1 34 LYS QD A 531 . HD# 1 1 566 1 2 1 1 36 TRP H A 533 . HN 1 1 567 1 1 1 1 34 LYS QE A 531 . HE# 1 1 567 1 2 1 1 34 LYS QG A 531 . HG# 1 1 568 1 1 1 1 35 ASP H A 532 . HN 1 1 568 1 2 1 1 35 ASP HB2 A 532 . HB2 1 1 569 1 1 1 1 35 ASP H A 532 . HN 1 1 569 1 2 1 1 35 ASP HB3 A 532 . HB1 1 1 570 1 1 1 1 35 ASP H A 532 . HN 1 1 570 1 2 1 1 36 TRP H A 533 . HN 1 1 571 1 1 1 1 35 ASP H A 532 . HN 1 1 571 1 2 1 1 36 TRP HB2 A 533 . HB2 1 1 572 1 1 1 1 35 ASP H A 532 . HN 1 1 572 1 2 1 1 36 TRP HB3 A 533 . HB1 1 1 573 1 1 1 1 35 ASP HB2 A 532 . HB2 1 1 573 1 2 1 1 36 TRP H A 533 . HN 1 1 574 1 1 1 1 35 ASP HB3 A 532 . HB1 1 1 574 1 2 1 1 36 TRP H A 533 . HN 1 1 575 1 1 1 1 35 ASP HB3 A 532 . HB1 1 1 575 1 2 1 1 36 TRP HB2 A 533 . HB2 1 1 576 1 1 1 1 35 ASP HB3 A 532 . HB1 1 1 576 1 2 1 1 36 TRP HB3 A 533 . HB1 1 1 577 1 1 1 1 36 TRP H A 533 . HN 1 1 577 1 2 1 1 36 TRP HB2 A 533 . HB2 1 1 578 1 1 1 1 36 TRP H A 533 . HN 1 1 578 1 2 1 1 36 TRP HB3 A 533 . HB1 1 1 579 1 1 1 1 36 TRP H A 533 . HN 1 1 579 1 2 1 1 36 TRP HD1 A 533 . HD1 1 1 580 1 1 1 1 36 TRP H A 533 . HN 1 1 580 1 2 1 1 37 LYS HB2 A 534 . HB2 1 1 581 1 1 1 1 36 TRP H A 533 . HN 1 1 581 1 2 1 1 37 LYS QG A 534 . HG# 1 1 582 1 1 1 1 36 TRP H A 533 . HN 1 1 582 1 2 1 1 39 HIS H A 536 . HN 1 1 583 1 1 1 1 36 TRP HA A 533 . HA 1 1 583 1 2 1 1 36 TRP HD1 A 533 . HD1 1 1 584 1 1 1 1 36 TRP HA A 533 . HA 1 1 584 1 2 1 1 36 TRP HE3 A 533 . HE3 1 1 585 1 1 1 1 36 TRP HA A 533 . HA 1 1 585 1 2 1 1 39 HIS H A 536 . HN 1 1 586 1 1 1 1 36 TRP HA A 533 . HA 1 1 586 1 2 1 1 39 HIS HB2 A 536 . HB2 1 1 587 1 1 1 1 36 TRP HA A 533 . HA 1 1 587 1 2 1 1 39 HIS HB3 A 536 . HB1 1 1 588 1 1 1 1 36 TRP HA A 533 . HA 1 1 588 1 2 1 1 39 HIS HD2 A 536 . HD2 1 1 589 1 1 1 1 36 TRP HA A 533 . HA 1 1 589 1 2 1 1 40 GLN H A 537 . HN 1 1 590 1 1 1 1 36 TRP HB2 A 533 . HB2 1 1 590 1 2 1 1 36 TRP HD1 A 533 . HD1 1 1 591 1 1 1 1 36 TRP HB2 A 533 . HB2 1 1 591 1 2 1 1 37 LYS H A 534 . HN 1 1 592 1 1 1 1 36 TRP HB3 A 533 . HB1 1 1 592 1 2 1 1 36 TRP HD1 A 533 . HD1 1 1 593 1 1 1 1 36 TRP HB3 A 533 . HB1 1 1 593 1 2 1 1 36 TRP HE1 A 533 . HE1 1 1 594 1 1 1 1 36 TRP HB3 A 533 . HB1 1 1 594 1 2 1 1 37 LYS H A 534 . HN 1 1 595 1 1 1 1 36 TRP HB3 A 533 . HB1 1 1 595 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 596 1 1 1 1 36 TRP HD1 A 533 . HD1 1 1 596 1 2 1 1 37 LYS H A 534 . HN 1 1 597 1 1 1 1 36 TRP HD1 A 533 . HD1 1 1 597 1 2 1 1 37 LYS QG A 534 . HG# 1 1 598 1 1 1 1 36 TRP HD1 A 533 . HD1 1 1 598 1 2 1 1 40 GLN HB2 A 537 . HB2 1 1 599 1 1 1 1 36 TRP HD1 A 533 . HD1 1 1 599 1 2 1 1 40 GLN QB A 537 . HB# 1 1 600 1 1 1 1 36 TRP HD1 A 533 . HD1 1 1 600 1 2 1 1 40 GLN HB3 A 537 . HB1 1 1 601 1 1 1 1 36 TRP HD1 A 533 . HD1 1 1 601 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 602 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 602 1 2 1 1 37 LYS HA A 534 . HA 1 1 603 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 603 1 2 1 1 40 GLN H A 537 . HN 1 1 604 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 604 1 2 1 1 40 GLN HA A 537 . HA 1 1 605 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 605 1 2 1 1 40 GLN HB2 A 537 . HB2 1 1 606 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 606 1 2 1 1 40 GLN QB A 537 . HB# 1 1 607 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 607 1 2 1 1 40 GLN HB3 A 537 . HB1 1 1 608 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 608 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 609 1 1 1 1 36 TRP HE1 A 533 . HE1 1 1 609 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 610 1 1 1 1 36 TRP HE3 A 533 . HE3 1 1 610 1 2 1 1 39 HIS HD2 A 536 . HD2 1 1 611 1 1 1 1 36 TRP HH2 A 533 . HH2 1 1 611 1 2 1 1 40 GLN HA A 537 . HA 1 1 612 1 1 1 1 36 TRP HH2 A 533 . HH2 1 1 612 1 2 1 1 40 GLN QB A 537 . HB# 1 1 613 1 1 1 1 36 TRP HH2 A 533 . HH2 1 1 613 1 2 1 1 43 CYS HB2 A 540 . HB2 1 1 614 1 1 1 1 36 TRP HH2 A 533 . HH2 1 1 614 1 2 1 1 43 CYS HB3 A 540 . HB1 1 1 615 1 1 1 1 36 TRP HZ2 A 533 . HZ2 1 1 615 1 2 1 1 40 GLN HB2 A 537 . HB2 1 1 616 1 1 1 1 36 TRP HZ2 A 533 . HZ2 1 1 616 1 2 1 1 40 GLN HB3 A 537 . HB1 1 1 617 1 1 1 1 36 TRP HZ2 A 533 . HZ2 1 1 617 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 618 1 1 1 1 36 TRP HZ2 A 533 . HZ2 1 1 618 1 2 1 1 40 GLN HG3 A 537 . HG1 1 1 619 1 1 1 1 36 TRP HZ3 A 533 . HZ3 1 1 619 1 2 1 1 40 GLN HA A 537 . HA 1 1 620 1 1 1 1 36 TRP HZ3 A 533 . HZ3 1 1 620 1 2 1 1 43 CYS HB2 A 540 . HB2 1 1 621 1 1 1 1 36 TRP HZ3 A 533 . HZ3 1 1 621 1 2 1 1 43 CYS HB3 A 540 . HB1 1 1 622 1 1 1 1 37 LYS H A 534 . HN 1 1 622 1 2 1 1 37 LYS HB2 A 534 . HB2 1 1 623 1 1 1 1 37 LYS H A 534 . HN 1 1 623 1 2 1 1 37 LYS HB3 A 534 . HB1 1 1 624 1 1 1 1 37 LYS H A 534 . HN 1 1 624 1 2 1 1 37 LYS QD A 534 . HD# 1 1 625 1 1 1 1 37 LYS H A 534 . HN 1 1 625 1 2 1 1 37 LYS QG A 534 . HG# 1 1 626 1 1 1 1 37 LYS H A 534 . HN 1 1 626 1 2 1 1 38 ASP H A 535 . HN 1 1 627 1 1 1 1 37 LYS H A 534 . HN 1 1 627 1 2 1 1 38 ASP HB2 A 535 . HB2 1 1 628 1 1 1 1 37 LYS H A 534 . HN 1 1 628 1 2 1 1 39 HIS H A 536 . HN 1 1 629 1 1 1 1 37 LYS H A 534 . HN 1 1 629 1 2 1 1 40 GLN H A 537 . HN 1 1 630 1 1 1 1 37 LYS H A 534 . HN 1 1 630 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 631 1 1 1 1 37 LYS H A 534 . HN 1 1 631 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 632 1 1 1 1 37 LYS HA A 534 . HA 1 1 632 1 2 1 1 37 LYS QD A 534 . HD# 1 1 633 1 1 1 1 37 LYS HA A 534 . HA 1 1 633 1 2 1 1 37 LYS QE A 534 . HE# 1 1 634 1 1 1 1 37 LYS HA A 534 . HA 1 1 634 1 2 1 1 37 LYS QG A 534 . HG# 1 1 635 1 1 1 1 37 LYS HA A 534 . HA 1 1 635 1 2 1 1 39 HIS H A 536 . HN 1 1 636 1 1 1 1 37 LYS HA A 534 . HA 1 1 636 1 2 1 1 40 GLN H A 537 . HN 1 1 637 1 1 1 1 37 LYS HA A 534 . HA 1 1 637 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 638 1 1 1 1 37 LYS HA A 534 . HA 1 1 638 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 639 1 1 1 1 37 LYS HA A 534 . HA 1 1 639 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 640 1 1 1 1 37 LYS HA A 534 . HA 1 1 640 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 641 1 1 1 1 37 LYS HB2 A 534 . HB2 1 1 641 1 2 1 1 37 LYS QE A 534 . HE# 1 1 642 1 1 1 1 37 LYS HB2 A 534 . HB2 1 1 642 1 2 1 1 38 ASP H A 535 . HN 1 1 643 1 1 1 1 37 LYS HB2 A 534 . HB2 1 1 643 1 2 1 1 39 HIS H A 536 . HN 1 1 644 1 1 1 1 37 LYS HB2 A 534 . HB2 1 1 644 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 645 1 1 1 1 37 LYS HB2 A 534 . HB2 1 1 645 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 646 1 1 1 1 37 LYS HB3 A 534 . HB1 1 1 646 1 2 1 1 38 ASP H A 535 . HN 1 1 647 1 1 1 1 37 LYS HB3 A 534 . HB1 1 1 647 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 648 1 1 1 1 37 LYS QD A 534 . HD# 1 1 648 1 2 1 1 37 LYS QE A 534 . HE# 1 1 649 1 1 1 1 37 LYS QE A 534 . HE# 1 1 649 1 2 1 1 37 LYS QG A 534 . HG# 1 1 650 1 1 1 1 37 LYS QG A 534 . HG# 1 1 650 1 2 1 1 38 ASP H A 535 . HN 1 1 651 1 1 1 1 37 LYS QG A 534 . HG# 1 1 651 1 2 1 1 39 HIS H A 536 . HN 1 1 652 1 1 1 1 37 LYS QG A 534 . HG# 1 1 652 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 653 1 1 1 1 38 ASP H A 535 . HN 1 1 653 1 2 1 1 38 ASP HB2 A 535 . HB2 1 1 654 1 1 1 1 38 ASP H A 535 . HN 1 1 654 1 2 1 1 38 ASP HB3 A 535 . HB1 1 1 655 1 1 1 1 38 ASP H A 535 . HN 1 1 655 1 2 1 1 39 HIS H A 536 . HN 1 1 656 1 1 1 1 38 ASP H A 535 . HN 1 1 656 1 2 1 1 39 HIS HA A 536 . HA 1 1 657 1 1 1 1 38 ASP H A 535 . HN 1 1 657 1 2 1 1 39 HIS HB2 A 536 . HB2 1 1 658 1 1 1 1 38 ASP H A 535 . HN 1 1 658 1 2 1 1 39 HIS QB A 536 . HB# 1 1 659 1 1 1 1 38 ASP H A 535 . HN 1 1 659 1 2 1 1 39 HIS HB3 A 536 . HB1 1 1 660 1 1 1 1 38 ASP H A 535 . HN 1 1 660 1 2 1 1 40 GLN H A 537 . HN 1 1 661 1 1 1 1 38 ASP H A 535 . HN 1 1 661 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 662 1 1 1 1 38 ASP HA A 535 . HA 1 1 662 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 663 1 1 1 1 38 ASP HA A 535 . HA 1 1 663 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 664 1 1 1 1 38 ASP HB2 A 535 . HB2 1 1 664 1 2 1 1 39 HIS H A 536 . HN 1 1 665 1 1 1 1 38 ASP HB2 A 535 . HB2 1 1 665 1 2 1 1 39 HIS HA A 536 . HA 1 1 666 1 1 1 1 38 ASP HB2 A 535 . HB2 1 1 666 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 667 1 1 1 1 38 ASP HB3 A 535 . HB1 1 1 667 1 2 1 1 39 HIS H A 536 . HN 1 1 668 1 1 1 1 38 ASP HB3 A 535 . HB1 1 1 668 1 2 1 1 39 HIS HA A 536 . HA 1 1 669 1 1 1 1 39 HIS H A 536 . HN 1 1 669 1 2 1 1 39 HIS HB2 A 536 . HB2 1 1 670 1 1 1 1 39 HIS H A 536 . HN 1 1 670 1 2 1 1 39 HIS HB3 A 536 . HB1 1 1 671 1 1 1 1 39 HIS H A 536 . HN 1 1 671 1 2 1 1 39 HIS HD2 A 536 . HD2 1 1 672 1 1 1 1 39 HIS H A 536 . HN 1 1 672 1 2 1 1 40 GLN H A 537 . HN 1 1 673 1 1 1 1 39 HIS H A 536 . HN 1 1 673 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 674 1 1 1 1 39 HIS H A 536 . HN 1 1 674 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 675 1 1 1 1 39 HIS H A 536 . HN 1 1 675 1 2 1 1 41 HIS H A 538 . HN 1 1 676 1 1 1 1 39 HIS H A 536 . HN 1 1 676 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 677 1 1 1 1 39 HIS H A 536 . HN 1 1 677 1 2 1 1 42 ILE H A 539 . HN 1 1 678 1 1 1 1 39 HIS H A 536 . HN 1 1 678 1 2 1 1 42 ILE HG13 A 539 . HG11 1 1 679 1 1 1 1 39 HIS H A 536 . HN 1 1 679 1 2 1 1 43 CYS H A 540 . HN 1 1 680 1 1 1 1 39 HIS HA A 536 . HA 1 1 680 1 2 1 1 39 HIS HE1 A 536 . HE1 1 1 681 1 1 1 1 39 HIS HA A 536 . HA 1 1 681 1 2 1 1 42 ILE H A 539 . HN 1 1 682 1 1 1 1 39 HIS HA A 536 . HA 1 1 682 1 2 1 1 42 ILE HB A 539 . HB 1 1 683 1 1 1 1 39 HIS HA A 536 . HA 1 1 683 1 2 1 1 42 ILE MD A 539 . HD1# 1 1 684 1 1 1 1 39 HIS HA A 536 . HA 1 1 684 1 2 1 1 42 ILE HG12 A 539 . HG12 1 1 685 1 1 1 1 39 HIS HA A 536 . HA 1 1 685 1 2 1 1 42 ILE HG13 A 539 . HG11 1 1 686 1 1 1 1 39 HIS HA A 536 . HA 1 1 686 1 2 1 1 43 CYS H A 540 . HN 1 1 687 1 1 1 1 39 HIS QB A 536 . HB# 1 1 687 1 2 1 1 39 HIS HD2 A 536 . HD2 1 1 688 1 1 1 1 39 HIS QB A 536 . HB# 1 1 688 1 2 1 1 40 GLN H A 537 . HN 1 1 689 1 1 1 1 39 HIS HB2 A 536 . HB2 1 1 689 1 2 1 1 40 GLN H A 537 . HN 1 1 690 1 1 1 1 39 HIS HB3 A 536 . HB1 1 1 690 1 2 1 1 40 GLN H A 537 . HN 1 1 691 1 1 1 1 39 HIS HD2 A 536 . HD2 1 1 691 1 2 1 1 43 CYS HB2 A 540 . HB2 1 1 692 1 1 1 1 39 HIS HE1 A 536 . HE1 1 1 692 1 2 1 1 42 ILE MD A 539 . HD1# 1 1 693 1 1 1 1 39 HIS HE1 A 536 . HE1 1 1 693 1 2 1 1 42 ILE HG12 A 539 . HG12 1 1 694 1 1 1 1 39 HIS HE1 A 536 . HE1 1 1 694 1 2 1 1 43 CYS H A 540 . HN 1 1 695 1 1 1 1 39 HIS HE1 A 536 . HE1 1 1 695 1 2 1 1 43 CYS HA A 540 . HA 1 1 696 1 1 1 1 40 GLN H A 537 . HN 1 1 696 1 2 1 1 40 GLN QB A 537 . HB# 1 1 697 1 1 1 1 40 GLN H A 537 . HN 1 1 697 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 698 1 1 1 1 40 GLN H A 537 . HN 1 1 698 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 699 1 1 1 1 40 GLN H A 537 . HN 1 1 699 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 700 1 1 1 1 40 GLN H A 537 . HN 1 1 700 1 2 1 1 40 GLN HG3 A 537 . HG1 1 1 701 1 1 1 1 40 GLN H A 537 . HN 1 1 701 1 2 1 1 41 HIS H A 538 . HN 1 1 702 1 1 1 1 40 GLN H A 537 . HN 1 1 702 1 2 1 1 42 ILE H A 539 . HN 1 1 703 1 1 1 1 40 GLN H A 537 . HN 1 1 703 1 2 1 1 43 CYS H A 540 . HN 1 1 704 1 1 1 1 40 GLN HA A 537 . HA 1 1 704 1 2 1 1 42 ILE H A 539 . HN 1 1 705 1 1 1 1 40 GLN HA A 537 . HA 1 1 705 1 2 1 1 43 CYS H A 540 . HN 1 1 706 1 1 1 1 40 GLN HA A 537 . HA 1 1 706 1 2 1 1 43 CYS HB3 A 540 . HB1 1 1 707 1 1 1 1 40 GLN QB A 537 . HB# 1 1 707 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 708 1 1 1 1 40 GLN QB A 537 . HB# 1 1 708 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 709 1 1 1 1 40 GLN HB2 A 537 . HB2 1 1 709 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 710 1 1 1 1 40 GLN HB2 A 537 . HB2 1 1 710 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 711 1 1 1 1 40 GLN HB3 A 537 . HB1 1 1 711 1 2 1 1 40 GLN HE21 A 537 . HE21 1 1 712 1 1 1 1 40 GLN HB3 A 537 . HB1 1 1 712 1 2 1 1 40 GLN HE22 A 537 . HE22 1 1 713 1 1 1 1 40 GLN HE21 A 537 . HE21 1 1 713 1 2 1 1 40 GLN HG2 A 537 . HG2 1 1 714 1 1 1 1 40 GLN HG2 A 537 . HG2 1 1 714 1 2 1 1 41 HIS H A 538 . HN 1 1 715 1 1 1 1 40 GLN HG2 A 537 . HG2 1 1 715 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 716 1 1 1 1 40 GLN HG2 A 537 . HG2 1 1 716 1 2 1 1 42 ILE H A 539 . HN 1 1 717 1 1 1 1 40 GLN HG3 A 537 . HG1 1 1 717 1 2 1 1 41 HIS H A 538 . HN 1 1 718 1 1 1 1 40 GLN HG3 A 537 . HG1 1 1 718 1 2 1 1 41 HIS HA A 538 . HA 1 1 719 1 1 1 1 40 GLN HG3 A 537 . HG1 1 1 719 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 720 1 1 1 1 40 GLN HG3 A 537 . HG1 1 1 720 1 2 1 1 42 ILE H A 539 . HN 1 1 721 1 1 1 1 41 HIS H A 538 . HN 1 1 721 1 2 1 1 41 HIS HB2 A 538 . HB2 1 1 722 1 1 1 1 41 HIS H A 538 . HN 1 1 722 1 2 1 1 41 HIS QB A 538 . HB# 1 1 723 1 1 1 1 41 HIS H A 538 . HN 1 1 723 1 2 1 1 41 HIS HB3 A 538 . HB1 1 1 724 1 1 1 1 41 HIS H A 538 . HN 1 1 724 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 725 1 1 1 1 41 HIS H A 538 . HN 1 1 725 1 2 1 1 42 ILE H A 539 . HN 1 1 726 1 1 1 1 41 HIS H A 538 . HN 1 1 726 1 2 1 1 42 ILE HB A 539 . HB 1 1 727 1 1 1 1 41 HIS H A 538 . HN 1 1 727 1 2 1 1 43 CYS H A 540 . HN 1 1 728 1 1 1 1 41 HIS HA A 538 . HA 1 1 728 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 729 1 1 1 1 41 HIS HA A 538 . HA 1 1 729 1 2 1 1 42 ILE MG A 539 . HG2# 1 1 730 1 1 1 1 41 HIS QB A 538 . HB# 1 1 730 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 731 1 1 1 1 41 HIS QB A 538 . HB# 1 1 731 1 2 1 1 42 ILE H A 539 . HN 1 1 732 1 1 1 1 41 HIS HB2 A 538 . HB2 1 1 732 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 733 1 1 1 1 41 HIS HB2 A 538 . HB2 1 1 733 1 2 1 1 42 ILE H A 539 . HN 1 1 734 1 1 1 1 41 HIS HB2 A 538 . HB2 1 1 734 1 2 1 1 42 ILE MG A 539 . HG2# 1 1 735 1 1 1 1 41 HIS HB3 A 538 . HB1 1 1 735 1 2 1 1 41 HIS HD2 A 538 . HD2 1 1 736 1 1 1 1 41 HIS HB3 A 538 . HB1 1 1 736 1 2 1 1 42 ILE H A 539 . HN 1 1 737 1 1 1 1 41 HIS HB3 A 538 . HB1 1 1 737 1 2 1 1 42 ILE MG A 539 . HG2# 1 1 738 1 1 1 1 41 HIS HD2 A 538 . HD2 1 1 738 1 2 1 1 42 ILE HB A 539 . HB 1 1 739 1 1 1 1 41 HIS HD2 A 538 . HD2 1 1 739 1 2 1 1 42 ILE MG A 539 . HG2# 1 1 740 1 1 1 1 41 HIS HE1 A 538 . HE1 1 1 740 1 2 1 1 42 ILE H A 539 . HN 1 1 741 1 1 1 1 41 HIS HE1 A 538 . HE1 1 1 741 1 2 1 1 42 ILE HG12 A 539 . HG12 1 1 742 1 1 1 1 41 HIS HE1 A 538 . HE1 1 1 742 1 2 1 1 42 ILE MG A 539 . HG2# 1 1 743 1 1 1 1 42 ILE H A 539 . HN 1 1 743 1 2 1 1 42 ILE HB A 539 . HB 1 1 744 1 1 1 1 42 ILE H A 539 . HN 1 1 744 1 2 1 1 42 ILE MD A 539 . HD1# 1 1 745 1 1 1 1 42 ILE H A 539 . HN 1 1 745 1 2 1 1 42 ILE HG12 A 539 . HG12 1 1 746 1 1 1 1 42 ILE H A 539 . HN 1 1 746 1 2 1 1 42 ILE HG13 A 539 . HG11 1 1 747 1 1 1 1 42 ILE H A 539 . HN 1 1 747 1 2 1 1 42 ILE MG A 539 . HG2# 1 1 748 1 1 1 1 42 ILE H A 539 . HN 1 1 748 1 2 1 1 43 CYS H A 540 . HN 1 1 749 1 1 1 1 42 ILE H A 539 . HN 1 1 749 1 2 1 1 43 CYS HA A 540 . HA 1 1 750 1 1 1 1 42 ILE H A 539 . HN 1 1 750 1 2 1 1 43 CYS HB2 A 540 . HB2 1 1 751 1 1 1 1 42 ILE HA A 539 . HA 1 1 751 1 2 1 1 42 ILE HB A 539 . HB 1 1 752 1 1 1 1 42 ILE HA A 539 . HA 1 1 752 1 2 1 1 42 ILE MD A 539 . HD1# 1 1 753 1 1 1 1 42 ILE HA A 539 . HA 1 1 753 1 2 1 1 42 ILE MG A 539 . HG2# 1 1 754 1 1 1 1 42 ILE HB A 539 . HB 1 1 754 1 2 1 1 42 ILE MD A 539 . HD1# 1 1 755 1 1 1 1 42 ILE HB A 539 . HB 1 1 755 1 2 1 1 43 CYS H A 540 . HN 1 1 756 1 1 1 1 42 ILE MD A 539 . HD1# 1 1 756 1 2 1 1 43 CYS H A 540 . HN 1 1 757 1 1 1 1 42 ILE MD A 539 . HD1# 1 1 757 1 2 1 1 43 CYS HA A 540 . HA 1 1 758 1 1 1 1 42 ILE MD A 539 . HD1# 1 1 758 1 2 1 1 43 CYS HB2 A 540 . HB2 1 1 759 1 1 1 1 42 ILE MD A 539 . HD1# 1 1 759 1 2 1 1 44 GLY H A 541 . HN 1 1 760 1 1 1 1 42 ILE MD A 539 . HD1# 1 1 760 1 2 1 1 45 GLN H A 542 . HN 1 1 761 1 1 1 1 42 ILE HG12 A 539 . HG12 1 1 761 1 2 1 1 43 CYS H A 540 . HN 1 1 762 1 1 1 1 42 ILE HG12 A 539 . HG12 1 1 762 1 2 1 1 43 CYS HA A 540 . HA 1 1 763 1 1 1 1 42 ILE HG13 A 539 . HG11 1 1 763 1 2 1 1 43 CYS H A 540 . HN 1 1 764 1 1 1 1 42 ILE HG13 A 539 . HG11 1 1 764 1 2 1 1 43 CYS HA A 540 . HA 1 1 765 1 1 1 1 42 ILE HG13 A 539 . HG11 1 1 765 1 2 1 1 43 CYS HB3 A 540 . HB1 1 1 766 1 1 1 1 42 ILE MG A 539 . HG2# 1 1 766 1 2 1 1 43 CYS H A 540 . HN 1 1 767 1 1 1 1 42 ILE MG A 539 . HG2# 1 1 767 1 2 1 1 43 CYS HA A 540 . HA 1 1 768 1 1 1 1 43 CYS H A 540 . HN 1 1 768 1 2 1 1 43 CYS HB2 A 540 . HB2 1 1 769 1 1 1 1 43 CYS H A 540 . HN 1 1 769 1 2 1 1 43 CYS HB3 A 540 . HB1 1 1 770 1 1 1 1 43 CYS H A 540 . HN 1 1 770 1 2 1 1 44 GLY H A 541 . HN 1 1 771 1 1 1 1 43 CYS H A 540 . HN 1 1 771 1 2 1 1 45 GLN H A 542 . HN 1 1 772 1 1 1 1 43 CYS HA A 540 . HA 1 1 772 1 2 1 1 44 GLY H A 541 . HN 1 1 773 1 1 1 1 43 CYS HA A 540 . HA 1 1 773 1 2 1 1 44 GLY QA A 541 . HA# 1 1 774 1 1 1 1 43 CYS HA A 540 . HA 1 1 774 1 2 1 1 45 GLN H A 542 . HN 1 1 775 1 1 1 1 43 CYS HB2 A 540 . HB2 1 1 775 1 2 1 1 44 GLY H A 541 . HN 1 1 776 1 1 1 1 43 CYS HB3 A 540 . HB1 1 1 776 1 2 1 1 44 GLY H A 541 . HN 1 1 777 1 1 1 1 43 CYS HB3 A 540 . HB1 1 1 777 1 2 1 1 44 GLY HA2 A 541 . HA2 1 1 778 1 1 1 1 43 CYS HB3 A 540 . HB1 1 1 778 1 2 1 1 44 GLY HA3 A 541 . HA1 1 1 779 1 1 1 1 44 GLY H A 541 . HN 1 1 779 1 2 1 1 44 GLY QA A 541 . HA# 1 1 780 1 1 1 1 44 GLY H A 541 . HN 1 1 780 1 2 1 1 45 GLN H A 542 . HN 1 1 781 1 1 1 1 44 GLY H A 541 . HN 1 1 781 1 2 1 1 45 GLN HA A 542 . HA 1 1 782 1 1 1 1 44 GLY H A 541 . HN 1 1 782 1 2 1 1 45 GLN QE A 542 . HE2# 1 1 783 1 1 1 1 44 GLY QA A 541 . HA# 1 1 783 1 2 1 1 45 GLN QB A 542 . HB# 1 1 784 1 1 1 1 44 GLY QA A 541 . HA# 1 1 784 1 2 1 1 45 GLN QG A 542 . HG# 1 1 785 1 1 1 1 45 GLN H A 542 . HN 1 1 785 1 2 1 1 45 GLN QB A 542 . HB# 1 1 786 1 1 1 1 45 GLN H A 542 . HN 1 1 786 1 2 1 1 45 GLN QE A 542 . HE2# 1 1 787 1 1 1 1 45 GLN H A 542 . HN 1 1 787 1 2 1 1 45 GLN QG A 542 . HG# 1 1 788 1 1 1 1 45 GLN HA A 542 . HA 1 1 788 1 2 1 1 45 GLN QE A 542 . HE2# 1 1 789 1 1 1 1 45 GLN HA A 542 . HA 1 1 789 1 2 1 1 45 GLN QG A 542 . HG# 1 1 790 1 1 1 1 45 GLN QE A 542 . HE2# 1 1 790 1 2 1 1 46 SER H A 543 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.07 1.8 4.34 1 1 2 1 . . . . . 3.785 1.8 5.77 1 1 3 1 . . . . . 2.735 1.8 3.67 1 1 4 1 . . . . . 3.35 1.8 4.9 1 1 5 1 . . . . . 2.195 1.8 2.59 1 1 6 1 . . . . . 3.085 1.8 4.37 1 1 7 1 . . . . . 2.67 1.8 3.54 1 1 8 1 . . . . . 2.705 1.8 3.61 1 1 9 1 . . . . . 2.7 1.8 3.6 1 1 10 1 . . . . . 3.445 1.8 5.09 1 1 11 1 . . . . . 3.125 1.8 4.45 1 1 12 1 . . . . . 3.445 1.8 5.09 1 1 13 1 . . . . . 2.83 1.8 3.86 1 1 14 1 . . . . . 2.57 1.8 3.34 1 1 15 1 . . . . . 2.83 1.8 3.86 1 1 16 1 . . . . . 2.745 1.8 3.69 1 1 17 1 . . . . . 4.035 1.8 6.27 1 1 18 1 . . . . . 3.185 1.8 4.57 1 1 19 1 . . . . . 2.715 1.8 3.63 1 1 20 1 . . . . . 2.28 1.8 2.76 1 1 21 1 . . . . . 3.07 1.8 4.34 1 1 22 1 . . . . . 3.53 1.8 5.26 1 1 23 1 . . . . . 3.13 1.8 4.46 1 1 24 1 . . . . . 3.36 1.8 4.92 1 1 25 1 . . . . . 2.915 1.8 4.03 1 1 26 1 . . . . . 2.98 1.8 4.16 1 1 27 1 . . . . . 2.915 1.8 4.03 1 1 28 1 . . . . . 2.98 1.8 4.16 1 1 29 1 . . . . . 3.05 1.8 4.3 1 1 30 1 . . . . . 2.68 1.8 3.56 1 1 31 1 . . . . . 3.475 1.8 5.15 1 1 32 1 . . . . . 2.51 1.8 3.22 1 1 33 1 . . . . . 3.18 1.8 4.56 1 1 34 1 . . . . . 3.135 1.8 4.47 1 1 35 1 . . . . . 3.495 1.8 5.19 1 1 36 1 . . . . . 3.47 1.8 5.14 1 1 37 1 . . . . . 2.385 1.8 2.97 1 1 38 1 . . . . . 3.31 1.8 4.82 1 1 39 1 . . . . . 2.575 1.8 3.35 1 1 40 1 . . . . . 2.785 1.8 3.77 1 1 41 1 . . . . . 3.715 1.8 5.63 1 1 42 1 . . . . . 2.615 1.8 3.43 1 1 43 1 . . . . . 3.73 1.8 5.66 1 1 44 1 . . . . . 3.73 1.8 5.66 1 1 45 1 . . . . . 2.585 1.8 3.37 1 1 46 1 . . . . . 2.755 1.8 3.71 1 1 47 1 . . . . . 3.365 1.8 4.93 1 1 48 1 . . . . . 3.41 1.8 5.02 1 1 49 1 . . . . . 3.4 1.8 5.0 1 1 50 1 . . . . . 3.41 1.8 5.02 1 1 51 1 . . . . . 3.595 1.8 5.39 1 1 52 1 . . . . . 3.635 1.8 5.47 1 1 53 1 . . . . . 3.675 1.8 5.55 1 1 54 1 . . . . . 2.72 1.8 3.64 1 1 55 1 . . . . . 3.585 1.8 5.37 1 1 56 1 . . . . . 2.725 1.8 3.65 1 1 57 1 . . . . . 3.53 1.8 5.26 1 1 58 1 . . . . . 3.84 1.8 5.88 1 1 59 1 . . . . . 2.305 1.8 2.81 1 1 60 1 . . . . . 2.955 1.8 4.11 1 1 61 1 . . . . . 3.0 1.8 4.2 1 1 62 1 . . . . . 3.14 1.8 4.48 1 1 63 1 . . . . . 3.27 1.8 4.74 1 1 64 1 . . . . . 2.69 1.8 3.58 1 1 65 1 . . . . . 3.49 1.8 5.18 1 1 66 1 . . . . . 3.195 1.8 4.59 1 1 67 1 . . . . . 4.0 1.8 6.2 1 1 68 1 . . . . . 3.37 1.8 4.94 1 1 69 1 . . . . . 2.855 1.8 3.91 1 1 70 1 . . . . . 2.965 1.8 4.13 1 1 71 1 . . . . . 3.965 1.8 6.13 1 1 72 1 . . . . . 3.155 1.8 4.51 1 1 73 1 . . . . . 3.685 1.8 5.57 1 1 74 1 . . . . . 3.045 1.8 4.29 1 1 75 1 . . . . . 3.395 1.8 4.99 1 1 76 1 . . . . . 3.015 1.8 4.23 1 1 77 1 . . . . . 2.7 1.8 3.6 1 1 78 1 . . . . . 3.72 1.8 5.64 1 1 79 1 . . . . . 3.36 1.8 4.92 1 1 80 1 . . . . . 2.98 1.8 4.16 1 1 81 1 . . . . . 3.225 1.8 4.65 1 1 82 1 . . . . . 3.27 1.8 4.74 1 1 83 1 . . . . . 2.69 1.8 3.58 1 1 84 1 . . . . . 2.595 1.8 3.39 1 1 85 1 . . . . . 3.155 1.8 4.51 1 1 86 1 . . . . . 3.26 1.8 4.72 1 1 87 1 . . . . . 2.74 1.8 3.68 1 1 88 1 . . . . . 2.425 1.8 3.05 1 1 89 1 . . . . . 2.71 1.8 3.62 1 1 90 1 . . . . . 3.34 1.8 4.88 1 1 91 1 . . . . . 3.45 1.8 5.1 1 1 92 1 . . . . . 3.82 1.8 5.84 1 1 93 1 . . . . . 2.96 1.8 4.12 1 1 94 1 . . . . . 3.625 1.8 5.45 1 1 95 1 . . . . . 3.66 1.8 5.52 1 1 96 1 . . . . . 2.425 1.8 3.05 1 1 97 1 . . . . . 3.395 1.8 4.99 1 1 98 1 . . . . . 3.455 1.8 5.11 1 1 99 1 . . . . . 3.51 1.8 5.22 1 1 100 1 . . . . . 3.745 1.8 5.69 1 1 101 1 . . . . . 2.79 1.8 3.78 1 1 102 1 . . . . . 2.94 1.8 4.08 1 1 103 1 . . . . . 3.46 1.8 5.12 1 1 104 1 . . . . . 3.62 1.8 5.44 1 1 105 1 . . . . . 3.43 1.8 5.06 1 1 106 1 . . . . . 3.46 1.8 5.12 1 1 107 1 . . . . . 2.5 1.8 3.2 1 1 108 1 . . . . . 2.775 1.8 3.75 1 1 109 1 . . . . . 2.79 1.8 3.78 1 1 110 1 . . . . . 3.375 1.8 4.95 1 1 111 1 . . . . . 2.905 1.8 4.01 1 1 112 1 . . . . . 2.855 1.8 3.91 1 1 113 1 . . . . . 3.57 1.8 5.34 1 1 114 1 . . . . . 3.63 1.8 5.46 1 1 115 1 . . . . . 3.135 1.8 4.47 1 1 116 1 . . . . . 3.275 1.8 4.75 1 1 117 1 . . . . . 3.965 1.8 6.13 1 1 118 1 . . . . . 4.15 1.8 6.5 1 1 119 1 . . . . . 3.93 1.8 6.06 1 1 120 1 . . . . . 3.215 1.8 4.63 1 1 121 1 . . . . . 4.13 1.8 6.46 1 1 122 1 . . . . . 3.135 1.8 4.47 1 1 123 1 . . . . . 3.275 1.8 4.75 1 1 124 1 . . . . . 3.965 1.8 6.13 1 1 125 1 . . . . . 4.15 1.8 6.5 1 1 126 1 . . . . . 3.93 1.8 6.06 1 1 127 1 . . . . . 3.215 1.8 4.63 1 1 128 1 . . . . . 4.13 1.8 6.46 1 1 129 1 . . . . . 2.715 1.8 3.63 1 1 130 1 . . . . . 2.785 1.8 3.77 1 1 131 1 . . . . . 2.515 1.8 3.23 1 1 132 1 . . . . . 3.215 1.8 4.63 1 1 133 1 . . . . . 3.415 1.8 5.03 1 1 134 1 . . . . . 3.24 1.8 4.68 1 1 135 1 . . . . . 3.73 1.8 5.66 1 1 136 1 . . . . . 3.4 1.8 5.0 1 1 137 1 . . . . . 3.065 1.8 4.33 1 1 138 1 . . . . . 3.34 1.8 4.88 1 1 139 1 . . . . . 3.11 1.8 4.42 1 1 140 1 . . . . . 3.235 1.8 4.67 1 1 141 1 . . . . . 3.345 1.8 4.89 1 1 142 1 . . . . . 2.89 1.8 3.98 1 1 143 1 . . . . . 2.78 1.8 3.76 1 1 144 1 . . . . . 3.43 1.8 5.06 1 1 145 1 . . . . . 3.105 1.8 4.41 1 1 146 1 . . . . . 2.825 1.8 3.85 1 1 147 1 . . . . . 3.445 1.8 5.09 1 1 148 1 . . . . . 3.22 1.8 4.64 1 1 149 1 . . . . . 3.59 1.8 5.38 1 1 150 1 . . . . . 3.24 1.8 4.68 1 1 151 1 . . . . . 3.59 1.8 5.38 1 1 152 1 . . . . . 3.94 1.8 6.08 1 1 153 1 . . . . . 3.945 1.8 6.09 1 1 154 1 . . . . . 3.07 1.8 4.34 1 1 155 1 . . . . . 3.42 1.8 5.04 1 1 156 1 . . . . . 3.125 1.8 4.45 1 1 157 1 . . . . . 3.76 1.8 5.72 1 1 158 1 . . . . . 3.59 1.8 5.38 1 1 159 1 . . . . . 3.28 1.8 4.76 1 1 160 1 . . . . . 2.82 1.8 3.84 1 1 161 1 . . . . . 2.82 1.8 3.84 1 1 162 1 . . . . . 2.485 1.8 3.17 1 1 163 1 . . . . . 3.52 1.8 5.24 1 1 164 1 . . . . . 2.89 1.8 3.98 1 1 165 1 . . . . . 2.89 1.8 3.98 1 1 166 1 . . . . . 3.195 1.8 4.59 1 1 167 1 . . . . . 3.43 1.8 5.06 1 1 168 1 . . . . . 2.985 1.8 4.17 1 1 169 1 . . . . . 3.07 1.8 4.34 1 1 170 1 . . . . . 2.945 1.8 4.09 1 1 171 1 . . . . . 2.585 1.8 3.37 1 1 172 1 . . . . . 3.345 1.8 4.89 1 1 173 1 . . . . . 3.23 1.8 4.66 1 1 174 1 . . . . . 2.71 1.8 3.62 1 1 175 1 . . . . . 3.035 1.8 4.27 1 1 176 1 . . . . . 2.985 1.8 4.17 1 1 177 1 . . . . . 2.985 1.8 4.17 1 1 178 1 . . . . . 3.405 1.8 5.01 1 1 179 1 . . . . . 3.31 1.8 4.82 1 1 180 1 . . . . . 2.375 1.8 2.95 1 1 181 1 . . . . . 2.145 1.8 2.49 1 1 182 1 . . . . . 2.375 1.8 2.95 1 1 183 1 . . . . . 2.93 1.8 4.06 1 1 184 1 . . . . . 2.965 1.8 4.13 1 1 185 1 . . . . . 2.64 1.8 3.48 1 1 186 1 . . . . . 2.57 1.8 3.34 1 1 187 1 . . . . . 3.295 1.8 4.79 1 1 188 1 . . . . . 2.725 1.8 3.65 1 1 189 1 . . . . . 3.245 1.8 4.69 1 1 190 1 . . . . . 2.515 1.8 3.23 1 1 191 1 . . . . . 3.43 1.8 5.06 1 1 192 1 . . . . . 3.055 1.8 4.31 1 1 193 1 . . . . . 3.43 1.8 5.06 1 1 194 1 . . . . . 2.465 1.8 3.13 1 1 195 1 . . . . . 3.2 1.8 4.6 1 1 196 1 . . . . . 2.795 1.8 3.79 1 1 197 1 . . . . . 3.51 1.8 5.22 1 1 198 1 . . . . . 2.52 1.8 3.24 1 1 199 1 . . . . . 3.02 1.8 4.24 1 1 200 1 . . . . . 2.73 1.8 3.66 1 1 201 1 . . . . . 3.02 1.8 4.24 1 1 202 1 . . . . . 2.85 1.8 3.9 1 1 203 1 . . . . . 2.975 1.8 4.15 1 1 204 1 . . . . . 2.89 1.8 3.98 1 1 205 1 . . . . . 3.675 1.8 5.55 1 1 206 1 . . . . . 3.205 1.8 4.61 1 1 207 1 . . . . . 2.68 1.8 3.56 1 1 208 1 . . . . . 2.865 1.8 3.93 1 1 209 1 . . . . . 3.075 1.8 4.35 1 1 210 1 . . . . . 3.2 1.8 4.6 1 1 211 1 . . . . . 2.84 1.8 3.88 1 1 212 1 . . . . . 3.185 1.8 4.57 1 1 213 1 . . . . . 3.63 1.8 5.46 1 1 214 1 . . . . . 3.105 1.8 4.41 1 1 215 1 . . . . . 2.995 1.8 4.19 1 1 216 1 . . . . . 3.26 1.8 4.72 1 1 217 1 . . . . . 2.915 1.8 4.03 1 1 218 1 . . . . . 3.26 1.8 4.72 1 1 219 1 . . . . . 3.755 1.8 5.71 1 1 220 1 . . . . . 2.88 1.8 3.96 1 1 221 1 . . . . . 2.635 1.8 3.47 1 1 222 1 . . . . . 2.88 1.8 3.96 1 1 223 1 . . . . . 3.165 1.8 4.53 1 1 224 1 . . . . . 2.35 1.8 2.9 1 1 225 1 . . . . . 3.36 1.8 4.92 1 1 226 1 . . . . . 2.71 1.8 3.62 1 1 227 1 . . . . . 3.24 1.8 4.68 1 1 228 1 . . . . . 3.505 1.8 5.21 1 1 229 1 . . . . . 2.7 1.8 3.6 1 1 230 1 . . . . . 2.765 1.8 3.73 1 1 231 1 . . . . . 3.03 1.8 4.26 1 1 232 1 . . . . . 3.03 1.8 4.26 1 1 233 1 . . . . . 3.47 1.8 5.14 1 1 234 1 . . . . . 2.51 1.8 3.22 1 1 235 1 . . . . . 3.355 1.8 4.91 1 1 236 1 . . . . . 3.12 1.8 4.44 1 1 237 1 . . . . . 3.705 1.8 5.61 1 1 238 1 . . . . . 3.68 1.8 5.56 1 1 239 1 . . . . . 2.685 1.8 3.57 1 1 240 1 . . . . . 3.765 1.8 5.73 1 1 241 1 . . . . . 2.325 1.8 2.85 1 1 242 1 . . . . . 2.235 1.8 2.67 1 1 243 1 . . . . . 2.56 1.8 3.32 1 1 244 1 . . . . . 3.295 1.8 4.79 1 1 245 1 . . . . . 2.455 1.8 3.11 1 1 246 1 . . . . . 2.795 1.8 3.79 1 1 247 1 . . . . . 2.54 1.8 3.28 1 1 248 1 . . . . . 2.795 1.8 3.79 1 1 249 1 . . . . . 3.225 1.8 4.65 1 1 250 1 . . . . . 3.795 1.8 5.79 1 1 251 1 . . . . . 2.74 1.8 3.68 1 1 252 1 . . . . . 2.345 1.8 2.89 1 1 253 1 . . . . . 3.52 1.8 5.24 1 1 254 1 . . . . . 3.36 1.8 4.92 1 1 255 1 . . . . . 3.715 1.8 5.63 1 1 256 1 . . . . . 2.795 1.8 3.79 1 1 257 1 . . . . . 3.445 1.8 5.09 1 1 258 1 . . . . . 2.735 1.8 3.67 1 1 259 1 . . . . . 2.535 1.8 3.27 1 1 260 1 . . . . . 3.785 1.8 5.77 1 1 261 1 . . . . . 2.965 1.8 4.13 1 1 262 1 . . . . . 3.575 1.8 5.35 1 1 263 1 . . . . . 3.77 1.8 5.74 1 1 264 1 . . . . . 2.935 1.8 4.07 1 1 265 1 . . . . . 3.23 1.8 4.66 1 1 266 1 . . . . . 2.855 1.8 3.91 1 1 267 1 . . . . . 3.65 1.8 5.5 1 1 268 1 . . . . . 3.29 1.8 4.78 1 1 269 1 . . . . . 3.29 1.8 4.78 1 1 270 1 . . . . . 2.6 1.8 3.4 1 1 271 1 . . . . . 2.535 1.8 3.27 1 1 272 1 . . . . . 3.2 1.8 4.6 1 1 273 1 . . . . . 3.68 1.8 5.56 1 1 274 1 . . . . . 4.15 1.8 6.5 1 1 275 1 . . . . . 3.6 1.8 5.4 1 1 276 1 . . . . . 2.91 1.8 4.02 1 1 277 1 . . . . . 2.715 1.8 3.63 1 1 278 1 . . . . . 3.235 1.8 4.67 1 1 279 1 . . . . . 3.22 1.8 4.64 1 1 280 1 . . . . . 2.35 1.8 2.9 1 1 281 1 . . . . . 3.08 1.8 4.36 1 1 282 1 . . . . . 2.88 1.8 3.96 1 1 283 1 . . . . . 2.875 1.8 3.95 1 1 284 1 . . . . . 3.135 1.8 4.47 1 1 285 1 . . . . . 3.865 1.8 5.93 1 1 286 1 . . . . . 2.975 1.8 4.15 1 1 287 1 . . . . . 2.955 1.8 4.11 1 1 288 1 . . . . . 3.79 1.8 5.78 1 1 289 1 . . . . . 3.035 1.8 4.27 1 1 290 1 . . . . . 3.19 1.8 4.58 1 1 291 1 . . . . . 3.485 1.8 5.17 1 1 292 1 . . . . . 3.475 1.8 5.15 1 1 293 1 . . . . . 2.695 1.8 3.59 1 1 294 1 . . . . . 3.33 1.8 4.86 1 1 295 1 . . . . . 2.75 1.8 3.7 1 1 296 1 . . . . . 2.575 1.8 3.35 1 1 297 1 . . . . . 2.87 1.8 3.94 1 1 298 1 . . . . . 3.775 1.8 5.75 1 1 299 1 . . . . . 3.4 1.8 5.0 1 1 300 1 . . . . . 3.15 1.8 4.5 1 1 301 1 . . . . . 2.5 1.8 3.2 1 1 302 1 . . . . . 3.08 1.8 4.36 1 1 303 1 . . . . . 3.02 1.8 4.24 1 1 304 1 . . . . . 3.19 1.8 4.58 1 1 305 1 . . . . . 3.205 1.8 4.61 1 1 306 1 . . . . . 2.495 1.8 3.19 1 1 307 1 . . . . . 3.34 1.8 4.88 1 1 308 1 . . . . . 3.725 1.8 5.65 1 1 309 1 . . . . . 3.435 1.8 5.07 1 1 310 1 . . . . . 3.27 1.8 4.74 1 1 311 1 . . . . . 3.03 1.8 4.26 1 1 312 1 . . . . . 2.94 1.8 4.08 1 1 313 1 . . . . . 2.695 1.8 3.59 1 1 314 1 . . . . . 3.57 1.8 5.34 1 1 315 1 . . . . . 3.165 1.8 4.53 1 1 316 1 . . . . . 3.165 1.8 4.53 1 1 317 1 . . . . . 3.825 1.8 5.85 1 1 318 1 . . . . . 3.985 1.8 6.17 1 1 319 1 . . . . . 3.625 1.8 5.45 1 1 320 1 . . . . . 3.015 1.8 4.23 1 1 321 1 . . . . . 3.04 1.8 4.28 1 1 322 1 . . . . . 3.42 1.8 5.04 1 1 323 1 . . . . . 3.0 1.8 4.2 1 1 324 1 . . . . . 3.01 1.8 4.22 1 1 325 1 . . . . . 3.205 1.8 4.61 1 1 326 1 . . . . . 3.12 1.8 4.44 1 1 327 1 . . . . . 3.56 1.8 5.32 1 1 328 1 . . . . . 4.005 1.8 6.21 1 1 329 1 . . . . . 2.81 1.8 3.82 1 1 330 1 . . . . . 2.885 1.8 3.97 1 1 331 1 . . . . . 2.82 1.8 3.84 1 1 332 1 . . . . . 2.355 1.8 2.91 1 1 333 1 . . . . . 2.62 1.8 3.44 1 1 334 1 . . . . . 3.155 1.8 4.51 1 1 335 1 . . . . . 3.865 1.8 5.93 1 1 336 1 . . . . . 3.05 1.8 4.3 1 1 337 1 . . . . . 3.055 1.8 4.31 1 1 338 1 . . . . . 2.605 1.8 3.41 1 1 339 1 . . . . . 3.75 1.8 5.7 1 1 340 1 . . . . . 3.36 1.8 4.92 1 1 341 1 . . . . . 3.755 1.8 5.71 1 1 342 1 . . . . . 3.78 1.8 5.76 1 1 343 1 . . . . . 2.39 1.8 2.98 1 1 344 1 . . . . . 3.495 1.8 5.19 1 1 345 1 . . . . . 2.6 1.8 3.4 1 1 346 1 . . . . . 2.295 1.8 2.79 1 1 347 1 . . . . . 3.435 1.8 5.07 1 1 348 1 . . . . . 3.19 1.8 4.58 1 1 349 1 . . . . . 2.965 1.8 4.13 1 1 350 1 . . . . . 3.59 1.8 5.38 1 1 351 1 . . . . . 2.395 1.8 2.99 1 1 352 1 . . . . . 3.215 1.8 4.63 1 1 353 1 . . . . . 3.275 1.8 4.75 1 1 354 1 . . . . . 2.865 1.8 3.93 1 1 355 1 . . . . . 2.605 1.8 3.41 1 1 356 1 . . . . . 2.865 1.8 3.93 1 1 357 1 . . . . . 2.395 1.8 2.99 1 1 358 1 . . . . . 2.97 1.8 4.14 1 1 359 1 . . . . . 2.775 1.8 3.75 1 1 360 1 . . . . . 2.825 1.8 3.85 1 1 361 1 . . . . . 3.265 1.8 4.73 1 1 362 1 . . . . . 3.665 1.8 5.53 1 1 363 1 . . . . . 3.465 1.8 5.13 1 1 364 1 . . . . . 3.005 1.8 4.21 1 1 365 1 . . . . . 2.915 1.8 4.03 1 1 366 1 . . . . . 3.19 1.8 4.58 1 1 367 1 . . . . . 3.4 1.8 5.0 1 1 368 1 . . . . . 3.01 1.8 4.22 1 1 369 1 . . . . . 2.725 1.8 3.65 1 1 370 1 . . . . . 3.01 1.8 4.22 1 1 371 1 . . . . . 2.71 1.8 3.62 1 1 372 1 . . . . . 2.81 1.8 3.82 1 1 373 1 . . . . . 3.145 1.8 4.49 1 1 374 1 . . . . . 2.755 1.8 3.71 1 1 375 1 . . . . . 2.515 1.8 3.23 1 1 376 1 . . . . . 3.225 1.8 4.65 1 1 377 1 . . . . . 2.55 1.8 3.3 1 1 378 1 . . . . . 2.81 1.8 3.82 1 1 379 1 . . . . . 2.295 1.8 2.79 1 1 380 1 . . . . . 3.19 1.8 4.58 1 1 381 1 . . . . . 3.735 1.8 5.67 1 1 382 1 . . . . . 3.58 1.8 5.36 1 1 383 1 . . . . . 3.74 1.8 5.68 1 1 384 1 . . . . . 3.405 1.8 5.01 1 1 385 1 . . . . . 2.48 1.8 3.16 1 1 386 1 . . . . . 3.66 1.8 5.52 1 1 387 1 . . . . . 2.9 1.8 4.0 1 1 388 1 . . . . . 2.56 1.8 3.32 1 1 389 1 . . . . . 2.715 1.8 3.63 1 1 390 1 . . . . . 3.275 1.8 4.75 1 1 391 1 . . . . . 3.87 1.8 5.94 1 1 392 1 . . . . . 3.74 1.8 5.68 1 1 393 1 . . . . . 3.675 1.8 5.11 1 1 394 1 . . . . . 2.83 1.8 3.86 1 1 395 1 . . . . . 3.225 1.8 4.65 1 1 396 1 . . . . . 2.57 1.8 3.34 1 1 397 1 . . . . . 2.7 1.8 3.6 1 1 398 1 . . . . . 2.935 1.8 4.07 1 1 399 1 . . . . . 2.92 1.8 4.04 1 1 400 1 . . . . . 3.07 1.8 4.34 1 1 401 1 . . . . . 3.845 1.8 5.89 1 1 402 1 . . . . . 3.0 1.8 4.2 1 1 403 1 . . . . . 3.52 1.8 5.24 1 1 404 1 . . . . . 2.38 1.8 2.96 1 1 405 1 . . . . . 2.58 1.8 3.36 1 1 406 1 . . . . . 2.77 1.8 3.74 1 1 407 1 . . . . . 2.615 1.8 3.43 1 1 408 1 . . . . . 2.69 1.8 3.58 1 1 409 1 . . . . . 3.285 1.8 4.77 1 1 410 1 . . . . . 3.135 1.8 4.47 1 1 411 1 . . . . . 4.02 1.8 6.24 1 1 412 1 . . . . . 2.765 1.8 3.73 1 1 413 1 . . . . . 2.91 1.8 4.02 1 1 414 1 . . . . . 3.24 1.8 4.68 1 1 415 1 . . . . . 3.405 1.8 5.01 1 1 416 1 . . . . . 3.675 1.8 5.55 1 1 417 1 . . . . . 2.89 1.8 3.98 1 1 418 1 . . . . . 2.475 1.8 3.15 1 1 419 1 . . . . . 3.735 1.8 5.67 1 1 420 1 . . . . . 3.18 1.8 4.56 1 1 421 1 . . . . . 4.11 1.8 6.42 1 1 422 1 . . . . . 3.26 1.8 4.72 1 1 423 1 . . . . . 2.865 1.8 3.93 1 1 424 1 . . . . . 2.845 1.8 3.89 1 1 425 1 . . . . . 3.31 1.8 4.82 1 1 426 1 . . . . . 3.19 1.8 4.58 1 1 427 1 . . . . . 2.61 1.8 3.42 1 1 428 1 . . . . . 2.515 1.8 3.23 1 1 429 1 . . . . . 3.17 1.8 4.54 1 1 430 1 . . . . . 3.795 1.8 4.73 1 1 431 1 . . . . . 3.355 1.8 4.91 1 1 432 1 . . . . . 3.1 1.8 4.4 1 1 433 1 . . . . . 3.515 1.8 5.23 1 1 434 1 . . . . . 2.88 1.8 3.96 1 1 435 1 . . . . . 3.315 1.8 4.83 1 1 436 1 . . . . . 3.235 1.8 4.67 1 1 437 1 . . . . . 3.01 1.8 4.22 1 1 438 1 . . . . . 3.59 1.8 5.38 1 1 439 1 . . . . . 3.35 1.8 4.9 1 1 440 1 . . . . . 2.91 1.8 4.02 1 1 441 1 . . . . . 2.99 1.8 4.18 1 1 442 1 . . . . . 3.635 1.8 5.47 1 1 443 1 . . . . . 2.535 1.8 3.27 1 1 444 1 . . . . . 2.585 1.8 3.37 1 1 445 1 . . . . . 3.26 1.8 4.72 1 1 446 1 . . . . . 3.33 1.8 4.86 1 1 447 1 . . . . . 3.965 1.8 6.13 1 1 448 1 . . . . . 3.095 1.8 4.39 1 1 449 1 . . . . . 3.19 1.8 4.58 1 1 450 1 . . . . . 3.255 1.8 4.71 1 1 451 1 . . . . . 3.795 1.8 5.79 1 1 452 1 . . . . . 3.165 1.8 4.53 1 1 453 1 . . . . . 3.49 1.8 5.18 1 1 454 1 . . . . . 3.445 1.8 5.09 1 1 455 1 . . . . . 3.135 1.8 4.47 1 1 456 1 . . . . . 3.14 1.8 4.48 1 1 457 1 . . . . . 3.135 1.8 4.47 1 1 458 1 . . . . . 3.14 1.8 4.48 1 1 459 1 . . . . . 2.5 1.8 3.2 1 1 460 1 . . . . . 2.595 1.8 3.39 1 1 461 1 . . . . . 3.485 1.8 5.17 1 1 462 1 . . . . . 3.095 1.8 4.39 1 1 463 1 . . . . . 2.525 1.8 3.25 1 1 464 1 . . . . . 3.06 1.8 4.32 1 1 465 1 . . . . . 3.13 1.8 4.46 1 1 466 1 . . . . . 3.005 1.8 4.21 1 1 467 1 . . . . . 3.14 1.8 4.48 1 1 468 1 . . . . . 3.54 1.8 5.28 1 1 469 1 . . . . . 3.305 1.8 4.81 1 1 470 1 . . . . . 3.26 1.8 4.72 1 1 471 1 . . . . . 3.73 1.8 5.66 1 1 472 1 . . . . . 3.81 1.8 5.82 1 1 473 1 . . . . . 2.845 1.8 3.89 1 1 474 1 . . . . . 2.86 1.8 3.92 1 1 475 1 . . . . . 2.915 1.8 4.03 1 1 476 1 . . . . . 2.49 1.8 3.18 1 1 477 1 . . . . . 3.31 1.8 4.82 1 1 478 1 . . . . . 2.855 1.8 3.91 1 1 479 1 . . . . . 3.435 1.8 5.07 1 1 480 1 . . . . . 2.86 1.8 3.92 1 1 481 1 . . . . . 3.19 1.8 4.58 1 1 482 1 . . . . . 2.755 1.8 3.71 1 1 483 1 . . . . . 2.465 1.8 3.13 1 1 484 1 . . . . . 3.575 1.8 5.35 1 1 485 1 . . . . . 3.75 1.8 5.7 1 1 486 1 . . . . . 2.91 1.8 4.02 1 1 487 1 . . . . . 2.915 1.8 4.03 1 1 488 1 . . . . . 3.735 1.8 5.67 1 1 489 1 . . . . . 2.915 1.8 4.03 1 1 490 1 . . . . . 3.265 1.8 4.73 1 1 491 1 . . . . . 3.43 1.8 5.06 1 1 492 1 . . . . . 3.085 1.8 4.37 1 1 493 1 . . . . . 2.89 1.8 3.98 1 1 494 1 . . . . . 3.7 1.8 5.6 1 1 495 1 . . . . . 3.56 1.8 5.32 1 1 496 1 . . . . . 2.705 1.8 3.61 1 1 497 1 . . . . . 2.57 1.8 3.34 1 1 498 1 . . . . . 2.58 1.8 3.36 1 1 499 1 . . . . . 4.07 1.8 6.34 1 1 500 1 . . . . . 3.17 1.8 4.54 1 1 501 1 . . . . . 3.125 1.8 4.45 1 1 502 1 . . . . . 3.385 1.8 4.97 1 1 503 1 . . . . . 3.035 1.8 4.27 1 1 504 1 . . . . . 3.33 1.8 4.86 1 1 505 1 . . . . . 3.455 1.8 5.11 1 1 506 1 . . . . . 3.29 1.8 4.78 1 1 507 1 . . . . . 2.55 1.8 3.3 1 1 508 1 . . . . . 2.3 1.8 2.8 1 1 509 1 . . . . . 2.54 1.8 3.28 1 1 510 1 . . . . . 3.24 1.8 4.68 1 1 511 1 . . . . . 3.36 1.8 4.92 1 1 512 1 . . . . . 3.32 1.8 4.84 1 1 513 1 . . . . . 2.905 1.8 4.01 1 1 514 1 . . . . . 3.19 1.8 4.58 1 1 515 1 . . . . . 3.195 1.8 4.59 1 1 516 1 . . . . . 2.425 1.8 3.05 1 1 517 1 . . . . . 2.465 1.8 3.13 1 1 518 1 . . . . . 3.45 1.8 5.1 1 1 519 1 . . . . . 2.925 1.8 4.05 1 1 520 1 . . . . . 3.38 1.8 4.96 1 1 521 1 . . . . . 2.995 1.8 4.19 1 1 522 1 . . . . . 2.785 1.8 3.77 1 1 523 1 . . . . . 3.12 1.8 4.44 1 1 524 1 . . . . . 2.995 1.8 4.19 1 1 525 1 . . . . . 2.27 1.8 2.74 1 1 526 1 . . . . . 3.245 1.8 4.69 1 1 527 1 . . . . . 3.37 1.8 4.94 1 1 528 1 . . . . . 3.045 1.8 4.29 1 1 529 1 . . . . . 3.37 1.8 4.94 1 1 530 1 . . . . . 3.935 1.8 6.07 1 1 531 1 . . . . . 3.655 1.8 5.51 1 1 532 1 . . . . . 2.95 1.8 4.1 1 1 533 1 . . . . . 2.87 1.8 3.94 1 1 534 1 . . . . . 2.535 1.8 3.27 1 1 535 1 . . . . . 2.87 1.8 3.94 1 1 536 1 . . . . . 2.73 1.8 3.66 1 1 537 1 . . . . . 3.3 1.8 4.8 1 1 538 1 . . . . . 2.99 1.8 4.18 1 1 539 1 . . . . . 2.865 1.8 3.93 1 1 540 1 . . . . . 2.415 1.8 3.03 1 1 541 1 . . . . . 2.58 1.8 3.36 1 1 542 1 . . . . . 3.545 1.8 5.29 1 1 543 1 . . . . . 3.635 1.8 5.47 1 1 544 1 . . . . . 3.62 1.8 5.44 1 1 545 1 . . . . . 3.62 1.8 5.44 1 1 546 1 . . . . . 2.75 1.8 3.7 1 1 547 1 . . . . . 2.5 1.8 3.2 1 1 548 1 . . . . . 2.75 1.8 3.7 1 1 549 1 . . . . . 3.47 1.8 5.14 1 1 550 1 . . . . . 2.545 1.8 3.29 1 1 551 1 . . . . . 3.375 1.8 4.95 1 1 552 1 . . . . . 3.685 1.8 5.57 1 1 553 1 . . . . . 2.975 1.8 4.15 1 1 554 1 . . . . . 3.33 1.8 4.86 1 1 555 1 . . . . . 3.26 1.8 4.72 1 1 556 1 . . . . . 2.585 1.8 3.37 1 1 557 1 . . . . . 3.34 1.8 4.88 1 1 558 1 . . . . . 3.42 1.8 5.04 1 1 559 1 . . . . . 2.86 1.8 3.92 1 1 560 1 . . . . . 3.84 1.8 5.88 1 1 561 1 . . . . . 2.86 1.8 3.92 1 1 562 1 . . . . . 3.84 1.8 5.88 1 1 563 1 . . . . . 2.915 1.8 4.03 1 1 564 1 . . . . . 3.31 1.8 4.82 1 1 565 1 . . . . . 3.5 1.8 5.2 1 1 566 1 . . . . . 3.91 1.8 6.02 1 1 567 1 . . . . . 2.41 1.8 3.02 1 1 568 1 . . . . . 2.51 1.8 3.22 1 1 569 1 . . . . . 2.54 1.8 3.28 1 1 570 1 . . . . . 2.55 1.8 3.3 1 1 571 1 . . . . . 3.37 1.8 4.94 1 1 572 1 . . . . . 3.485 1.8 5.17 1 1 573 1 . . . . . 2.975 1.8 4.15 1 1 574 1 . . . . . 2.93 1.8 4.06 1 1 575 1 . . . . . 3.545 1.8 5.29 1 1 576 1 . . . . . 3.935 1.8 6.07 1 1 577 1 . . . . . 2.405 1.8 3.01 1 1 578 1 . . . . . 2.44 1.8 3.08 1 1 579 1 . . . . . 3.58 1.8 5.36 1 1 580 1 . . . . . 4.02 1.8 6.24 1 1 581 1 . . . . . 3.55 1.8 5.3 1 1 582 1 . . . . . 3.455 1.8 5.11 1 1 583 1 . . . . . 3.17 1.8 4.54 1 1 584 1 . . . . . 2.62 1.8 3.44 1 1 585 1 . . . . . 3.05 1.8 4.3 1 1 586 1 . . . . . 3.165 1.8 4.53 1 1 587 1 . . . . . 3.165 1.8 4.53 1 1 588 1 . . . . . 3.04 1.8 4.28 1 1 589 1 . . . . . 2.96 1.8 4.12 1 1 590 1 . . . . . 2.82 1.8 3.84 1 1 591 1 . . . . . 2.945 1.8 4.09 1 1 592 1 . . . . . 2.69 1.8 3.58 1 1 593 1 . . . . . 3.435 1.8 5.07 1 1 594 1 . . . . . 2.705 1.8 3.61 1 1 595 1 . . . . . 3.19 1.8 4.58 1 1 596 1 . . . . . 3.31 1.8 4.82 1 1 597 1 . . . . . 3.54 1.8 5.28 1 1 598 1 . . . . . 3.355 1.8 4.91 1 1 599 1 . . . . . 3.05 1.8 4.3 1 1 600 1 . . . . . 3.355 1.8 4.91 1 1 601 1 . . . . . 3.715 1.8 5.63 1 1 602 1 . . . . . 3.965 1.8 6.13 1 1 603 1 . . . . . 3.735 1.8 5.67 1 1 604 1 . . . . . 3.68 1.8 5.56 1 1 605 1 . . . . . 3.31 1.8 4.82 1 1 606 1 . . . . . 3.015 1.8 4.23 1 1 607 1 . . . . . 3.31 1.8 4.82 1 1 608 1 . . . . . 3.455 1.8 5.11 1 1 609 1 . . . . . 3.2 1.8 4.6 1 1 610 1 . . . . . 2.565 1.8 3.33 1 1 611 1 . . . . . 2.94 1.8 4.08 1 1 612 1 . . . . . 3.175 1.8 4.55 1 1 613 1 . . . . . 3.475 1.8 5.15 1 1 614 1 . . . . . 3.355 1.8 4.91 1 1 615 1 . . . . . 3.145 1.8 4.49 1 1 616 1 . . . . . 3.145 1.8 4.49 1 1 617 1 . . . . . 4.035 1.8 6.27 1 1 618 1 . . . . . 3.72 1.8 5.64 1 1 619 1 . . . . . 3.1 1.8 4.4 1 1 620 1 . . . . . 3.425 1.8 5.05 1 1 621 1 . . . . . 3.015 1.8 4.23 1 1 622 1 . . . . . 2.28 1.8 2.76 1 1 623 1 . . . . . 2.765 1.8 3.73 1 1 624 1 . . . . . 3.28 1.8 4.76 1 1 625 1 . . . . . 2.66 1.8 3.52 1 1 626 1 . . . . . 2.595 1.8 3.39 1 1 627 1 . . . . . 3.585 1.8 5.37 1 1 628 1 . . . . . 3.115 1.8 4.43 1 1 629 1 . . . . . 3.09 1.8 4.38 1 1 630 1 . . . . . 3.43 1.8 5.06 1 1 631 1 . . . . . 3.625 1.8 5.45 1 1 632 1 . . . . . 3.19 1.8 4.58 1 1 633 1 . . . . . 3.3 1.8 4.8 1 1 634 1 . . . . . 2.63 1.8 3.46 1 1 635 1 . . . . . 3.405 1.8 5.01 1 1 636 1 . . . . . 3.11 1.8 4.42 1 1 637 1 . . . . . 2.635 1.8 3.47 1 1 638 1 . . . . . 2.71 1.8 3.62 1 1 639 1 . . . . . 2.8 1.8 3.8 1 1 640 1 . . . . . 3.955 1.8 6.11 1 1 641 1 . . . . . 3.415 1.8 5.03 1 1 642 1 . . . . . 2.65 1.8 3.5 1 1 643 1 . . . . . 3.545 1.8 5.29 1 1 644 1 . . . . . 3.325 1.8 4.85 1 1 645 1 . . . . . 3.75 1.8 5.7 1 1 646 1 . . . . . 2.925 1.8 4.05 1 1 647 1 . . . . . 4.15 1.8 6.5 1 1 648 1 . . . . . 2.35 1.8 2.9 1 1 649 1 . . . . . 2.9 1.8 4.0 1 1 650 1 . . . . . 3.12 1.8 4.44 1 1 651 1 . . . . . 3.715 1.8 5.63 1 1 652 1 . . . . . 3.035 1.8 4.27 1 1 653 1 . . . . . 2.35 1.8 2.9 1 1 654 1 . . . . . 2.795 1.8 3.79 1 1 655 1 . . . . . 2.36 1.8 2.92 1 1 656 1 . . . . . 3.33 1.8 4.86 1 1 657 1 . . . . . 3.245 1.8 4.69 1 1 658 1 . . . . . 2.93 1.8 4.06 1 1 659 1 . . . . . 3.245 1.8 4.69 1 1 660 1 . . . . . 2.94 1.8 4.08 1 1 661 1 . . . . . 3.425 1.8 5.05 1 1 662 1 . . . . . 2.925 1.8 4.05 1 1 663 1 . . . . . 2.51 1.8 3.22 1 1 664 1 . . . . . 2.56 1.8 3.32 1 1 665 1 . . . . . 3.365 1.8 4.93 1 1 666 1 . . . . . 3.345 1.8 4.89 1 1 667 1 . . . . . 2.915 1.8 4.03 1 1 668 1 . . . . . 3.355 1.8 4.91 1 1 669 1 . . . . . 2.565 1.8 3.33 1 1 670 1 . . . . . 2.565 1.8 3.33 1 1 671 1 . . . . . 3.615 1.8 5.43 1 1 672 1 . . . . . 2.64 1.8 3.48 1 1 673 1 . . . . . 4.02 1.8 6.24 1 1 674 1 . . . . . 3.82 1.8 5.84 1 1 675 1 . . . . . 4.115 1.8 6.43 1 1 676 1 . . . . . 3.28 1.8 4.76 1 1 677 1 . . . . . 3.325 1.8 4.85 1 1 678 1 . . . . . 3.55 1.8 5.3 1 1 679 1 . . . . . 4.04 1.8 6.28 1 1 680 1 . . . . . 3.3 1.8 4.8 1 1 681 1 . . . . . 2.95 1.8 4.1 1 1 682 1 . . . . . 3.09 1.8 4.38 1 1 683 1 . . . . . 3.0 1.8 4.2 1 1 684 1 . . . . . 3.14 1.8 4.48 1 1 685 1 . . . . . 2.665 1.8 3.53 1 1 686 1 . . . . . 3.33 1.8 4.86 1 1 687 1 . . . . . 2.645 1.8 3.49 1 1 688 1 . . . . . 2.615 1.8 3.43 1 1 689 1 . . . . . 2.9 1.8 4.0 1 1 690 1 . . . . . 2.9 1.8 4.0 1 1 691 1 . . . . . 2.605 1.8 3.41 1 1 692 1 . . . . . 2.435 1.8 3.07 1 1 693 1 . . . . . 3.18 1.8 4.56 1 1 694 1 . . . . . 3.41 1.8 5.02 1 1 695 1 . . . . . 3.045 1.8 4.29 1 1 696 1 . . . . . 2.53 1.8 3.26 1 1 697 1 . . . . . 3.07 1.8 4.34 1 1 698 1 . . . . . 3.61 1.8 5.42 1 1 699 1 . . . . . 2.575 1.8 3.35 1 1 700 1 . . . . . 2.9 1.8 4.0 1 1 701 1 . . . . . 2.87 1.8 3.94 1 1 702 1 . . . . . 3.025 1.8 4.25 1 1 703 1 . . . . . 3.43 1.8 5.06 1 1 704 1 . . . . . 3.32 1.8 4.84 1 1 705 1 . . . . . 2.88 1.8 3.96 1 1 706 1 . . . . . 2.965 1.8 4.13 1 1 707 1 . . . . . 2.94 1.8 4.08 1 1 708 1 . . . . . 3.05 1.8 4.3 1 1 709 1 . . . . . 3.31 1.8 4.82 1 1 710 1 . . . . . 3.405 1.8 5.01 1 1 711 1 . . . . . 3.31 1.8 4.82 1 1 712 1 . . . . . 3.405 1.8 5.01 1 1 713 1 . . . . . 2.665 1.8 3.53 1 1 714 1 . . . . . 2.91 1.8 4.02 1 1 715 1 . . . . . 3.115 1.8 4.43 1 1 716 1 . . . . . 3.445 1.8 5.09 1 1 717 1 . . . . . 3.02 1.8 4.24 1 1 718 1 . . . . . 3.16 1.8 4.52 1 1 719 1 . . . . . 3.565 1.8 5.33 1 1 720 1 . . . . . 3.445 1.8 5.09 1 1 721 1 . . . . . 2.995 1.8 4.19 1 1 722 1 . . . . . 2.7 1.8 3.6 1 1 723 1 . . . . . 2.995 1.8 4.19 1 1 724 1 . . . . . 3.09 1.8 4.38 1 1 725 1 . . . . . 2.73 1.8 3.66 1 1 726 1 . . . . . 3.995 1.8 6.19 1 1 727 1 . . . . . 3.39 1.8 4.98 1 1 728 1 . . . . . 3.45 1.8 5.1 1 1 729 1 . . . . . 3.165 1.8 4.53 1 1 730 1 . . . . . 2.51 1.8 3.22 1 1 731 1 . . . . . 2.75 1.8 3.7 1 1 732 1 . . . . . 2.86 1.8 3.92 1 1 733 1 . . . . . 3.05 1.8 4.3 1 1 734 1 . . . . . 3.11 1.8 4.42 1 1 735 1 . . . . . 2.86 1.8 3.92 1 1 736 1 . . . . . 3.05 1.8 4.3 1 1 737 1 . . . . . 3.11 1.8 4.42 1 1 738 1 . . . . . 4.15 1.8 6.5 1 1 739 1 . . . . . 2.895 1.8 3.99 1 1 740 1 . . . . . 3.39 1.8 4.98 1 1 741 1 . . . . . 3.79 1.8 5.78 1 1 742 1 . . . . . 3.11 1.8 4.42 1 1 743 1 . . . . . 2.75 1.8 3.7 1 1 744 1 . . . . . 2.94 1.8 4.08 1 1 745 1 . . . . . 2.87 1.8 3.94 1 1 746 1 . . . . . 2.565 1.8 3.33 1 1 747 1 . . . . . 2.67 1.8 3.54 1 1 748 1 . . . . . 2.31 1.8 2.82 1 1 749 1 . . . . . 3.375 1.8 4.95 1 1 750 1 . . . . . 3.06 1.8 4.32 1 1 751 1 . . . . . 2.395 1.8 2.99 1 1 752 1 . . . . . 2.62 1.8 3.44 1 1 753 1 . . . . . 2.5 1.8 3.2 1 1 754 1 . . . . . 2.375 1.8 2.95 1 1 755 1 . . . . . 3.355 1.8 4.91 1 1 756 1 . . . . . 2.925 1.8 4.05 1 1 757 1 . . . . . 3.245 1.8 4.69 1 1 758 1 . . . . . 3.495 1.8 5.19 1 1 759 1 . . . . . 3.665 1.8 5.53 1 1 760 1 . . . . . 3.46 1.8 5.12 1 1 761 1 . . . . . 2.85 1.8 3.9 1 1 762 1 . . . . . 3.245 1.8 4.69 1 1 763 1 . . . . . 2.895 1.8 3.99 1 1 764 1 . . . . . 3.245 1.8 4.69 1 1 765 1 . . . . . 3.245 1.8 4.69 1 1 766 1 . . . . . 3.21 1.8 4.62 1 1 767 1 . . . . . 3.57 1.8 5.34 1 1 768 1 . . . . . 2.53 1.8 3.26 1 1 769 1 . . . . . 2.495 1.8 3.19 1 1 770 1 . . . . . 3.18 1.8 4.56 1 1 771 1 . . . . . 4.15 1.8 6.5 1 1 772 1 . . . . . 2.405 1.8 3.01 1 1 773 1 . . . . . 3.155 1.8 4.51 1 1 774 1 . . . . . 3.505 1.8 5.21 1 1 775 1 . . . . . 3.15 1.8 4.5 1 1 776 1 . . . . . 2.945 1.8 4.09 1 1 777 1 . . . . . 3.51 1.8 5.22 1 1 778 1 . . . . . 3.51 1.8 5.22 1 1 779 1 . . . . . 2.19 1.8 2.58 1 1 780 1 . . . . . 2.71 1.8 3.62 1 1 781 1 . . . . . 3.48 1.8 5.16 1 1 782 1 . . . . . 4.035 1.8 6.27 1 1 783 1 . . . . . 3.59 1.8 5.38 1 1 784 1 . . . . . 3.25 1.8 4.7 1 1 785 1 . . . . . 2.56 1.8 3.32 1 1 786 1 . . . . . 3.615 1.8 5.43 1 1 787 1 . . . . . 2.795 1.8 3.79 1 1 788 1 . . . . . 3.205 1.8 4.61 1 1 789 1 . . . . . 2.825 1.8 3.85 1 1 790 1 . . . . . 4.035 1.8 6.27 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 MET C 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU C -108.95 -56.429996 A 500 . C A 501 . N A 501 . CA A 501 . C 1 1 2 . 1 1 4 GLU N 1 1 4 GLU CA 1 1 4 GLU C 1 1 5 GLN N -43.74 -4.58 A 501 . N A 501 . CA A 501 . C A 502 . N 1 1 3 . 1 1 4 GLU C 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C -173.96 -55.56 A 501 . C A 502 . N A 502 . CA A 502 . C 1 1 4 . 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C 1 1 6 SER N 103.86 185.64 A 502 . N A 502 . CA A 502 . C A 503 . N 1 1 5 . 1 1 5 GLN C 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER C -128.48 -85.64 A 502 . C A 503 . N A 503 . CA A 503 . C 1 1 6 . 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER C 1 1 7 CYS N 121.12999 156.05 A 503 . N A 503 . CA A 503 . C A 504 . N 1 1 7 . 1 1 6 SER C 1 1 7 CYS N 1 1 7 CYS CA 1 1 7 CYS C -114.01 -61.689995 A 503 . C A 504 . N A 504 . CA A 504 . C 1 1 8 . 1 1 7 CYS N 1 1 7 CYS CA 1 1 7 CYS C 1 1 8 VAL N 118.27 134.49 A 504 . N A 504 . CA A 504 . C A 505 . N 1 1 9 . 1 1 8 VAL C 1 1 9 ASN N 1 1 9 ASN CA 1 1 9 ASN C -119.24 -77.6 A 505 . C A 506 . N A 506 . CA A 506 . C 1 1 10 . 1 1 9 ASN N 1 1 9 ASN CA 1 1 9 ASN C 1 1 10 CYS N -41.37 -20.21 A 506 . N A 506 . CA A 506 . C A 507 . N 1 1 11 . 1 1 9 ASN C 1 1 10 CYS N 1 1 10 CYS CA 1 1 10 CYS C -162.99 -123.01 A 506 . C A 507 . N A 507 . CA A 507 . C 1 1 12 . 1 1 11 GLY C 1 1 12 ARG N 1 1 12 ARG CA 1 1 12 ARG C -83.88 -54.98 A 508 . C A 509 . N A 509 . CA A 509 . C 1 1 13 . 1 1 12 ARG N 1 1 12 ARG CA 1 1 12 ARG C 1 1 13 GLU N -54.71 -10.65 A 509 . N A 509 . CA A 509 . C A 510 . N 1 1 14 . 1 1 12 ARG C 1 1 13 GLU N 1 1 13 GLU CA 1 1 13 GLU C -102.07 -49.39 A 509 . C A 510 . N A 510 . CA A 510 . C 1 1 15 . 1 1 13 GLU N 1 1 13 GLU CA 1 1 13 GLU C 1 1 14 ALA N -52.88 -4.96 A 510 . N A 510 . CA A 510 . C A 511 . N 1 1 16 . 1 1 15 MET C 1 1 16 SER N 1 1 16 SER CA 1 1 16 SER C -121.31999 -80.08 A 512 . C A 513 . N A 513 . CA A 513 . C 1 1 17 . 1 1 16 SER N 1 1 16 SER CA 1 1 16 SER C 1 1 17 GLU N 122.01999 154.14 A 513 . N A 513 . CA A 513 . C A 514 . N 1 1 18 . 1 1 16 SER C 1 1 17 GLU N 1 1 17 GLU CA 1 1 17 GLU C -143.74 -101.86 A 513 . C A 514 . N A 514 . CA A 514 . C 1 1 19 . 1 1 17 GLU N 1 1 17 GLU CA 1 1 17 GLU C 1 1 18 CYS N 131.09 163.39 A 514 . N A 514 . CA A 514 . C A 515 . N 1 1 20 . 1 1 17 GLU C 1 1 18 CYS N 1 1 18 CYS CA 1 1 18 CYS C -120.78 -71.12 A 514 . C A 515 . N A 515 . CA A 515 . C 1 1 21 . 1 1 18 CYS N 1 1 18 CYS CA 1 1 18 CYS C 1 1 19 THR N 119.2 139.6 A 515 . N A 515 . CA A 515 . C A 516 . N 1 1 22 . 1 1 18 CYS C 1 1 19 THR N 1 1 19 THR CA 1 1 19 THR C -76.77 -45.43 A 515 . C A 516 . N A 516 . CA A 516 . C 1 1 23 . 1 1 19 THR N 1 1 19 THR CA 1 1 19 THR C 1 1 20 GLY N 120.549995 143.87 A 516 . N A 516 . CA A 516 . C A 517 . N 1 1 24 . 1 1 20 GLY C 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS C -144.46 -99.08 A 517 . C A 518 . N A 518 . CA A 518 . C 1 1 25 . 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS C 1 1 22 HIS N 146.91 175.97 A 518 . N A 518 . CA A 518 . C A 519 . N 1 1 26 . 1 1 22 HIS C 1 1 23 LYS N 1 1 23 LYS CA 1 1 23 LYS C -112.27 -87.79 A 519 . C A 520 . N A 520 . CA A 520 . C 1 1 27 . 1 1 23 LYS N 1 1 23 LYS CA 1 1 23 LYS C 1 1 24 VAL N -39.99 9.19 A 520 . N A 520 . CA A 520 . C A 521 . N 1 1 28 . 1 1 23 LYS C 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL C -158.17 -119.85 A 520 . C A 521 . N A 521 . CA A 521 . C 1 1 29 . 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL C 1 1 25 ASN N 135.5 175.8 A 521 . N A 521 . CA A 521 . C A 522 . N 1 1 30 . 1 1 24 VAL C 1 1 25 ASN N 1 1 25 ASN CA 1 1 25 ASN C -155.45 -103.75 A 521 . C A 522 . N A 522 . CA A 522 . C 1 1 31 . 1 1 25 ASN N 1 1 25 ASN CA 1 1 25 ASN C 1 1 26 TYR N 131.11 183.31 A 522 . N A 522 . CA A 522 . C A 523 . N 1 1 32 . 1 1 25 ASN C 1 1 26 TYR N 1 1 26 TYR CA 1 1 26 TYR C -149.71 -112.91 A 522 . C A 523 . N A 523 . CA A 523 . C 1 1 33 . 1 1 26 TYR C 1 1 27 CYS N 1 1 27 CYS CA 1 1 27 CYS C -159.68 -103.0 A 523 . C A 524 . N A 524 . CA A 524 . C 1 1 34 . 1 1 28 SER N 1 1 28 SER CA 1 1 28 SER C 1 1 29 THR N 161.19 171.91 A 525 . N A 525 . CA A 525 . C A 526 . N 1 1 35 . 1 1 28 SER C 1 1 29 THR N 1 1 29 THR CA 1 1 29 THR C -71.01 -53.09 A 525 . C A 526 . N A 526 . CA A 526 . C 1 1 36 . 1 1 29 THR N 1 1 29 THR CA 1 1 29 THR C 1 1 30 PHE N -44.32 -24.22 A 526 . N A 526 . CA A 526 . C A 527 . N 1 1 37 . 1 1 29 THR C 1 1 30 PHE N 1 1 30 PHE CA 1 1 30 PHE C -69.83 -61.95 A 526 . C A 527 . N A 527 . CA A 527 . C 1 1 38 . 1 1 30 PHE N 1 1 30 PHE CA 1 1 30 PHE C 1 1 31 CYS N -47.98 -34.86 A 527 . N A 527 . CA A 527 . C A 528 . N 1 1 39 . 1 1 30 PHE C 1 1 31 CYS N 1 1 31 CYS CA 1 1 31 CYS C -64.29 -56.15 A 527 . C A 528 . N A 528 . CA A 528 . C 1 1 40 . 1 1 31 CYS N 1 1 31 CYS CA 1 1 31 CYS C 1 1 32 GLN N -49.68 -37.26 A 528 . N A 528 . CA A 528 . C A 529 . N 1 1 41 . 1 1 31 CYS C 1 1 32 GLN N 1 1 32 GLN CA 1 1 32 GLN C -64.59 -56.37 A 528 . C A 529 . N A 529 . CA A 529 . C 1 1 42 . 1 1 32 GLN N 1 1 32 GLN CA 1 1 32 GLN C 1 1 33 ARG N -48.06 -38.319996 A 529 . N A 529 . CA A 529 . C A 530 . N 1 1 43 . 1 1 32 GLN C 1 1 33 ARG N 1 1 33 ARG CA 1 1 33 ARG C -69.24 -59.639996 A 529 . C A 530 . N A 530 . CA A 530 . C 1 1 44 . 1 1 33 ARG N 1 1 33 ARG CA 1 1 33 ARG C 1 1 34 LYS N -42.58 -29.68 A 530 . N A 530 . CA A 530 . C A 531 . N 1 1 45 . 1 1 33 ARG C 1 1 34 LYS N 1 1 34 LYS CA 1 1 34 LYS C -73.29 -58.55 A 530 . C A 531 . N A 531 . CA A 531 . C 1 1 46 . 1 1 34 LYS N 1 1 34 LYS CA 1 1 34 LYS C 1 1 35 ASP N -41.319996 -19.6 A 531 . N A 531 . CA A 531 . C A 532 . N 1 1 47 . 1 1 34 LYS C 1 1 35 ASP N 1 1 35 ASP CA 1 1 35 ASP C -111.03 -70.27 A 531 . C A 532 . N A 532 . CA A 532 . C 1 1 48 . 1 1 35 ASP N 1 1 35 ASP CA 1 1 35 ASP C 1 1 36 TRP N -41.34 -1.9000001 A 532 . N A 532 . CA A 532 . C A 533 . N 1 1 49 . 1 1 35 ASP C 1 1 36 TRP N 1 1 36 TRP CA 1 1 36 TRP C -67.3 -55.98 A 532 . C A 533 . N A 533 . CA A 533 . C 1 1 50 . 1 1 36 TRP N 1 1 36 TRP CA 1 1 36 TRP C 1 1 37 LYS N -52.439995 -27.2 A 533 . N A 533 . CA A 533 . C A 534 . N 1 1 51 . 1 1 36 TRP C 1 1 37 LYS N 1 1 37 LYS CA 1 1 37 LYS C -69.01 -54.45 A 533 . C A 534 . N A 534 . CA A 534 . C 1 1 52 . 1 1 37 LYS N 1 1 37 LYS CA 1 1 37 LYS C 1 1 38 ASP N -43.79 -28.23 A 534 . N A 534 . CA A 534 . C A 535 . N 1 1 53 . 1 1 37 LYS C 1 1 38 ASP N 1 1 38 ASP CA 1 1 38 ASP C -91.54 -62.119995 A 534 . C A 535 . N A 535 . CA A 535 . C 1 1 54 . 1 1 38 ASP N 1 1 38 ASP CA 1 1 38 ASP C 1 1 39 HIS N -56.29 -16.91 A 535 . N A 535 . CA A 535 . C A 536 . N 1 1 55 . 1 1 38 ASP C 1 1 39 HIS N 1 1 39 HIS CA 1 1 39 HIS C -67.84 -55.52 A 535 . C A 536 . N A 536 . CA A 536 . C 1 1 56 . 1 1 39 HIS N 1 1 39 HIS CA 1 1 39 HIS C 1 1 40 GLN N -46.49 -33.21 A 536 . N A 536 . CA A 536 . C A 537 . N 1 1 57 . 1 1 39 HIS C 1 1 40 GLN N 1 1 40 GLN CA 1 1 40 GLN C -77.49 -52.07 A 536 . C A 537 . N A 537 . CA A 537 . C 1 1 58 . 1 1 40 GLN N 1 1 40 GLN CA 1 1 40 GLN C 1 1 41 HIS N -48.55 -12.51 A 537 . N A 537 . CA A 537 . C A 538 . N 1 1 59 . 1 1 40 GLN C 1 1 41 HIS N 1 1 41 HIS CA 1 1 41 HIS C -83.34 -61.459995 A 537 . C A 538 . N A 538 . CA A 538 . C 1 1 60 . 1 1 41 HIS N 1 1 41 HIS CA 1 1 41 HIS C 1 1 42 ILE N -43.46 -16.12 A 538 . N A 538 . CA A 538 . C A 539 . N 1 1 61 . 1 1 42 ILE C 1 1 43 CYS N 1 1 43 CYS CA 1 1 43 CYS C -97.09 -57.31 A 539 . C A 540 . N A 540 . CA A 540 . C 1 1 62 . 1 1 43 CYS N 1 1 43 CYS CA 1 1 43 CYS C 1 1 44 GLY N 126.37 152.83 A 540 . N A 540 . CA A 540 . C A 541 . N 1 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _RDC_constraint_list.Sf_category RDC_constraints _RDC_constraint_list.Entry_ID 1 _RDC_constraint_list.ID 1 _RDC_constraint_list.Constraint_file_ID . _RDC_constraint_list.Block_ID . loop_ _RDC_constraint.ID _RDC_constraint.Entity_assembly_ID_1 _RDC_constraint.Entity_ID_1 _RDC_constraint.Comp_index_ID_1 _RDC_constraint.Comp_ID_1 _RDC_constraint.Atom_ID_1 _RDC_constraint.Entity_assembly_ID_2 _RDC_constraint.Entity_ID_2 _RDC_constraint.Comp_index_ID_2 _RDC_constraint.Comp_ID_2 _RDC_constraint.Atom_ID_2 _RDC_constraint.RDC_val _RDC_constraint.RDC_lower_bound _RDC_constraint.RDC_upper_bound _RDC_constraint.RDC_val_err _RDC_constraint.Auth_asym_ID_1 _RDC_constraint.Auth_seq_ID_1 _RDC_constraint.Auth_comp_ID_1 _RDC_constraint.Auth_atom_ID_1 _RDC_constraint.Auth_asym_ID_2 _RDC_constraint.Auth_seq_ID_2 _RDC_constraint.Auth_comp_ID_2 _RDC_constraint.Auth_atom_ID_2 _RDC_constraint.Entry_ID _RDC_constraint.RDC_constraint_list_ID 1 1 1 7 CYS N 1 1 7 CYS H 23.8 . . . A 504 . HN A 504 . N 1 1 2 1 1 8 VAL N 1 1 8 VAL H -0.26 . . . A 505 . HN A 505 . N 1 1 3 1 1 9 ASN N 1 1 9 ASN H 6.29 . . . A 506 . HN A 506 . N 1 1 4 1 1 12 ARG N 1 1 12 ARG H -18.29 . . . A 509 . HN A 509 . N 1 1 5 1 1 13 GLU N 1 1 13 GLU H 20.95 . . . A 510 . HN A 510 . N 1 1 6 1 1 14 ALA N 1 1 14 ALA H -37.09 . . . A 511 . HN A 511 . N 1 1 7 1 1 16 SER N 1 1 16 SER H 13.55 . . . A 513 . HN A 513 . N 1 1 8 1 1 19 THR N 1 1 19 THR H -2.92 . . . A 516 . HN A 516 . N 1 1 9 1 1 20 GLY N 1 1 20 GLY H 23.72 . . . A 517 . HN A 517 . N 1 1 10 1 1 23 LYS N 1 1 23 LYS H -9.74 . . . A 520 . HN A 520 . N 1 1 11 1 1 24 VAL N 1 1 24 VAL H -35.64 . . . A 521 . HN A 521 . N 1 1 12 1 1 26 TYR N 1 1 26 TYR H 10.6 . . . A 523 . HN A 523 . N 1 1 13 1 1 27 CYS N 1 1 27 CYS H 16.5 . . . A 524 . HN A 524 . N 1 1 14 1 1 28 SER N 1 1 28 SER H 8.1 . . . A 525 . HN A 525 . N 1 1 15 1 1 31 CYS N 1 1 31 CYS H 26.98 . . . A 528 . HN A 528 . N 1 1 16 1 1 32 GLN N 1 1 32 GLN H 9.04 . . . A 529 . HN A 529 . N 1 1 17 1 1 33 ARG N 1 1 33 ARG H 17.47 . . . A 530 . HN A 530 . N 1 1 18 1 1 34 LYS N 1 1 34 LYS H 24.57 . . . A 531 . HN A 531 . N 1 1 19 1 1 35 ASP N 1 1 35 ASP H 22.61 . . . A 532 . HN A 532 . N 1 1 20 1 1 36 TRP N 1 1 36 TRP H -2.36 . . . A 533 . HN A 533 . N 1 1 21 1 1 37 LYS N 1 1 37 LYS H 19.39 . . . A 534 . HN A 534 . N 1 1 22 1 1 38 ASP N 1 1 38 ASP H 21.47 . . . A 535 . HN A 535 . N 1 1 23 1 1 39 HIS N 1 1 39 HIS H 8.39 . . . A 536 . HN A 536 . N 1 1 24 1 1 41 HIS N 1 1 41 HIS H 24.08 . . . A 538 . HN A 538 . N 1 1 25 1 1 42 ILE N 1 1 42 ILE H 12.49 . . . A 539 . HN A 539 . N 1 1 26 1 1 43 CYS N 1 1 43 CYS H 14.4 . . . A 540 . HN A 540 . N 1 1 27 1 1 44 GLY N 1 1 44 GLY H 1.54 . . . A 541 . HN A 541 . N 1 1 28 1 1 7 CYS C 1 1 8 VAL N 16.675 . . . A 504 . C A 505 . N 1 1 29 1 1 18 CYS C 1 1 19 THR N -48.067 . . . A 515 . C A 516 . N 1 1 30 1 1 23 LYS C 1 1 24 VAL N -20.84 . . . A 520 . C A 521 . N 1 1 31 1 1 24 VAL C 1 1 25 ASN N 15.76 . . . A 521 . C A 522 . N 1 1 32 1 1 25 ASN C 1 1 26 TYR N -32.377 . . . A 522 . C A 523 . N 1 1 33 1 1 31 CYS C 1 1 32 GLN N 8.53 . . . A 528 . C A 529 . N 1 1 34 1 1 35 ASP C 1 1 36 TRP N -47.592 . . . A 532 . C A 533 . N 1 1 35 1 1 36 TRP C 1 1 37 LYS N 21.845 . . . A 533 . C A 534 . N 1 1 36 1 1 38 ASP C 1 1 39 HIS N 12.505 . . . A 535 . C A 536 . N 1 1 37 1 1 4 GLU C 1 1 5 GLN H -15.575 . . . A 502 . HN A 501 . C 1 1 38 1 1 18 CYS C 1 1 19 THR H -42.937 . . . A 516 . HN A 515 . C 1 1 39 1 1 24 VAL C 1 1 25 ASN H 4.436 . . . A 522 . HN A 521 . C 1 1 40 1 1 29 THR C 1 1 30 PHE H 26.067 . . . A 527 . HN A 526 . C 1 1 41 1 1 41 HIS C 1 1 42 ILE H 17.551 . . . A 539 . HN A 538 . C 1 1 42 1 1 42 ILE C 1 1 43 CYS H -6.67 . . . A 540 . HN A 539 . C 1 1 43 1 1 43 CYS C 1 1 44 GLY H 0.356 . . . A 541 . HN A 540 . C 1 1 44 1 1 44 GLY C 1 1 45 GLN H 0.259 . . . A 542 . HN A 541 . C 1 1 45 1 1 45 GLN C 1 1 46 SER H 3.076 . . . A 543 . HN A 542 . C 1 1 46 1 1 5 GLN CA 1 1 5 GLN HA -19.99 . . . A 502 . HA A 502 . CA 1 1 47 1 1 7 CYS CA 1 1 7 CYS HA 8.117 . . . A 504 . HA A 504 . CA 1 1 48 1 1 15 MET CA 1 1 15 MET HA -4.96 . . . A 512 . HA A 512 . CA 1 1 49 1 1 16 SER CA 1 1 16 SER HA 25.408 . . . A 513 . HA A 513 . CA 1 1 50 1 1 17 GLU CA 1 1 17 GLU HA -16.075 . . . A 514 . HA A 514 . CA 1 1 51 1 1 18 CYS CA 1 1 18 CYS HA -25.099 . . . A 515 . HA A 515 . CA 1 1 52 1 1 21 CYS CA 1 1 21 CYS HA 26.454 . . . A 518 . HA A 518 . CA 1 1 53 1 1 25 ASN CA 1 1 25 ASN HA -24.342 . . . A 522 . HA A 522 . CA 1 1 54 1 1 31 CYS CA 1 1 31 CYS HA 28.565 . . . A 528 . HA A 528 . CA 1 1 55 1 1 32 GLN CA 1 1 32 GLN HA -36.533 . . . A 529 . HA A 529 . CA 1 1 56 1 1 33 ARG CA 1 1 33 ARG HA 25.249 . . . A 530 . HA A 530 . CA 1 1 57 1 1 35 ASP CA 1 1 35 ASP HA 3.008 . . . A 532 . HA A 532 . CA 1 1 58 1 1 36 TRP CA 1 1 36 TRP HA 11.125 . . . A 533 . HA A 533 . CA 1 1 59 1 1 37 LYS CA 1 1 37 LYS HA -13.815 . . . A 534 . HA A 534 . CA 1 1 60 1 1 38 ASP CA 1 1 38 ASP HA 25.099 . . . A 535 . HA A 535 . CA 1 1 61 1 1 40 GLN CA 1 1 40 GLN HA 21.494 . . . A 537 . HA A 537 . CA 1 1 62 1 1 41 HIS CA 1 1 41 HIS HA -5.568 . . . A 538 . HA A 538 . CA 1 1 63 1 1 43 CYS CA 1 1 43 CYS HA -5.866 . . . A 540 . HA A 540 . CA 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 -14.662 2.864 2.963 1.00 . A A . 498 GLY C 1 1 1 2 1 1 1 GLY CA C -15.572 3.365 4.060 1.00 . A A . 498 GLY CA 1 1 1 3 1 1 1 GLY H1 H -14.058 4.352 5.093 1.00 . A A . 498 GLY H1 1 1 1 4 1 1 1 GLY H2 H -15.616 4.832 5.538 1.00 . A A . 498 GLY H2 1 1 1 5 1 1 1 GLY H3 H -14.955 5.359 4.065 1.00 . A A . 498 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -15.705 2.580 4.788 1.00 . A A . 498 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -16.532 3.618 3.634 1.00 . A A . 498 GLY HA3 1 1 1 8 1 1 1 GLY N N -15.015 4.560 4.736 1.00 . A A . 498 GLY N 1 1 1 9 1 1 1 GLY O O -13.726 3.558 2.560 1.00 . A A . 498 GLY O 1 1 1 10 1 1 2 ALA C C -14.565 1.597 0.050 1.00 . A A . 499 ALA C 1 1 1 11 1 1 2 ALA CA C -14.141 1.061 1.417 1.00 . A A . 499 ALA CA 1 1 1 12 1 1 2 ALA CB C -14.268 -0.455 1.470 1.00 . A A . 499 ALA CB 1 1 1 13 1 1 2 ALA H H -15.701 1.162 2.845 1.00 . A A . 499 ALA H 1 1 1 14 1 1 2 ALA HA H -13.106 1.318 1.589 1.00 . A A . 499 ALA HA 1 1 1 15 1 1 2 ALA HB1 H -15.297 -0.735 1.298 1.00 . A A . 499 ALA HB1 1 1 1 16 1 1 2 ALA HB2 H -13.643 -0.896 0.708 1.00 . A A . 499 ALA HB2 1 1 1 17 1 1 2 ALA HB3 H -13.957 -0.809 2.442 1.00 . A A . 499 ALA HB3 1 1 1 18 1 1 2 ALA N N -14.935 1.663 2.478 1.00 . A A . 499 ALA N 1 1 1 19 1 1 2 ALA O O -14.971 0.840 -0.837 1.00 . A A . 499 ALA O 1 1 1 20 1 1 3 MET C C -13.816 4.712 -1.591 1.00 . A A . 500 MET C 1 1 1 21 1 1 3 MET CA C -14.802 3.575 -1.356 1.00 . A A . 500 MET CA 1 1 1 22 1 1 3 MET CB C -16.238 4.128 -1.371 1.00 . A A . 500 MET CB 1 1 1 23 1 1 3 MET CE C -18.745 1.135 0.107 1.00 . A A . 500 MET CE 1 1 1 24 1 1 3 MET CG C -17.326 3.065 -1.281 1.00 . A A . 500 MET CG 1 1 1 25 1 1 3 MET H H -14.236 3.459 0.676 1.00 . A A . 500 MET H 1 1 1 26 1 1 3 MET HA H -14.694 2.848 -2.148 1.00 . A A . 500 MET HA 1 1 1 27 1 1 3 MET HB2 H -16.357 4.801 -0.535 1.00 . A A . 500 MET HB2 1 1 1 28 1 1 3 MET HB3 H -16.384 4.682 -2.287 1.00 . A A . 500 MET HB3 1 1 1 29 1 1 3 MET HE1 H -18.231 0.390 -0.483 1.00 . A A . 500 MET HE1 1 1 1 30 1 1 3 MET HE2 H -19.048 0.701 1.049 1.00 . A A . 500 MET HE2 1 1 1 31 1 1 3 MET HE3 H -19.618 1.478 -0.428 1.00 . A A . 500 MET HE3 1 1 1 32 1 1 3 MET HG2 H -18.238 3.470 -1.691 1.00 . A A . 500 MET HG2 1 1 1 33 1 1 3 MET HG3 H -17.020 2.211 -1.868 1.00 . A A . 500 MET HG3 1 1 1 34 1 1 3 MET N N -14.497 2.914 -0.095 1.00 . A A . 500 MET N 1 1 1 35 1 1 3 MET O O -13.367 4.941 -2.712 1.00 . A A . 500 MET O 1 1 1 36 1 1 3 MET SD S -17.648 2.519 0.410 1.00 . A A . 500 MET SD 1 1 1 37 1 1 4 GLU C C -11.179 6.154 -1.063 1.00 . A A . 501 GLU C 1 1 1 38 1 1 4 GLU CA C -12.572 6.558 -0.576 1.00 . A A . 501 GLU CA 1 1 1 39 1 1 4 GLU CB C -12.454 7.237 0.795 1.00 . A A . 501 GLU CB 1 1 1 40 1 1 4 GLU CD C -14.656 6.808 1.991 1.00 . A A . 501 GLU CD 1 1 1 41 1 1 4 GLU CG C -13.758 7.829 1.320 1.00 . A A . 501 GLU CG 1 1 1 42 1 1 4 GLU H H -13.877 5.176 0.352 1.00 . A A . 501 GLU H 1 1 1 43 1 1 4 GLU HA H -12.987 7.266 -1.276 1.00 . A A . 501 GLU HA 1 1 1 44 1 1 4 GLU HB2 H -12.105 6.508 1.512 1.00 . A A . 501 GLU HB2 1 1 1 45 1 1 4 GLU HB3 H -11.728 8.032 0.726 1.00 . A A . 501 GLU HB3 1 1 1 46 1 1 4 GLU HG2 H -13.522 8.597 2.040 1.00 . A A . 501 GLU HG2 1 1 1 47 1 1 4 GLU HG3 H -14.295 8.271 0.491 1.00 . A A . 501 GLU HG3 1 1 1 48 1 1 4 GLU N N -13.478 5.415 -0.513 1.00 . A A . 501 GLU N 1 1 1 49 1 1 4 GLU O O -10.468 6.954 -1.678 1.00 . A A . 501 GLU O 1 1 1 50 1 1 4 GLU OE1 O -15.400 6.104 1.286 1.00 . A A . 501 GLU OE1 1 1 1 51 1 1 4 GLU OE2 O -14.635 6.720 3.239 1.00 . A A . 501 GLU OE2 1 1 1 52 1 1 5 GLN C C -9.553 3.079 -1.835 1.00 . A A . 502 GLN C 1 1 1 53 1 1 5 GLN CA C -9.462 4.449 -1.172 1.00 . A A . 502 GLN CA 1 1 1 54 1 1 5 GLN CB C -8.543 4.417 0.052 1.00 . A A . 502 GLN CB 1 1 1 55 1 1 5 GLN CD C -8.337 3.865 2.520 1.00 . A A . 502 GLN CD 1 1 1 56 1 1 5 GLN CG C -9.149 3.696 1.249 1.00 . A A . 502 GLN CG 1 1 1 57 1 1 5 GLN H H -11.401 4.306 -0.337 1.00 . A A . 502 GLN H 1 1 1 58 1 1 5 GLN HA H -9.075 5.153 -1.894 1.00 . A A . 502 GLN HA 1 1 1 59 1 1 5 GLN HB2 H -7.626 3.914 -0.216 1.00 . A A . 502 GLN HB2 1 1 1 60 1 1 5 GLN HB3 H -8.315 5.432 0.346 1.00 . A A . 502 GLN HB3 1 1 1 61 1 1 5 GLN HE21 H -7.741 5.670 1.945 1.00 . A A . 502 GLN HE21 1 1 1 62 1 1 5 GLN HE22 H -7.151 5.137 3.476 1.00 . A A . 502 GLN HE22 1 1 1 63 1 1 5 GLN HG2 H -10.142 4.087 1.421 1.00 . A A . 502 GLN HG2 1 1 1 64 1 1 5 GLN HG3 H -9.215 2.643 1.019 1.00 . A A . 502 GLN HG3 1 1 1 65 1 1 5 GLN N N -10.786 4.920 -0.790 1.00 . A A . 502 GLN N 1 1 1 66 1 1 5 GLN NE2 N -7.674 5.003 2.660 1.00 . A A . 502 GLN NE2 1 1 1 67 1 1 5 GLN O O -10.486 2.324 -1.583 1.00 . A A . 502 GLN O 1 1 1 68 1 1 5 GLN OE1 O -8.320 2.983 3.378 1.00 . A A . 502 GLN OE1 1 1 1 69 1 1 6 SER C C -7.265 0.780 -3.314 1.00 . A A . 503 SER C 1 1 1 70 1 1 6 SER CA C -8.595 1.527 -3.450 1.00 . A A . 503 SER CA 1 1 1 71 1 1 6 SER CB C -8.897 1.838 -4.919 1.00 . A A . 503 SER CB 1 1 1 72 1 1 6 SER H H -7.846 3.401 -2.822 1.00 . A A . 503 SER H 1 1 1 73 1 1 6 SER HA H -9.384 0.904 -3.055 1.00 . A A . 503 SER HA 1 1 1 74 1 1 6 SER HB2 H -8.569 1.014 -5.536 1.00 . A A . 503 SER HB2 1 1 1 75 1 1 6 SER HB3 H -9.961 1.978 -5.044 1.00 . A A . 503 SER HB3 1 1 1 76 1 1 6 SER HG H -8.660 3.794 -4.944 1.00 . A A . 503 SER HG 1 1 1 77 1 1 6 SER N N -8.585 2.771 -2.691 1.00 . A A . 503 SER N 1 1 1 78 1 1 6 SER O O -6.200 1.348 -3.548 1.00 . A A . 503 SER O 1 1 1 79 1 1 6 SER OG O -8.226 3.019 -5.340 1.00 . A A . 503 SER OG 1 1 1 80 1 1 7 CYS C C -5.435 -1.438 -4.114 1.00 . A A . 504 CYS C 1 1 1 81 1 1 7 CYS CA C -6.143 -1.309 -2.778 1.00 . A A . 504 CYS CA 1 1 1 82 1 1 7 CYS CB C -6.482 -2.709 -2.237 1.00 . A A . 504 CYS CB 1 1 1 83 1 1 7 CYS H H -8.219 -0.897 -2.782 1.00 . A A . 504 CYS H 1 1 1 84 1 1 7 CYS HA H -5.487 -0.815 -2.077 1.00 . A A . 504 CYS HA 1 1 1 85 1 1 7 CYS HB2 H -7.004 -2.611 -1.296 1.00 . A A . 504 CYS HB2 1 1 1 86 1 1 7 CYS HB3 H -7.115 -3.220 -2.946 1.00 . A A . 504 CYS HB3 1 1 1 87 1 1 7 CYS N N -7.333 -0.492 -2.933 1.00 . A A . 504 CYS N 1 1 1 88 1 1 7 CYS O O -6.040 -1.832 -5.113 1.00 . A A . 504 CYS O 1 1 1 89 1 1 7 CYS SG S -5.007 -3.756 -1.952 1.00 . A A . 504 CYS SG 1 1 1 90 1 1 8 VAL C C -3.217 -2.617 -5.798 1.00 . A A . 505 VAL C 1 1 1 91 1 1 8 VAL CA C -3.348 -1.165 -5.323 1.00 . A A . 505 VAL CA 1 1 1 92 1 1 8 VAL CB C -1.955 -0.537 -5.071 1.00 . A A . 505 VAL CB 1 1 1 93 1 1 8 VAL CG1 C -1.129 -1.386 -4.117 1.00 . A A . 505 VAL CG1 1 1 1 94 1 1 8 VAL CG2 C -1.212 -0.295 -6.377 1.00 . A A . 505 VAL CG2 1 1 1 95 1 1 8 VAL H H -3.764 -0.718 -3.302 1.00 . A A . 505 VAL H 1 1 1 96 1 1 8 VAL HA H -3.843 -0.591 -6.092 1.00 . A A . 505 VAL HA 1 1 1 97 1 1 8 VAL HB H -2.111 0.424 -4.598 1.00 . A A . 505 VAL HB 1 1 1 98 1 1 8 VAL HG11 H -0.992 -2.371 -4.536 1.00 . A A . 505 VAL HG11 1 1 1 99 1 1 8 VAL HG12 H -0.166 -0.922 -3.963 1.00 . A A . 505 VAL HG12 1 1 1 100 1 1 8 VAL HG13 H -1.644 -1.466 -3.170 1.00 . A A . 505 VAL HG13 1 1 1 101 1 1 8 VAL HG21 H -1.789 0.375 -6.996 1.00 . A A . 505 VAL HG21 1 1 1 102 1 1 8 VAL HG22 H -0.251 0.149 -6.164 1.00 . A A . 505 VAL HG22 1 1 1 103 1 1 8 VAL HG23 H -1.070 -1.233 -6.892 1.00 . A A . 505 VAL HG23 1 1 1 104 1 1 8 VAL N N -4.162 -1.085 -4.122 1.00 . A A . 505 VAL N 1 1 1 105 1 1 8 VAL O O -2.852 -2.883 -6.945 1.00 . A A . 505 VAL O 1 1 1 106 1 1 9 ASN C C -4.850 -5.554 -5.528 1.00 . A A . 506 ASN C 1 1 1 107 1 1 9 ASN CA C -3.463 -4.969 -5.260 1.00 . A A . 506 ASN CA 1 1 1 108 1 1 9 ASN CB C -2.752 -5.742 -4.142 1.00 . A A . 506 ASN CB 1 1 1 109 1 1 9 ASN CG C -2.575 -7.218 -4.463 1.00 . A A . 506 ASN CG 1 1 1 110 1 1 9 ASN H H -3.843 -3.296 -4.018 1.00 . A A . 506 ASN H 1 1 1 111 1 1 9 ASN HA H -2.876 -5.051 -6.163 1.00 . A A . 506 ASN HA 1 1 1 112 1 1 9 ASN HB2 H -1.775 -5.311 -3.984 1.00 . A A . 506 ASN HB2 1 1 1 113 1 1 9 ASN HB3 H -3.327 -5.656 -3.231 1.00 . A A . 506 ASN HB3 1 1 1 114 1 1 9 ASN HD21 H -4.088 -7.708 -3.273 1.00 . A A . 506 ASN HD21 1 1 1 115 1 1 9 ASN HD22 H -3.311 -9.021 -4.081 1.00 . A A . 506 ASN HD22 1 1 1 116 1 1 9 ASN N N -3.543 -3.557 -4.920 1.00 . A A . 506 ASN N 1 1 1 117 1 1 9 ASN ND2 N -3.407 -8.066 -3.881 1.00 . A A . 506 ASN ND2 1 1 1 118 1 1 9 ASN O O -4.984 -6.535 -6.260 1.00 . A A . 506 ASN O 1 1 1 119 1 1 9 ASN OD1 O -1.661 -7.596 -5.192 1.00 . A A . 506 ASN OD1 1 1 1 120 1 1 10 CYS C C -8.181 -4.433 -5.758 1.00 . A A . 507 CYS C 1 1 1 121 1 1 10 CYS CA C -7.239 -5.449 -5.118 1.00 . A A . 507 CYS CA 1 1 1 122 1 1 10 CYS CB C -7.794 -5.859 -3.756 1.00 . A A . 507 CYS CB 1 1 1 123 1 1 10 CYS H H -5.733 -4.101 -4.475 1.00 . A A . 507 CYS H 1 1 1 124 1 1 10 CYS HA H -7.192 -6.322 -5.749 1.00 . A A . 507 CYS HA 1 1 1 125 1 1 10 CYS HB2 H -7.928 -4.977 -3.147 1.00 . A A . 507 CYS HB2 1 1 1 126 1 1 10 CYS HB3 H -8.750 -6.342 -3.896 1.00 . A A . 507 CYS HB3 1 1 1 127 1 1 10 CYS N N -5.883 -4.929 -4.978 1.00 . A A . 507 CYS N 1 1 1 128 1 1 10 CYS O O -8.365 -4.414 -6.977 1.00 . A A . 507 CYS O 1 1 1 129 1 1 10 CYS SG S -6.724 -7.005 -2.843 1.00 . A A . 507 CYS SG 1 1 1 130 1 1 11 GLY C C -10.243 -1.751 -4.269 1.00 . A A . 508 GLY C 1 1 1 131 1 1 11 GLY CA C -9.762 -2.650 -5.385 1.00 . A A . 508 GLY CA 1 1 1 132 1 1 11 GLY H H -8.513 -3.599 -3.978 1.00 . A A . 508 GLY H 1 1 1 133 1 1 11 GLY HA2 H -9.335 -2.043 -6.170 1.00 . A A . 508 GLY HA2 1 1 1 134 1 1 11 GLY HA3 H -10.605 -3.197 -5.782 1.00 . A A . 508 GLY HA3 1 1 1 135 1 1 11 GLY N N -8.767 -3.590 -4.923 1.00 . A A . 508 GLY N 1 1 1 136 1 1 11 GLY O O -9.591 -1.658 -3.233 1.00 . A A . 508 GLY O 1 1 1 137 1 1 12 ARG C C -12.081 -0.690 -2.082 1.00 . A A . 509 ARG C 1 1 1 138 1 1 12 ARG CA C -11.948 -0.141 -3.513 1.00 . A A . 509 ARG CA 1 1 1 139 1 1 12 ARG CB C -13.316 0.342 -4.004 1.00 . A A . 509 ARG CB 1 1 1 140 1 1 12 ARG CD C -15.724 -0.238 -4.474 1.00 . A A . 509 ARG CD 1 1 1 141 1 1 12 ARG CG C -14.358 -0.761 -4.064 1.00 . A A . 509 ARG CG 1 1 1 142 1 1 12 ARG CZ C -18.006 -1.164 -4.734 1.00 . A A . 509 ARG CZ 1 1 1 143 1 1 12 ARG H H -11.864 -1.249 -5.322 1.00 . A A . 509 ARG H 1 1 1 144 1 1 12 ARG HA H -11.280 0.704 -3.488 1.00 . A A . 509 ARG HA 1 1 1 145 1 1 12 ARG HB2 H -13.677 1.113 -3.338 1.00 . A A . 509 ARG HB2 1 1 1 146 1 1 12 ARG HB3 H -13.204 0.757 -4.994 1.00 . A A . 509 ARG HB3 1 1 1 147 1 1 12 ARG HD2 H -15.966 0.624 -3.869 1.00 . A A . 509 ARG HD2 1 1 1 148 1 1 12 ARG HD3 H -15.692 0.047 -5.515 1.00 . A A . 509 ARG HD3 1 1 1 149 1 1 12 ARG HE H -16.492 -2.067 -3.791 1.00 . A A . 509 ARG HE 1 1 1 150 1 1 12 ARG HG2 H -14.041 -1.500 -4.784 1.00 . A A . 509 ARG HG2 1 1 1 151 1 1 12 ARG HG3 H -14.437 -1.219 -3.089 1.00 . A A . 509 ARG HG3 1 1 1 152 1 1 12 ARG HH11 H -17.767 0.649 -5.607 1.00 . A A . 509 ARG HH11 1 1 1 153 1 1 12 ARG HH12 H -19.357 -0.042 -5.749 1.00 . A A . 509 ARG HH12 1 1 1 154 1 1 12 ARG HH21 H -18.566 -2.957 -3.977 1.00 . A A . 509 ARG HH21 1 1 1 155 1 1 12 ARG HH22 H -19.809 -2.079 -4.815 1.00 . A A . 509 ARG HH22 1 1 1 156 1 1 12 ARG N N -11.391 -1.111 -4.469 1.00 . A A . 509 ARG N 1 1 1 157 1 1 12 ARG NE N -16.754 -1.259 -4.289 1.00 . A A . 509 ARG NE 1 1 1 158 1 1 12 ARG NH1 N -18.405 -0.101 -5.417 1.00 . A A . 509 ARG NH1 1 1 1 159 1 1 12 ARG NH2 N -18.862 -2.144 -4.493 1.00 . A A . 509 ARG NH2 1 1 1 160 1 1 12 ARG O O -12.340 0.067 -1.156 1.00 . A A . 509 ARG O 1 1 1 161 1 1 13 GLU C C -10.890 -2.138 0.363 1.00 . A A . 510 GLU C 1 1 1 162 1 1 13 GLU CA C -11.967 -2.630 -0.608 1.00 . A A . 510 GLU CA 1 1 1 163 1 1 13 GLU CB C -11.823 -4.126 -0.816 1.00 . A A . 510 GLU CB 1 1 1 164 1 1 13 GLU CD C -13.473 -4.347 -2.706 1.00 . A A . 510 GLU CD 1 1 1 165 1 1 13 GLU CG C -13.081 -4.804 -1.320 1.00 . A A . 510 GLU CG 1 1 1 166 1 1 13 GLU H H -11.671 -2.557 -2.662 1.00 . A A . 510 GLU H 1 1 1 167 1 1 13 GLU HA H -12.938 -2.426 -0.191 1.00 . A A . 510 GLU HA 1 1 1 168 1 1 13 GLU HB2 H -11.040 -4.297 -1.540 1.00 . A A . 510 GLU HB2 1 1 1 169 1 1 13 GLU HB3 H -11.540 -4.568 0.102 1.00 . A A . 510 GLU HB3 1 1 1 170 1 1 13 GLU HG2 H -12.915 -5.869 -1.340 1.00 . A A . 510 GLU HG2 1 1 1 171 1 1 13 GLU HG3 H -13.888 -4.578 -0.641 1.00 . A A . 510 GLU HG3 1 1 1 172 1 1 13 GLU N N -11.885 -1.991 -1.900 1.00 . A A . 510 GLU N 1 1 1 173 1 1 13 GLU O O -10.849 -2.566 1.518 1.00 . A A . 510 GLU O 1 1 1 174 1 1 13 GLU OE1 O -12.683 -4.561 -3.650 1.00 . A A . 510 GLU OE1 1 1 1 175 1 1 13 GLU OE2 O -14.562 -3.752 -2.857 1.00 . A A . 510 GLU OE2 1 1 1 176 1 1 14 ALA C C -9.385 -0.203 2.023 1.00 . A A . 511 ALA C 1 1 1 177 1 1 14 ALA CA C -8.922 -0.701 0.659 1.00 . A A . 511 ALA CA 1 1 1 178 1 1 14 ALA CB C -8.256 0.434 -0.094 1.00 . A A . 511 ALA CB 1 1 1 179 1 1 14 ALA H H -10.088 -1.028 -1.076 1.00 . A A . 511 ALA H 1 1 1 180 1 1 14 ALA HA H -8.186 -1.472 0.807 1.00 . A A . 511 ALA HA 1 1 1 181 1 1 14 ALA HB1 H -7.944 0.086 -1.067 1.00 . A A . 511 ALA HB1 1 1 1 182 1 1 14 ALA HB2 H -8.954 1.251 -0.210 1.00 . A A . 511 ALA HB2 1 1 1 183 1 1 14 ALA HB3 H -7.393 0.776 0.460 1.00 . A A . 511 ALA HB3 1 1 1 184 1 1 14 ALA N N -10.009 -1.276 -0.134 1.00 . A A . 511 ALA N 1 1 1 185 1 1 14 ALA O O -10.451 0.406 2.158 1.00 . A A . 511 ALA O 1 1 1 186 1 1 15 MET C C -7.636 0.300 5.193 1.00 . A A . 512 MET C 1 1 1 187 1 1 15 MET CA C -8.891 -0.061 4.389 1.00 . A A . 512 MET CA 1 1 1 188 1 1 15 MET CB C -9.660 -1.195 5.079 1.00 . A A . 512 MET CB 1 1 1 189 1 1 15 MET CE C -12.350 -2.511 6.160 1.00 . A A . 512 MET CE 1 1 1 190 1 1 15 MET CG C -10.139 -0.860 6.485 1.00 . A A . 512 MET CG 1 1 1 191 1 1 15 MET H H -7.708 -0.874 2.843 1.00 . A A . 512 MET H 1 1 1 192 1 1 15 MET HA H -9.527 0.807 4.315 1.00 . A A . 512 MET HA 1 1 1 193 1 1 15 MET HB2 H -10.524 -1.443 4.481 1.00 . A A . 512 MET HB2 1 1 1 194 1 1 15 MET HB3 H -9.016 -2.062 5.139 1.00 . A A . 512 MET HB3 1 1 1 195 1 1 15 MET HE1 H -11.972 -2.737 5.174 1.00 . A A . 512 MET HE1 1 1 1 196 1 1 15 MET HE2 H -12.949 -3.335 6.515 1.00 . A A . 512 MET HE2 1 1 1 197 1 1 15 MET HE3 H -12.956 -1.618 6.117 1.00 . A A . 512 MET HE3 1 1 1 198 1 1 15 MET HG2 H -9.284 -0.580 7.083 1.00 . A A . 512 MET HG2 1 1 1 199 1 1 15 MET HG3 H -10.824 -0.028 6.429 1.00 . A A . 512 MET HG3 1 1 1 200 1 1 15 MET N N -8.559 -0.444 3.028 1.00 . A A . 512 MET N 1 1 1 201 1 1 15 MET O O -7.710 1.044 6.168 1.00 . A A . 512 MET O 1 1 1 202 1 1 15 MET SD S -10.976 -2.249 7.282 1.00 . A A . 512 MET SD 1 1 1 203 1 1 16 SER C C -4.180 0.629 4.642 1.00 . A A . 513 SER C 1 1 1 204 1 1 16 SER CA C -5.257 0.021 5.537 1.00 . A A . 513 SER CA 1 1 1 205 1 1 16 SER CB C -4.769 -1.270 6.190 1.00 . A A . 513 SER CB 1 1 1 206 1 1 16 SER H H -6.443 -0.741 3.966 1.00 . A A . 513 SER H 1 1 1 207 1 1 16 SER HA H -5.498 0.744 6.301 1.00 . A A . 513 SER HA 1 1 1 208 1 1 16 SER HB2 H -4.488 -1.975 5.422 1.00 . A A . 513 SER HB2 1 1 1 209 1 1 16 SER HB3 H -3.915 -1.055 6.815 1.00 . A A . 513 SER HB3 1 1 1 210 1 1 16 SER HG H -6.620 -1.379 6.821 1.00 . A A . 513 SER HG 1 1 1 211 1 1 16 SER N N -6.482 -0.226 4.794 1.00 . A A . 513 SER N 1 1 1 212 1 1 16 SER O O -4.052 0.279 3.470 1.00 . A A . 513 SER O 1 1 1 213 1 1 16 SER OG O -5.792 -1.843 6.989 1.00 . A A . 513 SER OG 1 1 1 214 1 1 17 GLU C C -0.991 1.774 4.894 1.00 . A A . 514 GLU C 1 1 1 215 1 1 17 GLU CA C -2.379 2.265 4.487 1.00 . A A . 514 GLU CA 1 1 1 216 1 1 17 GLU CB C -2.505 3.763 4.775 1.00 . A A . 514 GLU CB 1 1 1 217 1 1 17 GLU CD C -2.614 5.588 6.510 1.00 . A A . 514 GLU CD 1 1 1 218 1 1 17 GLU CG C -2.411 4.113 6.249 1.00 . A A . 514 GLU CG 1 1 1 219 1 1 17 GLU H H -3.546 1.741 6.169 1.00 . A A . 514 GLU H 1 1 1 220 1 1 17 GLU HA H -2.529 2.110 3.428 1.00 . A A . 514 GLU HA 1 1 1 221 1 1 17 GLU HB2 H -1.717 4.284 4.253 1.00 . A A . 514 GLU HB2 1 1 1 222 1 1 17 GLU HB3 H -3.459 4.110 4.405 1.00 . A A . 514 GLU HB3 1 1 1 223 1 1 17 GLU HG2 H -3.168 3.562 6.786 1.00 . A A . 514 GLU HG2 1 1 1 224 1 1 17 GLU HG3 H -1.434 3.828 6.612 1.00 . A A . 514 GLU HG3 1 1 1 225 1 1 17 GLU N N -3.415 1.544 5.213 1.00 . A A . 514 GLU N 1 1 1 226 1 1 17 GLU O O -0.837 1.106 5.924 1.00 . A A . 514 GLU O 1 1 1 227 1 1 17 GLU OE1 O -1.669 6.370 6.297 1.00 . A A . 514 GLU OE1 1 1 1 228 1 1 17 GLU OE2 O -3.715 5.972 6.952 1.00 . A A . 514 GLU OE2 1 1 1 229 1 1 18 CYS C C 1.913 2.767 5.467 1.00 . A A . 515 CYS C 1 1 1 230 1 1 18 CYS CA C 1.390 1.795 4.424 1.00 . A A . 515 CYS CA 1 1 1 231 1 1 18 CYS CB C 2.290 1.846 3.177 1.00 . A A . 515 CYS CB 1 1 1 232 1 1 18 CYS H H -0.181 2.598 3.267 1.00 . A A . 515 CYS H 1 1 1 233 1 1 18 CYS HA H 1.438 0.813 4.877 1.00 . A A . 515 CYS HA 1 1 1 234 1 1 18 CYS HB2 H 2.164 0.936 2.611 1.00 . A A . 515 CYS HB2 1 1 1 235 1 1 18 CYS HB3 H 2.001 2.688 2.567 1.00 . A A . 515 CYS HB3 1 1 1 236 1 1 18 CYS N N 0.009 2.106 4.092 1.00 . A A . 515 CYS N 1 1 1 237 1 1 18 CYS O O 1.804 3.982 5.320 1.00 . A A . 515 CYS O 1 1 1 238 1 1 18 CYS SG S 4.069 2.019 3.558 1.00 . A A . 515 CYS SG 1 1 1 239 1 1 19 THR C C 4.600 3.201 6.943 1.00 . A A . 516 THR C 1 1 1 240 1 1 19 THR CA C 3.196 3.004 7.503 1.00 . A A . 516 THR CA 1 1 1 241 1 1 19 THR CB C 3.243 2.350 8.904 1.00 . A A . 516 THR CB 1 1 1 242 1 1 19 THR CG2 C 3.636 0.883 8.818 1.00 . A A . 516 THR CG2 1 1 1 243 1 1 19 THR H H 2.291 1.278 6.742 1.00 . A A . 516 THR H 1 1 1 244 1 1 19 THR HA H 2.720 3.972 7.594 1.00 . A A . 516 THR HA 1 1 1 245 1 1 19 THR HB H 2.256 2.412 9.339 1.00 . A A . 516 THR HB 1 1 1 246 1 1 19 THR HG1 H 4.586 2.422 10.354 1.00 . A A . 516 THR HG1 1 1 1 247 1 1 19 THR HG21 H 4.618 0.801 8.378 1.00 . A A . 516 THR HG21 1 1 1 248 1 1 19 THR HG22 H 3.648 0.456 9.809 1.00 . A A . 516 THR HG22 1 1 1 249 1 1 19 THR HG23 H 2.921 0.355 8.206 1.00 . A A . 516 THR HG23 1 1 1 250 1 1 19 THR N N 2.426 2.222 6.565 1.00 . A A . 516 THR N 1 1 1 251 1 1 19 THR O O 5.313 2.239 6.645 1.00 . A A . 516 THR O 1 1 1 252 1 1 19 THR OG1 O 4.159 3.052 9.755 1.00 . A A . 516 THR OG1 1 1 1 253 1 1 20 GLY C C 5.972 5.776 5.018 1.00 . A A . 517 GLY C 1 1 1 254 1 1 20 GLY CA C 6.214 4.765 6.107 1.00 . A A . 517 GLY CA 1 1 1 255 1 1 20 GLY H H 4.428 5.166 7.170 1.00 . A A . 517 GLY H 1 1 1 256 1 1 20 GLY HA2 H 6.920 5.170 6.819 1.00 . A A . 517 GLY HA2 1 1 1 257 1 1 20 GLY HA3 H 6.623 3.865 5.670 1.00 . A A . 517 GLY HA3 1 1 1 258 1 1 20 GLY N N 4.983 4.448 6.788 1.00 . A A . 517 GLY N 1 1 1 259 1 1 20 GLY O O 6.622 6.825 4.979 1.00 . A A . 517 GLY O 1 1 1 260 1 1 21 CYS C C 3.094 6.445 3.030 1.00 . A A . 518 CYS C 1 1 1 261 1 1 21 CYS CA C 4.613 6.446 3.143 1.00 . A A . 518 CYS CA 1 1 1 262 1 1 21 CYS CB C 5.255 6.131 1.790 1.00 . A A . 518 CYS CB 1 1 1 263 1 1 21 CYS H H 4.561 4.614 4.191 1.00 . A A . 518 CYS H 1 1 1 264 1 1 21 CYS HA H 4.942 7.405 3.504 1.00 . A A . 518 CYS HA 1 1 1 265 1 1 21 CYS HB2 H 5.187 7.000 1.153 1.00 . A A . 518 CYS HB2 1 1 1 266 1 1 21 CYS HB3 H 6.295 5.883 1.940 1.00 . A A . 518 CYS HB3 1 1 1 267 1 1 21 CYS N N 5.016 5.484 4.145 1.00 . A A . 518 CYS N 1 1 1 268 1 1 21 CYS O O 2.455 5.415 3.199 1.00 . A A . 518 CYS O 1 1 1 269 1 1 21 CYS SG S 4.476 4.738 0.911 1.00 . A A . 518 CYS SG 1 1 1 270 1 1 22 HIS C C 0.653 7.896 1.205 1.00 . A A . 519 HIS C 1 1 1 271 1 1 22 HIS CA C 1.066 7.694 2.652 1.00 . A A . 519 HIS CA 1 1 1 272 1 1 22 HIS CB C 0.539 8.859 3.497 1.00 . A A . 519 HIS CB 1 1 1 273 1 1 22 HIS CD2 C 2.058 9.171 5.575 1.00 . A A . 519 HIS CD2 1 1 1 274 1 1 22 HIS CE1 C 0.670 8.441 7.097 1.00 . A A . 519 HIS CE1 1 1 1 275 1 1 22 HIS CG C 0.920 8.798 4.943 1.00 . A A . 519 HIS CG 1 1 1 276 1 1 22 HIS H H 3.067 8.390 2.582 1.00 . A A . 519 HIS H 1 1 1 277 1 1 22 HIS HA H 0.641 6.769 3.015 1.00 . A A . 519 HIS HA 1 1 1 278 1 1 22 HIS HB2 H 0.925 9.783 3.095 1.00 . A A . 519 HIS HB2 1 1 1 279 1 1 22 HIS HB3 H -0.540 8.873 3.437 1.00 . A A . 519 HIS HB3 1 1 1 280 1 1 22 HIS HD1 H -0.832 7.974 5.788 1.00 . A A . 519 HIS HD1 1 1 1 281 1 1 22 HIS HD2 H 2.948 9.573 5.111 1.00 . A A . 519 HIS HD2 1 1 1 282 1 1 22 HIS HE1 H 0.244 8.156 8.048 1.00 . A A . 519 HIS HE1 1 1 1 283 1 1 22 HIS HE2 H 2.592 8.936 7.595 1.00 . A A . 519 HIS HE2 1 1 1 284 1 1 22 HIS N N 2.514 7.593 2.748 1.00 . A A . 519 HIS N 1 1 1 285 1 1 22 HIS ND1 N 0.075 8.341 5.927 1.00 . A A . 519 HIS ND1 1 1 1 286 1 1 22 HIS NE2 N 1.874 8.939 6.914 1.00 . A A . 519 HIS NE2 1 1 1 287 1 1 22 HIS O O -0.438 8.392 0.927 1.00 . A A . 519 HIS O 1 1 1 288 1 1 23 LYS C C 0.470 6.660 -1.774 1.00 . A A . 520 LYS C 1 1 1 289 1 1 23 LYS CA C 1.275 7.780 -1.128 1.00 . A A . 520 LYS CA 1 1 1 290 1 1 23 LYS CB C 2.585 8.003 -1.897 1.00 . A A . 520 LYS CB 1 1 1 291 1 1 23 LYS CD C 4.653 7.019 -2.938 1.00 . A A . 520 LYS CD 1 1 1 292 1 1 23 LYS CE C 4.150 7.282 -4.355 1.00 . A A . 520 LYS CE 1 1 1 293 1 1 23 LYS CG C 3.497 6.785 -1.974 1.00 . A A . 520 LYS CG 1 1 1 294 1 1 23 LYS H H 2.367 7.085 0.540 1.00 . A A . 520 LYS H 1 1 1 295 1 1 23 LYS HA H 0.693 8.686 -1.185 1.00 . A A . 520 LYS HA 1 1 1 296 1 1 23 LYS HB2 H 2.346 8.304 -2.905 1.00 . A A . 520 LYS HB2 1 1 1 297 1 1 23 LYS HB3 H 3.132 8.801 -1.418 1.00 . A A . 520 LYS HB3 1 1 1 298 1 1 23 LYS HD2 H 5.222 7.872 -2.602 1.00 . A A . 520 LYS HD2 1 1 1 299 1 1 23 LYS HD3 H 5.285 6.140 -2.946 1.00 . A A . 520 LYS HD3 1 1 1 300 1 1 23 LYS HE2 H 3.659 6.391 -4.717 1.00 . A A . 520 LYS HE2 1 1 1 301 1 1 23 LYS HE3 H 3.440 8.095 -4.325 1.00 . A A . 520 LYS HE3 1 1 1 302 1 1 23 LYS HG2 H 3.896 6.583 -0.991 1.00 . A A . 520 LYS HG2 1 1 1 303 1 1 23 LYS HG3 H 2.923 5.937 -2.313 1.00 . A A . 520 LYS HG3 1 1 1 304 1 1 23 LYS HZ1 H 6.060 6.991 -5.160 1.00 . A A . 520 LYS HZ1 1 1 1 305 1 1 23 LYS HZ2 H 4.921 7.564 -6.281 1.00 . A A . 520 LYS HZ2 1 1 1 306 1 1 23 LYS HZ3 H 5.572 8.617 -5.124 1.00 . A A . 520 LYS HZ3 1 1 1 307 1 1 23 LYS N N 1.529 7.523 0.278 1.00 . A A . 520 LYS N 1 1 1 308 1 1 23 LYS NZ N 5.251 7.638 -5.293 1.00 . A A . 520 LYS NZ 1 1 1 309 1 1 23 LYS O O -0.186 6.885 -2.792 1.00 . A A . 520 LYS O 1 1 1 310 1 1 24 VAL C C -1.132 3.718 -0.688 1.00 . A A . 521 VAL C 1 1 1 311 1 1 24 VAL CA C -0.234 4.333 -1.758 1.00 . A A . 521 VAL CA 1 1 1 312 1 1 24 VAL CB C 0.694 3.237 -2.324 1.00 . A A . 521 VAL CB 1 1 1 313 1 1 24 VAL CG1 C 1.504 3.757 -3.500 1.00 . A A . 521 VAL CG1 1 1 1 314 1 1 24 VAL CG2 C 1.609 2.697 -1.239 1.00 . A A . 521 VAL CG2 1 1 1 315 1 1 24 VAL H H 1.027 5.313 -0.385 1.00 . A A . 521 VAL H 1 1 1 316 1 1 24 VAL HA H -0.852 4.705 -2.561 1.00 . A A . 521 VAL HA 1 1 1 317 1 1 24 VAL HB H 0.077 2.426 -2.676 1.00 . A A . 521 VAL HB 1 1 1 318 1 1 24 VAL HG11 H 2.114 4.587 -3.180 1.00 . A A . 521 VAL HG11 1 1 1 319 1 1 24 VAL HG12 H 2.138 2.968 -3.875 1.00 . A A . 521 VAL HG12 1 1 1 320 1 1 24 VAL HG13 H 0.834 4.082 -4.282 1.00 . A A . 521 VAL HG13 1 1 1 321 1 1 24 VAL HG21 H 1.013 2.276 -0.443 1.00 . A A . 521 VAL HG21 1 1 1 322 1 1 24 VAL HG22 H 2.247 1.932 -1.654 1.00 . A A . 521 VAL HG22 1 1 1 323 1 1 24 VAL HG23 H 2.216 3.499 -0.846 1.00 . A A . 521 VAL HG23 1 1 1 324 1 1 24 VAL N N 0.511 5.456 -1.210 1.00 . A A . 521 VAL N 1 1 1 325 1 1 24 VAL O O -0.882 3.868 0.509 1.00 . A A . 521 VAL O 1 1 1 326 1 1 25 ASN C C -3.390 0.981 -0.513 1.00 . A A . 522 ASN C 1 1 1 327 1 1 25 ASN CA C -3.139 2.446 -0.198 1.00 . A A . 522 ASN CA 1 1 1 328 1 1 25 ASN CB C -4.465 3.221 -0.205 1.00 . A A . 522 ASN CB 1 1 1 329 1 1 25 ASN CG C -4.653 4.077 -1.441 1.00 . A A . 522 ASN CG 1 1 1 330 1 1 25 ASN H H -2.288 2.888 -2.092 1.00 . A A . 522 ASN H 1 1 1 331 1 1 25 ASN HA H -2.714 2.503 0.793 1.00 . A A . 522 ASN HA 1 1 1 332 1 1 25 ASN HB2 H -5.284 2.518 -0.156 1.00 . A A . 522 ASN HB2 1 1 1 333 1 1 25 ASN HB3 H -4.501 3.863 0.663 1.00 . A A . 522 ASN HB3 1 1 1 334 1 1 25 ASN HD21 H -5.192 2.478 -2.495 1.00 . A A . 522 ASN HD21 1 1 1 335 1 1 25 ASN HD22 H -5.162 3.986 -3.355 1.00 . A A . 522 ASN HD22 1 1 1 336 1 1 25 ASN N N -2.174 3.029 -1.125 1.00 . A A . 522 ASN N 1 1 1 337 1 1 25 ASN ND2 N -5.043 3.455 -2.537 1.00 . A A . 522 ASN ND2 1 1 1 338 1 1 25 ASN O O -3.360 0.559 -1.672 1.00 . A A . 522 ASN O 1 1 1 339 1 1 25 ASN OD1 O -4.427 5.287 -1.415 1.00 . A A . 522 ASN OD1 1 1 1 340 1 1 26 TYR C C -5.221 -1.546 1.093 1.00 . A A . 523 TYR C 1 1 1 341 1 1 26 TYR CA C -3.890 -1.208 0.429 1.00 . A A . 523 TYR CA 1 1 1 342 1 1 26 TYR CB C -2.769 -2.009 1.106 1.00 . A A . 523 TYR CB 1 1 1 343 1 1 26 TYR CD1 C -0.875 -2.422 -0.520 1.00 . A A . 523 TYR CD1 1 1 1 344 1 1 26 TYR CD2 C -0.550 -0.801 1.198 1.00 . A A . 523 TYR CD2 1 1 1 345 1 1 26 TYR CE1 C 0.405 -2.186 -0.990 1.00 . A A . 523 TYR CE1 1 1 1 346 1 1 26 TYR CE2 C 0.731 -0.563 0.735 1.00 . A A . 523 TYR CE2 1 1 1 347 1 1 26 TYR CG C -1.374 -1.734 0.580 1.00 . A A . 523 TYR CG 1 1 1 348 1 1 26 TYR CZ C 1.202 -1.255 -0.360 1.00 . A A . 523 TYR CZ 1 1 1 349 1 1 26 TYR H H -3.721 0.651 1.419 1.00 . A A . 523 TYR H 1 1 1 350 1 1 26 TYR HA H -3.938 -1.462 -0.620 1.00 . A A . 523 TYR HA 1 1 1 351 1 1 26 TYR HB2 H -2.770 -1.784 2.163 1.00 . A A . 523 TYR HB2 1 1 1 352 1 1 26 TYR HB3 H -2.970 -3.063 0.974 1.00 . A A . 523 TYR HB3 1 1 1 353 1 1 26 TYR HD1 H -0.921 -0.256 2.054 1.00 . A A . 523 TYR HD1 1 1 1 354 1 1 26 TYR HD2 H -1.502 -3.150 -1.012 1.00 . A A . 523 TYR HD2 1 1 1 355 1 1 26 TYR HE1 H 1.356 0.166 1.228 1.00 . A A . 523 TYR HE1 1 1 1 356 1 1 26 TYR HE2 H 0.773 -2.728 -1.848 1.00 . A A . 523 TYR HE2 1 1 1 357 1 1 26 TYR HH H 2.541 -1.205 -1.760 1.00 . A A . 523 TYR HH 1 1 1 358 1 1 26 TYR N N -3.648 0.221 0.539 1.00 . A A . 523 TYR N 1 1 1 359 1 1 26 TYR O O -5.941 -0.650 1.534 1.00 . A A . 523 TYR O 1 1 1 360 1 1 26 TYR OH O 2.483 -1.025 -0.808 1.00 . A A . 523 TYR OH 1 1 1 361 1 1 27 CYS C C -6.457 -3.914 3.178 1.00 . A A . 524 CYS C 1 1 1 362 1 1 27 CYS CA C -6.767 -3.241 1.848 1.00 . A A . 524 CYS CA 1 1 1 363 1 1 27 CYS CB C -7.556 -4.183 0.932 1.00 . A A . 524 CYS CB 1 1 1 364 1 1 27 CYS H H -4.890 -3.509 0.926 1.00 . A A . 524 CYS H 1 1 1 365 1 1 27 CYS HA H -7.353 -2.360 2.036 1.00 . A A . 524 CYS HA 1 1 1 366 1 1 27 CYS HB2 H -8.538 -4.340 1.352 1.00 . A A . 524 CYS HB2 1 1 1 367 1 1 27 CYS HB3 H -7.657 -3.724 -0.041 1.00 . A A . 524 CYS HB3 1 1 1 368 1 1 27 CYS N N -5.528 -2.828 1.214 1.00 . A A . 524 CYS N 1 1 1 369 1 1 27 CYS O O -7.189 -3.767 4.158 1.00 . A A . 524 CYS O 1 1 1 370 1 1 27 CYS SG S -6.794 -5.818 0.696 1.00 . A A . 524 CYS SG 1 1 1 371 1 1 28 SER C C -3.389 -5.353 4.481 1.00 . A A . 525 SER C 1 1 1 372 1 1 28 SER CA C -4.912 -5.352 4.381 1.00 . A A . 525 SER CA 1 1 1 373 1 1 28 SER CB C -5.449 -6.781 4.310 1.00 . A A . 525 SER CB 1 1 1 374 1 1 28 SER H H -4.778 -4.657 2.404 1.00 . A A . 525 SER H 1 1 1 375 1 1 28 SER HA H -5.322 -4.861 5.251 1.00 . A A . 525 SER HA 1 1 1 376 1 1 28 SER HB2 H -4.897 -7.408 4.994 1.00 . A A . 525 SER HB2 1 1 1 377 1 1 28 SER HB3 H -6.495 -6.785 4.576 1.00 . A A . 525 SER HB3 1 1 1 378 1 1 28 SER HG H -5.870 -6.794 2.393 1.00 . A A . 525 SER HG 1 1 1 379 1 1 28 SER N N -5.337 -4.620 3.206 1.00 . A A . 525 SER N 1 1 1 380 1 1 28 SER O O -2.704 -4.900 3.559 1.00 . A A . 525 SER O 1 1 1 381 1 1 28 SER OG O -5.309 -7.303 3.000 1.00 . A A . 525 SER OG 1 1 1 382 1 1 29 THR C C -0.797 -6.939 4.833 1.00 . A A . 526 THR C 1 1 1 383 1 1 29 THR CA C -1.427 -5.929 5.790 1.00 . A A . 526 THR CA 1 1 1 384 1 1 29 THR CB C -1.100 -6.312 7.243 1.00 . A A . 526 THR CB 1 1 1 385 1 1 29 THR CG2 C 0.391 -6.196 7.525 1.00 . A A . 526 THR CG2 1 1 1 386 1 1 29 THR H H -3.460 -6.194 6.293 1.00 . A A . 526 THR H 1 1 1 387 1 1 29 THR HA H -1.011 -4.951 5.593 1.00 . A A . 526 THR HA 1 1 1 388 1 1 29 THR HB H -1.409 -7.334 7.411 1.00 . A A . 526 THR HB 1 1 1 389 1 1 29 THR HG1 H -2.039 -5.933 8.941 1.00 . A A . 526 THR HG1 1 1 1 390 1 1 29 THR HG21 H 0.705 -5.174 7.375 1.00 . A A . 526 THR HG21 1 1 1 391 1 1 29 THR HG22 H 0.589 -6.488 8.546 1.00 . A A . 526 THR HG22 1 1 1 392 1 1 29 THR HG23 H 0.936 -6.843 6.854 1.00 . A A . 526 THR HG23 1 1 1 393 1 1 29 THR N N -2.865 -5.856 5.588 1.00 . A A . 526 THR N 1 1 1 394 1 1 29 THR O O 0.376 -6.826 4.476 1.00 . A A . 526 THR O 1 1 1 395 1 1 29 THR OG1 O -1.819 -5.448 8.130 1.00 . A A . 526 THR OG1 1 1 1 396 1 1 30 PHE C C -0.687 -8.255 2.140 1.00 . A A . 527 PHE C 1 1 1 397 1 1 30 PHE CA C -1.127 -8.910 3.448 1.00 . A A . 527 PHE CA 1 1 1 398 1 1 30 PHE CB C -2.233 -9.936 3.183 1.00 . A A . 527 PHE CB 1 1 1 399 1 1 30 PHE CD1 C -1.013 -11.751 1.941 1.00 . A A . 527 PHE CD1 1 1 1 400 1 1 30 PHE CD2 C -2.778 -10.597 0.829 1.00 . A A . 527 PHE CD2 1 1 1 401 1 1 30 PHE CE1 C -0.803 -12.522 0.814 1.00 . A A . 527 PHE CE1 1 1 1 402 1 1 30 PHE CE2 C -2.574 -11.365 -0.300 1.00 . A A . 527 PHE CE2 1 1 1 403 1 1 30 PHE CG C -2.002 -10.780 1.960 1.00 . A A . 527 PHE CG 1 1 1 404 1 1 30 PHE CZ C -1.585 -12.328 -0.308 1.00 . A A . 527 PHE CZ 1 1 1 405 1 1 30 PHE H H -2.505 -7.976 4.754 1.00 . A A . 527 PHE H 1 1 1 406 1 1 30 PHE HA H -0.280 -9.415 3.886 1.00 . A A . 527 PHE HA 1 1 1 407 1 1 30 PHE HB2 H -2.309 -10.599 4.033 1.00 . A A . 527 PHE HB2 1 1 1 408 1 1 30 PHE HB3 H -3.172 -9.416 3.057 1.00 . A A . 527 PHE HB3 1 1 1 409 1 1 30 PHE HD1 H -0.402 -11.903 2.819 1.00 . A A . 527 PHE HD1 1 1 1 410 1 1 30 PHE HD2 H -3.551 -9.843 0.836 1.00 . A A . 527 PHE HD2 1 1 1 411 1 1 30 PHE HE1 H -0.028 -13.275 0.810 1.00 . A A . 527 PHE HE1 1 1 1 412 1 1 30 PHE HE2 H -3.186 -11.213 -1.175 1.00 . A A . 527 PHE HE2 1 1 1 413 1 1 30 PHE HZ H -1.422 -12.929 -1.190 1.00 . A A . 527 PHE HZ 1 1 1 414 1 1 30 PHE N N -1.591 -7.911 4.400 1.00 . A A . 527 PHE N 1 1 1 415 1 1 30 PHE O O 0.414 -8.519 1.653 1.00 . A A . 527 PHE O 1 1 1 416 1 1 31 CYS C C -0.008 -5.748 0.591 1.00 . A A . 528 CYS C 1 1 1 417 1 1 31 CYS CA C -1.176 -6.690 0.354 1.00 . A A . 528 CYS CA 1 1 1 418 1 1 31 CYS CB C -2.376 -5.946 -0.220 1.00 . A A . 528 CYS CB 1 1 1 419 1 1 31 CYS H H -2.389 -7.202 2.011 1.00 . A A . 528 CYS H 1 1 1 420 1 1 31 CYS HA H -0.862 -7.454 -0.343 1.00 . A A . 528 CYS HA 1 1 1 421 1 1 31 CYS HB2 H -2.789 -5.296 0.540 1.00 . A A . 528 CYS HB2 1 1 1 422 1 1 31 CYS HB3 H -2.060 -5.354 -1.066 1.00 . A A . 528 CYS HB3 1 1 1 423 1 1 31 CYS N N -1.527 -7.385 1.584 1.00 . A A . 528 CYS N 1 1 1 424 1 1 31 CYS O O 0.851 -5.581 -0.273 1.00 . A A . 528 CYS O 1 1 1 425 1 1 31 CYS SG S -3.697 -7.059 -0.781 1.00 . A A . 528 CYS SG 1 1 1 426 1 1 32 GLN C C 2.438 -5.004 2.098 1.00 . A A . 529 GLN C 1 1 1 427 1 1 32 GLN CA C 1.108 -4.257 2.148 1.00 . A A . 529 GLN CA 1 1 1 428 1 1 32 GLN CB C 0.869 -3.702 3.562 1.00 . A A . 529 GLN CB 1 1 1 429 1 1 32 GLN CD C 2.620 -1.940 4.060 1.00 . A A . 529 GLN CD 1 1 1 430 1 1 32 GLN CG C 2.143 -3.351 4.319 1.00 . A A . 529 GLN CG 1 1 1 431 1 1 32 GLN H H -0.689 -5.336 2.424 1.00 . A A . 529 GLN H 1 1 1 432 1 1 32 GLN HA H 1.124 -3.444 1.438 1.00 . A A . 529 GLN HA 1 1 1 433 1 1 32 GLN HB2 H 0.272 -2.802 3.486 1.00 . A A . 529 GLN HB2 1 1 1 434 1 1 32 GLN HB3 H 0.324 -4.436 4.137 1.00 . A A . 529 GLN HB3 1 1 1 435 1 1 32 GLN HE21 H 3.643 -2.530 2.459 1.00 . A A . 529 GLN HE21 1 1 1 436 1 1 32 GLN HE22 H 3.714 -0.839 2.824 1.00 . A A . 529 GLN HE22 1 1 1 437 1 1 32 GLN HG2 H 1.958 -3.461 5.377 1.00 . A A . 529 GLN HG2 1 1 1 438 1 1 32 GLN HG3 H 2.921 -4.038 4.021 1.00 . A A . 529 GLN HG3 1 1 1 439 1 1 32 GLN N N 0.021 -5.148 1.774 1.00 . A A . 529 GLN N 1 1 1 440 1 1 32 GLN NE2 N 3.407 -1.752 3.012 1.00 . A A . 529 GLN NE2 1 1 1 441 1 1 32 GLN O O 3.419 -4.518 1.530 1.00 . A A . 529 GLN O 1 1 1 442 1 1 32 GLN OE1 O 2.277 -1.023 4.802 1.00 . A A . 529 GLN OE1 1 1 1 443 1 1 33 ARG C C 4.052 -7.617 1.477 1.00 . A A . 530 ARG C 1 1 1 444 1 1 33 ARG CA C 3.680 -6.967 2.813 1.00 . A A . 530 ARG CA 1 1 1 445 1 1 33 ARG CB C 3.561 -8.013 3.922 1.00 . A A . 530 ARG CB 1 1 1 446 1 1 33 ARG CD C 4.746 -9.481 5.575 1.00 . A A . 530 ARG CD 1 1 1 447 1 1 33 ARG CG C 4.899 -8.565 4.375 1.00 . A A . 530 ARG CG 1 1 1 448 1 1 33 ARG CZ C 6.176 -10.567 7.261 1.00 . A A . 530 ARG CZ 1 1 1 449 1 1 33 ARG H H 1.628 -6.533 3.101 1.00 . A A . 530 ARG H 1 1 1 450 1 1 33 ARG HA H 4.461 -6.266 3.069 1.00 . A A . 530 ARG HA 1 1 1 451 1 1 33 ARG HB2 H 3.074 -7.562 4.775 1.00 . A A . 530 ARG HB2 1 1 1 452 1 1 33 ARG HB3 H 2.956 -8.835 3.565 1.00 . A A . 530 ARG HB3 1 1 1 453 1 1 33 ARG HD2 H 4.089 -9.009 6.291 1.00 . A A . 530 ARG HD2 1 1 1 454 1 1 33 ARG HD3 H 4.311 -10.413 5.247 1.00 . A A . 530 ARG HD3 1 1 1 455 1 1 33 ARG HE H 6.825 -9.291 5.855 1.00 . A A . 530 ARG HE 1 1 1 456 1 1 33 ARG HG2 H 5.340 -9.124 3.563 1.00 . A A . 530 ARG HG2 1 1 1 457 1 1 33 ARG HG3 H 5.546 -7.742 4.640 1.00 . A A . 530 ARG HG3 1 1 1 458 1 1 33 ARG HH11 H 4.221 -11.080 7.343 1.00 . A A . 530 ARG HH11 1 1 1 459 1 1 33 ARG HH12 H 5.228 -11.813 8.549 1.00 . A A . 530 ARG HH12 1 1 1 460 1 1 33 ARG HH21 H 8.176 -10.257 7.440 1.00 . A A . 530 ARG HH21 1 1 1 461 1 1 33 ARG HH22 H 7.474 -11.352 8.600 1.00 . A A . 530 ARG HH22 1 1 1 462 1 1 33 ARG N N 2.461 -6.182 2.713 1.00 . A A . 530 ARG N 1 1 1 463 1 1 33 ARG NE N 6.030 -9.756 6.218 1.00 . A A . 530 ARG NE 1 1 1 464 1 1 33 ARG NH1 N 5.124 -11.206 7.756 1.00 . A A . 530 ARG NH1 1 1 1 465 1 1 33 ARG NH2 N 7.370 -10.741 7.810 1.00 . A A . 530 ARG NH2 1 1 1 466 1 1 33 ARG O O 5.232 -7.730 1.151 1.00 . A A . 530 ARG O 1 1 1 467 1 1 34 LYS C C 3.925 -7.706 -1.570 1.00 . A A . 531 LYS C 1 1 1 468 1 1 34 LYS CA C 3.350 -8.707 -0.574 1.00 . A A . 531 LYS CA 1 1 1 469 1 1 34 LYS CB C 2.112 -9.436 -1.146 1.00 . A A . 531 LYS CB 1 1 1 470 1 1 34 LYS CD C 1.115 -7.882 -2.905 1.00 . A A . 531 LYS CD 1 1 1 471 1 1 34 LYS CE C 1.312 -8.886 -4.033 1.00 . A A . 531 LYS CE 1 1 1 472 1 1 34 LYS CG C 0.923 -8.560 -1.549 1.00 . A A . 531 LYS CG 1 1 1 473 1 1 34 LYS H H 2.128 -7.954 1.003 1.00 . A A . 531 LYS H 1 1 1 474 1 1 34 LYS HA H 4.115 -9.445 -0.375 1.00 . A A . 531 LYS HA 1 1 1 475 1 1 34 LYS HB2 H 2.419 -9.987 -2.018 1.00 . A A . 531 LYS HB2 1 1 1 476 1 1 34 LYS HB3 H 1.767 -10.136 -0.403 1.00 . A A . 531 LYS HB3 1 1 1 477 1 1 34 LYS HD2 H 0.242 -7.285 -3.121 1.00 . A A . 531 LYS HD2 1 1 1 478 1 1 34 LYS HD3 H 1.983 -7.241 -2.851 1.00 . A A . 531 LYS HD3 1 1 1 479 1 1 34 LYS HE2 H 1.675 -8.361 -4.904 1.00 . A A . 531 LYS HE2 1 1 1 480 1 1 34 LYS HE3 H 2.046 -9.615 -3.724 1.00 . A A . 531 LYS HE3 1 1 1 481 1 1 34 LYS HG2 H 0.040 -9.179 -1.598 1.00 . A A . 531 LYS HG2 1 1 1 482 1 1 34 LYS HG3 H 0.784 -7.800 -0.795 1.00 . A A . 531 LYS HG3 1 1 1 483 1 1 34 LYS HZ1 H -0.644 -8.914 -4.768 1.00 . A A . 531 LYS HZ1 1 1 1 484 1 1 34 LYS HZ2 H 0.243 -10.318 -5.114 1.00 . A A . 531 LYS HZ2 1 1 1 485 1 1 34 LYS HZ3 H -0.355 -10.057 -3.551 1.00 . A A . 531 LYS HZ3 1 1 1 486 1 1 34 LYS N N 3.060 -8.055 0.703 1.00 . A A . 531 LYS N 1 1 1 487 1 1 34 LYS NZ N 0.053 -9.592 -4.389 1.00 . A A . 531 LYS NZ 1 1 1 488 1 1 34 LYS O O 4.820 -8.033 -2.353 1.00 . A A . 531 LYS O 1 1 1 489 1 1 35 ASP C C 5.281 -4.948 -1.974 1.00 . A A . 532 ASP C 1 1 1 490 1 1 35 ASP CA C 3.894 -5.416 -2.398 1.00 . A A . 532 ASP CA 1 1 1 491 1 1 35 ASP CB C 2.918 -4.236 -2.372 1.00 . A A . 532 ASP CB 1 1 1 492 1 1 35 ASP CG C 3.179 -3.239 -3.486 1.00 . A A . 532 ASP CG 1 1 1 493 1 1 35 ASP H H 2.675 -6.297 -0.907 1.00 . A A . 532 ASP H 1 1 1 494 1 1 35 ASP HA H 3.943 -5.796 -3.407 1.00 . A A . 532 ASP HA 1 1 1 495 1 1 35 ASP HB2 H 1.910 -4.609 -2.476 1.00 . A A . 532 ASP HB2 1 1 1 496 1 1 35 ASP HB3 H 3.010 -3.723 -1.426 1.00 . A A . 532 ASP HB3 1 1 1 497 1 1 35 ASP N N 3.419 -6.484 -1.524 1.00 . A A . 532 ASP N 1 1 1 498 1 1 35 ASP O O 5.983 -4.295 -2.739 1.00 . A A . 532 ASP O 1 1 1 499 1 1 35 ASP OD1 O 3.108 -3.641 -4.668 1.00 . A A . 532 ASP OD1 1 1 1 500 1 1 35 ASP OD2 O 3.454 -2.057 -3.190 1.00 . A A . 532 ASP OD2 1 1 1 501 1 1 36 TRP C C 8.156 -5.228 -1.037 1.00 . A A . 533 TRP C 1 1 1 502 1 1 36 TRP CA C 6.941 -4.894 -0.174 1.00 . A A . 533 TRP CA 1 1 1 503 1 1 36 TRP CB C 7.118 -5.489 1.223 1.00 . A A . 533 TRP CB 1 1 1 504 1 1 36 TRP CD1 C 9.378 -5.444 2.427 1.00 . A A . 533 TRP CD1 1 1 1 505 1 1 36 TRP CD2 C 8.329 -3.467 2.350 1.00 . A A . 533 TRP CD2 1 1 1 506 1 1 36 TRP CE2 C 9.551 -3.298 3.020 1.00 . A A . 533 TRP CE2 1 1 1 507 1 1 36 TRP CE3 C 7.493 -2.358 2.179 1.00 . A A . 533 TRP CE3 1 1 1 508 1 1 36 TRP CG C 8.237 -4.847 1.979 1.00 . A A . 533 TRP CG 1 1 1 509 1 1 36 TRP CH2 C 9.128 -0.997 3.337 1.00 . A A . 533 TRP CH2 1 1 1 510 1 1 36 TRP CZ2 C 9.963 -2.067 3.517 1.00 . A A . 533 TRP CZ2 1 1 1 511 1 1 36 TRP CZ3 C 7.901 -1.136 2.676 1.00 . A A . 533 TRP CZ3 1 1 1 512 1 1 36 TRP H H 5.137 -5.994 -0.277 1.00 . A A . 533 TRP H 1 1 1 513 1 1 36 TRP HA H 6.880 -3.821 -0.063 1.00 . A A . 533 TRP HA 1 1 1 514 1 1 36 TRP HB2 H 6.208 -5.352 1.788 1.00 . A A . 533 TRP HB2 1 1 1 515 1 1 36 TRP HB3 H 7.331 -6.544 1.137 1.00 . A A . 533 TRP HB3 1 1 1 516 1 1 36 TRP HD1 H 9.606 -6.493 2.302 1.00 . A A . 533 TRP HD1 1 1 1 517 1 1 36 TRP HE1 H 11.054 -4.700 3.463 1.00 . A A . 533 TRP HE1 1 1 1 518 1 1 36 TRP HE3 H 6.543 -2.447 1.670 1.00 . A A . 533 TRP HE3 1 1 1 519 1 1 36 TRP HH2 H 9.409 -0.023 3.711 1.00 . A A . 533 TRP HH2 1 1 1 520 1 1 36 TRP HZ2 H 10.910 -1.945 4.021 1.00 . A A . 533 TRP HZ2 1 1 1 521 1 1 36 TRP HZ3 H 7.269 -0.268 2.553 1.00 . A A . 533 TRP HZ3 1 1 1 522 1 1 36 TRP N N 5.693 -5.358 -0.777 1.00 . A A . 533 TRP N 1 1 1 523 1 1 36 TRP NE1 N 10.174 -4.518 3.055 1.00 . A A . 533 TRP NE1 1 1 1 524 1 1 36 TRP O O 9.167 -4.543 -0.980 1.00 . A A . 533 TRP O 1 1 1 525 1 1 37 LYS C C 9.463 -5.584 -3.727 1.00 . A A . 534 LYS C 1 1 1 526 1 1 37 LYS CA C 9.153 -6.679 -2.711 1.00 . A A . 534 LYS CA 1 1 1 527 1 1 37 LYS CB C 8.848 -8.000 -3.422 1.00 . A A . 534 LYS CB 1 1 1 528 1 1 37 LYS CD C 8.451 -10.467 -3.254 1.00 . A A . 534 LYS CD 1 1 1 529 1 1 37 LYS CE C 8.156 -11.645 -2.340 1.00 . A A . 534 LYS CE 1 1 1 530 1 1 37 LYS CG C 8.569 -9.162 -2.483 1.00 . A A . 534 LYS CG 1 1 1 531 1 1 37 LYS H H 7.215 -6.771 -1.858 1.00 . A A . 534 LYS H 1 1 1 532 1 1 37 LYS HA H 10.052 -6.783 -2.123 1.00 . A A . 534 LYS HA 1 1 1 533 1 1 37 LYS HB2 H 7.985 -7.862 -4.054 1.00 . A A . 534 LYS HB2 1 1 1 534 1 1 37 LYS HB3 H 9.693 -8.263 -4.040 1.00 . A A . 534 LYS HB3 1 1 1 535 1 1 37 LYS HD2 H 7.652 -10.377 -3.975 1.00 . A A . 534 LYS HD2 1 1 1 536 1 1 37 LYS HD3 H 9.383 -10.650 -3.771 1.00 . A A . 534 LYS HD3 1 1 1 537 1 1 37 LYS HE2 H 8.255 -12.559 -2.907 1.00 . A A . 534 LYS HE2 1 1 1 538 1 1 37 LYS HE3 H 8.875 -11.644 -1.534 1.00 . A A . 534 LYS HE3 1 1 1 539 1 1 37 LYS HG2 H 9.380 -9.247 -1.775 1.00 . A A . 534 LYS HG2 1 1 1 540 1 1 37 LYS HG3 H 7.643 -8.976 -1.958 1.00 . A A . 534 LYS HG3 1 1 1 541 1 1 37 LYS HZ1 H 6.092 -11.369 -2.515 1.00 . A A . 534 LYS HZ1 1 1 1 542 1 1 37 LYS HZ2 H 6.540 -12.497 -1.323 1.00 . A A . 534 LYS HZ2 1 1 1 543 1 1 37 LYS HZ3 H 6.735 -10.834 -1.039 1.00 . A A . 534 LYS HZ3 1 1 1 544 1 1 37 LYS N N 8.053 -6.274 -1.838 1.00 . A A . 534 LYS N 1 1 1 545 1 1 37 LYS NZ N 6.787 -11.581 -1.766 1.00 . A A . 534 LYS NZ 1 1 1 546 1 1 37 LYS O O 10.624 -5.367 -4.065 1.00 . A A . 534 LYS O 1 1 1 547 1 1 38 ASP C C 8.724 -2.479 -4.179 1.00 . A A . 535 ASP C 1 1 1 548 1 1 38 ASP CA C 8.696 -3.715 -5.039 1.00 . A A . 535 ASP CA 1 1 1 549 1 1 38 ASP CB C 7.607 -3.542 -6.090 1.00 . A A . 535 ASP CB 1 1 1 550 1 1 38 ASP CG C 7.922 -2.433 -7.075 1.00 . A A . 535 ASP CG 1 1 1 551 1 1 38 ASP H H 7.531 -5.149 -3.992 1.00 . A A . 535 ASP H 1 1 1 552 1 1 38 ASP HA H 9.655 -3.849 -5.515 1.00 . A A . 535 ASP HA 1 1 1 553 1 1 38 ASP HB2 H 7.489 -4.453 -6.626 1.00 . A A . 535 ASP HB2 1 1 1 554 1 1 38 ASP HB3 H 6.677 -3.301 -5.596 1.00 . A A . 535 ASP HB3 1 1 1 555 1 1 38 ASP N N 8.452 -4.884 -4.204 1.00 . A A . 535 ASP N 1 1 1 556 1 1 38 ASP O O 9.529 -1.580 -4.348 1.00 . A A . 535 ASP O 1 1 1 557 1 1 38 ASP OD1 O 8.878 -2.591 -7.864 1.00 . A A . 535 ASP OD1 1 1 1 558 1 1 38 ASP OD2 O 7.210 -1.407 -7.079 1.00 . A A . 535 ASP OD2 1 1 1 559 1 1 39 HIS C C 8.771 -0.882 -1.629 1.00 . A A . 536 HIS C 1 1 1 560 1 1 39 HIS CA C 7.570 -1.285 -2.469 1.00 . A A . 536 HIS CA 1 1 1 561 1 1 39 HIS CB C 6.351 -1.509 -1.580 1.00 . A A . 536 HIS CB 1 1 1 562 1 1 39 HIS CD2 C 5.612 0.136 0.270 1.00 . A A . 536 HIS CD2 1 1 1 563 1 1 39 HIS CE1 C 4.812 1.716 -0.978 1.00 . A A . 536 HIS CE1 1 1 1 564 1 1 39 HIS CG C 5.775 -0.254 -1.019 1.00 . A A . 536 HIS CG 1 1 1 565 1 1 39 HIS H H 7.341 -3.280 -3.039 1.00 . A A . 536 HIS H 1 1 1 566 1 1 39 HIS HA H 7.354 -0.498 -3.183 1.00 . A A . 536 HIS HA 1 1 1 567 1 1 39 HIS HB2 H 5.581 -1.998 -2.157 1.00 . A A . 536 HIS HB2 1 1 1 568 1 1 39 HIS HB3 H 6.631 -2.146 -0.754 1.00 . A A . 536 HIS HB3 1 1 1 569 1 1 39 HIS HD1 H 5.206 0.764 -2.786 1.00 . A A . 536 HIS HD1 1 1 1 570 1 1 39 HIS HD2 H 5.905 -0.419 1.150 1.00 . A A . 536 HIS HD2 1 1 1 571 1 1 39 HIS HE1 H 4.372 2.650 -1.302 1.00 . A A . 536 HIS HE1 1 1 1 572 1 1 39 HIS N N 7.840 -2.466 -3.229 1.00 . A A . 536 HIS N 1 1 1 573 1 1 39 HIS ND1 N 5.261 0.760 -1.798 1.00 . A A . 536 HIS ND1 1 1 1 574 1 1 39 HIS NE2 N 4.997 1.375 0.274 1.00 . A A . 536 HIS NE2 1 1 1 575 1 1 39 HIS O O 8.989 0.293 -1.404 1.00 . A A . 536 HIS O 1 1 1 576 1 1 40 GLN C C 11.710 -0.649 -0.985 1.00 . A A . 537 GLN C 1 1 1 577 1 1 40 GLN CA C 10.685 -1.551 -0.296 1.00 . A A . 537 GLN CA 1 1 1 578 1 1 40 GLN CB C 11.359 -2.832 0.196 1.00 . A A . 537 GLN CB 1 1 1 579 1 1 40 GLN CD C 12.582 -4.949 -0.413 1.00 . A A . 537 GLN CD 1 1 1 580 1 1 40 GLN CG C 12.057 -3.617 -0.902 1.00 . A A . 537 GLN CG 1 1 1 581 1 1 40 GLN H H 9.357 -2.793 -1.415 1.00 . A A . 537 GLN H 1 1 1 582 1 1 40 GLN HA H 10.287 -1.009 0.549 1.00 . A A . 537 GLN HA 1 1 1 583 1 1 40 GLN HB2 H 12.092 -2.573 0.945 1.00 . A A . 537 GLN HB2 1 1 1 584 1 1 40 GLN HB3 H 10.610 -3.470 0.643 1.00 . A A . 537 GLN HB3 1 1 1 585 1 1 40 GLN HE21 H 10.848 -5.812 -0.837 1.00 . A A . 537 GLN HE21 1 1 1 586 1 1 40 GLN HE22 H 12.066 -6.850 -0.184 1.00 . A A . 537 GLN HE22 1 1 1 587 1 1 40 GLN HG2 H 11.359 -3.790 -1.715 1.00 . A A . 537 GLN HG2 1 1 1 588 1 1 40 GLN HG3 H 12.888 -3.029 -1.260 1.00 . A A . 537 GLN HG3 1 1 1 589 1 1 40 GLN N N 9.553 -1.853 -1.172 1.00 . A A . 537 GLN N 1 1 1 590 1 1 40 GLN NE2 N 11.749 -5.973 -0.482 1.00 . A A . 537 GLN NE2 1 1 1 591 1 1 40 GLN O O 12.351 0.171 -0.330 1.00 . A A . 537 GLN O 1 1 1 592 1 1 40 GLN OE1 O 13.721 -5.053 0.041 1.00 . A A . 537 GLN OE1 1 1 1 593 1 1 41 HIS C C 12.213 1.415 -3.320 1.00 . A A . 538 HIS C 1 1 1 594 1 1 41 HIS CA C 12.825 0.050 -3.014 1.00 . A A . 538 HIS CA 1 1 1 595 1 1 41 HIS CB C 13.369 -0.622 -4.298 1.00 . A A . 538 HIS CB 1 1 1 596 1 1 41 HIS CD2 C 11.653 -1.587 -5.973 1.00 . A A . 538 HIS CD2 1 1 1 597 1 1 41 HIS CE1 C 11.488 0.161 -7.257 1.00 . A A . 538 HIS CE1 1 1 1 598 1 1 41 HIS CG C 12.452 -0.609 -5.492 1.00 . A A . 538 HIS CG 1 1 1 599 1 1 41 HIS H H 11.391 -1.505 -2.770 1.00 . A A . 538 HIS H 1 1 1 600 1 1 41 HIS HA H 13.660 0.222 -2.349 1.00 . A A . 538 HIS HA 1 1 1 601 1 1 41 HIS HB2 H 14.279 -0.123 -4.588 1.00 . A A . 538 HIS HB2 1 1 1 602 1 1 41 HIS HB3 H 13.599 -1.655 -4.073 1.00 . A A . 538 HIS HB3 1 1 1 603 1 1 41 HIS HD2 H 11.472 -2.551 -5.523 1.00 . A A . 538 HIS HD2 1 1 1 604 1 1 41 HIS HE1 H 11.159 0.827 -8.041 1.00 . A A . 538 HIS HE1 1 1 1 605 1 1 41 HIS HE2 H 10.240 -1.473 -7.530 1.00 . A A . 538 HIS HE2 1 1 1 606 1 1 41 HIS N N 11.880 -0.799 -2.296 1.00 . A A . 538 HIS N 1 1 1 607 1 1 41 HIS ND1 N 12.345 0.493 -6.307 1.00 . A A . 538 HIS ND1 1 1 1 608 1 1 41 HIS NE2 N 11.044 -1.091 -7.099 1.00 . A A . 538 HIS NE2 1 1 1 609 1 1 41 HIS O O 12.941 2.379 -3.565 1.00 . A A . 538 HIS O 1 1 1 610 1 1 42 ILE C C 9.956 3.539 -2.251 1.00 . A A . 539 ILE C 1 1 1 611 1 1 42 ILE CA C 10.224 2.784 -3.562 1.00 . A A . 539 ILE CA 1 1 1 612 1 1 42 ILE CB C 8.910 2.588 -4.396 1.00 . A A . 539 ILE CB 1 1 1 613 1 1 42 ILE CD1 C 6.959 3.723 -3.186 1.00 . A A . 539 ILE CD1 1 1 1 614 1 1 42 ILE CG1 C 7.650 2.418 -3.537 1.00 . A A . 539 ILE CG1 1 1 1 615 1 1 42 ILE CG2 C 9.047 1.394 -5.321 1.00 . A A . 539 ILE CG2 1 1 1 616 1 1 42 ILE H H 10.336 0.705 -3.149 1.00 . A A . 539 ILE H 1 1 1 617 1 1 42 ILE HA H 10.904 3.377 -4.156 1.00 . A A . 539 ILE HA 1 1 1 618 1 1 42 ILE HB H 8.787 3.450 -5.017 1.00 . A A . 539 ILE HB 1 1 1 619 1 1 42 ILE HD11 H 6.646 4.217 -4.092 1.00 . A A . 539 ILE HD11 1 1 1 620 1 1 42 ILE HD12 H 6.096 3.519 -2.572 1.00 . A A . 539 ILE HD12 1 1 1 621 1 1 42 ILE HD13 H 7.645 4.360 -2.646 1.00 . A A . 539 ILE HD13 1 1 1 622 1 1 42 ILE HG12 H 6.942 1.811 -4.073 1.00 . A A . 539 ILE HG12 1 1 1 623 1 1 42 ILE HG13 H 7.914 1.924 -2.615 1.00 . A A . 539 ILE HG13 1 1 1 624 1 1 42 ILE HG21 H 9.283 0.512 -4.741 1.00 . A A . 539 ILE HG21 1 1 1 625 1 1 42 ILE HG22 H 8.118 1.239 -5.850 1.00 . A A . 539 ILE HG22 1 1 1 626 1 1 42 ILE HG23 H 9.840 1.578 -6.032 1.00 . A A . 539 ILE HG23 1 1 1 627 1 1 42 ILE N N 10.884 1.509 -3.302 1.00 . A A . 539 ILE N 1 1 1 628 1 1 42 ILE O O 10.228 4.740 -2.145 1.00 . A A . 539 ILE O 1 1 1 629 1 1 43 CYS C C 10.263 4.073 0.655 1.00 . A A . 540 CYS C 1 1 1 630 1 1 43 CYS CA C 9.050 3.404 0.009 1.00 . A A . 540 CYS CA 1 1 1 631 1 1 43 CYS CB C 8.520 2.299 0.925 1.00 . A A . 540 CYS CB 1 1 1 632 1 1 43 CYS H H 9.224 1.867 -1.419 1.00 . A A . 540 CYS H 1 1 1 633 1 1 43 CYS HA H 8.266 4.133 -0.125 1.00 . A A . 540 CYS HA 1 1 1 634 1 1 43 CYS HB2 H 7.933 1.607 0.340 1.00 . A A . 540 CYS HB2 1 1 1 635 1 1 43 CYS HB3 H 9.356 1.772 1.362 1.00 . A A . 540 CYS HB3 1 1 1 636 1 1 43 CYS N N 9.407 2.825 -1.272 1.00 . A A . 540 CYS N 1 1 1 637 1 1 43 CYS O O 11.289 3.439 0.912 1.00 . A A . 540 CYS O 1 1 1 638 1 1 43 CYS SG S 7.471 2.896 2.288 1.00 . A A . 540 CYS SG 1 1 1 639 1 1 44 GLY C C 11.283 7.510 0.851 1.00 . A A . 541 GLY C 1 1 1 640 1 1 44 GLY CA C 11.223 6.126 1.439 1.00 . A A . 541 GLY CA 1 1 1 641 1 1 44 GLY H H 9.235 5.773 0.757 1.00 . A A . 541 GLY H 1 1 1 642 1 1 44 GLY HA2 H 11.103 6.202 2.510 1.00 . A A . 541 GLY HA2 1 1 1 643 1 1 44 GLY HA3 H 12.148 5.612 1.223 1.00 . A A . 541 GLY HA3 1 1 1 644 1 1 44 GLY N N 10.122 5.358 0.898 1.00 . A A . 541 GLY N 1 1 1 645 1 1 44 GLY O O 11.576 8.479 1.550 1.00 . A A . 541 GLY O 1 1 1 646 1 1 45 GLN C C 9.580 9.508 -0.687 1.00 . A A . 542 GLN C 1 1 1 647 1 1 45 GLN CA C 10.911 8.892 -1.087 1.00 . A A . 542 GLN CA 1 1 1 648 1 1 45 GLN CB C 11.015 8.750 -2.607 1.00 . A A . 542 GLN CB 1 1 1 649 1 1 45 GLN CD C 13.532 9.025 -2.669 1.00 . A A . 542 GLN CD 1 1 1 650 1 1 45 GLN CG C 12.343 8.175 -3.075 1.00 . A A . 542 GLN CG 1 1 1 651 1 1 45 GLN H H 10.917 6.774 -0.967 1.00 . A A . 542 GLN H 1 1 1 652 1 1 45 GLN HA H 11.711 9.521 -0.727 1.00 . A A . 542 GLN HA 1 1 1 653 1 1 45 GLN HB2 H 10.225 8.099 -2.951 1.00 . A A . 542 GLN HB2 1 1 1 654 1 1 45 GLN HB3 H 10.890 9.722 -3.057 1.00 . A A . 542 GLN HB3 1 1 1 655 1 1 45 GLN HE21 H 13.714 8.013 -0.973 1.00 . A A . 542 GLN HE21 1 1 1 656 1 1 45 GLN HE22 H 14.866 9.275 -1.222 1.00 . A A . 542 GLN HE22 1 1 1 657 1 1 45 GLN HG2 H 12.464 7.191 -2.646 1.00 . A A . 542 GLN HG2 1 1 1 658 1 1 45 GLN HG3 H 12.326 8.097 -4.152 1.00 . A A . 542 GLN HG3 1 1 1 659 1 1 45 GLN N N 11.032 7.598 -0.441 1.00 . A A . 542 GLN N 1 1 1 660 1 1 45 GLN NE2 N 14.092 8.744 -1.505 1.00 . A A . 542 GLN NE2 1 1 1 661 1 1 45 GLN O O 9.546 10.421 0.143 1.00 . A A . 542 GLN O 1 1 1 662 1 1 45 GLN OE1 O 13.947 9.924 -3.397 1.00 . A A . 542 GLN OE1 1 1 1 663 1 1 46 SER C C 6.610 10.614 -1.477 1.00 . A A . 543 SER C 1 1 1 664 1 1 46 SER CA C 7.139 9.318 -0.884 1.00 . A A . 543 SER CA 1 1 1 665 1 1 46 SER CB C 7.040 9.317 0.649 1.00 . A A . 543 SER CB 1 1 1 666 1 1 46 SER H H 8.634 8.624 -2.200 1.00 . A A . 543 SER H 1 1 1 667 1 1 46 SER HA H 6.529 8.510 -1.264 1.00 . A A . 543 SER HA 1 1 1 668 1 1 46 SER HB2 H 7.602 10.149 1.044 1.00 . A A . 543 SER HB2 1 1 1 669 1 1 46 SER HB3 H 6.004 9.410 0.943 1.00 . A A . 543 SER HB3 1 1 1 670 1 1 46 SER HG H 7.400 8.089 2.136 1.00 . A A . 543 SER HG 1 1 1 671 1 1 46 SER N N 8.506 9.066 -1.338 1.00 . A A . 543 SER N 1 1 1 672 1 1 46 SER O O 6.278 11.571 -0.770 1.00 . A A . 543 SER O 1 1 1 673 1 1 46 SER OG O 7.565 8.113 1.188 1.00 . A A . 543 SER OG 1 1 1 674 1 1 47 ALA C C 5.343 11.163 -4.798 1.00 . A A . 544 ALA C 1 1 1 675 1 1 47 ALA CA C 6.000 11.725 -3.550 1.00 . A A . 544 ALA CA 1 1 1 676 1 1 47 ALA CB C 7.077 12.737 -3.910 1.00 . A A . 544 ALA CB 1 1 1 677 1 1 47 ALA H H 6.914 9.859 -3.290 1.00 . A A . 544 ALA H 1 1 1 678 1 1 47 ALA HA H 5.252 12.213 -2.939 1.00 . A A . 544 ALA HA 1 1 1 679 1 1 47 ALA HB1 H 7.826 12.260 -4.524 1.00 . A A . 544 ALA HB1 1 1 1 680 1 1 47 ALA HB2 H 6.634 13.557 -4.454 1.00 . A A . 544 ALA HB2 1 1 1 681 1 1 47 ALA HB3 H 7.537 13.110 -3.006 1.00 . A A . 544 ALA HB3 1 1 1 682 1 1 47 ALA N N 6.558 10.626 -2.796 1.00 . A A . 544 ALA N 1 1 1 683 1 1 47 ALA O O 4.213 11.570 -5.118 1.00 . A A . 544 ALA O 1 1 1 684 1 1 47 ALA OXT O 5.945 10.255 -5.412 1.00 . A A . 544 ALA OXT 1 1 1 685 2 2 1 ZN ZN ZN -5.577 -5.871 -1.234 1.00 . B A . 601 ZN ZN 1 1 1 686 3 2 1 ZN ZN ZN 5.248 2.715 1.700 1.00 . C A . 602 ZN ZN 1 1 2 687 1 1 1 GLY C C -14.197 3.628 4.907 1.00 . A A . 498 GLY C 1 1 2 688 1 1 1 GLY CA C -15.091 4.636 5.601 1.00 . A A . 498 GLY CA 1 1 2 689 1 1 1 GLY H1 H -15.309 5.878 3.941 1.00 . A A . 498 GLY H1 1 1 2 690 1 1 1 GLY H2 H -16.477 6.128 5.148 1.00 . A A . 498 GLY H2 1 1 2 691 1 1 1 GLY H3 H -16.574 4.767 4.142 1.00 . A A . 498 GLY H3 1 1 2 692 1 1 1 GLY HA2 H -14.473 5.324 6.159 1.00 . A A . 498 GLY HA2 1 1 2 693 1 1 1 GLY HA3 H -15.740 4.113 6.287 1.00 . A A . 498 GLY HA3 1 1 2 694 1 1 1 GLY N N -15.921 5.406 4.643 1.00 . A A . 498 GLY N 1 1 2 695 1 1 1 GLY O O -13.087 3.356 5.364 1.00 . A A . 498 GLY O 1 1 2 696 1 1 2 ALA C C -14.087 2.272 1.553 1.00 . A A . 499 ALA C 1 1 2 697 1 1 2 ALA CA C -13.916 2.082 3.058 1.00 . A A . 499 ALA CA 1 1 2 698 1 1 2 ALA CB C -14.346 0.684 3.477 1.00 . A A . 499 ALA CB 1 1 2 699 1 1 2 ALA H H -15.564 3.338 3.470 1.00 . A A . 499 ALA H 1 1 2 700 1 1 2 ALA HA H -12.872 2.204 3.309 1.00 . A A . 499 ALA HA 1 1 2 701 1 1 2 ALA HB1 H -15.383 0.533 3.219 1.00 . A A . 499 ALA HB1 1 1 2 702 1 1 2 ALA HB2 H -13.737 -0.049 2.967 1.00 . A A . 499 ALA HB2 1 1 2 703 1 1 2 ALA HB3 H -14.221 0.576 4.545 1.00 . A A . 499 ALA HB3 1 1 2 704 1 1 2 ALA N N -14.674 3.076 3.797 1.00 . A A . 499 ALA N 1 1 2 705 1 1 2 ALA O O -13.992 1.320 0.782 1.00 . A A . 499 ALA O 1 1 2 706 1 1 3 MET C C -13.591 4.906 -0.734 1.00 . A A . 500 MET C 1 1 2 707 1 1 3 MET CA C -14.528 3.799 -0.280 1.00 . A A . 500 MET CA 1 1 2 708 1 1 3 MET CB C -15.979 4.197 -0.568 1.00 . A A . 500 MET CB 1 1 2 709 1 1 3 MET CE C -18.508 4.036 -2.474 1.00 . A A . 500 MET CE 1 1 2 710 1 1 3 MET CG C -16.972 3.062 -0.379 1.00 . A A . 500 MET CG 1 1 2 711 1 1 3 MET H H -14.397 4.238 1.794 1.00 . A A . 500 MET H 1 1 2 712 1 1 3 MET HA H -14.297 2.902 -0.834 1.00 . A A . 500 MET HA 1 1 2 713 1 1 3 MET HB2 H -16.257 5.006 0.091 1.00 . A A . 500 MET HB2 1 1 2 714 1 1 3 MET HB3 H -16.049 4.539 -1.591 1.00 . A A . 500 MET HB3 1 1 2 715 1 1 3 MET HE1 H -18.164 3.197 -3.060 1.00 . A A . 500 MET HE1 1 1 2 716 1 1 3 MET HE2 H -19.466 4.367 -2.847 1.00 . A A . 500 MET HE2 1 1 2 717 1 1 3 MET HE3 H -17.794 4.845 -2.551 1.00 . A A . 500 MET HE3 1 1 2 718 1 1 3 MET HG2 H -16.691 2.245 -1.029 1.00 . A A . 500 MET HG2 1 1 2 719 1 1 3 MET HG3 H -16.927 2.733 0.649 1.00 . A A . 500 MET HG3 1 1 2 720 1 1 3 MET N N -14.341 3.505 1.136 1.00 . A A . 500 MET N 1 1 2 721 1 1 3 MET O O -13.336 5.070 -1.928 1.00 . A A . 500 MET O 1 1 2 722 1 1 3 MET SD S -18.669 3.544 -0.758 1.00 . A A . 500 MET SD 1 1 2 723 1 1 4 GLU C C -10.896 6.362 -0.694 1.00 . A A . 501 GLU C 1 1 2 724 1 1 4 GLU CA C -12.208 6.798 -0.050 1.00 . A A . 501 GLU CA 1 1 2 725 1 1 4 GLU CB C -11.895 7.580 1.232 1.00 . A A . 501 GLU CB 1 1 2 726 1 1 4 GLU CD C -13.497 6.774 3.020 1.00 . A A . 501 GLU CD 1 1 2 727 1 1 4 GLU CG C -13.111 7.907 2.086 1.00 . A A . 501 GLU CG 1 1 2 728 1 1 4 GLU H H -13.283 5.439 1.167 1.00 . A A . 501 GLU H 1 1 2 729 1 1 4 GLU HA H -12.733 7.446 -0.735 1.00 . A A . 501 GLU HA 1 1 2 730 1 1 4 GLU HB2 H -11.211 6.997 1.832 1.00 . A A . 501 GLU HB2 1 1 2 731 1 1 4 GLU HB3 H -11.414 8.509 0.961 1.00 . A A . 501 GLU HB3 1 1 2 732 1 1 4 GLU HG2 H -12.893 8.782 2.680 1.00 . A A . 501 GLU HG2 1 1 2 733 1 1 4 GLU HG3 H -13.946 8.116 1.433 1.00 . A A . 501 GLU HG3 1 1 2 734 1 1 4 GLU N N -13.067 5.653 0.231 1.00 . A A . 501 GLU N 1 1 2 735 1 1 4 GLU O O -10.245 7.138 -1.395 1.00 . A A . 501 GLU O 1 1 2 736 1 1 4 GLU OE1 O -14.277 5.889 2.608 1.00 . A A . 501 GLU OE1 1 1 2 737 1 1 4 GLU OE2 O -13.018 6.758 4.171 1.00 . A A . 501 GLU OE2 1 1 2 738 1 1 5 GLN C C -9.407 3.308 -1.691 1.00 . A A . 502 GLN C 1 1 2 739 1 1 5 GLN CA C -9.236 4.625 -0.948 1.00 . A A . 502 GLN CA 1 1 2 740 1 1 5 GLN CB C -8.254 4.469 0.214 1.00 . A A . 502 GLN CB 1 1 2 741 1 1 5 GLN CD C -7.831 3.585 2.528 1.00 . A A . 502 GLN CD 1 1 2 742 1 1 5 GLN CG C -8.790 3.634 1.361 1.00 . A A . 502 GLN CG 1 1 2 743 1 1 5 GLN H H -11.117 4.508 0.006 1.00 . A A . 502 GLN H 1 1 2 744 1 1 5 GLN HA H -8.849 5.358 -1.634 1.00 . A A . 502 GLN HA 1 1 2 745 1 1 5 GLN HB2 H -7.352 4.000 -0.151 1.00 . A A . 502 GLN HB2 1 1 2 746 1 1 5 GLN HB3 H -8.008 5.449 0.594 1.00 . A A . 502 GLN HB3 1 1 2 747 1 1 5 GLN HE21 H -8.643 5.232 3.269 1.00 . A A . 502 GLN HE21 1 1 2 748 1 1 5 GLN HE22 H -7.340 4.553 4.184 1.00 . A A . 502 GLN HE22 1 1 2 749 1 1 5 GLN HG2 H -9.721 4.063 1.698 1.00 . A A . 502 GLN HG2 1 1 2 750 1 1 5 GLN HG3 H -8.959 2.627 1.009 1.00 . A A . 502 GLN HG3 1 1 2 751 1 1 5 GLN N N -10.514 5.117 -0.468 1.00 . A A . 502 GLN N 1 1 2 752 1 1 5 GLN NE2 N -7.948 4.552 3.416 1.00 . A A . 502 GLN NE2 1 1 2 753 1 1 5 GLN O O -10.354 2.564 -1.445 1.00 . A A . 502 GLN O 1 1 2 754 1 1 5 GLN OE1 O -6.988 2.695 2.620 1.00 . A A . 502 GLN OE1 1 1 2 755 1 1 6 SER C C -7.178 1.099 -3.284 1.00 . A A . 503 SER C 1 1 2 756 1 1 6 SER CA C -8.526 1.809 -3.389 1.00 . A A . 503 SER CA 1 1 2 757 1 1 6 SER CB C -8.853 2.124 -4.850 1.00 . A A . 503 SER CB 1 1 2 758 1 1 6 SER H H -7.786 3.697 -2.790 1.00 . A A . 503 SER H 1 1 2 759 1 1 6 SER HA H -9.296 1.171 -2.980 1.00 . A A . 503 SER HA 1 1 2 760 1 1 6 SER HB2 H -8.032 2.667 -5.291 1.00 . A A . 503 SER HB2 1 1 2 761 1 1 6 SER HB3 H -9.009 1.200 -5.390 1.00 . A A . 503 SER HB3 1 1 2 762 1 1 6 SER HG H -9.857 3.800 -4.578 1.00 . A A . 503 SER HG 1 1 2 763 1 1 6 SER N N -8.499 3.041 -2.617 1.00 . A A . 503 SER N 1 1 2 764 1 1 6 SER O O -6.137 1.702 -3.531 1.00 . A A . 503 SER O 1 1 2 765 1 1 6 SER OG O -10.029 2.917 -4.948 1.00 . A A . 503 SER OG 1 1 2 766 1 1 7 CYS C C -5.129 -0.984 -3.928 1.00 . A A . 504 CYS C 1 1 2 767 1 1 7 CYS CA C -5.979 -0.936 -2.667 1.00 . A A . 504 CYS CA 1 1 2 768 1 1 7 CYS CB C -6.316 -2.349 -2.197 1.00 . A A . 504 CYS CB 1 1 2 769 1 1 7 CYS H H -8.069 -0.643 -2.854 1.00 . A A . 504 CYS H 1 1 2 770 1 1 7 CYS HA H -5.427 -0.432 -1.886 1.00 . A A . 504 CYS HA 1 1 2 771 1 1 7 CYS HB2 H -7.035 -2.289 -1.395 1.00 . A A . 504 CYS HB2 1 1 2 772 1 1 7 CYS HB3 H -6.751 -2.899 -3.021 1.00 . A A . 504 CYS HB3 1 1 2 773 1 1 7 CYS N N -7.202 -0.182 -2.922 1.00 . A A . 504 CYS N 1 1 2 774 1 1 7 CYS O O -5.594 -1.417 -4.987 1.00 . A A . 504 CYS O 1 1 2 775 1 1 7 CYS SG S -4.901 -3.311 -1.584 1.00 . A A . 504 CYS SG 1 1 2 776 1 1 8 VAL C C -2.600 -1.868 -5.406 1.00 . A A . 505 VAL C 1 1 2 777 1 1 8 VAL CA C -2.979 -0.464 -4.935 1.00 . A A . 505 VAL CA 1 1 2 778 1 1 8 VAL CB C -1.706 0.345 -4.581 1.00 . A A . 505 VAL CB 1 1 2 779 1 1 8 VAL CG1 C -0.891 -0.354 -3.506 1.00 . A A . 505 VAL CG1 1 1 2 780 1 1 8 VAL CG2 C -0.859 0.604 -5.822 1.00 . A A . 505 VAL CG2 1 1 2 781 1 1 8 VAL H H -3.603 -0.159 -2.936 1.00 . A A . 505 VAL H 1 1 2 782 1 1 8 VAL HA H -3.482 0.046 -5.744 1.00 . A A . 505 VAL HA 1 1 2 783 1 1 8 VAL HB H -2.019 1.299 -4.185 1.00 . A A . 505 VAL HB 1 1 2 784 1 1 8 VAL HG11 H -0.575 -1.323 -3.864 1.00 . A A . 505 VAL HG11 1 1 2 785 1 1 8 VAL HG12 H -0.024 0.244 -3.269 1.00 . A A . 505 VAL HG12 1 1 2 786 1 1 8 VAL HG13 H -1.497 -0.478 -2.621 1.00 . A A . 505 VAL HG13 1 1 2 787 1 1 8 VAL HG21 H -1.436 1.171 -6.536 1.00 . A A . 505 VAL HG21 1 1 2 788 1 1 8 VAL HG22 H 0.022 1.164 -5.546 1.00 . A A . 505 VAL HG22 1 1 2 789 1 1 8 VAL HG23 H -0.565 -0.337 -6.262 1.00 . A A . 505 VAL HG23 1 1 2 790 1 1 8 VAL N N -3.896 -0.517 -3.808 1.00 . A A . 505 VAL N 1 1 2 791 1 1 8 VAL O O -2.160 -2.056 -6.538 1.00 . A A . 505 VAL O 1 1 2 792 1 1 9 ASN C C -3.619 -5.007 -5.456 1.00 . A A . 506 ASN C 1 1 2 793 1 1 9 ASN CA C -2.433 -4.224 -4.902 1.00 . A A . 506 ASN CA 1 1 2 794 1 1 9 ASN CB C -1.811 -4.964 -3.715 1.00 . A A . 506 ASN CB 1 1 2 795 1 1 9 ASN CG C -1.460 -6.402 -4.067 1.00 . A A . 506 ASN CG 1 1 2 796 1 1 9 ASN H H -3.202 -2.680 -3.671 1.00 . A A . 506 ASN H 1 1 2 797 1 1 9 ASN HA H -1.688 -4.155 -5.683 1.00 . A A . 506 ASN HA 1 1 2 798 1 1 9 ASN HB2 H -0.908 -4.454 -3.410 1.00 . A A . 506 ASN HB2 1 1 2 799 1 1 9 ASN HB3 H -2.513 -4.971 -2.892 1.00 . A A . 506 ASN HB3 1 1 2 800 1 1 9 ASN HD21 H -3.158 -7.038 -3.256 1.00 . A A . 506 ASN HD21 1 1 2 801 1 1 9 ASN HD22 H -2.160 -8.261 -3.965 1.00 . A A . 506 ASN HD22 1 1 2 802 1 1 9 ASN N N -2.799 -2.864 -4.549 1.00 . A A . 506 ASN N 1 1 2 803 1 1 9 ASN ND2 N -2.342 -7.327 -3.725 1.00 . A A . 506 ASN ND2 1 1 2 804 1 1 9 ASN O O -3.462 -5.757 -6.420 1.00 . A A . 506 ASN O 1 1 2 805 1 1 9 ASN OD1 O -0.396 -6.681 -4.619 1.00 . A A . 506 ASN OD1 1 1 2 806 1 1 10 CYS C C -7.104 -4.742 -5.862 1.00 . A A . 507 CYS C 1 1 2 807 1 1 10 CYS CA C -5.944 -5.620 -5.352 1.00 . A A . 507 CYS CA 1 1 2 808 1 1 10 CYS CB C -6.396 -6.636 -4.285 1.00 . A A . 507 CYS CB 1 1 2 809 1 1 10 CYS H H -4.928 -4.180 -4.168 1.00 . A A . 507 CYS H 1 1 2 810 1 1 10 CYS HA H -5.584 -6.183 -6.202 1.00 . A A . 507 CYS HA 1 1 2 811 1 1 10 CYS HB2 H -7.114 -7.305 -4.730 1.00 . A A . 507 CYS HB2 1 1 2 812 1 1 10 CYS HB3 H -5.535 -7.211 -3.971 1.00 . A A . 507 CYS HB3 1 1 2 813 1 1 10 CYS N N -4.812 -4.834 -4.887 1.00 . A A . 507 CYS N 1 1 2 814 1 1 10 CYS O O -7.298 -4.643 -7.076 1.00 . A A . 507 CYS O 1 1 2 815 1 1 10 CYS SG S -7.172 -5.948 -2.786 1.00 . A A . 507 CYS SG 1 1 2 816 1 1 11 GLY C C -9.579 -2.383 -4.369 1.00 . A A . 508 GLY C 1 1 2 817 1 1 11 GLY CA C -9.004 -3.309 -5.429 1.00 . A A . 508 GLY CA 1 1 2 818 1 1 11 GLY H H -7.621 -4.123 -4.016 1.00 . A A . 508 GLY H 1 1 2 819 1 1 11 GLY HA2 H -8.706 -2.714 -6.279 1.00 . A A . 508 GLY HA2 1 1 2 820 1 1 11 GLY HA3 H -9.777 -3.995 -5.744 1.00 . A A . 508 GLY HA3 1 1 2 821 1 1 11 GLY N N -7.851 -4.084 -4.974 1.00 . A A . 508 GLY N 1 1 2 822 1 1 11 GLY O O -8.967 -2.174 -3.330 1.00 . A A . 508 GLY O 1 1 2 823 1 1 12 ARG C C -11.617 -1.369 -2.307 1.00 . A A . 509 ARG C 1 1 2 824 1 1 12 ARG CA C -11.453 -0.871 -3.748 1.00 . A A . 509 ARG CA 1 1 2 825 1 1 12 ARG CB C -12.844 -0.552 -4.297 1.00 . A A . 509 ARG CB 1 1 2 826 1 1 12 ARG CD C -15.231 -1.307 -4.553 1.00 . A A . 509 ARG CD 1 1 2 827 1 1 12 ARG CG C -13.835 -1.687 -4.099 1.00 . A A . 509 ARG CG 1 1 2 828 1 1 12 ARG CZ C -17.169 -2.761 -5.027 1.00 . A A . 509 ARG CZ 1 1 2 829 1 1 12 ARG H H -11.162 -1.972 -5.533 1.00 . A A . 509 ARG H 1 1 2 830 1 1 12 ARG HA H -10.875 0.039 -3.736 1.00 . A A . 509 ARG HA 1 1 2 831 1 1 12 ARG HB2 H -13.226 0.325 -3.794 1.00 . A A . 509 ARG HB2 1 1 2 832 1 1 12 ARG HB3 H -12.767 -0.349 -5.354 1.00 . A A . 509 ARG HB3 1 1 2 833 1 1 12 ARG HD2 H -15.510 -0.377 -4.079 1.00 . A A . 509 ARG HD2 1 1 2 834 1 1 12 ARG HD3 H -15.225 -1.178 -5.625 1.00 . A A . 509 ARG HD3 1 1 2 835 1 1 12 ARG HE H -16.169 -2.704 -3.291 1.00 . A A . 509 ARG HE 1 1 2 836 1 1 12 ARG HG2 H -13.505 -2.544 -4.668 1.00 . A A . 509 ARG HG2 1 1 2 837 1 1 12 ARG HG3 H -13.868 -1.943 -3.050 1.00 . A A . 509 ARG HG3 1 1 2 838 1 1 12 ARG HH11 H -16.498 -1.713 -6.627 1.00 . A A . 509 ARG HH11 1 1 2 839 1 1 12 ARG HH12 H -17.934 -2.652 -6.900 1.00 . A A . 509 ARG HH12 1 1 2 840 1 1 12 ARG HH21 H -18.025 -3.996 -3.660 1.00 . A A . 509 ARG HH21 1 1 2 841 1 1 12 ARG HH22 H -18.789 -3.965 -5.229 1.00 . A A . 509 ARG HH22 1 1 2 842 1 1 12 ARG N N -10.766 -1.826 -4.645 1.00 . A A . 509 ARG N 1 1 2 843 1 1 12 ARG NE N -16.212 -2.334 -4.203 1.00 . A A . 509 ARG NE 1 1 2 844 1 1 12 ARG NH1 N -17.202 -2.347 -6.285 1.00 . A A . 509 ARG NH1 1 1 2 845 1 1 12 ARG NH2 N -18.062 -3.644 -4.606 1.00 . A A . 509 ARG NH2 1 1 2 846 1 1 12 ARG O O -12.033 -0.607 -1.437 1.00 . A A . 509 ARG O 1 1 2 847 1 1 13 GLU C C -10.498 -2.535 0.282 1.00 . A A . 510 GLU C 1 1 2 848 1 1 13 GLU CA C -11.409 -3.240 -0.737 1.00 . A A . 510 GLU CA 1 1 2 849 1 1 13 GLU CB C -11.047 -4.726 -0.805 1.00 . A A . 510 GLU CB 1 1 2 850 1 1 13 GLU CD C -13.219 -5.720 0.011 1.00 . A A . 510 GLU CD 1 1 2 851 1 1 13 GLU CG C -11.729 -5.575 0.256 1.00 . A A . 510 GLU CG 1 1 2 852 1 1 13 GLU H H -11.014 -3.191 -2.819 1.00 . A A . 510 GLU H 1 1 2 853 1 1 13 GLU HA H -12.431 -3.145 -0.407 1.00 . A A . 510 GLU HA 1 1 2 854 1 1 13 GLU HB2 H -11.326 -5.107 -1.776 1.00 . A A . 510 GLU HB2 1 1 2 855 1 1 13 GLU HB3 H -9.977 -4.828 -0.683 1.00 . A A . 510 GLU HB3 1 1 2 856 1 1 13 GLU HG2 H -11.281 -6.556 0.256 1.00 . A A . 510 GLU HG2 1 1 2 857 1 1 13 GLU HG3 H -11.581 -5.113 1.219 1.00 . A A . 510 GLU HG3 1 1 2 858 1 1 13 GLU N N -11.311 -2.638 -2.068 1.00 . A A . 510 GLU N 1 1 2 859 1 1 13 GLU O O -10.479 -2.907 1.458 1.00 . A A . 510 GLU O 1 1 2 860 1 1 13 GLU OE1 O -13.999 -4.869 0.487 1.00 . A A . 510 GLU OE1 1 1 2 861 1 1 13 GLU OE2 O -13.618 -6.688 -0.668 1.00 . A A . 510 GLU OE2 1 1 2 862 1 1 14 ALA C C -9.377 -0.367 1.977 1.00 . A A . 511 ALA C 1 1 2 863 1 1 14 ALA CA C -8.784 -0.801 0.643 1.00 . A A . 511 ALA CA 1 1 2 864 1 1 14 ALA CB C -8.265 0.421 -0.094 1.00 . A A . 511 ALA CB 1 1 2 865 1 1 14 ALA H H -9.813 -1.307 -1.130 1.00 . A A . 511 ALA H 1 1 2 866 1 1 14 ALA HA H -7.941 -1.446 0.833 1.00 . A A . 511 ALA HA 1 1 2 867 1 1 14 ALA HB1 H -7.890 0.125 -1.063 1.00 . A A . 511 ALA HB1 1 1 2 868 1 1 14 ALA HB2 H -9.067 1.133 -0.220 1.00 . A A . 511 ALA HB2 1 1 2 869 1 1 14 ALA HB3 H -7.462 0.876 0.477 1.00 . A A . 511 ALA HB3 1 1 2 870 1 1 14 ALA N N -9.731 -1.546 -0.187 1.00 . A A . 511 ALA N 1 1 2 871 1 1 14 ALA O O -10.586 -0.149 2.108 1.00 . A A . 511 ALA O 1 1 2 872 1 1 15 MET C C -7.659 0.535 5.140 1.00 . A A . 512 MET C 1 1 2 873 1 1 15 MET CA C -8.884 0.132 4.312 1.00 . A A . 512 MET CA 1 1 2 874 1 1 15 MET CB C -9.598 -1.058 4.974 1.00 . A A . 512 MET CB 1 1 2 875 1 1 15 MET CE C -10.429 -1.955 8.961 1.00 . A A . 512 MET CE 1 1 2 876 1 1 15 MET CG C -9.829 -0.900 6.470 1.00 . A A . 512 MET CG 1 1 2 877 1 1 15 MET H H -7.545 -0.295 2.733 1.00 . A A . 512 MET H 1 1 2 878 1 1 15 MET HA H -9.562 0.969 4.235 1.00 . A A . 512 MET HA 1 1 2 879 1 1 15 MET HB2 H -10.559 -1.192 4.501 1.00 . A A . 512 MET HB2 1 1 2 880 1 1 15 MET HB3 H -9.007 -1.948 4.818 1.00 . A A . 512 MET HB3 1 1 2 881 1 1 15 MET HE1 H -11.062 -1.094 9.116 1.00 . A A . 512 MET HE1 1 1 2 882 1 1 15 MET HE2 H -10.791 -2.781 9.556 1.00 . A A . 512 MET HE2 1 1 2 883 1 1 15 MET HE3 H -9.418 -1.717 9.254 1.00 . A A . 512 MET HE3 1 1 2 884 1 1 15 MET HG2 H -8.894 -0.637 6.940 1.00 . A A . 512 MET HG2 1 1 2 885 1 1 15 MET HG3 H -10.546 -0.107 6.631 1.00 . A A . 512 MET HG3 1 1 2 886 1 1 15 MET N N -8.495 -0.209 2.951 1.00 . A A . 512 MET N 1 1 2 887 1 1 15 MET O O -7.758 1.339 6.067 1.00 . A A . 512 MET O 1 1 2 888 1 1 15 MET SD S -10.458 -2.413 7.229 1.00 . A A . 512 MET SD 1 1 2 889 1 1 16 SER C C -4.192 0.803 4.726 1.00 . A A . 513 SER C 1 1 2 890 1 1 16 SER CA C -5.301 0.206 5.591 1.00 . A A . 513 SER CA 1 1 2 891 1 1 16 SER CB C -4.846 -1.112 6.225 1.00 . A A . 513 SER CB 1 1 2 892 1 1 16 SER H H -6.435 -0.517 3.963 1.00 . A A . 513 SER H 1 1 2 893 1 1 16 SER HA H -5.555 0.920 6.359 1.00 . A A . 513 SER HA 1 1 2 894 1 1 16 SER HB2 H -4.406 -1.739 5.465 1.00 . A A . 513 SER HB2 1 1 2 895 1 1 16 SER HB3 H -4.114 -0.910 6.992 1.00 . A A . 513 SER HB3 1 1 2 896 1 1 16 SER HG H -6.411 -2.302 6.129 1.00 . A A . 513 SER HG 1 1 2 897 1 1 16 SER N N -6.500 -0.014 4.797 1.00 . A A . 513 SER N 1 1 2 898 1 1 16 SER O O -4.016 0.411 3.576 1.00 . A A . 513 SER O 1 1 2 899 1 1 16 SER OG O -5.941 -1.802 6.813 1.00 . A A . 513 SER OG 1 1 2 900 1 1 17 GLU C C -1.022 1.831 4.913 1.00 . A A . 514 GLU C 1 1 2 901 1 1 17 GLU CA C -2.382 2.410 4.541 1.00 . A A . 514 GLU CA 1 1 2 902 1 1 17 GLU CB C -2.393 3.912 4.837 1.00 . A A . 514 GLU CB 1 1 2 903 1 1 17 GLU CD C -2.071 5.717 6.587 1.00 . A A . 514 GLU CD 1 1 2 904 1 1 17 GLU CG C -2.280 4.240 6.316 1.00 . A A . 514 GLU CG 1 1 2 905 1 1 17 GLU H H -3.610 1.999 6.215 1.00 . A A . 514 GLU H 1 1 2 906 1 1 17 GLU HA H -2.558 2.261 3.487 1.00 . A A . 514 GLU HA 1 1 2 907 1 1 17 GLU HB2 H -1.564 4.375 4.322 1.00 . A A . 514 GLU HB2 1 1 2 908 1 1 17 GLU HB3 H -3.316 4.332 4.467 1.00 . A A . 514 GLU HB3 1 1 2 909 1 1 17 GLU HG2 H -3.186 3.925 6.805 1.00 . A A . 514 GLU HG2 1 1 2 910 1 1 17 GLU HG3 H -1.443 3.693 6.727 1.00 . A A . 514 GLU HG3 1 1 2 911 1 1 17 GLU N N -3.447 1.744 5.283 1.00 . A A . 514 GLU N 1 1 2 912 1 1 17 GLU O O -0.884 1.145 5.927 1.00 . A A . 514 GLU O 1 1 2 913 1 1 17 GLU OE1 O -2.392 6.553 5.713 1.00 . A A . 514 GLU OE1 1 1 2 914 1 1 17 GLU OE2 O -1.589 6.059 7.686 1.00 . A A . 514 GLU OE2 1 1 2 915 1 1 18 CYS C C 1.886 2.713 5.437 1.00 . A A . 515 CYS C 1 1 2 916 1 1 18 CYS CA C 1.346 1.762 4.384 1.00 . A A . 515 CYS CA 1 1 2 917 1 1 18 CYS CB C 2.242 1.832 3.136 1.00 . A A . 515 CYS CB 1 1 2 918 1 1 18 CYS H H -0.225 2.579 3.247 1.00 . A A . 515 CYS H 1 1 2 919 1 1 18 CYS HA H 1.388 0.773 4.827 1.00 . A A . 515 CYS HA 1 1 2 920 1 1 18 CYS HB2 H 2.214 0.879 2.627 1.00 . A A . 515 CYS HB2 1 1 2 921 1 1 18 CYS HB3 H 1.870 2.600 2.478 1.00 . A A . 515 CYS HB3 1 1 2 922 1 1 18 CYS N N -0.031 2.107 4.080 1.00 . A A . 515 CYS N 1 1 2 923 1 1 18 CYS O O 1.798 3.933 5.301 1.00 . A A . 515 CYS O 1 1 2 924 1 1 18 CYS SG S 3.995 2.216 3.507 1.00 . A A . 515 CYS SG 1 1 2 925 1 1 19 THR C C 4.581 3.062 6.901 1.00 . A A . 516 THR C 1 1 2 926 1 1 19 THR CA C 3.172 2.903 7.465 1.00 . A A . 516 THR CA 1 1 2 927 1 1 19 THR CB C 3.193 2.240 8.865 1.00 . A A . 516 THR CB 1 1 2 928 1 1 19 THR CG2 C 3.655 0.791 8.796 1.00 . A A . 516 THR CG2 1 1 2 929 1 1 19 THR H H 2.235 1.203 6.699 1.00 . A A . 516 THR H 1 1 2 930 1 1 19 THR HA H 2.724 3.883 7.559 1.00 . A A . 516 THR HA 1 1 2 931 1 1 19 THR HB H 2.186 2.256 9.257 1.00 . A A . 516 THR HB 1 1 2 932 1 1 19 THR HG1 H 4.062 3.903 9.479 1.00 . A A . 516 THR HG1 1 1 2 933 1 1 19 THR HG21 H 4.662 0.755 8.408 1.00 . A A . 516 THR HG21 1 1 2 934 1 1 19 THR HG22 H 3.633 0.359 9.784 1.00 . A A . 516 THR HG22 1 1 2 935 1 1 19 THR HG23 H 2.997 0.235 8.144 1.00 . A A . 516 THR HG23 1 1 2 936 1 1 19 THR N N 2.386 2.147 6.528 1.00 . A A . 516 THR N 1 1 2 937 1 1 19 THR O O 5.291 2.083 6.659 1.00 . A A . 516 THR O 1 1 2 938 1 1 19 THR OG1 O 4.041 2.978 9.754 1.00 . A A . 516 THR OG1 1 1 2 939 1 1 20 GLY C C 5.961 5.613 4.909 1.00 . A A . 517 GLY C 1 1 2 940 1 1 20 GLY CA C 6.198 4.575 5.976 1.00 . A A . 517 GLY CA 1 1 2 941 1 1 20 GLY H H 4.458 5.040 7.090 1.00 . A A . 517 GLY H 1 1 2 942 1 1 20 GLY HA2 H 6.948 4.938 6.664 1.00 . A A . 517 GLY HA2 1 1 2 943 1 1 20 GLY HA3 H 6.549 3.666 5.512 1.00 . A A . 517 GLY HA3 1 1 2 944 1 1 20 GLY N N 4.981 4.300 6.703 1.00 . A A . 517 GLY N 1 1 2 945 1 1 20 GLY O O 6.689 6.604 4.822 1.00 . A A . 517 GLY O 1 1 2 946 1 1 21 CYS C C 3.005 6.401 3.010 1.00 . A A . 518 CYS C 1 1 2 947 1 1 21 CYS CA C 4.519 6.413 3.154 1.00 . A A . 518 CYS CA 1 1 2 948 1 1 21 CYS CB C 5.185 6.190 1.797 1.00 . A A . 518 CYS CB 1 1 2 949 1 1 21 CYS H H 4.424 4.558 4.160 1.00 . A A . 518 CYS H 1 1 2 950 1 1 21 CYS HA H 4.829 7.362 3.562 1.00 . A A . 518 CYS HA 1 1 2 951 1 1 21 CYS HB2 H 5.114 7.098 1.218 1.00 . A A . 518 CYS HB2 1 1 2 952 1 1 21 CYS HB3 H 6.227 5.953 1.952 1.00 . A A . 518 CYS HB3 1 1 2 953 1 1 21 CYS N N 4.928 5.403 4.102 1.00 . A A . 518 CYS N 1 1 2 954 1 1 21 CYS O O 2.376 5.355 3.072 1.00 . A A . 518 CYS O 1 1 2 955 1 1 21 CYS SG S 4.451 4.848 0.808 1.00 . A A . 518 CYS SG 1 1 2 956 1 1 22 HIS C C 0.617 7.952 1.225 1.00 . A A . 519 HIS C 1 1 2 957 1 1 22 HIS CA C 0.981 7.661 2.669 1.00 . A A . 519 HIS CA 1 1 2 958 1 1 22 HIS CB C 0.416 8.760 3.576 1.00 . A A . 519 HIS CB 1 1 2 959 1 1 22 HIS CD2 C 1.954 9.010 5.647 1.00 . A A . 519 HIS CD2 1 1 2 960 1 1 22 HIS CE1 C 0.615 8.151 7.148 1.00 . A A . 519 HIS CE1 1 1 2 961 1 1 22 HIS CG C 0.817 8.636 5.014 1.00 . A A . 519 HIS CG 1 1 2 962 1 1 22 HIS H H 2.974 8.377 2.715 1.00 . A A . 519 HIS H 1 1 2 963 1 1 22 HIS HA H 0.553 6.713 2.953 1.00 . A A . 519 HIS HA 1 1 2 964 1 1 22 HIS HB2 H 0.758 9.719 3.220 1.00 . A A . 519 HIS HB2 1 1 2 965 1 1 22 HIS HB3 H -0.663 8.731 3.531 1.00 . A A . 519 HIS HB3 1 1 2 966 1 1 22 HIS HD1 H -0.895 7.712 5.834 1.00 . A A . 519 HIS HD1 1 1 2 967 1 1 22 HIS HD2 H 2.824 9.461 5.189 1.00 . A A . 519 HIS HD2 1 1 2 968 1 1 22 HIS HE1 H 0.215 7.792 8.086 1.00 . A A . 519 HIS HE1 1 1 2 969 1 1 22 HIS HE2 H 2.383 9.033 7.701 1.00 . A A . 519 HIS HE2 1 1 2 970 1 1 22 HIS N N 2.423 7.564 2.800 1.00 . A A . 519 HIS N 1 1 2 971 1 1 22 HIS ND1 N 0.002 8.098 5.982 1.00 . A A . 519 HIS ND1 1 1 2 972 1 1 22 HIS NE2 N 1.803 8.699 6.974 1.00 . A A . 519 HIS NE2 1 1 2 973 1 1 22 HIS O O -0.444 8.512 0.938 1.00 . A A . 519 HIS O 1 1 2 974 1 1 23 LYS C C 0.440 6.760 -1.750 1.00 . A A . 520 LYS C 1 1 2 975 1 1 23 LYS CA C 1.287 7.845 -1.101 1.00 . A A . 520 LYS CA 1 1 2 976 1 1 23 LYS CB C 2.628 7.957 -1.838 1.00 . A A . 520 LYS CB 1 1 2 977 1 1 23 LYS CD C 4.739 6.781 -2.596 1.00 . A A . 520 LYS CD 1 1 2 978 1 1 23 LYS CE C 5.639 7.941 -2.188 1.00 . A A . 520 LYS CE 1 1 2 979 1 1 23 LYS CG C 3.477 6.700 -1.742 1.00 . A A . 520 LYS CG 1 1 2 980 1 1 23 LYS H H 2.326 7.117 0.579 1.00 . A A . 520 LYS H 1 1 2 981 1 1 23 LYS HA H 0.766 8.787 -1.177 1.00 . A A . 520 LYS HA 1 1 2 982 1 1 23 LYS HB2 H 2.435 8.156 -2.882 1.00 . A A . 520 LYS HB2 1 1 2 983 1 1 23 LYS HB3 H 3.188 8.780 -1.420 1.00 . A A . 520 LYS HB3 1 1 2 984 1 1 23 LYS HD2 H 5.291 5.858 -2.491 1.00 . A A . 520 LYS HD2 1 1 2 985 1 1 23 LYS HD3 H 4.451 6.910 -3.629 1.00 . A A . 520 LYS HD3 1 1 2 986 1 1 23 LYS HE2 H 6.583 7.850 -2.707 1.00 . A A . 520 LYS HE2 1 1 2 987 1 1 23 LYS HE3 H 5.161 8.865 -2.475 1.00 . A A . 520 LYS HE3 1 1 2 988 1 1 23 LYS HG2 H 3.764 6.552 -0.712 1.00 . A A . 520 LYS HG2 1 1 2 989 1 1 23 LYS HG3 H 2.885 5.859 -2.073 1.00 . A A . 520 LYS HG3 1 1 2 990 1 1 23 LYS HZ1 H 5.751 7.024 -0.313 1.00 . A A . 520 LYS HZ1 1 1 2 991 1 1 23 LYS HZ2 H 6.877 8.270 -0.534 1.00 . A A . 520 LYS HZ2 1 1 2 992 1 1 23 LYS HZ3 H 5.243 8.641 -0.265 1.00 . A A . 520 LYS HZ3 1 1 2 993 1 1 23 LYS N N 1.499 7.569 0.309 1.00 . A A . 520 LYS N 1 1 2 994 1 1 23 LYS NZ N 5.899 7.968 -0.726 1.00 . A A . 520 LYS NZ 1 1 2 995 1 1 23 LYS O O -0.114 6.970 -2.829 1.00 . A A . 520 LYS O 1 1 2 996 1 1 24 VAL C C -1.290 3.910 -0.482 1.00 . A A . 521 VAL C 1 1 2 997 1 1 24 VAL CA C -0.483 4.512 -1.624 1.00 . A A . 521 VAL CA 1 1 2 998 1 1 24 VAL CB C 0.351 3.391 -2.292 1.00 . A A . 521 VAL CB 1 1 2 999 1 1 24 VAL CG1 C 1.072 3.906 -3.529 1.00 . A A . 521 VAL CG1 1 1 2 1000 1 1 24 VAL CG2 C 1.347 2.795 -1.306 1.00 . A A . 521 VAL CG2 1 1 2 1001 1 1 24 VAL H H 0.832 5.445 -0.283 1.00 . A A . 521 VAL H 1 1 2 1002 1 1 24 VAL HA H -1.162 4.921 -2.359 1.00 . A A . 521 VAL HA 1 1 2 1003 1 1 24 VAL HB H -0.327 2.608 -2.601 1.00 . A A . 521 VAL HB 1 1 2 1004 1 1 24 VAL HG11 H 1.684 4.754 -3.262 1.00 . A A . 521 VAL HG11 1 1 2 1005 1 1 24 VAL HG12 H 1.698 3.124 -3.932 1.00 . A A . 521 VAL HG12 1 1 2 1006 1 1 24 VAL HG13 H 0.345 4.205 -4.272 1.00 . A A . 521 VAL HG13 1 1 2 1007 1 1 24 VAL HG21 H 0.819 2.417 -0.443 1.00 . A A . 521 VAL HG21 1 1 2 1008 1 1 24 VAL HG22 H 1.885 1.987 -1.780 1.00 . A A . 521 VAL HG22 1 1 2 1009 1 1 24 VAL HG23 H 2.045 3.557 -0.995 1.00 . A A . 521 VAL HG23 1 1 2 1010 1 1 24 VAL N N 0.344 5.592 -1.122 1.00 . A A . 521 VAL N 1 1 2 1011 1 1 24 VAL O O -0.920 4.040 0.686 1.00 . A A . 521 VAL O 1 1 2 1012 1 1 25 ASN C C -3.453 1.161 -0.190 1.00 . A A . 522 ASN C 1 1 2 1013 1 1 25 ASN CA C -3.240 2.618 0.165 1.00 . A A . 522 ASN CA 1 1 2 1014 1 1 25 ASN CB C -4.595 3.318 0.310 1.00 . A A . 522 ASN CB 1 1 2 1015 1 1 25 ASN CG C -4.923 4.234 -0.846 1.00 . A A . 522 ASN CG 1 1 2 1016 1 1 25 ASN H H -2.631 3.203 -1.773 1.00 . A A . 522 ASN H 1 1 2 1017 1 1 25 ASN HA H -2.733 2.648 1.115 1.00 . A A . 522 ASN HA 1 1 2 1018 1 1 25 ASN HB2 H -5.371 2.568 0.374 1.00 . A A . 522 ASN HB2 1 1 2 1019 1 1 25 ASN HB3 H -4.596 3.900 1.218 1.00 . A A . 522 ASN HB3 1 1 2 1020 1 1 25 ASN HD21 H -5.549 2.691 -1.922 1.00 . A A . 522 ASN HD21 1 1 2 1021 1 1 25 ASN HD22 H -5.657 4.245 -2.683 1.00 . A A . 522 ASN HD22 1 1 2 1022 1 1 25 ASN N N -2.391 3.267 -0.826 1.00 . A A . 522 ASN N 1 1 2 1023 1 1 25 ASN ND2 N -5.422 3.668 -1.922 1.00 . A A . 522 ASN ND2 1 1 2 1024 1 1 25 ASN O O -3.380 0.767 -1.355 1.00 . A A . 522 ASN O 1 1 2 1025 1 1 25 ASN OD1 O -4.704 5.442 -0.782 1.00 . A A . 522 ASN OD1 1 1 2 1026 1 1 26 TYR C C -5.280 -1.372 1.358 1.00 . A A . 523 TYR C 1 1 2 1027 1 1 26 TYR CA C -3.956 -1.040 0.701 1.00 . A A . 523 TYR CA 1 1 2 1028 1 1 26 TYR CB C -2.842 -1.860 1.365 1.00 . A A . 523 TYR CB 1 1 2 1029 1 1 26 TYR CD1 C -0.656 -0.602 1.278 1.00 . A A . 523 TYR CD1 1 1 2 1030 1 1 26 TYR CD2 C -0.946 -2.456 -0.189 1.00 . A A . 523 TYR CD2 1 1 2 1031 1 1 26 TYR CE1 C 0.617 -0.402 0.783 1.00 . A A . 523 TYR CE1 1 1 2 1032 1 1 26 TYR CE2 C 0.326 -2.260 -0.693 1.00 . A A . 523 TYR CE2 1 1 2 1033 1 1 26 TYR CG C -1.459 -1.629 0.802 1.00 . A A . 523 TYR CG 1 1 2 1034 1 1 26 TYR CZ C 1.104 -1.234 -0.202 1.00 . A A . 523 TYR CZ 1 1 2 1035 1 1 26 TYR H H -3.812 0.791 1.725 1.00 . A A . 523 TYR H 1 1 2 1036 1 1 26 TYR HA H -4.008 -1.278 -0.353 1.00 . A A . 523 TYR HA 1 1 2 1037 1 1 26 TYR HB2 H -2.811 -1.618 2.416 1.00 . A A . 523 TYR HB2 1 1 2 1038 1 1 26 TYR HB3 H -3.071 -2.911 1.254 1.00 . A A . 523 TYR HB3 1 1 2 1039 1 1 26 TYR HD1 H -1.040 0.051 2.049 1.00 . A A . 523 TYR HD1 1 1 2 1040 1 1 26 TYR HD2 H -1.559 -3.259 -0.572 1.00 . A A . 523 TYR HD2 1 1 2 1041 1 1 26 TYR HE1 H 1.226 0.404 1.167 1.00 . A A . 523 TYR HE1 1 1 2 1042 1 1 26 TYR HE2 H 0.707 -2.912 -1.465 1.00 . A A . 523 TYR HE2 1 1 2 1043 1 1 26 TYR HH H 2.428 -1.326 -1.615 1.00 . A A . 523 TYR HH 1 1 2 1044 1 1 26 TYR N N -3.720 0.379 0.839 1.00 . A A . 523 TYR N 1 1 2 1045 1 1 26 TYR O O -6.001 -0.477 1.796 1.00 . A A . 523 TYR O 1 1 2 1046 1 1 26 TYR OH O 2.378 -1.043 -0.684 1.00 . A A . 523 TYR OH 1 1 2 1047 1 1 27 CYS C C -6.477 -3.690 3.462 1.00 . A A . 524 CYS C 1 1 2 1048 1 1 27 CYS CA C -6.809 -3.064 2.119 1.00 . A A . 524 CYS CA 1 1 2 1049 1 1 27 CYS CB C -7.546 -4.061 1.226 1.00 . A A . 524 CYS CB 1 1 2 1050 1 1 27 CYS H H -4.949 -3.318 1.172 1.00 . A A . 524 CYS H 1 1 2 1051 1 1 27 CYS HA H -7.427 -2.196 2.282 1.00 . A A . 524 CYS HA 1 1 2 1052 1 1 27 CYS HB2 H -8.464 -4.359 1.709 1.00 . A A . 524 CYS HB2 1 1 2 1053 1 1 27 CYS HB3 H -7.777 -3.586 0.283 1.00 . A A . 524 CYS HB3 1 1 2 1054 1 1 27 CYS N N -5.584 -2.643 1.474 1.00 . A A . 524 CYS N 1 1 2 1055 1 1 27 CYS O O -7.091 -3.388 4.489 1.00 . A A . 524 CYS O 1 1 2 1056 1 1 27 CYS SG S -6.592 -5.567 0.870 1.00 . A A . 524 CYS SG 1 1 2 1057 1 1 28 SER C C -3.538 -5.391 4.641 1.00 . A A . 525 SER C 1 1 2 1058 1 1 28 SER CA C -5.055 -5.276 4.607 1.00 . A A . 525 SER CA 1 1 2 1059 1 1 28 SER CB C -5.689 -6.670 4.578 1.00 . A A . 525 SER CB 1 1 2 1060 1 1 28 SER H H -4.954 -4.639 2.608 1.00 . A A . 525 SER H 1 1 2 1061 1 1 28 SER HA H -5.391 -4.747 5.486 1.00 . A A . 525 SER HA 1 1 2 1062 1 1 28 SER HB2 H -6.747 -6.578 4.378 1.00 . A A . 525 SER HB2 1 1 2 1063 1 1 28 SER HB3 H -5.225 -7.259 3.796 1.00 . A A . 525 SER HB3 1 1 2 1064 1 1 28 SER HG H -6.283 -7.153 6.386 1.00 . A A . 525 SER HG 1 1 2 1065 1 1 28 SER N N -5.458 -4.525 3.442 1.00 . A A . 525 SER N 1 1 2 1066 1 1 28 SER O O -2.865 -5.011 3.676 1.00 . A A . 525 SER O 1 1 2 1067 1 1 28 SER OG O -5.519 -7.342 5.814 1.00 . A A . 525 SER OG 1 1 2 1068 1 1 29 THR C C -1.020 -7.039 4.807 1.00 . A A . 526 THR C 1 1 2 1069 1 1 29 THR CA C -1.570 -6.086 5.871 1.00 . A A . 526 THR CA 1 1 2 1070 1 1 29 THR CB C -1.224 -6.634 7.265 1.00 . A A . 526 THR CB 1 1 2 1071 1 1 29 THR CG2 C 0.249 -6.410 7.587 1.00 . A A . 526 THR CG2 1 1 2 1072 1 1 29 THR H H -3.593 -6.198 6.466 1.00 . A A . 526 THR H 1 1 2 1073 1 1 29 THR HA H -1.104 -5.119 5.758 1.00 . A A . 526 THR HA 1 1 2 1074 1 1 29 THR HB H -1.426 -7.695 7.281 1.00 . A A . 526 THR HB 1 1 2 1075 1 1 29 THR HG1 H -1.744 -6.245 9.138 1.00 . A A . 526 THR HG1 1 1 2 1076 1 1 29 THR HG21 H 0.466 -5.351 7.568 1.00 . A A . 526 THR HG21 1 1 2 1077 1 1 29 THR HG22 H 0.468 -6.806 8.568 1.00 . A A . 526 THR HG22 1 1 2 1078 1 1 29 THR HG23 H 0.858 -6.915 6.852 1.00 . A A . 526 THR HG23 1 1 2 1079 1 1 29 THR N N -3.006 -5.919 5.730 1.00 . A A . 526 THR N 1 1 2 1080 1 1 29 THR O O 0.137 -6.926 4.398 1.00 . A A . 526 THR O 1 1 2 1081 1 1 29 THR OG1 O -2.037 -5.982 8.252 1.00 . A A . 526 THR OG1 1 1 2 1082 1 1 30 PHE C C -0.949 -8.322 2.084 1.00 . A A . 527 PHE C 1 1 2 1083 1 1 30 PHE CA C -1.436 -8.968 3.380 1.00 . A A . 527 PHE CA 1 1 2 1084 1 1 30 PHE CB C -2.583 -9.939 3.073 1.00 . A A . 527 PHE CB 1 1 2 1085 1 1 30 PHE CD1 C -2.321 -10.689 0.692 1.00 . A A . 527 PHE CD1 1 1 2 1086 1 1 30 PHE CD2 C -1.774 -12.227 2.429 1.00 . A A . 527 PHE CD2 1 1 2 1087 1 1 30 PHE CE1 C -1.975 -11.625 -0.257 1.00 . A A . 527 PHE CE1 1 1 2 1088 1 1 30 PHE CE2 C -1.430 -13.173 1.483 1.00 . A A . 527 PHE CE2 1 1 2 1089 1 1 30 PHE CG C -2.225 -10.977 2.045 1.00 . A A . 527 PHE CG 1 1 2 1090 1 1 30 PHE CZ C -1.528 -12.870 0.138 1.00 . A A . 527 PHE CZ 1 1 2 1091 1 1 30 PHE H H -2.780 -7.987 4.689 1.00 . A A . 527 PHE H 1 1 2 1092 1 1 30 PHE HA H -0.618 -9.522 3.815 1.00 . A A . 527 PHE HA 1 1 2 1093 1 1 30 PHE HB2 H -2.863 -10.455 3.980 1.00 . A A . 527 PHE HB2 1 1 2 1094 1 1 30 PHE HB3 H -3.431 -9.379 2.704 1.00 . A A . 527 PHE HB3 1 1 2 1095 1 1 30 PHE HD1 H -2.670 -9.714 0.384 1.00 . A A . 527 PHE HD1 1 1 2 1096 1 1 30 PHE HD2 H -1.699 -12.463 3.480 1.00 . A A . 527 PHE HD2 1 1 2 1097 1 1 30 PHE HE1 H -2.052 -11.382 -1.307 1.00 . A A . 527 PHE HE1 1 1 2 1098 1 1 30 PHE HE2 H -1.082 -14.145 1.794 1.00 . A A . 527 PHE HE2 1 1 2 1099 1 1 30 PHE HZ H -1.256 -13.608 -0.603 1.00 . A A . 527 PHE HZ 1 1 2 1100 1 1 30 PHE N N -1.863 -7.966 4.348 1.00 . A A . 527 PHE N 1 1 2 1101 1 1 30 PHE O O 0.156 -8.613 1.630 1.00 . A A . 527 PHE O 1 1 2 1102 1 1 31 CYS C C -0.110 -5.882 0.542 1.00 . A A . 528 CYS C 1 1 2 1103 1 1 31 CYS CA C -1.336 -6.754 0.276 1.00 . A A . 528 CYS CA 1 1 2 1104 1 1 31 CYS CB C -2.456 -5.903 -0.329 1.00 . A A . 528 CYS CB 1 1 2 1105 1 1 31 CYS H H -2.617 -7.224 1.902 1.00 . A A . 528 CYS H 1 1 2 1106 1 1 31 CYS HA H -1.056 -7.532 -0.418 1.00 . A A . 528 CYS HA 1 1 2 1107 1 1 31 CYS HB2 H -2.913 -5.324 0.459 1.00 . A A . 528 CYS HB2 1 1 2 1108 1 1 31 CYS HB3 H -2.020 -5.224 -1.047 1.00 . A A . 528 CYS HB3 1 1 2 1109 1 1 31 CYS N N -1.749 -7.428 1.503 1.00 . A A . 528 CYS N 1 1 2 1110 1 1 31 CYS O O 0.770 -5.775 -0.305 1.00 . A A . 528 CYS O 1 1 2 1111 1 1 31 CYS SG S -3.800 -6.814 -1.179 1.00 . A A . 528 CYS SG 1 1 2 1112 1 1 32 GLN C C 2.380 -5.216 2.059 1.00 . A A . 529 GLN C 1 1 2 1113 1 1 32 GLN CA C 1.074 -4.424 2.106 1.00 . A A . 529 GLN CA 1 1 2 1114 1 1 32 GLN CB C 0.855 -3.844 3.516 1.00 . A A . 529 GLN CB 1 1 2 1115 1 1 32 GLN CD C 2.547 -2.013 3.950 1.00 . A A . 529 GLN CD 1 1 2 1116 1 1 32 GLN CG C 2.137 -3.441 4.234 1.00 . A A . 529 GLN CG 1 1 2 1117 1 1 32 GLN H H -0.766 -5.438 2.382 1.00 . A A . 529 GLN H 1 1 2 1118 1 1 32 GLN HA H 1.118 -3.618 1.389 1.00 . A A . 529 GLN HA 1 1 2 1119 1 1 32 GLN HB2 H 0.236 -2.957 3.437 1.00 . A A . 529 GLN HB2 1 1 2 1120 1 1 32 GLN HB3 H 0.344 -4.579 4.120 1.00 . A A . 529 GLN HB3 1 1 2 1121 1 1 32 GLN HE21 H 3.592 -2.579 2.357 1.00 . A A . 529 GLN HE21 1 1 2 1122 1 1 32 GLN HE22 H 3.593 -0.882 2.701 1.00 . A A . 529 GLN HE22 1 1 2 1123 1 1 32 GLN HG2 H 1.988 -3.550 5.296 1.00 . A A . 529 GLN HG2 1 1 2 1124 1 1 32 GLN HG3 H 2.935 -4.098 3.915 1.00 . A A . 529 GLN HG3 1 1 2 1125 1 1 32 GLN N N -0.054 -5.278 1.729 1.00 . A A . 529 GLN N 1 1 2 1126 1 1 32 GLN NE2 N 3.323 -1.806 2.898 1.00 . A A . 529 GLN NE2 1 1 2 1127 1 1 32 GLN O O 3.372 -4.764 1.491 1.00 . A A . 529 GLN O 1 1 2 1128 1 1 32 GLN OE1 O 2.164 -1.101 4.675 1.00 . A A . 529 GLN OE1 1 1 2 1129 1 1 33 ARG C C 3.816 -7.882 1.344 1.00 . A A . 530 ARG C 1 1 2 1130 1 1 33 ARG CA C 3.555 -7.246 2.715 1.00 . A A . 530 ARG CA 1 1 2 1131 1 1 33 ARG CB C 3.398 -8.320 3.788 1.00 . A A . 530 ARG CB 1 1 2 1132 1 1 33 ARG CD C 4.380 -10.339 4.897 1.00 . A A . 530 ARG CD 1 1 2 1133 1 1 33 ARG CG C 4.672 -9.089 4.086 1.00 . A A . 530 ARG CG 1 1 2 1134 1 1 33 ARG CZ C 2.839 -12.248 4.561 1.00 . A A . 530 ARG CZ 1 1 2 1135 1 1 33 ARG H H 1.535 -6.705 3.090 1.00 . A A . 530 ARG H 1 1 2 1136 1 1 33 ARG HA H 4.386 -6.601 2.957 1.00 . A A . 530 ARG HA 1 1 2 1137 1 1 33 ARG HB2 H 3.066 -7.852 4.702 1.00 . A A . 530 ARG HB2 1 1 2 1138 1 1 33 ARG HB3 H 2.646 -9.024 3.463 1.00 . A A . 530 ARG HB3 1 1 2 1139 1 1 33 ARG HD2 H 5.311 -10.737 5.270 1.00 . A A . 530 ARG HD2 1 1 2 1140 1 1 33 ARG HD3 H 3.742 -10.073 5.726 1.00 . A A . 530 ARG HD3 1 1 2 1141 1 1 33 ARG HE H 3.945 -11.396 3.133 1.00 . A A . 530 ARG HE 1 1 2 1142 1 1 33 ARG HG2 H 5.135 -9.374 3.153 1.00 . A A . 530 ARG HG2 1 1 2 1143 1 1 33 ARG HG3 H 5.342 -8.453 4.646 1.00 . A A . 530 ARG HG3 1 1 2 1144 1 1 33 ARG HH11 H 2.820 -11.522 6.461 1.00 . A A . 530 ARG HH11 1 1 2 1145 1 1 33 ARG HH12 H 1.793 -12.901 6.175 1.00 . A A . 530 ARG HH12 1 1 2 1146 1 1 33 ARG HH21 H 2.612 -13.171 2.774 1.00 . A A . 530 ARG HH21 1 1 2 1147 1 1 33 ARG HH22 H 1.677 -13.839 4.083 1.00 . A A . 530 ARG HH22 1 1 2 1148 1 1 33 ARG N N 2.371 -6.396 2.673 1.00 . A A . 530 ARG N 1 1 2 1149 1 1 33 ARG NE N 3.712 -11.360 4.090 1.00 . A A . 530 ARG NE 1 1 2 1150 1 1 33 ARG NH1 N 2.457 -12.220 5.833 1.00 . A A . 530 ARG NH1 1 1 2 1151 1 1 33 ARG NH2 N 2.335 -13.158 3.744 1.00 . A A . 530 ARG NH2 1 1 2 1152 1 1 33 ARG O O 4.960 -8.131 0.963 1.00 . A A . 530 ARG O 1 1 2 1153 1 1 34 LYS C C 3.437 -7.808 -1.726 1.00 . A A . 531 LYS C 1 1 2 1154 1 1 34 LYS CA C 2.827 -8.768 -0.703 1.00 . A A . 531 LYS CA 1 1 2 1155 1 1 34 LYS CB C 1.422 -9.173 -1.152 1.00 . A A . 531 LYS CB 1 1 2 1156 1 1 34 LYS CD C -0.001 -9.607 -3.151 1.00 . A A . 531 LYS CD 1 1 2 1157 1 1 34 LYS CE C -0.006 -10.006 -4.616 1.00 . A A . 531 LYS CE 1 1 2 1158 1 1 34 LYS CG C 1.367 -9.793 -2.529 1.00 . A A . 531 LYS CG 1 1 2 1159 1 1 34 LYS H H 1.857 -7.913 0.976 1.00 . A A . 531 LYS H 1 1 2 1160 1 1 34 LYS HA H 3.446 -9.650 -0.625 1.00 . A A . 531 LYS HA 1 1 2 1161 1 1 34 LYS HB2 H 1.027 -9.887 -0.445 1.00 . A A . 531 LYS HB2 1 1 2 1162 1 1 34 LYS HB3 H 0.793 -8.297 -1.151 1.00 . A A . 531 LYS HB3 1 1 2 1163 1 1 34 LYS HD2 H -0.715 -10.217 -2.617 1.00 . A A . 531 LYS HD2 1 1 2 1164 1 1 34 LYS HD3 H -0.279 -8.563 -3.068 1.00 . A A . 531 LYS HD3 1 1 2 1165 1 1 34 LYS HE2 H 0.414 -10.997 -4.708 1.00 . A A . 531 LYS HE2 1 1 2 1166 1 1 34 LYS HE3 H -1.027 -10.014 -4.971 1.00 . A A . 531 LYS HE3 1 1 2 1167 1 1 34 LYS HG2 H 2.109 -9.325 -3.157 1.00 . A A . 531 LYS HG2 1 1 2 1168 1 1 34 LYS HG3 H 1.571 -10.849 -2.444 1.00 . A A . 531 LYS HG3 1 1 2 1169 1 1 34 LYS HZ1 H 0.478 -8.084 -5.281 1.00 . A A . 531 LYS HZ1 1 1 2 1170 1 1 34 LYS HZ2 H 1.806 -9.141 -5.210 1.00 . A A . 531 LYS HZ2 1 1 2 1171 1 1 34 LYS HZ3 H 0.666 -9.290 -6.459 1.00 . A A . 531 LYS HZ3 1 1 2 1172 1 1 34 LYS N N 2.741 -8.142 0.613 1.00 . A A . 531 LYS N 1 1 2 1173 1 1 34 LYS NZ N 0.791 -9.065 -5.448 1.00 . A A . 531 LYS NZ 1 1 2 1174 1 1 34 LYS O O 4.293 -8.184 -2.529 1.00 . A A . 531 LYS O 1 1 2 1175 1 1 35 ASP C C 4.841 -4.993 -2.071 1.00 . A A . 532 ASP C 1 1 2 1176 1 1 35 ASP CA C 3.486 -5.506 -2.546 1.00 . A A . 532 ASP CA 1 1 2 1177 1 1 35 ASP CB C 2.470 -4.365 -2.554 1.00 . A A . 532 ASP CB 1 1 2 1178 1 1 35 ASP CG C 2.842 -3.240 -3.502 1.00 . A A . 532 ASP CG 1 1 2 1179 1 1 35 ASP H H 2.272 -6.340 -1.038 1.00 . A A . 532 ASP H 1 1 2 1180 1 1 35 ASP HA H 3.573 -5.875 -3.559 1.00 . A A . 532 ASP HA 1 1 2 1181 1 1 35 ASP HB2 H 1.514 -4.760 -2.857 1.00 . A A . 532 ASP HB2 1 1 2 1182 1 1 35 ASP HB3 H 2.382 -3.967 -1.557 1.00 . A A . 532 ASP HB3 1 1 2 1183 1 1 35 ASP N N 2.992 -6.565 -1.673 1.00 . A A . 532 ASP N 1 1 2 1184 1 1 35 ASP O O 5.555 -4.310 -2.801 1.00 . A A . 532 ASP O 1 1 2 1185 1 1 35 ASP OD1 O 2.979 -3.505 -4.717 1.00 . A A . 532 ASP OD1 1 1 2 1186 1 1 35 ASP OD2 O 2.999 -2.089 -3.041 1.00 . A A . 532 ASP OD2 1 1 2 1187 1 1 36 TRP C C 7.678 -5.184 -1.009 1.00 . A A . 533 TRP C 1 1 2 1188 1 1 36 TRP CA C 6.417 -4.902 -0.202 1.00 . A A . 533 TRP CA 1 1 2 1189 1 1 36 TRP CB C 6.567 -5.520 1.191 1.00 . A A . 533 TRP CB 1 1 2 1190 1 1 36 TRP CD1 C 8.912 -5.645 2.212 1.00 . A A . 533 TRP CD1 1 1 2 1191 1 1 36 TRP CD2 C 7.914 -3.653 2.440 1.00 . A A . 533 TRP CD2 1 1 2 1192 1 1 36 TRP CE2 C 9.189 -3.586 3.025 1.00 . A A . 533 TRP CE2 1 1 2 1193 1 1 36 TRP CE3 C 7.102 -2.514 2.463 1.00 . A A . 533 TRP CE3 1 1 2 1194 1 1 36 TRP CG C 7.754 -4.982 1.928 1.00 . A A . 533 TRP CG 1 1 2 1195 1 1 36 TRP CH2 C 8.863 -1.327 3.627 1.00 . A A . 533 TRP CH2 1 1 2 1196 1 1 36 TRP CZ2 C 9.676 -2.427 3.619 1.00 . A A . 533 TRP CZ2 1 1 2 1197 1 1 36 TRP CZ3 C 7.585 -1.364 3.056 1.00 . A A . 533 TRP CZ3 1 1 2 1198 1 1 36 TRP H H 4.655 -6.055 -0.392 1.00 . A A . 533 TRP H 1 1 2 1199 1 1 36 TRP HA H 6.315 -3.833 -0.073 1.00 . A A . 533 TRP HA 1 1 2 1200 1 1 36 TRP HB2 H 5.683 -5.308 1.772 1.00 . A A . 533 TRP HB2 1 1 2 1201 1 1 36 TRP HB3 H 6.687 -6.589 1.096 1.00 . A A . 533 TRP HB3 1 1 2 1202 1 1 36 TRP HD1 H 9.104 -6.673 1.953 1.00 . A A . 533 TRP HD1 1 1 2 1203 1 1 36 TRP HE1 H 10.684 -5.059 3.188 1.00 . A A . 533 TRP HE1 1 1 2 1204 1 1 36 TRP HE3 H 6.115 -2.522 2.028 1.00 . A A . 533 TRP HE3 1 1 2 1205 1 1 36 TRP HH2 H 9.201 -0.408 4.080 1.00 . A A . 533 TRP HH2 1 1 2 1206 1 1 36 TRP HZ2 H 10.662 -2.384 4.055 1.00 . A A . 533 TRP HZ2 1 1 2 1207 1 1 36 TRP HZ3 H 6.974 -0.476 3.081 1.00 . A A . 533 TRP HZ3 1 1 2 1208 1 1 36 TRP N N 5.213 -5.401 -0.861 1.00 . A A . 533 TRP N 1 1 2 1209 1 1 36 TRP NE1 N 9.778 -4.813 2.874 1.00 . A A . 533 TRP NE1 1 1 2 1210 1 1 36 TRP O O 8.653 -4.453 -0.921 1.00 . A A . 533 TRP O 1 1 2 1211 1 1 37 LYS C C 9.195 -5.631 -3.616 1.00 . A A . 534 LYS C 1 1 2 1212 1 1 37 LYS CA C 8.845 -6.644 -2.535 1.00 . A A . 534 LYS CA 1 1 2 1213 1 1 37 LYS CB C 8.678 -8.052 -3.105 1.00 . A A . 534 LYS CB 1 1 2 1214 1 1 37 LYS CD C 8.535 -10.493 -2.526 1.00 . A A . 534 LYS CD 1 1 2 1215 1 1 37 LYS CE C 8.116 -11.508 -1.472 1.00 . A A . 534 LYS CE 1 1 2 1216 1 1 37 LYS CG C 8.298 -9.076 -2.048 1.00 . A A . 534 LYS CG 1 1 2 1217 1 1 37 LYS H H 6.811 -6.708 -1.941 1.00 . A A . 534 LYS H 1 1 2 1218 1 1 37 LYS HA H 9.670 -6.640 -1.841 1.00 . A A . 534 LYS HA 1 1 2 1219 1 1 37 LYS HB2 H 7.903 -8.035 -3.858 1.00 . A A . 534 LYS HB2 1 1 2 1220 1 1 37 LYS HB3 H 9.609 -8.358 -3.561 1.00 . A A . 534 LYS HB3 1 1 2 1221 1 1 37 LYS HD2 H 7.960 -10.661 -3.425 1.00 . A A . 534 LYS HD2 1 1 2 1222 1 1 37 LYS HD3 H 9.586 -10.621 -2.739 1.00 . A A . 534 LYS HD3 1 1 2 1223 1 1 37 LYS HE2 H 8.506 -11.193 -0.514 1.00 . A A . 534 LYS HE2 1 1 2 1224 1 1 37 LYS HE3 H 7.037 -11.538 -1.426 1.00 . A A . 534 LYS HE3 1 1 2 1225 1 1 37 LYS HG2 H 8.890 -8.904 -1.164 1.00 . A A . 534 LYS HG2 1 1 2 1226 1 1 37 LYS HG3 H 7.250 -8.960 -1.810 1.00 . A A . 534 LYS HG3 1 1 2 1227 1 1 37 LYS HZ1 H 8.389 -13.135 -2.756 1.00 . A A . 534 LYS HZ1 1 1 2 1228 1 1 37 LYS HZ2 H 9.664 -12.895 -1.662 1.00 . A A . 534 LYS HZ2 1 1 2 1229 1 1 37 LYS HZ3 H 8.205 -13.564 -1.127 1.00 . A A . 534 LYS HZ3 1 1 2 1230 1 1 37 LYS N N 7.652 -6.230 -1.809 1.00 . A A . 534 LYS N 1 1 2 1231 1 1 37 LYS NZ N 8.627 -12.868 -1.776 1.00 . A A . 534 LYS NZ 1 1 2 1232 1 1 37 LYS O O 10.367 -5.448 -3.948 1.00 . A A . 534 LYS O 1 1 2 1233 1 1 38 ASP C C 8.423 -2.546 -4.259 1.00 . A A . 535 ASP C 1 1 2 1234 1 1 38 ASP CA C 8.438 -3.840 -5.048 1.00 . A A . 535 ASP CA 1 1 2 1235 1 1 38 ASP CB C 7.378 -3.763 -6.138 1.00 . A A . 535 ASP CB 1 1 2 1236 1 1 38 ASP CG C 7.982 -3.564 -7.511 1.00 . A A . 535 ASP CG 1 1 2 1237 1 1 38 ASP H H 7.268 -5.219 -3.946 1.00 . A A . 535 ASP H 1 1 2 1238 1 1 38 ASP HA H 9.411 -3.981 -5.494 1.00 . A A . 535 ASP HA 1 1 2 1239 1 1 38 ASP HB2 H 6.804 -4.670 -6.136 1.00 . A A . 535 ASP HB2 1 1 2 1240 1 1 38 ASP HB3 H 6.723 -2.929 -5.930 1.00 . A A . 535 ASP HB3 1 1 2 1241 1 1 38 ASP N N 8.190 -4.961 -4.155 1.00 . A A . 535 ASP N 1 1 2 1242 1 1 38 ASP O O 9.191 -1.629 -4.491 1.00 . A A . 535 ASP O 1 1 2 1243 1 1 38 ASP OD1 O 8.349 -2.419 -7.848 1.00 . A A . 535 ASP OD1 1 1 2 1244 1 1 38 ASP OD2 O 8.096 -4.551 -8.261 1.00 . A A . 535 ASP OD2 1 1 2 1245 1 1 39 HIS C C 8.499 -0.902 -1.717 1.00 . A A . 536 HIS C 1 1 2 1246 1 1 39 HIS CA C 7.287 -1.295 -2.551 1.00 . A A . 536 HIS CA 1 1 2 1247 1 1 39 HIS CB C 6.069 -1.495 -1.651 1.00 . A A . 536 HIS CB 1 1 2 1248 1 1 39 HIS CD2 C 5.422 0.190 0.199 1.00 . A A . 536 HIS CD2 1 1 2 1249 1 1 39 HIS CE1 C 4.556 1.741 -1.042 1.00 . A A . 536 HIS CE1 1 1 2 1250 1 1 39 HIS CG C 5.520 -0.229 -1.088 1.00 . A A . 536 HIS CG 1 1 2 1251 1 1 39 HIS H H 7.012 -3.298 -3.109 1.00 . A A . 536 HIS H 1 1 2 1252 1 1 39 HIS HA H 7.078 -0.500 -3.261 1.00 . A A . 536 HIS HA 1 1 2 1253 1 1 39 HIS HB2 H 5.285 -1.970 -2.220 1.00 . A A . 536 HIS HB2 1 1 2 1254 1 1 39 HIS HB3 H 6.345 -2.135 -0.824 1.00 . A A . 536 HIS HB3 1 1 2 1255 1 1 39 HIS HD1 H 4.857 0.745 -2.845 1.00 . A A . 536 HIS HD1 1 1 2 1256 1 1 39 HIS HD2 H 5.765 -0.341 1.073 1.00 . A A . 536 HIS HD2 1 1 2 1257 1 1 39 HIS HE1 H 4.094 2.662 -1.363 1.00 . A A . 536 HIS HE1 1 1 2 1258 1 1 39 HIS N N 7.535 -2.498 -3.304 1.00 . A A . 536 HIS N 1 1 2 1259 1 1 39 HIS ND1 N 4.964 0.766 -1.863 1.00 . A A . 536 HIS ND1 1 1 2 1260 1 1 39 HIS NE2 N 4.805 1.429 0.208 1.00 . A A . 536 HIS NE2 1 1 2 1261 1 1 39 HIS O O 8.754 0.273 -1.530 1.00 . A A . 536 HIS O 1 1 2 1262 1 1 40 GLN C C 11.459 -0.747 -1.056 1.00 . A A . 537 GLN C 1 1 2 1263 1 1 40 GLN CA C 10.389 -1.592 -0.358 1.00 . A A . 537 GLN CA 1 1 2 1264 1 1 40 GLN CB C 11.011 -2.881 0.184 1.00 . A A . 537 GLN CB 1 1 2 1265 1 1 40 GLN CD C 12.198 -5.043 -0.292 1.00 . A A . 537 GLN CD 1 1 2 1266 1 1 40 GLN CG C 11.661 -3.754 -0.874 1.00 . A A . 537 GLN CG 1 1 2 1267 1 1 40 GLN H H 9.028 -2.820 -1.452 1.00 . A A . 537 GLN H 1 1 2 1268 1 1 40 GLN HA H 10.004 -1.022 0.476 1.00 . A A . 537 GLN HA 1 1 2 1269 1 1 40 GLN HB2 H 11.761 -2.625 0.917 1.00 . A A . 537 GLN HB2 1 1 2 1270 1 1 40 GLN HB3 H 10.238 -3.460 0.668 1.00 . A A . 537 GLN HB3 1 1 2 1271 1 1 40 GLN HE21 H 10.412 -5.870 -0.460 1.00 . A A . 537 GLN HE21 1 1 2 1272 1 1 40 GLN HE22 H 11.641 -6.885 0.211 1.00 . A A . 537 GLN HE22 1 1 2 1273 1 1 40 GLN HG2 H 10.930 -3.991 -1.638 1.00 . A A . 537 GLN HG2 1 1 2 1274 1 1 40 GLN HG3 H 12.478 -3.207 -1.314 1.00 . A A . 537 GLN HG3 1 1 2 1275 1 1 40 GLN N N 9.253 -1.880 -1.235 1.00 . A A . 537 GLN N 1 1 2 1276 1 1 40 GLN NE2 N 11.332 -6.030 -0.173 1.00 . A A . 537 GLN NE2 1 1 2 1277 1 1 40 GLN O O 12.178 0.004 -0.399 1.00 . A A . 537 GLN O 1 1 2 1278 1 1 40 GLN OE1 O 13.368 -5.138 0.080 1.00 . A A . 537 GLN OE1 1 1 2 1279 1 1 41 HIS C C 11.976 1.309 -3.435 1.00 . A A . 538 HIS C 1 1 2 1280 1 1 41 HIS CA C 12.566 -0.056 -3.090 1.00 . A A . 538 HIS CA 1 1 2 1281 1 1 41 HIS CB C 13.130 -0.759 -4.346 1.00 . A A . 538 HIS CB 1 1 2 1282 1 1 41 HIS CD2 C 11.419 -1.811 -5.964 1.00 . A A . 538 HIS CD2 1 1 2 1283 1 1 41 HIS CE1 C 11.282 -0.157 -7.363 1.00 . A A . 538 HIS CE1 1 1 2 1284 1 1 41 HIS CG C 12.223 -0.811 -5.543 1.00 . A A . 538 HIS CG 1 1 2 1285 1 1 41 HIS H H 11.083 -1.567 -2.850 1.00 . A A . 538 HIS H 1 1 2 1286 1 1 41 HIS HA H 13.386 0.113 -2.408 1.00 . A A . 538 HIS HA 1 1 2 1287 1 1 41 HIS HB2 H 14.031 -0.251 -4.650 1.00 . A A . 538 HIS HB2 1 1 2 1288 1 1 41 HIS HB3 H 13.379 -1.776 -4.083 1.00 . A A . 538 HIS HB3 1 1 2 1289 1 1 41 HIS HD2 H 11.226 -2.740 -5.453 1.00 . A A . 538 HIS HD2 1 1 2 1290 1 1 41 HIS HE1 H 10.977 0.452 -8.199 1.00 . A A . 538 HIS HE1 1 1 2 1291 1 1 41 HIS HE2 H 9.996 -1.775 -7.510 1.00 . A A . 538 HIS HE2 1 1 2 1292 1 1 41 HIS N N 11.599 -0.882 -2.374 1.00 . A A . 538 HIS N 1 1 2 1293 1 1 41 HIS ND1 N 12.135 0.234 -6.430 1.00 . A A . 538 HIS ND1 1 1 2 1294 1 1 41 HIS NE2 N 10.823 -1.390 -7.125 1.00 . A A . 538 HIS NE2 1 1 2 1295 1 1 41 HIS O O 12.716 2.267 -3.656 1.00 . A A . 538 HIS O 1 1 2 1296 1 1 42 ILE C C 9.732 3.488 -2.536 1.00 . A A . 539 ILE C 1 1 2 1297 1 1 42 ILE CA C 10.013 2.679 -3.811 1.00 . A A . 539 ILE CA 1 1 2 1298 1 1 42 ILE CB C 8.715 2.467 -4.659 1.00 . A A . 539 ILE CB 1 1 2 1299 1 1 42 ILE CD1 C 6.727 3.622 -3.549 1.00 . A A . 539 ILE CD1 1 1 2 1300 1 1 42 ILE CG1 C 7.445 2.311 -3.815 1.00 . A A . 539 ILE CG1 1 1 2 1301 1 1 42 ILE CG2 C 8.869 1.260 -5.563 1.00 . A A . 539 ILE CG2 1 1 2 1302 1 1 42 ILE H H 10.089 0.609 -3.349 1.00 . A A . 539 ILE H 1 1 2 1303 1 1 42 ILE HA H 10.711 3.242 -4.415 1.00 . A A . 539 ILE HA 1 1 2 1304 1 1 42 ILE HB H 8.601 3.319 -5.296 1.00 . A A . 539 ILE HB 1 1 2 1305 1 1 42 ILE HD11 H 6.416 4.061 -4.485 1.00 . A A . 539 ILE HD11 1 1 2 1306 1 1 42 ILE HD12 H 5.860 3.439 -2.929 1.00 . A A . 539 ILE HD12 1 1 2 1307 1 1 42 ILE HD13 H 7.397 4.298 -3.040 1.00 . A A . 539 ILE HD13 1 1 2 1308 1 1 42 ILE HG12 H 6.763 1.661 -4.329 1.00 . A A . 539 ILE HG12 1 1 2 1309 1 1 42 ILE HG13 H 7.699 1.875 -2.864 1.00 . A A . 539 ILE HG13 1 1 2 1310 1 1 42 ILE HG21 H 9.077 0.387 -4.962 1.00 . A A . 539 ILE HG21 1 1 2 1311 1 1 42 ILE HG22 H 7.956 1.108 -6.118 1.00 . A A . 539 ILE HG22 1 1 2 1312 1 1 42 ILE HG23 H 9.686 1.427 -6.251 1.00 . A A . 539 ILE HG23 1 1 2 1313 1 1 42 ILE N N 10.650 1.406 -3.490 1.00 . A A . 539 ILE N 1 1 2 1314 1 1 42 ILE O O 9.983 4.694 -2.487 1.00 . A A . 539 ILE O 1 1 2 1315 1 1 43 CYS C C 10.072 4.141 0.314 1.00 . A A . 540 CYS C 1 1 2 1316 1 1 43 CYS CA C 8.847 3.434 -0.271 1.00 . A A . 540 CYS CA 1 1 2 1317 1 1 43 CYS CB C 8.370 2.339 0.689 1.00 . A A . 540 CYS CB 1 1 2 1318 1 1 43 CYS H H 8.950 1.861 -1.669 1.00 . A A . 540 CYS H 1 1 2 1319 1 1 43 CYS HA H 8.044 4.141 -0.413 1.00 . A A . 540 CYS HA 1 1 2 1320 1 1 43 CYS HB2 H 7.759 1.636 0.143 1.00 . A A . 540 CYS HB2 1 1 2 1321 1 1 43 CYS HB3 H 9.233 1.823 1.084 1.00 . A A . 540 CYS HB3 1 1 2 1322 1 1 43 CYS N N 9.180 2.815 -1.538 1.00 . A A . 540 CYS N 1 1 2 1323 1 1 43 CYS O O 11.113 3.526 0.548 1.00 . A A . 540 CYS O 1 1 2 1324 1 1 43 CYS SG S 7.387 2.930 2.104 1.00 . A A . 540 CYS SG 1 1 2 1325 1 1 44 GLY C C 11.212 7.524 0.277 1.00 . A A . 541 GLY C 1 1 2 1326 1 1 44 GLY CA C 11.057 6.214 1.014 1.00 . A A . 541 GLY CA 1 1 2 1327 1 1 44 GLY H H 9.054 5.855 0.399 1.00 . A A . 541 GLY H 1 1 2 1328 1 1 44 GLY HA2 H 10.910 6.422 2.062 1.00 . A A . 541 GLY HA2 1 1 2 1329 1 1 44 GLY HA3 H 11.962 5.637 0.895 1.00 . A A . 541 GLY HA3 1 1 2 1330 1 1 44 GLY N N 9.938 5.435 0.529 1.00 . A A . 541 GLY N 1 1 2 1331 1 1 44 GLY O O 11.827 8.463 0.786 1.00 . A A . 541 GLY O 1 1 2 1332 1 1 45 GLN C C 9.819 9.880 -1.002 1.00 . A A . 542 GLN C 1 1 2 1333 1 1 45 GLN CA C 10.676 8.830 -1.702 1.00 . A A . 542 GLN CA 1 1 2 1334 1 1 45 GLN CB C 10.159 8.577 -3.122 1.00 . A A . 542 GLN CB 1 1 2 1335 1 1 45 GLN CD C 12.429 7.957 -4.058 1.00 . A A . 542 GLN CD 1 1 2 1336 1 1 45 GLN CG C 10.976 7.551 -3.894 1.00 . A A . 542 GLN CG 1 1 2 1337 1 1 45 GLN H H 10.253 6.791 -1.317 1.00 . A A . 542 GLN H 1 1 2 1338 1 1 45 GLN HA H 11.694 9.184 -1.751 1.00 . A A . 542 GLN HA 1 1 2 1339 1 1 45 GLN HB2 H 9.140 8.225 -3.065 1.00 . A A . 542 GLN HB2 1 1 2 1340 1 1 45 GLN HB3 H 10.180 9.508 -3.670 1.00 . A A . 542 GLN HB3 1 1 2 1341 1 1 45 GLN HE21 H 11.915 9.869 -4.194 1.00 . A A . 542 GLN HE21 1 1 2 1342 1 1 45 GLN HE22 H 13.611 9.537 -4.277 1.00 . A A . 542 GLN HE22 1 1 2 1343 1 1 45 GLN HG2 H 10.941 6.610 -3.363 1.00 . A A . 542 GLN HG2 1 1 2 1344 1 1 45 GLN HG3 H 10.538 7.425 -4.874 1.00 . A A . 542 GLN HG3 1 1 2 1345 1 1 45 GLN N N 10.665 7.593 -0.931 1.00 . A A . 542 GLN N 1 1 2 1346 1 1 45 GLN NE2 N 12.675 9.250 -4.196 1.00 . A A . 542 GLN NE2 1 1 2 1347 1 1 45 GLN O O 8.805 9.545 -0.387 1.00 . A A . 542 GLN O 1 1 2 1348 1 1 45 GLN OE1 O 13.323 7.112 -4.088 1.00 . A A . 542 GLN OE1 1 1 2 1349 1 1 46 SER C C 8.198 12.544 -1.085 1.00 . A A . 543 SER C 1 1 2 1350 1 1 46 SER CA C 9.522 12.213 -0.402 1.00 . A A . 543 SER CA 1 1 2 1351 1 1 46 SER CB C 10.413 13.453 -0.326 1.00 . A A . 543 SER CB 1 1 2 1352 1 1 46 SER H H 10.971 11.369 -1.692 1.00 . A A . 543 SER H 1 1 2 1353 1 1 46 SER HA H 9.318 11.865 0.601 1.00 . A A . 543 SER HA 1 1 2 1354 1 1 46 SER HB2 H 10.575 13.842 -1.320 1.00 . A A . 543 SER HB2 1 1 2 1355 1 1 46 SER HB3 H 9.931 14.206 0.281 1.00 . A A . 543 SER HB3 1 1 2 1356 1 1 46 SER HG H 11.632 12.255 0.640 1.00 . A A . 543 SER HG 1 1 2 1357 1 1 46 SER N N 10.212 11.144 -1.107 1.00 . A A . 543 SER N 1 1 2 1358 1 1 46 SER O O 8.137 13.388 -1.981 1.00 . A A . 543 SER O 1 1 2 1359 1 1 46 SER OG O 11.671 13.137 0.251 1.00 . A A . 543 SER OG 1 1 2 1360 1 1 47 ALA C C 4.774 11.479 -0.255 1.00 . A A . 544 ALA C 1 1 2 1361 1 1 47 ALA CA C 5.815 12.052 -1.208 1.00 . A A . 544 ALA CA 1 1 2 1362 1 1 47 ALA CB C 5.703 11.408 -2.581 1.00 . A A . 544 ALA CB 1 1 2 1363 1 1 47 ALA H H 7.268 11.218 0.080 1.00 . A A . 544 ALA H 1 1 2 1364 1 1 47 ALA HA H 5.644 13.113 -1.315 1.00 . A A . 544 ALA HA 1 1 2 1365 1 1 47 ALA HB1 H 5.890 10.348 -2.498 1.00 . A A . 544 ALA HB1 1 1 2 1366 1 1 47 ALA HB2 H 4.710 11.569 -2.973 1.00 . A A . 544 ALA HB2 1 1 2 1367 1 1 47 ALA HB3 H 6.429 11.851 -3.248 1.00 . A A . 544 ALA HB3 1 1 2 1368 1 1 47 ALA N N 7.145 11.866 -0.654 1.00 . A A . 544 ALA N 1 1 2 1369 1 1 47 ALA O O 4.077 12.273 0.406 1.00 . A A . 544 ALA O 1 1 2 1370 1 1 47 ALA OXT O 4.691 10.237 -0.136 1.00 . A A . 544 ALA OXT 1 1 2 1371 2 2 1 ZN ZN ZN -5.614 -5.426 -1.184 1.00 . B A . 601 ZN ZN 1 1 2 1372 3 2 1 ZN ZN ZN 5.141 2.797 1.604 1.00 . C A . 602 ZN ZN 1 1 3 1373 1 1 1 GLY C C -18.048 6.573 0.453 1.00 . A A . 498 GLY C 1 1 3 1374 1 1 1 GLY CA C -18.273 8.067 0.378 1.00 . A A . 498 GLY CA 1 1 3 1375 1 1 1 GLY H1 H -19.542 8.005 -1.273 1.00 . A A . 498 GLY H1 1 1 3 1376 1 1 1 GLY H2 H -19.658 9.436 -0.366 1.00 . A A . 498 GLY H2 1 1 3 1377 1 1 1 GLY H3 H -20.349 8.002 0.219 1.00 . A A . 498 GLY H3 1 1 3 1378 1 1 1 GLY HA2 H -17.454 8.519 -0.162 1.00 . A A . 498 GLY HA2 1 1 3 1379 1 1 1 GLY HA3 H -18.300 8.471 1.379 1.00 . A A . 498 GLY HA3 1 1 3 1380 1 1 1 GLY N N -19.543 8.401 -0.308 1.00 . A A . 498 GLY N 1 1 3 1381 1 1 1 GLY O O -18.755 5.808 -0.209 1.00 . A A . 498 GLY O 1 1 3 1382 1 1 2 ALA C C -16.075 4.179 0.156 1.00 . A A . 499 ALA C 1 1 3 1383 1 1 2 ALA CA C -16.687 4.757 1.430 1.00 . A A . 499 ALA CA 1 1 3 1384 1 1 2 ALA CB C -17.862 3.905 1.890 1.00 . A A . 499 ALA CB 1 1 3 1385 1 1 2 ALA H H -16.581 6.844 1.786 1.00 . A A . 499 ALA H 1 1 3 1386 1 1 2 ALA HA H -15.937 4.721 2.208 1.00 . A A . 499 ALA HA 1 1 3 1387 1 1 2 ALA HB1 H -18.287 4.327 2.788 1.00 . A A . 499 ALA HB1 1 1 3 1388 1 1 2 ALA HB2 H -18.611 3.877 1.114 1.00 . A A . 499 ALA HB2 1 1 3 1389 1 1 2 ALA HB3 H -17.517 2.900 2.091 1.00 . A A . 499 ALA HB3 1 1 3 1390 1 1 2 ALA N N -17.070 6.166 1.267 1.00 . A A . 499 ALA N 1 1 3 1391 1 1 2 ALA O O -16.545 4.438 -0.953 1.00 . A A . 499 ALA O 1 1 3 1392 1 1 3 MET C C -13.787 3.863 -1.746 1.00 . A A . 500 MET C 1 1 3 1393 1 1 3 MET CA C -14.286 2.789 -0.781 1.00 . A A . 500 MET CA 1 1 3 1394 1 1 3 MET CB C -15.137 1.747 -1.524 1.00 . A A . 500 MET CB 1 1 3 1395 1 1 3 MET CE C -18.022 0.761 -0.230 1.00 . A A . 500 MET CE 1 1 3 1396 1 1 3 MET CG C -15.319 0.438 -0.764 1.00 . A A . 500 MET CG 1 1 3 1397 1 1 3 MET H H -14.712 3.209 1.248 1.00 . A A . 500 MET H 1 1 3 1398 1 1 3 MET HA H -13.428 2.293 -0.358 1.00 . A A . 500 MET HA 1 1 3 1399 1 1 3 MET HB2 H -16.115 2.165 -1.713 1.00 . A A . 500 MET HB2 1 1 3 1400 1 1 3 MET HB3 H -14.664 1.524 -2.470 1.00 . A A . 500 MET HB3 1 1 3 1401 1 1 3 MET HE1 H -18.194 -0.095 -0.866 1.00 . A A . 500 MET HE1 1 1 3 1402 1 1 3 MET HE2 H -18.822 0.841 0.491 1.00 . A A . 500 MET HE2 1 1 3 1403 1 1 3 MET HE3 H -17.990 1.657 -0.834 1.00 . A A . 500 MET HE3 1 1 3 1404 1 1 3 MET HG2 H -15.697 -0.306 -1.449 1.00 . A A . 500 MET HG2 1 1 3 1405 1 1 3 MET HG3 H -14.355 0.119 -0.393 1.00 . A A . 500 MET HG3 1 1 3 1406 1 1 3 MET N N -15.017 3.392 0.333 1.00 . A A . 500 MET N 1 1 3 1407 1 1 3 MET O O -13.772 3.673 -2.963 1.00 . A A . 500 MET O 1 1 3 1408 1 1 3 MET SD S -16.462 0.565 0.628 1.00 . A A . 500 MET SD 1 1 3 1409 1 1 4 GLU C C -11.387 5.932 -2.265 1.00 . A A . 501 GLU C 1 1 3 1410 1 1 4 GLU CA C -12.862 6.125 -1.934 1.00 . A A . 501 GLU CA 1 1 3 1411 1 1 4 GLU CB C -13.074 7.424 -1.162 1.00 . A A . 501 GLU CB 1 1 3 1412 1 1 4 GLU CD C -14.726 8.995 -0.101 1.00 . A A . 501 GLU CD 1 1 3 1413 1 1 4 GLU CG C -14.540 7.751 -0.933 1.00 . A A . 501 GLU CG 1 1 3 1414 1 1 4 GLU H H -13.418 5.058 -0.196 1.00 . A A . 501 GLU H 1 1 3 1415 1 1 4 GLU HA H -13.417 6.175 -2.858 1.00 . A A . 501 GLU HA 1 1 3 1416 1 1 4 GLU HB2 H -12.588 7.345 -0.200 1.00 . A A . 501 GLU HB2 1 1 3 1417 1 1 4 GLU HB3 H -12.628 8.236 -1.715 1.00 . A A . 501 GLU HB3 1 1 3 1418 1 1 4 GLU HG2 H -15.017 7.900 -1.890 1.00 . A A . 501 GLU HG2 1 1 3 1419 1 1 4 GLU HG3 H -15.005 6.921 -0.423 1.00 . A A . 501 GLU HG3 1 1 3 1420 1 1 4 GLU N N -13.376 4.988 -1.175 1.00 . A A . 501 GLU N 1 1 3 1421 1 1 4 GLU O O -10.755 6.778 -2.896 1.00 . A A . 501 GLU O 1 1 3 1422 1 1 4 GLU OE1 O -14.658 8.896 1.141 1.00 . A A . 501 GLU OE1 1 1 3 1423 1 1 4 GLU OE2 O -14.945 10.074 -0.681 1.00 . A A . 501 GLU OE2 1 1 3 1424 1 1 5 GLN C C -9.254 3.093 -2.459 1.00 . A A . 502 GLN C 1 1 3 1425 1 1 5 GLN CA C -9.443 4.522 -1.984 1.00 . A A . 502 GLN CA 1 1 3 1426 1 1 5 GLN CB C -8.711 4.763 -0.654 1.00 . A A . 502 GLN CB 1 1 3 1427 1 1 5 GLN CD C -10.536 4.579 1.118 1.00 . A A . 502 GLN CD 1 1 3 1428 1 1 5 GLN CG C -9.267 3.978 0.531 1.00 . A A . 502 GLN CG 1 1 3 1429 1 1 5 GLN H H -11.456 4.080 -1.542 1.00 . A A . 502 GLN H 1 1 3 1430 1 1 5 GLN HA H -9.054 5.192 -2.736 1.00 . A A . 502 GLN HA 1 1 3 1431 1 1 5 GLN HB2 H -7.673 4.490 -0.778 1.00 . A A . 502 GLN HB2 1 1 3 1432 1 1 5 GLN HB3 H -8.767 5.816 -0.416 1.00 . A A . 502 GLN HB3 1 1 3 1433 1 1 5 GLN HE21 H -9.899 6.421 0.717 1.00 . A A . 502 GLN HE21 1 1 3 1434 1 1 5 GLN HE22 H -11.455 6.305 1.470 1.00 . A A . 502 GLN HE22 1 1 3 1435 1 1 5 GLN HG2 H -9.484 2.972 0.206 1.00 . A A . 502 GLN HG2 1 1 3 1436 1 1 5 GLN HG3 H -8.513 3.945 1.305 1.00 . A A . 502 GLN HG3 1 1 3 1437 1 1 5 GLN N N -10.859 4.794 -1.861 1.00 . A A . 502 GLN N 1 1 3 1438 1 1 5 GLN NE2 N -10.641 5.900 1.100 1.00 . A A . 502 GLN NE2 1 1 3 1439 1 1 5 GLN O O -10.000 2.200 -2.063 1.00 . A A . 502 GLN O 1 1 3 1440 1 1 5 GLN OE1 O -11.405 3.860 1.611 1.00 . A A . 502 GLN OE1 1 1 3 1441 1 1 6 SER C C -6.788 0.943 -3.346 1.00 . A A . 503 SER C 1 1 3 1442 1 1 6 SER CA C -8.063 1.565 -3.892 1.00 . A A . 503 SER CA 1 1 3 1443 1 1 6 SER CB C -7.975 1.665 -5.414 1.00 . A A . 503 SER CB 1 1 3 1444 1 1 6 SER H H -7.693 3.624 -3.589 1.00 . A A . 503 SER H 1 1 3 1445 1 1 6 SER HA H -8.899 0.941 -3.622 1.00 . A A . 503 SER HA 1 1 3 1446 1 1 6 SER HB2 H -7.028 2.109 -5.685 1.00 . A A . 503 SER HB2 1 1 3 1447 1 1 6 SER HB3 H -8.042 0.675 -5.840 1.00 . A A . 503 SER HB3 1 1 3 1448 1 1 6 SER HG H -8.680 2.971 -6.696 1.00 . A A . 503 SER HG 1 1 3 1449 1 1 6 SER N N -8.282 2.879 -3.325 1.00 . A A . 503 SER N 1 1 3 1450 1 1 6 SER O O -5.742 1.586 -3.313 1.00 . A A . 503 SER O 1 1 3 1451 1 1 6 SER OG O -9.023 2.464 -5.942 1.00 . A A . 503 SER OG 1 1 3 1452 1 1 7 CYS C C -4.816 -1.202 -3.723 1.00 . A A . 504 CYS C 1 1 3 1453 1 1 7 CYS CA C -5.722 -1.059 -2.514 1.00 . A A . 504 CYS CA 1 1 3 1454 1 1 7 CYS CB C -6.146 -2.428 -1.994 1.00 . A A . 504 CYS CB 1 1 3 1455 1 1 7 CYS H H -7.778 -0.720 -2.836 1.00 . A A . 504 CYS H 1 1 3 1456 1 1 7 CYS HA H -5.200 -0.528 -1.734 1.00 . A A . 504 CYS HA 1 1 3 1457 1 1 7 CYS HB2 H -6.857 -2.291 -1.194 1.00 . A A . 504 CYS HB2 1 1 3 1458 1 1 7 CYS HB3 H -6.620 -2.975 -2.795 1.00 . A A . 504 CYS HB3 1 1 3 1459 1 1 7 CYS N N -6.889 -0.300 -2.901 1.00 . A A . 504 CYS N 1 1 3 1460 1 1 7 CYS O O -5.226 -1.735 -4.756 1.00 . A A . 504 CYS O 1 1 3 1461 1 1 7 CYS SG S -4.794 -3.460 -1.347 1.00 . A A . 504 CYS SG 1 1 3 1462 1 1 8 VAL C C -2.308 -2.082 -5.178 1.00 . A A . 505 VAL C 1 1 3 1463 1 1 8 VAL CA C -2.657 -0.673 -4.702 1.00 . A A . 505 VAL CA 1 1 3 1464 1 1 8 VAL CB C -1.368 0.104 -4.325 1.00 . A A . 505 VAL CB 1 1 3 1465 1 1 8 VAL CG1 C -0.571 -0.637 -3.263 1.00 . A A . 505 VAL CG1 1 1 3 1466 1 1 8 VAL CG2 C -0.512 0.381 -5.553 1.00 . A A . 505 VAL CG2 1 1 3 1467 1 1 8 VAL H H -3.324 -0.335 -2.720 1.00 . A A . 505 VAL H 1 1 3 1468 1 1 8 VAL HA H -3.138 -0.145 -5.513 1.00 . A A . 505 VAL HA 1 1 3 1469 1 1 8 VAL HB H -1.663 1.056 -3.908 1.00 . A A . 505 VAL HB 1 1 3 1470 1 1 8 VAL HG11 H -0.296 -1.614 -3.634 1.00 . A A . 505 VAL HG11 1 1 3 1471 1 1 8 VAL HG12 H 0.320 -0.078 -3.024 1.00 . A A . 505 VAL HG12 1 1 3 1472 1 1 8 VAL HG13 H -1.176 -0.747 -2.375 1.00 . A A . 505 VAL HG13 1 1 3 1473 1 1 8 VAL HG21 H -1.083 0.959 -6.263 1.00 . A A . 505 VAL HG21 1 1 3 1474 1 1 8 VAL HG22 H 0.366 0.934 -5.262 1.00 . A A . 505 VAL HG22 1 1 3 1475 1 1 8 VAL HG23 H -0.215 -0.555 -6.005 1.00 . A A . 505 VAL HG23 1 1 3 1476 1 1 8 VAL N N -3.595 -0.710 -3.589 1.00 . A A . 505 VAL N 1 1 3 1477 1 1 8 VAL O O -1.804 -2.267 -6.288 1.00 . A A . 505 VAL O 1 1 3 1478 1 1 9 ASN C C -3.508 -5.190 -5.250 1.00 . A A . 506 ASN C 1 1 3 1479 1 1 9 ASN CA C -2.287 -4.453 -4.707 1.00 . A A . 506 ASN CA 1 1 3 1480 1 1 9 ASN CB C -1.687 -5.210 -3.519 1.00 . A A . 506 ASN CB 1 1 3 1481 1 1 9 ASN CG C -1.389 -6.660 -3.855 1.00 . A A . 506 ASN CG 1 1 3 1482 1 1 9 ASN H H -3.004 -2.892 -3.475 1.00 . A A . 506 ASN H 1 1 3 1483 1 1 9 ASN HA H -1.547 -4.418 -5.492 1.00 . A A . 506 ASN HA 1 1 3 1484 1 1 9 ASN HB2 H -0.765 -4.732 -3.224 1.00 . A A . 506 ASN HB2 1 1 3 1485 1 1 9 ASN HB3 H -2.381 -5.185 -2.693 1.00 . A A . 506 ASN HB3 1 1 3 1486 1 1 9 ASN HD21 H -2.976 -7.259 -2.815 1.00 . A A . 506 ASN HD21 1 1 3 1487 1 1 9 ASN HD22 H -2.059 -8.508 -3.585 1.00 . A A . 506 ASN HD22 1 1 3 1488 1 1 9 ASN N N -2.592 -3.080 -4.348 1.00 . A A . 506 ASN N 1 1 3 1489 1 1 9 ASN ND2 N -2.222 -7.568 -3.370 1.00 . A A . 506 ASN ND2 1 1 3 1490 1 1 9 ASN O O -3.379 -5.983 -6.185 1.00 . A A . 506 ASN O 1 1 3 1491 1 1 9 ASN OD1 O -0.397 -6.962 -4.514 1.00 . A A . 506 ASN OD1 1 1 3 1492 1 1 10 CYS C C -6.997 -4.762 -5.663 1.00 . A A . 507 CYS C 1 1 3 1493 1 1 10 CYS CA C -5.858 -5.678 -5.165 1.00 . A A . 507 CYS CA 1 1 3 1494 1 1 10 CYS CB C -6.330 -6.695 -4.108 1.00 . A A . 507 CYS CB 1 1 3 1495 1 1 10 CYS H H -4.788 -4.260 -4.003 1.00 . A A . 507 CYS H 1 1 3 1496 1 1 10 CYS HA H -5.520 -6.243 -6.023 1.00 . A A . 507 CYS HA 1 1 3 1497 1 1 10 CYS HB2 H -7.036 -7.365 -4.571 1.00 . A A . 507 CYS HB2 1 1 3 1498 1 1 10 CYS HB3 H -5.475 -7.269 -3.778 1.00 . A A . 507 CYS HB3 1 1 3 1499 1 1 10 CYS N N -4.696 -4.942 -4.700 1.00 . A A . 507 CYS N 1 1 3 1500 1 1 10 CYS O O -7.190 -4.634 -6.875 1.00 . A A . 507 CYS O 1 1 3 1501 1 1 10 CYS SG S -7.138 -6.018 -2.621 1.00 . A A . 507 CYS SG 1 1 3 1502 1 1 11 GLY C C -9.383 -2.283 -4.229 1.00 . A A . 508 GLY C 1 1 3 1503 1 1 11 GLY CA C -8.902 -3.338 -5.217 1.00 . A A . 508 GLY CA 1 1 3 1504 1 1 11 GLY H H -7.507 -4.154 -3.810 1.00 . A A . 508 GLY H 1 1 3 1505 1 1 11 GLY HA2 H -8.646 -2.845 -6.143 1.00 . A A . 508 GLY HA2 1 1 3 1506 1 1 11 GLY HA3 H -9.713 -4.024 -5.409 1.00 . A A . 508 GLY HA3 1 1 3 1507 1 1 11 GLY N N -7.741 -4.110 -4.767 1.00 . A A . 508 GLY N 1 1 3 1508 1 1 11 GLY O O -8.844 -2.151 -3.139 1.00 . A A . 508 GLY O 1 1 3 1509 1 1 12 ARG C C -11.447 -0.844 -2.432 1.00 . A A . 509 ARG C 1 1 3 1510 1 1 12 ARG CA C -11.012 -0.434 -3.847 1.00 . A A . 509 ARG CA 1 1 3 1511 1 1 12 ARG CB C -12.201 0.164 -4.595 1.00 . A A . 509 ARG CB 1 1 3 1512 1 1 12 ARG CD C -14.428 -0.208 -5.674 1.00 . A A . 509 ARG CD 1 1 3 1513 1 1 12 ARG CG C -13.367 -0.791 -4.760 1.00 . A A . 509 ARG CG 1 1 3 1514 1 1 12 ARG CZ C -16.254 1.352 -5.074 1.00 . A A . 509 ARG CZ 1 1 3 1515 1 1 12 ARG H H -10.782 -1.691 -5.537 1.00 . A A . 509 ARG H 1 1 3 1516 1 1 12 ARG HA H -10.260 0.332 -3.759 1.00 . A A . 509 ARG HA 1 1 3 1517 1 1 12 ARG HB2 H -12.550 1.031 -4.057 1.00 . A A . 509 ARG HB2 1 1 3 1518 1 1 12 ARG HB3 H -11.873 0.470 -5.579 1.00 . A A . 509 ARG HB3 1 1 3 1519 1 1 12 ARG HD2 H -13.984 -0.050 -6.643 1.00 . A A . 509 ARG HD2 1 1 3 1520 1 1 12 ARG HD3 H -15.239 -0.914 -5.759 1.00 . A A . 509 ARG HD3 1 1 3 1521 1 1 12 ARG HE H -14.300 1.761 -4.936 1.00 . A A . 509 ARG HE 1 1 3 1522 1 1 12 ARG HG2 H -13.006 -1.716 -5.186 1.00 . A A . 509 ARG HG2 1 1 3 1523 1 1 12 ARG HG3 H -13.806 -0.986 -3.793 1.00 . A A . 509 ARG HG3 1 1 3 1524 1 1 12 ARG HH11 H -16.885 -0.464 -5.739 1.00 . A A . 509 ARG HH11 1 1 3 1525 1 1 12 ARG HH12 H -18.143 0.658 -5.301 1.00 . A A . 509 ARG HH12 1 1 3 1526 1 1 12 ARG HH21 H -15.955 3.250 -4.418 1.00 . A A . 509 ARG HH21 1 1 3 1527 1 1 12 ARG HH22 H -17.617 2.767 -4.569 1.00 . A A . 509 ARG HH22 1 1 3 1528 1 1 12 ARG N N -10.421 -1.535 -4.637 1.00 . A A . 509 ARG N 1 1 3 1529 1 1 12 ARG NE N -14.955 1.069 -5.182 1.00 . A A . 509 ARG NE 1 1 3 1530 1 1 12 ARG NH1 N -17.167 0.445 -5.400 1.00 . A A . 509 ARG NH1 1 1 3 1531 1 1 12 ARG NH2 N -16.641 2.552 -4.652 1.00 . A A . 509 ARG NH2 1 1 3 1532 1 1 12 ARG O O -11.864 0.000 -1.642 1.00 . A A . 509 ARG O 1 1 3 1533 1 1 13 GLU C C -10.726 -2.086 0.266 1.00 . A A . 510 GLU C 1 1 3 1534 1 1 13 GLU CA C -11.670 -2.674 -0.807 1.00 . A A . 510 GLU CA 1 1 3 1535 1 1 13 GLU CB C -11.555 -4.201 -0.834 1.00 . A A . 510 GLU CB 1 1 3 1536 1 1 13 GLU CD C -13.722 -4.616 0.404 1.00 . A A . 510 GLU CD 1 1 3 1537 1 1 13 GLU CG C -12.233 -4.896 0.339 1.00 . A A . 510 GLU CG 1 1 3 1538 1 1 13 GLU H H -11.182 -2.759 -2.867 1.00 . A A . 510 GLU H 1 1 3 1539 1 1 13 GLU HA H -12.681 -2.406 -0.555 1.00 . A A . 510 GLU HA 1 1 3 1540 1 1 13 GLU HB2 H -12.002 -4.568 -1.746 1.00 . A A . 510 GLU HB2 1 1 3 1541 1 1 13 GLU HB3 H -10.510 -4.468 -0.825 1.00 . A A . 510 GLU HB3 1 1 3 1542 1 1 13 GLU HG2 H -12.088 -5.961 0.239 1.00 . A A . 510 GLU HG2 1 1 3 1543 1 1 13 GLU HG3 H -11.776 -4.555 1.255 1.00 . A A . 510 GLU HG3 1 1 3 1544 1 1 13 GLU N N -11.394 -2.137 -2.143 1.00 . A A . 510 GLU N 1 1 3 1545 1 1 13 GLU O O -10.816 -2.443 1.443 1.00 . A A . 510 GLU O 1 1 3 1546 1 1 13 GLU OE1 O -14.380 -4.626 -0.658 1.00 . A A . 510 GLU OE1 1 1 3 1547 1 1 13 GLU OE2 O -14.243 -4.406 1.521 1.00 . A A . 510 GLU OE2 1 1 3 1548 1 1 14 ALA C C -9.373 -0.084 2.019 1.00 . A A . 511 ALA C 1 1 3 1549 1 1 14 ALA CA C -8.799 -0.612 0.703 1.00 . A A . 511 ALA CA 1 1 3 1550 1 1 14 ALA CB C -8.094 0.514 -0.034 1.00 . A A . 511 ALA CB 1 1 3 1551 1 1 14 ALA H H -9.836 -0.947 -1.102 1.00 . A A . 511 ALA H 1 1 3 1552 1 1 14 ALA HA H -8.061 -1.370 0.926 1.00 . A A . 511 ALA HA 1 1 3 1553 1 1 14 ALA HB1 H -7.705 0.145 -0.971 1.00 . A A . 511 ALA HB1 1 1 3 1554 1 1 14 ALA HB2 H -8.794 1.313 -0.225 1.00 . A A . 511 ALA HB2 1 1 3 1555 1 1 14 ALA HB3 H -7.279 0.886 0.571 1.00 . A A . 511 ALA HB3 1 1 3 1556 1 1 14 ALA N N -9.810 -1.216 -0.164 1.00 . A A . 511 ALA N 1 1 3 1557 1 1 14 ALA O O -10.537 0.315 2.104 1.00 . A A . 511 ALA O 1 1 3 1558 1 1 15 MET C C -7.697 0.754 5.213 1.00 . A A . 512 MET C 1 1 3 1559 1 1 15 MET CA C -8.913 0.348 4.375 1.00 . A A . 512 MET CA 1 1 3 1560 1 1 15 MET CB C -9.673 -0.784 5.075 1.00 . A A . 512 MET CB 1 1 3 1561 1 1 15 MET CE C -11.645 1.186 8.190 1.00 . A A . 512 MET CE 1 1 3 1562 1 1 15 MET CG C -10.178 -0.412 6.462 1.00 . A A . 512 MET CG 1 1 3 1563 1 1 15 MET H H -7.591 -0.316 2.860 1.00 . A A . 512 MET H 1 1 3 1564 1 1 15 MET HA H -9.569 1.202 4.288 1.00 . A A . 512 MET HA 1 1 3 1565 1 1 15 MET HB2 H -10.523 -1.062 4.469 1.00 . A A . 512 MET HB2 1 1 3 1566 1 1 15 MET HB3 H -9.016 -1.637 5.172 1.00 . A A . 512 MET HB3 1 1 3 1567 1 1 15 MET HE1 H -10.720 1.401 8.703 1.00 . A A . 512 MET HE1 1 1 3 1568 1 1 15 MET HE2 H -12.337 2.003 8.338 1.00 . A A . 512 MET HE2 1 1 3 1569 1 1 15 MET HE3 H -12.072 0.276 8.584 1.00 . A A . 512 MET HE3 1 1 3 1570 1 1 15 MET HG2 H -10.684 -1.266 6.887 1.00 . A A . 512 MET HG2 1 1 3 1571 1 1 15 MET HG3 H -9.330 -0.155 7.079 1.00 . A A . 512 MET HG3 1 1 3 1572 1 1 15 MET N N -8.519 -0.062 3.031 1.00 . A A . 512 MET N 1 1 3 1573 1 1 15 MET O O -7.802 1.601 6.099 1.00 . A A . 512 MET O 1 1 3 1574 1 1 15 MET SD S -11.321 0.985 6.438 1.00 . A A . 512 MET SD 1 1 3 1575 1 1 16 SER C C -4.222 0.971 4.870 1.00 . A A . 513 SER C 1 1 3 1576 1 1 16 SER CA C -5.354 0.412 5.725 1.00 . A A . 513 SER CA 1 1 3 1577 1 1 16 SER CB C -4.925 -0.882 6.417 1.00 . A A . 513 SER CB 1 1 3 1578 1 1 16 SER H H -6.461 -0.338 4.092 1.00 . A A . 513 SER H 1 1 3 1579 1 1 16 SER HA H -5.614 1.149 6.468 1.00 . A A . 513 SER HA 1 1 3 1580 1 1 16 SER HB2 H -4.675 -1.623 5.671 1.00 . A A . 513 SER HB2 1 1 3 1581 1 1 16 SER HB3 H -4.064 -0.688 7.039 1.00 . A A . 513 SER HB3 1 1 3 1582 1 1 16 SER HG H -6.395 -2.127 6.786 1.00 . A A . 513 SER HG 1 1 3 1583 1 1 16 SER N N -6.538 0.180 4.913 1.00 . A A . 513 SER N 1 1 3 1584 1 1 16 SER O O -4.078 0.609 3.706 1.00 . A A . 513 SER O 1 1 3 1585 1 1 16 SER OG O -5.972 -1.385 7.230 1.00 . A A . 513 SER OG 1 1 3 1586 1 1 17 GLU C C -1.003 1.810 5.116 1.00 . A A . 514 GLU C 1 1 3 1587 1 1 17 GLU CA C -2.322 2.464 4.718 1.00 . A A . 514 GLU CA 1 1 3 1588 1 1 17 GLU CB C -2.260 3.971 4.992 1.00 . A A . 514 GLU CB 1 1 3 1589 1 1 17 GLU CD C -1.905 5.810 6.702 1.00 . A A . 514 GLU CD 1 1 3 1590 1 1 17 GLU CG C -1.988 4.317 6.447 1.00 . A A . 514 GLU CG 1 1 3 1591 1 1 17 GLU H H -3.586 2.116 6.374 1.00 . A A . 514 GLU H 1 1 3 1592 1 1 17 GLU HA H -2.488 2.301 3.663 1.00 . A A . 514 GLU HA 1 1 3 1593 1 1 17 GLU HB2 H -1.474 4.401 4.390 1.00 . A A . 514 GLU HB2 1 1 3 1594 1 1 17 GLU HB3 H -3.202 4.418 4.708 1.00 . A A . 514 GLU HB3 1 1 3 1595 1 1 17 GLU HG2 H -2.783 3.910 7.053 1.00 . A A . 514 GLU HG2 1 1 3 1596 1 1 17 GLU HG3 H -1.050 3.867 6.740 1.00 . A A . 514 GLU HG3 1 1 3 1597 1 1 17 GLU N N -3.429 1.860 5.443 1.00 . A A . 514 GLU N 1 1 3 1598 1 1 17 GLU O O -0.878 1.236 6.203 1.00 . A A . 514 GLU O 1 1 3 1599 1 1 17 GLU OE1 O -1.955 6.598 5.736 1.00 . A A . 514 GLU OE1 1 1 3 1600 1 1 17 GLU OE2 O -1.798 6.206 7.883 1.00 . A A . 514 GLU OE2 1 1 3 1601 1 1 18 CYS C C 1.987 2.400 5.445 1.00 . A A . 515 CYS C 1 1 3 1602 1 1 18 CYS CA C 1.315 1.434 4.491 1.00 . A A . 515 CYS CA 1 1 3 1603 1 1 18 CYS CB C 2.120 1.340 3.194 1.00 . A A . 515 CYS CB 1 1 3 1604 1 1 18 CYS H H -0.234 2.271 3.341 1.00 . A A . 515 CYS H 1 1 3 1605 1 1 18 CYS HA H 1.293 0.472 4.991 1.00 . A A . 515 CYS HA 1 1 3 1606 1 1 18 CYS HB2 H 1.892 0.403 2.708 1.00 . A A . 515 CYS HB2 1 1 3 1607 1 1 18 CYS HB3 H 1.834 2.154 2.543 1.00 . A A . 515 CYS HB3 1 1 3 1608 1 1 18 CYS N N -0.038 1.881 4.215 1.00 . A A . 515 CYS N 1 1 3 1609 1 1 18 CYS O O 2.010 3.602 5.213 1.00 . A A . 515 CYS O 1 1 3 1610 1 1 18 CYS SG S 3.929 1.417 3.421 1.00 . A A . 515 CYS SG 1 1 3 1611 1 1 19 THR C C 4.674 2.870 6.864 1.00 . A A . 516 THR C 1 1 3 1612 1 1 19 THR CA C 3.291 2.658 7.462 1.00 . A A . 516 THR CA 1 1 3 1613 1 1 19 THR CB C 3.409 1.963 8.832 1.00 . A A . 516 THR CB 1 1 3 1614 1 1 19 THR CG2 C 4.097 2.866 9.844 1.00 . A A . 516 THR CG2 1 1 3 1615 1 1 19 THR H H 2.361 0.931 6.739 1.00 . A A . 516 THR H 1 1 3 1616 1 1 19 THR HA H 2.807 3.614 7.596 1.00 . A A . 516 THR HA 1 1 3 1617 1 1 19 THR HB H 3.996 1.065 8.714 1.00 . A A . 516 THR HB 1 1 3 1618 1 1 19 THR HG1 H 1.812 0.790 8.886 1.00 . A A . 516 THR HG1 1 1 3 1619 1 1 19 THR HG21 H 3.513 3.766 9.978 1.00 . A A . 516 THR HG21 1 1 3 1620 1 1 19 THR HG22 H 4.185 2.350 10.788 1.00 . A A . 516 THR HG22 1 1 3 1621 1 1 19 THR HG23 H 5.082 3.127 9.484 1.00 . A A . 516 THR HG23 1 1 3 1622 1 1 19 THR N N 2.503 1.870 6.546 1.00 . A A . 516 THR N 1 1 3 1623 1 1 19 THR O O 5.407 1.915 6.607 1.00 . A A . 516 THR O 1 1 3 1624 1 1 19 THR OG1 O 2.102 1.611 9.313 1.00 . A A . 516 THR OG1 1 1 3 1625 1 1 20 GLY C C 5.991 5.510 4.895 1.00 . A A . 517 GLY C 1 1 3 1626 1 1 20 GLY CA C 6.237 4.440 5.930 1.00 . A A . 517 GLY CA 1 1 3 1627 1 1 20 GLY H H 4.487 4.842 7.045 1.00 . A A . 517 GLY H 1 1 3 1628 1 1 20 GLY HA2 H 6.989 4.785 6.625 1.00 . A A . 517 GLY HA2 1 1 3 1629 1 1 20 GLY HA3 H 6.595 3.549 5.435 1.00 . A A . 517 GLY HA3 1 1 3 1630 1 1 20 GLY N N 5.029 4.124 6.658 1.00 . A A . 517 GLY N 1 1 3 1631 1 1 20 GLY O O 6.749 6.480 4.796 1.00 . A A . 517 GLY O 1 1 3 1632 1 1 21 CYS C C 3.040 6.634 3.320 1.00 . A A . 518 CYS C 1 1 3 1633 1 1 21 CYS CA C 4.530 6.360 3.174 1.00 . A A . 518 CYS CA 1 1 3 1634 1 1 21 CYS CB C 4.844 5.907 1.748 1.00 . A A . 518 CYS CB 1 1 3 1635 1 1 21 CYS H H 4.378 4.536 4.224 1.00 . A A . 518 CYS H 1 1 3 1636 1 1 21 CYS HA H 5.082 7.251 3.422 1.00 . A A . 518 CYS HA 1 1 3 1637 1 1 21 CYS HB2 H 4.660 6.726 1.070 1.00 . A A . 518 CYS HB2 1 1 3 1638 1 1 21 CYS HB3 H 5.882 5.617 1.679 1.00 . A A . 518 CYS HB3 1 1 3 1639 1 1 21 CYS N N 4.923 5.348 4.132 1.00 . A A . 518 CYS N 1 1 3 1640 1 1 21 CYS O O 2.333 5.888 3.981 1.00 . A A . 518 CYS O 1 1 3 1641 1 1 21 CYS SG S 3.830 4.492 1.198 1.00 . A A . 518 CYS SG 1 1 3 1642 1 1 22 HIS C C 0.698 8.300 1.303 1.00 . A A . 519 HIS C 1 1 3 1643 1 1 22 HIS CA C 1.133 7.965 2.712 1.00 . A A . 519 HIS CA 1 1 3 1644 1 1 22 HIS CB C 0.746 9.090 3.671 1.00 . A A . 519 HIS CB 1 1 3 1645 1 1 22 HIS CD2 C 2.336 8.982 5.696 1.00 . A A . 519 HIS CD2 1 1 3 1646 1 1 22 HIS CE1 C 0.946 8.144 7.164 1.00 . A A . 519 HIS CE1 1 1 3 1647 1 1 22 HIS CG C 1.147 8.814 5.081 1.00 . A A . 519 HIS CG 1 1 3 1648 1 1 22 HIS H H 3.182 8.380 2.357 1.00 . A A . 519 HIS H 1 1 3 1649 1 1 22 HIS HA H 0.637 7.057 3.020 1.00 . A A . 519 HIS HA 1 1 3 1650 1 1 22 HIS HB2 H 1.229 10.005 3.360 1.00 . A A . 519 HIS HB2 1 1 3 1651 1 1 22 HIS HB3 H -0.325 9.225 3.647 1.00 . A A . 519 HIS HB3 1 1 3 1652 1 1 22 HIS HD1 H -0.646 8.020 5.877 1.00 . A A . 519 HIS HD1 1 1 3 1653 1 1 22 HIS HD2 H 3.243 9.355 5.237 1.00 . A A . 519 HIS HD2 1 1 3 1654 1 1 22 HIS HE1 H 0.533 7.754 8.085 1.00 . A A . 519 HIS HE1 1 1 3 1655 1 1 22 HIS HE2 H 2.932 8.383 7.622 1.00 . A A . 519 HIS HE2 1 1 3 1656 1 1 22 HIS N N 2.564 7.719 2.744 1.00 . A A . 519 HIS N 1 1 3 1657 1 1 22 HIS ND1 N 0.296 8.285 6.027 1.00 . A A . 519 HIS ND1 1 1 3 1658 1 1 22 HIS NE2 N 2.187 8.559 6.993 1.00 . A A . 519 HIS NE2 1 1 3 1659 1 1 22 HIS O O -0.286 9.006 1.096 1.00 . A A . 519 HIS O 1 1 3 1660 1 1 23 LYS C C 0.166 7.008 -1.606 1.00 . A A . 520 LYS C 1 1 3 1661 1 1 23 LYS CA C 1.116 8.065 -1.061 1.00 . A A . 520 LYS CA 1 1 3 1662 1 1 23 LYS CB C 2.380 8.135 -1.927 1.00 . A A . 520 LYS CB 1 1 3 1663 1 1 23 LYS CD C 4.166 6.839 -3.142 1.00 . A A . 520 LYS CD 1 1 3 1664 1 1 23 LYS CE C 3.441 6.954 -4.480 1.00 . A A . 520 LYS CE 1 1 3 1665 1 1 23 LYS CG C 3.178 6.840 -1.981 1.00 . A A . 520 LYS CG 1 1 3 1666 1 1 23 LYS H H 2.231 7.255 0.536 1.00 . A A . 520 LYS H 1 1 3 1667 1 1 23 LYS HA H 0.618 9.022 -1.099 1.00 . A A . 520 LYS HA 1 1 3 1668 1 1 23 LYS HB2 H 2.096 8.394 -2.934 1.00 . A A . 520 LYS HB2 1 1 3 1669 1 1 23 LYS HB3 H 3.024 8.909 -1.538 1.00 . A A . 520 LYS HB3 1 1 3 1670 1 1 23 LYS HD2 H 4.841 7.676 -3.032 1.00 . A A . 520 LYS HD2 1 1 3 1671 1 1 23 LYS HD3 H 4.727 5.915 -3.122 1.00 . A A . 520 LYS HD3 1 1 3 1672 1 1 23 LYS HE2 H 2.792 6.099 -4.593 1.00 . A A . 520 LYS HE2 1 1 3 1673 1 1 23 LYS HE3 H 2.846 7.855 -4.475 1.00 . A A . 520 LYS HE3 1 1 3 1674 1 1 23 LYS HG2 H 3.723 6.728 -1.056 1.00 . A A . 520 LYS HG2 1 1 3 1675 1 1 23 LYS HG3 H 2.494 6.013 -2.102 1.00 . A A . 520 LYS HG3 1 1 3 1676 1 1 23 LYS HZ1 H 4.996 6.163 -5.634 1.00 . A A . 520 LYS HZ1 1 1 3 1677 1 1 23 LYS HZ2 H 3.830 7.008 -6.530 1.00 . A A . 520 LYS HZ2 1 1 3 1678 1 1 23 LYS HZ3 H 4.957 7.861 -5.598 1.00 . A A . 520 LYS HZ3 1 1 3 1679 1 1 23 LYS N N 1.442 7.801 0.326 1.00 . A A . 520 LYS N 1 1 3 1680 1 1 23 LYS NZ N 4.373 7.000 -5.637 1.00 . A A . 520 LYS NZ 1 1 3 1681 1 1 23 LYS O O -0.594 7.277 -2.540 1.00 . A A . 520 LYS O 1 1 3 1682 1 1 24 VAL C C -1.378 4.049 -0.358 1.00 . A A . 521 VAL C 1 1 3 1683 1 1 24 VAL CA C -0.629 4.702 -1.515 1.00 . A A . 521 VAL CA 1 1 3 1684 1 1 24 VAL CB C 0.207 3.615 -2.235 1.00 . A A . 521 VAL CB 1 1 3 1685 1 1 24 VAL CG1 C 0.860 4.167 -3.493 1.00 . A A . 521 VAL CG1 1 1 3 1686 1 1 24 VAL CG2 C 1.258 3.034 -1.297 1.00 . A A . 521 VAL CG2 1 1 3 1687 1 1 24 VAL H H 0.762 5.644 -0.245 1.00 . A A . 521 VAL H 1 1 3 1688 1 1 24 VAL HA H -1.346 5.103 -2.215 1.00 . A A . 521 VAL HA 1 1 3 1689 1 1 24 VAL HB H -0.459 2.817 -2.528 1.00 . A A . 521 VAL HB 1 1 3 1690 1 1 24 VAL HG11 H 1.505 4.991 -3.231 1.00 . A A . 521 VAL HG11 1 1 3 1691 1 1 24 VAL HG12 H 1.441 3.391 -3.965 1.00 . A A . 521 VAL HG12 1 1 3 1692 1 1 24 VAL HG13 H 0.096 4.510 -4.176 1.00 . A A . 521 VAL HG13 1 1 3 1693 1 1 24 VAL HG21 H 0.772 2.570 -0.451 1.00 . A A . 521 VAL HG21 1 1 3 1694 1 1 24 VAL HG22 H 1.842 2.294 -1.824 1.00 . A A . 521 VAL HG22 1 1 3 1695 1 1 24 VAL HG23 H 1.908 3.823 -0.950 1.00 . A A . 521 VAL HG23 1 1 3 1696 1 1 24 VAL N N 0.199 5.802 -1.037 1.00 . A A . 521 VAL N 1 1 3 1697 1 1 24 VAL O O -0.986 4.178 0.801 1.00 . A A . 521 VAL O 1 1 3 1698 1 1 25 ASN C C -3.434 1.201 -0.024 1.00 . A A . 522 ASN C 1 1 3 1699 1 1 25 ASN CA C -3.251 2.670 0.325 1.00 . A A . 522 ASN CA 1 1 3 1700 1 1 25 ASN CB C -4.626 3.329 0.512 1.00 . A A . 522 ASN CB 1 1 3 1701 1 1 25 ASN CG C -4.999 4.273 -0.611 1.00 . A A . 522 ASN CG 1 1 3 1702 1 1 25 ASN H H -2.718 3.290 -1.626 1.00 . A A . 522 ASN H 1 1 3 1703 1 1 25 ASN HA H -2.714 2.718 1.260 1.00 . A A . 522 ASN HA 1 1 3 1704 1 1 25 ASN HB2 H -5.382 2.557 0.561 1.00 . A A . 522 ASN HB2 1 1 3 1705 1 1 25 ASN HB3 H -4.627 3.885 1.439 1.00 . A A . 522 ASN HB3 1 1 3 1706 1 1 25 ASN HD21 H -5.632 2.746 -1.715 1.00 . A A . 522 ASN HD21 1 1 3 1707 1 1 25 ASN HD22 H -5.780 4.321 -2.436 1.00 . A A . 522 ASN HD22 1 1 3 1708 1 1 25 ASN N N -2.455 3.355 -0.684 1.00 . A A . 522 ASN N 1 1 3 1709 1 1 25 ASN ND2 N -5.519 3.727 -1.693 1.00 . A A . 522 ASN ND2 1 1 3 1710 1 1 25 ASN O O -3.325 0.798 -1.182 1.00 . A A . 522 ASN O 1 1 3 1711 1 1 25 ASN OD1 O -4.795 5.481 -0.514 1.00 . A A . 522 ASN OD1 1 1 3 1712 1 1 26 TYR C C -5.250 -1.360 1.530 1.00 . A A . 523 TYR C 1 1 3 1713 1 1 26 TYR CA C -3.929 -1.008 0.869 1.00 . A A . 523 TYR CA 1 1 3 1714 1 1 26 TYR CB C -2.810 -1.820 1.533 1.00 . A A . 523 TYR CB 1 1 3 1715 1 1 26 TYR CD1 C -0.634 -0.568 1.233 1.00 . A A . 523 TYR CD1 1 1 3 1716 1 1 26 TYR CD2 C -0.942 -2.596 0.026 1.00 . A A . 523 TYR CD2 1 1 3 1717 1 1 26 TYR CE1 C 0.627 -0.429 0.686 1.00 . A A . 523 TYR CE1 1 1 3 1718 1 1 26 TYR CE2 C 0.317 -2.463 -0.527 1.00 . A A . 523 TYR CE2 1 1 3 1719 1 1 26 TYR CG C -1.438 -1.653 0.916 1.00 . A A . 523 TYR CG 1 1 3 1720 1 1 26 TYR CZ C 1.096 -1.376 -0.195 1.00 . A A . 523 TYR CZ 1 1 3 1721 1 1 26 TYR H H -3.811 0.833 1.891 1.00 . A A . 523 TYR H 1 1 3 1722 1 1 26 TYR HA H -3.980 -1.242 -0.186 1.00 . A A . 523 TYR HA 1 1 3 1723 1 1 26 TYR HB2 H -2.736 -1.527 2.569 1.00 . A A . 523 TYR HB2 1 1 3 1724 1 1 26 TYR HB3 H -3.068 -2.869 1.485 1.00 . A A . 523 TYR HB3 1 1 3 1725 1 1 26 TYR HD1 H -1.003 0.175 1.925 1.00 . A A . 523 TYR HD1 1 1 3 1726 1 1 26 TYR HD2 H -1.557 -3.448 -0.233 1.00 . A A . 523 TYR HD2 1 1 3 1727 1 1 26 TYR HE1 H 1.237 0.423 0.946 1.00 . A A . 523 TYR HE1 1 1 3 1728 1 1 26 TYR HE2 H 0.683 -3.208 -1.217 1.00 . A A . 523 TYR HE2 1 1 3 1729 1 1 26 TYR HH H 2.356 -1.558 -1.651 1.00 . A A . 523 TYR HH 1 1 3 1730 1 1 26 TYR N N -3.704 0.419 1.007 1.00 . A A . 523 TYR N 1 1 3 1731 1 1 26 TYR O O -5.982 -0.475 1.975 1.00 . A A . 523 TYR O 1 1 3 1732 1 1 26 TYR OH O 2.354 -1.241 -0.731 1.00 . A A . 523 TYR OH 1 1 3 1733 1 1 27 CYS C C -6.431 -3.786 3.583 1.00 . A A . 524 CYS C 1 1 3 1734 1 1 27 CYS CA C -6.762 -3.082 2.277 1.00 . A A . 524 CYS CA 1 1 3 1735 1 1 27 CYS CB C -7.533 -4.024 1.353 1.00 . A A . 524 CYS CB 1 1 3 1736 1 1 27 CYS H H -4.884 -3.308 1.351 1.00 . A A . 524 CYS H 1 1 3 1737 1 1 27 CYS HA H -7.367 -2.212 2.485 1.00 . A A . 524 CYS HA 1 1 3 1738 1 1 27 CYS HB2 H -8.493 -4.245 1.797 1.00 . A A . 524 CYS HB2 1 1 3 1739 1 1 27 CYS HB3 H -7.683 -3.540 0.400 1.00 . A A . 524 CYS HB3 1 1 3 1740 1 1 27 CYS N N -5.535 -2.642 1.644 1.00 . A A . 524 CYS N 1 1 3 1741 1 1 27 CYS O O -7.111 -3.611 4.596 1.00 . A A . 524 CYS O 1 1 3 1742 1 1 27 CYS SG S -6.689 -5.609 1.044 1.00 . A A . 524 CYS SG 1 1 3 1743 1 1 28 SER C C -3.409 -5.416 4.709 1.00 . A A . 525 SER C 1 1 3 1744 1 1 28 SER CA C -4.931 -5.370 4.671 1.00 . A A . 525 SER CA 1 1 3 1745 1 1 28 SER CB C -5.501 -6.788 4.536 1.00 . A A . 525 SER CB 1 1 3 1746 1 1 28 SER H H -4.823 -4.611 2.727 1.00 . A A . 525 SER H 1 1 3 1747 1 1 28 SER HA H -5.301 -4.917 5.578 1.00 . A A . 525 SER HA 1 1 3 1748 1 1 28 SER HB2 H -4.989 -7.448 5.219 1.00 . A A . 525 SER HB2 1 1 3 1749 1 1 28 SER HB3 H -6.555 -6.778 4.768 1.00 . A A . 525 SER HB3 1 1 3 1750 1 1 28 SER HG H -5.811 -6.721 2.590 1.00 . A A . 525 SER HG 1 1 3 1751 1 1 28 SER N N -5.360 -4.565 3.545 1.00 . A A . 525 SER N 1 1 3 1752 1 1 28 SER O O -2.754 -4.959 3.769 1.00 . A A . 525 SER O 1 1 3 1753 1 1 28 SER OG O -5.326 -7.285 3.216 1.00 . A A . 525 SER OG 1 1 3 1754 1 1 29 THR C C -0.884 -7.152 4.894 1.00 . A A . 526 THR C 1 1 3 1755 1 1 29 THR CA C -1.402 -6.101 5.880 1.00 . A A . 526 THR CA 1 1 3 1756 1 1 29 THR CB C -0.988 -6.472 7.320 1.00 . A A . 526 THR CB 1 1 3 1757 1 1 29 THR CG2 C 0.528 -6.482 7.475 1.00 . A A . 526 THR CG2 1 1 3 1758 1 1 29 THR H H -3.415 -6.297 6.505 1.00 . A A . 526 THR H 1 1 3 1759 1 1 29 THR HA H -0.962 -5.143 5.633 1.00 . A A . 526 THR HA 1 1 3 1760 1 1 29 THR HB H -1.365 -7.460 7.544 1.00 . A A . 526 THR HB 1 1 3 1761 1 1 29 THR HG1 H -2.482 -5.765 8.405 1.00 . A A . 526 THR HG1 1 1 3 1762 1 1 29 THR HG21 H 0.924 -5.511 7.214 1.00 . A A . 526 THR HG21 1 1 3 1763 1 1 29 THR HG22 H 0.784 -6.713 8.498 1.00 . A A . 526 THR HG22 1 1 3 1764 1 1 29 THR HG23 H 0.953 -7.231 6.821 1.00 . A A . 526 THR HG23 1 1 3 1765 1 1 29 THR N N -2.847 -5.969 5.771 1.00 . A A . 526 THR N 1 1 3 1766 1 1 29 THR O O 0.276 -7.114 4.477 1.00 . A A . 526 THR O 1 1 3 1767 1 1 29 THR OG1 O -1.555 -5.531 8.241 1.00 . A A . 526 THR OG1 1 1 3 1768 1 1 30 PHE C C -0.955 -8.534 2.216 1.00 . A A . 527 PHE C 1 1 3 1769 1 1 30 PHE CA C -1.399 -9.120 3.556 1.00 . A A . 527 PHE CA 1 1 3 1770 1 1 30 PHE CB C -2.583 -10.071 3.351 1.00 . A A . 527 PHE CB 1 1 3 1771 1 1 30 PHE CD1 C -1.644 -12.155 2.311 1.00 . A A . 527 PHE CD1 1 1 3 1772 1 1 30 PHE CD2 C -2.984 -10.715 0.965 1.00 . A A . 527 PHE CD2 1 1 3 1773 1 1 30 PHE CE1 C -1.468 -13.003 1.236 1.00 . A A . 527 PHE CE1 1 1 3 1774 1 1 30 PHE CE2 C -2.808 -11.557 -0.116 1.00 . A A . 527 PHE CE2 1 1 3 1775 1 1 30 PHE CG C -2.404 -11.004 2.188 1.00 . A A . 527 PHE CG 1 1 3 1776 1 1 30 PHE CZ C -2.049 -12.704 0.021 1.00 . A A . 527 PHE CZ 1 1 3 1777 1 1 30 PHE H H -2.663 -8.066 4.888 1.00 . A A . 527 PHE H 1 1 3 1778 1 1 30 PHE HA H -0.576 -9.676 3.981 1.00 . A A . 527 PHE HA 1 1 3 1779 1 1 30 PHE HB2 H -2.714 -10.669 4.241 1.00 . A A . 527 PHE HB2 1 1 3 1780 1 1 30 PHE HB3 H -3.476 -9.489 3.179 1.00 . A A . 527 PHE HB3 1 1 3 1781 1 1 30 PHE HD1 H -3.582 -9.818 0.865 1.00 . A A . 527 PHE HD1 1 1 3 1782 1 1 30 PHE HD2 H -1.188 -12.390 3.262 1.00 . A A . 527 PHE HD2 1 1 3 1783 1 1 30 PHE HE1 H -3.261 -11.319 -1.067 1.00 . A A . 527 PHE HE1 1 1 3 1784 1 1 30 PHE HE2 H -0.873 -13.899 1.345 1.00 . A A . 527 PHE HE2 1 1 3 1785 1 1 30 PHE HZ H -1.908 -13.364 -0.822 1.00 . A A . 527 PHE HZ 1 1 3 1786 1 1 30 PHE N N -1.759 -8.073 4.502 1.00 . A A . 527 PHE N 1 1 3 1787 1 1 30 PHE O O 0.112 -8.888 1.712 1.00 . A A . 527 PHE O 1 1 3 1788 1 1 31 CYS C C -0.116 -6.134 0.618 1.00 . A A . 528 CYS C 1 1 3 1789 1 1 31 CYS CA C -1.358 -6.988 0.395 1.00 . A A . 528 CYS CA 1 1 3 1790 1 1 31 CYS CB C -2.476 -6.126 -0.195 1.00 . A A . 528 CYS CB 1 1 3 1791 1 1 31 CYS H H -2.588 -7.373 2.084 1.00 . A A . 528 CYS H 1 1 3 1792 1 1 31 CYS HA H -1.110 -7.785 -0.289 1.00 . A A . 528 CYS HA 1 1 3 1793 1 1 31 CYS HB2 H -2.869 -5.491 0.583 1.00 . A A . 528 CYS HB2 1 1 3 1794 1 1 31 CYS HB3 H -2.056 -5.503 -0.970 1.00 . A A . 528 CYS HB3 1 1 3 1795 1 1 31 CYS N N -1.747 -7.626 1.648 1.00 . A A . 528 CYS N 1 1 3 1796 1 1 31 CYS O O 0.746 -6.039 -0.248 1.00 . A A . 528 CYS O 1 1 3 1797 1 1 31 CYS SG S -3.892 -7.024 -0.922 1.00 . A A . 528 CYS SG 1 1 3 1798 1 1 32 GLN C C 2.404 -5.380 2.036 1.00 . A A . 529 GLN C 1 1 3 1799 1 1 32 GLN CA C 1.073 -4.636 2.142 1.00 . A A . 529 GLN CA 1 1 3 1800 1 1 32 GLN CB C 0.876 -4.088 3.566 1.00 . A A . 529 GLN CB 1 1 3 1801 1 1 32 GLN CD C 2.504 -2.230 4.074 1.00 . A A . 529 GLN CD 1 1 3 1802 1 1 32 GLN CG C 2.166 -3.688 4.268 1.00 . A A . 529 GLN CG 1 1 3 1803 1 1 32 GLN H H -0.738 -5.683 2.460 1.00 . A A . 529 GLN H 1 1 3 1804 1 1 32 GLN HA H 1.064 -3.820 1.437 1.00 . A A . 529 GLN HA 1 1 3 1805 1 1 32 GLN HB2 H 0.245 -3.208 3.516 1.00 . A A . 529 GLN HB2 1 1 3 1806 1 1 32 GLN HB3 H 0.384 -4.839 4.164 1.00 . A A . 529 GLN HB3 1 1 3 1807 1 1 32 GLN HE21 H 3.534 -2.650 2.428 1.00 . A A . 529 GLN HE21 1 1 3 1808 1 1 32 GLN HE22 H 3.470 -0.974 2.875 1.00 . A A . 529 GLN HE22 1 1 3 1809 1 1 32 GLN HG2 H 2.061 -3.879 5.326 1.00 . A A . 529 GLN HG2 1 1 3 1810 1 1 32 GLN HG3 H 2.976 -4.285 3.873 1.00 . A A . 529 GLN HG3 1 1 3 1811 1 1 32 GLN N N -0.040 -5.517 1.795 1.00 . A A . 529 GLN N 1 1 3 1812 1 1 32 GLN NE2 N 3.245 -1.922 3.021 1.00 . A A . 529 GLN NE2 1 1 3 1813 1 1 32 GLN O O 3.355 -4.887 1.427 1.00 . A A . 529 GLN O 1 1 3 1814 1 1 32 GLN OE1 O 2.094 -1.388 4.871 1.00 . A A . 529 GLN OE1 1 1 3 1815 1 1 33 ARG C C 3.895 -7.983 1.242 1.00 . A A . 530 ARG C 1 1 3 1816 1 1 33 ARG CA C 3.679 -7.364 2.623 1.00 . A A . 530 ARG CA 1 1 3 1817 1 1 33 ARG CB C 3.634 -8.444 3.706 1.00 . A A . 530 ARG CB 1 1 3 1818 1 1 33 ARG CD C 4.883 -10.194 5.017 1.00 . A A . 530 ARG CD 1 1 3 1819 1 1 33 ARG CG C 4.991 -9.068 4.002 1.00 . A A . 530 ARG CG 1 1 3 1820 1 1 33 ARG CZ C 3.548 -12.263 5.183 1.00 . A A . 530 ARG CZ 1 1 3 1821 1 1 33 ARG H H 1.645 -6.916 3.060 1.00 . A A . 530 ARG H 1 1 3 1822 1 1 33 ARG HA H 4.492 -6.682 2.825 1.00 . A A . 530 ARG HA 1 1 3 1823 1 1 33 ARG HB2 H 3.255 -8.008 4.619 1.00 . A A . 530 ARG HB2 1 1 3 1824 1 1 33 ARG HB3 H 2.964 -9.229 3.388 1.00 . A A . 530 ARG HB3 1 1 3 1825 1 1 33 ARG HD2 H 5.877 -10.472 5.336 1.00 . A A . 530 ARG HD2 1 1 3 1826 1 1 33 ARG HD3 H 4.318 -9.843 5.867 1.00 . A A . 530 ARG HD3 1 1 3 1827 1 1 33 ARG HE H 4.308 -11.519 3.483 1.00 . A A . 530 ARG HE 1 1 3 1828 1 1 33 ARG HG2 H 5.403 -9.463 3.085 1.00 . A A . 530 ARG HG2 1 1 3 1829 1 1 33 ARG HG3 H 5.648 -8.304 4.393 1.00 . A A . 530 ARG HG3 1 1 3 1830 1 1 33 ARG HH11 H 3.728 -11.241 6.931 1.00 . A A . 530 ARG HH11 1 1 3 1831 1 1 33 ARG HH12 H 2.867 -12.748 7.035 1.00 . A A . 530 ARG HH12 1 1 3 1832 1 1 33 ARG HH21 H 3.155 -13.474 3.601 1.00 . A A . 530 ARG HH21 1 1 3 1833 1 1 33 ARG HH22 H 2.532 -14.021 5.134 1.00 . A A . 530 ARG HH22 1 1 3 1834 1 1 33 ARG N N 2.460 -6.564 2.636 1.00 . A A . 530 ARG N 1 1 3 1835 1 1 33 ARG NE N 4.220 -11.370 4.461 1.00 . A A . 530 ARG NE 1 1 3 1836 1 1 33 ARG NH1 N 3.363 -12.069 6.485 1.00 . A A . 530 ARG NH1 1 1 3 1837 1 1 33 ARG NH2 N 3.036 -13.337 4.593 1.00 . A A . 530 ARG NH2 1 1 3 1838 1 1 33 ARG O O 5.025 -8.194 0.806 1.00 . A A . 530 ARG O 1 1 3 1839 1 1 34 LYS C C 3.379 -7.897 -1.795 1.00 . A A . 531 LYS C 1 1 3 1840 1 1 34 LYS CA C 2.834 -8.880 -0.758 1.00 . A A . 531 LYS CA 1 1 3 1841 1 1 34 LYS CB C 1.420 -9.355 -1.125 1.00 . A A . 531 LYS CB 1 1 3 1842 1 1 34 LYS CD C 1.232 -9.376 -3.645 1.00 . A A . 531 LYS CD 1 1 3 1843 1 1 34 LYS CE C 0.940 -10.232 -4.865 1.00 . A A . 531 LYS CE 1 1 3 1844 1 1 34 LYS CG C 1.319 -10.214 -2.380 1.00 . A A . 531 LYS CG 1 1 3 1845 1 1 34 LYS H H 1.923 -8.041 0.956 1.00 . A A . 531 LYS H 1 1 3 1846 1 1 34 LYS HA H 3.492 -9.734 -0.703 1.00 . A A . 531 LYS HA 1 1 3 1847 1 1 34 LYS HB2 H 1.028 -9.929 -0.301 1.00 . A A . 531 LYS HB2 1 1 3 1848 1 1 34 LYS HB3 H 0.796 -8.483 -1.265 1.00 . A A . 531 LYS HB3 1 1 3 1849 1 1 34 LYS HD2 H 0.441 -8.652 -3.531 1.00 . A A . 531 LYS HD2 1 1 3 1850 1 1 34 LYS HD3 H 2.174 -8.864 -3.791 1.00 . A A . 531 LYS HD3 1 1 3 1851 1 1 34 LYS HE2 H 1.789 -10.874 -5.050 1.00 . A A . 531 LYS HE2 1 1 3 1852 1 1 34 LYS HE3 H 0.068 -10.839 -4.668 1.00 . A A . 531 LYS HE3 1 1 3 1853 1 1 34 LYS HG2 H 2.191 -10.844 -2.441 1.00 . A A . 531 LYS HG2 1 1 3 1854 1 1 34 LYS HG3 H 0.432 -10.829 -2.307 1.00 . A A . 531 LYS HG3 1 1 3 1855 1 1 34 LYS HZ1 H 1.522 -8.807 -6.279 1.00 . A A . 531 LYS HZ1 1 1 3 1856 1 1 34 LYS HZ2 H 0.502 -10.013 -6.895 1.00 . A A . 531 LYS HZ2 1 1 3 1857 1 1 34 LYS HZ3 H -0.136 -8.785 -5.916 1.00 . A A . 531 LYS HZ3 1 1 3 1858 1 1 34 LYS N N 2.793 -8.259 0.558 1.00 . A A . 531 LYS N 1 1 3 1859 1 1 34 LYS NZ N 0.690 -9.400 -6.071 1.00 . A A . 531 LYS NZ 1 1 3 1860 1 1 34 LYS O O 4.206 -8.255 -2.634 1.00 . A A . 531 LYS O 1 1 3 1861 1 1 35 ASP C C 4.751 -5.067 -2.188 1.00 . A A . 532 ASP C 1 1 3 1862 1 1 35 ASP CA C 3.376 -5.588 -2.604 1.00 . A A . 532 ASP CA 1 1 3 1863 1 1 35 ASP CB C 2.358 -4.442 -2.574 1.00 . A A . 532 ASP CB 1 1 3 1864 1 1 35 ASP CG C 2.647 -3.353 -3.590 1.00 . A A . 532 ASP CG 1 1 3 1865 1 1 35 ASP H H 2.222 -6.439 -1.057 1.00 . A A . 532 ASP H 1 1 3 1866 1 1 35 ASP HA H 3.427 -5.972 -3.613 1.00 . A A . 532 ASP HA 1 1 3 1867 1 1 35 ASP HB2 H 1.376 -4.841 -2.773 1.00 . A A . 532 ASP HB2 1 1 3 1868 1 1 35 ASP HB3 H 2.363 -3.996 -1.588 1.00 . A A . 532 ASP HB3 1 1 3 1869 1 1 35 ASP N N 2.924 -6.653 -1.714 1.00 . A A . 532 ASP N 1 1 3 1870 1 1 35 ASP O O 5.428 -4.381 -2.954 1.00 . A A . 532 ASP O 1 1 3 1871 1 1 35 ASP OD1 O 2.620 -3.647 -4.804 1.00 . A A . 532 ASP OD1 1 1 3 1872 1 1 35 ASP OD2 O 2.868 -2.195 -3.177 1.00 . A A . 532 ASP OD2 1 1 3 1873 1 1 36 TRP C C 7.648 -5.208 -1.228 1.00 . A A . 533 TRP C 1 1 3 1874 1 1 36 TRP CA C 6.403 -4.950 -0.379 1.00 . A A . 533 TRP CA 1 1 3 1875 1 1 36 TRP CB C 6.603 -5.551 1.014 1.00 . A A . 533 TRP CB 1 1 3 1876 1 1 36 TRP CD1 C 8.899 -5.488 2.147 1.00 . A A . 533 TRP CD1 1 1 3 1877 1 1 36 TRP CD2 C 7.799 -3.538 2.176 1.00 . A A . 533 TRP CD2 1 1 3 1878 1 1 36 TRP CE2 C 9.040 -3.364 2.816 1.00 . A A . 533 TRP CE2 1 1 3 1879 1 1 36 TRP CE3 C 6.934 -2.443 2.073 1.00 . A A . 533 TRP CE3 1 1 3 1880 1 1 36 TRP CG C 7.728 -4.906 1.759 1.00 . A A . 533 TRP CG 1 1 3 1881 1 1 36 TRP CH2 C 8.576 -1.088 3.228 1.00 . A A . 533 TRP CH2 1 1 3 1882 1 1 36 TRP CZ2 C 9.439 -2.142 3.345 1.00 . A A . 533 TRP CZ2 1 1 3 1883 1 1 36 TRP CZ3 C 7.331 -1.230 2.601 1.00 . A A . 533 TRP CZ3 1 1 3 1884 1 1 36 TRP H H 4.650 -6.133 -0.507 1.00 . A A . 533 TRP H 1 1 3 1885 1 1 36 TRP HA H 6.284 -3.881 -0.263 1.00 . A A . 533 TRP HA 1 1 3 1886 1 1 36 TRP HB2 H 5.699 -5.425 1.589 1.00 . A A . 533 TRP HB2 1 1 3 1887 1 1 36 TRP HB3 H 6.823 -6.604 0.919 1.00 . A A . 533 TRP HB3 1 1 3 1888 1 1 36 TRP HD1 H 9.150 -6.523 1.973 1.00 . A A . 533 TRP HD1 1 1 3 1889 1 1 36 TRP HE1 H 10.589 -4.742 3.161 1.00 . A A . 533 TRP HE1 1 1 3 1890 1 1 36 TRP HE3 H 5.970 -2.536 1.593 1.00 . A A . 533 TRP HE3 1 1 3 1891 1 1 36 TRP HH2 H 8.847 -0.123 3.628 1.00 . A A . 533 TRP HH2 1 1 3 1892 1 1 36 TRP HZ2 H 10.397 -2.014 3.824 1.00 . A A . 533 TRP HZ2 1 1 3 1893 1 1 36 TRP HZ3 H 6.679 -0.372 2.532 1.00 . A A . 533 TRP HZ3 1 1 3 1894 1 1 36 TRP N N 5.180 -5.471 -0.996 1.00 . A A . 533 TRP N 1 1 3 1895 1 1 36 TRP NE1 N 9.693 -4.566 2.785 1.00 . A A . 533 TRP NE1 1 1 3 1896 1 1 36 TRP O O 8.617 -4.467 -1.154 1.00 . A A . 533 TRP O 1 1 3 1897 1 1 37 LYS C C 9.111 -5.591 -3.890 1.00 . A A . 534 LYS C 1 1 3 1898 1 1 37 LYS CA C 8.790 -6.628 -2.821 1.00 . A A . 534 LYS CA 1 1 3 1899 1 1 37 LYS CB C 8.596 -8.012 -3.429 1.00 . A A . 534 LYS CB 1 1 3 1900 1 1 37 LYS CD C 8.018 -10.422 -3.027 1.00 . A A . 534 LYS CD 1 1 3 1901 1 1 37 LYS CE C 7.751 -11.483 -1.973 1.00 . A A . 534 LYS CE 1 1 3 1902 1 1 37 LYS CG C 8.327 -9.082 -2.387 1.00 . A A . 534 LYS CG 1 1 3 1903 1 1 37 LYS H H 6.780 -6.734 -2.151 1.00 . A A . 534 LYS H 1 1 3 1904 1 1 37 LYS HA H 9.645 -6.634 -2.164 1.00 . A A . 534 LYS HA 1 1 3 1905 1 1 37 LYS HB2 H 7.761 -7.983 -4.114 1.00 . A A . 534 LYS HB2 1 1 3 1906 1 1 37 LYS HB3 H 9.489 -8.283 -3.972 1.00 . A A . 534 LYS HB3 1 1 3 1907 1 1 37 LYS HD2 H 7.143 -10.320 -3.649 1.00 . A A . 534 LYS HD2 1 1 3 1908 1 1 37 LYS HD3 H 8.859 -10.728 -3.631 1.00 . A A . 534 LYS HD3 1 1 3 1909 1 1 37 LYS HE2 H 8.655 -11.651 -1.409 1.00 . A A . 534 LYS HE2 1 1 3 1910 1 1 37 LYS HE3 H 6.976 -11.124 -1.312 1.00 . A A . 534 LYS HE3 1 1 3 1911 1 1 37 LYS HG2 H 9.197 -9.186 -1.760 1.00 . A A . 534 LYS HG2 1 1 3 1912 1 1 37 LYS HG3 H 7.483 -8.776 -1.785 1.00 . A A . 534 LYS HG3 1 1 3 1913 1 1 37 LYS HZ1 H 8.037 -13.112 -3.248 1.00 . A A . 534 LYS HZ1 1 1 3 1914 1 1 37 LYS HZ2 H 7.169 -13.484 -1.837 1.00 . A A . 534 LYS HZ2 1 1 3 1915 1 1 37 LYS HZ3 H 6.418 -12.629 -3.096 1.00 . A A . 534 LYS HZ3 1 1 3 1916 1 1 37 LYS N N 7.615 -6.240 -2.043 1.00 . A A . 534 LYS N 1 1 3 1917 1 1 37 LYS NZ N 7.315 -12.765 -2.581 1.00 . A A . 534 LYS NZ 1 1 3 1918 1 1 37 LYS O O 10.278 -5.376 -4.214 1.00 . A A . 534 LYS O 1 1 3 1919 1 1 38 ASP C C 8.321 -2.525 -4.478 1.00 . A A . 535 ASP C 1 1 3 1920 1 1 38 ASP CA C 8.342 -3.790 -5.293 1.00 . A A . 535 ASP CA 1 1 3 1921 1 1 38 ASP CB C 7.266 -3.683 -6.361 1.00 . A A . 535 ASP CB 1 1 3 1922 1 1 38 ASP CG C 7.539 -2.585 -7.367 1.00 . A A . 535 ASP CG 1 1 3 1923 1 1 38 ASP H H 7.180 -5.225 -4.240 1.00 . A A . 535 ASP H 1 1 3 1924 1 1 38 ASP HA H 9.309 -3.916 -5.750 1.00 . A A . 535 ASP HA 1 1 3 1925 1 1 38 ASP HB2 H 7.196 -4.609 -6.878 1.00 . A A . 535 ASP HB2 1 1 3 1926 1 1 38 ASP HB3 H 6.322 -3.474 -5.883 1.00 . A A . 535 ASP HB3 1 1 3 1927 1 1 38 ASP N N 8.101 -4.936 -4.424 1.00 . A A . 535 ASP N 1 1 3 1928 1 1 38 ASP O O 9.098 -1.608 -4.672 1.00 . A A . 535 ASP O 1 1 3 1929 1 1 38 ASP OD1 O 8.339 -2.811 -8.299 1.00 . A A . 535 ASP OD1 1 1 3 1930 1 1 38 ASP OD2 O 6.935 -1.503 -7.248 1.00 . A A . 535 ASP OD2 1 1 3 1931 1 1 39 HIS C C 8.281 -0.874 -1.940 1.00 . A A . 536 HIS C 1 1 3 1932 1 1 39 HIS CA C 7.118 -1.305 -2.825 1.00 . A A . 536 HIS CA 1 1 3 1933 1 1 39 HIS CB C 5.852 -1.508 -1.998 1.00 . A A . 536 HIS CB 1 1 3 1934 1 1 39 HIS CD2 C 5.233 0.057 -0.044 1.00 . A A . 536 HIS CD2 1 1 3 1935 1 1 39 HIS CE1 C 4.483 1.748 -1.176 1.00 . A A . 536 HIS CE1 1 1 3 1936 1 1 39 HIS CG C 5.343 -0.265 -1.356 1.00 . A A . 536 HIS CG 1 1 3 1937 1 1 39 HIS H H 6.936 -3.318 -3.339 1.00 . A A . 536 HIS H 1 1 3 1938 1 1 39 HIS HA H 6.936 -0.537 -3.568 1.00 . A A . 536 HIS HA 1 1 3 1939 1 1 39 HIS HB2 H 5.072 -1.893 -2.638 1.00 . A A . 536 HIS HB2 1 1 3 1940 1 1 39 HIS HB3 H 6.055 -2.226 -1.218 1.00 . A A . 536 HIS HB3 1 1 3 1941 1 1 39 HIS HD1 H 4.781 0.881 -3.042 1.00 . A A . 536 HIS HD1 1 1 3 1942 1 1 39 HIS HD2 H 5.510 -0.560 0.796 1.00 . A A . 536 HIS HD2 1 1 3 1943 1 1 39 HIS HE1 H 4.070 2.714 -1.432 1.00 . A A . 536 HIS HE1 1 1 3 1944 1 1 39 HIS N N 7.423 -2.504 -3.544 1.00 . A A . 536 HIS N 1 1 3 1945 1 1 39 HIS ND1 N 4.861 0.819 -2.064 1.00 . A A . 536 HIS ND1 1 1 3 1946 1 1 39 HIS NE2 N 4.686 1.317 0.045 1.00 . A A . 536 HIS NE2 1 1 3 1947 1 1 39 HIS O O 8.482 0.305 -1.736 1.00 . A A . 536 HIS O 1 1 3 1948 1 1 40 GLN C C 11.168 -0.568 -1.154 1.00 . A A . 537 GLN C 1 1 3 1949 1 1 40 GLN CA C 10.141 -1.495 -0.502 1.00 . A A . 537 GLN CA 1 1 3 1950 1 1 40 GLN CB C 10.829 -2.759 0.019 1.00 . A A . 537 GLN CB 1 1 3 1951 1 1 40 GLN CD C 12.068 -4.885 -0.529 1.00 . A A . 537 GLN CD 1 1 3 1952 1 1 40 GLN CG C 11.484 -3.596 -1.066 1.00 . A A . 537 GLN CG 1 1 3 1953 1 1 40 GLN H H 8.860 -2.772 -1.637 1.00 . A A . 537 GLN H 1 1 3 1954 1 1 40 GLN HA H 9.704 -0.963 0.330 1.00 . A A . 537 GLN HA 1 1 3 1955 1 1 40 GLN HB2 H 11.590 -2.472 0.729 1.00 . A A . 537 GLN HB2 1 1 3 1956 1 1 40 GLN HB3 H 10.095 -3.371 0.522 1.00 . A A . 537 GLN HB3 1 1 3 1957 1 1 40 GLN HE21 H 10.320 -5.792 -0.745 1.00 . A A . 537 GLN HE21 1 1 3 1958 1 1 40 GLN HE22 H 11.598 -6.767 -0.117 1.00 . A A . 537 GLN HE22 1 1 3 1959 1 1 40 GLN HG2 H 10.746 -3.833 -1.824 1.00 . A A . 537 GLN HG2 1 1 3 1960 1 1 40 GLN HG3 H 12.277 -3.015 -1.505 1.00 . A A . 537 GLN HG3 1 1 3 1961 1 1 40 GLN N N 9.045 -1.826 -1.418 1.00 . A A . 537 GLN N 1 1 3 1962 1 1 40 GLN NE2 N 11.246 -5.918 -0.457 1.00 . A A . 537 GLN NE2 1 1 3 1963 1 1 40 GLN O O 11.688 0.339 -0.505 1.00 . A A . 537 GLN O 1 1 3 1964 1 1 40 GLN OE1 O 13.242 -4.947 -0.168 1.00 . A A . 537 GLN OE1 1 1 3 1965 1 1 41 HIS C C 11.820 1.408 -3.482 1.00 . A A . 538 HIS C 1 1 3 1966 1 1 41 HIS CA C 12.427 0.055 -3.123 1.00 . A A . 538 HIS CA 1 1 3 1967 1 1 41 HIS CB C 13.016 -0.640 -4.370 1.00 . A A . 538 HIS CB 1 1 3 1968 1 1 41 HIS CD2 C 11.351 -1.600 -6.101 1.00 . A A . 538 HIS CD2 1 1 3 1969 1 1 41 HIS CE1 C 11.251 0.144 -7.393 1.00 . A A . 538 HIS CE1 1 1 3 1970 1 1 41 HIS CG C 12.150 -0.630 -5.599 1.00 . A A . 538 HIS CG 1 1 3 1971 1 1 41 HIS H H 11.011 -1.509 -2.913 1.00 . A A . 538 HIS H 1 1 3 1972 1 1 41 HIS HA H 13.238 0.255 -2.439 1.00 . A A . 538 HIS HA 1 1 3 1973 1 1 41 HIS HB2 H 13.945 -0.155 -4.629 1.00 . A A . 538 HIS HB2 1 1 3 1974 1 1 41 HIS HB3 H 13.221 -1.671 -4.123 1.00 . A A . 538 HIS HB3 1 1 3 1975 1 1 41 HIS HD2 H 11.143 -2.560 -5.653 1.00 . A A . 538 HIS HD2 1 1 3 1976 1 1 41 HIS HE1 H 10.953 0.812 -8.187 1.00 . A A . 538 HIS HE1 1 1 3 1977 1 1 41 HIS HE2 H 10.000 -1.479 -7.702 1.00 . A A . 538 HIS HE2 1 1 3 1978 1 1 41 HIS N N 11.452 -0.778 -2.435 1.00 . A A . 538 HIS N 1 1 3 1979 1 1 41 HIS ND1 N 12.082 0.470 -6.420 1.00 . A A . 538 HIS ND1 1 1 3 1980 1 1 41 HIS NE2 N 10.785 -1.102 -7.244 1.00 . A A . 538 HIS NE2 1 1 3 1981 1 1 41 HIS O O 12.548 2.371 -3.730 1.00 . A A . 538 HIS O 1 1 3 1982 1 1 42 ILE C C 9.539 3.525 -2.483 1.00 . A A . 539 ILE C 1 1 3 1983 1 1 42 ILE CA C 9.840 2.764 -3.783 1.00 . A A . 539 ILE CA 1 1 3 1984 1 1 42 ILE CB C 8.550 2.562 -4.644 1.00 . A A . 539 ILE CB 1 1 3 1985 1 1 42 ILE CD1 C 6.550 3.660 -3.489 1.00 . A A . 539 ILE CD1 1 1 3 1986 1 1 42 ILE CG1 C 7.280 2.369 -3.807 1.00 . A A . 539 ILE CG1 1 1 3 1987 1 1 42 ILE CG2 C 8.720 1.382 -5.583 1.00 . A A . 539 ILE CG2 1 1 3 1988 1 1 42 ILE H H 9.946 0.690 -3.337 1.00 . A A . 539 ILE H 1 1 3 1989 1 1 42 ILE HA H 10.533 3.357 -4.363 1.00 . A A . 539 ILE HA 1 1 3 1990 1 1 42 ILE HB H 8.428 3.432 -5.255 1.00 . A A . 539 ILE HB 1 1 3 1991 1 1 42 ILE HD11 H 6.269 4.151 -4.408 1.00 . A A . 539 ILE HD11 1 1 3 1992 1 1 42 ILE HD12 H 5.664 3.442 -2.912 1.00 . A A . 539 ILE HD12 1 1 3 1993 1 1 42 ILE HD13 H 7.200 4.308 -2.920 1.00 . A A . 539 ILE HD13 1 1 3 1994 1 1 42 ILE HG12 H 6.602 1.734 -4.347 1.00 . A A . 539 ILE HG12 1 1 3 1995 1 1 42 ILE HG13 H 7.540 1.895 -2.871 1.00 . A A . 539 ILE HG13 1 1 3 1996 1 1 42 ILE HG21 H 8.928 0.491 -5.007 1.00 . A A . 539 ILE HG21 1 1 3 1997 1 1 42 ILE HG22 H 7.814 1.240 -6.151 1.00 . A A . 539 ILE HG22 1 1 3 1998 1 1 42 ILE HG23 H 9.542 1.573 -6.257 1.00 . A A . 539 ILE HG23 1 1 3 1999 1 1 42 ILE N N 10.494 1.495 -3.496 1.00 . A A . 539 ILE N 1 1 3 2000 1 1 42 ILE O O 9.766 4.733 -2.394 1.00 . A A . 539 ILE O 1 1 3 2001 1 1 43 CYS C C 9.805 4.122 0.426 1.00 . A A . 540 CYS C 1 1 3 2002 1 1 43 CYS CA C 8.635 3.381 -0.220 1.00 . A A . 540 CYS CA 1 1 3 2003 1 1 43 CYS CB C 8.154 2.271 0.716 1.00 . A A . 540 CYS CB 1 1 3 2004 1 1 43 CYS H H 8.854 1.840 -1.641 1.00 . A A . 540 CYS H 1 1 3 2005 1 1 43 CYS HA H 7.818 4.074 -0.362 1.00 . A A . 540 CYS HA 1 1 3 2006 1 1 43 CYS HB2 H 7.569 1.559 0.150 1.00 . A A . 540 CYS HB2 1 1 3 2007 1 1 43 CYS HB3 H 9.013 1.768 1.136 1.00 . A A . 540 CYS HB3 1 1 3 2008 1 1 43 CYS N N 9.016 2.803 -1.498 1.00 . A A . 540 CYS N 1 1 3 2009 1 1 43 CYS O O 10.878 3.564 0.674 1.00 . A A . 540 CYS O 1 1 3 2010 1 1 43 CYS SG S 7.122 2.861 2.097 1.00 . A A . 540 CYS SG 1 1 3 2011 1 1 44 GLY C C 10.445 7.647 0.666 1.00 . A A . 541 GLY C 1 1 3 2012 1 1 44 GLY CA C 10.581 6.258 1.223 1.00 . A A . 541 GLY CA 1 1 3 2013 1 1 44 GLY H H 8.655 5.732 0.512 1.00 . A A . 541 GLY H 1 1 3 2014 1 1 44 GLY HA2 H 10.473 6.295 2.298 1.00 . A A . 541 GLY HA2 1 1 3 2015 1 1 44 GLY HA3 H 11.555 5.869 0.976 1.00 . A A . 541 GLY HA3 1 1 3 2016 1 1 44 GLY N N 9.565 5.391 0.673 1.00 . A A . 541 GLY N 1 1 3 2017 1 1 44 GLY O O 10.670 8.641 1.359 1.00 . A A . 541 GLY O 1 1 3 2018 1 1 45 GLN C C 8.285 9.159 -1.393 1.00 . A A . 542 GLN C 1 1 3 2019 1 1 45 GLN CA C 9.786 8.971 -1.247 1.00 . A A . 542 GLN CA 1 1 3 2020 1 1 45 GLN CB C 10.460 9.012 -2.619 1.00 . A A . 542 GLN CB 1 1 3 2021 1 1 45 GLN CD C 12.619 8.758 -3.919 1.00 . A A . 542 GLN CD 1 1 3 2022 1 1 45 GLN CG C 11.972 8.874 -2.552 1.00 . A A . 542 GLN CG 1 1 3 2023 1 1 45 GLN H H 9.924 6.872 -1.090 1.00 . A A . 542 GLN H 1 1 3 2024 1 1 45 GLN HA H 10.185 9.763 -0.629 1.00 . A A . 542 GLN HA 1 1 3 2025 1 1 45 GLN HB2 H 10.071 8.205 -3.222 1.00 . A A . 542 GLN HB2 1 1 3 2026 1 1 45 GLN HB3 H 10.226 9.952 -3.096 1.00 . A A . 542 GLN HB3 1 1 3 2027 1 1 45 GLN HE21 H 11.013 7.841 -4.644 1.00 . A A . 542 GLN HE21 1 1 3 2028 1 1 45 GLN HE22 H 12.310 8.078 -5.759 1.00 . A A . 542 GLN HE22 1 1 3 2029 1 1 45 GLN HG2 H 12.376 9.743 -2.053 1.00 . A A . 542 GLN HG2 1 1 3 2030 1 1 45 GLN HG3 H 12.212 7.989 -1.980 1.00 . A A . 542 GLN HG3 1 1 3 2031 1 1 45 GLN N N 10.052 7.709 -0.590 1.00 . A A . 542 GLN N 1 1 3 2032 1 1 45 GLN NE2 N 11.909 8.170 -4.868 1.00 . A A . 542 GLN NE2 1 1 3 2033 1 1 45 GLN O O 7.526 8.192 -1.355 1.00 . A A . 542 GLN O 1 1 3 2034 1 1 45 GLN OE1 O 13.755 9.185 -4.117 1.00 . A A . 542 GLN OE1 1 1 3 2035 1 1 46 SER C C 6.216 11.273 -3.133 1.00 . A A . 543 SER C 1 1 3 2036 1 1 46 SER CA C 6.449 10.694 -1.745 1.00 . A A . 543 SER CA 1 1 3 2037 1 1 46 SER CB C 5.965 11.662 -0.664 1.00 . A A . 543 SER CB 1 1 3 2038 1 1 46 SER H H 8.504 11.134 -1.559 1.00 . A A . 543 SER H 1 1 3 2039 1 1 46 SER HA H 5.902 9.767 -1.659 1.00 . A A . 543 SER HA 1 1 3 2040 1 1 46 SER HB2 H 6.563 12.560 -0.695 1.00 . A A . 543 SER HB2 1 1 3 2041 1 1 46 SER HB3 H 4.930 11.912 -0.843 1.00 . A A . 543 SER HB3 1 1 3 2042 1 1 46 SER HG H 6.934 10.638 0.715 1.00 . A A . 543 SER HG 1 1 3 2043 1 1 46 SER N N 7.856 10.397 -1.558 1.00 . A A . 543 SER N 1 1 3 2044 1 1 46 SER O O 5.583 12.317 -3.292 1.00 . A A . 543 SER O 1 1 3 2045 1 1 46 SER OG O 6.078 11.084 0.629 1.00 . A A . 543 SER OG 1 1 3 2046 1 1 47 ALA C C 6.131 9.814 -6.344 1.00 . A A . 544 ALA C 1 1 3 2047 1 1 47 ALA CA C 6.586 11.001 -5.514 1.00 . A A . 544 ALA CA 1 1 3 2048 1 1 47 ALA CB C 7.884 11.580 -6.061 1.00 . A A . 544 ALA CB 1 1 3 2049 1 1 47 ALA H H 7.264 9.781 -3.939 1.00 . A A . 544 ALA H 1 1 3 2050 1 1 47 ALA HA H 5.827 11.770 -5.550 1.00 . A A . 544 ALA HA 1 1 3 2051 1 1 47 ALA HB1 H 8.657 10.826 -6.029 1.00 . A A . 544 ALA HB1 1 1 3 2052 1 1 47 ALA HB2 H 7.735 11.899 -7.082 1.00 . A A . 544 ALA HB2 1 1 3 2053 1 1 47 ALA HB3 H 8.181 12.428 -5.460 1.00 . A A . 544 ALA HB3 1 1 3 2054 1 1 47 ALA N N 6.750 10.593 -4.133 1.00 . A A . 544 ALA N 1 1 3 2055 1 1 47 ALA O O 6.992 9.096 -6.886 1.00 . A A . 544 ALA O 1 1 3 2056 1 1 47 ALA OXT O 4.910 9.576 -6.411 1.00 . A A . 544 ALA OXT 1 1 3 2057 2 2 1 ZN ZN ZN -5.623 -5.543 -0.972 1.00 . B A . 601 ZN ZN 1 1 3 2058 3 2 1 ZN ZN ZN 4.893 2.489 1.624 1.00 . C A . 602 ZN ZN 1 1 4 2059 1 1 1 GLY C C -13.817 1.447 3.437 1.00 . A A . 498 GLY C 1 1 4 2060 1 1 1 GLY CA C -13.800 -0.055 3.608 1.00 . A A . 498 GLY CA 1 1 4 2061 1 1 1 GLY H1 H -14.953 -1.555 4.491 1.00 . A A . 498 GLY H1 1 1 4 2062 1 1 1 GLY H2 H -15.809 -0.124 4.169 1.00 . A A . 498 GLY H2 1 1 4 2063 1 1 1 GLY H3 H -14.724 -0.191 5.470 1.00 . A A . 498 GLY H3 1 1 4 2064 1 1 1 GLY HA2 H -12.855 -0.348 4.038 1.00 . A A . 498 GLY HA2 1 1 4 2065 1 1 1 GLY HA3 H -13.908 -0.524 2.640 1.00 . A A . 498 GLY HA3 1 1 4 2066 1 1 1 GLY N N -14.896 -0.514 4.494 1.00 . A A . 498 GLY N 1 1 4 2067 1 1 1 GLY O O -14.590 2.142 4.097 1.00 . A A . 498 GLY O 1 1 4 2068 1 1 2 ALA C C -12.980 3.566 0.753 1.00 . A A . 499 ALA C 1 1 4 2069 1 1 2 ALA CA C -12.945 3.368 2.254 1.00 . A A . 499 ALA CA 1 1 4 2070 1 1 2 ALA CB C -11.712 4.030 2.841 1.00 . A A . 499 ALA CB 1 1 4 2071 1 1 2 ALA H H -12.319 1.355 2.115 1.00 . A A . 499 ALA H 1 1 4 2072 1 1 2 ALA HA H -13.821 3.826 2.693 1.00 . A A . 499 ALA HA 1 1 4 2073 1 1 2 ALA HB1 H -10.827 3.579 2.419 1.00 . A A . 499 ALA HB1 1 1 4 2074 1 1 2 ALA HB2 H -11.726 5.086 2.606 1.00 . A A . 499 ALA HB2 1 1 4 2075 1 1 2 ALA HB3 H -11.711 3.898 3.912 1.00 . A A . 499 ALA HB3 1 1 4 2076 1 1 2 ALA N N -12.964 1.952 2.564 1.00 . A A . 499 ALA N 1 1 4 2077 1 1 2 ALA O O -12.065 3.152 0.049 1.00 . A A . 499 ALA O 1 1 4 2078 1 1 3 MET C C -13.184 5.438 -1.673 1.00 . A A . 500 MET C 1 1 4 2079 1 1 3 MET CA C -14.196 4.415 -1.166 1.00 . A A . 500 MET CA 1 1 4 2080 1 1 3 MET CB C -15.623 4.881 -1.472 1.00 . A A . 500 MET CB 1 1 4 2081 1 1 3 MET CE C -18.525 4.250 -2.661 1.00 . A A . 500 MET CE 1 1 4 2082 1 1 3 MET CG C -15.902 5.104 -2.952 1.00 . A A . 500 MET CG 1 1 4 2083 1 1 3 MET H H -14.724 4.534 0.883 1.00 . A A . 500 MET H 1 1 4 2084 1 1 3 MET HA H -14.015 3.474 -1.660 1.00 . A A . 500 MET HA 1 1 4 2085 1 1 3 MET HB2 H -16.316 4.137 -1.108 1.00 . A A . 500 MET HB2 1 1 4 2086 1 1 3 MET HB3 H -15.803 5.810 -0.950 1.00 . A A . 500 MET HB3 1 1 4 2087 1 1 3 MET HE1 H -18.317 4.112 -1.611 1.00 . A A . 500 MET HE1 1 1 4 2088 1 1 3 MET HE2 H -19.581 4.434 -2.797 1.00 . A A . 500 MET HE2 1 1 4 2089 1 1 3 MET HE3 H -18.241 3.360 -3.205 1.00 . A A . 500 MET HE3 1 1 4 2090 1 1 3 MET HG2 H -15.222 5.857 -3.323 1.00 . A A . 500 MET HG2 1 1 4 2091 1 1 3 MET HG3 H -15.731 4.177 -3.481 1.00 . A A . 500 MET HG3 1 1 4 2092 1 1 3 MET N N -14.034 4.199 0.264 1.00 . A A . 500 MET N 1 1 4 2093 1 1 3 MET O O -12.906 5.524 -2.871 1.00 . A A . 500 MET O 1 1 4 2094 1 1 3 MET SD S -17.591 5.650 -3.277 1.00 . A A . 500 MET SD 1 1 4 2095 1 1 4 GLU C C -10.365 6.618 -1.611 1.00 . A A . 501 GLU C 1 1 4 2096 1 1 4 GLU CA C -11.656 7.231 -1.078 1.00 . A A . 501 GLU CA 1 1 4 2097 1 1 4 GLU CB C -11.336 8.102 0.144 1.00 . A A . 501 GLU CB 1 1 4 2098 1 1 4 GLU CD C -13.492 7.965 1.463 1.00 . A A . 501 GLU CD 1 1 4 2099 1 1 4 GLU CG C -12.528 8.860 0.712 1.00 . A A . 501 GLU CG 1 1 4 2100 1 1 4 GLU H H -12.879 6.069 0.194 1.00 . A A . 501 GLU H 1 1 4 2101 1 1 4 GLU HA H -12.089 7.854 -1.846 1.00 . A A . 501 GLU HA 1 1 4 2102 1 1 4 GLU HB2 H -10.941 7.468 0.924 1.00 . A A . 501 GLU HB2 1 1 4 2103 1 1 4 GLU HB3 H -10.580 8.823 -0.133 1.00 . A A . 501 GLU HB3 1 1 4 2104 1 1 4 GLU HG2 H -12.166 9.620 1.389 1.00 . A A . 501 GLU HG2 1 1 4 2105 1 1 4 GLU HG3 H -13.058 9.332 -0.102 1.00 . A A . 501 GLU HG3 1 1 4 2106 1 1 4 GLU N N -12.624 6.200 -0.744 1.00 . A A . 501 GLU N 1 1 4 2107 1 1 4 GLU O O -9.607 7.277 -2.323 1.00 . A A . 501 GLU O 1 1 4 2108 1 1 4 GLU OE1 O -13.176 7.577 2.604 1.00 . A A . 501 GLU OE1 1 1 4 2109 1 1 4 GLU OE2 O -14.562 7.635 0.910 1.00 . A A . 501 GLU OE2 1 1 4 2110 1 1 5 GLN C C -9.177 3.296 -2.216 1.00 . A A . 502 GLN C 1 1 4 2111 1 1 5 GLN CA C -8.893 4.695 -1.684 1.00 . A A . 502 GLN CA 1 1 4 2112 1 1 5 GLN CB C -7.903 4.628 -0.520 1.00 . A A . 502 GLN CB 1 1 4 2113 1 1 5 GLN CD C -7.497 3.999 1.890 1.00 . A A . 502 GLN CD 1 1 4 2114 1 1 5 GLN CG C -8.495 4.045 0.752 1.00 . A A . 502 GLN CG 1 1 4 2115 1 1 5 GLN H H -10.786 4.856 -0.754 1.00 . A A . 502 GLN H 1 1 4 2116 1 1 5 GLN HA H -8.466 5.284 -2.474 1.00 . A A . 502 GLN HA 1 1 4 2117 1 1 5 GLN HB2 H -7.060 4.018 -0.812 1.00 . A A . 502 GLN HB2 1 1 4 2118 1 1 5 GLN HB3 H -7.553 5.628 -0.304 1.00 . A A . 502 GLN HB3 1 1 4 2119 1 1 5 GLN HE21 H -7.934 5.878 2.350 1.00 . A A . 502 GLN HE21 1 1 4 2120 1 1 5 GLN HE22 H -6.747 5.110 3.350 1.00 . A A . 502 GLN HE22 1 1 4 2121 1 1 5 GLN HG2 H -9.335 4.651 1.055 1.00 . A A . 502 GLN HG2 1 1 4 2122 1 1 5 GLN HG3 H -8.833 3.039 0.548 1.00 . A A . 502 GLN HG3 1 1 4 2123 1 1 5 GLN N N -10.119 5.358 -1.273 1.00 . A A . 502 GLN N 1 1 4 2124 1 1 5 GLN NE2 N -7.378 5.104 2.602 1.00 . A A . 502 GLN NE2 1 1 4 2125 1 1 5 GLN O O -10.211 2.705 -1.921 1.00 . A A . 502 GLN O 1 1 4 2126 1 1 5 GLN OE1 O -6.824 2.993 2.108 1.00 . A A . 502 GLN OE1 1 1 4 2127 1 1 6 SER C C -7.063 0.691 -3.337 1.00 . A A . 503 SER C 1 1 4 2128 1 1 6 SER CA C -8.382 1.427 -3.527 1.00 . A A . 503 SER CA 1 1 4 2129 1 1 6 SER CB C -8.797 1.436 -4.997 1.00 . A A . 503 SER CB 1 1 4 2130 1 1 6 SER H H -7.514 3.336 -3.310 1.00 . A A . 503 SER H 1 1 4 2131 1 1 6 SER HA H -9.145 0.925 -2.949 1.00 . A A . 503 SER HA 1 1 4 2132 1 1 6 SER HB2 H -8.085 2.015 -5.568 1.00 . A A . 503 SER HB2 1 1 4 2133 1 1 6 SER HB3 H -8.821 0.422 -5.370 1.00 . A A . 503 SER HB3 1 1 4 2134 1 1 6 SER HG H -10.424 2.266 -4.276 1.00 . A A . 503 SER HG 1 1 4 2135 1 1 6 SER N N -8.276 2.787 -3.033 1.00 . A A . 503 SER N 1 1 4 2136 1 1 6 SER O O -5.996 1.252 -3.576 1.00 . A A . 503 SER O 1 1 4 2137 1 1 6 SER OG O -10.085 2.013 -5.145 1.00 . A A . 503 SER OG 1 1 4 2138 1 1 7 CYS C C -5.208 -1.502 -4.000 1.00 . A A . 504 CYS C 1 1 4 2139 1 1 7 CYS CA C -5.953 -1.362 -2.687 1.00 . A A . 504 CYS CA 1 1 4 2140 1 1 7 CYS CB C -6.323 -2.748 -2.154 1.00 . A A . 504 CYS CB 1 1 4 2141 1 1 7 CYS H H -8.033 -0.956 -2.743 1.00 . A A . 504 CYS H 1 1 4 2142 1 1 7 CYS HA H -5.323 -0.863 -1.966 1.00 . A A . 504 CYS HA 1 1 4 2143 1 1 7 CYS HB2 H -6.913 -2.635 -1.257 1.00 . A A . 504 CYS HB2 1 1 4 2144 1 1 7 CYS HB3 H -6.905 -3.264 -2.897 1.00 . A A . 504 CYS HB3 1 1 4 2145 1 1 7 CYS N N -7.141 -0.558 -2.900 1.00 . A A . 504 CYS N 1 1 4 2146 1 1 7 CYS O O -5.774 -1.946 -5.000 1.00 . A A . 504 CYS O 1 1 4 2147 1 1 7 CYS SG S -4.890 -3.807 -1.743 1.00 . A A . 504 CYS SG 1 1 4 2148 1 1 8 VAL C C -2.916 -2.639 -5.609 1.00 . A A . 505 VAL C 1 1 4 2149 1 1 8 VAL CA C -3.114 -1.184 -5.172 1.00 . A A . 505 VAL CA 1 1 4 2150 1 1 8 VAL CB C -1.751 -0.497 -4.918 1.00 . A A . 505 VAL CB 1 1 4 2151 1 1 8 VAL CG1 C -0.886 -1.313 -3.972 1.00 . A A . 505 VAL CG1 1 1 4 2152 1 1 8 VAL CG2 C -1.027 -0.220 -6.223 1.00 . A A . 505 VAL CG2 1 1 4 2153 1 1 8 VAL H H -3.568 -0.740 -3.163 1.00 . A A . 505 VAL H 1 1 4 2154 1 1 8 VAL HA H -3.619 -0.649 -5.966 1.00 . A A . 505 VAL HA 1 1 4 2155 1 1 8 VAL HB H -1.946 0.454 -4.443 1.00 . A A . 505 VAL HB 1 1 4 2156 1 1 8 VAL HG11 H -0.743 -2.304 -4.376 1.00 . A A . 505 VAL HG11 1 1 4 2157 1 1 8 VAL HG12 H 0.072 -0.829 -3.853 1.00 . A A . 505 VAL HG12 1 1 4 2158 1 1 8 VAL HG13 H -1.375 -1.383 -3.011 1.00 . A A . 505 VAL HG13 1 1 4 2159 1 1 8 VAL HG21 H -1.644 0.409 -6.846 1.00 . A A . 505 VAL HG21 1 1 4 2160 1 1 8 VAL HG22 H -0.094 0.280 -6.017 1.00 . A A . 505 VAL HG22 1 1 4 2161 1 1 8 VAL HG23 H -0.834 -1.151 -6.734 1.00 . A A . 505 VAL HG23 1 1 4 2162 1 1 8 VAL N N -3.946 -1.114 -3.988 1.00 . A A . 505 VAL N 1 1 4 2163 1 1 8 VAL O O -2.536 -2.915 -6.749 1.00 . A A . 505 VAL O 1 1 4 2164 1 1 9 ASN C C -4.412 -5.584 -5.412 1.00 . A A . 506 ASN C 1 1 4 2165 1 1 9 ASN CA C -3.071 -4.985 -5.001 1.00 . A A . 506 ASN CA 1 1 4 2166 1 1 9 ASN CB C -2.503 -5.738 -3.793 1.00 . A A . 506 ASN CB 1 1 4 2167 1 1 9 ASN CG C -2.331 -7.225 -4.059 1.00 . A A . 506 ASN CG 1 1 4 2168 1 1 9 ASN H H -3.537 -3.298 -3.816 1.00 . A A . 506 ASN H 1 1 4 2169 1 1 9 ASN HA H -2.382 -5.079 -5.827 1.00 . A A . 506 ASN HA 1 1 4 2170 1 1 9 ASN HB2 H -1.539 -5.325 -3.540 1.00 . A A . 506 ASN HB2 1 1 4 2171 1 1 9 ASN HB3 H -3.172 -5.616 -2.952 1.00 . A A . 506 ASN HB3 1 1 4 2172 1 1 9 ASN HD21 H -4.115 -7.612 -3.270 1.00 . A A . 506 ASN HD21 1 1 4 2173 1 1 9 ASN HD22 H -3.242 -8.980 -3.875 1.00 . A A . 506 ASN HD22 1 1 4 2174 1 1 9 ASN N N -3.211 -3.570 -4.704 1.00 . A A . 506 ASN N 1 1 4 2175 1 1 9 ASN ND2 N -3.326 -8.018 -3.694 1.00 . A A . 506 ASN ND2 1 1 4 2176 1 1 9 ASN O O -4.459 -6.492 -6.240 1.00 . A A . 506 ASN O 1 1 4 2177 1 1 9 ASN OD1 O -1.304 -7.659 -4.574 1.00 . A A . 506 ASN OD1 1 1 4 2178 1 1 10 CYS C C -7.774 -4.574 -5.694 1.00 . A A . 507 CYS C 1 1 4 2179 1 1 10 CYS CA C -6.820 -5.621 -5.112 1.00 . A A . 507 CYS CA 1 1 4 2180 1 1 10 CYS CB C -7.399 -6.208 -3.828 1.00 . A A . 507 CYS CB 1 1 4 2181 1 1 10 CYS H H -5.414 -4.284 -4.261 1.00 . A A . 507 CYS H 1 1 4 2182 1 1 10 CYS HA H -6.701 -6.415 -5.833 1.00 . A A . 507 CYS HA 1 1 4 2183 1 1 10 CYS HB2 H -7.779 -5.407 -3.213 1.00 . A A . 507 CYS HB2 1 1 4 2184 1 1 10 CYS HB3 H -8.208 -6.878 -4.079 1.00 . A A . 507 CYS HB3 1 1 4 2185 1 1 10 CYS N N -5.500 -5.062 -4.852 1.00 . A A . 507 CYS N 1 1 4 2186 1 1 10 CYS O O -7.945 -4.494 -6.911 1.00 . A A . 507 CYS O 1 1 4 2187 1 1 10 CYS SG S -6.190 -7.140 -2.833 1.00 . A A . 507 CYS SG 1 1 4 2188 1 1 11 GLY C C -9.967 -1.953 -4.199 1.00 . A A . 508 GLY C 1 1 4 2189 1 1 11 GLY CA C -9.347 -2.786 -5.308 1.00 . A A . 508 GLY CA 1 1 4 2190 1 1 11 GLY H H -8.197 -3.843 -3.876 1.00 . A A . 508 GLY H 1 1 4 2191 1 1 11 GLY HA2 H -8.846 -2.122 -5.997 1.00 . A A . 508 GLY HA2 1 1 4 2192 1 1 11 GLY HA3 H -10.135 -3.301 -5.837 1.00 . A A . 508 GLY HA3 1 1 4 2193 1 1 11 GLY N N -8.391 -3.769 -4.832 1.00 . A A . 508 GLY N 1 1 4 2194 1 1 11 GLY O O -9.396 -1.821 -3.121 1.00 . A A . 508 GLY O 1 1 4 2195 1 1 12 ARG C C -12.092 -1.001 -2.147 1.00 . A A . 509 ARG C 1 1 4 2196 1 1 12 ARG CA C -11.891 -0.493 -3.583 1.00 . A A . 509 ARG CA 1 1 4 2197 1 1 12 ARG CB C -13.257 -0.183 -4.204 1.00 . A A . 509 ARG CB 1 1 4 2198 1 1 12 ARG CD C -15.305 -1.080 -5.372 1.00 . A A . 509 ARG CD 1 1 4 2199 1 1 12 ARG CG C -13.995 -1.425 -4.684 1.00 . A A . 509 ARG CG 1 1 4 2200 1 1 12 ARG CZ C -17.051 -2.308 -6.622 1.00 . A A . 509 ARG CZ 1 1 4 2201 1 1 12 ARG H H -11.534 -1.569 -5.375 1.00 . A A . 509 ARG H 1 1 4 2202 1 1 12 ARG HA H -11.330 0.426 -3.538 1.00 . A A . 509 ARG HA 1 1 4 2203 1 1 12 ARG HB2 H -13.871 0.313 -3.467 1.00 . A A . 509 ARG HB2 1 1 4 2204 1 1 12 ARG HB3 H -13.116 0.475 -5.049 1.00 . A A . 509 ARG HB3 1 1 4 2205 1 1 12 ARG HD2 H -16.040 -0.830 -4.620 1.00 . A A . 509 ARG HD2 1 1 4 2206 1 1 12 ARG HD3 H -15.147 -0.230 -6.020 1.00 . A A . 509 ARG HD3 1 1 4 2207 1 1 12 ARG HE H -15.158 -2.910 -6.404 1.00 . A A . 509 ARG HE 1 1 4 2208 1 1 12 ARG HG2 H -13.367 -1.958 -5.381 1.00 . A A . 509 ARG HG2 1 1 4 2209 1 1 12 ARG HG3 H -14.203 -2.057 -3.831 1.00 . A A . 509 ARG HG3 1 1 4 2210 1 1 12 ARG HH11 H -17.731 -0.625 -5.705 1.00 . A A . 509 ARG HH11 1 1 4 2211 1 1 12 ARG HH12 H -18.906 -1.493 -6.645 1.00 . A A . 509 ARG HH12 1 1 4 2212 1 1 12 ARG HH21 H -16.687 -4.033 -7.618 1.00 . A A . 509 ARG HH21 1 1 4 2213 1 1 12 ARG HH22 H -18.316 -3.432 -7.744 1.00 . A A . 509 ARG HH22 1 1 4 2214 1 1 12 ARG N N -11.154 -1.411 -4.479 1.00 . A A . 509 ARG N 1 1 4 2215 1 1 12 ARG NE N -15.805 -2.200 -6.169 1.00 . A A . 509 ARG NE 1 1 4 2216 1 1 12 ARG NH1 N -17.970 -1.404 -6.300 1.00 . A A . 509 ARG NH1 1 1 4 2217 1 1 12 ARG NH2 N -17.377 -3.340 -7.387 1.00 . A A . 509 ARG NH2 1 1 4 2218 1 1 12 ARG O O -12.574 -0.258 -1.294 1.00 . A A . 509 ARG O 1 1 4 2219 1 1 13 GLU C C -10.832 -2.162 0.420 1.00 . A A . 510 GLU C 1 1 4 2220 1 1 13 GLU CA C -11.856 -2.799 -0.531 1.00 . A A . 510 GLU CA 1 1 4 2221 1 1 13 GLU CB C -11.691 -4.317 -0.568 1.00 . A A . 510 GLU CB 1 1 4 2222 1 1 13 GLU CD C -13.525 -4.779 1.108 1.00 . A A . 510 GLU CD 1 1 4 2223 1 1 13 GLU CG C -12.081 -5.016 0.726 1.00 . A A . 510 GLU CG 1 1 4 2224 1 1 13 GLU H H -11.425 -2.815 -2.608 1.00 . A A . 510 GLU H 1 1 4 2225 1 1 13 GLU HA H -12.841 -2.566 -0.172 1.00 . A A . 510 GLU HA 1 1 4 2226 1 1 13 GLU HB2 H -12.304 -4.713 -1.362 1.00 . A A . 510 GLU HB2 1 1 4 2227 1 1 13 GLU HB3 H -10.657 -4.545 -0.776 1.00 . A A . 510 GLU HB3 1 1 4 2228 1 1 13 GLU HG2 H -11.927 -6.078 0.608 1.00 . A A . 510 GLU HG2 1 1 4 2229 1 1 13 GLU HG3 H -11.450 -4.649 1.519 1.00 . A A . 510 GLU HG3 1 1 4 2230 1 1 13 GLU N N -11.750 -2.249 -1.880 1.00 . A A . 510 GLU N 1 1 4 2231 1 1 13 GLU O O -10.788 -2.489 1.606 1.00 . A A . 510 GLU O 1 1 4 2232 1 1 13 GLU OE1 O -14.411 -5.459 0.547 1.00 . A A . 510 GLU OE1 1 1 4 2233 1 1 13 GLU OE2 O -13.791 -3.930 1.982 1.00 . A A . 510 GLU OE2 1 1 4 2234 1 1 14 ALA C C -9.491 -0.020 1.970 1.00 . A A . 511 ALA C 1 1 4 2235 1 1 14 ALA CA C -8.963 -0.591 0.659 1.00 . A A . 511 ALA CA 1 1 4 2236 1 1 14 ALA CB C -8.325 0.519 -0.154 1.00 . A A . 511 ALA CB 1 1 4 2237 1 1 14 ALA H H -10.090 -1.061 -1.070 1.00 . A A . 511 ALA H 1 1 4 2238 1 1 14 ALA HA H -8.195 -1.317 0.883 1.00 . A A . 511 ALA HA 1 1 4 2239 1 1 14 ALA HB1 H -7.993 0.125 -1.104 1.00 . A A . 511 ALA HB1 1 1 4 2240 1 1 14 ALA HB2 H -9.045 1.306 -0.321 1.00 . A A . 511 ALA HB2 1 1 4 2241 1 1 14 ALA HB3 H -7.476 0.914 0.384 1.00 . A A . 511 ALA HB3 1 1 4 2242 1 1 14 ALA N N -9.999 -1.270 -0.119 1.00 . A A . 511 ALA N 1 1 4 2243 1 1 14 ALA O O -10.644 0.414 2.066 1.00 . A A . 511 ALA O 1 1 4 2244 1 1 15 MET C C -7.757 0.757 5.155 1.00 . A A . 512 MET C 1 1 4 2245 1 1 15 MET CA C -8.991 0.433 4.308 1.00 . A A . 512 MET CA 1 1 4 2246 1 1 15 MET CB C -9.830 -0.647 5.004 1.00 . A A . 512 MET CB 1 1 4 2247 1 1 15 MET CE C -11.481 -3.389 4.861 1.00 . A A . 512 MET CE 1 1 4 2248 1 1 15 MET CG C -9.115 -1.982 5.159 1.00 . A A . 512 MET CG 1 1 4 2249 1 1 15 MET H H -7.699 -0.260 2.784 1.00 . A A . 512 MET H 1 1 4 2250 1 1 15 MET HA H -9.588 1.327 4.211 1.00 . A A . 512 MET HA 1 1 4 2251 1 1 15 MET HB2 H -10.099 -0.293 5.987 1.00 . A A . 512 MET HB2 1 1 4 2252 1 1 15 MET HB3 H -10.731 -0.810 4.432 1.00 . A A . 512 MET HB3 1 1 4 2253 1 1 15 MET HE1 H -11.113 -3.753 3.914 1.00 . A A . 512 MET HE1 1 1 4 2254 1 1 15 MET HE2 H -12.200 -4.089 5.261 1.00 . A A . 512 MET HE2 1 1 4 2255 1 1 15 MET HE3 H -11.953 -2.428 4.720 1.00 . A A . 512 MET HE3 1 1 4 2256 1 1 15 MET HG2 H -8.864 -2.356 4.178 1.00 . A A . 512 MET HG2 1 1 4 2257 1 1 15 MET HG3 H -8.208 -1.823 5.724 1.00 . A A . 512 MET HG3 1 1 4 2258 1 1 15 MET N N -8.621 0.001 2.966 1.00 . A A . 512 MET N 1 1 4 2259 1 1 15 MET O O -7.841 1.530 6.111 1.00 . A A . 512 MET O 1 1 4 2260 1 1 15 MET SD S -10.114 -3.221 6.007 1.00 . A A . 512 MET SD 1 1 4 2261 1 1 16 SER C C -4.285 0.901 4.688 1.00 . A A . 513 SER C 1 1 4 2262 1 1 16 SER CA C -5.401 0.374 5.585 1.00 . A A . 513 SER CA 1 1 4 2263 1 1 16 SER CB C -4.985 -0.923 6.278 1.00 . A A . 513 SER CB 1 1 4 2264 1 1 16 SER H H -6.575 -0.365 3.999 1.00 . A A . 513 SER H 1 1 4 2265 1 1 16 SER HA H -5.619 1.129 6.327 1.00 . A A . 513 SER HA 1 1 4 2266 1 1 16 SER HB2 H -4.734 -1.664 5.534 1.00 . A A . 513 SER HB2 1 1 4 2267 1 1 16 SER HB3 H -4.128 -0.737 6.908 1.00 . A A . 513 SER HB3 1 1 4 2268 1 1 16 SER HG H -6.615 -0.691 7.335 1.00 . A A . 513 SER HG 1 1 4 2269 1 1 16 SER N N -6.616 0.167 4.814 1.00 . A A . 513 SER N 1 1 4 2270 1 1 16 SER O O -4.251 0.621 3.490 1.00 . A A . 513 SER O 1 1 4 2271 1 1 16 SER OG O -6.042 -1.423 7.079 1.00 . A A . 513 SER OG 1 1 4 2272 1 1 17 GLU C C -0.956 1.649 4.932 1.00 . A A . 514 GLU C 1 1 4 2273 1 1 17 GLU CA C -2.289 2.261 4.527 1.00 . A A . 514 GLU CA 1 1 4 2274 1 1 17 GLU CB C -2.263 3.776 4.749 1.00 . A A . 514 GLU CB 1 1 4 2275 1 1 17 GLU CD C -2.140 5.697 6.364 1.00 . A A . 514 GLU CD 1 1 4 2276 1 1 17 GLU CG C -2.240 4.196 6.204 1.00 . A A . 514 GLU CG 1 1 4 2277 1 1 17 GLU H H -3.437 1.820 6.245 1.00 . A A . 514 GLU H 1 1 4 2278 1 1 17 GLU HA H -2.464 2.085 3.475 1.00 . A A . 514 GLU HA 1 1 4 2279 1 1 17 GLU HB2 H -1.383 4.181 4.270 1.00 . A A . 514 GLU HB2 1 1 4 2280 1 1 17 GLU HB3 H -3.139 4.209 4.287 1.00 . A A . 514 GLU HB3 1 1 4 2281 1 1 17 GLU HG2 H -3.148 3.856 6.677 1.00 . A A . 514 GLU HG2 1 1 4 2282 1 1 17 GLU HG3 H -1.388 3.739 6.685 1.00 . A A . 514 GLU HG3 1 1 4 2283 1 1 17 GLU N N -3.381 1.664 5.273 1.00 . A A . 514 GLU N 1 1 4 2284 1 1 17 GLU O O -0.848 0.991 5.968 1.00 . A A . 514 GLU O 1 1 4 2285 1 1 17 GLU OE1 O -3.047 6.412 5.885 1.00 . A A . 514 GLU OE1 1 1 4 2286 1 1 17 GLU OE2 O -1.155 6.170 6.965 1.00 . A A . 514 GLU OE2 1 1 4 2287 1 1 18 CYS C C 2.064 2.378 5.350 1.00 . A A . 515 CYS C 1 1 4 2288 1 1 18 CYS CA C 1.396 1.418 4.392 1.00 . A A . 515 CYS CA 1 1 4 2289 1 1 18 CYS CB C 2.218 1.311 3.104 1.00 . A A . 515 CYS CB 1 1 4 2290 1 1 18 CYS H H -0.121 2.348 3.274 1.00 . A A . 515 CYS H 1 1 4 2291 1 1 18 CYS HA H 1.363 0.465 4.893 1.00 . A A . 515 CYS HA 1 1 4 2292 1 1 18 CYS HB2 H 1.968 0.388 2.604 1.00 . A A . 515 CYS HB2 1 1 4 2293 1 1 18 CYS HB3 H 1.971 2.143 2.459 1.00 . A A . 515 CYS HB3 1 1 4 2294 1 1 18 CYS N N 0.046 1.861 4.102 1.00 . A A . 515 CYS N 1 1 4 2295 1 1 18 CYS O O 2.106 3.577 5.112 1.00 . A A . 515 CYS O 1 1 4 2296 1 1 18 CYS SG S 4.026 1.325 3.363 1.00 . A A . 515 CYS SG 1 1 4 2297 1 1 19 THR C C 4.771 2.740 6.812 1.00 . A A . 516 THR C 1 1 4 2298 1 1 19 THR CA C 3.361 2.615 7.379 1.00 . A A . 516 THR CA 1 1 4 2299 1 1 19 THR CB C 3.405 1.949 8.764 1.00 . A A . 516 THR CB 1 1 4 2300 1 1 19 THR CG2 C 4.031 2.878 9.790 1.00 . A A . 516 THR CG2 1 1 4 2301 1 1 19 THR H H 2.373 0.912 6.670 1.00 . A A . 516 THR H 1 1 4 2302 1 1 19 THR HA H 2.925 3.599 7.478 1.00 . A A . 516 THR HA 1 1 4 2303 1 1 19 THR HB H 4.001 1.051 8.701 1.00 . A A . 516 THR HB 1 1 4 2304 1 1 19 THR HG1 H 1.493 1.588 8.403 1.00 . A A . 516 THR HG1 1 1 4 2305 1 1 19 THR HG21 H 3.450 3.786 9.855 1.00 . A A . 516 THR HG21 1 1 4 2306 1 1 19 THR HG22 H 4.047 2.392 10.753 1.00 . A A . 516 THR HG22 1 1 4 2307 1 1 19 THR HG23 H 5.041 3.118 9.490 1.00 . A A . 516 THR HG23 1 1 4 2308 1 1 19 THR N N 2.552 1.846 6.463 1.00 . A A . 516 THR N 1 1 4 2309 1 1 19 THR O O 5.440 1.734 6.555 1.00 . A A . 516 THR O 1 1 4 2310 1 1 19 THR OG1 O 2.075 1.607 9.176 1.00 . A A . 516 THR OG1 1 1 4 2311 1 1 20 GLY C C 6.281 5.265 4.875 1.00 . A A . 517 GLY C 1 1 4 2312 1 1 20 GLY CA C 6.457 4.210 5.934 1.00 . A A . 517 GLY CA 1 1 4 2313 1 1 20 GLY H H 4.707 4.722 7.006 1.00 . A A . 517 GLY H 1 1 4 2314 1 1 20 GLY HA2 H 7.201 4.540 6.646 1.00 . A A . 517 GLY HA2 1 1 4 2315 1 1 20 GLY HA3 H 6.792 3.295 5.469 1.00 . A A . 517 GLY HA3 1 1 4 2316 1 1 20 GLY N N 5.214 3.966 6.628 1.00 . A A . 517 GLY N 1 1 4 2317 1 1 20 GLY O O 7.175 6.078 4.640 1.00 . A A . 517 GLY O 1 1 4 2318 1 1 21 CYS C C 3.293 6.602 3.399 1.00 . A A . 518 CYS C 1 1 4 2319 1 1 21 CYS CA C 4.775 6.281 3.281 1.00 . A A . 518 CYS CA 1 1 4 2320 1 1 21 CYS CB C 5.100 5.822 1.861 1.00 . A A . 518 CYS CB 1 1 4 2321 1 1 21 CYS H H 4.468 4.547 4.435 1.00 . A A . 518 CYS H 1 1 4 2322 1 1 21 CYS HA H 5.348 7.156 3.536 1.00 . A A . 518 CYS HA 1 1 4 2323 1 1 21 CYS HB2 H 4.983 6.654 1.183 1.00 . A A . 518 CYS HB2 1 1 4 2324 1 1 21 CYS HB3 H 6.122 5.473 1.825 1.00 . A A . 518 CYS HB3 1 1 4 2325 1 1 21 CYS N N 5.118 5.257 4.242 1.00 . A A . 518 CYS N 1 1 4 2326 1 1 21 CYS O O 2.524 5.817 3.939 1.00 . A A . 518 CYS O 1 1 4 2327 1 1 21 CYS SG S 4.026 4.471 1.271 1.00 . A A . 518 CYS SG 1 1 4 2328 1 1 22 HIS C C 1.019 8.360 1.480 1.00 . A A . 519 HIS C 1 1 4 2329 1 1 22 HIS CA C 1.478 8.094 2.901 1.00 . A A . 519 HIS CA 1 1 4 2330 1 1 22 HIS CB C 1.186 9.308 3.790 1.00 . A A . 519 HIS CB 1 1 4 2331 1 1 22 HIS CD2 C 2.434 8.725 5.978 1.00 . A A . 519 HIS CD2 1 1 4 2332 1 1 22 HIS CE1 C 0.725 8.759 7.346 1.00 . A A . 519 HIS CE1 1 1 4 2333 1 1 22 HIS CG C 1.336 9.026 5.250 1.00 . A A . 519 HIS CG 1 1 4 2334 1 1 22 HIS H H 3.555 8.404 2.602 1.00 . A A . 519 HIS H 1 1 4 2335 1 1 22 HIS HA H 0.932 7.243 3.284 1.00 . A A . 519 HIS HA 1 1 4 2336 1 1 22 HIS HB2 H 1.869 10.105 3.537 1.00 . A A . 519 HIS HB2 1 1 4 2337 1 1 22 HIS HB3 H 0.173 9.639 3.615 1.00 . A A . 519 HIS HB3 1 1 4 2338 1 1 22 HIS HD1 H -0.656 9.234 5.914 1.00 . A A . 519 HIS HD1 1 1 4 2339 1 1 22 HIS HD2 H 3.445 8.632 5.598 1.00 . A A . 519 HIS HD2 1 1 4 2340 1 1 22 HIS HE1 H 0.122 8.702 8.239 1.00 . A A . 519 HIS HE1 1 1 4 2341 1 1 22 HIS HE2 H 2.633 8.517 8.062 1.00 . A A . 519 HIS HE2 1 1 4 2342 1 1 22 HIS N N 2.892 7.758 2.926 1.00 . A A . 519 HIS N 1 1 4 2343 1 1 22 HIS ND1 N 0.282 9.040 6.136 1.00 . A A . 519 HIS ND1 1 1 4 2344 1 1 22 HIS NE2 N 2.029 8.564 7.279 1.00 . A A . 519 HIS NE2 1 1 4 2345 1 1 22 HIS O O 0.147 9.198 1.250 1.00 . A A . 519 HIS O 1 1 4 2346 1 1 23 LYS C C 0.413 6.742 -1.459 1.00 . A A . 520 LYS C 1 1 4 2347 1 1 23 LYS CA C 1.256 7.883 -0.876 1.00 . A A . 520 LYS CA 1 1 4 2348 1 1 23 LYS CB C 2.524 8.094 -1.716 1.00 . A A . 520 LYS CB 1 1 4 2349 1 1 23 LYS CD C 4.666 7.154 -2.641 1.00 . A A . 520 LYS CD 1 1 4 2350 1 1 23 LYS CE C 4.401 7.888 -3.948 1.00 . A A . 520 LYS CE 1 1 4 2351 1 1 23 LYS CG C 3.374 6.845 -1.900 1.00 . A A . 520 LYS CG 1 1 4 2352 1 1 23 LYS H H 2.310 7.005 0.720 1.00 . A A . 520 LYS H 1 1 4 2353 1 1 23 LYS HA H 0.670 8.790 -0.916 1.00 . A A . 520 LYS HA 1 1 4 2354 1 1 23 LYS HB2 H 2.234 8.447 -2.693 1.00 . A A . 520 LYS HB2 1 1 4 2355 1 1 23 LYS HB3 H 3.133 8.849 -1.240 1.00 . A A . 520 LYS HB3 1 1 4 2356 1 1 23 LYS HD2 H 5.294 7.769 -2.014 1.00 . A A . 520 LYS HD2 1 1 4 2357 1 1 23 LYS HD3 H 5.174 6.220 -2.860 1.00 . A A . 520 LYS HD3 1 1 4 2358 1 1 23 LYS HE2 H 3.953 7.198 -4.648 1.00 . A A . 520 LYS HE2 1 1 4 2359 1 1 23 LYS HE3 H 3.718 8.701 -3.757 1.00 . A A . 520 LYS HE3 1 1 4 2360 1 1 23 LYS HG2 H 3.615 6.438 -0.930 1.00 . A A . 520 LYS HG2 1 1 4 2361 1 1 23 LYS HG3 H 2.810 6.125 -2.466 1.00 . A A . 520 LYS HG3 1 1 4 2362 1 1 23 LYS HZ1 H 6.325 7.663 -4.731 1.00 . A A . 520 LYS HZ1 1 1 4 2363 1 1 23 LYS HZ2 H 5.436 8.917 -5.442 1.00 . A A . 520 LYS HZ2 1 1 4 2364 1 1 23 LYS HZ3 H 6.090 9.116 -3.892 1.00 . A A . 520 LYS HZ3 1 1 4 2365 1 1 23 LYS N N 1.606 7.658 0.514 1.00 . A A . 520 LYS N 1 1 4 2366 1 1 23 LYS NZ N 5.649 8.432 -4.542 1.00 . A A . 520 LYS NZ 1 1 4 2367 1 1 23 LYS O O -0.371 6.966 -2.382 1.00 . A A . 520 LYS O 1 1 4 2368 1 1 24 VAL C C -1.140 3.777 -0.472 1.00 . A A . 521 VAL C 1 1 4 2369 1 1 24 VAL CA C -0.188 4.379 -1.497 1.00 . A A . 521 VAL CA 1 1 4 2370 1 1 24 VAL CB C 0.758 3.263 -1.998 1.00 . A A . 521 VAL CB 1 1 4 2371 1 1 24 VAL CG1 C 1.606 3.739 -3.172 1.00 . A A . 521 VAL CG1 1 1 4 2372 1 1 24 VAL CG2 C 1.635 2.759 -0.860 1.00 . A A . 521 VAL CG2 1 1 4 2373 1 1 24 VAL H H 1.072 5.370 -0.125 1.00 . A A . 521 VAL H 1 1 4 2374 1 1 24 VAL HA H -0.766 4.737 -2.339 1.00 . A A . 521 VAL HA 1 1 4 2375 1 1 24 VAL HB H 0.151 2.438 -2.343 1.00 . A A . 521 VAL HB 1 1 4 2376 1 1 24 VAL HG11 H 0.963 4.126 -3.950 1.00 . A A . 521 VAL HG11 1 1 4 2377 1 1 24 VAL HG12 H 2.277 4.512 -2.839 1.00 . A A . 521 VAL HG12 1 1 4 2378 1 1 24 VAL HG13 H 2.177 2.909 -3.561 1.00 . A A . 521 VAL HG13 1 1 4 2379 1 1 24 VAL HG21 H 1.011 2.322 -0.092 1.00 . A A . 521 VAL HG21 1 1 4 2380 1 1 24 VAL HG22 H 2.318 2.012 -1.236 1.00 . A A . 521 VAL HG22 1 1 4 2381 1 1 24 VAL HG23 H 2.195 3.583 -0.443 1.00 . A A . 521 VAL HG23 1 1 4 2382 1 1 24 VAL N N 0.534 5.519 -0.931 1.00 . A A . 521 VAL N 1 1 4 2383 1 1 24 VAL O O -0.957 3.944 0.737 1.00 . A A . 521 VAL O 1 1 4 2384 1 1 25 ASN C C -3.433 1.040 -0.419 1.00 . A A . 522 ASN C 1 1 4 2385 1 1 25 ASN CA C -3.186 2.513 -0.109 1.00 . A A . 522 ASN CA 1 1 4 2386 1 1 25 ASN CB C -4.492 3.301 -0.241 1.00 . A A . 522 ASN CB 1 1 4 2387 1 1 25 ASN CG C -4.563 4.109 -1.522 1.00 . A A . 522 ASN CG 1 1 4 2388 1 1 25 ASN H H -2.198 2.928 -1.941 1.00 . A A . 522 ASN H 1 1 4 2389 1 1 25 ASN HA H -2.840 2.580 0.911 1.00 . A A . 522 ASN HA 1 1 4 2390 1 1 25 ASN HB2 H -5.322 2.610 -0.232 1.00 . A A . 522 ASN HB2 1 1 4 2391 1 1 25 ASN HB3 H -4.584 3.975 0.596 1.00 . A A . 522 ASN HB3 1 1 4 2392 1 1 25 ASN HD21 H -5.175 2.505 -2.529 1.00 . A A . 522 ASN HD21 1 1 4 2393 1 1 25 ASN HD22 H -4.993 3.963 -3.448 1.00 . A A . 522 ASN HD22 1 1 4 2394 1 1 25 ASN N N -2.150 3.077 -0.966 1.00 . A A . 522 ASN N 1 1 4 2395 1 1 25 ASN ND2 N -4.953 3.466 -2.607 1.00 . A A . 522 ASN ND2 1 1 4 2396 1 1 25 ASN O O -3.351 0.604 -1.570 1.00 . A A . 522 ASN O 1 1 4 2397 1 1 25 ASN OD1 O -4.249 5.299 -1.541 1.00 . A A . 522 ASN OD1 1 1 4 2398 1 1 26 TYR C C -5.304 -1.507 1.160 1.00 . A A . 523 TYR C 1 1 4 2399 1 1 26 TYR CA C -3.964 -1.151 0.526 1.00 . A A . 523 TYR CA 1 1 4 2400 1 1 26 TYR CB C -2.845 -1.928 1.236 1.00 . A A . 523 TYR CB 1 1 4 2401 1 1 26 TYR CD1 C -0.642 -0.686 1.118 1.00 . A A . 523 TYR CD1 1 1 4 2402 1 1 26 TYR CD2 C -0.955 -2.564 -0.317 1.00 . A A . 523 TYR CD2 1 1 4 2403 1 1 26 TYR CE1 C 0.630 -0.503 0.606 1.00 . A A . 523 TYR CE1 1 1 4 2404 1 1 26 TYR CE2 C 0.317 -2.389 -0.829 1.00 . A A . 523 TYR CE2 1 1 4 2405 1 1 26 TYR CG C -1.456 -1.719 0.664 1.00 . A A . 523 TYR CG 1 1 4 2406 1 1 26 TYR CZ C 1.104 -1.357 -0.367 1.00 . A A . 523 TYR CZ 1 1 4 2407 1 1 26 TYR H H -3.854 0.721 1.506 1.00 . A A . 523 TYR H 1 1 4 2408 1 1 26 TYR HA H -3.983 -1.413 -0.522 1.00 . A A . 523 TYR HA 1 1 4 2409 1 1 26 TYR HB2 H -2.820 -1.627 2.272 1.00 . A A . 523 TYR HB2 1 1 4 2410 1 1 26 TYR HB3 H -3.070 -2.985 1.185 1.00 . A A . 523 TYR HB3 1 1 4 2411 1 1 26 TYR HD1 H -1.573 -3.374 -0.680 1.00 . A A . 523 TYR HD1 1 1 4 2412 1 1 26 TYR HD2 H -1.015 -0.019 1.882 1.00 . A A . 523 TYR HD2 1 1 4 2413 1 1 26 TYR HE1 H 0.688 -3.057 -1.590 1.00 . A A . 523 TYR HE1 1 1 4 2414 1 1 26 TYR HE2 H 1.247 0.307 0.969 1.00 . A A . 523 TYR HE2 1 1 4 2415 1 1 26 TYR HH H 2.392 -1.424 -1.811 1.00 . A A . 523 TYR HH 1 1 4 2416 1 1 26 TYR N N -3.736 0.285 0.631 1.00 . A A . 523 TYR N 1 1 4 2417 1 1 26 TYR O O -6.021 -0.630 1.646 1.00 . A A . 523 TYR O 1 1 4 2418 1 1 26 TYR OH O 2.372 -1.180 -0.870 1.00 . A A . 523 TYR OH 1 1 4 2419 1 1 27 CYS C C -6.675 -4.195 2.898 1.00 . A A . 524 CYS C 1 1 4 2420 1 1 27 CYS CA C -6.908 -3.233 1.743 1.00 . A A . 524 CYS CA 1 1 4 2421 1 1 27 CYS CB C -7.781 -3.888 0.661 1.00 . A A . 524 CYS CB 1 1 4 2422 1 1 27 CYS H H -4.971 -3.464 0.915 1.00 . A A . 524 CYS H 1 1 4 2423 1 1 27 CYS HA H -7.418 -2.359 2.123 1.00 . A A . 524 CYS HA 1 1 4 2424 1 1 27 CYS HB2 H -8.815 -3.818 0.963 1.00 . A A . 524 CYS HB2 1 1 4 2425 1 1 27 CYS HB3 H -7.651 -3.347 -0.266 1.00 . A A . 524 CYS HB3 1 1 4 2426 1 1 27 CYS N N -5.627 -2.795 1.198 1.00 . A A . 524 CYS N 1 1 4 2427 1 1 27 CYS O O -7.611 -4.617 3.578 1.00 . A A . 524 CYS O 1 1 4 2428 1 1 27 CYS SG S -7.433 -5.648 0.324 1.00 . A A . 524 CYS SG 1 1 4 2429 1 1 28 SER C C -3.534 -5.332 4.418 1.00 . A A . 525 SER C 1 1 4 2430 1 1 28 SER CA C -5.032 -5.453 4.165 1.00 . A A . 525 SER CA 1 1 4 2431 1 1 28 SER CB C -5.379 -6.887 3.748 1.00 . A A . 525 SER CB 1 1 4 2432 1 1 28 SER H H -4.700 -4.115 2.592 1.00 . A A . 525 SER H 1 1 4 2433 1 1 28 SER HA H -5.571 -5.198 5.066 1.00 . A A . 525 SER HA 1 1 4 2434 1 1 28 SER HB2 H -6.444 -6.966 3.590 1.00 . A A . 525 SER HB2 1 1 4 2435 1 1 28 SER HB3 H -4.862 -7.127 2.830 1.00 . A A . 525 SER HB3 1 1 4 2436 1 1 28 SER HG H -5.791 -8.224 5.131 1.00 . A A . 525 SER HG 1 1 4 2437 1 1 28 SER N N -5.412 -4.522 3.126 1.00 . A A . 525 SER N 1 1 4 2438 1 1 28 SER O O -2.798 -4.817 3.573 1.00 . A A . 525 SER O 1 1 4 2439 1 1 28 SER OG O -4.996 -7.821 4.745 1.00 . A A . 525 SER OG 1 1 4 2440 1 1 29 THR C C -0.960 -6.850 5.017 1.00 . A A . 526 THR C 1 1 4 2441 1 1 29 THR CA C -1.675 -5.820 5.889 1.00 . A A . 526 THR CA 1 1 4 2442 1 1 29 THR CB C -1.455 -6.149 7.377 1.00 . A A . 526 THR CB 1 1 4 2443 1 1 29 THR CG2 C 0.012 -6.010 7.765 1.00 . A A . 526 THR CG2 1 1 4 2444 1 1 29 THR H H -3.731 -6.136 6.234 1.00 . A A . 526 THR H 1 1 4 2445 1 1 29 THR HA H -1.269 -4.839 5.688 1.00 . A A . 526 THR HA 1 1 4 2446 1 1 29 THR HB H -1.767 -7.168 7.556 1.00 . A A . 526 THR HB 1 1 4 2447 1 1 29 THR HG1 H -1.829 -4.391 8.203 1.00 . A A . 526 THR HG1 1 1 4 2448 1 1 29 THR HG21 H 0.337 -4.993 7.593 1.00 . A A . 526 THR HG21 1 1 4 2449 1 1 29 THR HG22 H 0.131 -6.252 8.810 1.00 . A A . 526 THR HG22 1 1 4 2450 1 1 29 THR HG23 H 0.609 -6.685 7.168 1.00 . A A . 526 THR HG23 1 1 4 2451 1 1 29 THR N N -3.090 -5.799 5.573 1.00 . A A . 526 THR N 1 1 4 2452 1 1 29 THR O O 0.236 -6.730 4.742 1.00 . A A . 526 THR O 1 1 4 2453 1 1 29 THR OG1 O -2.248 -5.266 8.179 1.00 . A A . 526 THR OG1 1 1 4 2454 1 1 30 PHE C C -0.684 -8.262 2.377 1.00 . A A . 527 PHE C 1 1 4 2455 1 1 30 PHE CA C -1.157 -8.881 3.689 1.00 . A A . 527 PHE CA 1 1 4 2456 1 1 30 PHE CB C -2.193 -9.975 3.408 1.00 . A A . 527 PHE CB 1 1 4 2457 1 1 30 PHE CD1 C -1.031 -12.121 2.812 1.00 . A A . 527 PHE CD1 1 1 4 2458 1 1 30 PHE CD2 C -1.950 -10.800 1.051 1.00 . A A . 527 PHE CD2 1 1 4 2459 1 1 30 PHE CE1 C -0.579 -13.043 1.887 1.00 . A A . 527 PHE CE1 1 1 4 2460 1 1 30 PHE CE2 C -1.503 -11.715 0.124 1.00 . A A . 527 PHE CE2 1 1 4 2461 1 1 30 PHE CG C -1.719 -10.991 2.406 1.00 . A A . 527 PHE CG 1 1 4 2462 1 1 30 PHE CZ C -0.816 -12.840 0.539 1.00 . A A . 527 PHE CZ 1 1 4 2463 1 1 30 PHE H H -2.648 -7.924 4.845 1.00 . A A . 527 PHE H 1 1 4 2464 1 1 30 PHE HA H -0.307 -9.323 4.188 1.00 . A A . 527 PHE HA 1 1 4 2465 1 1 30 PHE HB2 H -2.421 -10.494 4.325 1.00 . A A . 527 PHE HB2 1 1 4 2466 1 1 30 PHE HB3 H -3.092 -9.518 3.021 1.00 . A A . 527 PHE HB3 1 1 4 2467 1 1 30 PHE HD1 H -0.847 -12.282 3.863 1.00 . A A . 527 PHE HD1 1 1 4 2468 1 1 30 PHE HD2 H -2.487 -9.922 0.725 1.00 . A A . 527 PHE HD2 1 1 4 2469 1 1 30 PHE HE1 H -0.040 -13.920 2.215 1.00 . A A . 527 PHE HE1 1 1 4 2470 1 1 30 PHE HE2 H -1.687 -11.549 -0.926 1.00 . A A . 527 PHE HE2 1 1 4 2471 1 1 30 PHE HZ H -0.463 -13.557 -0.186 1.00 . A A . 527 PHE HZ 1 1 4 2472 1 1 30 PHE N N -1.708 -7.860 4.569 1.00 . A A . 527 PHE N 1 1 4 2473 1 1 30 PHE O O 0.445 -8.496 1.949 1.00 . A A . 527 PHE O 1 1 4 2474 1 1 31 CYS C C -0.008 -5.906 0.661 1.00 . A A . 528 CYS C 1 1 4 2475 1 1 31 CYS CA C -1.211 -6.822 0.484 1.00 . A A . 528 CYS CA 1 1 4 2476 1 1 31 CYS CB C -2.413 -6.041 -0.037 1.00 . A A . 528 CYS CB 1 1 4 2477 1 1 31 CYS H H -2.421 -7.291 2.150 1.00 . A A . 528 CYS H 1 1 4 2478 1 1 31 CYS HA H -0.959 -7.616 -0.204 1.00 . A A . 528 CYS HA 1 1 4 2479 1 1 31 CYS HB2 H -2.507 -5.119 0.517 1.00 . A A . 528 CYS HB2 1 1 4 2480 1 1 31 CYS HB3 H -2.266 -5.817 -1.082 1.00 . A A . 528 CYS HB3 1 1 4 2481 1 1 31 CYS N N -1.542 -7.455 1.754 1.00 . A A . 528 CYS N 1 1 4 2482 1 1 31 CYS O O 0.839 -5.795 -0.221 1.00 . A A . 528 CYS O 1 1 4 2483 1 1 31 CYS SG S -3.978 -6.951 0.122 1.00 . A A . 528 CYS SG 1 1 4 2484 1 1 32 GLN C C 2.483 -5.170 2.145 1.00 . A A . 529 GLN C 1 1 4 2485 1 1 32 GLN CA C 1.166 -4.396 2.175 1.00 . A A . 529 GLN CA 1 1 4 2486 1 1 32 GLN CB C 0.933 -3.808 3.575 1.00 . A A . 529 GLN CB 1 1 4 2487 1 1 32 GLN CD C 2.658 -2.093 4.306 1.00 . A A . 529 GLN CD 1 1 4 2488 1 1 32 GLN CG C 2.212 -3.537 4.365 1.00 . A A . 529 GLN CG 1 1 4 2489 1 1 32 GLN H H -0.657 -5.414 2.485 1.00 . A A . 529 GLN H 1 1 4 2490 1 1 32 GLN HA H 1.197 -3.597 1.451 1.00 . A A . 529 GLN HA 1 1 4 2491 1 1 32 GLN HB2 H 0.398 -2.877 3.472 1.00 . A A . 529 GLN HB2 1 1 4 2492 1 1 32 GLN HB3 H 0.326 -4.498 4.144 1.00 . A A . 529 GLN HB3 1 1 4 2493 1 1 32 GLN HE21 H 3.707 -2.440 2.655 1.00 . A A . 529 GLN HE21 1 1 4 2494 1 1 32 GLN HE22 H 3.742 -0.807 3.246 1.00 . A A . 529 GLN HE22 1 1 4 2495 1 1 32 GLN HG2 H 2.042 -3.798 5.399 1.00 . A A . 529 GLN HG2 1 1 4 2496 1 1 32 GLN HG3 H 3.002 -4.158 3.967 1.00 . A A . 529 GLN HG3 1 1 4 2497 1 1 32 GLN N N 0.058 -5.270 1.827 1.00 . A A . 529 GLN N 1 1 4 2498 1 1 32 GLN NE2 N 3.450 -1.750 3.304 1.00 . A A . 529 GLN NE2 1 1 4 2499 1 1 32 GLN O O 3.470 -4.730 1.556 1.00 . A A . 529 GLN O 1 1 4 2500 1 1 32 GLN OE1 O 2.293 -1.294 5.166 1.00 . A A . 529 GLN OE1 1 1 4 2501 1 1 33 ARG C C 3.967 -7.835 1.559 1.00 . A A . 530 ARG C 1 1 4 2502 1 1 33 ARG CA C 3.664 -7.162 2.899 1.00 . A A . 530 ARG CA 1 1 4 2503 1 1 33 ARG CB C 3.467 -8.180 4.029 1.00 . A A . 530 ARG CB 1 1 4 2504 1 1 33 ARG CD C 4.367 -10.001 5.474 1.00 . A A . 530 ARG CD 1 1 4 2505 1 1 33 ARG CG C 4.604 -9.169 4.223 1.00 . A A . 530 ARG CG 1 1 4 2506 1 1 33 ARG CZ C 5.864 -11.478 6.765 1.00 . A A . 530 ARG CZ 1 1 4 2507 1 1 33 ARG H H 1.637 -6.630 3.209 1.00 . A A . 530 ARG H 1 1 4 2508 1 1 33 ARG HA H 4.480 -6.498 3.141 1.00 . A A . 530 ARG HA 1 1 4 2509 1 1 33 ARG HB2 H 3.339 -7.639 4.954 1.00 . A A . 530 ARG HB2 1 1 4 2510 1 1 33 ARG HB3 H 2.566 -8.740 3.830 1.00 . A A . 530 ARG HB3 1 1 4 2511 1 1 33 ARG HD2 H 4.466 -9.359 6.337 1.00 . A A . 530 ARG HD2 1 1 4 2512 1 1 33 ARG HD3 H 3.362 -10.394 5.439 1.00 . A A . 530 ARG HD3 1 1 4 2513 1 1 33 ARG HE H 5.490 -11.649 4.800 1.00 . A A . 530 ARG HE 1 1 4 2514 1 1 33 ARG HG2 H 4.655 -9.823 3.365 1.00 . A A . 530 ARG HG2 1 1 4 2515 1 1 33 ARG HG3 H 5.532 -8.626 4.327 1.00 . A A . 530 ARG HG3 1 1 4 2516 1 1 33 ARG HH11 H 5.172 -9.872 7.805 1.00 . A A . 530 ARG HH11 1 1 4 2517 1 1 33 ARG HH12 H 6.128 -11.002 8.718 1.00 . A A . 530 ARG HH12 1 1 4 2518 1 1 33 ARG HH21 H 6.729 -13.153 6.013 1.00 . A A . 530 ARG HH21 1 1 4 2519 1 1 33 ARG HH22 H 7.022 -12.849 7.700 1.00 . A A . 530 ARG HH22 1 1 4 2520 1 1 33 ARG N N 2.477 -6.326 2.798 1.00 . A A . 530 ARG N 1 1 4 2521 1 1 33 ARG NE N 5.303 -11.116 5.609 1.00 . A A . 530 ARG NE 1 1 4 2522 1 1 33 ARG NH1 N 5.710 -10.727 7.848 1.00 . A A . 530 ARG NH1 1 1 4 2523 1 1 33 ARG NH2 N 6.597 -12.580 6.833 1.00 . A A . 530 ARG NH2 1 1 4 2524 1 1 33 ARG O O 5.123 -8.090 1.225 1.00 . A A . 530 ARG O 1 1 4 2525 1 1 34 LYS C C 3.692 -7.741 -1.511 1.00 . A A . 531 LYS C 1 1 4 2526 1 1 34 LYS CA C 3.061 -8.722 -0.523 1.00 . A A . 531 LYS CA 1 1 4 2527 1 1 34 LYS CB C 1.676 -9.191 -1.015 1.00 . A A . 531 LYS CB 1 1 4 2528 1 1 34 LYS CD C 1.647 -8.735 -3.506 1.00 . A A . 531 LYS CD 1 1 4 2529 1 1 34 LYS CE C 1.538 -9.338 -4.894 1.00 . A A . 531 LYS CE 1 1 4 2530 1 1 34 LYS CG C 1.645 -9.801 -2.418 1.00 . A A . 531 LYS CG 1 1 4 2531 1 1 34 LYS H H 2.017 -7.909 1.136 1.00 . A A . 531 LYS H 1 1 4 2532 1 1 34 LYS HA H 3.707 -9.580 -0.422 1.00 . A A . 531 LYS HA 1 1 4 2533 1 1 34 LYS HB2 H 1.302 -9.931 -0.324 1.00 . A A . 531 LYS HB2 1 1 4 2534 1 1 34 LYS HB3 H 1.007 -8.342 -1.004 1.00 . A A . 531 LYS HB3 1 1 4 2535 1 1 34 LYS HD2 H 0.808 -8.074 -3.348 1.00 . A A . 531 LYS HD2 1 1 4 2536 1 1 34 LYS HD3 H 2.567 -8.172 -3.439 1.00 . A A . 531 LYS HD3 1 1 4 2537 1 1 34 LYS HE2 H 1.756 -8.574 -5.623 1.00 . A A . 531 LYS HE2 1 1 4 2538 1 1 34 LYS HE3 H 2.260 -10.135 -4.981 1.00 . A A . 531 LYS HE3 1 1 4 2539 1 1 34 LYS HG2 H 2.516 -10.426 -2.547 1.00 . A A . 531 LYS HG2 1 1 4 2540 1 1 34 LYS HG3 H 0.751 -10.403 -2.518 1.00 . A A . 531 LYS HG3 1 1 4 2541 1 1 34 LYS HZ1 H -0.535 -9.152 -4.975 1.00 . A A . 531 LYS HZ1 1 1 4 2542 1 1 34 LYS HZ2 H 0.111 -10.184 -6.153 1.00 . A A . 531 LYS HZ2 1 1 4 2543 1 1 34 LYS HZ3 H -0.005 -10.705 -4.542 1.00 . A A . 531 LYS HZ3 1 1 4 2544 1 1 34 LYS N N 2.918 -8.108 0.793 1.00 . A A . 531 LYS N 1 1 4 2545 1 1 34 LYS NZ N 0.184 -9.883 -5.158 1.00 . A A . 531 LYS NZ 1 1 4 2546 1 1 34 LYS O O 4.608 -8.094 -2.259 1.00 . A A . 531 LYS O 1 1 4 2547 1 1 35 ASP C C 5.080 -4.971 -2.007 1.00 . A A . 532 ASP C 1 1 4 2548 1 1 35 ASP CA C 3.691 -5.466 -2.404 1.00 . A A . 532 ASP CA 1 1 4 2549 1 1 35 ASP CB C 2.697 -4.306 -2.384 1.00 . A A . 532 ASP CB 1 1 4 2550 1 1 35 ASP CG C 2.858 -3.369 -3.561 1.00 . A A . 532 ASP CG 1 1 4 2551 1 1 35 ASP H H 2.502 -6.268 -0.857 1.00 . A A . 532 ASP H 1 1 4 2552 1 1 35 ASP HA H 3.727 -5.872 -3.404 1.00 . A A . 532 ASP HA 1 1 4 2553 1 1 35 ASP HB2 H 1.692 -4.704 -2.402 1.00 . A A . 532 ASP HB2 1 1 4 2554 1 1 35 ASP HB3 H 2.839 -3.741 -1.475 1.00 . A A . 532 ASP HB3 1 1 4 2555 1 1 35 ASP N N 3.222 -6.502 -1.487 1.00 . A A . 532 ASP N 1 1 4 2556 1 1 35 ASP O O 5.758 -4.295 -2.778 1.00 . A A . 532 ASP O 1 1 4 2557 1 1 35 ASP OD1 O 2.714 -3.833 -4.715 1.00 . A A . 532 ASP OD1 1 1 4 2558 1 1 35 ASP OD2 O 3.095 -2.164 -3.345 1.00 . A A . 532 ASP OD2 1 1 4 2559 1 1 36 TRP C C 7.972 -5.176 -1.084 1.00 . A A . 533 TRP C 1 1 4 2560 1 1 36 TRP CA C 6.746 -4.889 -0.217 1.00 . A A . 533 TRP CA 1 1 4 2561 1 1 36 TRP CB C 6.939 -5.490 1.175 1.00 . A A . 533 TRP CB 1 1 4 2562 1 1 36 TRP CD1 C 9.248 -5.461 2.285 1.00 . A A . 533 TRP CD1 1 1 4 2563 1 1 36 TRP CD2 C 8.158 -3.506 2.368 1.00 . A A . 533 TRP CD2 1 1 4 2564 1 1 36 TRP CE2 C 9.404 -3.352 2.999 1.00 . A A . 533 TRP CE2 1 1 4 2565 1 1 36 TRP CE3 C 7.296 -2.405 2.297 1.00 . A A . 533 TRP CE3 1 1 4 2566 1 1 36 TRP CG C 8.077 -4.865 1.920 1.00 . A A . 533 TRP CG 1 1 4 2567 1 1 36 TRP CH2 C 8.954 -1.082 3.469 1.00 . A A . 533 TRP CH2 1 1 4 2568 1 1 36 TRP CZ2 C 9.814 -2.143 3.553 1.00 . A A . 533 TRP CZ2 1 1 4 2569 1 1 36 TRP CZ3 C 7.704 -1.205 2.848 1.00 . A A . 533 TRP CZ3 1 1 4 2570 1 1 36 TRP H H 4.960 -6.027 -0.328 1.00 . A A . 533 TRP H 1 1 4 2571 1 1 36 TRP HA H 6.649 -3.819 -0.110 1.00 . A A . 533 TRP HA 1 1 4 2572 1 1 36 TRP HB2 H 6.040 -5.346 1.753 1.00 . A A . 533 TRP HB2 1 1 4 2573 1 1 36 TRP HB3 H 7.141 -6.547 1.082 1.00 . A A . 533 TRP HB3 1 1 4 2574 1 1 36 TRP HD1 H 9.492 -6.494 2.087 1.00 . A A . 533 TRP HD1 1 1 4 2575 1 1 36 TRP HE1 H 10.949 -4.748 3.298 1.00 . A A . 533 TRP HE1 1 1 4 2576 1 1 36 TRP HE3 H 6.329 -2.481 1.822 1.00 . A A . 533 TRP HE3 1 1 4 2577 1 1 36 TRP HH2 H 9.231 -0.125 3.888 1.00 . A A . 533 TRP HH2 1 1 4 2578 1 1 36 TRP HZ2 H 10.775 -2.032 4.030 1.00 . A A . 533 TRP HZ2 1 1 4 2579 1 1 36 TRP HZ3 H 7.053 -0.344 2.802 1.00 . A A . 533 TRP HZ3 1 1 4 2580 1 1 36 TRP N N 5.508 -5.380 -0.819 1.00 . A A . 533 TRP N 1 1 4 2581 1 1 36 TRP NE1 N 10.052 -4.559 2.936 1.00 . A A . 533 TRP NE1 1 1 4 2582 1 1 36 TRP O O 8.966 -4.469 -1.012 1.00 . A A . 533 TRP O 1 1 4 2583 1 1 37 LYS C C 9.389 -5.525 -3.749 1.00 . A A . 534 LYS C 1 1 4 2584 1 1 37 LYS CA C 9.038 -6.606 -2.732 1.00 . A A . 534 LYS CA 1 1 4 2585 1 1 37 LYS CB C 8.782 -7.944 -3.431 1.00 . A A . 534 LYS CB 1 1 4 2586 1 1 37 LYS CD C 8.051 -10.346 -3.241 1.00 . A A . 534 LYS CD 1 1 4 2587 1 1 37 LYS CE C 7.235 -10.227 -4.522 1.00 . A A . 534 LYS CE 1 1 4 2588 1 1 37 LYS CG C 8.189 -9.013 -2.523 1.00 . A A . 534 LYS CG 1 1 4 2589 1 1 37 LYS H H 7.040 -6.656 -2.019 1.00 . A A . 534 LYS H 1 1 4 2590 1 1 37 LYS HA H 9.912 -6.681 -2.105 1.00 . A A . 534 LYS HA 1 1 4 2591 1 1 37 LYS HB2 H 8.102 -7.784 -4.254 1.00 . A A . 534 LYS HB2 1 1 4 2592 1 1 37 LYS HB3 H 9.720 -8.315 -3.819 1.00 . A A . 534 LYS HB3 1 1 4 2593 1 1 37 LYS HD2 H 9.036 -10.712 -3.489 1.00 . A A . 534 LYS HD2 1 1 4 2594 1 1 37 LYS HD3 H 7.564 -11.048 -2.579 1.00 . A A . 534 LYS HD3 1 1 4 2595 1 1 37 LYS HE2 H 7.733 -9.538 -5.186 1.00 . A A . 534 LYS HE2 1 1 4 2596 1 1 37 LYS HE3 H 7.181 -11.198 -4.991 1.00 . A A . 534 LYS HE3 1 1 4 2597 1 1 37 LYS HG2 H 8.835 -9.143 -1.667 1.00 . A A . 534 LYS HG2 1 1 4 2598 1 1 37 LYS HG3 H 7.212 -8.688 -2.193 1.00 . A A . 534 LYS HG3 1 1 4 2599 1 1 37 LYS HZ1 H 5.375 -10.343 -3.567 1.00 . A A . 534 LYS HZ1 1 1 4 2600 1 1 37 LYS HZ2 H 5.874 -8.761 -3.908 1.00 . A A . 534 LYS HZ2 1 1 4 2601 1 1 37 LYS HZ3 H 5.299 -9.753 -5.157 1.00 . A A . 534 LYS HZ3 1 1 4 2602 1 1 37 LYS N N 7.893 -6.197 -1.916 1.00 . A A . 534 LYS N 1 1 4 2603 1 1 37 LYS NZ N 5.852 -9.737 -4.270 1.00 . A A . 534 LYS NZ 1 1 4 2604 1 1 37 LYS O O 10.569 -5.243 -3.959 1.00 . A A . 534 LYS O 1 1 4 2605 1 1 38 ASP C C 8.629 -2.483 -4.479 1.00 . A A . 535 ASP C 1 1 4 2606 1 1 38 ASP CA C 8.680 -3.779 -5.253 1.00 . A A . 535 ASP CA 1 1 4 2607 1 1 38 ASP CB C 7.654 -3.706 -6.375 1.00 . A A . 535 ASP CB 1 1 4 2608 1 1 38 ASP CG C 8.217 -3.086 -7.641 1.00 . A A . 535 ASP CG 1 1 4 2609 1 1 38 ASP H H 7.472 -5.190 -4.210 1.00 . A A . 535 ASP H 1 1 4 2610 1 1 38 ASP HA H 9.667 -3.917 -5.668 1.00 . A A . 535 ASP HA 1 1 4 2611 1 1 38 ASP HB2 H 7.306 -4.692 -6.595 1.00 . A A . 535 ASP HB2 1 1 4 2612 1 1 38 ASP HB3 H 6.817 -3.105 -6.047 1.00 . A A . 535 ASP HB3 1 1 4 2613 1 1 38 ASP N N 8.400 -4.898 -4.356 1.00 . A A . 535 ASP N 1 1 4 2614 1 1 38 ASP O O 9.394 -1.563 -4.688 1.00 . A A . 535 ASP O 1 1 4 2615 1 1 38 ASP OD1 O 8.564 -1.891 -7.629 1.00 . A A . 535 ASP OD1 1 1 4 2616 1 1 38 ASP OD2 O 8.294 -3.795 -8.669 1.00 . A A . 535 ASP OD2 1 1 4 2617 1 1 39 HIS C C 8.544 -0.791 -1.962 1.00 . A A . 536 HIS C 1 1 4 2618 1 1 39 HIS CA C 7.401 -1.232 -2.862 1.00 . A A . 536 HIS CA 1 1 4 2619 1 1 39 HIS CB C 6.119 -1.434 -2.064 1.00 . A A . 536 HIS CB 1 1 4 2620 1 1 39 HIS CD2 C 5.364 0.055 -0.108 1.00 . A A . 536 HIS CD2 1 1 4 2621 1 1 39 HIS CE1 C 4.808 1.836 -1.212 1.00 . A A . 536 HIS CE1 1 1 4 2622 1 1 39 HIS CG C 5.601 -0.200 -1.416 1.00 . A A . 536 HIS CG 1 1 4 2623 1 1 39 HIS H H 7.225 -3.246 -3.356 1.00 . A A . 536 HIS H 1 1 4 2624 1 1 39 HIS HA H 7.232 -0.467 -3.613 1.00 . A A . 536 HIS HA 1 1 4 2625 1 1 39 HIS HB2 H 5.353 -1.807 -2.726 1.00 . A A . 536 HIS HB2 1 1 4 2626 1 1 39 HIS HB3 H 6.303 -2.166 -1.291 1.00 . A A . 536 HIS HB3 1 1 4 2627 1 1 39 HIS HD1 H 5.272 1.067 -3.088 1.00 . A A . 536 HIS HD1 1 1 4 2628 1 1 39 HIS HD2 H 5.537 -0.619 0.717 1.00 . A A . 536 HIS HD2 1 1 4 2629 1 1 39 HIS HE1 H 4.459 2.827 -1.454 1.00 . A A . 536 HIS HE1 1 1 4 2630 1 1 39 HIS N N 7.717 -2.441 -3.560 1.00 . A A . 536 HIS N 1 1 4 2631 1 1 39 HIS ND1 N 5.242 0.942 -2.107 1.00 . A A . 536 HIS ND1 1 1 4 2632 1 1 39 HIS NE2 N 4.860 1.334 -0.002 1.00 . A A . 536 HIS NE2 1 1 4 2633 1 1 39 HIS O O 8.744 0.395 -1.774 1.00 . A A . 536 HIS O 1 1 4 2634 1 1 40 GLN C C 11.391 -0.430 -1.073 1.00 . A A . 537 GLN C 1 1 4 2635 1 1 40 GLN CA C 10.361 -1.384 -0.463 1.00 . A A . 537 GLN CA 1 1 4 2636 1 1 40 GLN CB C 11.058 -2.632 0.084 1.00 . A A . 537 GLN CB 1 1 4 2637 1 1 40 GLN CD C 12.337 -4.744 -0.432 1.00 . A A . 537 GLN CD 1 1 4 2638 1 1 40 GLN CG C 11.808 -3.432 -0.969 1.00 . A A . 537 GLN CG 1 1 4 2639 1 1 40 GLN H H 9.139 -2.683 -1.644 1.00 . A A . 537 GLN H 1 1 4 2640 1 1 40 GLN HA H 9.883 -0.860 0.350 1.00 . A A . 537 GLN HA 1 1 4 2641 1 1 40 GLN HB2 H 11.765 -2.330 0.844 1.00 . A A . 537 GLN HB2 1 1 4 2642 1 1 40 GLN HB3 H 10.317 -3.275 0.531 1.00 . A A . 537 GLN HB3 1 1 4 2643 1 1 40 GLN HE21 H 10.622 -5.630 -0.873 1.00 . A A . 537 GLN HE21 1 1 4 2644 1 1 40 GLN HE22 H 11.831 -6.643 -0.161 1.00 . A A . 537 GLN HE22 1 1 4 2645 1 1 40 GLN HG2 H 11.141 -3.637 -1.800 1.00 . A A . 537 GLN HG2 1 1 4 2646 1 1 40 GLN HG3 H 12.640 -2.842 -1.314 1.00 . A A . 537 GLN HG3 1 1 4 2647 1 1 40 GLN N N 9.302 -1.734 -1.415 1.00 . A A . 537 GLN N 1 1 4 2648 1 1 40 GLN NE2 N 11.516 -5.775 -0.492 1.00 . A A . 537 GLN NE2 1 1 4 2649 1 1 40 GLN O O 11.852 0.492 -0.401 1.00 . A A . 537 GLN O 1 1 4 2650 1 1 40 GLN OE1 O 13.468 -4.827 0.050 1.00 . A A . 537 GLN OE1 1 1 4 2651 1 1 41 HIS C C 12.087 1.580 -3.353 1.00 . A A . 538 HIS C 1 1 4 2652 1 1 41 HIS CA C 12.714 0.241 -2.986 1.00 . A A . 538 HIS CA 1 1 4 2653 1 1 41 HIS CB C 13.360 -0.421 -4.220 1.00 . A A . 538 HIS CB 1 1 4 2654 1 1 41 HIS CD2 C 11.743 -1.484 -5.923 1.00 . A A . 538 HIS CD2 1 1 4 2655 1 1 41 HIS CE1 C 11.584 0.214 -7.269 1.00 . A A . 538 HIS CE1 1 1 4 2656 1 1 41 HIS CG C 12.506 -0.475 -5.453 1.00 . A A . 538 HIS CG 1 1 4 2657 1 1 41 HIS H H 11.336 -1.369 -2.845 1.00 . A A . 538 HIS H 1 1 4 2658 1 1 41 HIS HA H 13.496 0.448 -2.268 1.00 . A A . 538 HIS HA 1 1 4 2659 1 1 41 HIS HB2 H 14.256 0.124 -4.474 1.00 . A A . 538 HIS HB2 1 1 4 2660 1 1 41 HIS HB3 H 13.629 -1.434 -3.964 1.00 . A A . 538 HIS HB3 1 1 4 2661 1 1 41 HIS HD2 H 11.572 -2.437 -5.446 1.00 . A A . 538 HIS HD2 1 1 4 2662 1 1 41 HIS HE1 H 11.271 0.848 -8.084 1.00 . A A . 538 HIS HE1 1 1 4 2663 1 1 41 HIS HE2 H 10.323 -1.419 -7.466 1.00 . A A . 538 HIS HE2 1 1 4 2664 1 1 41 HIS N N 11.736 -0.628 -2.343 1.00 . A A . 538 HIS N 1 1 4 2665 1 1 41 HIS ND1 N 12.407 0.595 -6.306 1.00 . A A . 538 HIS ND1 1 1 4 2666 1 1 41 HIS NE2 N 11.155 -1.043 -7.082 1.00 . A A . 538 HIS NE2 1 1 4 2667 1 1 41 HIS O O 12.798 2.560 -3.585 1.00 . A A . 538 HIS O 1 1 4 2668 1 1 42 ILE C C 9.730 3.632 -2.392 1.00 . A A . 539 ILE C 1 1 4 2669 1 1 42 ILE CA C 10.090 2.896 -3.696 1.00 . A A . 539 ILE CA 1 1 4 2670 1 1 42 ILE CB C 8.837 2.679 -4.613 1.00 . A A . 539 ILE CB 1 1 4 2671 1 1 42 ILE CD1 C 6.861 3.896 -3.534 1.00 . A A . 539 ILE CD1 1 1 4 2672 1 1 42 ILE CG1 C 7.519 2.563 -3.841 1.00 . A A . 539 ILE CG1 1 1 4 2673 1 1 42 ILE CG2 C 9.020 1.446 -5.475 1.00 . A A . 539 ILE CG2 1 1 4 2674 1 1 42 ILE H H 10.224 0.820 -3.264 1.00 . A A . 539 ILE H 1 1 4 2675 1 1 42 ILE HA H 10.796 3.509 -4.241 1.00 . A A . 539 ILE HA 1 1 4 2676 1 1 42 ILE HB H 8.771 3.514 -5.277 1.00 . A A . 539 ILE HB 1 1 4 2677 1 1 42 ILE HD11 H 6.663 4.421 -4.456 1.00 . A A . 539 ILE HD11 1 1 4 2678 1 1 42 ILE HD12 H 5.932 3.727 -3.009 1.00 . A A . 539 ILE HD12 1 1 4 2679 1 1 42 ILE HD13 H 7.520 4.488 -2.916 1.00 . A A . 539 ILE HD13 1 1 4 2680 1 1 42 ILE HG12 H 6.822 1.987 -4.429 1.00 . A A . 539 ILE HG12 1 1 4 2681 1 1 42 ILE HG13 H 7.699 2.053 -2.904 1.00 . A A . 539 ILE HG13 1 1 4 2682 1 1 42 ILE HG21 H 9.199 0.588 -4.841 1.00 . A A . 539 ILE HG21 1 1 4 2683 1 1 42 ILE HG22 H 8.128 1.280 -6.061 1.00 . A A . 539 ILE HG22 1 1 4 2684 1 1 42 ILE HG23 H 9.862 1.587 -6.136 1.00 . A A . 539 ILE HG23 1 1 4 2685 1 1 42 ILE N N 10.759 1.639 -3.401 1.00 . A A . 539 ILE N 1 1 4 2686 1 1 42 ILE O O 9.934 4.844 -2.280 1.00 . A A . 539 ILE O 1 1 4 2687 1 1 43 CYS C C 9.804 4.273 0.520 1.00 . A A . 540 CYS C 1 1 4 2688 1 1 43 CYS CA C 8.722 3.437 -0.169 1.00 . A A . 540 CYS CA 1 1 4 2689 1 1 43 CYS CB C 8.299 2.279 0.742 1.00 . A A . 540 CYS CB 1 1 4 2690 1 1 43 CYS H H 9.079 1.912 -1.593 1.00 . A A . 540 CYS H 1 1 4 2691 1 1 43 CYS HA H 7.858 4.058 -0.351 1.00 . A A . 540 CYS HA 1 1 4 2692 1 1 43 CYS HB2 H 7.737 1.563 0.160 1.00 . A A . 540 CYS HB2 1 1 4 2693 1 1 43 CYS HB3 H 9.185 1.797 1.131 1.00 . A A . 540 CYS HB3 1 1 4 2694 1 1 43 CYS N N 9.195 2.885 -1.435 1.00 . A A . 540 CYS N 1 1 4 2695 1 1 43 CYS O O 10.915 3.803 0.792 1.00 . A A . 540 CYS O 1 1 4 2696 1 1 43 CYS SG S 7.263 2.767 2.156 1.00 . A A . 540 CYS SG 1 1 4 2697 1 1 44 GLY C C 10.110 7.874 0.881 1.00 . A A . 541 GLY C 1 1 4 2698 1 1 44 GLY CA C 10.370 6.467 1.366 1.00 . A A . 541 GLY CA 1 1 4 2699 1 1 44 GLY H H 8.530 5.796 0.551 1.00 . A A . 541 GLY H 1 1 4 2700 1 1 44 GLY HA2 H 10.254 6.436 2.440 1.00 . A A . 541 GLY HA2 1 1 4 2701 1 1 44 GLY HA3 H 11.381 6.189 1.111 1.00 . A A . 541 GLY HA3 1 1 4 2702 1 1 44 GLY N N 9.451 5.523 0.761 1.00 . A A . 541 GLY N 1 1 4 2703 1 1 44 GLY O O 10.493 8.855 1.522 1.00 . A A . 541 GLY O 1 1 4 2704 1 1 45 GLN C C 7.633 9.562 -0.769 1.00 . A A . 542 GLN C 1 1 4 2705 1 1 45 GLN CA C 9.120 9.248 -0.848 1.00 . A A . 542 GLN CA 1 1 4 2706 1 1 45 GLN CB C 9.578 9.270 -2.305 1.00 . A A . 542 GLN CB 1 1 4 2707 1 1 45 GLN CD C 11.521 9.152 -3.911 1.00 . A A . 542 GLN CD 1 1 4 2708 1 1 45 GLN CG C 11.086 9.310 -2.469 1.00 . A A . 542 GLN CG 1 1 4 2709 1 1 45 GLN H H 9.127 7.139 -0.686 1.00 . A A . 542 GLN H 1 1 4 2710 1 1 45 GLN HA H 9.659 10.006 -0.303 1.00 . A A . 542 GLN HA 1 1 4 2711 1 1 45 GLN HB2 H 9.208 8.383 -2.799 1.00 . A A . 542 GLN HB2 1 1 4 2712 1 1 45 GLN HB3 H 9.161 10.141 -2.790 1.00 . A A . 542 GLN HB3 1 1 4 2713 1 1 45 GLN HE21 H 9.803 9.926 -4.549 1.00 . A A . 542 GLN HE21 1 1 4 2714 1 1 45 GLN HE22 H 10.926 9.455 -5.784 1.00 . A A . 542 GLN HE22 1 1 4 2715 1 1 45 GLN HG2 H 11.452 10.257 -2.099 1.00 . A A . 542 GLN HG2 1 1 4 2716 1 1 45 GLN HG3 H 11.521 8.507 -1.889 1.00 . A A . 542 GLN HG3 1 1 4 2717 1 1 45 GLN N N 9.428 7.964 -0.245 1.00 . A A . 542 GLN N 1 1 4 2718 1 1 45 GLN NE2 N 10.666 9.552 -4.839 1.00 . A A . 542 GLN NE2 1 1 4 2719 1 1 45 GLN O O 6.863 9.182 -1.648 1.00 . A A . 542 GLN O 1 1 4 2720 1 1 45 GLN OE1 O 12.616 8.660 -4.188 1.00 . A A . 542 GLN OE1 1 1 4 2721 1 1 46 SER C C 5.874 12.247 0.094 1.00 . A A . 543 SER C 1 1 4 2722 1 1 46 SER CA C 5.878 10.755 0.412 1.00 . A A . 543 SER CA 1 1 4 2723 1 1 46 SER CB C 5.325 10.524 1.818 1.00 . A A . 543 SER CB 1 1 4 2724 1 1 46 SER H H 7.865 10.381 1.039 1.00 . A A . 543 SER H 1 1 4 2725 1 1 46 SER HA H 5.261 10.238 -0.308 1.00 . A A . 543 SER HA 1 1 4 2726 1 1 46 SER HB2 H 5.865 11.141 2.521 1.00 . A A . 543 SER HB2 1 1 4 2727 1 1 46 SER HB3 H 4.278 10.791 1.837 1.00 . A A . 543 SER HB3 1 1 4 2728 1 1 46 SER HG H 6.381 8.999 2.451 1.00 . A A . 543 SER HG 1 1 4 2729 1 1 46 SER N N 7.235 10.238 0.301 1.00 . A A . 543 SER N 1 1 4 2730 1 1 46 SER O O 4.842 12.917 0.170 1.00 . A A . 543 SER O 1 1 4 2731 1 1 46 SER OG O 5.457 9.168 2.206 1.00 . A A . 543 SER OG 1 1 4 2732 1 1 47 ALA C C 7.946 14.328 -1.881 1.00 . A A . 544 ALA C 1 1 4 2733 1 1 47 ALA CA C 7.223 14.163 -0.556 1.00 . A A . 544 ALA CA 1 1 4 2734 1 1 47 ALA CB C 7.990 14.853 0.561 1.00 . A A . 544 ALA CB 1 1 4 2735 1 1 47 ALA H H 7.816 12.158 -0.331 1.00 . A A . 544 ALA H 1 1 4 2736 1 1 47 ALA HA H 6.245 14.617 -0.630 1.00 . A A . 544 ALA HA 1 1 4 2737 1 1 47 ALA HB1 H 8.966 14.401 0.663 1.00 . A A . 544 ALA HB1 1 1 4 2738 1 1 47 ALA HB2 H 8.101 15.901 0.325 1.00 . A A . 544 ALA HB2 1 1 4 2739 1 1 47 ALA HB3 H 7.446 14.750 1.489 1.00 . A A . 544 ALA HB3 1 1 4 2740 1 1 47 ALA N N 7.046 12.755 -0.255 1.00 . A A . 544 ALA N 1 1 4 2741 1 1 47 ALA O O 7.267 14.576 -2.897 1.00 . A A . 544 ALA O 1 1 4 2742 1 1 47 ALA OXT O 9.184 14.193 -1.906 1.00 . A A . 544 ALA OXT 1 1 4 2743 2 2 1 ZN ZN ZN -5.618 -5.867 -1.028 1.00 . B A . 601 ZN ZN 1 1 4 2744 3 2 1 ZN ZN ZN 5.042 2.437 1.628 1.00 . C A . 602 ZN ZN 1 1 5 2745 1 1 1 GLY C C -16.702 3.471 2.087 1.00 . A A . 498 GLY C 1 1 5 2746 1 1 1 GLY CA C -17.496 4.568 2.768 1.00 . A A . 498 GLY CA 1 1 5 2747 1 1 1 GLY H1 H -16.279 6.153 2.174 1.00 . A A . 498 GLY H1 1 1 5 2748 1 1 1 GLY H2 H -17.842 6.622 2.644 1.00 . A A . 498 GLY H2 1 1 5 2749 1 1 1 GLY H3 H -17.597 5.867 1.149 1.00 . A A . 498 GLY H3 1 1 5 2750 1 1 1 GLY HA2 H -17.197 4.623 3.803 1.00 . A A . 498 GLY HA2 1 1 5 2751 1 1 1 GLY HA3 H -18.547 4.319 2.721 1.00 . A A . 498 GLY HA3 1 1 5 2752 1 1 1 GLY N N -17.290 5.894 2.143 1.00 . A A . 498 GLY N 1 1 5 2753 1 1 1 GLY O O -17.268 2.642 1.374 1.00 . A A . 498 GLY O 1 1 5 2754 1 1 2 ALA C C -14.455 2.196 0.359 1.00 . A A . 499 ALA C 1 1 5 2755 1 1 2 ALA CA C -14.503 2.401 1.874 1.00 . A A . 499 ALA CA 1 1 5 2756 1 1 2 ALA CB C -14.908 1.105 2.570 1.00 . A A . 499 ALA CB 1 1 5 2757 1 1 2 ALA H H -14.985 4.285 2.707 1.00 . A A . 499 ALA H 1 1 5 2758 1 1 2 ALA HA H -13.508 2.649 2.211 1.00 . A A . 499 ALA HA 1 1 5 2759 1 1 2 ALA HB1 H -14.957 1.269 3.637 1.00 . A A . 499 ALA HB1 1 1 5 2760 1 1 2 ALA HB2 H -15.876 0.789 2.210 1.00 . A A . 499 ALA HB2 1 1 5 2761 1 1 2 ALA HB3 H -14.177 0.339 2.358 1.00 . A A . 499 ALA HB3 1 1 5 2762 1 1 2 ALA N N -15.385 3.495 2.282 1.00 . A A . 499 ALA N 1 1 5 2763 1 1 2 ALA O O -14.376 1.066 -0.112 1.00 . A A . 499 ALA O 1 1 5 2764 1 1 3 MET C C -13.518 4.440 -2.297 1.00 . A A . 500 MET C 1 1 5 2765 1 1 3 MET CA C -14.262 3.194 -1.842 1.00 . A A . 500 MET CA 1 1 5 2766 1 1 3 MET CB C -15.557 3.017 -2.648 1.00 . A A . 500 MET CB 1 1 5 2767 1 1 3 MET CE C -18.559 5.675 -3.817 1.00 . A A . 500 MET CE 1 1 5 2768 1 1 3 MET CG C -16.412 4.271 -2.755 1.00 . A A . 500 MET CG 1 1 5 2769 1 1 3 MET H H -14.769 4.143 -0.007 1.00 . A A . 500 MET H 1 1 5 2770 1 1 3 MET HA H -13.627 2.335 -2.008 1.00 . A A . 500 MET HA 1 1 5 2771 1 1 3 MET HB2 H -15.301 2.702 -3.649 1.00 . A A . 500 MET HB2 1 1 5 2772 1 1 3 MET HB3 H -16.151 2.244 -2.181 1.00 . A A . 500 MET HB3 1 1 5 2773 1 1 3 MET HE1 H -17.839 6.352 -4.254 1.00 . A A . 500 MET HE1 1 1 5 2774 1 1 3 MET HE2 H -19.461 5.679 -4.409 1.00 . A A . 500 MET HE2 1 1 5 2775 1 1 3 MET HE3 H -18.786 5.994 -2.810 1.00 . A A . 500 MET HE3 1 1 5 2776 1 1 3 MET HG2 H -16.727 4.563 -1.763 1.00 . A A . 500 MET HG2 1 1 5 2777 1 1 3 MET HG3 H -15.817 5.060 -3.190 1.00 . A A . 500 MET HG3 1 1 5 2778 1 1 3 MET N N -14.522 3.277 -0.406 1.00 . A A . 500 MET N 1 1 5 2779 1 1 3 MET O O -13.307 4.660 -3.490 1.00 . A A . 500 MET O 1 1 5 2780 1 1 3 MET SD S -17.876 4.019 -3.778 1.00 . A A . 500 MET SD 1 1 5 2781 1 1 4 GLU C C -10.945 6.218 -1.880 1.00 . A A . 501 GLU C 1 1 5 2782 1 1 4 GLU CA C -12.412 6.492 -1.577 1.00 . A A . 501 GLU CA 1 1 5 2783 1 1 4 GLU CB C -12.535 7.433 -0.372 1.00 . A A . 501 GLU CB 1 1 5 2784 1 1 4 GLU CD C -14.741 6.688 0.664 1.00 . A A . 501 GLU CD 1 1 5 2785 1 1 4 GLU CG C -13.970 7.812 -0.005 1.00 . A A . 501 GLU CG 1 1 5 2786 1 1 4 GLU H H -13.285 4.981 -0.392 1.00 . A A . 501 GLU H 1 1 5 2787 1 1 4 GLU HA H -12.867 6.956 -2.440 1.00 . A A . 501 GLU HA 1 1 5 2788 1 1 4 GLU HB2 H -12.087 6.955 0.487 1.00 . A A . 501 GLU HB2 1 1 5 2789 1 1 4 GLU HB3 H -11.992 8.342 -0.585 1.00 . A A . 501 GLU HB3 1 1 5 2790 1 1 4 GLU HG2 H -13.941 8.654 0.670 1.00 . A A . 501 GLU HG2 1 1 5 2791 1 1 4 GLU HG3 H -14.492 8.097 -0.907 1.00 . A A . 501 GLU HG3 1 1 5 2792 1 1 4 GLU N N -13.107 5.239 -1.319 1.00 . A A . 501 GLU N 1 1 5 2793 1 1 4 GLU O O -10.216 7.085 -2.360 1.00 . A A . 501 GLU O 1 1 5 2794 1 1 4 GLU OE1 O -14.659 6.552 1.902 1.00 . A A . 501 GLU OE1 1 1 5 2795 1 1 4 GLU OE2 O -15.443 5.933 -0.039 1.00 . A A . 501 GLU OE2 1 1 5 2796 1 1 5 GLN C C -9.252 3.123 -2.405 1.00 . A A . 502 GLN C 1 1 5 2797 1 1 5 GLN CA C -9.179 4.550 -1.884 1.00 . A A . 502 GLN CA 1 1 5 2798 1 1 5 GLN CB C -8.285 4.634 -0.642 1.00 . A A . 502 GLN CB 1 1 5 2799 1 1 5 GLN CD C -9.231 4.663 1.713 1.00 . A A . 502 GLN CD 1 1 5 2800 1 1 5 GLN CG C -8.780 3.812 0.539 1.00 . A A . 502 GLN CG 1 1 5 2801 1 1 5 GLN H H -11.150 4.371 -1.163 1.00 . A A . 502 GLN H 1 1 5 2802 1 1 5 GLN HA H -8.785 5.187 -2.662 1.00 . A A . 502 GLN HA 1 1 5 2803 1 1 5 GLN HB2 H -7.296 4.287 -0.904 1.00 . A A . 502 GLN HB2 1 1 5 2804 1 1 5 GLN HB3 H -8.221 5.667 -0.331 1.00 . A A . 502 GLN HB3 1 1 5 2805 1 1 5 GLN HE21 H -9.769 6.136 0.499 1.00 . A A . 502 GLN HE21 1 1 5 2806 1 1 5 GLN HE22 H -10.018 6.420 2.185 1.00 . A A . 502 GLN HE22 1 1 5 2807 1 1 5 GLN HG2 H -9.615 3.208 0.213 1.00 . A A . 502 GLN HG2 1 1 5 2808 1 1 5 GLN HG3 H -7.981 3.165 0.869 1.00 . A A . 502 GLN HG3 1 1 5 2809 1 1 5 GLN N N -10.525 5.001 -1.582 1.00 . A A . 502 GLN N 1 1 5 2810 1 1 5 GLN NE2 N -9.722 5.860 1.437 1.00 . A A . 502 GLN NE2 1 1 5 2811 1 1 5 GLN O O -10.223 2.420 -2.138 1.00 . A A . 502 GLN O 1 1 5 2812 1 1 5 GLN OE1 O -9.134 4.246 2.866 1.00 . A A . 502 GLN OE1 1 1 5 2813 1 1 6 SER C C -6.955 0.655 -3.433 1.00 . A A . 503 SER C 1 1 5 2814 1 1 6 SER CA C -8.256 1.377 -3.747 1.00 . A A . 503 SER CA 1 1 5 2815 1 1 6 SER CB C -8.441 1.489 -5.259 1.00 . A A . 503 SER CB 1 1 5 2816 1 1 6 SER H H -7.485 3.296 -3.323 1.00 . A A . 503 SER H 1 1 5 2817 1 1 6 SER HA H -9.081 0.822 -3.328 1.00 . A A . 503 SER HA 1 1 5 2818 1 1 6 SER HB2 H -7.569 1.958 -5.693 1.00 . A A . 503 SER HB2 1 1 5 2819 1 1 6 SER HB3 H -8.564 0.500 -5.678 1.00 . A A . 503 SER HB3 1 1 5 2820 1 1 6 SER HG H -9.424 3.184 -5.319 1.00 . A A . 503 SER HG 1 1 5 2821 1 1 6 SER N N -8.252 2.704 -3.159 1.00 . A A . 503 SER N 1 1 5 2822 1 1 6 SER O O -5.880 1.220 -3.583 1.00 . A A . 503 SER O 1 1 5 2823 1 1 6 SER OG O -9.586 2.267 -5.574 1.00 . A A . 503 SER OG 1 1 5 2824 1 1 7 CYS C C -5.045 -1.492 -3.977 1.00 . A A . 504 CYS C 1 1 5 2825 1 1 7 CYS CA C -5.869 -1.372 -2.713 1.00 . A A . 504 CYS CA 1 1 5 2826 1 1 7 CYS CB C -6.234 -2.764 -2.197 1.00 . A A . 504 CYS CB 1 1 5 2827 1 1 7 CYS H H -7.945 -0.996 -2.872 1.00 . A A . 504 CYS H 1 1 5 2828 1 1 7 CYS HA H -5.291 -0.857 -1.959 1.00 . A A . 504 CYS HA 1 1 5 2829 1 1 7 CYS HB2 H -6.916 -2.664 -1.365 1.00 . A A . 504 CYS HB2 1 1 5 2830 1 1 7 CYS HB3 H -6.717 -3.316 -2.988 1.00 . A A . 504 CYS HB3 1 1 5 2831 1 1 7 CYS N N -7.052 -0.592 -2.996 1.00 . A A . 504 CYS N 1 1 5 2832 1 1 7 CYS O O -5.540 -1.940 -5.015 1.00 . A A . 504 CYS O 1 1 5 2833 1 1 7 CYS SG S -4.803 -3.742 -1.627 1.00 . A A . 504 CYS SG 1 1 5 2834 1 1 8 VAL C C -2.679 -2.515 -5.515 1.00 . A A . 505 VAL C 1 1 5 2835 1 1 8 VAL CA C -2.887 -1.088 -5.010 1.00 . A A . 505 VAL CA 1 1 5 2836 1 1 8 VAL CB C -1.534 -0.435 -4.631 1.00 . A A . 505 VAL CB 1 1 5 2837 1 1 8 VAL CG1 C -0.787 -1.275 -3.612 1.00 . A A . 505 VAL CG1 1 1 5 2838 1 1 8 VAL CG2 C -0.675 -0.185 -5.860 1.00 . A A . 505 VAL CG2 1 1 5 2839 1 1 8 VAL H H -3.485 -0.705 -3.024 1.00 . A A . 505 VAL H 1 1 5 2840 1 1 8 VAL HA H -3.334 -0.502 -5.800 1.00 . A A . 505 VAL HA 1 1 5 2841 1 1 8 VAL HB H -1.744 0.522 -4.175 1.00 . A A . 505 VAL HB 1 1 5 2842 1 1 8 VAL HG11 H -0.598 -2.256 -4.022 1.00 . A A . 505 VAL HG11 1 1 5 2843 1 1 8 VAL HG12 H 0.152 -0.799 -3.370 1.00 . A A . 505 VAL HG12 1 1 5 2844 1 1 8 VAL HG13 H -1.384 -1.368 -2.717 1.00 . A A . 505 VAL HG13 1 1 5 2845 1 1 8 VAL HG21 H -1.203 0.467 -6.541 1.00 . A A . 505 VAL HG21 1 1 5 2846 1 1 8 VAL HG22 H 0.251 0.282 -5.560 1.00 . A A . 505 VAL HG22 1 1 5 2847 1 1 8 VAL HG23 H -0.464 -1.124 -6.351 1.00 . A A . 505 VAL HG23 1 1 5 2848 1 1 8 VAL N N -3.796 -1.070 -3.879 1.00 . A A . 505 VAL N 1 1 5 2849 1 1 8 VAL O O -2.222 -2.727 -6.635 1.00 . A A . 505 VAL O 1 1 5 2850 1 1 9 ASN C C -4.220 -5.509 -5.484 1.00 . A A . 506 ASN C 1 1 5 2851 1 1 9 ASN CA C -2.885 -4.889 -5.072 1.00 . A A . 506 ASN CA 1 1 5 2852 1 1 9 ASN CB C -2.268 -5.671 -3.910 1.00 . A A . 506 ASN CB 1 1 5 2853 1 1 9 ASN CG C -2.002 -7.130 -4.244 1.00 . A A . 506 ASN CG 1 1 5 2854 1 1 9 ASN H H -3.396 -3.284 -3.802 1.00 . A A . 506 ASN H 1 1 5 2855 1 1 9 ASN HA H -2.211 -4.929 -5.913 1.00 . A A . 506 ASN HA 1 1 5 2856 1 1 9 ASN HB2 H -1.330 -5.210 -3.637 1.00 . A A . 506 ASN HB2 1 1 5 2857 1 1 9 ASN HB3 H -2.938 -5.632 -3.065 1.00 . A A . 506 ASN HB3 1 1 5 2858 1 1 9 ASN HD21 H -3.754 -7.656 -3.465 1.00 . A A . 506 ASN HD21 1 1 5 2859 1 1 9 ASN HD22 H -2.799 -8.947 -4.113 1.00 . A A . 506 ASN HD22 1 1 5 2860 1 1 9 ASN N N -3.038 -3.496 -4.695 1.00 . A A . 506 ASN N 1 1 5 2861 1 1 9 ASN ND2 N -2.945 -7.997 -3.907 1.00 . A A . 506 ASN ND2 1 1 5 2862 1 1 9 ASN O O -4.255 -6.388 -6.345 1.00 . A A . 506 ASN O 1 1 5 2863 1 1 9 ASN OD1 O -0.946 -7.476 -4.779 1.00 . A A . 506 ASN OD1 1 1 5 2864 1 1 10 CYS C C -7.651 -4.707 -5.723 1.00 . A A . 507 CYS C 1 1 5 2865 1 1 10 CYS CA C -6.613 -5.677 -5.142 1.00 . A A . 507 CYS CA 1 1 5 2866 1 1 10 CYS CB C -7.138 -6.291 -3.847 1.00 . A A . 507 CYS CB 1 1 5 2867 1 1 10 CYS H H -5.266 -4.250 -4.323 1.00 . A A . 507 CYS H 1 1 5 2868 1 1 10 CYS HA H -6.452 -6.471 -5.856 1.00 . A A . 507 CYS HA 1 1 5 2869 1 1 10 CYS HB2 H -7.584 -5.514 -3.244 1.00 . A A . 507 CYS HB2 1 1 5 2870 1 1 10 CYS HB3 H -7.889 -7.030 -4.087 1.00 . A A . 507 CYS HB3 1 1 5 2871 1 1 10 CYS N N -5.321 -5.038 -4.905 1.00 . A A . 507 CYS N 1 1 5 2872 1 1 10 CYS O O -7.862 -4.676 -6.934 1.00 . A A . 507 CYS O 1 1 5 2873 1 1 10 CYS SG S -5.860 -7.108 -2.836 1.00 . A A . 507 CYS SG 1 1 5 2874 1 1 11 GLY C C -9.824 -2.048 -4.279 1.00 . A A . 508 GLY C 1 1 5 2875 1 1 11 GLY CA C -9.372 -3.047 -5.331 1.00 . A A . 508 GLY CA 1 1 5 2876 1 1 11 GLY H H -8.051 -3.928 -3.919 1.00 . A A . 508 GLY H 1 1 5 2877 1 1 11 GLY HA2 H -9.025 -2.505 -6.197 1.00 . A A . 508 GLY HA2 1 1 5 2878 1 1 11 GLY HA3 H -10.215 -3.658 -5.616 1.00 . A A . 508 GLY HA3 1 1 5 2879 1 1 11 GLY N N -8.301 -3.920 -4.865 1.00 . A A . 508 GLY N 1 1 5 2880 1 1 11 GLY O O -9.237 -1.978 -3.203 1.00 . A A . 508 GLY O 1 1 5 2881 1 1 12 ARG C C -11.713 -0.614 -2.296 1.00 . A A . 509 ARG C 1 1 5 2882 1 1 12 ARG CA C -11.381 -0.193 -3.733 1.00 . A A . 509 ARG CA 1 1 5 2883 1 1 12 ARG CB C -12.604 0.464 -4.371 1.00 . A A . 509 ARG CB 1 1 5 2884 1 1 12 ARG CD C -14.941 0.252 -5.216 1.00 . A A . 509 ARG CD 1 1 5 2885 1 1 12 ARG CG C -13.775 -0.479 -4.584 1.00 . A A . 509 ARG CG 1 1 5 2886 1 1 12 ARG CZ C -15.367 1.640 -7.211 1.00 . A A . 509 ARG CZ 1 1 5 2887 1 1 12 ARG H H -11.325 -1.427 -5.458 1.00 . A A . 509 ARG H 1 1 5 2888 1 1 12 ARG HA H -10.604 0.548 -3.685 1.00 . A A . 509 ARG HA 1 1 5 2889 1 1 12 ARG HB2 H -12.934 1.272 -3.734 1.00 . A A . 509 ARG HB2 1 1 5 2890 1 1 12 ARG HB3 H -12.317 0.870 -5.331 1.00 . A A . 509 ARG HB3 1 1 5 2891 1 1 12 ARG HD2 H -15.755 -0.441 -5.360 1.00 . A A . 509 ARG HD2 1 1 5 2892 1 1 12 ARG HD3 H -15.250 1.040 -4.547 1.00 . A A . 509 ARG HD3 1 1 5 2893 1 1 12 ARG HE H -13.673 0.638 -6.853 1.00 . A A . 509 ARG HE 1 1 5 2894 1 1 12 ARG HG2 H -13.468 -1.281 -5.239 1.00 . A A . 509 ARG HG2 1 1 5 2895 1 1 12 ARG HG3 H -14.085 -0.882 -3.631 1.00 . A A . 509 ARG HG3 1 1 5 2896 1 1 12 ARG HH11 H -16.968 1.451 -5.982 1.00 . A A . 509 ARG HH11 1 1 5 2897 1 1 12 ARG HH12 H -17.203 2.486 -7.354 1.00 . A A . 509 ARG HH12 1 1 5 2898 1 1 12 ARG HH21 H -13.974 1.997 -8.644 1.00 . A A . 509 ARG HH21 1 1 5 2899 1 1 12 ARG HH22 H -15.503 2.792 -8.876 1.00 . A A . 509 ARG HH22 1 1 5 2900 1 1 12 ARG N N -10.881 -1.286 -4.591 1.00 . A A . 509 ARG N 1 1 5 2901 1 1 12 ARG NE N -14.577 0.840 -6.502 1.00 . A A . 509 ARG NE 1 1 5 2902 1 1 12 ARG NH1 N -16.612 1.879 -6.818 1.00 . A A . 509 ARG NH1 1 1 5 2903 1 1 12 ARG NH2 N -14.912 2.185 -8.333 1.00 . A A . 509 ARG NH2 1 1 5 2904 1 1 12 ARG O O -12.007 0.232 -1.456 1.00 . A A . 509 ARG O 1 1 5 2905 1 1 13 GLU C C -10.856 -1.939 0.323 1.00 . A A . 510 GLU C 1 1 5 2906 1 1 13 GLU CA C -11.911 -2.441 -0.685 1.00 . A A . 510 GLU CA 1 1 5 2907 1 1 13 GLU CB C -11.936 -3.972 -0.738 1.00 . A A . 510 GLU CB 1 1 5 2908 1 1 13 GLU CD C -12.566 -6.118 0.430 1.00 . A A . 510 GLU CD 1 1 5 2909 1 1 13 GLU CG C -12.357 -4.630 0.568 1.00 . A A . 510 GLU CG 1 1 5 2910 1 1 13 GLU H H -11.520 -2.528 -2.769 1.00 . A A . 510 GLU H 1 1 5 2911 1 1 13 GLU HA H -12.876 -2.092 -0.364 1.00 . A A . 510 GLU HA 1 1 5 2912 1 1 13 GLU HB2 H -12.626 -4.282 -1.509 1.00 . A A . 510 GLU HB2 1 1 5 2913 1 1 13 GLU HB3 H -10.948 -4.326 -0.991 1.00 . A A . 510 GLU HB3 1 1 5 2914 1 1 13 GLU HG2 H -11.588 -4.459 1.307 1.00 . A A . 510 GLU HG2 1 1 5 2915 1 1 13 GLU HG3 H -13.280 -4.180 0.900 1.00 . A A . 510 GLU HG3 1 1 5 2916 1 1 13 GLU N N -11.686 -1.908 -2.030 1.00 . A A . 510 GLU N 1 1 5 2917 1 1 13 GLU O O -10.901 -2.279 1.505 1.00 . A A . 510 GLU O 1 1 5 2918 1 1 13 GLU OE1 O -11.566 -6.859 0.360 1.00 . A A . 510 GLU OE1 1 1 5 2919 1 1 13 GLU OE2 O -13.738 -6.556 0.393 1.00 . A A . 510 GLU OE2 1 1 5 2920 1 1 14 ALA C C -9.288 -0.030 1.973 1.00 . A A . 511 ALA C 1 1 5 2921 1 1 14 ALA CA C -8.809 -0.608 0.643 1.00 . A A . 511 ALA CA 1 1 5 2922 1 1 14 ALA CB C -8.059 0.457 -0.135 1.00 . A A . 511 ALA CB 1 1 5 2923 1 1 14 ALA H H -9.959 -0.878 -1.106 1.00 . A A . 511 ALA H 1 1 5 2924 1 1 14 ALA HA H -8.121 -1.417 0.842 1.00 . A A . 511 ALA HA 1 1 5 2925 1 1 14 ALA HB1 H -7.743 0.054 -1.086 1.00 . A A . 511 ALA HB1 1 1 5 2926 1 1 14 ALA HB2 H -8.707 1.305 -0.301 1.00 . A A . 511 ALA HB2 1 1 5 2927 1 1 14 ALA HB3 H -7.193 0.771 0.430 1.00 . A A . 511 ALA HB3 1 1 5 2928 1 1 14 ALA N N -9.903 -1.142 -0.168 1.00 . A A . 511 ALA N 1 1 5 2929 1 1 14 ALA O O -10.236 0.757 2.023 1.00 . A A . 511 ALA O 1 1 5 2930 1 1 15 MET C C -7.716 0.546 5.127 1.00 . A A . 512 MET C 1 1 5 2931 1 1 15 MET CA C -8.945 0.011 4.392 1.00 . A A . 512 MET CA 1 1 5 2932 1 1 15 MET CB C -9.529 -1.161 5.195 1.00 . A A . 512 MET CB 1 1 5 2933 1 1 15 MET CE C -13.643 -1.474 4.650 1.00 . A A . 512 MET CE 1 1 5 2934 1 1 15 MET CG C -10.890 -1.644 4.718 1.00 . A A . 512 MET CG 1 1 5 2935 1 1 15 MET H H -7.826 -0.994 2.912 1.00 . A A . 512 MET H 1 1 5 2936 1 1 15 MET HA H -9.682 0.793 4.313 1.00 . A A . 512 MET HA 1 1 5 2937 1 1 15 MET HB2 H -8.843 -1.992 5.145 1.00 . A A . 512 MET HB2 1 1 5 2938 1 1 15 MET HB3 H -9.626 -0.854 6.227 1.00 . A A . 512 MET HB3 1 1 5 2939 1 1 15 MET HE1 H -13.652 -2.385 5.230 1.00 . A A . 512 MET HE1 1 1 5 2940 1 1 15 MET HE2 H -14.544 -0.912 4.847 1.00 . A A . 512 MET HE2 1 1 5 2941 1 1 15 MET HE3 H -13.591 -1.716 3.599 1.00 . A A . 512 MET HE3 1 1 5 2942 1 1 15 MET HG2 H -10.853 -1.776 3.648 1.00 . A A . 512 MET HG2 1 1 5 2943 1 1 15 MET HG3 H -11.106 -2.594 5.189 1.00 . A A . 512 MET HG3 1 1 5 2944 1 1 15 MET N N -8.598 -0.415 3.041 1.00 . A A . 512 MET N 1 1 5 2945 1 1 15 MET O O -7.827 1.379 6.025 1.00 . A A . 512 MET O 1 1 5 2946 1 1 15 MET SD S -12.218 -0.491 5.109 1.00 . A A . 512 MET SD 1 1 5 2947 1 1 16 SER C C -4.268 0.994 4.602 1.00 . A A . 513 SER C 1 1 5 2948 1 1 16 SER CA C -5.329 0.349 5.492 1.00 . A A . 513 SER CA 1 1 5 2949 1 1 16 SER CB C -4.797 -0.933 6.142 1.00 . A A . 513 SER CB 1 1 5 2950 1 1 16 SER H H -6.479 -0.430 3.900 1.00 . A A . 513 SER H 1 1 5 2951 1 1 16 SER HA H -5.592 1.057 6.259 1.00 . A A . 513 SER HA 1 1 5 2952 1 1 16 SER HB2 H -5.581 -1.389 6.725 1.00 . A A . 513 SER HB2 1 1 5 2953 1 1 16 SER HB3 H -4.479 -1.619 5.366 1.00 . A A . 513 SER HB3 1 1 5 2954 1 1 16 SER HG H -4.009 -0.541 7.905 1.00 . A A . 513 SER HG 1 1 5 2955 1 1 16 SER N N -6.542 0.065 4.740 1.00 . A A . 513 SER N 1 1 5 2956 1 1 16 SER O O -4.288 0.851 3.383 1.00 . A A . 513 SER O 1 1 5 2957 1 1 16 SER OG O -3.695 -0.668 6.993 1.00 . A A . 513 SER OG 1 1 5 2958 1 1 17 GLU C C -0.935 1.904 4.947 1.00 . A A . 514 GLU C 1 1 5 2959 1 1 17 GLU CA C -2.305 2.426 4.523 1.00 . A A . 514 GLU CA 1 1 5 2960 1 1 17 GLU CB C -2.412 3.925 4.818 1.00 . A A . 514 GLU CB 1 1 5 2961 1 1 17 GLU CD C -2.756 5.714 6.559 1.00 . A A . 514 GLU CD 1 1 5 2962 1 1 17 GLU CG C -2.369 4.274 6.297 1.00 . A A . 514 GLU CG 1 1 5 2963 1 1 17 GLU H H -3.383 1.761 6.203 1.00 . A A . 514 GLU H 1 1 5 2964 1 1 17 GLU HA H -2.443 2.286 3.460 1.00 . A A . 514 GLU HA 1 1 5 2965 1 1 17 GLU HB2 H -1.594 4.434 4.328 1.00 . A A . 514 GLU HB2 1 1 5 2966 1 1 17 GLU HB3 H -3.344 4.292 4.412 1.00 . A A . 514 GLU HB3 1 1 5 2967 1 1 17 GLU HG2 H -3.057 3.630 6.824 1.00 . A A . 514 GLU HG2 1 1 5 2968 1 1 17 GLU HG3 H -1.367 4.110 6.666 1.00 . A A . 514 GLU HG3 1 1 5 2969 1 1 17 GLU N N -3.359 1.719 5.227 1.00 . A A . 514 GLU N 1 1 5 2970 1 1 17 GLU O O -0.814 1.232 5.972 1.00 . A A . 514 GLU O 1 1 5 2971 1 1 17 GLU OE1 O -1.975 6.622 6.211 1.00 . A A . 514 GLU OE1 1 1 5 2972 1 1 17 GLU OE2 O -3.849 5.947 7.116 1.00 . A A . 514 GLU OE2 1 1 5 2973 1 1 18 CYS C C 2.018 2.787 5.543 1.00 . A A . 515 CYS C 1 1 5 2974 1 1 18 CYS CA C 1.453 1.843 4.491 1.00 . A A . 515 CYS CA 1 1 5 2975 1 1 18 CYS CB C 2.347 1.868 3.239 1.00 . A A . 515 CYS CB 1 1 5 2976 1 1 18 CYS H H -0.075 2.742 3.356 1.00 . A A . 515 CYS H 1 1 5 2977 1 1 18 CYS HA H 1.473 0.861 4.949 1.00 . A A . 515 CYS HA 1 1 5 2978 1 1 18 CYS HB2 H 2.264 0.921 2.726 1.00 . A A . 515 CYS HB2 1 1 5 2979 1 1 18 CYS HB3 H 2.013 2.658 2.581 1.00 . A A . 515 CYS HB3 1 1 5 2980 1 1 18 CYS N N 0.087 2.216 4.164 1.00 . A A . 515 CYS N 1 1 5 2981 1 1 18 CYS O O 1.908 4.007 5.434 1.00 . A A . 515 CYS O 1 1 5 2982 1 1 18 CYS SG S 4.119 2.148 3.597 1.00 . A A . 515 CYS SG 1 1 5 2983 1 1 19 THR C C 4.795 3.039 6.955 1.00 . A A . 516 THR C 1 1 5 2984 1 1 19 THR CA C 3.385 2.939 7.542 1.00 . A A . 516 THR CA 1 1 5 2985 1 1 19 THR CB C 3.406 2.279 8.942 1.00 . A A . 516 THR CB 1 1 5 2986 1 1 19 THR CG2 C 3.817 0.814 8.865 1.00 . A A . 516 THR CG2 1 1 5 2987 1 1 19 THR H H 2.381 1.268 6.800 1.00 . A A . 516 THR H 1 1 5 2988 1 1 19 THR HA H 2.976 3.935 7.641 1.00 . A A . 516 THR HA 1 1 5 2989 1 1 19 THR HB H 2.407 2.330 9.353 1.00 . A A . 516 THR HB 1 1 5 2990 1 1 19 THR HG1 H 3.858 3.797 10.125 1.00 . A A . 516 THR HG1 1 1 5 2991 1 1 19 THR HG21 H 4.782 0.737 8.384 1.00 . A A . 516 THR HG21 1 1 5 2992 1 1 19 THR HG22 H 3.875 0.403 9.860 1.00 . A A . 516 THR HG22 1 1 5 2993 1 1 19 THR HG23 H 3.084 0.268 8.289 1.00 . A A . 516 THR HG23 1 1 5 2994 1 1 19 THR N N 2.546 2.208 6.622 1.00 . A A . 516 THR N 1 1 5 2995 1 1 19 THR O O 5.447 2.031 6.676 1.00 . A A . 516 THR O 1 1 5 2996 1 1 19 THR OG1 O 4.292 2.986 9.818 1.00 . A A . 516 THR OG1 1 1 5 2997 1 1 20 GLY C C 6.280 5.534 4.994 1.00 . A A . 517 GLY C 1 1 5 2998 1 1 20 GLY CA C 6.486 4.477 6.040 1.00 . A A . 517 GLY CA 1 1 5 2999 1 1 20 GLY H H 4.784 5.010 7.181 1.00 . A A . 517 GLY H 1 1 5 3000 1 1 20 GLY HA2 H 7.261 4.796 6.722 1.00 . A A . 517 GLY HA2 1 1 5 3001 1 1 20 GLY HA3 H 6.789 3.558 5.560 1.00 . A A . 517 GLY HA3 1 1 5 3002 1 1 20 GLY N N 5.261 4.253 6.777 1.00 . A A . 517 GLY N 1 1 5 3003 1 1 20 GLY O O 7.022 6.514 4.928 1.00 . A A . 517 GLY O 1 1 5 3004 1 1 21 CYS C C 3.291 6.366 3.244 1.00 . A A . 518 CYS C 1 1 5 3005 1 1 21 CYS CA C 4.810 6.377 3.285 1.00 . A A . 518 CYS CA 1 1 5 3006 1 1 21 CYS CB C 5.387 6.169 1.882 1.00 . A A . 518 CYS CB 1 1 5 3007 1 1 21 CYS H H 4.781 4.476 4.194 1.00 . A A . 518 CYS H 1 1 5 3008 1 1 21 CYS HA H 5.146 7.316 3.692 1.00 . A A . 518 CYS HA 1 1 5 3009 1 1 21 CYS HB2 H 5.270 7.082 1.316 1.00 . A A . 518 CYS HB2 1 1 5 3010 1 1 21 CYS HB3 H 6.438 5.935 1.965 1.00 . A A . 518 CYS HB3 1 1 5 3011 1 1 21 CYS N N 5.256 5.339 4.180 1.00 . A A . 518 CYS N 1 1 5 3012 1 1 21 CYS O O 2.670 5.310 3.275 1.00 . A A . 518 CYS O 1 1 5 3013 1 1 21 CYS SG S 4.590 4.827 0.936 1.00 . A A . 518 CYS SG 1 1 5 3014 1 1 22 HIS C C 0.753 7.920 1.746 1.00 . A A . 519 HIS C 1 1 5 3015 1 1 22 HIS CA C 1.244 7.613 3.145 1.00 . A A . 519 HIS CA 1 1 5 3016 1 1 22 HIS CB C 0.760 8.683 4.130 1.00 . A A . 519 HIS CB 1 1 5 3017 1 1 22 HIS CD2 C 2.261 8.713 6.246 1.00 . A A . 519 HIS CD2 1 1 5 3018 1 1 22 HIS CE1 C 0.911 7.673 7.614 1.00 . A A . 519 HIS CE1 1 1 5 3019 1 1 22 HIS CG C 1.139 8.409 5.554 1.00 . A A . 519 HIS CG 1 1 5 3020 1 1 22 HIS H H 3.228 8.353 3.075 1.00 . A A . 519 HIS H 1 1 5 3021 1 1 22 HIS HA H 0.855 6.652 3.449 1.00 . A A . 519 HIS HA 1 1 5 3022 1 1 22 HIS HB2 H 1.188 9.634 3.853 1.00 . A A . 519 HIS HB2 1 1 5 3023 1 1 22 HIS HB3 H -0.315 8.748 4.077 1.00 . A A . 519 HIS HB3 1 1 5 3024 1 1 22 HIS HD1 H -0.585 7.386 6.240 1.00 . A A . 519 HIS HD1 1 1 5 3025 1 1 22 HIS HD2 H 3.130 9.229 5.861 1.00 . A A . 519 HIS HD2 1 1 5 3026 1 1 22 HIS HE1 H 0.500 7.214 8.500 1.00 . A A . 519 HIS HE1 1 1 5 3027 1 1 22 HIS HE2 H 2.669 8.476 8.295 1.00 . A A . 519 HIS HE2 1 1 5 3028 1 1 22 HIS N N 2.691 7.530 3.149 1.00 . A A . 519 HIS N 1 1 5 3029 1 1 22 HIS ND1 N 0.316 7.755 6.443 1.00 . A A . 519 HIS ND1 1 1 5 3030 1 1 22 HIS NE2 N 2.094 8.246 7.524 1.00 . A A . 519 HIS NE2 1 1 5 3031 1 1 22 HIS O O -0.295 8.535 1.563 1.00 . A A . 519 HIS O 1 1 5 3032 1 1 23 LYS C C 0.395 6.686 -1.289 1.00 . A A . 520 LYS C 1 1 5 3033 1 1 23 LYS CA C 1.198 7.800 -0.625 1.00 . A A . 520 LYS CA 1 1 5 3034 1 1 23 LYS CB C 2.473 8.093 -1.430 1.00 . A A . 520 LYS CB 1 1 5 3035 1 1 23 LYS CD C 4.608 7.262 -2.481 1.00 . A A . 520 LYS CD 1 1 5 3036 1 1 23 LYS CE C 4.235 7.975 -3.777 1.00 . A A . 520 LYS CE 1 1 5 3037 1 1 23 LYS CG C 3.369 6.884 -1.674 1.00 . A A . 520 LYS CG 1 1 5 3038 1 1 23 LYS H H 2.317 6.948 0.952 1.00 . A A . 520 LYS H 1 1 5 3039 1 1 23 LYS HA H 0.591 8.692 -0.616 1.00 . A A . 520 LYS HA 1 1 5 3040 1 1 23 LYS HB2 H 2.187 8.495 -2.388 1.00 . A A . 520 LYS HB2 1 1 5 3041 1 1 23 LYS HB3 H 3.050 8.836 -0.900 1.00 . A A . 520 LYS HB3 1 1 5 3042 1 1 23 LYS HD2 H 5.227 7.917 -1.887 1.00 . A A . 520 LYS HD2 1 1 5 3043 1 1 23 LYS HD3 H 5.159 6.358 -2.723 1.00 . A A . 520 LYS HD3 1 1 5 3044 1 1 23 LYS HE2 H 3.726 7.276 -4.421 1.00 . A A . 520 LYS HE2 1 1 5 3045 1 1 23 LYS HE3 H 3.570 8.794 -3.540 1.00 . A A . 520 LYS HE3 1 1 5 3046 1 1 23 LYS HG2 H 3.681 6.481 -0.723 1.00 . A A . 520 LYS HG2 1 1 5 3047 1 1 23 LYS HG3 H 2.810 6.138 -2.218 1.00 . A A . 520 LYS HG3 1 1 5 3048 1 1 23 LYS HZ1 H 6.065 7.743 -4.766 1.00 . A A . 520 LYS HZ1 1 1 5 3049 1 1 23 LYS HZ2 H 5.116 9.010 -5.360 1.00 . A A . 520 LYS HZ2 1 1 5 3050 1 1 23 LYS HZ3 H 5.937 9.188 -3.895 1.00 . A A . 520 LYS HZ3 1 1 5 3051 1 1 23 LYS N N 1.517 7.483 0.754 1.00 . A A . 520 LYS N 1 1 5 3052 1 1 23 LYS NZ N 5.423 8.513 -4.495 1.00 . A A . 520 LYS NZ 1 1 5 3053 1 1 23 LYS O O -0.263 6.917 -2.303 1.00 . A A . 520 LYS O 1 1 5 3054 1 1 24 VAL C C -1.284 3.787 -0.291 1.00 . A A . 521 VAL C 1 1 5 3055 1 1 24 VAL CA C -0.300 4.353 -1.306 1.00 . A A . 521 VAL CA 1 1 5 3056 1 1 24 VAL CB C 0.638 3.218 -1.768 1.00 . A A . 521 VAL CB 1 1 5 3057 1 1 24 VAL CG1 C 1.535 3.681 -2.905 1.00 . A A . 521 VAL CG1 1 1 5 3058 1 1 24 VAL CG2 C 1.469 2.707 -0.600 1.00 . A A . 521 VAL CG2 1 1 5 3059 1 1 24 VAL H H 0.956 5.326 0.082 1.00 . A A . 521 VAL H 1 1 5 3060 1 1 24 VAL HA H -0.849 4.715 -2.164 1.00 . A A . 521 VAL HA 1 1 5 3061 1 1 24 VAL HB H 0.028 2.403 -2.130 1.00 . A A . 521 VAL HB 1 1 5 3062 1 1 24 VAL HG11 H 2.155 4.497 -2.567 1.00 . A A . 521 VAL HG11 1 1 5 3063 1 1 24 VAL HG12 H 2.163 2.862 -3.223 1.00 . A A . 521 VAL HG12 1 1 5 3064 1 1 24 VAL HG13 H 0.926 4.010 -3.734 1.00 . A A . 521 VAL HG13 1 1 5 3065 1 1 24 VAL HG21 H 0.812 2.350 0.180 1.00 . A A . 521 VAL HG21 1 1 5 3066 1 1 24 VAL HG22 H 2.102 1.899 -0.934 1.00 . A A . 521 VAL HG22 1 1 5 3067 1 1 24 VAL HG23 H 2.081 3.509 -0.216 1.00 . A A . 521 VAL HG23 1 1 5 3068 1 1 24 VAL N N 0.436 5.475 -0.738 1.00 . A A . 521 VAL N 1 1 5 3069 1 1 24 VAL O O -1.148 4.009 0.914 1.00 . A A . 521 VAL O 1 1 5 3070 1 1 25 ASN C C -3.537 1.013 -0.254 1.00 . A A . 522 ASN C 1 1 5 3071 1 1 25 ASN CA C -3.296 2.486 0.078 1.00 . A A . 522 ASN CA 1 1 5 3072 1 1 25 ASN CB C -4.598 3.298 0.016 1.00 . A A . 522 ASN CB 1 1 5 3073 1 1 25 ASN CG C -4.856 3.958 -1.334 1.00 . A A . 522 ASN CG 1 1 5 3074 1 1 25 ASN H H -2.345 2.937 -1.756 1.00 . A A . 522 ASN H 1 1 5 3075 1 1 25 ASN HA H -2.917 2.534 1.089 1.00 . A A . 522 ASN HA 1 1 5 3076 1 1 25 ASN HB2 H -5.424 2.639 0.225 1.00 . A A . 522 ASN HB2 1 1 5 3077 1 1 25 ASN HB3 H -4.564 4.069 0.772 1.00 . A A . 522 ASN HB3 1 1 5 3078 1 1 25 ASN HD21 H -4.344 2.307 -2.312 1.00 . A A . 522 ASN HD21 1 1 5 3079 1 1 25 ASN HD22 H -4.822 3.646 -3.299 1.00 . A A . 522 ASN HD22 1 1 5 3080 1 1 25 ASN N N -2.282 3.072 -0.786 1.00 . A A . 522 ASN N 1 1 5 3081 1 1 25 ASN ND2 N -4.647 3.233 -2.420 1.00 . A A . 522 ASN ND2 1 1 5 3082 1 1 25 ASN O O -3.478 0.603 -1.415 1.00 . A A . 522 ASN O 1 1 5 3083 1 1 25 ASN OD1 O -5.284 5.109 -1.395 1.00 . A A . 522 ASN OD1 1 1 5 3084 1 1 26 TYR C C -5.314 -1.604 1.291 1.00 . A A . 523 TYR C 1 1 5 3085 1 1 26 TYR CA C -3.968 -1.215 0.687 1.00 . A A . 523 TYR CA 1 1 5 3086 1 1 26 TYR CB C -2.856 -1.953 1.442 1.00 . A A . 523 TYR CB 1 1 5 3087 1 1 26 TYR CD1 C -0.899 -2.473 -0.065 1.00 . A A . 523 TYR CD1 1 1 5 3088 1 1 26 TYR CD2 C -0.688 -0.657 1.459 1.00 . A A . 523 TYR CD2 1 1 5 3089 1 1 26 TYR CE1 C 0.385 -2.242 -0.521 1.00 . A A . 523 TYR CE1 1 1 5 3090 1 1 26 TYR CE2 C 0.594 -0.419 1.006 1.00 . A A . 523 TYR CE2 1 1 5 3091 1 1 26 TYR CG C -1.457 -1.686 0.932 1.00 . A A . 523 TYR CG 1 1 5 3092 1 1 26 TYR CZ C 1.128 -1.214 0.018 1.00 . A A . 523 TYR CZ 1 1 5 3093 1 1 26 TYR H H -3.874 0.653 1.679 1.00 . A A . 523 TYR H 1 1 5 3094 1 1 26 TYR HA H -3.947 -1.492 -0.355 1.00 . A A . 523 TYR HA 1 1 5 3095 1 1 26 TYR HB2 H -2.886 -1.656 2.478 1.00 . A A . 523 TYR HB2 1 1 5 3096 1 1 26 TYR HB3 H -3.036 -3.016 1.374 1.00 . A A . 523 TYR HB3 1 1 5 3097 1 1 26 TYR HD1 H -1.481 -3.279 -0.485 1.00 . A A . 523 TYR HD1 1 1 5 3098 1 1 26 TYR HD2 H -1.107 -0.033 2.236 1.00 . A A . 523 TYR HD2 1 1 5 3099 1 1 26 TYR HE1 H 0.803 -2.868 -1.296 1.00 . A A . 523 TYR HE1 1 1 5 3100 1 1 26 TYR HE2 H 1.174 0.386 1.428 1.00 . A A . 523 TYR HE2 1 1 5 3101 1 1 26 TYR HH H 2.476 -1.213 -1.376 1.00 . A A . 523 TYR HH 1 1 5 3102 1 1 26 TYR N N -3.783 0.233 0.793 1.00 . A A . 523 TYR N 1 1 5 3103 1 1 26 TYR O O -6.019 -0.759 1.837 1.00 . A A . 523 TYR O 1 1 5 3104 1 1 26 TYR OH O 2.408 -0.978 -0.432 1.00 . A A . 523 TYR OH 1 1 5 3105 1 1 27 CYS C C -6.747 -4.302 2.909 1.00 . A A . 524 CYS C 1 1 5 3106 1 1 27 CYS CA C -6.941 -3.334 1.751 1.00 . A A . 524 CYS CA 1 1 5 3107 1 1 27 CYS CB C -7.794 -3.966 0.640 1.00 . A A . 524 CYS CB 1 1 5 3108 1 1 27 CYS H H -4.993 -3.547 0.940 1.00 . A A . 524 CYS H 1 1 5 3109 1 1 27 CYS HA H -7.454 -2.466 2.126 1.00 . A A . 524 CYS HA 1 1 5 3110 1 1 27 CYS HB2 H -8.831 -3.932 0.938 1.00 . A A . 524 CYS HB2 1 1 5 3111 1 1 27 CYS HB3 H -7.672 -3.386 -0.264 1.00 . A A . 524 CYS HB3 1 1 5 3112 1 1 27 CYS N N -5.649 -2.887 1.248 1.00 . A A . 524 CYS N 1 1 5 3113 1 1 27 CYS O O -7.657 -4.535 3.700 1.00 . A A . 524 CYS O 1 1 5 3114 1 1 27 CYS SG S -7.406 -5.700 0.239 1.00 . A A . 524 CYS SG 1 1 5 3115 1 1 28 SER C C -3.708 -5.614 4.388 1.00 . A A . 525 SER C 1 1 5 3116 1 1 28 SER CA C -5.195 -5.752 4.089 1.00 . A A . 525 SER CA 1 1 5 3117 1 1 28 SER CB C -5.524 -7.198 3.710 1.00 . A A . 525 SER CB 1 1 5 3118 1 1 28 SER H H -4.878 -4.660 2.324 1.00 . A A . 525 SER H 1 1 5 3119 1 1 28 SER HA H -5.764 -5.470 4.963 1.00 . A A . 525 SER HA 1 1 5 3120 1 1 28 SER HB2 H -4.933 -7.485 2.853 1.00 . A A . 525 SER HB2 1 1 5 3121 1 1 28 SER HB3 H -5.290 -7.845 4.542 1.00 . A A . 525 SER HB3 1 1 5 3122 1 1 28 SER HG H -7.273 -6.484 3.171 1.00 . A A . 525 SER HG 1 1 5 3123 1 1 28 SER N N -5.550 -4.858 3.004 1.00 . A A . 525 SER N 1 1 5 3124 1 1 28 SER O O -2.953 -5.112 3.553 1.00 . A A . 525 SER O 1 1 5 3125 1 1 28 SER OG O -6.897 -7.347 3.388 1.00 . A A . 525 SER OG 1 1 5 3126 1 1 29 THR C C -1.058 -6.935 5.064 1.00 . A A . 526 THR C 1 1 5 3127 1 1 29 THR CA C -1.880 -5.986 5.936 1.00 . A A . 526 THR CA 1 1 5 3128 1 1 29 THR CB C -1.681 -6.329 7.422 1.00 . A A . 526 THR CB 1 1 5 3129 1 1 29 THR CG2 C -0.267 -5.991 7.873 1.00 . A A . 526 THR CG2 1 1 5 3130 1 1 29 THR H H -3.938 -6.420 6.209 1.00 . A A . 526 THR H 1 1 5 3131 1 1 29 THR HA H -1.539 -4.974 5.770 1.00 . A A . 526 THR HA 1 1 5 3132 1 1 29 THR HB H -1.851 -7.387 7.563 1.00 . A A . 526 THR HB 1 1 5 3133 1 1 29 THR HG1 H -2.329 -5.588 9.138 1.00 . A A . 526 THR HG1 1 1 5 3134 1 1 29 THR HG21 H -0.095 -4.932 7.754 1.00 . A A . 526 THR HG21 1 1 5 3135 1 1 29 THR HG22 H -0.146 -6.260 8.911 1.00 . A A . 526 THR HG22 1 1 5 3136 1 1 29 THR HG23 H 0.444 -6.542 7.272 1.00 . A A . 526 THR HG23 1 1 5 3137 1 1 29 THR N N -3.287 -6.051 5.565 1.00 . A A . 526 THR N 1 1 5 3138 1 1 29 THR O O 0.129 -6.707 4.818 1.00 . A A . 526 THR O 1 1 5 3139 1 1 29 THR OG1 O -2.620 -5.590 8.214 1.00 . A A . 526 THR OG1 1 1 5 3140 1 1 30 PHE C C -0.615 -8.260 2.398 1.00 . A A . 527 PHE C 1 1 5 3141 1 1 30 PHE CA C -1.089 -8.941 3.679 1.00 . A A . 527 PHE CA 1 1 5 3142 1 1 30 PHE CB C -2.078 -10.065 3.344 1.00 . A A . 527 PHE CB 1 1 5 3143 1 1 30 PHE CD1 C -0.699 -11.911 2.343 1.00 . A A . 527 PHE CD1 1 1 5 3144 1 1 30 PHE CD2 C -2.231 -10.741 0.939 1.00 . A A . 527 PHE CD2 1 1 5 3145 1 1 30 PHE CE1 C -0.319 -12.699 1.272 1.00 . A A . 527 PHE CE1 1 1 5 3146 1 1 30 PHE CE2 C -1.856 -11.521 -0.133 1.00 . A A . 527 PHE CE2 1 1 5 3147 1 1 30 PHE CG C -1.658 -10.924 2.187 1.00 . A A . 527 PHE CG 1 1 5 3148 1 1 30 PHE CZ C -0.898 -12.502 0.031 1.00 . A A . 527 PHE CZ 1 1 5 3149 1 1 30 PHE H H -2.643 -8.125 4.845 1.00 . A A . 527 PHE H 1 1 5 3150 1 1 30 PHE HA H -0.235 -9.365 4.186 1.00 . A A . 527 PHE HA 1 1 5 3151 1 1 30 PHE HB2 H -2.188 -10.704 4.207 1.00 . A A . 527 PHE HB2 1 1 5 3152 1 1 30 PHE HB3 H -3.037 -9.629 3.103 1.00 . A A . 527 PHE HB3 1 1 5 3153 1 1 30 PHE HD1 H -0.246 -12.062 3.313 1.00 . A A . 527 PHE HD1 1 1 5 3154 1 1 30 PHE HD2 H -2.980 -9.975 0.809 1.00 . A A . 527 PHE HD2 1 1 5 3155 1 1 30 PHE HE1 H 0.429 -13.466 1.405 1.00 . A A . 527 PHE HE1 1 1 5 3156 1 1 30 PHE HE2 H -2.309 -11.361 -1.098 1.00 . A A . 527 PHE HE2 1 1 5 3157 1 1 30 PHE HZ H -0.604 -13.115 -0.808 1.00 . A A . 527 PHE HZ 1 1 5 3158 1 1 30 PHE N N -1.714 -7.982 4.577 1.00 . A A . 527 PHE N 1 1 5 3159 1 1 30 PHE O O 0.509 -8.482 1.953 1.00 . A A . 527 PHE O 1 1 5 3160 1 1 31 CYS C C 0.044 -5.799 0.799 1.00 . A A . 528 CYS C 1 1 5 3161 1 1 31 CYS CA C -1.135 -6.735 0.583 1.00 . A A . 528 CYS CA 1 1 5 3162 1 1 31 CYS CB C -2.334 -5.955 0.076 1.00 . A A . 528 CYS CB 1 1 5 3163 1 1 31 CYS H H -2.338 -7.256 2.233 1.00 . A A . 528 CYS H 1 1 5 3164 1 1 31 CYS HA H -0.858 -7.498 -0.130 1.00 . A A . 528 CYS HA 1 1 5 3165 1 1 31 CYS HB2 H -2.399 -5.016 0.606 1.00 . A A . 528 CYS HB2 1 1 5 3166 1 1 31 CYS HB3 H -2.209 -5.762 -0.980 1.00 . A A . 528 CYS HB3 1 1 5 3167 1 1 31 CYS N N -1.466 -7.419 1.820 1.00 . A A . 528 CYS N 1 1 5 3168 1 1 31 CYS O O 0.891 -5.648 -0.075 1.00 . A A . 528 CYS O 1 1 5 3169 1 1 31 CYS SG S -3.907 -6.828 0.299 1.00 . A A . 528 CYS SG 1 1 5 3170 1 1 32 GLN C C 2.511 -5.021 2.260 1.00 . A A . 529 GLN C 1 1 5 3171 1 1 32 GLN CA C 1.179 -4.285 2.333 1.00 . A A . 529 GLN CA 1 1 5 3172 1 1 32 GLN CB C 0.964 -3.728 3.752 1.00 . A A . 529 GLN CB 1 1 5 3173 1 1 32 GLN CD C 2.670 -1.895 4.117 1.00 . A A . 529 GLN CD 1 1 5 3174 1 1 32 GLN CG C 2.248 -3.307 4.455 1.00 . A A . 529 GLN CG 1 1 5 3175 1 1 32 GLN H H -0.598 -5.386 2.648 1.00 . A A . 529 GLN H 1 1 5 3176 1 1 32 GLN HA H 1.178 -3.468 1.627 1.00 . A A . 529 GLN HA 1 1 5 3177 1 1 32 GLN HB2 H 0.321 -2.858 3.692 1.00 . A A . 529 GLN HB2 1 1 5 3178 1 1 32 GLN HB3 H 0.480 -4.483 4.354 1.00 . A A . 529 GLN HB3 1 1 5 3179 1 1 32 GLN HE21 H 3.650 -2.529 2.510 1.00 . A A . 529 GLN HE21 1 1 5 3180 1 1 32 GLN HE22 H 3.689 -0.823 2.799 1.00 . A A . 529 GLN HE22 1 1 5 3181 1 1 32 GLN HG2 H 2.097 -3.373 5.522 1.00 . A A . 529 GLN HG2 1 1 5 3182 1 1 32 GLN HG3 H 3.039 -3.981 4.164 1.00 . A A . 529 GLN HG3 1 1 5 3183 1 1 32 GLN N N 0.096 -5.191 1.982 1.00 . A A . 529 GLN N 1 1 5 3184 1 1 32 GLN NE2 N 3.412 -1.734 3.036 1.00 . A A . 529 GLN NE2 1 1 5 3185 1 1 32 GLN O O 3.479 -4.536 1.672 1.00 . A A . 529 GLN O 1 1 5 3186 1 1 32 GLN OE1 O 2.323 -0.954 4.823 1.00 . A A . 529 GLN OE1 1 1 5 3187 1 1 33 ARG C C 4.042 -7.648 1.564 1.00 . A A . 530 ARG C 1 1 5 3188 1 1 33 ARG CA C 3.757 -6.999 2.921 1.00 . A A . 530 ARG CA 1 1 5 3189 1 1 33 ARG CB C 3.655 -8.039 4.030 1.00 . A A . 530 ARG CB 1 1 5 3190 1 1 33 ARG CD C 3.349 -8.470 6.482 1.00 . A A . 530 ARG CD 1 1 5 3191 1 1 33 ARG CG C 3.393 -7.420 5.392 1.00 . A A . 530 ARG CG 1 1 5 3192 1 1 33 ARG CZ C 4.905 -10.194 7.309 1.00 . A A . 530 ARG CZ 1 1 5 3193 1 1 33 ARG H H 1.724 -6.531 3.298 1.00 . A A . 530 ARG H 1 1 5 3194 1 1 33 ARG HA H 4.562 -6.318 3.146 1.00 . A A . 530 ARG HA 1 1 5 3195 1 1 33 ARG HB2 H 2.840 -8.712 3.801 1.00 . A A . 530 ARG HB2 1 1 5 3196 1 1 33 ARG HB3 H 4.576 -8.599 4.079 1.00 . A A . 530 ARG HB3 1 1 5 3197 1 1 33 ARG HD2 H 2.910 -8.033 7.364 1.00 . A A . 530 ARG HD2 1 1 5 3198 1 1 33 ARG HD3 H 2.736 -9.289 6.142 1.00 . A A . 530 ARG HD3 1 1 5 3199 1 1 33 ARG HE H 5.444 -8.375 6.677 1.00 . A A . 530 ARG HE 1 1 5 3200 1 1 33 ARG HG2 H 4.180 -6.715 5.617 1.00 . A A . 530 ARG HG2 1 1 5 3201 1 1 33 ARG HG3 H 2.443 -6.907 5.364 1.00 . A A . 530 ARG HG3 1 1 5 3202 1 1 33 ARG HH11 H 2.973 -10.797 7.186 1.00 . A A . 530 ARG HH11 1 1 5 3203 1 1 33 ARG HH12 H 4.073 -11.961 7.848 1.00 . A A . 530 ARG HH12 1 1 5 3204 1 1 33 ARG HH21 H 6.897 -9.900 7.507 1.00 . A A . 530 ARG HH21 1 1 5 3205 1 1 33 ARG HH22 H 6.320 -11.459 8.019 1.00 . A A . 530 ARG HH22 1 1 5 3206 1 1 33 ARG N N 2.547 -6.194 2.877 1.00 . A A . 530 ARG N 1 1 5 3207 1 1 33 ARG NE N 4.677 -8.982 6.811 1.00 . A A . 530 ARG NE 1 1 5 3208 1 1 33 ARG NH1 N 3.906 -11.055 7.457 1.00 . A A . 530 ARG NH1 1 1 5 3209 1 1 33 ARG NH2 N 6.138 -10.547 7.637 1.00 . A A . 530 ARG NH2 1 1 5 3210 1 1 33 ARG O O 5.196 -7.857 1.195 1.00 . A A . 530 ARG O 1 1 5 3211 1 1 34 LYS C C 3.655 -7.576 -1.506 1.00 . A A . 531 LYS C 1 1 5 3212 1 1 34 LYS CA C 3.123 -8.583 -0.488 1.00 . A A . 531 LYS CA 1 1 5 3213 1 1 34 LYS CB C 1.769 -9.161 -0.941 1.00 . A A . 531 LYS CB 1 1 5 3214 1 1 34 LYS CD C 1.653 -8.941 -3.457 1.00 . A A . 531 LYS CD 1 1 5 3215 1 1 34 LYS CE C 1.760 -9.669 -4.783 1.00 . A A . 531 LYS CE 1 1 5 3216 1 1 34 LYS CG C 1.802 -9.894 -2.279 1.00 . A A . 531 LYS CG 1 1 5 3217 1 1 34 LYS H H 2.084 -7.788 1.185 1.00 . A A . 531 LYS H 1 1 5 3218 1 1 34 LYS HA H 3.835 -9.389 -0.394 1.00 . A A . 531 LYS HA 1 1 5 3219 1 1 34 LYS HB2 H 1.421 -9.855 -0.191 1.00 . A A . 531 LYS HB2 1 1 5 3220 1 1 34 LYS HB3 H 1.058 -8.351 -1.022 1.00 . A A . 531 LYS HB3 1 1 5 3221 1 1 34 LYS HD2 H 0.687 -8.462 -3.400 1.00 . A A . 531 LYS HD2 1 1 5 3222 1 1 34 LYS HD3 H 2.431 -8.193 -3.403 1.00 . A A . 531 LYS HD3 1 1 5 3223 1 1 34 LYS HE2 H 2.720 -10.162 -4.832 1.00 . A A . 531 LYS HE2 1 1 5 3224 1 1 34 LYS HE3 H 0.973 -10.408 -4.839 1.00 . A A . 531 LYS HE3 1 1 5 3225 1 1 34 LYS HG2 H 2.744 -10.415 -2.369 1.00 . A A . 531 LYS HG2 1 1 5 3226 1 1 34 LYS HG3 H 0.993 -10.609 -2.302 1.00 . A A . 531 LYS HG3 1 1 5 3227 1 1 34 LYS HZ1 H 2.397 -8.031 -5.915 1.00 . A A . 531 LYS HZ1 1 1 5 3228 1 1 34 LYS HZ2 H 1.699 -9.271 -6.831 1.00 . A A . 531 LYS HZ2 1 1 5 3229 1 1 34 LYS HZ3 H 0.717 -8.249 -5.903 1.00 . A A . 531 LYS HZ3 1 1 5 3230 1 1 34 LYS N N 2.984 -7.962 0.826 1.00 . A A . 531 LYS N 1 1 5 3231 1 1 34 LYS NZ N 1.633 -8.741 -5.935 1.00 . A A . 531 LYS NZ 1 1 5 3232 1 1 34 LYS O O 4.537 -7.895 -2.305 1.00 . A A . 531 LYS O 1 1 5 3233 1 1 35 ASP C C 4.956 -4.821 -2.002 1.00 . A A . 532 ASP C 1 1 5 3234 1 1 35 ASP CA C 3.555 -5.292 -2.363 1.00 . A A . 532 ASP CA 1 1 5 3235 1 1 35 ASP CB C 2.569 -4.122 -2.290 1.00 . A A . 532 ASP CB 1 1 5 3236 1 1 35 ASP CG C 2.839 -3.046 -3.327 1.00 . A A . 532 ASP CG 1 1 5 3237 1 1 35 ASP H H 2.406 -6.165 -0.817 1.00 . A A . 532 ASP H 1 1 5 3238 1 1 35 ASP HA H 3.560 -5.676 -3.372 1.00 . A A . 532 ASP HA 1 1 5 3239 1 1 35 ASP HB2 H 1.570 -4.497 -2.448 1.00 . A A . 532 ASP HB2 1 1 5 3240 1 1 35 ASP HB3 H 2.629 -3.673 -1.309 1.00 . A A . 532 ASP HB3 1 1 5 3241 1 1 35 ASP N N 3.127 -6.359 -1.460 1.00 . A A . 532 ASP N 1 1 5 3242 1 1 35 ASP O O 5.634 -4.196 -2.809 1.00 . A A . 532 ASP O 1 1 5 3243 1 1 35 ASP OD1 O 2.800 -3.362 -4.536 1.00 . A A . 532 ASP OD1 1 1 5 3244 1 1 35 ASP OD2 O 3.073 -1.880 -2.933 1.00 . A A . 532 ASP OD2 1 1 5 3245 1 1 36 TRP C C 7.844 -5.153 -1.215 1.00 . A A . 533 TRP C 1 1 5 3246 1 1 36 TRP CA C 6.697 -4.776 -0.280 1.00 . A A . 533 TRP CA 1 1 5 3247 1 1 36 TRP CB C 6.939 -5.380 1.105 1.00 . A A . 533 TRP CB 1 1 5 3248 1 1 36 TRP CD1 C 9.318 -5.388 2.052 1.00 . A A . 533 TRP CD1 1 1 5 3249 1 1 36 TRP CD2 C 8.246 -3.435 2.255 1.00 . A A . 533 TRP CD2 1 1 5 3250 1 1 36 TRP CE2 C 9.534 -3.297 2.800 1.00 . A A . 533 TRP CE2 1 1 5 3251 1 1 36 TRP CE3 C 7.388 -2.331 2.268 1.00 . A A . 533 TRP CE3 1 1 5 3252 1 1 36 TRP CG C 8.127 -4.780 1.785 1.00 . A A . 533 TRP CG 1 1 5 3253 1 1 36 TRP CH2 C 9.129 -1.040 3.346 1.00 . A A . 533 TRP CH2 1 1 5 3254 1 1 36 TRP CZ2 C 9.988 -2.104 3.348 1.00 . A A . 533 TRP CZ2 1 1 5 3255 1 1 36 TRP CZ3 C 7.840 -1.146 2.814 1.00 . A A . 533 TRP CZ3 1 1 5 3256 1 1 36 TRP H H 4.843 -5.799 -0.264 1.00 . A A . 533 TRP H 1 1 5 3257 1 1 36 TRP HA H 6.674 -3.702 -0.169 1.00 . A A . 533 TRP HA 1 1 5 3258 1 1 36 TRP HB2 H 6.073 -5.206 1.726 1.00 . A A . 533 TRP HB2 1 1 5 3259 1 1 36 TRP HB3 H 7.107 -6.443 1.010 1.00 . A A . 533 TRP HB3 1 1 5 3260 1 1 36 TRP HD1 H 9.542 -6.417 1.814 1.00 . A A . 533 TRP HD1 1 1 5 3261 1 1 36 TRP HE1 H 11.089 -4.703 2.963 1.00 . A A . 533 TRP HE1 1 1 5 3262 1 1 36 TRP HE3 H 6.389 -2.395 1.863 1.00 . A A . 533 TRP HE3 1 1 5 3263 1 1 36 TRP HH2 H 9.440 -0.094 3.763 1.00 . A A . 533 TRP HH2 1 1 5 3264 1 1 36 TRP HZ2 H 10.982 -2.006 3.754 1.00 . A A . 533 TRP HZ2 1 1 5 3265 1 1 36 TRP HZ3 H 7.192 -0.281 2.832 1.00 . A A . 533 TRP HZ3 1 1 5 3266 1 1 36 TRP N N 5.405 -5.210 -0.809 1.00 . A A . 533 TRP N 1 1 5 3267 1 1 36 TRP NE1 N 10.168 -4.505 2.668 1.00 . A A . 533 TRP NE1 1 1 5 3268 1 1 36 TRP O O 8.876 -4.498 -1.242 1.00 . A A . 533 TRP O 1 1 5 3269 1 1 37 LYS C C 8.989 -5.620 -3.964 1.00 . A A . 534 LYS C 1 1 5 3270 1 1 37 LYS CA C 8.664 -6.680 -2.912 1.00 . A A . 534 LYS CA 1 1 5 3271 1 1 37 LYS CB C 8.222 -7.990 -3.565 1.00 . A A . 534 LYS CB 1 1 5 3272 1 1 37 LYS CD C 7.315 -10.326 -3.241 1.00 . A A . 534 LYS CD 1 1 5 3273 1 1 37 LYS CE C 8.518 -11.065 -3.803 1.00 . A A . 534 LYS CE 1 1 5 3274 1 1 37 LYS CG C 7.717 -9.023 -2.564 1.00 . A A . 534 LYS CG 1 1 5 3275 1 1 37 LYS H H 6.785 -6.657 -1.947 1.00 . A A . 534 LYS H 1 1 5 3276 1 1 37 LYS HA H 9.588 -6.835 -2.375 1.00 . A A . 534 LYS HA 1 1 5 3277 1 1 37 LYS HB2 H 7.429 -7.779 -4.264 1.00 . A A . 534 LYS HB2 1 1 5 3278 1 1 37 LYS HB3 H 9.060 -8.415 -4.097 1.00 . A A . 534 LYS HB3 1 1 5 3279 1 1 37 LYS HD2 H 6.825 -10.957 -2.516 1.00 . A A . 534 LYS HD2 1 1 5 3280 1 1 37 LYS HD3 H 6.632 -10.105 -4.047 1.00 . A A . 534 LYS HD3 1 1 5 3281 1 1 37 LYS HE2 H 8.174 -11.955 -4.309 1.00 . A A . 534 LYS HE2 1 1 5 3282 1 1 37 LYS HE3 H 9.020 -10.421 -4.511 1.00 . A A . 534 LYS HE3 1 1 5 3283 1 1 37 LYS HG2 H 8.501 -9.228 -1.852 1.00 . A A . 534 LYS HG2 1 1 5 3284 1 1 37 LYS HG3 H 6.860 -8.615 -2.048 1.00 . A A . 534 LYS HG3 1 1 5 3285 1 1 37 LYS HZ1 H 9.000 -12.039 -2.020 1.00 . A A . 534 LYS HZ1 1 1 5 3286 1 1 37 LYS HZ2 H 10.262 -12.009 -3.149 1.00 . A A . 534 LYS HZ2 1 1 5 3287 1 1 37 LYS HZ3 H 9.876 -10.608 -2.276 1.00 . A A . 534 LYS HZ3 1 1 5 3288 1 1 37 LYS N N 7.645 -6.201 -1.988 1.00 . A A . 534 LYS N 1 1 5 3289 1 1 37 LYS NZ N 9.478 -11.458 -2.739 1.00 . A A . 534 LYS NZ 1 1 5 3290 1 1 37 LYS O O 10.145 -5.480 -4.361 1.00 . A A . 534 LYS O 1 1 5 3291 1 1 38 ASP C C 8.382 -2.469 -4.382 1.00 . A A . 535 ASP C 1 1 5 3292 1 1 38 ASP CA C 8.281 -3.699 -5.245 1.00 . A A . 535 ASP CA 1 1 5 3293 1 1 38 ASP CB C 7.184 -3.468 -6.275 1.00 . A A . 535 ASP CB 1 1 5 3294 1 1 38 ASP CG C 7.524 -2.344 -7.235 1.00 . A A . 535 ASP CG 1 1 5 3295 1 1 38 ASP H H 7.073 -5.087 -4.178 1.00 . A A . 535 ASP H 1 1 5 3296 1 1 38 ASP HA H 9.223 -3.868 -5.743 1.00 . A A . 535 ASP HA 1 1 5 3297 1 1 38 ASP HB2 H 7.035 -4.363 -6.831 1.00 . A A . 535 ASP HB2 1 1 5 3298 1 1 38 ASP HB3 H 6.269 -3.211 -5.763 1.00 . A A . 535 ASP HB3 1 1 5 3299 1 1 38 ASP N N 7.999 -4.865 -4.411 1.00 . A A . 535 ASP N 1 1 5 3300 1 1 38 ASP O O 9.231 -1.615 -4.552 1.00 . A A . 535 ASP O 1 1 5 3301 1 1 38 ASP OD1 O 8.439 -2.526 -8.072 1.00 . A A . 535 ASP OD1 1 1 5 3302 1 1 38 ASP OD2 O 6.888 -1.276 -7.156 1.00 . A A . 535 ASP OD2 1 1 5 3303 1 1 39 HIS C C 8.527 -0.846 -1.854 1.00 . A A . 536 HIS C 1 1 5 3304 1 1 39 HIS CA C 7.295 -1.235 -2.654 1.00 . A A . 536 HIS CA 1 1 5 3305 1 1 39 HIS CB C 6.101 -1.441 -1.726 1.00 . A A . 536 HIS CB 1 1 5 3306 1 1 39 HIS CD2 C 5.520 0.187 0.198 1.00 . A A . 536 HIS CD2 1 1 5 3307 1 1 39 HIS CE1 C 4.603 1.769 -0.967 1.00 . A A . 536 HIS CE1 1 1 5 3308 1 1 39 HIS CG C 5.579 -0.191 -1.106 1.00 . A A . 536 HIS CG 1 1 5 3309 1 1 39 HIS H H 7.004 -3.222 -3.213 1.00 . A A . 536 HIS H 1 1 5 3310 1 1 39 HIS HA H 7.065 -0.446 -3.363 1.00 . A A . 536 HIS HA 1 1 5 3311 1 1 39 HIS HB2 H 5.293 -1.889 -2.285 1.00 . A A . 536 HIS HB2 1 1 5 3312 1 1 39 HIS HB3 H 6.388 -2.110 -0.928 1.00 . A A . 536 HIS HB3 1 1 5 3313 1 1 39 HIS HD1 H 4.857 0.835 -2.810 1.00 . A A . 536 HIS HD1 1 1 5 3314 1 1 39 HIS HD2 H 5.891 -0.372 1.044 1.00 . A A . 536 HIS HD2 1 1 5 3315 1 1 39 HIS HE1 H 4.118 2.695 -1.245 1.00 . A A . 536 HIS HE1 1 1 5 3316 1 1 39 HIS N N 7.519 -2.424 -3.417 1.00 . A A . 536 HIS N 1 1 5 3317 1 1 39 HIS ND1 N 4.994 0.825 -1.830 1.00 . A A . 536 HIS ND1 1 1 5 3318 1 1 39 HIS NE2 N 4.895 1.421 0.267 1.00 . A A . 536 HIS NE2 1 1 5 3319 1 1 39 HIS O O 8.769 0.326 -1.647 1.00 . A A . 536 HIS O 1 1 5 3320 1 1 40 GLN C C 11.467 -0.622 -1.286 1.00 . A A . 537 GLN C 1 1 5 3321 1 1 40 GLN CA C 10.469 -1.534 -0.572 1.00 . A A . 537 GLN CA 1 1 5 3322 1 1 40 GLN CB C 11.156 -2.820 -0.112 1.00 . A A . 537 GLN CB 1 1 5 3323 1 1 40 GLN CD C 12.245 -4.996 -0.795 1.00 . A A . 537 GLN CD 1 1 5 3324 1 1 40 GLN CG C 11.754 -3.635 -1.246 1.00 . A A . 537 GLN CG 1 1 5 3325 1 1 40 GLN H H 9.089 -2.766 -1.638 1.00 . A A . 537 GLN H 1 1 5 3326 1 1 40 GLN HA H 10.099 -0.994 0.284 1.00 . A A . 537 GLN HA 1 1 5 3327 1 1 40 GLN HB2 H 11.950 -2.562 0.573 1.00 . A A . 537 GLN HB2 1 1 5 3328 1 1 40 GLN HB3 H 10.433 -3.435 0.405 1.00 . A A . 537 GLN HB3 1 1 5 3329 1 1 40 GLN HE21 H 10.446 -5.771 -1.114 1.00 . A A . 537 GLN HE21 1 1 5 3330 1 1 40 GLN HE22 H 11.644 -6.867 -0.518 1.00 . A A . 537 GLN HE22 1 1 5 3331 1 1 40 GLN HG2 H 11.002 -3.774 -2.015 1.00 . A A . 537 GLN HG2 1 1 5 3332 1 1 40 GLN HG3 H 12.587 -3.086 -1.652 1.00 . A A . 537 GLN HG3 1 1 5 3333 1 1 40 GLN N N 9.307 -1.825 -1.412 1.00 . A A . 537 GLN N 1 1 5 3334 1 1 40 GLN NE2 N 11.358 -5.977 -0.813 1.00 . A A . 537 GLN NE2 1 1 5 3335 1 1 40 GLN O O 12.086 0.234 -0.650 1.00 . A A . 537 GLN O 1 1 5 3336 1 1 40 GLN OE1 O 13.407 -5.162 -0.426 1.00 . A A . 537 GLN OE1 1 1 5 3337 1 1 41 HIS C C 11.935 1.435 -3.607 1.00 . A A . 538 HIS C 1 1 5 3338 1 1 41 HIS CA C 12.547 0.063 -3.337 1.00 . A A . 538 HIS CA 1 1 5 3339 1 1 41 HIS CB C 13.035 -0.602 -4.644 1.00 . A A . 538 HIS CB 1 1 5 3340 1 1 41 HIS CD2 C 11.266 -1.528 -6.281 1.00 . A A . 538 HIS CD2 1 1 5 3341 1 1 41 HIS CE1 C 11.056 0.251 -7.512 1.00 . A A . 538 HIS CE1 1 1 5 3342 1 1 41 HIS CG C 12.079 -0.560 -5.802 1.00 . A A . 538 HIS CG 1 1 5 3343 1 1 41 HIS H H 11.126 -1.493 -3.060 1.00 . A A . 538 HIS H 1 1 5 3344 1 1 41 HIS HA H 13.406 0.218 -2.700 1.00 . A A . 538 HIS HA 1 1 5 3345 1 1 41 HIS HB2 H 13.943 -0.115 -4.959 1.00 . A A . 538 HIS HB2 1 1 5 3346 1 1 41 HIS HB3 H 13.256 -1.640 -4.438 1.00 . A A . 538 HIS HB3 1 1 5 3347 1 1 41 HIS HD2 H 11.102 -2.507 -5.848 1.00 . A A . 538 HIS HD2 1 1 5 3348 1 1 41 HIS HE1 H 10.707 0.934 -8.271 1.00 . A A . 538 HIS HE1 1 1 5 3349 1 1 41 HIS HE2 H 9.790 -1.373 -7.768 1.00 . A A . 538 HIS HE2 1 1 5 3350 1 1 41 HIS N N 11.621 -0.784 -2.598 1.00 . A A . 538 HIS N 1 1 5 3351 1 1 41 HIS ND1 N 11.944 0.562 -6.583 1.00 . A A . 538 HIS ND1 1 1 5 3352 1 1 41 HIS NE2 N 10.618 -1.006 -7.371 1.00 . A A . 538 HIS NE2 1 1 5 3353 1 1 41 HIS O O 12.660 2.408 -3.829 1.00 . A A . 538 HIS O 1 1 5 3354 1 1 42 ILE C C 9.731 3.552 -2.484 1.00 . A A . 539 ILE C 1 1 5 3355 1 1 42 ILE CA C 9.948 2.807 -3.808 1.00 . A A . 539 ILE CA 1 1 5 3356 1 1 42 ILE CB C 8.603 2.634 -4.601 1.00 . A A . 539 ILE CB 1 1 5 3357 1 1 42 ILE CD1 C 6.770 3.909 -3.341 1.00 . A A . 539 ILE CD1 1 1 5 3358 1 1 42 ILE CG1 C 7.350 2.558 -3.711 1.00 . A A . 539 ILE CG1 1 1 5 3359 1 1 42 ILE CG2 C 8.667 1.400 -5.478 1.00 . A A . 539 ILE CG2 1 1 5 3360 1 1 42 ILE H H 10.061 0.720 -3.437 1.00 . A A . 539 ILE H 1 1 5 3361 1 1 42 ILE HA H 10.614 3.400 -4.419 1.00 . A A . 539 ILE HA 1 1 5 3362 1 1 42 ILE HB H 8.504 3.476 -5.255 1.00 . A A . 539 ILE HB 1 1 5 3363 1 1 42 ILE HD11 H 6.501 4.443 -4.240 1.00 . A A . 539 ILE HD11 1 1 5 3364 1 1 42 ILE HD12 H 5.893 3.768 -2.728 1.00 . A A . 539 ILE HD12 1 1 5 3365 1 1 42 ILE HD13 H 7.506 4.477 -2.792 1.00 . A A . 539 ILE HD13 1 1 5 3366 1 1 42 ILE HG12 H 6.585 2.013 -4.237 1.00 . A A . 539 ILE HG12 1 1 5 3367 1 1 42 ILE HG13 H 7.595 2.037 -2.795 1.00 . A A . 539 ILE HG13 1 1 5 3368 1 1 42 ILE HG21 H 8.846 0.531 -4.863 1.00 . A A . 539 ILE HG21 1 1 5 3369 1 1 42 ILE HG22 H 7.730 1.282 -6.004 1.00 . A A . 539 ILE HG22 1 1 5 3370 1 1 42 ILE HG23 H 9.471 1.507 -6.193 1.00 . A A . 539 ILE HG23 1 1 5 3371 1 1 42 ILE N N 10.607 1.527 -3.581 1.00 . A A . 539 ILE N 1 1 5 3372 1 1 42 ILE O O 9.987 4.751 -2.387 1.00 . A A . 539 ILE O 1 1 5 3373 1 1 43 CYS C C 10.048 4.187 0.396 1.00 . A A . 540 CYS C 1 1 5 3374 1 1 43 CYS CA C 8.878 3.409 -0.205 1.00 . A A . 540 CYS CA 1 1 5 3375 1 1 43 CYS CB C 8.466 2.279 0.740 1.00 . A A . 540 CYS CB 1 1 5 3376 1 1 43 CYS H H 9.041 1.870 -1.646 1.00 . A A . 540 CYS H 1 1 5 3377 1 1 43 CYS HA H 8.038 4.073 -0.335 1.00 . A A . 540 CYS HA 1 1 5 3378 1 1 43 CYS HB2 H 7.862 1.570 0.196 1.00 . A A . 540 CYS HB2 1 1 5 3379 1 1 43 CYS HB3 H 9.357 1.782 1.099 1.00 . A A . 540 CYS HB3 1 1 5 3380 1 1 43 CYS N N 9.231 2.830 -1.492 1.00 . A A . 540 CYS N 1 1 5 3381 1 1 43 CYS O O 11.136 3.649 0.628 1.00 . A A . 540 CYS O 1 1 5 3382 1 1 43 CYS SG S 7.510 2.815 2.190 1.00 . A A . 540 CYS SG 1 1 5 3383 1 1 44 GLY C C 10.518 7.771 0.614 1.00 . A A . 541 GLY C 1 1 5 3384 1 1 44 GLY CA C 10.792 6.376 1.119 1.00 . A A . 541 GLY CA 1 1 5 3385 1 1 44 GLY H H 8.866 5.776 0.483 1.00 . A A . 541 GLY H 1 1 5 3386 1 1 44 GLY HA2 H 10.779 6.378 2.201 1.00 . A A . 541 GLY HA2 1 1 5 3387 1 1 44 GLY HA3 H 11.764 6.058 0.774 1.00 . A A . 541 GLY HA3 1 1 5 3388 1 1 44 GLY N N 9.785 5.458 0.632 1.00 . A A . 541 GLY N 1 1 5 3389 1 1 44 GLY O O 10.807 8.765 1.281 1.00 . A A . 541 GLY O 1 1 5 3390 1 1 45 GLN C C 8.079 9.392 -0.758 1.00 . A A . 542 GLN C 1 1 5 3391 1 1 45 GLN CA C 9.510 9.077 -1.181 1.00 . A A . 542 GLN CA 1 1 5 3392 1 1 45 GLN CB C 9.603 8.975 -2.705 1.00 . A A . 542 GLN CB 1 1 5 3393 1 1 45 GLN CD C 9.125 7.585 -4.749 1.00 . A A . 542 GLN CD 1 1 5 3394 1 1 45 GLN CG C 8.914 7.743 -3.264 1.00 . A A . 542 GLN CG 1 1 5 3395 1 1 45 GLN H H 9.816 6.998 -1.079 1.00 . A A . 542 GLN H 1 1 5 3396 1 1 45 GLN HA H 10.165 9.861 -0.837 1.00 . A A . 542 GLN HA 1 1 5 3397 1 1 45 GLN HB2 H 9.143 9.849 -3.142 1.00 . A A . 542 GLN HB2 1 1 5 3398 1 1 45 GLN HB3 H 10.642 8.941 -2.993 1.00 . A A . 542 GLN HB3 1 1 5 3399 1 1 45 GLN HE21 H 10.839 6.637 -4.407 1.00 . A A . 542 GLN HE21 1 1 5 3400 1 1 45 GLN HE22 H 10.399 6.839 -6.073 1.00 . A A . 542 GLN HE22 1 1 5 3401 1 1 45 GLN HG2 H 9.302 6.868 -2.768 1.00 . A A . 542 GLN HG2 1 1 5 3402 1 1 45 GLN HG3 H 7.854 7.823 -3.073 1.00 . A A . 542 GLN HG3 1 1 5 3403 1 1 45 GLN N N 9.944 7.829 -0.578 1.00 . A A . 542 GLN N 1 1 5 3404 1 1 45 GLN NE2 N 10.226 6.957 -5.118 1.00 . A A . 542 GLN NE2 1 1 5 3405 1 1 45 GLN O O 7.290 8.485 -0.497 1.00 . A A . 542 GLN O 1 1 5 3406 1 1 45 GLN OE1 O 8.316 8.040 -5.555 1.00 . A A . 542 GLN OE1 1 1 5 3407 1 1 46 SER C C 5.815 12.024 -1.347 1.00 . A A . 543 SER C 1 1 5 3408 1 1 46 SER CA C 6.421 11.101 -0.293 1.00 . A A . 543 SER CA 1 1 5 3409 1 1 46 SER CB C 6.496 11.812 1.060 1.00 . A A . 543 SER CB 1 1 5 3410 1 1 46 SER H H 8.422 11.348 -0.947 1.00 . A A . 543 SER H 1 1 5 3411 1 1 46 SER HA H 5.800 10.222 -0.199 1.00 . A A . 543 SER HA 1 1 5 3412 1 1 46 SER HB2 H 7.075 12.719 0.955 1.00 . A A . 543 SER HB2 1 1 5 3413 1 1 46 SER HB3 H 5.498 12.056 1.394 1.00 . A A . 543 SER HB3 1 1 5 3414 1 1 46 SER HG H 6.655 10.141 2.076 1.00 . A A . 543 SER HG 1 1 5 3415 1 1 46 SER N N 7.751 10.671 -0.699 1.00 . A A . 543 SER N 1 1 5 3416 1 1 46 SER O O 4.630 11.930 -1.669 1.00 . A A . 543 SER O 1 1 5 3417 1 1 46 SER OG O 7.118 10.985 2.032 1.00 . A A . 543 SER OG 1 1 5 3418 1 1 47 ALA C C 7.460 14.335 -3.663 1.00 . A A . 544 ALA C 1 1 5 3419 1 1 47 ALA CA C 6.233 13.828 -2.920 1.00 . A A . 544 ALA CA 1 1 5 3420 1 1 47 ALA CB C 5.440 14.986 -2.327 1.00 . A A . 544 ALA CB 1 1 5 3421 1 1 47 ALA H H 7.582 12.916 -1.585 1.00 . A A . 544 ALA H 1 1 5 3422 1 1 47 ALA HA H 5.596 13.297 -3.612 1.00 . A A . 544 ALA HA 1 1 5 3423 1 1 47 ALA HB1 H 6.053 15.516 -1.613 1.00 . A A . 544 ALA HB1 1 1 5 3424 1 1 47 ALA HB2 H 5.145 15.659 -3.118 1.00 . A A . 544 ALA HB2 1 1 5 3425 1 1 47 ALA HB3 H 4.559 14.604 -1.833 1.00 . A A . 544 ALA HB3 1 1 5 3426 1 1 47 ALA N N 6.646 12.901 -1.884 1.00 . A A . 544 ALA N 1 1 5 3427 1 1 47 ALA O O 7.820 15.519 -3.498 1.00 . A A . 544 ALA O 1 1 5 3428 1 1 47 ALA OXT O 8.101 13.518 -4.360 1.00 . A A . 544 ALA OXT 1 1 5 3429 2 2 1 ZN ZN ZN -5.491 -5.829 -0.992 1.00 . B A . 601 ZN ZN 1 1 5 3430 3 2 1 ZN ZN ZN 5.264 2.755 1.692 1.00 . C A . 602 ZN ZN 1 1 6 3431 1 1 1 GLY C C -12.594 3.626 4.419 1.00 . A A . 498 GLY C 1 1 6 3432 1 1 1 GLY CA C -11.590 4.710 4.743 1.00 . A A . 498 GLY CA 1 1 6 3433 1 1 1 GLY H1 H -12.908 6.053 5.647 1.00 . A A . 498 GLY H1 1 1 6 3434 1 1 1 GLY H2 H -12.726 6.287 3.975 1.00 . A A . 498 GLY H2 1 1 6 3435 1 1 1 GLY H3 H -11.497 6.771 5.038 1.00 . A A . 498 GLY H3 1 1 6 3436 1 1 1 GLY HA2 H -10.848 4.742 3.960 1.00 . A A . 498 GLY HA2 1 1 6 3437 1 1 1 GLY HA3 H -11.105 4.471 5.677 1.00 . A A . 498 GLY HA3 1 1 6 3438 1 1 1 GLY N N -12.223 6.047 4.860 1.00 . A A . 498 GLY N 1 1 6 3439 1 1 1 GLY O O -12.506 2.513 4.940 1.00 . A A . 498 GLY O 1 1 6 3440 1 1 2 ALA C C -14.303 2.614 1.677 1.00 . A A . 499 ALA C 1 1 6 3441 1 1 2 ALA CA C -14.548 2.982 3.134 1.00 . A A . 499 ALA CA 1 1 6 3442 1 1 2 ALA CB C -15.956 3.528 3.323 1.00 . A A . 499 ALA CB 1 1 6 3443 1 1 2 ALA H H -13.608 4.875 3.223 1.00 . A A . 499 ALA H 1 1 6 3444 1 1 2 ALA HA H -14.442 2.096 3.744 1.00 . A A . 499 ALA HA 1 1 6 3445 1 1 2 ALA HB1 H -16.093 4.397 2.697 1.00 . A A . 499 ALA HB1 1 1 6 3446 1 1 2 ALA HB2 H -16.675 2.771 3.051 1.00 . A A . 499 ALA HB2 1 1 6 3447 1 1 2 ALA HB3 H -16.098 3.804 4.359 1.00 . A A . 499 ALA HB3 1 1 6 3448 1 1 2 ALA N N -13.561 3.952 3.572 1.00 . A A . 499 ALA N 1 1 6 3449 1 1 2 ALA O O -13.978 1.470 1.364 1.00 . A A . 499 ALA O 1 1 6 3450 1 1 3 MET C C -13.685 4.703 -1.247 1.00 . A A . 500 MET C 1 1 6 3451 1 1 3 MET CA C -14.187 3.407 -0.628 1.00 . A A . 500 MET CA 1 1 6 3452 1 1 3 MET CB C -15.437 2.913 -1.365 1.00 . A A . 500 MET CB 1 1 6 3453 1 1 3 MET CE C -17.024 -0.912 -1.780 1.00 . A A . 500 MET CE 1 1 6 3454 1 1 3 MET CG C -15.701 1.429 -1.175 1.00 . A A . 500 MET CG 1 1 6 3455 1 1 3 MET H H -14.750 4.482 1.108 1.00 . A A . 500 MET H 1 1 6 3456 1 1 3 MET HA H -13.410 2.661 -0.717 1.00 . A A . 500 MET HA 1 1 6 3457 1 1 3 MET HB2 H -16.294 3.459 -1.001 1.00 . A A . 500 MET HB2 1 1 6 3458 1 1 3 MET HB3 H -15.319 3.104 -2.421 1.00 . A A . 500 MET HB3 1 1 6 3459 1 1 3 MET HE1 H -17.028 -1.108 -0.718 1.00 . A A . 500 MET HE1 1 1 6 3460 1 1 3 MET HE2 H -17.860 -1.417 -2.242 1.00 . A A . 500 MET HE2 1 1 6 3461 1 1 3 MET HE3 H -16.102 -1.274 -2.211 1.00 . A A . 500 MET HE3 1 1 6 3462 1 1 3 MET HG2 H -14.845 0.877 -1.533 1.00 . A A . 500 MET HG2 1 1 6 3463 1 1 3 MET HG3 H -15.836 1.235 -0.120 1.00 . A A . 500 MET HG3 1 1 6 3464 1 1 3 MET N N -14.452 3.597 0.794 1.00 . A A . 500 MET N 1 1 6 3465 1 1 3 MET O O -13.962 5.011 -2.408 1.00 . A A . 500 MET O 1 1 6 3466 1 1 3 MET SD S -17.163 0.852 -2.058 1.00 . A A . 500 MET SD 1 1 6 3467 1 1 4 GLU C C -10.967 6.412 -1.471 1.00 . A A . 501 GLU C 1 1 6 3468 1 1 4 GLU CA C -12.347 6.713 -0.907 1.00 . A A . 501 GLU CA 1 1 6 3469 1 1 4 GLU CB C -12.225 7.720 0.247 1.00 . A A . 501 GLU CB 1 1 6 3470 1 1 4 GLU CD C -14.183 6.934 1.659 1.00 . A A . 501 GLU CD 1 1 6 3471 1 1 4 GLU CG C -13.547 8.092 0.912 1.00 . A A . 501 GLU CG 1 1 6 3472 1 1 4 GLU H H -12.792 5.173 0.474 1.00 . A A . 501 GLU H 1 1 6 3473 1 1 4 GLU HA H -12.972 7.128 -1.687 1.00 . A A . 501 GLU HA 1 1 6 3474 1 1 4 GLU HB2 H -11.576 7.303 1.002 1.00 . A A . 501 GLU HB2 1 1 6 3475 1 1 4 GLU HB3 H -11.775 8.625 -0.134 1.00 . A A . 501 GLU HB3 1 1 6 3476 1 1 4 GLU HG2 H -13.367 8.895 1.612 1.00 . A A . 501 GLU HG2 1 1 6 3477 1 1 4 GLU HG3 H -14.233 8.430 0.150 1.00 . A A . 501 GLU HG3 1 1 6 3478 1 1 4 GLU N N -12.947 5.464 -0.453 1.00 . A A . 501 GLU N 1 1 6 3479 1 1 4 GLU O O -10.322 7.252 -2.097 1.00 . A A . 501 GLU O 1 1 6 3480 1 1 4 GLU OE1 O -13.634 6.518 2.699 1.00 . A A . 501 GLU OE1 1 1 6 3481 1 1 4 GLU OE2 O -15.219 6.418 1.189 1.00 . A A . 501 GLU OE2 1 1 6 3482 1 1 5 GLN C C -9.416 3.292 -2.226 1.00 . A A . 502 GLN C 1 1 6 3483 1 1 5 GLN CA C -9.252 4.694 -1.662 1.00 . A A . 502 GLN CA 1 1 6 3484 1 1 5 GLN CB C -8.248 4.687 -0.497 1.00 . A A . 502 GLN CB 1 1 6 3485 1 1 5 GLN CD C -9.643 4.937 1.613 1.00 . A A . 502 GLN CD 1 1 6 3486 1 1 5 GLN CG C -8.740 4.033 0.792 1.00 . A A . 502 GLN CG 1 1 6 3487 1 1 5 GLN H H -11.135 4.574 -0.745 1.00 . A A . 502 GLN H 1 1 6 3488 1 1 5 GLN HA H -8.869 5.347 -2.433 1.00 . A A . 502 GLN HA 1 1 6 3489 1 1 5 GLN HB2 H -7.360 4.160 -0.815 1.00 . A A . 502 GLN HB2 1 1 6 3490 1 1 5 GLN HB3 H -7.979 5.708 -0.273 1.00 . A A . 502 GLN HB3 1 1 6 3491 1 1 5 GLN HE21 H -8.056 5.799 2.433 1.00 . A A . 502 GLN HE21 1 1 6 3492 1 1 5 GLN HE22 H -9.589 6.406 2.957 1.00 . A A . 502 GLN HE22 1 1 6 3493 1 1 5 GLN HG2 H -9.291 3.139 0.538 1.00 . A A . 502 GLN HG2 1 1 6 3494 1 1 5 GLN HG3 H -7.882 3.766 1.391 1.00 . A A . 502 GLN HG3 1 1 6 3495 1 1 5 GLN N N -10.541 5.188 -1.232 1.00 . A A . 502 GLN N 1 1 6 3496 1 1 5 GLN NE2 N -9.035 5.797 2.416 1.00 . A A . 502 GLN NE2 1 1 6 3497 1 1 5 GLN O O -10.417 2.632 -1.959 1.00 . A A . 502 GLN O 1 1 6 3498 1 1 5 GLN OE1 O -10.870 4.887 1.506 1.00 . A A . 502 GLN OE1 1 1 6 3499 1 1 6 SER C C -7.207 0.782 -3.344 1.00 . A A . 503 SER C 1 1 6 3500 1 1 6 SER CA C -8.520 1.511 -3.585 1.00 . A A . 503 SER CA 1 1 6 3501 1 1 6 SER CB C -8.816 1.596 -5.081 1.00 . A A . 503 SER CB 1 1 6 3502 1 1 6 SER H H -7.703 3.430 -3.246 1.00 . A A . 503 SER H 1 1 6 3503 1 1 6 SER HA H -9.317 0.972 -3.096 1.00 . A A . 503 SER HA 1 1 6 3504 1 1 6 SER HB2 H -8.003 2.107 -5.577 1.00 . A A . 503 SER HB2 1 1 6 3505 1 1 6 SER HB3 H -8.919 0.601 -5.486 1.00 . A A . 503 SER HB3 1 1 6 3506 1 1 6 SER HG H -10.243 2.820 -4.524 1.00 . A A . 503 SER HG 1 1 6 3507 1 1 6 SER N N -8.467 2.847 -3.023 1.00 . A A . 503 SER N 1 1 6 3508 1 1 6 SER O O -6.138 1.345 -3.554 1.00 . A A . 503 SER O 1 1 6 3509 1 1 6 SER OG O -10.019 2.312 -5.315 1.00 . A A . 503 SER OG 1 1 6 3510 1 1 7 CYS C C -5.363 -1.387 -4.008 1.00 . A A . 504 CYS C 1 1 6 3511 1 1 7 CYS CA C -6.088 -1.253 -2.686 1.00 . A A . 504 CYS CA 1 1 6 3512 1 1 7 CYS CB C -6.416 -2.646 -2.138 1.00 . A A . 504 CYS CB 1 1 6 3513 1 1 7 CYS H H -8.172 -0.864 -2.721 1.00 . A A . 504 CYS H 1 1 6 3514 1 1 7 CYS HA H -5.452 -0.739 -1.979 1.00 . A A . 504 CYS HA 1 1 6 3515 1 1 7 CYS HB2 H -7.031 -2.545 -1.257 1.00 . A A . 504 CYS HB2 1 1 6 3516 1 1 7 CYS HB3 H -6.956 -3.202 -2.888 1.00 . A A . 504 CYS HB3 1 1 6 3517 1 1 7 CYS N N -7.285 -0.465 -2.894 1.00 . A A . 504 CYS N 1 1 6 3518 1 1 7 CYS O O -5.944 -1.820 -5.007 1.00 . A A . 504 CYS O 1 1 6 3519 1 1 7 CYS SG S -4.940 -3.623 -1.675 1.00 . A A . 504 CYS SG 1 1 6 3520 1 1 8 VAL C C -3.117 -2.493 -5.662 1.00 . A A . 505 VAL C 1 1 6 3521 1 1 8 VAL CA C -3.290 -1.043 -5.210 1.00 . A A . 505 VAL CA 1 1 6 3522 1 1 8 VAL CB C -1.912 -0.380 -4.975 1.00 . A A . 505 VAL CB 1 1 6 3523 1 1 8 VAL CG1 C -1.072 -1.183 -3.990 1.00 . A A . 505 VAL CG1 1 1 6 3524 1 1 8 VAL CG2 C -1.172 -0.173 -6.288 1.00 . A A . 505 VAL CG2 1 1 6 3525 1 1 8 VAL H H -3.722 -0.598 -3.193 1.00 . A A . 505 VAL H 1 1 6 3526 1 1 8 VAL HA H -3.801 -0.496 -5.990 1.00 . A A . 505 VAL HA 1 1 6 3527 1 1 8 VAL HB H -2.083 0.594 -4.538 1.00 . A A . 505 VAL HB 1 1 6 3528 1 1 8 VAL HG11 H -0.926 -2.182 -4.374 1.00 . A A . 505 VAL HG11 1 1 6 3529 1 1 8 VAL HG12 H -0.113 -0.703 -3.857 1.00 . A A . 505 VAL HG12 1 1 6 3530 1 1 8 VAL HG13 H -1.584 -1.233 -3.040 1.00 . A A . 505 VAL HG13 1 1 6 3531 1 1 8 VAL HG21 H -1.753 0.470 -6.933 1.00 . A A . 505 VAL HG21 1 1 6 3532 1 1 8 VAL HG22 H -0.214 0.286 -6.094 1.00 . A A . 505 VAL HG22 1 1 6 3533 1 1 8 VAL HG23 H -1.023 -1.126 -6.775 1.00 . A A . 505 VAL HG23 1 1 6 3534 1 1 8 VAL N N -4.107 -0.980 -4.015 1.00 . A A . 505 VAL N 1 1 6 3535 1 1 8 VAL O O -2.781 -2.760 -6.816 1.00 . A A . 505 VAL O 1 1 6 3536 1 1 9 ASN C C -4.552 -5.506 -5.386 1.00 . A A . 506 ASN C 1 1 6 3537 1 1 9 ASN CA C -3.216 -4.845 -5.059 1.00 . A A . 506 ASN CA 1 1 6 3538 1 1 9 ASN CB C -2.551 -5.564 -3.880 1.00 . A A . 506 ASN CB 1 1 6 3539 1 1 9 ASN CG C -2.288 -7.036 -4.157 1.00 . A A . 506 ASN CG 1 1 6 3540 1 1 9 ASN H H -3.689 -3.171 -3.858 1.00 . A A . 506 ASN H 1 1 6 3541 1 1 9 ASN HA H -2.571 -4.923 -5.923 1.00 . A A . 506 ASN HA 1 1 6 3542 1 1 9 ASN HB2 H -1.608 -5.087 -3.666 1.00 . A A . 506 ASN HB2 1 1 6 3543 1 1 9 ASN HB3 H -3.192 -5.489 -3.014 1.00 . A A . 506 ASN HB3 1 1 6 3544 1 1 9 ASN HD21 H -4.040 -7.544 -3.353 1.00 . A A . 506 ASN HD21 1 1 6 3545 1 1 9 ASN HD22 H -3.071 -8.851 -3.949 1.00 . A A . 506 ASN HD22 1 1 6 3546 1 1 9 ASN N N -3.380 -3.433 -4.757 1.00 . A A . 506 ASN N 1 1 6 3547 1 1 9 ASN ND2 N -3.225 -7.897 -3.785 1.00 . A A . 506 ASN ND2 1 1 6 3548 1 1 9 ASN O O -4.612 -6.412 -6.219 1.00 . A A . 506 ASN O 1 1 6 3549 1 1 9 ASN OD1 O -1.241 -7.398 -4.697 1.00 . A A . 506 ASN OD1 1 1 6 3550 1 1 10 CYS C C -7.989 -4.757 -5.460 1.00 . A A . 507 CYS C 1 1 6 3551 1 1 10 CYS CA C -6.918 -5.706 -4.909 1.00 . A A . 507 CYS CA 1 1 6 3552 1 1 10 CYS CB C -7.368 -6.296 -3.572 1.00 . A A . 507 CYS CB 1 1 6 3553 1 1 10 CYS H H -5.554 -4.256 -4.180 1.00 . A A . 507 CYS H 1 1 6 3554 1 1 10 CYS HA H -6.786 -6.513 -5.614 1.00 . A A . 507 CYS HA 1 1 6 3555 1 1 10 CYS HB2 H -7.806 -5.514 -2.970 1.00 . A A . 507 CYS HB2 1 1 6 3556 1 1 10 CYS HB3 H -8.109 -7.061 -3.756 1.00 . A A . 507 CYS HB3 1 1 6 3557 1 1 10 CYS N N -5.628 -5.046 -4.755 1.00 . A A . 507 CYS N 1 1 6 3558 1 1 10 CYS O O -8.230 -4.729 -6.669 1.00 . A A . 507 CYS O 1 1 6 3559 1 1 10 CYS SG S -6.019 -7.050 -2.603 1.00 . A A . 507 CYS SG 1 1 6 3560 1 1 11 GLY C C -10.108 -2.070 -4.007 1.00 . A A . 508 GLY C 1 1 6 3561 1 1 11 GLY CA C -9.724 -3.134 -5.020 1.00 . A A . 508 GLY CA 1 1 6 3562 1 1 11 GLY H H -8.331 -3.967 -3.649 1.00 . A A . 508 GLY H 1 1 6 3563 1 1 11 GLY HA2 H -9.444 -2.647 -5.943 1.00 . A A . 508 GLY HA2 1 1 6 3564 1 1 11 GLY HA3 H -10.583 -3.762 -5.207 1.00 . A A . 508 GLY HA3 1 1 6 3565 1 1 11 GLY N N -8.619 -3.976 -4.586 1.00 . A A . 508 GLY N 1 1 6 3566 1 1 11 GLY O O -9.465 -1.938 -2.970 1.00 . A A . 508 GLY O 1 1 6 3567 1 1 12 ARG C C -11.907 -0.514 -2.035 1.00 . A A . 509 ARG C 1 1 6 3568 1 1 12 ARG CA C -11.642 -0.176 -3.505 1.00 . A A . 509 ARG CA 1 1 6 3569 1 1 12 ARG CB C -12.934 0.381 -4.098 1.00 . A A . 509 ARG CB 1 1 6 3570 1 1 12 ARG CD C -14.239 1.056 -6.116 1.00 . A A . 509 ARG CD 1 1 6 3571 1 1 12 ARG CG C -12.899 0.574 -5.603 1.00 . A A . 509 ARG CG 1 1 6 3572 1 1 12 ARG CZ C -15.611 2.978 -5.397 1.00 . A A . 509 ARG CZ 1 1 6 3573 1 1 12 ARG H H -11.626 -1.480 -5.175 1.00 . A A . 509 ARG H 1 1 6 3574 1 1 12 ARG HA H -10.888 0.594 -3.550 1.00 . A A . 509 ARG HA 1 1 6 3575 1 1 12 ARG HB2 H -13.743 -0.296 -3.864 1.00 . A A . 509 ARG HB2 1 1 6 3576 1 1 12 ARG HB3 H -13.139 1.339 -3.641 1.00 . A A . 509 ARG HB3 1 1 6 3577 1 1 12 ARG HD2 H -14.282 0.897 -7.182 1.00 . A A . 509 ARG HD2 1 1 6 3578 1 1 12 ARG HD3 H -15.014 0.479 -5.634 1.00 . A A . 509 ARG HD3 1 1 6 3579 1 1 12 ARG HE H -13.702 3.088 -6.009 1.00 . A A . 509 ARG HE 1 1 6 3580 1 1 12 ARG HG2 H -12.143 1.306 -5.848 1.00 . A A . 509 ARG HG2 1 1 6 3581 1 1 12 ARG HG3 H -12.659 -0.367 -6.077 1.00 . A A . 509 ARG HG3 1 1 6 3582 1 1 12 ARG HH11 H -16.536 1.180 -5.252 1.00 . A A . 509 ARG HH11 1 1 6 3583 1 1 12 ARG HH12 H -17.501 2.546 -4.778 1.00 . A A . 509 ARG HH12 1 1 6 3584 1 1 12 ARG HH21 H -14.968 4.907 -5.412 1.00 . A A . 509 ARG HH21 1 1 6 3585 1 1 12 ARG HH22 H -16.612 4.674 -4.893 1.00 . A A . 509 ARG HH22 1 1 6 3586 1 1 12 ARG N N -11.169 -1.318 -4.319 1.00 . A A . 509 ARG N 1 1 6 3587 1 1 12 ARG NE N -14.459 2.475 -5.836 1.00 . A A . 509 ARG NE 1 1 6 3588 1 1 12 ARG NH1 N -16.629 2.168 -5.125 1.00 . A A . 509 ARG NH1 1 1 6 3589 1 1 12 ARG NH2 N -15.740 4.289 -5.217 1.00 . A A . 509 ARG NH2 1 1 6 3590 1 1 12 ARG O O -12.155 0.379 -1.233 1.00 . A A . 509 ARG O 1 1 6 3591 1 1 13 GLU C C -10.974 -1.710 0.624 1.00 . A A . 510 GLU C 1 1 6 3592 1 1 13 GLU CA C -12.075 -2.241 -0.317 1.00 . A A . 510 GLU CA 1 1 6 3593 1 1 13 GLU CB C -12.152 -3.772 -0.270 1.00 . A A . 510 GLU CB 1 1 6 3594 1 1 13 GLU CD C -12.951 -5.800 1.007 1.00 . A A . 510 GLU CD 1 1 6 3595 1 1 13 GLU CG C -12.659 -4.319 1.057 1.00 . A A . 510 GLU CG 1 1 6 3596 1 1 13 GLU H H -11.781 -2.450 -2.413 1.00 . A A . 510 GLU H 1 1 6 3597 1 1 13 GLU HA H -13.017 -1.842 0.016 1.00 . A A . 510 GLU HA 1 1 6 3598 1 1 13 GLU HB2 H -12.816 -4.110 -1.051 1.00 . A A . 510 GLU HB2 1 1 6 3599 1 1 13 GLU HB3 H -11.166 -4.175 -0.448 1.00 . A A . 510 GLU HB3 1 1 6 3600 1 1 13 GLU HG2 H -11.911 -4.142 1.814 1.00 . A A . 510 GLU HG2 1 1 6 3601 1 1 13 GLU HG3 H -13.567 -3.797 1.322 1.00 . A A . 510 GLU HG3 1 1 6 3602 1 1 13 GLU N N -11.890 -1.790 -1.701 1.00 . A A . 510 GLU N 1 1 6 3603 1 1 13 GLU O O -10.988 -1.989 1.824 1.00 . A A . 510 GLU O 1 1 6 3604 1 1 13 GLU OE1 O -14.100 -6.169 0.676 1.00 . A A . 510 GLU OE1 1 1 6 3605 1 1 13 GLU OE2 O -12.044 -6.603 1.308 1.00 . A A . 510 GLU OE2 1 1 6 3606 1 1 14 ALA C C -9.296 0.213 2.147 1.00 . A A . 511 ALA C 1 1 6 3607 1 1 14 ALA CA C -8.893 -0.403 0.806 1.00 . A A . 511 ALA CA 1 1 6 3608 1 1 14 ALA CB C -8.190 0.643 -0.042 1.00 . A A . 511 ALA CB 1 1 6 3609 1 1 14 ALA H H -10.116 -0.736 -0.883 1.00 . A A . 511 ALA H 1 1 6 3610 1 1 14 ALA HA H -8.195 -1.206 0.988 1.00 . A A . 511 ALA HA 1 1 6 3611 1 1 14 ALA HB1 H -7.918 0.212 -0.994 1.00 . A A . 511 ALA HB1 1 1 6 3612 1 1 14 ALA HB2 H -8.850 1.482 -0.202 1.00 . A A . 511 ALA HB2 1 1 6 3613 1 1 14 ALA HB3 H -7.295 0.981 0.468 1.00 . A A . 511 ALA HB3 1 1 6 3614 1 1 14 ALA N N -10.028 -0.956 0.064 1.00 . A A . 511 ALA N 1 1 6 3615 1 1 14 ALA O O -9.996 1.225 2.201 1.00 . A A . 511 ALA O 1 1 6 3616 1 1 15 MET C C -7.824 0.378 5.326 1.00 . A A . 512 MET C 1 1 6 3617 1 1 15 MET CA C -9.118 0.086 4.565 1.00 . A A . 512 MET CA 1 1 6 3618 1 1 15 MET CB C -9.956 -0.941 5.335 1.00 . A A . 512 MET CB 1 1 6 3619 1 1 15 MET CE C -10.165 -2.979 7.792 1.00 . A A . 512 MET CE 1 1 6 3620 1 1 15 MET CG C -10.437 -0.446 6.695 1.00 . A A . 512 MET CG 1 1 6 3621 1 1 15 MET H H -8.315 -1.219 3.120 1.00 . A A . 512 MET H 1 1 6 3622 1 1 15 MET HA H -9.682 1.004 4.484 1.00 . A A . 512 MET HA 1 1 6 3623 1 1 15 MET HB2 H -10.821 -1.195 4.741 1.00 . A A . 512 MET HB2 1 1 6 3624 1 1 15 MET HB3 H -9.363 -1.830 5.488 1.00 . A A . 512 MET HB3 1 1 6 3625 1 1 15 MET HE1 H -9.326 -2.600 8.358 1.00 . A A . 512 MET HE1 1 1 6 3626 1 1 15 MET HE2 H -10.604 -3.816 8.316 1.00 . A A . 512 MET HE2 1 1 6 3627 1 1 15 MET HE3 H -9.827 -3.301 6.819 1.00 . A A . 512 MET HE3 1 1 6 3628 1 1 15 MET HG2 H -9.578 -0.172 7.287 1.00 . A A . 512 MET HG2 1 1 6 3629 1 1 15 MET HG3 H -11.059 0.425 6.544 1.00 . A A . 512 MET HG3 1 1 6 3630 1 1 15 MET N N -8.837 -0.404 3.227 1.00 . A A . 512 MET N 1 1 6 3631 1 1 15 MET O O -7.832 1.125 6.307 1.00 . A A . 512 MET O 1 1 6 3632 1 1 15 MET SD S -11.389 -1.685 7.599 1.00 . A A . 512 MET SD 1 1 6 3633 1 1 16 SER C C -4.364 0.554 4.683 1.00 . A A . 513 SER C 1 1 6 3634 1 1 16 SER CA C -5.450 -0.020 5.597 1.00 . A A . 513 SER CA 1 1 6 3635 1 1 16 SER CB C -4.997 -1.337 6.231 1.00 . A A . 513 SER CB 1 1 6 3636 1 1 16 SER H H -6.733 -0.737 4.065 1.00 . A A . 513 SER H 1 1 6 3637 1 1 16 SER HA H -5.643 0.710 6.366 1.00 . A A . 513 SER HA 1 1 6 3638 1 1 16 SER HB2 H -4.736 -2.036 5.452 1.00 . A A . 513 SER HB2 1 1 6 3639 1 1 16 SER HB3 H -4.137 -1.156 6.857 1.00 . A A . 513 SER HB3 1 1 6 3640 1 1 16 SER HG H -6.351 -2.710 6.609 1.00 . A A . 513 SER HG 1 1 6 3641 1 1 16 SER N N -6.712 -0.206 4.887 1.00 . A A . 513 SER N 1 1 6 3642 1 1 16 SER O O -4.308 0.260 3.492 1.00 . A A . 513 SER O 1 1 6 3643 1 1 16 SER OG O -6.030 -1.902 7.025 1.00 . A A . 513 SER OG 1 1 6 3644 1 1 17 GLU C C -1.079 1.533 4.922 1.00 . A A . 514 GLU C 1 1 6 3645 1 1 17 GLU CA C -2.457 2.063 4.526 1.00 . A A . 514 GLU CA 1 1 6 3646 1 1 17 GLU CB C -2.537 3.564 4.812 1.00 . A A . 514 GLU CB 1 1 6 3647 1 1 17 GLU CD C -2.462 5.375 6.569 1.00 . A A . 514 GLU CD 1 1 6 3648 1 1 17 GLU CG C -2.139 3.939 6.228 1.00 . A A . 514 GLU CG 1 1 6 3649 1 1 17 GLU H H -3.560 1.507 6.241 1.00 . A A . 514 GLU H 1 1 6 3650 1 1 17 GLU HA H -2.618 1.899 3.467 1.00 . A A . 514 GLU HA 1 1 6 3651 1 1 17 GLU HB2 H -1.883 4.084 4.129 1.00 . A A . 514 GLU HB2 1 1 6 3652 1 1 17 GLU HB3 H -3.551 3.896 4.647 1.00 . A A . 514 GLU HB3 1 1 6 3653 1 1 17 GLU HG2 H -2.665 3.295 6.917 1.00 . A A . 514 GLU HG2 1 1 6 3654 1 1 17 GLU HG3 H -1.074 3.787 6.341 1.00 . A A . 514 GLU HG3 1 1 6 3655 1 1 17 GLU N N -3.500 1.367 5.266 1.00 . A A . 514 GLU N 1 1 6 3656 1 1 17 GLU O O -0.940 0.811 5.915 1.00 . A A . 514 GLU O 1 1 6 3657 1 1 17 GLU OE1 O -2.238 6.267 5.720 1.00 . A A . 514 GLU OE1 1 1 6 3658 1 1 17 GLU OE2 O -2.955 5.619 7.689 1.00 . A A . 514 GLU OE2 1 1 6 3659 1 1 18 CYS C C 1.826 2.549 5.484 1.00 . A A . 515 CYS C 1 1 6 3660 1 1 18 CYS CA C 1.302 1.563 4.455 1.00 . A A . 515 CYS CA 1 1 6 3661 1 1 18 CYS CB C 2.197 1.597 3.208 1.00 . A A . 515 CYS CB 1 1 6 3662 1 1 18 CYS H H -0.265 2.361 3.300 1.00 . A A . 515 CYS H 1 1 6 3663 1 1 18 CYS HA H 1.352 0.591 4.920 1.00 . A A . 515 CYS HA 1 1 6 3664 1 1 18 CYS HB2 H 2.120 0.652 2.690 1.00 . A A . 515 CYS HB2 1 1 6 3665 1 1 18 CYS HB3 H 1.862 2.390 2.555 1.00 . A A . 515 CYS HB3 1 1 6 3666 1 1 18 CYS N N -0.077 1.869 4.123 1.00 . A A . 515 CYS N 1 1 6 3667 1 1 18 CYS O O 1.729 3.762 5.316 1.00 . A A . 515 CYS O 1 1 6 3668 1 1 18 CYS SG S 3.962 1.888 3.584 1.00 . A A . 515 CYS SG 1 1 6 3669 1 1 19 THR C C 4.509 2.952 6.989 1.00 . A A . 516 THR C 1 1 6 3670 1 1 19 THR CA C 3.094 2.788 7.533 1.00 . A A . 516 THR CA 1 1 6 3671 1 1 19 THR CB C 3.131 2.098 8.907 1.00 . A A . 516 THR CB 1 1 6 3672 1 1 19 THR CG2 C 3.705 3.026 9.968 1.00 . A A . 516 THR CG2 1 1 6 3673 1 1 19 THR H H 2.189 1.069 6.774 1.00 . A A . 516 THR H 1 1 6 3674 1 1 19 THR HA H 2.632 3.758 7.638 1.00 . A A . 516 THR HA 1 1 6 3675 1 1 19 THR HB H 3.758 1.219 8.838 1.00 . A A . 516 THR HB 1 1 6 3676 1 1 19 THR HG1 H 1.164 2.222 8.786 1.00 . A A . 516 THR HG1 1 1 6 3677 1 1 19 THR HG21 H 3.082 3.904 10.052 1.00 . A A . 516 THR HG21 1 1 6 3678 1 1 19 THR HG22 H 3.734 2.513 10.917 1.00 . A A . 516 THR HG22 1 1 6 3679 1 1 19 THR HG23 H 4.705 3.320 9.686 1.00 . A A . 516 THR HG23 1 1 6 3680 1 1 19 THR N N 2.327 2.012 6.589 1.00 . A A . 516 THR N 1 1 6 3681 1 1 19 THR O O 5.217 1.967 6.769 1.00 . A A . 516 THR O 1 1 6 3682 1 1 19 THR OG1 O 1.804 1.701 9.283 1.00 . A A . 516 THR OG1 1 1 6 3683 1 1 20 GLY C C 6.006 5.453 5.008 1.00 . A A . 517 GLY C 1 1 6 3684 1 1 20 GLY CA C 6.173 4.440 6.113 1.00 . A A . 517 GLY CA 1 1 6 3685 1 1 20 GLY H H 4.399 4.929 7.161 1.00 . A A . 517 GLY H 1 1 6 3686 1 1 20 GLY HA2 H 6.891 4.812 6.829 1.00 . A A . 517 GLY HA2 1 1 6 3687 1 1 20 GLY HA3 H 6.539 3.516 5.693 1.00 . A A . 517 GLY HA3 1 1 6 3688 1 1 20 GLY N N 4.921 4.186 6.792 1.00 . A A . 517 GLY N 1 1 6 3689 1 1 20 GLY O O 6.771 6.414 4.920 1.00 . A A . 517 GLY O 1 1 6 3690 1 1 21 CYS C C 3.150 6.293 3.022 1.00 . A A . 518 CYS C 1 1 6 3691 1 1 21 CYS CA C 4.660 6.234 3.159 1.00 . A A . 518 CYS CA 1 1 6 3692 1 1 21 CYS CB C 5.296 5.902 1.808 1.00 . A A . 518 CYS CB 1 1 6 3693 1 1 21 CYS H H 4.475 4.418 4.227 1.00 . A A . 518 CYS H 1 1 6 3694 1 1 21 CYS HA H 5.019 7.182 3.521 1.00 . A A . 518 CYS HA 1 1 6 3695 1 1 21 CYS HB2 H 5.272 6.781 1.180 1.00 . A A . 518 CYS HB2 1 1 6 3696 1 1 21 CYS HB3 H 6.323 5.604 1.960 1.00 . A A . 518 CYS HB3 1 1 6 3697 1 1 21 CYS N N 5.004 5.247 4.164 1.00 . A A . 518 CYS N 1 1 6 3698 1 1 21 CYS O O 2.466 5.301 3.241 1.00 . A A . 518 CYS O 1 1 6 3699 1 1 21 CYS SG S 4.453 4.559 0.914 1.00 . A A . 518 CYS SG 1 1 6 3700 1 1 22 HIS C C 0.849 7.989 1.095 1.00 . A A . 519 HIS C 1 1 6 3701 1 1 22 HIS CA C 1.186 7.588 2.515 1.00 . A A . 519 HIS CA 1 1 6 3702 1 1 22 HIS CB C 0.625 8.609 3.510 1.00 . A A . 519 HIS CB 1 1 6 3703 1 1 22 HIS CD2 C 2.052 8.523 5.657 1.00 . A A . 519 HIS CD2 1 1 6 3704 1 1 22 HIS CE1 C 0.639 7.468 6.956 1.00 . A A . 519 HIS CE1 1 1 6 3705 1 1 22 HIS CG C 0.940 8.280 4.932 1.00 . A A . 519 HIS CG 1 1 6 3706 1 1 22 HIS H H 3.214 8.217 2.488 1.00 . A A . 519 HIS H 1 1 6 3707 1 1 22 HIS HA H 0.742 6.624 2.714 1.00 . A A . 519 HIS HA 1 1 6 3708 1 1 22 HIS HB2 H 1.043 9.581 3.293 1.00 . A A . 519 HIS HB2 1 1 6 3709 1 1 22 HIS HB3 H -0.449 8.651 3.406 1.00 . A A . 519 HIS HB3 1 1 6 3710 1 1 22 HIS HD1 H -0.832 7.280 5.533 1.00 . A A . 519 HIS HD1 1 1 6 3711 1 1 22 HIS HD2 H 2.945 9.025 5.310 1.00 . A A . 519 HIS HD2 1 1 6 3712 1 1 22 HIS HE1 H 0.195 6.991 7.816 1.00 . A A . 519 HIS HE1 1 1 6 3713 1 1 22 HIS HE2 H 2.541 7.888 7.595 1.00 . A A . 519 HIS HE2 1 1 6 3714 1 1 22 HIS N N 2.625 7.447 2.665 1.00 . A A . 519 HIS N 1 1 6 3715 1 1 22 HIS ND1 N 0.072 7.616 5.772 1.00 . A A . 519 HIS ND1 1 1 6 3716 1 1 22 HIS NE2 N 1.843 8.009 6.910 1.00 . A A . 519 HIS NE2 1 1 6 3717 1 1 22 HIS O O -0.113 8.717 0.853 1.00 . A A . 519 HIS O 1 1 6 3718 1 1 23 LYS C C 0.504 6.740 -1.845 1.00 . A A . 520 LYS C 1 1 6 3719 1 1 23 LYS CA C 1.416 7.804 -1.249 1.00 . A A . 520 LYS CA 1 1 6 3720 1 1 23 LYS CB C 2.736 7.855 -2.030 1.00 . A A . 520 LYS CB 1 1 6 3721 1 1 23 LYS CD C 4.818 6.614 -2.758 1.00 . A A . 520 LYS CD 1 1 6 3722 1 1 23 LYS CE C 5.688 7.847 -2.574 1.00 . A A . 520 LYS CE 1 1 6 3723 1 1 23 LYS CG C 3.611 6.622 -1.830 1.00 . A A . 520 LYS CG 1 1 6 3724 1 1 23 LYS H H 2.480 7.044 0.395 1.00 . A A . 520 LYS H 1 1 6 3725 1 1 23 LYS HA H 0.926 8.765 -1.322 1.00 . A A . 520 LYS HA 1 1 6 3726 1 1 23 LYS HB2 H 2.513 7.945 -3.084 1.00 . A A . 520 LYS HB2 1 1 6 3727 1 1 23 LYS HB3 H 3.295 8.723 -1.714 1.00 . A A . 520 LYS HB3 1 1 6 3728 1 1 23 LYS HD2 H 5.413 5.736 -2.547 1.00 . A A . 520 LYS HD2 1 1 6 3729 1 1 23 LYS HD3 H 4.471 6.576 -3.781 1.00 . A A . 520 LYS HD3 1 1 6 3730 1 1 23 LYS HE2 H 5.086 8.726 -2.747 1.00 . A A . 520 LYS HE2 1 1 6 3731 1 1 23 LYS HE3 H 6.062 7.860 -1.561 1.00 . A A . 520 LYS HE3 1 1 6 3732 1 1 23 LYS HG2 H 3.960 6.607 -0.809 1.00 . A A . 520 LYS HG2 1 1 6 3733 1 1 23 LYS HG3 H 3.018 5.740 -2.020 1.00 . A A . 520 LYS HG3 1 1 6 3734 1 1 23 LYS HZ1 H 6.505 7.685 -4.492 1.00 . A A . 520 LYS HZ1 1 1 6 3735 1 1 23 LYS HZ2 H 7.316 8.785 -3.486 1.00 . A A . 520 LYS HZ2 1 1 6 3736 1 1 23 LYS HZ3 H 7.524 7.120 -3.260 1.00 . A A . 520 LYS HZ3 1 1 6 3737 1 1 23 LYS N N 1.666 7.539 0.154 1.00 . A A . 520 LYS N 1 1 6 3738 1 1 23 LYS NZ N 6.838 7.856 -3.517 1.00 . A A . 520 LYS NZ 1 1 6 3739 1 1 23 LYS O O -0.268 7.018 -2.765 1.00 . A A . 520 LYS O 1 1 6 3740 1 1 24 VAL C C -1.087 3.840 -0.742 1.00 . A A . 521 VAL C 1 1 6 3741 1 1 24 VAL CA C -0.205 4.415 -1.839 1.00 . A A . 521 VAL CA 1 1 6 3742 1 1 24 VAL CB C 0.689 3.288 -2.405 1.00 . A A . 521 VAL CB 1 1 6 3743 1 1 24 VAL CG1 C 1.554 3.804 -3.544 1.00 . A A . 521 VAL CG1 1 1 6 3744 1 1 24 VAL CG2 C 1.549 2.677 -1.308 1.00 . A A . 521 VAL CG2 1 1 6 3745 1 1 24 VAL H H 1.138 5.362 -0.527 1.00 . A A . 521 VAL H 1 1 6 3746 1 1 24 VAL HA H -0.831 4.790 -2.637 1.00 . A A . 521 VAL HA 1 1 6 3747 1 1 24 VAL HB H 0.046 2.514 -2.800 1.00 . A A . 521 VAL HB 1 1 6 3748 1 1 24 VAL HG11 H 2.173 4.616 -3.189 1.00 . A A . 521 VAL HG11 1 1 6 3749 1 1 24 VAL HG12 H 2.181 3.005 -3.910 1.00 . A A . 521 VAL HG12 1 1 6 3750 1 1 24 VAL HG13 H 0.920 4.158 -4.342 1.00 . A A . 521 VAL HG13 1 1 6 3751 1 1 24 VAL HG21 H 0.913 2.289 -0.526 1.00 . A A . 521 VAL HG21 1 1 6 3752 1 1 24 VAL HG22 H 2.141 1.871 -1.720 1.00 . A A . 521 VAL HG22 1 1 6 3753 1 1 24 VAL HG23 H 2.205 3.430 -0.897 1.00 . A A . 521 VAL HG23 1 1 6 3754 1 1 24 VAL N N 0.576 5.522 -1.317 1.00 . A A . 521 VAL N 1 1 6 3755 1 1 24 VAL O O -0.816 4.026 0.444 1.00 . A A . 521 VAL O 1 1 6 3756 1 1 25 ASN C C -3.319 1.095 -0.501 1.00 . A A . 522 ASN C 1 1 6 3757 1 1 25 ASN CA C -3.060 2.562 -0.183 1.00 . A A . 522 ASN CA 1 1 6 3758 1 1 25 ASN CB C -4.382 3.341 -0.133 1.00 . A A . 522 ASN CB 1 1 6 3759 1 1 25 ASN CG C -4.652 4.146 -1.389 1.00 . A A . 522 ASN CG 1 1 6 3760 1 1 25 ASN H H -2.293 3.019 -2.101 1.00 . A A . 522 ASN H 1 1 6 3761 1 1 25 ASN HA H -2.593 2.622 0.788 1.00 . A A . 522 ASN HA 1 1 6 3762 1 1 25 ASN HB2 H -5.195 2.644 0.000 1.00 . A A . 522 ASN HB2 1 1 6 3763 1 1 25 ASN HB3 H -4.359 4.019 0.707 1.00 . A A . 522 ASN HB3 1 1 6 3764 1 1 25 ASN HD21 H -5.448 2.552 -2.264 1.00 . A A . 522 ASN HD21 1 1 6 3765 1 1 25 ASN HD22 H -5.430 4.008 -3.207 1.00 . A A . 522 ASN HD22 1 1 6 3766 1 1 25 ASN N N -2.137 3.150 -1.139 1.00 . A A . 522 ASN N 1 1 6 3767 1 1 25 ASN ND2 N -5.232 3.507 -2.383 1.00 . A A . 522 ASN ND2 1 1 6 3768 1 1 25 ASN O O -3.287 0.671 -1.659 1.00 . A A . 522 ASN O 1 1 6 3769 1 1 25 ASN OD1 O -4.323 5.332 -1.468 1.00 . A A . 522 ASN OD1 1 1 6 3770 1 1 26 TYR C C -5.173 -1.407 1.062 1.00 . A A . 523 TYR C 1 1 6 3771 1 1 26 TYR CA C -3.826 -1.097 0.437 1.00 . A A . 523 TYR CA 1 1 6 3772 1 1 26 TYR CB C -2.737 -1.902 1.154 1.00 . A A . 523 TYR CB 1 1 6 3773 1 1 26 TYR CD1 C -0.827 -2.482 -0.393 1.00 . A A . 523 TYR CD1 1 1 6 3774 1 1 26 TYR CD2 C -0.519 -0.699 1.157 1.00 . A A . 523 TYR CD2 1 1 6 3775 1 1 26 TYR CE1 C 0.460 -2.302 -0.862 1.00 . A A . 523 TYR CE1 1 1 6 3776 1 1 26 TYR CE2 C 0.765 -0.510 0.687 1.00 . A A . 523 TYR CE2 1 1 6 3777 1 1 26 TYR CG C -1.337 -1.686 0.625 1.00 . A A . 523 TYR CG 1 1 6 3778 1 1 26 TYR CZ C 1.251 -1.316 -0.318 1.00 . A A . 523 TYR CZ 1 1 6 3779 1 1 26 TYR H H -3.649 0.763 1.428 1.00 . A A . 523 TYR H 1 1 6 3780 1 1 26 TYR HA H -3.846 -1.360 -0.612 1.00 . A A . 523 TYR HA 1 1 6 3781 1 1 26 TYR HB2 H -2.735 -1.632 2.201 1.00 . A A . 523 TYR HB2 1 1 6 3782 1 1 26 TYR HB3 H -2.966 -2.953 1.064 1.00 . A A . 523 TYR HB3 1 1 6 3783 1 1 26 TYR HD1 H -1.450 -3.255 -0.817 1.00 . A A . 523 TYR HD1 1 1 6 3784 1 1 26 TYR HD2 H -0.901 -0.068 1.945 1.00 . A A . 523 TYR HD2 1 1 6 3785 1 1 26 TYR HE1 H 0.838 -2.929 -1.656 1.00 . A A . 523 TYR HE1 1 1 6 3786 1 1 26 TYR HE2 H 1.387 0.262 1.115 1.00 . A A . 523 TYR HE2 1 1 6 3787 1 1 26 TYR HH H 2.592 -1.371 -1.711 1.00 . A A . 523 TYR HH 1 1 6 3788 1 1 26 TYR N N -3.574 0.332 0.549 1.00 . A A . 523 TYR N 1 1 6 3789 1 1 26 TYR O O -5.902 -0.494 1.443 1.00 . A A . 523 TYR O 1 1 6 3790 1 1 26 TYR OH O 2.536 -1.136 -0.771 1.00 . A A . 523 TYR OH 1 1 6 3791 1 1 27 CYS C C -6.509 -3.903 3.049 1.00 . A A . 524 CYS C 1 1 6 3792 1 1 27 CYS CA C -6.764 -3.031 1.830 1.00 . A A . 524 CYS CA 1 1 6 3793 1 1 27 CYS CB C -7.737 -3.705 0.847 1.00 . A A . 524 CYS CB 1 1 6 3794 1 1 27 CYS H H -4.879 -3.380 0.917 1.00 . A A . 524 CYS H 1 1 6 3795 1 1 27 CYS HA H -7.207 -2.111 2.170 1.00 . A A . 524 CYS HA 1 1 6 3796 1 1 27 CYS HB2 H -8.735 -3.643 1.254 1.00 . A A . 524 CYS HB2 1 1 6 3797 1 1 27 CYS HB3 H -7.710 -3.165 -0.088 1.00 . A A . 524 CYS HB3 1 1 6 3798 1 1 27 CYS N N -5.505 -2.678 1.198 1.00 . A A . 524 CYS N 1 1 6 3799 1 1 27 CYS O O -7.363 -4.036 3.925 1.00 . A A . 524 CYS O 1 1 6 3800 1 1 27 CYS SG S -7.415 -5.460 0.477 1.00 . A A . 524 CYS SG 1 1 6 3801 1 1 28 SER C C -3.397 -5.271 4.354 1.00 . A A . 525 SER C 1 1 6 3802 1 1 28 SER CA C -4.914 -5.305 4.226 1.00 . A A . 525 SER CA 1 1 6 3803 1 1 28 SER CB C -5.403 -6.739 4.015 1.00 . A A . 525 SER CB 1 1 6 3804 1 1 28 SER H H -4.662 -4.322 2.399 1.00 . A A . 525 SER H 1 1 6 3805 1 1 28 SER HA H -5.354 -4.905 5.127 1.00 . A A . 525 SER HA 1 1 6 3806 1 1 28 SER HB2 H -5.068 -7.094 3.052 1.00 . A A . 525 SER HB2 1 1 6 3807 1 1 28 SER HB3 H -4.999 -7.372 4.792 1.00 . A A . 525 SER HB3 1 1 6 3808 1 1 28 SER HG H -7.193 -5.933 3.876 1.00 . A A . 525 SER HG 1 1 6 3809 1 1 28 SER N N -5.314 -4.471 3.116 1.00 . A A . 525 SER N 1 1 6 3810 1 1 28 SER O O -2.701 -4.846 3.429 1.00 . A A . 525 SER O 1 1 6 3811 1 1 28 SER OG O -6.822 -6.811 4.059 1.00 . A A . 525 SER OG 1 1 6 3812 1 1 29 THR C C -0.775 -6.762 4.813 1.00 . A A . 526 THR C 1 1 6 3813 1 1 29 THR CA C -1.451 -5.725 5.717 1.00 . A A . 526 THR CA 1 1 6 3814 1 1 29 THR CB C -1.132 -6.012 7.197 1.00 . A A . 526 THR CB 1 1 6 3815 1 1 29 THR CG2 C 0.361 -5.924 7.473 1.00 . A A . 526 THR CG2 1 1 6 3816 1 1 29 THR H H -3.489 -5.999 6.217 1.00 . A A . 526 THR H 1 1 6 3817 1 1 29 THR HA H -1.065 -4.746 5.472 1.00 . A A . 526 THR HA 1 1 6 3818 1 1 29 THR HB H -1.471 -7.009 7.438 1.00 . A A . 526 THR HB 1 1 6 3819 1 1 29 THR HG1 H -1.778 -4.188 7.616 1.00 . A A . 526 THR HG1 1 1 6 3820 1 1 29 THR HG21 H 0.713 -4.929 7.243 1.00 . A A . 526 THR HG21 1 1 6 3821 1 1 29 THR HG22 H 0.550 -6.141 8.515 1.00 . A A . 526 THR HG22 1 1 6 3822 1 1 29 THR HG23 H 0.884 -6.639 6.856 1.00 . A A . 526 THR HG23 1 1 6 3823 1 1 29 THR N N -2.886 -5.703 5.495 1.00 . A A . 526 THR N 1 1 6 3824 1 1 29 THR O O 0.405 -6.633 4.480 1.00 . A A . 526 THR O 1 1 6 3825 1 1 29 THR OG1 O -1.824 -5.067 8.025 1.00 . A A . 526 THR OG1 1 1 6 3826 1 1 30 PHE C C -0.561 -8.210 2.177 1.00 . A A . 527 PHE C 1 1 6 3827 1 1 30 PHE CA C -1.008 -8.804 3.511 1.00 . A A . 527 PHE CA 1 1 6 3828 1 1 30 PHE CB C -2.059 -9.893 3.272 1.00 . A A . 527 PHE CB 1 1 6 3829 1 1 30 PHE CD1 C -0.838 -11.966 2.539 1.00 . A A . 527 PHE CD1 1 1 6 3830 1 1 30 PHE CD2 C -2.080 -10.746 0.911 1.00 . A A . 527 PHE CD2 1 1 6 3831 1 1 30 PHE CE1 C -0.454 -12.872 1.568 1.00 . A A . 527 PHE CE1 1 1 6 3832 1 1 30 PHE CE2 C -1.696 -11.644 -0.063 1.00 . A A . 527 PHE CE2 1 1 6 3833 1 1 30 PHE CG C -1.655 -10.892 2.222 1.00 . A A . 527 PHE CG 1 1 6 3834 1 1 30 PHE CZ C -0.883 -12.710 0.265 1.00 . A A . 527 PHE CZ 1 1 6 3835 1 1 30 PHE H H -2.460 -7.841 4.711 1.00 . A A . 527 PHE H 1 1 6 3836 1 1 30 PHE HA H -0.150 -9.248 3.995 1.00 . A A . 527 PHE HA 1 1 6 3837 1 1 30 PHE HB2 H -2.228 -10.429 4.194 1.00 . A A . 527 PHE HB2 1 1 6 3838 1 1 30 PHE HB3 H -2.983 -9.430 2.955 1.00 . A A . 527 PHE HB3 1 1 6 3839 1 1 30 PHE HD1 H -2.716 -9.911 0.651 1.00 . A A . 527 PHE HD1 1 1 6 3840 1 1 30 PHE HD2 H -0.505 -12.096 3.559 1.00 . A A . 527 PHE HD2 1 1 6 3841 1 1 30 PHE HE1 H -2.036 -11.512 -1.079 1.00 . A A . 527 PHE HE1 1 1 6 3842 1 1 30 PHE HE2 H 0.184 -13.704 1.826 1.00 . A A . 527 PHE HE2 1 1 6 3843 1 1 30 PHE HZ H -0.582 -13.413 -0.497 1.00 . A A . 527 PHE HZ 1 1 6 3844 1 1 30 PHE N N -1.533 -7.775 4.398 1.00 . A A . 527 PHE N 1 1 6 3845 1 1 30 PHE O O 0.559 -8.462 1.731 1.00 . A A . 527 PHE O 1 1 6 3846 1 1 31 CYS C C 0.111 -5.908 0.397 1.00 . A A . 528 CYS C 1 1 6 3847 1 1 31 CYS CA C -1.108 -6.803 0.266 1.00 . A A . 528 CYS CA 1 1 6 3848 1 1 31 CYS CB C -2.293 -5.992 -0.240 1.00 . A A . 528 CYS CB 1 1 6 3849 1 1 31 CYS H H -2.293 -7.219 1.965 1.00 . A A . 528 CYS H 1 1 6 3850 1 1 31 CYS HA H -0.886 -7.608 -0.417 1.00 . A A . 528 CYS HA 1 1 6 3851 1 1 31 CYS HB2 H -2.160 -4.957 0.042 1.00 . A A . 528 CYS HB2 1 1 6 3852 1 1 31 CYS HB3 H -2.339 -6.066 -1.317 1.00 . A A . 528 CYS HB3 1 1 6 3853 1 1 31 CYS N N -1.422 -7.405 1.555 1.00 . A A . 528 CYS N 1 1 6 3854 1 1 31 CYS O O 0.942 -5.830 -0.502 1.00 . A A . 528 CYS O 1 1 6 3855 1 1 31 CYS SG S -3.888 -6.548 0.423 1.00 . A A . 528 CYS SG 1 1 6 3856 1 1 32 GLN C C 2.614 -5.139 1.867 1.00 . A A . 529 GLN C 1 1 6 3857 1 1 32 GLN CA C 1.305 -4.358 1.835 1.00 . A A . 529 GLN CA 1 1 6 3858 1 1 32 GLN CB C 1.020 -3.617 3.165 1.00 . A A . 529 GLN CB 1 1 6 3859 1 1 32 GLN CD C 3.439 -3.230 3.989 1.00 . A A . 529 GLN CD 1 1 6 3860 1 1 32 GLN CG C 2.051 -3.783 4.295 1.00 . A A . 529 GLN CG 1 1 6 3861 1 1 32 GLN H H -0.476 -5.409 2.232 1.00 . A A . 529 GLN H 1 1 6 3862 1 1 32 GLN HA H 1.365 -3.629 1.040 1.00 . A A . 529 GLN HA 1 1 6 3863 1 1 32 GLN HB2 H 0.924 -2.564 2.956 1.00 . A A . 529 GLN HB2 1 1 6 3864 1 1 32 GLN HB3 H 0.070 -3.973 3.537 1.00 . A A . 529 GLN HB3 1 1 6 3865 1 1 32 GLN HE21 H 2.690 -1.845 2.784 1.00 . A A . 529 GLN HE21 1 1 6 3866 1 1 32 GLN HE22 H 4.406 -1.861 2.941 1.00 . A A . 529 GLN HE22 1 1 6 3867 1 1 32 GLN HG2 H 1.676 -3.275 5.170 1.00 . A A . 529 GLN HG2 1 1 6 3868 1 1 32 GLN HG3 H 2.144 -4.838 4.515 1.00 . A A . 529 GLN HG3 1 1 6 3869 1 1 32 GLN N N 0.206 -5.258 1.546 1.00 . A A . 529 GLN N 1 1 6 3870 1 1 32 GLN NE2 N 3.517 -2.206 3.159 1.00 . A A . 529 GLN NE2 1 1 6 3871 1 1 32 GLN O O 3.591 -4.756 1.225 1.00 . A A . 529 GLN O 1 1 6 3872 1 1 32 GLN OE1 O 4.440 -3.730 4.505 1.00 . A A . 529 GLN OE1 1 1 6 3873 1 1 33 ARG C C 4.156 -7.775 1.440 1.00 . A A . 530 ARG C 1 1 6 3874 1 1 33 ARG CA C 3.829 -7.036 2.739 1.00 . A A . 530 ARG CA 1 1 6 3875 1 1 33 ARG CB C 3.697 -8.006 3.910 1.00 . A A . 530 ARG CB 1 1 6 3876 1 1 33 ARG CD C 3.346 -8.293 6.381 1.00 . A A . 530 ARG CD 1 1 6 3877 1 1 33 ARG CG C 3.465 -7.305 5.238 1.00 . A A . 530 ARG CG 1 1 6 3878 1 1 33 ARG CZ C 4.793 -10.179 7.051 1.00 . A A . 530 ARG CZ 1 1 6 3879 1 1 33 ARG H H 1.793 -6.520 3.049 1.00 . A A . 530 ARG H 1 1 6 3880 1 1 33 ARG HA H 4.624 -6.336 2.947 1.00 . A A . 530 ARG HA 1 1 6 3881 1 1 33 ARG HB2 H 2.863 -8.667 3.723 1.00 . A A . 530 ARG HB2 1 1 6 3882 1 1 33 ARG HB3 H 4.603 -8.590 3.988 1.00 . A A . 530 ARG HB3 1 1 6 3883 1 1 33 ARG HD2 H 2.955 -7.779 7.244 1.00 . A A . 530 ARG HD2 1 1 6 3884 1 1 33 ARG HD3 H 2.663 -9.075 6.087 1.00 . A A . 530 ARG HD3 1 1 6 3885 1 1 33 ARG HE H 5.424 -8.299 6.731 1.00 . A A . 530 ARG HE 1 1 6 3886 1 1 33 ARG HG2 H 4.295 -6.643 5.433 1.00 . A A . 530 ARG HG2 1 1 6 3887 1 1 33 ARG HG3 H 2.552 -6.731 5.175 1.00 . A A . 530 ARG HG3 1 1 6 3888 1 1 33 ARG HH11 H 2.825 -10.654 6.876 1.00 . A A . 530 ARG HH11 1 1 6 3889 1 1 33 ARG HH12 H 3.871 -11.967 7.320 1.00 . A A . 530 ARG HH12 1 1 6 3890 1 1 33 ARG HH21 H 6.796 -10.019 7.358 1.00 . A A . 530 ARG HH21 1 1 6 3891 1 1 33 ARG HH22 H 6.128 -11.611 7.589 1.00 . A A . 530 ARG HH22 1 1 6 3892 1 1 33 ARG N N 2.621 -6.241 2.597 1.00 . A A . 530 ARG N 1 1 6 3893 1 1 33 ARG NE N 4.631 -8.895 6.729 1.00 . A A . 530 ARG NE 1 1 6 3894 1 1 33 ARG NH1 N 3.746 -11.000 7.086 1.00 . A A . 530 ARG NH1 1 1 6 3895 1 1 33 ARG NH2 N 6.001 -10.638 7.361 1.00 . A A . 530 ARG NH2 1 1 6 3896 1 1 33 ARG O O 5.315 -8.048 1.141 1.00 . A A . 530 ARG O 1 1 6 3897 1 1 34 LYS C C 3.877 -7.785 -1.633 1.00 . A A . 531 LYS C 1 1 6 3898 1 1 34 LYS CA C 3.288 -8.765 -0.613 1.00 . A A . 531 LYS CA 1 1 6 3899 1 1 34 LYS CB C 1.931 -9.311 -1.085 1.00 . A A . 531 LYS CB 1 1 6 3900 1 1 34 LYS CD C 2.305 -9.754 -3.547 1.00 . A A . 531 LYS CD 1 1 6 3901 1 1 34 LYS CE C 2.315 -10.805 -4.645 1.00 . A A . 531 LYS CE 1 1 6 3902 1 1 34 LYS CG C 2.005 -10.363 -2.187 1.00 . A A . 531 LYS CG 1 1 6 3903 1 1 34 LYS H H 2.212 -7.918 1.008 1.00 . A A . 531 LYS H 1 1 6 3904 1 1 34 LYS HA H 3.977 -9.588 -0.481 1.00 . A A . 531 LYS HA 1 1 6 3905 1 1 34 LYS HB2 H 1.427 -9.751 -0.240 1.00 . A A . 531 LYS HB2 1 1 6 3906 1 1 34 LYS HB3 H 1.337 -8.485 -1.450 1.00 . A A . 531 LYS HB3 1 1 6 3907 1 1 34 LYS HD2 H 1.550 -9.017 -3.775 1.00 . A A . 531 LYS HD2 1 1 6 3908 1 1 34 LYS HD3 H 3.274 -9.276 -3.510 1.00 . A A . 531 LYS HD3 1 1 6 3909 1 1 34 LYS HE2 H 2.595 -10.332 -5.574 1.00 . A A . 531 LYS HE2 1 1 6 3910 1 1 34 LYS HE3 H 3.042 -11.563 -4.394 1.00 . A A . 531 LYS HE3 1 1 6 3911 1 1 34 LYS HG2 H 2.785 -11.068 -1.943 1.00 . A A . 531 LYS HG2 1 1 6 3912 1 1 34 LYS HG3 H 1.057 -10.879 -2.238 1.00 . A A . 531 LYS HG3 1 1 6 3913 1 1 34 LYS HZ1 H 0.239 -10.722 -4.897 1.00 . A A . 531 LYS HZ1 1 1 6 3914 1 1 34 LYS HZ2 H 0.976 -12.033 -5.676 1.00 . A A . 531 LYS HZ2 1 1 6 3915 1 1 34 LYS HZ3 H 0.765 -12.057 -3.992 1.00 . A A . 531 LYS HZ3 1 1 6 3916 1 1 34 LYS N N 3.120 -8.103 0.678 1.00 . A A . 531 LYS N 1 1 6 3917 1 1 34 LYS NZ N 0.984 -11.449 -4.813 1.00 . A A . 531 LYS NZ 1 1 6 3918 1 1 34 LYS O O 4.777 -8.128 -2.404 1.00 . A A . 531 LYS O 1 1 6 3919 1 1 35 ASP C C 5.243 -5.022 -2.071 1.00 . A A . 532 ASP C 1 1 6 3920 1 1 35 ASP CA C 3.858 -5.500 -2.498 1.00 . A A . 532 ASP CA 1 1 6 3921 1 1 35 ASP CB C 2.873 -4.325 -2.478 1.00 . A A . 532 ASP CB 1 1 6 3922 1 1 35 ASP CG C 3.164 -3.280 -3.541 1.00 . A A . 532 ASP CG 1 1 6 3923 1 1 35 ASP H H 2.643 -6.348 -0.989 1.00 . A A . 532 ASP H 1 1 6 3924 1 1 35 ASP HA H 3.909 -5.886 -3.507 1.00 . A A . 532 ASP HA 1 1 6 3925 1 1 35 ASP HB2 H 1.876 -4.702 -2.640 1.00 . A A . 532 ASP HB2 1 1 6 3926 1 1 35 ASP HB3 H 2.916 -3.848 -1.510 1.00 . A A . 532 ASP HB3 1 1 6 3927 1 1 35 ASP N N 3.376 -6.558 -1.612 1.00 . A A . 532 ASP N 1 1 6 3928 1 1 35 ASP O O 5.952 -4.379 -2.840 1.00 . A A . 532 ASP O 1 1 6 3929 1 1 35 ASP OD1 O 3.283 -3.651 -4.732 1.00 . A A . 532 ASP OD1 1 1 6 3930 1 1 35 ASP OD2 O 3.256 -2.084 -3.197 1.00 . A A . 532 ASP OD2 1 1 6 3931 1 1 36 TRP C C 8.120 -5.233 -1.075 1.00 . A A . 533 TRP C 1 1 6 3932 1 1 36 TRP CA C 6.873 -4.923 -0.244 1.00 . A A . 533 TRP CA 1 1 6 3933 1 1 36 TRP CB C 7.026 -5.501 1.166 1.00 . A A . 533 TRP CB 1 1 6 3934 1 1 36 TRP CD1 C 9.316 -5.530 2.317 1.00 . A A . 533 TRP CD1 1 1 6 3935 1 1 36 TRP CD2 C 8.301 -3.535 2.328 1.00 . A A . 533 TRP CD2 1 1 6 3936 1 1 36 TRP CE2 C 9.540 -3.409 2.979 1.00 . A A . 533 TRP CE2 1 1 6 3937 1 1 36 TRP CE3 C 7.483 -2.406 2.214 1.00 . A A . 533 TRP CE3 1 1 6 3938 1 1 36 TRP CG C 8.175 -4.901 1.915 1.00 . A A . 533 TRP CG 1 1 6 3939 1 1 36 TRP CH2 C 9.165 -1.114 3.379 1.00 . A A . 533 TRP CH2 1 1 6 3940 1 1 36 TRP CZ2 C 9.985 -2.201 3.506 1.00 . A A . 533 TRP CZ2 1 1 6 3941 1 1 36 TRP CZ3 C 7.925 -1.208 2.739 1.00 . A A . 533 TRP CZ3 1 1 6 3942 1 1 36 TRP H H 5.101 -6.061 -0.368 1.00 . A A . 533 TRP H 1 1 6 3943 1 1 36 TRP HA H 6.788 -3.852 -0.138 1.00 . A A . 533 TRP HA 1 1 6 3944 1 1 36 TRP HB2 H 6.122 -5.301 1.728 1.00 . A A . 533 TRP HB2 1 1 6 3945 1 1 36 TRP HB3 H 7.183 -6.567 1.103 1.00 . A A . 533 TRP HB3 1 1 6 3946 1 1 36 TRP HD1 H 9.526 -6.575 2.149 1.00 . A A . 533 TRP HD1 1 1 6 3947 1 1 36 TRP HE1 H 11.031 -4.851 3.341 1.00 . A A . 533 TRP HE1 1 1 6 3948 1 1 36 TRP HE3 H 6.522 -2.460 1.722 1.00 . A A . 533 TRP HE3 1 1 6 3949 1 1 36 TRP HH2 H 9.470 -0.156 3.777 1.00 . A A . 533 TRP HH2 1 1 6 3950 1 1 36 TRP HZ2 H 10.941 -2.112 3.998 1.00 . A A . 533 TRP HZ2 1 1 6 3951 1 1 36 TRP HZ3 H 7.307 -0.327 2.658 1.00 . A A . 533 TRP HZ3 1 1 6 3952 1 1 36 TRP N N 5.647 -5.418 -0.865 1.00 . A A . 533 TRP N 1 1 6 3953 1 1 36 TRP NE1 N 10.142 -4.639 2.958 1.00 . A A . 533 TRP NE1 1 1 6 3954 1 1 36 TRP O O 9.110 -4.522 -0.998 1.00 . A A . 533 TRP O 1 1 6 3955 1 1 37 LYS C C 9.514 -5.570 -3.740 1.00 . A A . 534 LYS C 1 1 6 3956 1 1 37 LYS CA C 9.212 -6.656 -2.714 1.00 . A A . 534 LYS CA 1 1 6 3957 1 1 37 LYS CB C 8.988 -8.006 -3.395 1.00 . A A . 534 LYS CB 1 1 6 3958 1 1 37 LYS CD C 8.727 -10.493 -3.148 1.00 . A A . 534 LYS CD 1 1 6 3959 1 1 37 LYS CE C 8.684 -11.664 -2.178 1.00 . A A . 534 LYS CE 1 1 6 3960 1 1 37 LYS CG C 8.883 -9.168 -2.420 1.00 . A A . 534 LYS CG 1 1 6 3961 1 1 37 LYS H H 7.252 -6.812 -1.914 1.00 . A A . 534 LYS H 1 1 6 3962 1 1 37 LYS HA H 10.096 -6.704 -2.099 1.00 . A A . 534 LYS HA 1 1 6 3963 1 1 37 LYS HB2 H 8.074 -7.959 -3.970 1.00 . A A . 534 LYS HB2 1 1 6 3964 1 1 37 LYS HB3 H 9.813 -8.200 -4.066 1.00 . A A . 534 LYS HB3 1 1 6 3965 1 1 37 LYS HD2 H 7.808 -10.474 -3.717 1.00 . A A . 534 LYS HD2 1 1 6 3966 1 1 37 LYS HD3 H 9.564 -10.621 -3.820 1.00 . A A . 534 LYS HD3 1 1 6 3967 1 1 37 LYS HE2 H 9.589 -11.664 -1.588 1.00 . A A . 534 LYS HE2 1 1 6 3968 1 1 37 LYS HE3 H 7.830 -11.546 -1.527 1.00 . A A . 534 LYS HE3 1 1 6 3969 1 1 37 LYS HG2 H 9.778 -9.204 -1.818 1.00 . A A . 534 LYS HG2 1 1 6 3970 1 1 37 LYS HG3 H 8.023 -9.015 -1.785 1.00 . A A . 534 LYS HG3 1 1 6 3971 1 1 37 LYS HZ1 H 9.354 -13.064 -3.575 1.00 . A A . 534 LYS HZ1 1 1 6 3972 1 1 37 LYS HZ2 H 8.610 -13.753 -2.215 1.00 . A A . 534 LYS HZ2 1 1 6 3973 1 1 37 LYS HZ3 H 7.668 -13.008 -3.410 1.00 . A A . 534 LYS HZ3 1 1 6 3974 1 1 37 LYS N N 8.071 -6.285 -1.874 1.00 . A A . 534 LYS N 1 1 6 3975 1 1 37 LYS NZ N 8.572 -12.962 -2.891 1.00 . A A . 534 LYS NZ 1 1 6 3976 1 1 37 LYS O O 10.679 -5.314 -4.048 1.00 . A A . 534 LYS O 1 1 6 3977 1 1 38 ASP C C 8.702 -2.498 -4.270 1.00 . A A . 535 ASP C 1 1 6 3978 1 1 38 ASP CA C 8.723 -3.752 -5.105 1.00 . A A . 535 ASP CA 1 1 6 3979 1 1 38 ASP CB C 7.645 -3.632 -6.170 1.00 . A A . 535 ASP CB 1 1 6 3980 1 1 38 ASP CG C 7.984 -2.610 -7.237 1.00 . A A . 535 ASP CG 1 1 6 3981 1 1 38 ASP H H 7.576 -5.197 -4.055 1.00 . A A . 535 ASP H 1 1 6 3982 1 1 38 ASP HA H 9.690 -3.868 -5.570 1.00 . A A . 535 ASP HA 1 1 6 3983 1 1 38 ASP HB2 H 7.500 -4.579 -6.633 1.00 . A A . 535 ASP HB2 1 1 6 3984 1 1 38 ASP HB3 H 6.726 -3.329 -5.696 1.00 . A A . 535 ASP HB3 1 1 6 3985 1 1 38 ASP N N 8.494 -4.910 -4.253 1.00 . A A . 535 ASP N 1 1 6 3986 1 1 38 ASP O O 9.443 -1.558 -4.486 1.00 . A A . 535 ASP O 1 1 6 3987 1 1 38 ASP OD1 O 8.922 -2.855 -8.027 1.00 . A A . 535 ASP OD1 1 1 6 3988 1 1 38 ASP OD2 O 7.299 -1.569 -7.304 1.00 . A A . 535 ASP OD2 1 1 6 3989 1 1 39 HIS C C 8.717 -0.922 -1.681 1.00 . A A . 536 HIS C 1 1 6 3990 1 1 39 HIS CA C 7.533 -1.339 -2.542 1.00 . A A . 536 HIS CA 1 1 6 3991 1 1 39 HIS CB C 6.304 -1.605 -1.673 1.00 . A A . 536 HIS CB 1 1 6 3992 1 1 39 HIS CD2 C 5.535 -0.031 0.226 1.00 . A A . 536 HIS CD2 1 1 6 3993 1 1 39 HIS CE1 C 4.609 1.517 -0.969 1.00 . A A . 536 HIS CE1 1 1 6 3994 1 1 39 HIS CG C 5.689 -0.386 -1.075 1.00 . A A . 536 HIS CG 1 1 6 3995 1 1 39 HIS H H 7.355 -3.335 -3.112 1.00 . A A . 536 HIS H 1 1 6 3996 1 1 39 HIS HA H 7.308 -0.551 -3.251 1.00 . A A . 536 HIS HA 1 1 6 3997 1 1 39 HIS HB2 H 5.549 -2.092 -2.271 1.00 . A A . 536 HIS HB2 1 1 6 3998 1 1 39 HIS HB3 H 6.588 -2.260 -0.865 1.00 . A A . 536 HIS HB3 1 1 6 3999 1 1 39 HIS HD1 H 5.007 0.625 -2.804 1.00 . A A . 536 HIS HD1 1 1 6 4000 1 1 39 HIS HD2 H 5.881 -0.584 1.086 1.00 . A A . 536 HIS HD2 1 1 6 4001 1 1 39 HIS HE1 H 4.094 2.418 -1.264 1.00 . A A . 536 HIS HE1 1 1 6 4002 1 1 39 HIS N N 7.831 -2.510 -3.307 1.00 . A A . 536 HIS N 1 1 6 4003 1 1 39 HIS ND1 N 5.093 0.607 -1.820 1.00 . A A . 536 HIS ND1 1 1 6 4004 1 1 39 HIS NE2 N 4.846 1.167 0.274 1.00 . A A . 536 HIS NE2 1 1 6 4005 1 1 39 HIS O O 8.921 0.255 -1.454 1.00 . A A . 536 HIS O 1 1 6 4006 1 1 40 GLN C C 11.614 -0.605 -0.900 1.00 . A A . 537 GLN C 1 1 6 4007 1 1 40 GLN CA C 10.601 -1.571 -0.286 1.00 . A A . 537 GLN CA 1 1 6 4008 1 1 40 GLN CB C 11.307 -2.840 0.195 1.00 . A A . 537 GLN CB 1 1 6 4009 1 1 40 GLN CD C 12.477 -4.985 -0.447 1.00 . A A . 537 GLN CD 1 1 6 4010 1 1 40 GLN CG C 11.955 -3.643 -0.921 1.00 . A A . 537 GLN CG 1 1 6 4011 1 1 40 GLN H H 9.335 -2.826 -1.467 1.00 . A A . 537 GLN H 1 1 6 4012 1 1 40 GLN HA H 10.151 -1.069 0.554 1.00 . A A . 537 GLN HA 1 1 6 4013 1 1 40 GLN HB2 H 12.076 -2.564 0.900 1.00 . A A . 537 GLN HB2 1 1 6 4014 1 1 40 GLN HB3 H 10.586 -3.473 0.691 1.00 . A A . 537 GLN HB3 1 1 6 4015 1 1 40 GLN HE21 H 10.692 -5.799 -0.722 1.00 . A A . 537 GLN HE21 1 1 6 4016 1 1 40 GLN HE22 H 11.927 -6.872 -0.156 1.00 . A A . 537 GLN HE22 1 1 6 4017 1 1 40 GLN HG2 H 11.228 -3.809 -1.708 1.00 . A A . 537 GLN HG2 1 1 6 4018 1 1 40 GLN HG3 H 12.782 -3.071 -1.313 1.00 . A A . 537 GLN HG3 1 1 6 4019 1 1 40 GLN N N 9.506 -1.884 -1.208 1.00 . A A . 537 GLN N 1 1 6 4020 1 1 40 GLN NE2 N 11.612 -5.985 -0.436 1.00 . A A . 537 GLN NE2 1 1 6 4021 1 1 40 GLN O O 12.172 0.235 -0.197 1.00 . A A . 537 GLN O 1 1 6 4022 1 1 40 GLN OE1 O 13.639 -5.114 -0.067 1.00 . A A . 537 GLN OE1 1 1 6 4023 1 1 41 HIS C C 12.134 1.519 -3.199 1.00 . A A . 538 HIS C 1 1 6 4024 1 1 41 HIS CA C 12.795 0.184 -2.854 1.00 . A A . 538 HIS CA 1 1 6 4025 1 1 41 HIS CB C 13.438 -0.460 -4.098 1.00 . A A . 538 HIS CB 1 1 6 4026 1 1 41 HIS CD2 C 11.785 -1.491 -5.797 1.00 . A A . 538 HIS CD2 1 1 6 4027 1 1 41 HIS CE1 C 11.717 0.189 -7.173 1.00 . A A . 538 HIS CE1 1 1 6 4028 1 1 41 HIS CG C 12.582 -0.501 -5.330 1.00 . A A . 538 HIS CG 1 1 6 4029 1 1 41 HIS H H 11.434 -1.442 -2.707 1.00 . A A . 538 HIS H 1 1 6 4030 1 1 41 HIS HA H 13.583 0.406 -2.150 1.00 . A A . 538 HIS HA 1 1 6 4031 1 1 41 HIS HB2 H 14.332 0.086 -4.346 1.00 . A A . 538 HIS HB2 1 1 6 4032 1 1 41 HIS HB3 H 13.709 -1.478 -3.855 1.00 . A A . 538 HIS HB3 1 1 6 4033 1 1 41 HIS HD2 H 11.572 -2.434 -5.315 1.00 . A A . 538 HIS HD2 1 1 6 4034 1 1 41 HIS HE1 H 11.449 0.812 -8.013 1.00 . A A . 538 HIS HE1 1 1 6 4035 1 1 41 HIS HE2 H 10.469 -1.444 -7.429 1.00 . A A . 538 HIS HE2 1 1 6 4036 1 1 41 HIS N N 11.859 -0.720 -2.199 1.00 . A A . 538 HIS N 1 1 6 4037 1 1 41 HIS ND1 N 12.534 0.559 -6.204 1.00 . A A . 538 HIS ND1 1 1 6 4038 1 1 41 HIS NE2 N 11.243 -1.046 -6.971 1.00 . A A . 538 HIS NE2 1 1 6 4039 1 1 41 HIS O O 12.826 2.518 -3.385 1.00 . A A . 538 HIS O 1 1 6 4040 1 1 42 ILE C C 9.721 3.541 -2.293 1.00 . A A . 539 ILE C 1 1 6 4041 1 1 42 ILE CA C 10.105 2.792 -3.579 1.00 . A A . 539 ILE CA 1 1 6 4042 1 1 42 ILE CB C 8.853 2.534 -4.478 1.00 . A A . 539 ILE CB 1 1 6 4043 1 1 42 ILE CD1 C 6.723 3.362 -3.351 1.00 . A A . 539 ILE CD1 1 1 6 4044 1 1 42 ILE CG1 C 7.595 2.167 -3.685 1.00 . A A . 539 ILE CG1 1 1 6 4045 1 1 42 ILE CG2 C 9.150 1.442 -5.485 1.00 . A A . 539 ILE CG2 1 1 6 4046 1 1 42 ILE H H 10.290 0.718 -3.151 1.00 . A A . 539 ILE H 1 1 6 4047 1 1 42 ILE HA H 10.785 3.415 -4.138 1.00 . A A . 539 ILE HA 1 1 6 4048 1 1 42 ILE HB H 8.657 3.428 -5.032 1.00 . A A . 539 ILE HB 1 1 6 4049 1 1 42 ILE HD11 H 6.354 3.804 -4.264 1.00 . A A . 539 ILE HD11 1 1 6 4050 1 1 42 ILE HD12 H 5.890 3.043 -2.741 1.00 . A A . 539 ILE HD12 1 1 6 4051 1 1 42 ILE HD13 H 7.307 4.090 -2.810 1.00 . A A . 539 ILE HD13 1 1 6 4052 1 1 42 ILE HG12 H 7.003 1.479 -4.262 1.00 . A A . 539 ILE HG12 1 1 6 4053 1 1 42 ILE HG13 H 7.882 1.695 -2.757 1.00 . A A . 539 ILE HG13 1 1 6 4054 1 1 42 ILE HG21 H 9.457 0.545 -4.966 1.00 . A A . 539 ILE HG21 1 1 6 4055 1 1 42 ILE HG22 H 8.262 1.235 -6.065 1.00 . A A . 539 ILE HG22 1 1 6 4056 1 1 42 ILE HG23 H 9.943 1.765 -6.144 1.00 . A A . 539 ILE HG23 1 1 6 4057 1 1 42 ILE N N 10.805 1.547 -3.275 1.00 . A A . 539 ILE N 1 1 6 4058 1 1 42 ILE O O 9.854 4.763 -2.206 1.00 . A A . 539 ILE O 1 1 6 4059 1 1 43 CYS C C 9.835 4.176 0.615 1.00 . A A . 540 CYS C 1 1 6 4060 1 1 43 CYS CA C 8.750 3.338 -0.067 1.00 . A A . 540 CYS CA 1 1 6 4061 1 1 43 CYS CB C 8.369 2.173 0.848 1.00 . A A . 540 CYS CB 1 1 6 4062 1 1 43 CYS H H 9.099 1.823 -1.490 1.00 . A A . 540 CYS H 1 1 6 4063 1 1 43 CYS HA H 7.871 3.941 -0.232 1.00 . A A . 540 CYS HA 1 1 6 4064 1 1 43 CYS HB2 H 7.814 1.446 0.275 1.00 . A A . 540 CYS HB2 1 1 6 4065 1 1 43 CYS HB3 H 9.271 1.712 1.222 1.00 . A A . 540 CYS HB3 1 1 6 4066 1 1 43 CYS N N 9.212 2.792 -1.330 1.00 . A A . 540 CYS N 1 1 6 4067 1 1 43 CYS O O 10.927 3.691 0.914 1.00 . A A . 540 CYS O 1 1 6 4068 1 1 43 CYS SG S 7.351 2.636 2.280 1.00 . A A . 540 CYS SG 1 1 6 4069 1 1 44 GLY C C 10.294 7.757 1.054 1.00 . A A . 541 GLY C 1 1 6 4070 1 1 44 GLY CA C 10.453 6.322 1.498 1.00 . A A . 541 GLY CA 1 1 6 4071 1 1 44 GLY H H 8.585 5.722 0.686 1.00 . A A . 541 GLY H 1 1 6 4072 1 1 44 GLY HA2 H 10.320 6.274 2.570 1.00 . A A . 541 GLY HA2 1 1 6 4073 1 1 44 GLY HA3 H 11.454 5.993 1.257 1.00 . A A . 541 GLY HA3 1 1 6 4074 1 1 44 GLY N N 9.505 5.427 0.868 1.00 . A A . 541 GLY N 1 1 6 4075 1 1 44 GLY O O 9.983 8.634 1.859 1.00 . A A . 541 GLY O 1 1 6 4076 1 1 45 GLN C C 10.108 9.320 -2.243 1.00 . A A . 542 GLN C 1 1 6 4077 1 1 45 GLN CA C 10.473 9.351 -0.769 1.00 . A A . 542 GLN CA 1 1 6 4078 1 1 45 GLN CB C 11.842 10.001 -0.564 1.00 . A A . 542 GLN CB 1 1 6 4079 1 1 45 GLN CD C 14.343 9.740 -0.680 1.00 . A A . 542 GLN CD 1 1 6 4080 1 1 45 GLN CG C 13.001 9.163 -1.073 1.00 . A A . 542 GLN CG 1 1 6 4081 1 1 45 GLN H H 10.622 7.249 -0.846 1.00 . A A . 542 GLN H 1 1 6 4082 1 1 45 GLN HA H 9.730 9.917 -0.232 1.00 . A A . 542 GLN HA 1 1 6 4083 1 1 45 GLN HB2 H 11.854 10.947 -1.083 1.00 . A A . 542 GLN HB2 1 1 6 4084 1 1 45 GLN HB3 H 11.989 10.177 0.491 1.00 . A A . 542 GLN HB3 1 1 6 4085 1 1 45 GLN HE21 H 14.281 8.750 1.043 1.00 . A A . 542 GLN HE21 1 1 6 4086 1 1 45 GLN HE22 H 15.692 9.720 0.775 1.00 . A A . 542 GLN HE22 1 1 6 4087 1 1 45 GLN HG2 H 12.920 8.168 -0.661 1.00 . A A . 542 GLN HG2 1 1 6 4088 1 1 45 GLN HG3 H 12.948 9.111 -2.151 1.00 . A A . 542 GLN HG3 1 1 6 4089 1 1 45 GLN N N 10.485 7.999 -0.232 1.00 . A A . 542 GLN N 1 1 6 4090 1 1 45 GLN NE2 N 14.820 9.369 0.496 1.00 . A A . 542 GLN NE2 1 1 6 4091 1 1 45 GLN O O 9.817 8.257 -2.794 1.00 . A A . 542 GLN O 1 1 6 4092 1 1 45 GLN OE1 O 14.937 10.524 -1.416 1.00 . A A . 542 GLN OE1 1 1 6 4093 1 1 46 SER C C 10.749 11.486 -5.011 1.00 . A A . 543 SER C 1 1 6 4094 1 1 46 SER CA C 9.752 10.587 -4.285 1.00 . A A . 543 SER CA 1 1 6 4095 1 1 46 SER CB C 8.338 11.150 -4.427 1.00 . A A . 543 SER CB 1 1 6 4096 1 1 46 SER H H 10.307 11.306 -2.383 1.00 . A A . 543 SER H 1 1 6 4097 1 1 46 SER HA H 9.786 9.597 -4.715 1.00 . A A . 543 SER HA 1 1 6 4098 1 1 46 SER HB2 H 8.340 12.197 -4.166 1.00 . A A . 543 SER HB2 1 1 6 4099 1 1 46 SER HB3 H 8.004 11.030 -5.447 1.00 . A A . 543 SER HB3 1 1 6 4100 1 1 46 SER HG H 7.536 10.805 -2.663 1.00 . A A . 543 SER HG 1 1 6 4101 1 1 46 SER N N 10.092 10.485 -2.877 1.00 . A A . 543 SER N 1 1 6 4102 1 1 46 SER O O 10.925 11.389 -6.224 1.00 . A A . 543 SER O 1 1 6 4103 1 1 46 SER OG O 7.436 10.467 -3.569 1.00 . A A . 543 SER OG 1 1 6 4104 1 1 47 ALA C C 13.196 13.890 -3.667 1.00 . A A . 544 ALA C 1 1 6 4105 1 1 47 ALA CA C 12.365 13.297 -4.796 1.00 . A A . 544 ALA CA 1 1 6 4106 1 1 47 ALA CB C 11.665 14.400 -5.578 1.00 . A A . 544 ALA CB 1 1 6 4107 1 1 47 ALA H H 11.216 12.381 -3.288 1.00 . A A . 544 ALA H 1 1 6 4108 1 1 47 ALA HA H 13.017 12.759 -5.470 1.00 . A A . 544 ALA HA 1 1 6 4109 1 1 47 ALA HB1 H 10.991 14.933 -4.923 1.00 . A A . 544 ALA HB1 1 1 6 4110 1 1 47 ALA HB2 H 12.402 15.085 -5.973 1.00 . A A . 544 ALA HB2 1 1 6 4111 1 1 47 ALA HB3 H 11.106 13.964 -6.391 1.00 . A A . 544 ALA HB3 1 1 6 4112 1 1 47 ALA N N 11.396 12.361 -4.252 1.00 . A A . 544 ALA N 1 1 6 4113 1 1 47 ALA O O 14.419 13.647 -3.626 1.00 . A A . 544 ALA O 1 1 6 4114 1 1 47 ALA OXT O 12.611 14.574 -2.799 1.00 . A A . 544 ALA OXT 1 1 6 4115 2 2 1 ZN ZN ZN -5.568 -5.669 -0.842 1.00 . B A . 601 ZN ZN 1 1 6 4116 3 2 1 ZN ZN ZN 5.131 2.509 1.700 1.00 . C A . 602 ZN ZN 1 1 7 4117 1 1 1 GLY C C -19.656 4.707 1.802 1.00 . A A . 498 GLY C 1 1 7 4118 1 1 1 GLY CA C -19.820 6.207 1.668 1.00 . A A . 498 GLY CA 1 1 7 4119 1 1 1 GLY H1 H -19.563 7.730 0.267 1.00 . A A . 498 GLY H1 1 1 7 4120 1 1 1 GLY H2 H -19.894 6.214 -0.418 1.00 . A A . 498 GLY H2 1 1 7 4121 1 1 1 GLY H3 H -18.354 6.540 0.220 1.00 . A A . 498 GLY H3 1 1 7 4122 1 1 1 GLY HA2 H -19.237 6.690 2.436 1.00 . A A . 498 GLY HA2 1 1 7 4123 1 1 1 GLY HA3 H -20.861 6.459 1.808 1.00 . A A . 498 GLY HA3 1 1 7 4124 1 1 1 GLY N N -19.378 6.707 0.343 1.00 . A A . 498 GLY N 1 1 7 4125 1 1 1 GLY O O -20.553 4.019 2.294 1.00 . A A . 498 GLY O 1 1 7 4126 1 1 2 ALA C C -16.732 2.525 1.216 1.00 . A A . 499 ALA C 1 1 7 4127 1 1 2 ALA CA C -18.215 2.771 1.456 1.00 . A A . 499 ALA CA 1 1 7 4128 1 1 2 ALA CB C -19.062 1.963 0.475 1.00 . A A . 499 ALA CB 1 1 7 4129 1 1 2 ALA H H -17.849 4.791 0.935 1.00 . A A . 499 ALA H 1 1 7 4130 1 1 2 ALA HA H -18.464 2.453 2.459 1.00 . A A . 499 ALA HA 1 1 7 4131 1 1 2 ALA HB1 H -18.821 2.257 -0.537 1.00 . A A . 499 ALA HB1 1 1 7 4132 1 1 2 ALA HB2 H -18.856 0.910 0.602 1.00 . A A . 499 ALA HB2 1 1 7 4133 1 1 2 ALA HB3 H -20.108 2.151 0.665 1.00 . A A . 499 ALA HB3 1 1 7 4134 1 1 2 ALA N N -18.516 4.194 1.349 1.00 . A A . 499 ALA N 1 1 7 4135 1 1 2 ALA O O -15.957 2.366 2.159 1.00 . A A . 499 ALA O 1 1 7 4136 1 1 3 MET C C -14.403 3.585 -1.054 1.00 . A A . 500 MET C 1 1 7 4137 1 1 3 MET CA C -14.945 2.320 -0.412 1.00 . A A . 500 MET CA 1 1 7 4138 1 1 3 MET CB C -14.802 1.130 -1.364 1.00 . A A . 500 MET CB 1 1 7 4139 1 1 3 MET CE C -15.245 -2.150 1.181 1.00 . A A . 500 MET CE 1 1 7 4140 1 1 3 MET CG C -15.293 -0.181 -0.770 1.00 . A A . 500 MET CG 1 1 7 4141 1 1 3 MET H H -16.996 2.687 -0.759 1.00 . A A . 500 MET H 1 1 7 4142 1 1 3 MET HA H -14.387 2.120 0.492 1.00 . A A . 500 MET HA 1 1 7 4143 1 1 3 MET HB2 H -15.368 1.328 -2.261 1.00 . A A . 500 MET HB2 1 1 7 4144 1 1 3 MET HB3 H -13.760 1.015 -1.623 1.00 . A A . 500 MET HB3 1 1 7 4145 1 1 3 MET HE1 H -15.017 -2.864 0.403 1.00 . A A . 500 MET HE1 1 1 7 4146 1 1 3 MET HE2 H -14.862 -2.513 2.124 1.00 . A A . 500 MET HE2 1 1 7 4147 1 1 3 MET HE3 H -16.315 -2.025 1.253 1.00 . A A . 500 MET HE3 1 1 7 4148 1 1 3 MET HG2 H -16.356 -0.108 -0.599 1.00 . A A . 500 MET HG2 1 1 7 4149 1 1 3 MET HG3 H -15.096 -0.976 -1.475 1.00 . A A . 500 MET HG3 1 1 7 4150 1 1 3 MET N N -16.336 2.526 -0.047 1.00 . A A . 500 MET N 1 1 7 4151 1 1 3 MET O O -14.573 3.813 -2.251 1.00 . A A . 500 MET O 1 1 7 4152 1 1 3 MET SD S -14.483 -0.577 0.792 1.00 . A A . 500 MET SD 1 1 7 4153 1 1 4 GLU C C -11.893 5.662 -1.231 1.00 . A A . 501 GLU C 1 1 7 4154 1 1 4 GLU CA C -13.317 5.725 -0.689 1.00 . A A . 501 GLU CA 1 1 7 4155 1 1 4 GLU CB C -13.380 6.711 0.476 1.00 . A A . 501 GLU CB 1 1 7 4156 1 1 4 GLU CD C -15.897 6.970 0.403 1.00 . A A . 501 GLU CD 1 1 7 4157 1 1 4 GLU CG C -14.685 6.666 1.256 1.00 . A A . 501 GLU CG 1 1 7 4158 1 1 4 GLU H H -13.572 4.124 0.677 1.00 . A A . 501 GLU H 1 1 7 4159 1 1 4 GLU HA H -13.980 6.060 -1.471 1.00 . A A . 501 GLU HA 1 1 7 4160 1 1 4 GLU HB2 H -12.573 6.491 1.158 1.00 . A A . 501 GLU HB2 1 1 7 4161 1 1 4 GLU HB3 H -13.251 7.711 0.091 1.00 . A A . 501 GLU HB3 1 1 7 4162 1 1 4 GLU HG2 H -14.804 5.679 1.677 1.00 . A A . 501 GLU HG2 1 1 7 4163 1 1 4 GLU HG3 H -14.634 7.391 2.053 1.00 . A A . 501 GLU HG3 1 1 7 4164 1 1 4 GLU N N -13.760 4.409 -0.245 1.00 . A A . 501 GLU N 1 1 7 4165 1 1 4 GLU O O -11.377 6.635 -1.782 1.00 . A A . 501 GLU O 1 1 7 4166 1 1 4 GLU OE1 O -15.983 8.094 -0.127 1.00 . A A . 501 GLU OE1 1 1 7 4167 1 1 4 GLU OE2 O -16.774 6.086 0.266 1.00 . A A . 501 GLU OE2 1 1 7 4168 1 1 5 GLN C C -9.736 2.975 -2.196 1.00 . A A . 502 GLN C 1 1 7 4169 1 1 5 GLN CA C -9.888 4.295 -1.449 1.00 . A A . 502 GLN CA 1 1 7 4170 1 1 5 GLN CB C -9.001 4.307 -0.202 1.00 . A A . 502 GLN CB 1 1 7 4171 1 1 5 GLN CD C -8.702 3.631 2.194 1.00 . A A . 502 GLN CD 1 1 7 4172 1 1 5 GLN CG C -9.502 3.432 0.929 1.00 . A A . 502 GLN CG 1 1 7 4173 1 1 5 GLN H H -11.773 3.757 -0.676 1.00 . A A . 502 GLN H 1 1 7 4174 1 1 5 GLN HA H -9.567 5.106 -2.083 1.00 . A A . 502 GLN HA 1 1 7 4175 1 1 5 GLN HB2 H -8.012 3.970 -0.477 1.00 . A A . 502 GLN HB2 1 1 7 4176 1 1 5 GLN HB3 H -8.934 5.321 0.162 1.00 . A A . 502 GLN HB3 1 1 7 4177 1 1 5 GLN HE21 H -9.908 5.110 2.719 1.00 . A A . 502 GLN HE21 1 1 7 4178 1 1 5 GLN HE22 H -8.623 4.764 3.824 1.00 . A A . 502 GLN HE22 1 1 7 4179 1 1 5 GLN HG2 H -10.534 3.680 1.129 1.00 . A A . 502 GLN HG2 1 1 7 4180 1 1 5 GLN HG3 H -9.430 2.396 0.631 1.00 . A A . 502 GLN HG3 1 1 7 4181 1 1 5 GLN N N -11.273 4.507 -1.065 1.00 . A A . 502 GLN N 1 1 7 4182 1 1 5 GLN NE2 N -9.121 4.596 2.993 1.00 . A A . 502 GLN NE2 1 1 7 4183 1 1 5 GLN O O -10.554 2.070 -2.030 1.00 . A A . 502 GLN O 1 1 7 4184 1 1 5 GLN OE1 O -7.716 2.940 2.443 1.00 . A A . 502 GLN OE1 1 1 7 4185 1 1 6 SER C C -7.091 1.054 -3.421 1.00 . A A . 503 SER C 1 1 7 4186 1 1 6 SER CA C -8.457 1.642 -3.766 1.00 . A A . 503 SER CA 1 1 7 4187 1 1 6 SER CB C -8.557 1.910 -5.268 1.00 . A A . 503 SER CB 1 1 7 4188 1 1 6 SER H H -8.093 3.630 -3.131 1.00 . A A . 503 SER H 1 1 7 4189 1 1 6 SER HA H -9.217 0.931 -3.485 1.00 . A A . 503 SER HA 1 1 7 4190 1 1 6 SER HB2 H -7.779 2.597 -5.565 1.00 . A A . 503 SER HB2 1 1 7 4191 1 1 6 SER HB3 H -8.444 0.981 -5.809 1.00 . A A . 503 SER HB3 1 1 7 4192 1 1 6 SER HG H -9.823 3.408 -5.320 1.00 . A A . 503 SER HG 1 1 7 4193 1 1 6 SER N N -8.703 2.867 -3.019 1.00 . A A . 503 SER N 1 1 7 4194 1 1 6 SER O O -6.072 1.738 -3.502 1.00 . A A . 503 SER O 1 1 7 4195 1 1 6 SER OG O -9.815 2.479 -5.594 1.00 . A A . 503 SER OG 1 1 7 4196 1 1 7 CYS C C -4.940 -0.979 -3.853 1.00 . A A . 504 CYS C 1 1 7 4197 1 1 7 CYS CA C -5.875 -0.920 -2.659 1.00 . A A . 504 CYS CA 1 1 7 4198 1 1 7 CYS CB C -6.226 -2.328 -2.196 1.00 . A A . 504 CYS CB 1 1 7 4199 1 1 7 CYS H H -7.947 -0.700 -2.987 1.00 . A A . 504 CYS H 1 1 7 4200 1 1 7 CYS HA H -5.392 -0.401 -1.846 1.00 . A A . 504 CYS HA 1 1 7 4201 1 1 7 CYS HB2 H -6.995 -2.265 -1.440 1.00 . A A . 504 CYS HB2 1 1 7 4202 1 1 7 CYS HB3 H -6.609 -2.886 -3.038 1.00 . A A . 504 CYS HB3 1 1 7 4203 1 1 7 CYS N N -7.091 -0.213 -3.024 1.00 . A A . 504 CYS N 1 1 7 4204 1 1 7 CYS O O -5.321 -1.449 -4.926 1.00 . A A . 504 CYS O 1 1 7 4205 1 1 7 CYS SG S -4.845 -3.273 -1.491 1.00 . A A . 504 CYS SG 1 1 7 4206 1 1 8 VAL C C -2.352 -1.827 -5.216 1.00 . A A . 505 VAL C 1 1 7 4207 1 1 8 VAL CA C -2.747 -0.429 -4.735 1.00 . A A . 505 VAL CA 1 1 7 4208 1 1 8 VAL CB C -1.490 0.367 -4.300 1.00 . A A . 505 VAL CB 1 1 7 4209 1 1 8 VAL CG1 C -0.748 -0.346 -3.181 1.00 . A A . 505 VAL CG1 1 1 7 4210 1 1 8 VAL CG2 C -0.564 0.633 -5.484 1.00 . A A . 505 VAL CG2 1 1 7 4211 1 1 8 VAL H H -3.486 -0.143 -2.773 1.00 . A A . 505 VAL H 1 1 7 4212 1 1 8 VAL HA H -3.203 0.098 -5.559 1.00 . A A . 505 VAL HA 1 1 7 4213 1 1 8 VAL HB H -1.822 1.322 -3.919 1.00 . A A . 505 VAL HB 1 1 7 4214 1 1 8 VAL HG11 H -0.427 -1.318 -3.525 1.00 . A A . 505 VAL HG11 1 1 7 4215 1 1 8 VAL HG12 H 0.113 0.237 -2.893 1.00 . A A . 505 VAL HG12 1 1 7 4216 1 1 8 VAL HG13 H -1.404 -0.463 -2.331 1.00 . A A . 505 VAL HG13 1 1 7 4217 1 1 8 VAL HG21 H -1.095 1.194 -6.240 1.00 . A A . 505 VAL HG21 1 1 7 4218 1 1 8 VAL HG22 H 0.292 1.202 -5.150 1.00 . A A . 505 VAL HG22 1 1 7 4219 1 1 8 VAL HG23 H -0.232 -0.307 -5.900 1.00 . A A . 505 VAL HG23 1 1 7 4220 1 1 8 VAL N N -3.725 -0.494 -3.661 1.00 . A A . 505 VAL N 1 1 7 4221 1 1 8 VAL O O -1.866 -1.992 -6.335 1.00 . A A . 505 VAL O 1 1 7 4222 1 1 9 ASN C C -3.385 -4.930 -5.414 1.00 . A A . 506 ASN C 1 1 7 4223 1 1 9 ASN CA C -2.219 -4.195 -4.768 1.00 . A A . 506 ASN CA 1 1 7 4224 1 1 9 ASN CB C -1.736 -5.012 -3.576 1.00 . A A . 506 ASN CB 1 1 7 4225 1 1 9 ASN CG C -1.380 -6.430 -3.988 1.00 . A A . 506 ASN CG 1 1 7 4226 1 1 9 ASN H H -2.990 -2.675 -3.510 1.00 . A A . 506 ASN H 1 1 7 4227 1 1 9 ASN HA H -1.418 -4.128 -5.487 1.00 . A A . 506 ASN HA 1 1 7 4228 1 1 9 ASN HB2 H -0.860 -4.544 -3.152 1.00 . A A . 506 ASN HB2 1 1 7 4229 1 1 9 ASN HB3 H -2.518 -5.055 -2.832 1.00 . A A . 506 ASN HB3 1 1 7 4230 1 1 9 ASN HD21 H -2.531 -7.160 -2.543 1.00 . A A . 506 ASN HD21 1 1 7 4231 1 1 9 ASN HD22 H -1.727 -8.331 -3.543 1.00 . A A . 506 ASN HD22 1 1 7 4232 1 1 9 ASN N N -2.581 -2.840 -4.387 1.00 . A A . 506 ASN N 1 1 7 4233 1 1 9 ASN ND2 N -1.927 -7.404 -3.287 1.00 . A A . 506 ASN ND2 1 1 7 4234 1 1 9 ASN O O -3.204 -5.615 -6.422 1.00 . A A . 506 ASN O 1 1 7 4235 1 1 9 ASN OD1 O -0.661 -6.646 -4.963 1.00 . A A . 506 ASN OD1 1 1 7 4236 1 1 10 CYS C C -6.836 -4.718 -5.899 1.00 . A A . 507 CYS C 1 1 7 4237 1 1 10 CYS CA C -5.688 -5.585 -5.363 1.00 . A A . 507 CYS CA 1 1 7 4238 1 1 10 CYS CB C -6.145 -6.606 -4.300 1.00 . A A . 507 CYS CB 1 1 7 4239 1 1 10 CYS H H -4.728 -4.136 -4.146 1.00 . A A . 507 CYS H 1 1 7 4240 1 1 10 CYS HA H -5.295 -6.144 -6.200 1.00 . A A . 507 CYS HA 1 1 7 4241 1 1 10 CYS HB2 H -6.807 -7.316 -4.770 1.00 . A A . 507 CYS HB2 1 1 7 4242 1 1 10 CYS HB3 H -5.274 -7.134 -3.939 1.00 . A A . 507 CYS HB3 1 1 7 4243 1 1 10 CYS N N -4.586 -4.783 -4.869 1.00 . A A . 507 CYS N 1 1 7 4244 1 1 10 CYS O O -7.036 -4.661 -7.116 1.00 . A A . 507 CYS O 1 1 7 4245 1 1 10 CYS SG S -7.023 -5.942 -2.844 1.00 . A A . 507 CYS SG 1 1 7 4246 1 1 11 GLY C C -9.398 -2.415 -4.455 1.00 . A A . 508 GLY C 1 1 7 4247 1 1 11 GLY CA C -8.649 -3.181 -5.534 1.00 . A A . 508 GLY CA 1 1 7 4248 1 1 11 GLY H H -7.398 -4.103 -4.070 1.00 . A A . 508 GLY H 1 1 7 4249 1 1 11 GLY HA2 H -8.227 -2.470 -6.228 1.00 . A A . 508 GLY HA2 1 1 7 4250 1 1 11 GLY HA3 H -9.354 -3.803 -6.070 1.00 . A A . 508 GLY HA3 1 1 7 4251 1 1 11 GLY N N -7.575 -4.028 -5.036 1.00 . A A . 508 GLY N 1 1 7 4252 1 1 11 GLY O O -8.871 -2.164 -3.380 1.00 . A A . 508 GLY O 1 1 7 4253 1 1 12 ARG C C -11.658 -1.757 -2.449 1.00 . A A . 509 ARG C 1 1 7 4254 1 1 12 ARG CA C -11.524 -1.244 -3.898 1.00 . A A . 509 ARG CA 1 1 7 4255 1 1 12 ARG CB C -12.920 -1.166 -4.542 1.00 . A A . 509 ARG CB 1 1 7 4256 1 1 12 ARG CD C -13.153 -3.686 -4.918 1.00 . A A . 509 ARG CD 1 1 7 4257 1 1 12 ARG CG C -13.791 -2.415 -4.356 1.00 . A A . 509 ARG CG 1 1 7 4258 1 1 12 ARG CZ C -12.140 -4.392 -7.058 1.00 . A A . 509 ARG CZ 1 1 7 4259 1 1 12 ARG H H -10.950 -2.192 -5.693 1.00 . A A . 509 ARG H 1 1 7 4260 1 1 12 ARG HA H -11.117 -0.245 -3.862 1.00 . A A . 509 ARG HA 1 1 7 4261 1 1 12 ARG HB2 H -13.448 -0.326 -4.117 1.00 . A A . 509 ARG HB2 1 1 7 4262 1 1 12 ARG HB3 H -12.799 -0.998 -5.603 1.00 . A A . 509 ARG HB3 1 1 7 4263 1 1 12 ARG HD2 H -12.169 -3.795 -4.486 1.00 . A A . 509 ARG HD2 1 1 7 4264 1 1 12 ARG HD3 H -13.762 -4.531 -4.632 1.00 . A A . 509 ARG HD3 1 1 7 4265 1 1 12 ARG HE H -13.660 -3.092 -6.879 1.00 . A A . 509 ARG HE 1 1 7 4266 1 1 12 ARG HG2 H -13.966 -2.559 -3.300 1.00 . A A . 509 ARG HG2 1 1 7 4267 1 1 12 ARG HG3 H -14.738 -2.252 -4.854 1.00 . A A . 509 ARG HG3 1 1 7 4268 1 1 12 ARG HH11 H -11.276 -5.208 -5.410 1.00 . A A . 509 ARG HH11 1 1 7 4269 1 1 12 ARG HH12 H -10.608 -5.718 -6.933 1.00 . A A . 509 ARG HH12 1 1 7 4270 1 1 12 ARG HH21 H -12.767 -3.749 -8.876 1.00 . A A . 509 ARG HH21 1 1 7 4271 1 1 12 ARG HH22 H -11.448 -4.880 -8.897 1.00 . A A . 509 ARG HH22 1 1 7 4272 1 1 12 ARG N N -10.639 -2.044 -4.771 1.00 . A A . 509 ARG N 1 1 7 4273 1 1 12 ARG NE N -13.027 -3.665 -6.375 1.00 . A A . 509 ARG NE 1 1 7 4274 1 1 12 ARG NH1 N -11.272 -5.165 -6.418 1.00 . A A . 509 ARG NH1 1 1 7 4275 1 1 12 ARG NH2 N -12.116 -4.339 -8.382 1.00 . A A . 509 ARG NH2 1 1 7 4276 1 1 12 ARG O O -12.260 -1.082 -1.619 1.00 . A A . 509 ARG O 1 1 7 4277 1 1 13 GLU C C -10.368 -2.619 0.203 1.00 . A A . 510 GLU C 1 1 7 4278 1 1 13 GLU CA C -11.165 -3.481 -0.796 1.00 . A A . 510 GLU CA 1 1 7 4279 1 1 13 GLU CB C -10.618 -4.916 -0.807 1.00 . A A . 510 GLU CB 1 1 7 4280 1 1 13 GLU CD C -12.282 -6.029 0.741 1.00 . A A . 510 GLU CD 1 1 7 4281 1 1 13 GLU CG C -10.829 -5.687 0.488 1.00 . A A . 510 GLU CG 1 1 7 4282 1 1 13 GLU H H -10.673 -3.432 -2.866 1.00 . A A . 510 GLU H 1 1 7 4283 1 1 13 GLU HA H -12.194 -3.500 -0.489 1.00 . A A . 510 GLU HA 1 1 7 4284 1 1 13 GLU HB2 H -11.100 -5.464 -1.604 1.00 . A A . 510 GLU HB2 1 1 7 4285 1 1 13 GLU HB3 H -9.557 -4.879 -1.004 1.00 . A A . 510 GLU HB3 1 1 7 4286 1 1 13 GLU HG2 H -10.264 -6.605 0.442 1.00 . A A . 510 GLU HG2 1 1 7 4287 1 1 13 GLU HG3 H -10.470 -5.085 1.310 1.00 . A A . 510 GLU HG3 1 1 7 4288 1 1 13 GLU N N -11.118 -2.928 -2.152 1.00 . A A . 510 GLU N 1 1 7 4289 1 1 13 GLU O O -10.384 -2.882 1.408 1.00 . A A . 510 GLU O 1 1 7 4290 1 1 13 GLU OE1 O -13.024 -5.173 1.270 1.00 . A A . 510 GLU OE1 1 1 7 4291 1 1 13 GLU OE2 O -12.692 -7.162 0.416 1.00 . A A . 510 GLU OE2 1 1 7 4292 1 1 14 ALA C C -9.403 -0.255 1.783 1.00 . A A . 511 ALA C 1 1 7 4293 1 1 14 ALA CA C -8.778 -0.763 0.493 1.00 . A A . 511 ALA CA 1 1 7 4294 1 1 14 ALA CB C -8.265 0.410 -0.312 1.00 . A A . 511 ALA CB 1 1 7 4295 1 1 14 ALA H H -9.818 -1.363 -1.250 1.00 . A A . 511 ALA H 1 1 7 4296 1 1 14 ALA HA H -7.928 -1.379 0.746 1.00 . A A . 511 ALA HA 1 1 7 4297 1 1 14 ALA HB1 H -9.090 1.054 -0.573 1.00 . A A . 511 ALA HB1 1 1 7 4298 1 1 14 ALA HB2 H -7.540 0.965 0.275 1.00 . A A . 511 ALA HB2 1 1 7 4299 1 1 14 ALA HB3 H -7.793 0.047 -1.211 1.00 . A A . 511 ALA HB3 1 1 7 4300 1 1 14 ALA N N -9.691 -1.584 -0.306 1.00 . A A . 511 ALA N 1 1 7 4301 1 1 14 ALA O O -10.598 0.036 1.852 1.00 . A A . 511 ALA O 1 1 7 4302 1 1 15 MET C C -7.772 0.658 4.994 1.00 . A A . 512 MET C 1 1 7 4303 1 1 15 MET CA C -8.971 0.248 4.131 1.00 . A A . 512 MET CA 1 1 7 4304 1 1 15 MET CB C -9.697 -0.937 4.780 1.00 . A A . 512 MET CB 1 1 7 4305 1 1 15 MET CE C -9.701 -3.267 6.943 1.00 . A A . 512 MET CE 1 1 7 4306 1 1 15 MET CG C -10.225 -0.655 6.176 1.00 . A A . 512 MET CG 1 1 7 4307 1 1 15 MET H H -7.597 -0.227 2.597 1.00 . A A . 512 MET H 1 1 7 4308 1 1 15 MET HA H -9.652 1.082 4.058 1.00 . A A . 512 MET HA 1 1 7 4309 1 1 15 MET HB2 H -10.532 -1.217 4.155 1.00 . A A . 512 MET HB2 1 1 7 4310 1 1 15 MET HB3 H -9.012 -1.770 4.840 1.00 . A A . 512 MET HB3 1 1 7 4311 1 1 15 MET HE1 H -8.883 -2.860 7.519 1.00 . A A . 512 MET HE1 1 1 7 4312 1 1 15 MET HE2 H -10.037 -4.187 7.396 1.00 . A A . 512 MET HE2 1 1 7 4313 1 1 15 MET HE3 H -9.366 -3.463 5.934 1.00 . A A . 512 MET HE3 1 1 7 4314 1 1 15 MET HG2 H -9.398 -0.371 6.808 1.00 . A A . 512 MET HG2 1 1 7 4315 1 1 15 MET HG3 H -10.931 0.160 6.120 1.00 . A A . 512 MET HG3 1 1 7 4316 1 1 15 MET N N -8.551 -0.111 2.783 1.00 . A A . 512 MET N 1 1 7 4317 1 1 15 MET O O -7.911 1.462 5.915 1.00 . A A . 512 MET O 1 1 7 4318 1 1 15 MET SD S -11.049 -2.086 6.907 1.00 . A A . 512 MET SD 1 1 7 4319 1 1 16 SER C C -4.284 0.970 4.688 1.00 . A A . 513 SER C 1 1 7 4320 1 1 16 SER CA C -5.411 0.331 5.503 1.00 . A A . 513 SER CA 1 1 7 4321 1 1 16 SER CB C -4.959 -0.998 6.105 1.00 . A A . 513 SER CB 1 1 7 4322 1 1 16 SER H H -6.500 -0.361 3.835 1.00 . A A . 513 SER H 1 1 7 4323 1 1 16 SER HA H -5.690 1.019 6.284 1.00 . A A . 513 SER HA 1 1 7 4324 1 1 16 SER HB2 H -4.563 -1.628 5.324 1.00 . A A . 513 SER HB2 1 1 7 4325 1 1 16 SER HB3 H -4.195 -0.815 6.846 1.00 . A A . 513 SER HB3 1 1 7 4326 1 1 16 SER HG H -6.536 -2.164 6.054 1.00 . A A . 513 SER HG 1 1 7 4327 1 1 16 SER N N -6.591 0.127 4.674 1.00 . A A . 513 SER N 1 1 7 4328 1 1 16 SER O O -4.252 0.851 3.471 1.00 . A A . 513 SER O 1 1 7 4329 1 1 16 SER OG O -6.047 -1.669 6.723 1.00 . A A . 513 SER OG 1 1 7 4330 1 1 17 GLU C C -0.926 1.908 5.112 1.00 . A A . 514 GLU C 1 1 7 4331 1 1 17 GLU CA C -2.312 2.395 4.684 1.00 . A A . 514 GLU CA 1 1 7 4332 1 1 17 GLU CB C -2.468 3.886 4.988 1.00 . A A . 514 GLU CB 1 1 7 4333 1 1 17 GLU CD C -2.916 5.645 6.727 1.00 . A A . 514 GLU CD 1 1 7 4334 1 1 17 GLU CG C -2.475 4.222 6.467 1.00 . A A . 514 GLU CG 1 1 7 4335 1 1 17 GLU H H -3.408 1.667 6.342 1.00 . A A . 514 GLU H 1 1 7 4336 1 1 17 GLU HA H -2.433 2.262 3.617 1.00 . A A . 514 GLU HA 1 1 7 4337 1 1 17 GLU HB2 H -1.651 4.421 4.525 1.00 . A A . 514 GLU HB2 1 1 7 4338 1 1 17 GLU HB3 H -3.398 4.230 4.559 1.00 . A A . 514 GLU HB3 1 1 7 4339 1 1 17 GLU HG2 H -3.151 3.550 6.975 1.00 . A A . 514 GLU HG2 1 1 7 4340 1 1 17 GLU HG3 H -1.476 4.091 6.856 1.00 . A A . 514 GLU HG3 1 1 7 4341 1 1 17 GLU N N -3.373 1.656 5.361 1.00 . A A . 514 GLU N 1 1 7 4342 1 1 17 GLU O O -0.760 1.364 6.208 1.00 . A A . 514 GLU O 1 1 7 4343 1 1 17 GLU OE1 O -2.289 6.575 6.183 1.00 . A A . 514 GLU OE1 1 1 7 4344 1 1 17 GLU OE2 O -3.893 5.840 7.480 1.00 . A A . 514 GLU OE2 1 1 7 4345 1 1 18 CYS C C 2.022 2.701 5.595 1.00 . A A . 515 CYS C 1 1 7 4346 1 1 18 CYS CA C 1.450 1.766 4.540 1.00 . A A . 515 CYS CA 1 1 7 4347 1 1 18 CYS CB C 2.327 1.829 3.268 1.00 . A A . 515 CYS CB 1 1 7 4348 1 1 18 CYS H H -0.137 2.548 3.392 1.00 . A A . 515 CYS H 1 1 7 4349 1 1 18 CYS HA H 1.492 0.777 4.980 1.00 . A A . 515 CYS HA 1 1 7 4350 1 1 18 CYS HB2 H 2.293 0.873 2.769 1.00 . A A . 515 CYS HB2 1 1 7 4351 1 1 18 CYS HB3 H 1.933 2.588 2.607 1.00 . A A . 515 CYS HB3 1 1 7 4352 1 1 18 CYS N N 0.064 2.119 4.246 1.00 . A A . 515 CYS N 1 1 7 4353 1 1 18 CYS O O 1.893 3.924 5.511 1.00 . A A . 515 CYS O 1 1 7 4354 1 1 18 CYS SG S 4.090 2.227 3.589 1.00 . A A . 515 CYS SG 1 1 7 4355 1 1 19 THR C C 4.797 3.012 6.947 1.00 . A A . 516 THR C 1 1 7 4356 1 1 19 THR CA C 3.425 2.826 7.578 1.00 . A A . 516 THR CA 1 1 7 4357 1 1 19 THR CB C 3.566 2.056 8.905 1.00 . A A . 516 THR CB 1 1 7 4358 1 1 19 THR CG2 C 4.301 2.886 9.947 1.00 . A A . 516 THR CG2 1 1 7 4359 1 1 19 THR H H 2.422 1.164 6.820 1.00 . A A . 516 THR H 1 1 7 4360 1 1 19 THR HA H 2.981 3.792 7.776 1.00 . A A . 516 THR HA 1 1 7 4361 1 1 19 THR HB H 4.132 1.155 8.719 1.00 . A A . 516 THR HB 1 1 7 4362 1 1 19 THR HG1 H 1.588 2.147 8.879 1.00 . A A . 516 THR HG1 1 1 7 4363 1 1 19 THR HG21 H 3.767 3.811 10.112 1.00 . A A . 516 THR HG21 1 1 7 4364 1 1 19 THR HG22 H 4.356 2.333 10.872 1.00 . A A . 516 THR HG22 1 1 7 4365 1 1 19 THR HG23 H 5.299 3.103 9.595 1.00 . A A . 516 THR HG23 1 1 7 4366 1 1 19 THR N N 2.583 2.107 6.651 1.00 . A A . 516 THR N 1 1 7 4367 1 1 19 THR O O 5.477 2.041 6.612 1.00 . A A . 516 THR O 1 1 7 4368 1 1 19 THR OG1 O 2.270 1.697 9.402 1.00 . A A . 516 THR OG1 1 1 7 4369 1 1 20 GLY C C 6.180 5.602 5.033 1.00 . A A . 517 GLY C 1 1 7 4370 1 1 20 GLY CA C 6.414 4.540 6.069 1.00 . A A . 517 GLY CA 1 1 7 4371 1 1 20 GLY H H 4.674 4.974 7.192 1.00 . A A . 517 GLY H 1 1 7 4372 1 1 20 GLY HA2 H 7.168 4.881 6.765 1.00 . A A . 517 GLY HA2 1 1 7 4373 1 1 20 GLY HA3 H 6.762 3.642 5.580 1.00 . A A . 517 GLY HA3 1 1 7 4374 1 1 20 GLY N N 5.198 4.249 6.790 1.00 . A A . 517 GLY N 1 1 7 4375 1 1 20 GLY O O 6.876 6.619 5.006 1.00 . A A . 517 GLY O 1 1 7 4376 1 1 21 CYS C C 3.242 6.391 3.192 1.00 . A A . 518 CYS C 1 1 7 4377 1 1 21 CYS CA C 4.758 6.403 3.263 1.00 . A A . 518 CYS CA 1 1 7 4378 1 1 21 CYS CB C 5.367 6.194 1.873 1.00 . A A . 518 CYS CB 1 1 7 4379 1 1 21 CYS H H 4.725 4.507 4.189 1.00 . A A . 518 CYS H 1 1 7 4380 1 1 21 CYS HA H 5.081 7.347 3.667 1.00 . A A . 518 CYS HA 1 1 7 4381 1 1 21 CYS HB2 H 5.291 7.113 1.313 1.00 . A A . 518 CYS HB2 1 1 7 4382 1 1 21 CYS HB3 H 6.409 5.932 1.979 1.00 . A A . 518 CYS HB3 1 1 7 4383 1 1 21 CYS N N 5.190 5.377 4.181 1.00 . A A . 518 CYS N 1 1 7 4384 1 1 21 CYS O O 2.618 5.336 3.256 1.00 . A A . 518 CYS O 1 1 7 4385 1 1 21 CYS SG S 4.567 4.885 0.892 1.00 . A A . 518 CYS SG 1 1 7 4386 1 1 22 HIS C C 0.766 8.133 1.633 1.00 . A A . 519 HIS C 1 1 7 4387 1 1 22 HIS CA C 1.196 7.644 3.000 1.00 . A A . 519 HIS CA 1 1 7 4388 1 1 22 HIS CB C 0.666 8.563 4.103 1.00 . A A . 519 HIS CB 1 1 7 4389 1 1 22 HIS CD2 C 2.187 8.206 6.174 1.00 . A A . 519 HIS CD2 1 1 7 4390 1 1 22 HIS CE1 C 0.765 7.126 7.437 1.00 . A A . 519 HIS CE1 1 1 7 4391 1 1 22 HIS CG C 1.027 8.101 5.482 1.00 . A A . 519 HIS CG 1 1 7 4392 1 1 22 HIS H H 3.190 8.373 2.988 1.00 . A A . 519 HIS H 1 1 7 4393 1 1 22 HIS HA H 0.800 6.650 3.150 1.00 . A A . 519 HIS HA 1 1 7 4394 1 1 22 HIS HB2 H 1.074 9.552 3.965 1.00 . A A . 519 HIS HB2 1 1 7 4395 1 1 22 HIS HB3 H -0.411 8.609 4.038 1.00 . A A . 519 HIS HB3 1 1 7 4396 1 1 22 HIS HD1 H -0.783 7.185 6.092 1.00 . A A . 519 HIS HD1 1 1 7 4397 1 1 22 HIS HD2 H 3.095 8.683 5.835 1.00 . A A . 519 HIS HD2 1 1 7 4398 1 1 22 HIS HE1 H 0.327 6.591 8.268 1.00 . A A . 519 HIS HE1 1 1 7 4399 1 1 22 HIS HE2 H 2.727 7.297 7.985 1.00 . A A . 519 HIS HE2 1 1 7 4400 1 1 22 HIS N N 2.646 7.555 3.054 1.00 . A A . 519 HIS N 1 1 7 4401 1 1 22 HIS ND1 N 0.158 7.422 6.305 1.00 . A A . 519 HIS ND1 1 1 7 4402 1 1 22 HIS NE2 N 1.999 7.588 7.385 1.00 . A A . 519 HIS NE2 1 1 7 4403 1 1 22 HIS O O -0.160 8.931 1.501 1.00 . A A . 519 HIS O 1 1 7 4404 1 1 23 LYS C C 0.207 7.006 -1.354 1.00 . A A . 520 LYS C 1 1 7 4405 1 1 23 LYS CA C 1.169 8.016 -0.756 1.00 . A A . 520 LYS CA 1 1 7 4406 1 1 23 LYS CB C 2.450 8.071 -1.594 1.00 . A A . 520 LYS CB 1 1 7 4407 1 1 23 LYS CD C 4.452 6.819 -2.505 1.00 . A A . 520 LYS CD 1 1 7 4408 1 1 23 LYS CE C 5.392 7.960 -2.158 1.00 . A A . 520 LYS CE 1 1 7 4409 1 1 23 LYS CG C 3.245 6.773 -1.578 1.00 . A A . 520 LYS CG 1 1 7 4410 1 1 23 LYS H H 2.237 7.071 0.800 1.00 . A A . 520 LYS H 1 1 7 4411 1 1 23 LYS HA H 0.701 8.990 -0.758 1.00 . A A . 520 LYS HA 1 1 7 4412 1 1 23 LYS HB2 H 2.187 8.295 -2.618 1.00 . A A . 520 LYS HB2 1 1 7 4413 1 1 23 LYS HB3 H 3.081 8.860 -1.212 1.00 . A A . 520 LYS HB3 1 1 7 4414 1 1 23 LYS HD2 H 4.993 5.888 -2.421 1.00 . A A . 520 LYS HD2 1 1 7 4415 1 1 23 LYS HD3 H 4.107 6.945 -3.521 1.00 . A A . 520 LYS HD3 1 1 7 4416 1 1 23 LYS HE2 H 6.256 7.908 -2.805 1.00 . A A . 520 LYS HE2 1 1 7 4417 1 1 23 LYS HE3 H 4.877 8.894 -2.322 1.00 . A A . 520 LYS HE3 1 1 7 4418 1 1 23 LYS HG2 H 3.592 6.593 -0.572 1.00 . A A . 520 LYS HG2 1 1 7 4419 1 1 23 LYS HG3 H 2.598 5.963 -1.886 1.00 . A A . 520 LYS HG3 1 1 7 4420 1 1 23 LYS HZ1 H 5.922 6.910 -0.432 1.00 . A A . 520 LYS HZ1 1 1 7 4421 1 1 23 LYS HZ2 H 6.778 8.357 -0.648 1.00 . A A . 520 LYS HZ2 1 1 7 4422 1 1 23 LYS HZ3 H 5.164 8.396 -0.126 1.00 . A A . 520 LYS HZ3 1 1 7 4423 1 1 23 LYS N N 1.477 7.667 0.618 1.00 . A A . 520 LYS N 1 1 7 4424 1 1 23 LYS NZ N 5.845 7.899 -0.743 1.00 . A A . 520 LYS NZ 1 1 7 4425 1 1 23 LYS O O -0.526 7.319 -2.292 1.00 . A A . 520 LYS O 1 1 7 4426 1 1 24 VAL C C -1.458 4.093 -0.234 1.00 . A A . 521 VAL C 1 1 7 4427 1 1 24 VAL CA C -0.627 4.724 -1.344 1.00 . A A . 521 VAL CA 1 1 7 4428 1 1 24 VAL CB C 0.217 3.620 -2.025 1.00 . A A . 521 VAL CB 1 1 7 4429 1 1 24 VAL CG1 C 0.921 4.155 -3.262 1.00 . A A . 521 VAL CG1 1 1 7 4430 1 1 24 VAL CG2 C 1.224 3.027 -1.051 1.00 . A A . 521 VAL CG2 1 1 7 4431 1 1 24 VAL H H 0.758 5.609 -0.024 1.00 . A A . 521 VAL H 1 1 7 4432 1 1 24 VAL HA H -1.290 5.150 -2.082 1.00 . A A . 521 VAL HA 1 1 7 4433 1 1 24 VAL HB H -0.453 2.832 -2.337 1.00 . A A . 521 VAL HB 1 1 7 4434 1 1 24 VAL HG11 H 1.533 5.000 -2.990 1.00 . A A . 521 VAL HG11 1 1 7 4435 1 1 24 VAL HG12 H 1.545 3.379 -3.684 1.00 . A A . 521 VAL HG12 1 1 7 4436 1 1 24 VAL HG13 H 0.186 4.463 -3.991 1.00 . A A . 521 VAL HG13 1 1 7 4437 1 1 24 VAL HG21 H 0.704 2.631 -0.191 1.00 . A A . 521 VAL HG21 1 1 7 4438 1 1 24 VAL HG22 H 1.774 2.233 -1.536 1.00 . A A . 521 VAL HG22 1 1 7 4439 1 1 24 VAL HG23 H 1.911 3.797 -0.731 1.00 . A A . 521 VAL HG23 1 1 7 4440 1 1 24 VAL N N 0.208 5.791 -0.817 1.00 . A A . 521 VAL N 1 1 7 4441 1 1 24 VAL O O -1.136 4.227 0.949 1.00 . A A . 521 VAL O 1 1 7 4442 1 1 25 ASN C C -3.541 1.259 -0.064 1.00 . A A . 522 ASN C 1 1 7 4443 1 1 25 ASN CA C -3.376 2.713 0.328 1.00 . A A . 522 ASN CA 1 1 7 4444 1 1 25 ASN CB C -4.755 3.373 0.456 1.00 . A A . 522 ASN CB 1 1 7 4445 1 1 25 ASN CG C -5.072 4.319 -0.677 1.00 . A A . 522 ASN CG 1 1 7 4446 1 1 25 ASN H H -2.732 3.349 -1.577 1.00 . A A . 522 ASN H 1 1 7 4447 1 1 25 ASN HA H -2.892 2.743 1.290 1.00 . A A . 522 ASN HA 1 1 7 4448 1 1 25 ASN HB2 H -5.512 2.602 0.468 1.00 . A A . 522 ASN HB2 1 1 7 4449 1 1 25 ASN HB3 H -4.795 3.924 1.384 1.00 . A A . 522 ASN HB3 1 1 7 4450 1 1 25 ASN HD21 H -5.668 2.798 -1.803 1.00 . A A . 522 ASN HD21 1 1 7 4451 1 1 25 ASN HD22 H -5.783 4.373 -2.525 1.00 . A A . 522 ASN HD22 1 1 7 4452 1 1 25 ASN N N -2.522 3.408 -0.623 1.00 . A A . 522 ASN N 1 1 7 4453 1 1 25 ASN ND2 N -5.553 3.777 -1.778 1.00 . A A . 522 ASN ND2 1 1 7 4454 1 1 25 ASN O O -3.443 0.894 -1.237 1.00 . A A . 522 ASN O 1 1 7 4455 1 1 25 ASN OD1 O -4.860 5.528 -0.571 1.00 . A A . 522 ASN OD1 1 1 7 4456 1 1 26 TYR C C -5.338 -1.338 1.385 1.00 . A A . 523 TYR C 1 1 7 4457 1 1 26 TYR CA C -3.999 -0.973 0.775 1.00 . A A . 523 TYR CA 1 1 7 4458 1 1 26 TYR CB C -2.894 -1.779 1.469 1.00 . A A . 523 TYR CB 1 1 7 4459 1 1 26 TYR CD1 C -0.716 -0.501 1.405 1.00 . A A . 523 TYR CD1 1 1 7 4460 1 1 26 TYR CD2 C -0.954 -2.393 -0.021 1.00 . A A . 523 TYR CD2 1 1 7 4461 1 1 26 TYR CE1 C 0.569 -0.304 0.935 1.00 . A A . 523 TYR CE1 1 1 7 4462 1 1 26 TYR CE2 C 0.326 -2.201 -0.498 1.00 . A A . 523 TYR CE2 1 1 7 4463 1 1 26 TYR CG C -1.498 -1.547 0.934 1.00 . A A . 523 TYR CG 1 1 7 4464 1 1 26 TYR CZ C 1.084 -1.157 -0.016 1.00 . A A . 523 TYR CZ 1 1 7 4465 1 1 26 TYR H H -3.910 0.845 1.835 1.00 . A A . 523 TYR H 1 1 7 4466 1 1 26 TYR HA H -4.012 -1.195 -0.282 1.00 . A A . 523 TYR HA 1 1 7 4467 1 1 26 TYR HB2 H -2.886 -1.527 2.518 1.00 . A A . 523 TYR HB2 1 1 7 4468 1 1 26 TYR HB3 H -3.115 -2.833 1.364 1.00 . A A . 523 TYR HB3 1 1 7 4469 1 1 26 TYR HD1 H -1.125 0.168 2.149 1.00 . A A . 523 TYR HD1 1 1 7 4470 1 1 26 TYR HD2 H -1.549 -3.211 -0.396 1.00 . A A . 523 TYR HD2 1 1 7 4471 1 1 26 TYR HE1 H 1.161 0.515 1.313 1.00 . A A . 523 TYR HE1 1 1 7 4472 1 1 26 TYR HE2 H 0.731 -2.869 -1.243 1.00 . A A . 523 TYR HE2 1 1 7 4473 1 1 26 TYR HH H 2.418 -1.228 -1.419 1.00 . A A . 523 TYR HH 1 1 7 4474 1 1 26 TYR N N -3.796 0.449 0.939 1.00 . A A . 523 TYR N 1 1 7 4475 1 1 26 TYR O O -6.085 -0.459 1.803 1.00 . A A . 523 TYR O 1 1 7 4476 1 1 26 TYR OH O 2.365 -0.970 -0.480 1.00 . A A . 523 TYR OH 1 1 7 4477 1 1 27 CYS C C -6.535 -3.669 3.467 1.00 . A A . 524 CYS C 1 1 7 4478 1 1 27 CYS CA C -6.854 -3.058 2.109 1.00 . A A . 524 CYS CA 1 1 7 4479 1 1 27 CYS CB C -7.564 -4.072 1.210 1.00 . A A . 524 CYS CB 1 1 7 4480 1 1 27 CYS H H -4.978 -3.282 1.176 1.00 . A A . 524 CYS H 1 1 7 4481 1 1 27 CYS HA H -7.489 -2.197 2.252 1.00 . A A . 524 CYS HA 1 1 7 4482 1 1 27 CYS HB2 H -8.487 -4.375 1.681 1.00 . A A . 524 CYS HB2 1 1 7 4483 1 1 27 CYS HB3 H -7.787 -3.602 0.264 1.00 . A A . 524 CYS HB3 1 1 7 4484 1 1 27 CYS N N -5.624 -2.616 1.484 1.00 . A A . 524 CYS N 1 1 7 4485 1 1 27 CYS O O -7.173 -3.372 4.481 1.00 . A A . 524 CYS O 1 1 7 4486 1 1 27 CYS SG S -6.605 -5.579 0.865 1.00 . A A . 524 CYS SG 1 1 7 4487 1 1 28 SER C C -3.558 -5.347 4.640 1.00 . A A . 525 SER C 1 1 7 4488 1 1 28 SER CA C -5.076 -5.213 4.642 1.00 . A A . 525 SER CA 1 1 7 4489 1 1 28 SER CB C -5.745 -6.593 4.659 1.00 . A A . 525 SER CB 1 1 7 4490 1 1 28 SER H H -4.997 -4.598 2.633 1.00 . A A . 525 SER H 1 1 7 4491 1 1 28 SER HA H -5.382 -4.655 5.516 1.00 . A A . 525 SER HA 1 1 7 4492 1 1 28 SER HB2 H -6.818 -6.468 4.676 1.00 . A A . 525 SER HB2 1 1 7 4493 1 1 28 SER HB3 H -5.464 -7.134 3.767 1.00 . A A . 525 SER HB3 1 1 7 4494 1 1 28 SER HG H -5.481 -6.820 6.596 1.00 . A A . 525 SER HG 1 1 7 4495 1 1 28 SER N N -5.498 -4.485 3.466 1.00 . A A . 525 SER N 1 1 7 4496 1 1 28 SER O O -2.911 -5.069 3.623 1.00 . A A . 525 SER O 1 1 7 4497 1 1 28 SER OG O -5.361 -7.353 5.792 1.00 . A A . 525 SER OG 1 1 7 4498 1 1 29 THR C C -1.029 -6.975 4.872 1.00 . A A . 526 THR C 1 1 7 4499 1 1 29 THR CA C -1.555 -5.942 5.877 1.00 . A A . 526 THR CA 1 1 7 4500 1 1 29 THR CB C -1.181 -6.365 7.309 1.00 . A A . 526 THR CB 1 1 7 4501 1 1 29 THR CG2 C 0.321 -6.276 7.536 1.00 . A A . 526 THR CG2 1 1 7 4502 1 1 29 THR H H -3.564 -5.966 6.539 1.00 . A A . 526 THR H 1 1 7 4503 1 1 29 THR HA H -1.092 -4.988 5.674 1.00 . A A . 526 THR HA 1 1 7 4504 1 1 29 THR HB H -1.497 -7.385 7.466 1.00 . A A . 526 THR HB 1 1 7 4505 1 1 29 THR HG1 H -1.881 -5.958 9.110 1.00 . A A . 526 THR HG1 1 1 7 4506 1 1 29 THR HG21 H 0.649 -5.259 7.381 1.00 . A A . 526 THR HG21 1 1 7 4507 1 1 29 THR HG22 H 0.551 -6.577 8.547 1.00 . A A . 526 THR HG22 1 1 7 4508 1 1 29 THR HG23 H 0.830 -6.929 6.842 1.00 . A A . 526 THR HG23 1 1 7 4509 1 1 29 THR N N -2.995 -5.772 5.759 1.00 . A A . 526 THR N 1 1 7 4510 1 1 29 THR O O 0.140 -6.935 4.482 1.00 . A A . 526 THR O 1 1 7 4511 1 1 29 THR OG1 O -1.851 -5.516 8.247 1.00 . A A . 526 THR OG1 1 1 7 4512 1 1 30 PHE C C -1.002 -8.306 2.179 1.00 . A A . 527 PHE C 1 1 7 4513 1 1 30 PHE CA C -1.512 -8.919 3.483 1.00 . A A . 527 PHE CA 1 1 7 4514 1 1 30 PHE CB C -2.696 -9.847 3.189 1.00 . A A . 527 PHE CB 1 1 7 4515 1 1 30 PHE CD1 C -1.783 -12.058 2.415 1.00 . A A . 527 PHE CD1 1 1 7 4516 1 1 30 PHE CD2 C -2.776 -10.615 0.797 1.00 . A A . 527 PHE CD2 1 1 7 4517 1 1 30 PHE CE1 C -1.518 -12.986 1.426 1.00 . A A . 527 PHE CE1 1 1 7 4518 1 1 30 PHE CE2 C -2.513 -11.538 -0.194 1.00 . A A . 527 PHE CE2 1 1 7 4519 1 1 30 PHE CG C -2.415 -10.862 2.114 1.00 . A A . 527 PHE CG 1 1 7 4520 1 1 30 PHE CZ C -1.882 -12.725 0.121 1.00 . A A . 527 PHE CZ 1 1 7 4521 1 1 30 PHE H H -2.816 -7.878 4.789 1.00 . A A . 527 PHE H 1 1 7 4522 1 1 30 PHE HA H -0.717 -9.497 3.930 1.00 . A A . 527 PHE HA 1 1 7 4523 1 1 30 PHE HB2 H -2.959 -10.381 4.089 1.00 . A A . 527 PHE HB2 1 1 7 4524 1 1 30 PHE HB3 H -3.540 -9.250 2.871 1.00 . A A . 527 PHE HB3 1 1 7 4525 1 1 30 PHE HD1 H -1.496 -12.262 3.436 1.00 . A A . 527 PHE HD1 1 1 7 4526 1 1 30 PHE HD2 H -3.269 -9.686 0.549 1.00 . A A . 527 PHE HD2 1 1 7 4527 1 1 30 PHE HE1 H -1.024 -13.915 1.674 1.00 . A A . 527 PHE HE1 1 1 7 4528 1 1 30 PHE HE2 H -2.798 -11.329 -1.214 1.00 . A A . 527 PHE HE2 1 1 7 4529 1 1 30 PHE HZ H -1.676 -13.451 -0.653 1.00 . A A . 527 PHE HZ 1 1 7 4530 1 1 30 PHE N N -1.902 -7.885 4.437 1.00 . A A . 527 PHE N 1 1 7 4531 1 1 30 PHE O O 0.089 -8.651 1.717 1.00 . A A . 527 PHE O 1 1 7 4532 1 1 31 CYS C C -0.104 -5.836 0.688 1.00 . A A . 528 CYS C 1 1 7 4533 1 1 31 CYS CA C -1.323 -6.701 0.393 1.00 . A A . 528 CYS CA 1 1 7 4534 1 1 31 CYS CB C -2.428 -5.848 -0.225 1.00 . A A . 528 CYS CB 1 1 7 4535 1 1 31 CYS H H -2.629 -7.155 1.999 1.00 . A A . 528 CYS H 1 1 7 4536 1 1 31 CYS HA H -1.031 -7.473 -0.305 1.00 . A A . 528 CYS HA 1 1 7 4537 1 1 31 CYS HB2 H -2.898 -5.270 0.556 1.00 . A A . 528 CYS HB2 1 1 7 4538 1 1 31 CYS HB3 H -1.982 -5.170 -0.939 1.00 . A A . 528 CYS HB3 1 1 7 4539 1 1 31 CYS N N -1.766 -7.383 1.601 1.00 . A A . 528 CYS N 1 1 7 4540 1 1 31 CYS O O 0.784 -5.712 -0.144 1.00 . A A . 528 CYS O 1 1 7 4541 1 1 31 CYS SG S -3.748 -6.769 -1.087 1.00 . A A . 528 CYS SG 1 1 7 4542 1 1 32 GLN C C 2.360 -5.117 2.204 1.00 . A A . 529 GLN C 1 1 7 4543 1 1 32 GLN CA C 1.032 -4.362 2.269 1.00 . A A . 529 GLN CA 1 1 7 4544 1 1 32 GLN CB C 0.792 -3.806 3.686 1.00 . A A . 529 GLN CB 1 1 7 4545 1 1 32 GLN CD C 2.586 -2.076 4.113 1.00 . A A . 529 GLN CD 1 1 7 4546 1 1 32 GLN CG C 2.060 -3.454 4.447 1.00 . A A . 529 GLN CG 1 1 7 4547 1 1 32 GLN H H -0.771 -5.441 2.532 1.00 . A A . 529 GLN H 1 1 7 4548 1 1 32 GLN HA H 1.055 -3.545 1.561 1.00 . A A . 529 GLN HA 1 1 7 4549 1 1 32 GLN HB2 H 0.198 -2.900 3.611 1.00 . A A . 529 GLN HB2 1 1 7 4550 1 1 32 GLN HB3 H 0.243 -4.539 4.262 1.00 . A A . 529 GLN HB3 1 1 7 4551 1 1 32 GLN HE21 H 3.651 -2.805 2.602 1.00 . A A . 529 GLN HE21 1 1 7 4552 1 1 32 GLN HE22 H 3.772 -1.097 2.862 1.00 . A A . 529 GLN HE22 1 1 7 4553 1 1 32 GLN HG2 H 1.854 -3.495 5.507 1.00 . A A . 529 GLN HG2 1 1 7 4554 1 1 32 GLN HG3 H 2.821 -4.181 4.203 1.00 . A A . 529 GLN HG3 1 1 7 4555 1 1 32 GLN N N -0.066 -5.247 1.882 1.00 . A A . 529 GLN N 1 1 7 4556 1 1 32 GLN NE2 N 3.420 -1.984 3.091 1.00 . A A . 529 GLN NE2 1 1 7 4557 1 1 32 GLN O O 3.342 -4.633 1.639 1.00 . A A . 529 GLN O 1 1 7 4558 1 1 32 GLN OE1 O 2.240 -1.099 4.771 1.00 . A A . 529 GLN OE1 1 1 7 4559 1 1 33 ARG C C 3.848 -7.744 1.448 1.00 . A A . 530 ARG C 1 1 7 4560 1 1 33 ARG CA C 3.577 -7.125 2.820 1.00 . A A . 530 ARG CA 1 1 7 4561 1 1 33 ARG CB C 3.459 -8.213 3.880 1.00 . A A . 530 ARG CB 1 1 7 4562 1 1 33 ARG CD C 3.094 -8.820 6.285 1.00 . A A . 530 ARG CD 1 1 7 4563 1 1 33 ARG CG C 3.218 -7.683 5.284 1.00 . A A . 530 ARG CG 1 1 7 4564 1 1 33 ARG CZ C 1.724 -10.853 6.574 1.00 . A A . 530 ARG CZ 1 1 7 4565 1 1 33 ARG H H 1.549 -6.637 3.206 1.00 . A A . 530 ARG H 1 1 7 4566 1 1 33 ARG HA H 4.394 -6.464 3.062 1.00 . A A . 530 ARG HA 1 1 7 4567 1 1 33 ARG HB2 H 2.634 -8.856 3.618 1.00 . A A . 530 ARG HB2 1 1 7 4568 1 1 33 ARG HB3 H 4.370 -8.793 3.887 1.00 . A A . 530 ARG HB3 1 1 7 4569 1 1 33 ARG HD2 H 4.070 -9.254 6.440 1.00 . A A . 530 ARG HD2 1 1 7 4570 1 1 33 ARG HD3 H 2.723 -8.424 7.219 1.00 . A A . 530 ARG HD3 1 1 7 4571 1 1 33 ARG HE H 1.919 -9.840 4.864 1.00 . A A . 530 ARG HE 1 1 7 4572 1 1 33 ARG HG2 H 4.049 -7.054 5.569 1.00 . A A . 530 ARG HG2 1 1 7 4573 1 1 33 ARG HG3 H 2.305 -7.105 5.291 1.00 . A A . 530 ARG HG3 1 1 7 4574 1 1 33 ARG HH11 H 2.586 -10.186 8.289 1.00 . A A . 530 ARG HH11 1 1 7 4575 1 1 33 ARG HH12 H 1.668 -11.660 8.441 1.00 . A A . 530 ARG HH12 1 1 7 4576 1 1 33 ARG HH21 H 0.724 -11.745 5.055 1.00 . A A . 530 ARG HH21 1 1 7 4577 1 1 33 ARG HH22 H 0.619 -12.559 6.590 1.00 . A A . 530 ARG HH22 1 1 7 4578 1 1 33 ARG N N 2.377 -6.302 2.797 1.00 . A A . 530 ARG N 1 1 7 4579 1 1 33 ARG NE N 2.182 -9.862 5.816 1.00 . A A . 530 ARG NE 1 1 7 4580 1 1 33 ARG NH1 N 2.015 -10.903 7.870 1.00 . A A . 530 ARG NH1 1 1 7 4581 1 1 33 ARG NH2 N 0.956 -11.790 6.032 1.00 . A A . 530 ARG NH2 1 1 7 4582 1 1 33 ARG O O 4.996 -7.979 1.076 1.00 . A A . 530 ARG O 1 1 7 4583 1 1 34 LYS C C 3.424 -7.617 -1.632 1.00 . A A . 531 LYS C 1 1 7 4584 1 1 34 LYS CA C 2.899 -8.627 -0.614 1.00 . A A . 531 LYS CA 1 1 7 4585 1 1 34 LYS CB C 1.535 -9.193 -1.038 1.00 . A A . 531 LYS CB 1 1 7 4586 1 1 34 LYS CD C 1.255 -8.988 -3.534 1.00 . A A . 531 LYS CD 1 1 7 4587 1 1 34 LYS CE C 1.126 -9.739 -4.849 1.00 . A A . 531 LYS CE 1 1 7 4588 1 1 34 LYS CG C 1.522 -9.929 -2.370 1.00 . A A . 531 LYS CG 1 1 7 4589 1 1 34 LYS H H 1.893 -7.809 1.062 1.00 . A A . 531 LYS H 1 1 7 4590 1 1 34 LYS HA H 3.607 -9.441 -0.538 1.00 . A A . 531 LYS HA 1 1 7 4591 1 1 34 LYS HB2 H 1.198 -9.880 -0.276 1.00 . A A . 531 LYS HB2 1 1 7 4592 1 1 34 LYS HB3 H 0.830 -8.376 -1.098 1.00 . A A . 531 LYS HB3 1 1 7 4593 1 1 34 LYS HD2 H 0.337 -8.452 -3.346 1.00 . A A . 531 LYS HD2 1 1 7 4594 1 1 34 LYS HD3 H 2.074 -8.285 -3.608 1.00 . A A . 531 LYS HD3 1 1 7 4595 1 1 34 LYS HE2 H 2.099 -10.114 -5.134 1.00 . A A . 531 LYS HE2 1 1 7 4596 1 1 34 LYS HE3 H 0.446 -10.567 -4.714 1.00 . A A . 531 LYS HE3 1 1 7 4597 1 1 34 LYS HG2 H 2.480 -10.403 -2.517 1.00 . A A . 531 LYS HG2 1 1 7 4598 1 1 34 LYS HG3 H 0.747 -10.682 -2.343 1.00 . A A . 531 LYS HG3 1 1 7 4599 1 1 34 LYS HZ1 H -0.260 -8.383 -5.615 1.00 . A A . 531 LYS HZ1 1 1 7 4600 1 1 34 LYS HZ2 H 1.316 -8.134 -6.174 1.00 . A A . 531 LYS HZ2 1 1 7 4601 1 1 34 LYS HZ3 H 0.399 -9.421 -6.782 1.00 . A A . 531 LYS HZ3 1 1 7 4602 1 1 34 LYS N N 2.783 -8.014 0.705 1.00 . A A . 531 LYS N 1 1 7 4603 1 1 34 LYS NZ N 0.611 -8.859 -5.928 1.00 . A A . 531 LYS NZ 1 1 7 4604 1 1 34 LYS O O 4.303 -7.928 -2.437 1.00 . A A . 531 LYS O 1 1 7 4605 1 1 35 ASP C C 4.732 -4.845 -2.041 1.00 . A A . 532 ASP C 1 1 7 4606 1 1 35 ASP CA C 3.343 -5.317 -2.445 1.00 . A A . 532 ASP CA 1 1 7 4607 1 1 35 ASP CB C 2.347 -4.156 -2.378 1.00 . A A . 532 ASP CB 1 1 7 4608 1 1 35 ASP CG C 2.646 -3.051 -3.374 1.00 . A A . 532 ASP CG 1 1 7 4609 1 1 35 ASP H H 2.178 -6.211 -0.931 1.00 . A A . 532 ASP H 1 1 7 4610 1 1 35 ASP HA H 3.377 -5.689 -3.460 1.00 . A A . 532 ASP HA 1 1 7 4611 1 1 35 ASP HB2 H 1.354 -4.531 -2.578 1.00 . A A . 532 ASP HB2 1 1 7 4612 1 1 35 ASP HB3 H 2.369 -3.732 -1.384 1.00 . A A . 532 ASP HB3 1 1 7 4613 1 1 35 ASP N N 2.904 -6.399 -1.569 1.00 . A A . 532 ASP N 1 1 7 4614 1 1 35 ASP O O 5.427 -4.210 -2.820 1.00 . A A . 532 ASP O 1 1 7 4615 1 1 35 ASP OD1 O 2.632 -3.327 -4.591 1.00 . A A . 532 ASP OD1 1 1 7 4616 1 1 35 ASP OD2 O 2.884 -1.901 -2.944 1.00 . A A . 532 ASP OD2 1 1 7 4617 1 1 36 TRP C C 7.602 -5.213 -1.164 1.00 . A A . 533 TRP C 1 1 7 4618 1 1 36 TRP CA C 6.430 -4.820 -0.271 1.00 . A A . 533 TRP CA 1 1 7 4619 1 1 36 TRP CB C 6.627 -5.427 1.119 1.00 . A A . 533 TRP CB 1 1 7 4620 1 1 36 TRP CD1 C 8.979 -5.627 2.107 1.00 . A A . 533 TRP CD1 1 1 7 4621 1 1 36 TRP CD2 C 8.095 -3.575 2.251 1.00 . A A . 533 TRP CD2 1 1 7 4622 1 1 36 TRP CE2 C 9.381 -3.550 2.819 1.00 . A A . 533 TRP CE2 1 1 7 4623 1 1 36 TRP CE3 C 7.342 -2.397 2.229 1.00 . A A . 533 TRP CE3 1 1 7 4624 1 1 36 TRP CG C 7.855 -4.916 1.806 1.00 . A A . 533 TRP CG 1 1 7 4625 1 1 36 TRP CH2 C 9.181 -1.248 3.314 1.00 . A A . 533 TRP CH2 1 1 7 4626 1 1 36 TRP CZ2 C 9.938 -2.390 3.350 1.00 . A A . 533 TRP CZ2 1 1 7 4627 1 1 36 TRP CZ3 C 7.893 -1.245 2.759 1.00 . A A . 533 TRP CZ3 1 1 7 4628 1 1 36 TRP H H 4.579 -5.844 -0.314 1.00 . A A . 533 TRP H 1 1 7 4629 1 1 36 TRP HA H 6.416 -3.747 -0.160 1.00 . A A . 533 TRP HA 1 1 7 4630 1 1 36 TRP HB2 H 5.775 -5.188 1.737 1.00 . A A . 533 TRP HB2 1 1 7 4631 1 1 36 TRP HB3 H 6.716 -6.499 1.031 1.00 . A A . 533 TRP HB3 1 1 7 4632 1 1 36 TRP HD1 H 9.111 -6.676 1.893 1.00 . A A . 533 TRP HD1 1 1 7 4633 1 1 36 TRP HE1 H 10.794 -5.097 3.032 1.00 . A A . 533 TRP HE1 1 1 7 4634 1 1 36 TRP HE3 H 6.347 -2.376 1.807 1.00 . A A . 533 TRP HE3 1 1 7 4635 1 1 36 TRP HH2 H 9.573 -0.325 3.717 1.00 . A A . 533 TRP HH2 1 1 7 4636 1 1 36 TRP HZ2 H 10.930 -2.378 3.774 1.00 . A A . 533 TRP HZ2 1 1 7 4637 1 1 36 TRP HZ3 H 7.328 -0.324 2.748 1.00 . A A . 533 TRP HZ3 1 1 7 4638 1 1 36 TRP N N 5.152 -5.246 -0.840 1.00 . A A . 533 TRP N 1 1 7 4639 1 1 36 TRP NE1 N 9.902 -4.813 2.718 1.00 . A A . 533 TRP NE1 1 1 7 4640 1 1 36 TRP O O 8.636 -4.564 -1.165 1.00 . A A . 533 TRP O 1 1 7 4641 1 1 37 LYS C C 8.813 -5.731 -3.885 1.00 . A A . 534 LYS C 1 1 7 4642 1 1 37 LYS CA C 8.481 -6.760 -2.812 1.00 . A A . 534 LYS CA 1 1 7 4643 1 1 37 LYS CB C 8.089 -8.107 -3.420 1.00 . A A . 534 LYS CB 1 1 7 4644 1 1 37 LYS CD C 7.403 -10.486 -2.964 1.00 . A A . 534 LYS CD 1 1 7 4645 1 1 37 LYS CE C 7.452 -11.622 -1.957 1.00 . A A . 534 LYS CE 1 1 7 4646 1 1 37 LYS CG C 7.994 -9.214 -2.385 1.00 . A A . 534 LYS CG 1 1 7 4647 1 1 37 LYS H H 6.570 -6.732 -1.909 1.00 . A A . 534 LYS H 1 1 7 4648 1 1 37 LYS HA H 9.385 -6.877 -2.234 1.00 . A A . 534 LYS HA 1 1 7 4649 1 1 37 LYS HB2 H 7.126 -8.008 -3.901 1.00 . A A . 534 LYS HB2 1 1 7 4650 1 1 37 LYS HB3 H 8.826 -8.392 -4.157 1.00 . A A . 534 LYS HB3 1 1 7 4651 1 1 37 LYS HD2 H 6.374 -10.303 -3.237 1.00 . A A . 534 LYS HD2 1 1 7 4652 1 1 37 LYS HD3 H 7.966 -10.768 -3.842 1.00 . A A . 534 LYS HD3 1 1 7 4653 1 1 37 LYS HE2 H 6.989 -12.493 -2.396 1.00 . A A . 534 LYS HE2 1 1 7 4654 1 1 37 LYS HE3 H 8.485 -11.839 -1.734 1.00 . A A . 534 LYS HE3 1 1 7 4655 1 1 37 LYS HG2 H 8.986 -9.430 -2.017 1.00 . A A . 534 LYS HG2 1 1 7 4656 1 1 37 LYS HG3 H 7.372 -8.878 -1.570 1.00 . A A . 534 LYS HG3 1 1 7 4657 1 1 37 LYS HZ1 H 5.726 -11.156 -0.866 1.00 . A A . 534 LYS HZ1 1 1 7 4658 1 1 37 LYS HZ2 H 6.867 -12.058 -0.001 1.00 . A A . 534 LYS HZ2 1 1 7 4659 1 1 37 LYS HZ3 H 7.132 -10.412 -0.281 1.00 . A A . 534 LYS HZ3 1 1 7 4660 1 1 37 LYS N N 7.429 -6.272 -1.930 1.00 . A A . 534 LYS N 1 1 7 4661 1 1 37 LYS NZ N 6.746 -11.289 -0.692 1.00 . A A . 534 LYS NZ 1 1 7 4662 1 1 37 LYS O O 9.967 -5.613 -4.293 1.00 . A A . 534 LYS O 1 1 7 4663 1 1 38 ASP C C 8.220 -2.583 -4.345 1.00 . A A . 535 ASP C 1 1 7 4664 1 1 38 ASP CA C 8.098 -3.831 -5.189 1.00 . A A . 535 ASP CA 1 1 7 4665 1 1 38 ASP CB C 6.979 -3.614 -6.199 1.00 . A A . 535 ASP CB 1 1 7 4666 1 1 38 ASP CG C 7.370 -2.638 -7.289 1.00 . A A . 535 ASP CG 1 1 7 4667 1 1 38 ASP H H 6.900 -5.176 -4.065 1.00 . A A . 535 ASP H 1 1 7 4668 1 1 38 ASP HA H 9.028 -4.018 -5.700 1.00 . A A . 535 ASP HA 1 1 7 4669 1 1 38 ASP HB2 H 6.724 -4.546 -6.647 1.00 . A A . 535 ASP HB2 1 1 7 4670 1 1 38 ASP HB3 H 6.114 -3.221 -5.686 1.00 . A A . 535 ASP HB3 1 1 7 4671 1 1 38 ASP N N 7.825 -4.975 -4.327 1.00 . A A . 535 ASP N 1 1 7 4672 1 1 38 ASP O O 9.088 -1.745 -4.531 1.00 . A A . 535 ASP O 1 1 7 4673 1 1 38 ASP OD1 O 7.140 -1.426 -7.119 1.00 . A A . 535 ASP OD1 1 1 7 4674 1 1 38 ASP OD2 O 7.902 -3.083 -8.327 1.00 . A A . 535 ASP OD2 1 1 7 4675 1 1 39 HIS C C 8.407 -0.939 -1.837 1.00 . A A . 536 HIS C 1 1 7 4676 1 1 39 HIS CA C 7.159 -1.298 -2.625 1.00 . A A . 536 HIS CA 1 1 7 4677 1 1 39 HIS CB C 5.958 -1.458 -1.691 1.00 . A A . 536 HIS CB 1 1 7 4678 1 1 39 HIS CD2 C 5.352 0.208 0.191 1.00 . A A . 536 HIS CD2 1 1 7 4679 1 1 39 HIS CE1 C 4.542 1.814 -1.011 1.00 . A A . 536 HIS CE1 1 1 7 4680 1 1 39 HIS CG C 5.452 -0.182 -1.105 1.00 . A A . 536 HIS CG 1 1 7 4681 1 1 39 HIS H H 6.812 -3.288 -3.166 1.00 . A A . 536 HIS H 1 1 7 4682 1 1 39 HIS HA H 6.954 -0.510 -3.343 1.00 . A A . 536 HIS HA 1 1 7 4683 1 1 39 HIS HB2 H 5.146 -1.911 -2.240 1.00 . A A . 536 HIS HB2 1 1 7 4684 1 1 39 HIS HB3 H 6.238 -2.111 -0.875 1.00 . A A . 536 HIS HB3 1 1 7 4685 1 1 39 HIS HD1 H 4.832 0.864 -2.835 1.00 . A A . 536 HIS HD1 1 1 7 4686 1 1 39 HIS HD2 H 5.661 -0.362 1.053 1.00 . A A . 536 HIS HD2 1 1 7 4687 1 1 39 HIS HE1 H 4.102 2.753 -1.312 1.00 . A A . 536 HIS HE1 1 1 7 4688 1 1 39 HIS N N 7.352 -2.504 -3.379 1.00 . A A . 536 HIS N 1 1 7 4689 1 1 39 HIS ND1 N 4.932 0.852 -1.857 1.00 . A A . 536 HIS ND1 1 1 7 4690 1 1 39 HIS NE2 N 4.772 1.463 0.234 1.00 . A A . 536 HIS NE2 1 1 7 4691 1 1 39 HIS O O 8.687 0.224 -1.636 1.00 . A A . 536 HIS O 1 1 7 4692 1 1 40 GLN C C 11.379 -0.836 -1.361 1.00 . A A . 537 GLN C 1 1 7 4693 1 1 40 GLN CA C 10.355 -1.676 -0.597 1.00 . A A . 537 GLN CA 1 1 7 4694 1 1 40 GLN CB C 10.993 -2.979 -0.114 1.00 . A A . 537 GLN CB 1 1 7 4695 1 1 40 GLN CD C 12.076 -5.167 -0.735 1.00 . A A . 537 GLN CD 1 1 7 4696 1 1 40 GLN CG C 11.568 -3.831 -1.231 1.00 . A A . 537 GLN CG 1 1 7 4697 1 1 40 GLN H H 8.903 -2.873 -1.600 1.00 . A A . 537 GLN H 1 1 7 4698 1 1 40 GLN HA H 10.032 -1.099 0.257 1.00 . A A . 537 GLN HA 1 1 7 4699 1 1 40 GLN HB2 H 11.788 -2.742 0.576 1.00 . A A . 537 GLN HB2 1 1 7 4700 1 1 40 GLN HB3 H 10.244 -3.560 0.404 1.00 . A A . 537 GLN HB3 1 1 7 4701 1 1 40 GLN HE21 H 10.273 -5.960 -0.961 1.00 . A A . 537 GLN HE21 1 1 7 4702 1 1 40 GLN HE22 H 11.494 -7.026 -0.362 1.00 . A A . 537 GLN HE22 1 1 7 4703 1 1 40 GLN HG2 H 10.800 -4.003 -1.977 1.00 . A A . 537 GLN HG2 1 1 7 4704 1 1 40 GLN HG3 H 12.390 -3.296 -1.680 1.00 . A A . 537 GLN HG3 1 1 7 4705 1 1 40 GLN N N 9.161 -1.938 -1.399 1.00 . A A . 537 GLN N 1 1 7 4706 1 1 40 GLN NE2 N 11.193 -6.151 -0.682 1.00 . A A . 537 GLN NE2 1 1 7 4707 1 1 40 GLN O O 12.092 -0.034 -0.761 1.00 . A A . 537 GLN O 1 1 7 4708 1 1 40 GLN OE1 O 13.247 -5.311 -0.389 1.00 . A A . 537 GLN OE1 1 1 7 4709 1 1 41 HIS C C 11.854 1.167 -3.748 1.00 . A A . 538 HIS C 1 1 7 4710 1 1 41 HIS CA C 12.413 -0.223 -3.457 1.00 . A A . 538 HIS CA 1 1 7 4711 1 1 41 HIS CB C 12.858 -0.940 -4.754 1.00 . A A . 538 HIS CB 1 1 7 4712 1 1 41 HIS CD2 C 11.024 -1.787 -6.377 1.00 . A A . 538 HIS CD2 1 1 7 4713 1 1 41 HIS CE1 C 10.943 -0.034 -7.660 1.00 . A A . 538 HIS CE1 1 1 7 4714 1 1 41 HIS CG C 11.906 -0.866 -5.922 1.00 . A A . 538 HIS CG 1 1 7 4715 1 1 41 HIS H H 10.910 -1.689 -3.118 1.00 . A A . 538 HIS H 1 1 7 4716 1 1 41 HIS HA H 13.286 -0.095 -2.830 1.00 . A A . 538 HIS HA 1 1 7 4717 1 1 41 HIS HB2 H 13.791 -0.511 -5.079 1.00 . A A . 538 HIS HB2 1 1 7 4718 1 1 41 HIS HB3 H 13.018 -1.984 -4.527 1.00 . A A . 538 HIS HB3 1 1 7 4719 1 1 41 HIS HD2 H 10.790 -2.736 -5.919 1.00 . A A . 538 HIS HD2 1 1 7 4720 1 1 41 HIS HE1 H 10.642 0.653 -8.438 1.00 . A A . 538 HIS HE1 1 1 7 4721 1 1 41 HIS HE2 H 9.577 -1.573 -7.885 1.00 . A A . 538 HIS HE2 1 1 7 4722 1 1 41 HIS N N 11.463 -1.009 -2.680 1.00 . A A . 538 HIS N 1 1 7 4723 1 1 41 HIS ND1 N 11.852 0.239 -6.737 1.00 . A A . 538 HIS ND1 1 1 7 4724 1 1 41 HIS NE2 N 10.417 -1.251 -7.484 1.00 . A A . 538 HIS NE2 1 1 7 4725 1 1 41 HIS O O 12.610 2.095 -4.032 1.00 . A A . 538 HIS O 1 1 7 4726 1 1 42 ILE C C 9.746 3.395 -2.600 1.00 . A A . 539 ILE C 1 1 7 4727 1 1 42 ILE CA C 9.926 2.621 -3.915 1.00 . A A . 539 ILE CA 1 1 7 4728 1 1 42 ILE CB C 8.575 2.486 -4.694 1.00 . A A . 539 ILE CB 1 1 7 4729 1 1 42 ILE CD1 C 6.690 3.625 -3.402 1.00 . A A . 539 ILE CD1 1 1 7 4730 1 1 42 ILE CG1 C 7.352 2.318 -3.787 1.00 . A A . 539 ILE CG1 1 1 7 4731 1 1 42 ILE CG2 C 8.642 1.324 -5.662 1.00 . A A . 539 ILE CG2 1 1 7 4732 1 1 42 ILE H H 9.957 0.543 -3.499 1.00 . A A . 539 ILE H 1 1 7 4733 1 1 42 ILE HA H 10.608 3.179 -4.539 1.00 . A A . 539 ILE HA 1 1 7 4734 1 1 42 ILE HB H 8.447 3.372 -5.278 1.00 . A A . 539 ILE HB 1 1 7 4735 1 1 42 ILE HD11 H 6.337 4.125 -4.292 1.00 . A A . 539 ILE HD11 1 1 7 4736 1 1 42 ILE HD12 H 5.855 3.427 -2.747 1.00 . A A . 539 ILE HD12 1 1 7 4737 1 1 42 ILE HD13 H 7.405 4.255 -2.895 1.00 . A A . 539 ILE HD13 1 1 7 4738 1 1 42 ILE HG12 H 6.620 1.721 -4.301 1.00 . A A . 539 ILE HG12 1 1 7 4739 1 1 42 ILE HG13 H 7.649 1.815 -2.880 1.00 . A A . 539 ILE HG13 1 1 7 4740 1 1 42 ILE HG21 H 8.856 0.414 -5.118 1.00 . A A . 539 ILE HG21 1 1 7 4741 1 1 42 ILE HG22 H 7.697 1.225 -6.175 1.00 . A A . 539 ILE HG22 1 1 7 4742 1 1 42 ILE HG23 H 9.426 1.501 -6.384 1.00 . A A . 539 ILE HG23 1 1 7 4743 1 1 42 ILE N N 10.534 1.321 -3.673 1.00 . A A . 539 ILE N 1 1 7 4744 1 1 42 ILE O O 10.085 4.579 -2.519 1.00 . A A . 539 ILE O 1 1 7 4745 1 1 43 CYS C C 10.157 3.981 0.279 1.00 . A A . 540 CYS C 1 1 7 4746 1 1 43 CYS CA C 8.909 3.317 -0.308 1.00 . A A . 540 CYS CA 1 1 7 4747 1 1 43 CYS CB C 8.402 2.227 0.642 1.00 . A A . 540 CYS CB 1 1 7 4748 1 1 43 CYS H H 8.972 1.762 -1.731 1.00 . A A . 540 CYS H 1 1 7 4749 1 1 43 CYS HA H 8.130 4.053 -0.425 1.00 . A A . 540 CYS HA 1 1 7 4750 1 1 43 CYS HB2 H 7.751 1.561 0.096 1.00 . A A . 540 CYS HB2 1 1 7 4751 1 1 43 CYS HB3 H 9.248 1.667 1.016 1.00 . A A . 540 CYS HB3 1 1 7 4752 1 1 43 CYS N N 9.206 2.714 -1.595 1.00 . A A . 540 CYS N 1 1 7 4753 1 1 43 CYS O O 11.189 3.340 0.494 1.00 . A A . 540 CYS O 1 1 7 4754 1 1 43 CYS SG S 7.469 2.843 2.082 1.00 . A A . 540 CYS SG 1 1 7 4755 1 1 44 GLY C C 11.250 7.384 0.293 1.00 . A A . 541 GLY C 1 1 7 4756 1 1 44 GLY CA C 11.169 6.046 0.982 1.00 . A A . 541 GLY CA 1 1 7 4757 1 1 44 GLY H H 9.160 5.697 0.394 1.00 . A A . 541 GLY H 1 1 7 4758 1 1 44 GLY HA2 H 11.071 6.203 2.046 1.00 . A A . 541 GLY HA2 1 1 7 4759 1 1 44 GLY HA3 H 12.079 5.495 0.791 1.00 . A A . 541 GLY HA3 1 1 7 4760 1 1 44 GLY N N 10.040 5.272 0.511 1.00 . A A . 541 GLY N 1 1 7 4761 1 1 44 GLY O O 11.834 8.331 0.819 1.00 . A A . 541 GLY O 1 1 7 4762 1 1 45 GLN C C 9.342 9.474 -1.178 1.00 . A A . 542 GLN C 1 1 7 4763 1 1 45 GLN CA C 10.579 8.708 -1.629 1.00 . A A . 542 GLN CA 1 1 7 4764 1 1 45 GLN CB C 10.520 8.425 -3.129 1.00 . A A . 542 GLN CB 1 1 7 4765 1 1 45 GLN CD C 11.510 7.146 -5.060 1.00 . A A . 542 GLN CD 1 1 7 4766 1 1 45 GLN CG C 11.706 7.623 -3.640 1.00 . A A . 542 GLN CG 1 1 7 4767 1 1 45 GLN H H 10.292 6.649 -1.293 1.00 . A A . 542 GLN H 1 1 7 4768 1 1 45 GLN HA H 11.458 9.293 -1.412 1.00 . A A . 542 GLN HA 1 1 7 4769 1 1 45 GLN HB2 H 9.617 7.873 -3.345 1.00 . A A . 542 GLN HB2 1 1 7 4770 1 1 45 GLN HB3 H 10.494 9.365 -3.660 1.00 . A A . 542 GLN HB3 1 1 7 4771 1 1 45 GLN HE21 H 10.614 5.510 -4.392 1.00 . A A . 542 GLN HE21 1 1 7 4772 1 1 45 GLN HE22 H 10.751 5.648 -6.112 1.00 . A A . 542 GLN HE22 1 1 7 4773 1 1 45 GLN HG2 H 12.589 8.243 -3.604 1.00 . A A . 542 GLN HG2 1 1 7 4774 1 1 45 GLN HG3 H 11.846 6.762 -3.002 1.00 . A A . 542 GLN HG3 1 1 7 4775 1 1 45 GLN N N 10.670 7.458 -0.894 1.00 . A A . 542 GLN N 1 1 7 4776 1 1 45 GLN NE2 N 10.898 5.985 -5.204 1.00 . A A . 542 GLN NE2 1 1 7 4777 1 1 45 GLN O O 8.350 8.861 -0.766 1.00 . A A . 542 GLN O 1 1 7 4778 1 1 45 GLN OE1 O 11.894 7.821 -6.015 1.00 . A A . 542 GLN OE1 1 1 7 4779 1 1 46 SER C C 8.017 11.381 0.684 1.00 . A A . 543 SER C 1 1 7 4780 1 1 46 SER CA C 8.317 11.659 -0.791 1.00 . A A . 543 SER CA 1 1 7 4781 1 1 46 SER CB C 7.063 11.457 -1.658 1.00 . A A . 543 SER CB 1 1 7 4782 1 1 46 SER H H 10.204 11.218 -1.647 1.00 . A A . 543 SER H 1 1 7 4783 1 1 46 SER HA H 8.647 12.684 -0.886 1.00 . A A . 543 SER HA 1 1 7 4784 1 1 46 SER HB2 H 7.280 11.757 -2.672 1.00 . A A . 543 SER HB2 1 1 7 4785 1 1 46 SER HB3 H 6.787 10.413 -1.645 1.00 . A A . 543 SER HB3 1 1 7 4786 1 1 46 SER HG H 5.910 12.132 -0.223 1.00 . A A . 543 SER HG 1 1 7 4787 1 1 46 SER N N 9.403 10.801 -1.257 1.00 . A A . 543 SER N 1 1 7 4788 1 1 46 SER O O 6.886 11.051 1.057 1.00 . A A . 543 SER O 1 1 7 4789 1 1 46 SER OG O 5.967 12.226 -1.183 1.00 . A A . 543 SER OG 1 1 7 4790 1 1 47 ALA C C 9.480 12.417 3.731 1.00 . A A . 544 ALA C 1 1 7 4791 1 1 47 ALA CA C 8.892 11.260 2.938 1.00 . A A . 544 ALA CA 1 1 7 4792 1 1 47 ALA CB C 9.551 9.940 3.328 1.00 . A A . 544 ALA CB 1 1 7 4793 1 1 47 ALA H H 9.917 11.777 1.163 1.00 . A A . 544 ALA H 1 1 7 4794 1 1 47 ALA HA H 7.835 11.188 3.155 1.00 . A A . 544 ALA HA 1 1 7 4795 1 1 47 ALA HB1 H 10.608 9.986 3.111 1.00 . A A . 544 ALA HB1 1 1 7 4796 1 1 47 ALA HB2 H 9.408 9.764 4.385 1.00 . A A . 544 ALA HB2 1 1 7 4797 1 1 47 ALA HB3 H 9.103 9.135 2.764 1.00 . A A . 544 ALA HB3 1 1 7 4798 1 1 47 ALA N N 9.040 11.501 1.514 1.00 . A A . 544 ALA N 1 1 7 4799 1 1 47 ALA O O 10.534 12.235 4.368 1.00 . A A . 544 ALA O 1 1 7 4800 1 1 47 ALA OXT O 8.902 13.522 3.683 1.00 . A A . 544 ALA OXT 1 1 7 4801 2 2 1 ZN ZN ZN -5.562 -5.400 -1.157 1.00 . B A . 601 ZN ZN 1 1 7 4802 3 2 1 ZN ZN ZN 5.199 2.793 1.640 1.00 . C A . 602 ZN ZN 1 1 8 4803 1 1 1 GLY C C -15.392 3.472 3.825 1.00 . A A . 498 GLY C 1 1 8 4804 1 1 1 GLY CA C -16.066 4.698 4.400 1.00 . A A . 498 GLY CA 1 1 8 4805 1 1 1 GLY H1 H -17.784 4.562 3.234 1.00 . A A . 498 GLY H1 1 1 8 4806 1 1 1 GLY H2 H -16.567 5.532 2.560 1.00 . A A . 498 GLY H2 1 1 8 4807 1 1 1 GLY H3 H -17.500 6.109 3.854 1.00 . A A . 498 GLY H3 1 1 8 4808 1 1 1 GLY HA2 H -15.314 5.442 4.620 1.00 . A A . 498 GLY HA2 1 1 8 4809 1 1 1 GLY HA3 H -16.574 4.427 5.313 1.00 . A A . 498 GLY HA3 1 1 8 4810 1 1 1 GLY N N -17.049 5.266 3.449 1.00 . A A . 498 GLY N 1 1 8 4811 1 1 1 GLY O O -16.063 2.489 3.509 1.00 . A A . 498 GLY O 1 1 8 4812 1 1 2 ALA C C -13.673 2.187 1.640 1.00 . A A . 499 ALA C 1 1 8 4813 1 1 2 ALA CA C -13.281 2.449 3.097 1.00 . A A . 499 ALA CA 1 1 8 4814 1 1 2 ALA CB C -13.413 1.180 3.933 1.00 . A A . 499 ALA CB 1 1 8 4815 1 1 2 ALA H H -13.602 4.362 3.950 1.00 . A A . 499 ALA H 1 1 8 4816 1 1 2 ALA HA H -12.244 2.754 3.120 1.00 . A A . 499 ALA HA 1 1 8 4817 1 1 2 ALA HB1 H -14.437 0.839 3.913 1.00 . A A . 499 ALA HB1 1 1 8 4818 1 1 2 ALA HB2 H -12.770 0.413 3.525 1.00 . A A . 499 ALA HB2 1 1 8 4819 1 1 2 ALA HB3 H -13.121 1.388 4.952 1.00 . A A . 499 ALA HB3 1 1 8 4820 1 1 2 ALA N N -14.070 3.543 3.670 1.00 . A A . 499 ALA N 1 1 8 4821 1 1 2 ALA O O -13.453 1.100 1.111 1.00 . A A . 499 ALA O 1 1 8 4822 1 1 3 MET C C -14.191 4.382 -1.121 1.00 . A A . 500 MET C 1 1 8 4823 1 1 3 MET CA C -14.618 3.109 -0.405 1.00 . A A . 500 MET CA 1 1 8 4824 1 1 3 MET CB C -16.126 2.901 -0.575 1.00 . A A . 500 MET CB 1 1 8 4825 1 1 3 MET CE C -18.623 -0.326 0.318 1.00 . A A . 500 MET CE 1 1 8 4826 1 1 3 MET CG C -16.627 1.557 -0.067 1.00 . A A . 500 MET CG 1 1 8 4827 1 1 3 MET H H -14.452 4.024 1.494 1.00 . A A . 500 MET H 1 1 8 4828 1 1 3 MET HA H -14.092 2.270 -0.837 1.00 . A A . 500 MET HA 1 1 8 4829 1 1 3 MET HB2 H -16.643 3.681 -0.035 1.00 . A A . 500 MET HB2 1 1 8 4830 1 1 3 MET HB3 H -16.371 2.981 -1.625 1.00 . A A . 500 MET HB3 1 1 8 4831 1 1 3 MET HE1 H -18.310 -0.347 1.352 1.00 . A A . 500 MET HE1 1 1 8 4832 1 1 3 MET HE2 H -19.665 -0.600 0.251 1.00 . A A . 500 MET HE2 1 1 8 4833 1 1 3 MET HE3 H -18.031 -1.029 -0.250 1.00 . A A . 500 MET HE3 1 1 8 4834 1 1 3 MET HG2 H -16.092 0.771 -0.578 1.00 . A A . 500 MET HG2 1 1 8 4835 1 1 3 MET HG3 H -16.433 1.492 0.995 1.00 . A A . 500 MET HG3 1 1 8 4836 1 1 3 MET N N -14.257 3.195 1.002 1.00 . A A . 500 MET N 1 1 8 4837 1 1 3 MET O O -14.688 4.710 -2.195 1.00 . A A . 500 MET O 1 1 8 4838 1 1 3 MET SD S -18.396 1.323 -0.345 1.00 . A A . 500 MET SD 1 1 8 4839 1 1 4 GLU C C -11.346 6.123 -1.561 1.00 . A A . 501 GLU C 1 1 8 4840 1 1 4 GLU CA C -12.761 6.351 -1.048 1.00 . A A . 501 GLU CA 1 1 8 4841 1 1 4 GLU CB C -12.761 7.463 0.013 1.00 . A A . 501 GLU CB 1 1 8 4842 1 1 4 GLU CD C -14.516 6.758 1.718 1.00 . A A . 501 GLU CD 1 1 8 4843 1 1 4 GLU CG C -14.124 7.749 0.636 1.00 . A A . 501 GLU CG 1 1 8 4844 1 1 4 GLU H H -12.928 4.792 0.370 1.00 . A A . 501 GLU H 1 1 8 4845 1 1 4 GLU HA H -13.393 6.640 -1.873 1.00 . A A . 501 GLU HA 1 1 8 4846 1 1 4 GLU HB2 H -12.087 7.180 0.806 1.00 . A A . 501 GLU HB2 1 1 8 4847 1 1 4 GLU HB3 H -12.400 8.374 -0.441 1.00 . A A . 501 GLU HB3 1 1 8 4848 1 1 4 GLU HG2 H -14.103 8.737 1.072 1.00 . A A . 501 GLU HG2 1 1 8 4849 1 1 4 GLU HG3 H -14.871 7.721 -0.145 1.00 . A A . 501 GLU HG3 1 1 8 4850 1 1 4 GLU N N -13.276 5.108 -0.494 1.00 . A A . 501 GLU N 1 1 8 4851 1 1 4 GLU O O -10.727 7.000 -2.167 1.00 . A A . 501 GLU O 1 1 8 4852 1 1 4 GLU OE1 O -14.041 6.899 2.862 1.00 . A A . 501 GLU OE1 1 1 8 4853 1 1 4 GLU OE2 O -15.320 5.841 1.440 1.00 . A A . 501 GLU OE2 1 1 8 4854 1 1 5 GLN C C -9.527 3.131 -2.279 1.00 . A A . 502 GLN C 1 1 8 4855 1 1 5 GLN CA C -9.509 4.526 -1.671 1.00 . A A . 502 GLN CA 1 1 8 4856 1 1 5 GLN CB C -8.578 4.560 -0.445 1.00 . A A . 502 GLN CB 1 1 8 4857 1 1 5 GLN CD C -10.138 4.515 1.556 1.00 . A A . 502 GLN CD 1 1 8 4858 1 1 5 GLN CG C -9.066 3.779 0.773 1.00 . A A . 502 GLN CG 1 1 8 4859 1 1 5 GLN H H -11.436 4.258 -0.879 1.00 . A A . 502 GLN H 1 1 8 4860 1 1 5 GLN HA H -9.133 5.223 -2.401 1.00 . A A . 502 GLN HA 1 1 8 4861 1 1 5 GLN HB2 H -7.620 4.155 -0.732 1.00 . A A . 502 GLN HB2 1 1 8 4862 1 1 5 GLN HB3 H -8.442 5.590 -0.149 1.00 . A A . 502 GLN HB3 1 1 8 4863 1 1 5 GLN HE21 H -8.744 5.488 2.577 1.00 . A A . 502 GLN HE21 1 1 8 4864 1 1 5 GLN HE22 H -10.386 5.878 2.969 1.00 . A A . 502 GLN HE22 1 1 8 4865 1 1 5 GLN HG2 H -9.471 2.835 0.440 1.00 . A A . 502 GLN HG2 1 1 8 4866 1 1 5 GLN HG3 H -8.225 3.598 1.426 1.00 . A A . 502 GLN HG3 1 1 8 4867 1 1 5 GLN N N -10.857 4.920 -1.314 1.00 . A A . 502 GLN N 1 1 8 4868 1 1 5 GLN NE2 N -9.716 5.376 2.460 1.00 . A A . 502 GLN NE2 1 1 8 4869 1 1 5 GLN O O -10.391 2.319 -1.952 1.00 . A A . 502 GLN O 1 1 8 4870 1 1 5 GLN OE1 O -11.334 4.326 1.340 1.00 . A A . 502 GLN OE1 1 1 8 4871 1 1 6 SER C C -7.162 0.911 -3.467 1.00 . A A . 503 SER C 1 1 8 4872 1 1 6 SER CA C -8.498 1.555 -3.803 1.00 . A A . 503 SER CA 1 1 8 4873 1 1 6 SER CB C -8.658 1.687 -5.316 1.00 . A A . 503 SER CB 1 1 8 4874 1 1 6 SER H H -7.957 3.570 -3.435 1.00 . A A . 503 SER H 1 1 8 4875 1 1 6 SER HA H -9.293 0.940 -3.415 1.00 . A A . 503 SER HA 1 1 8 4876 1 1 6 SER HB2 H -7.852 2.287 -5.712 1.00 . A A . 503 SER HB2 1 1 8 4877 1 1 6 SER HB3 H -8.633 0.707 -5.766 1.00 . A A . 503 SER HB3 1 1 8 4878 1 1 6 SER HG H -10.042 3.041 -5.030 1.00 . A A . 503 SER HG 1 1 8 4879 1 1 6 SER N N -8.598 2.865 -3.178 1.00 . A A . 503 SER N 1 1 8 4880 1 1 6 SER O O -6.118 1.541 -3.595 1.00 . A A . 503 SER O 1 1 8 4881 1 1 6 SER OG O -9.891 2.308 -5.638 1.00 . A A . 503 SER OG 1 1 8 4882 1 1 7 CYS C C -5.089 -1.147 -3.903 1.00 . A A . 504 CYS C 1 1 8 4883 1 1 7 CYS CA C -5.989 -1.059 -2.683 1.00 . A A . 504 CYS CA 1 1 8 4884 1 1 7 CYS CB C -6.338 -2.457 -2.177 1.00 . A A . 504 CYS CB 1 1 8 4885 1 1 7 CYS H H -8.068 -0.801 -2.964 1.00 . A A . 504 CYS H 1 1 8 4886 1 1 7 CYS HA H -5.481 -0.519 -1.896 1.00 . A A . 504 CYS HA 1 1 8 4887 1 1 7 CYS HB2 H -7.070 -2.369 -1.389 1.00 . A A . 504 CYS HB2 1 1 8 4888 1 1 7 CYS HB3 H -6.764 -3.025 -2.990 1.00 . A A . 504 CYS HB3 1 1 8 4889 1 1 7 CYS N N -7.200 -0.341 -3.035 1.00 . A A . 504 CYS N 1 1 8 4890 1 1 7 CYS O O -5.502 -1.631 -4.959 1.00 . A A . 504 CYS O 1 1 8 4891 1 1 7 CYS SG S -4.938 -3.406 -1.513 1.00 . A A . 504 CYS SG 1 1 8 4892 1 1 8 VAL C C -2.533 -2.042 -5.268 1.00 . A A . 505 VAL C 1 1 8 4893 1 1 8 VAL CA C -2.920 -0.625 -4.848 1.00 . A A . 505 VAL CA 1 1 8 4894 1 1 8 VAL CB C -1.656 0.186 -4.467 1.00 . A A . 505 VAL CB 1 1 8 4895 1 1 8 VAL CG1 C -0.898 -0.482 -3.331 1.00 . A A . 505 VAL CG1 1 1 8 4896 1 1 8 VAL CG2 C -0.748 0.387 -5.672 1.00 . A A . 505 VAL CG2 1 1 8 4897 1 1 8 VAL H H -3.614 -0.276 -2.881 1.00 . A A . 505 VAL H 1 1 8 4898 1 1 8 VAL HA H -3.396 -0.131 -5.686 1.00 . A A . 505 VAL HA 1 1 8 4899 1 1 8 VAL HB H -1.976 1.160 -4.123 1.00 . A A . 505 VAL HB 1 1 8 4900 1 1 8 VAL HG11 H -0.575 -1.465 -3.642 1.00 . A A . 505 VAL HG11 1 1 8 4901 1 1 8 VAL HG12 H -0.036 0.117 -3.075 1.00 . A A . 505 VAL HG12 1 1 8 4902 1 1 8 VAL HG13 H -1.543 -0.572 -2.470 1.00 . A A . 505 VAL HG13 1 1 8 4903 1 1 8 VAL HG21 H -1.280 0.936 -6.437 1.00 . A A . 505 VAL HG21 1 1 8 4904 1 1 8 VAL HG22 H 0.129 0.941 -5.375 1.00 . A A . 505 VAL HG22 1 1 8 4905 1 1 8 VAL HG23 H -0.451 -0.575 -6.063 1.00 . A A . 505 VAL HG23 1 1 8 4906 1 1 8 VAL N N -3.873 -0.653 -3.753 1.00 . A A . 505 VAL N 1 1 8 4907 1 1 8 VAL O O -2.066 -2.262 -6.386 1.00 . A A . 505 VAL O 1 1 8 4908 1 1 9 ASN C C -3.524 -5.199 -5.210 1.00 . A A . 506 ASN C 1 1 8 4909 1 1 9 ASN CA C -2.356 -4.376 -4.669 1.00 . A A . 506 ASN CA 1 1 8 4910 1 1 9 ASN CB C -1.761 -5.031 -3.420 1.00 . A A . 506 ASN CB 1 1 8 4911 1 1 9 ASN CG C -1.202 -6.414 -3.697 1.00 . A A . 506 ASN CG 1 1 8 4912 1 1 9 ASN H H -3.153 -2.806 -3.511 1.00 . A A . 506 ASN H 1 1 8 4913 1 1 9 ASN HA H -1.591 -4.338 -5.433 1.00 . A A . 506 ASN HA 1 1 8 4914 1 1 9 ASN HB2 H -0.961 -4.409 -3.042 1.00 . A A . 506 ASN HB2 1 1 8 4915 1 1 9 ASN HB3 H -2.530 -5.118 -2.665 1.00 . A A . 506 ASN HB3 1 1 8 4916 1 1 9 ASN HD21 H -2.841 -7.261 -2.955 1.00 . A A . 506 ASN HD21 1 1 8 4917 1 1 9 ASN HD22 H -1.632 -8.343 -3.555 1.00 . A A . 506 ASN HD22 1 1 8 4918 1 1 9 ASN N N -2.749 -3.010 -4.382 1.00 . A A . 506 ASN N 1 1 8 4919 1 1 9 ASN ND2 N -1.965 -7.443 -3.369 1.00 . A A . 506 ASN ND2 1 1 8 4920 1 1 9 ASN O O -3.324 -6.059 -6.068 1.00 . A A . 506 ASN O 1 1 8 4921 1 1 9 ASN OD1 O -0.075 -6.557 -4.163 1.00 . A A . 506 ASN OD1 1 1 8 4922 1 1 10 CYS C C -7.029 -4.862 -5.749 1.00 . A A . 507 CYS C 1 1 8 4923 1 1 10 CYS CA C -5.869 -5.732 -5.224 1.00 . A A . 507 CYS CA 1 1 8 4924 1 1 10 CYS CB C -6.319 -6.765 -4.172 1.00 . A A . 507 CYS CB 1 1 8 4925 1 1 10 CYS H H -4.890 -4.238 -4.079 1.00 . A A . 507 CYS H 1 1 8 4926 1 1 10 CYS HA H -5.492 -6.284 -6.072 1.00 . A A . 507 CYS HA 1 1 8 4927 1 1 10 CYS HB2 H -6.996 -7.456 -4.643 1.00 . A A . 507 CYS HB2 1 1 8 4928 1 1 10 CYS HB3 H -5.447 -7.311 -3.838 1.00 . A A . 507 CYS HB3 1 1 8 4929 1 1 10 CYS N N -4.747 -4.947 -4.738 1.00 . A A . 507 CYS N 1 1 8 4930 1 1 10 CYS O O -7.200 -4.753 -6.965 1.00 . A A . 507 CYS O 1 1 8 4931 1 1 10 CYS SG S -7.161 -6.120 -2.689 1.00 . A A . 507 CYS SG 1 1 8 4932 1 1 11 GLY C C -9.556 -2.507 -4.344 1.00 . A A . 508 GLY C 1 1 8 4933 1 1 11 GLY CA C -8.982 -3.493 -5.353 1.00 . A A . 508 GLY CA 1 1 8 4934 1 1 11 GLY H H -7.610 -4.274 -3.912 1.00 . A A . 508 GLY H 1 1 8 4935 1 1 11 GLY HA2 H -8.698 -2.947 -6.243 1.00 . A A . 508 GLY HA2 1 1 8 4936 1 1 11 GLY HA3 H -9.753 -4.199 -5.618 1.00 . A A . 508 GLY HA3 1 1 8 4937 1 1 11 GLY N N -7.816 -4.235 -4.873 1.00 . A A . 508 GLY N 1 1 8 4938 1 1 11 GLY O O -9.004 -2.324 -3.267 1.00 . A A . 508 GLY O 1 1 8 4939 1 1 12 ARG C C -11.672 -1.283 -2.466 1.00 . A A . 509 ARG C 1 1 8 4940 1 1 12 ARG CA C -11.348 -0.837 -3.891 1.00 . A A . 509 ARG CA 1 1 8 4941 1 1 12 ARG CB C -12.654 -0.421 -4.558 1.00 . A A . 509 ARG CB 1 1 8 4942 1 1 12 ARG CD C -13.854 0.354 -6.600 1.00 . A A . 509 ARG CD 1 1 8 4943 1 1 12 ARG CG C -12.499 0.105 -5.969 1.00 . A A . 509 ARG CG 1 1 8 4944 1 1 12 ARG CZ C -14.768 1.406 -8.635 1.00 . A A . 509 ARG CZ 1 1 8 4945 1 1 12 ARG H H -11.044 -2.039 -5.611 1.00 . A A . 509 ARG H 1 1 8 4946 1 1 12 ARG HA H -10.697 0.022 -3.848 1.00 . A A . 509 ARG HA 1 1 8 4947 1 1 12 ARG HB2 H -13.310 -1.277 -4.592 1.00 . A A . 509 ARG HB2 1 1 8 4948 1 1 12 ARG HB3 H -13.116 0.349 -3.960 1.00 . A A . 509 ARG HB3 1 1 8 4949 1 1 12 ARG HD2 H -14.375 -0.588 -6.671 1.00 . A A . 509 ARG HD2 1 1 8 4950 1 1 12 ARG HD3 H -14.415 1.029 -5.969 1.00 . A A . 509 ARG HD3 1 1 8 4951 1 1 12 ARG HE H -12.841 0.978 -8.332 1.00 . A A . 509 ARG HE 1 1 8 4952 1 1 12 ARG HG2 H -11.943 1.032 -5.942 1.00 . A A . 509 ARG HG2 1 1 8 4953 1 1 12 ARG HG3 H -11.965 -0.624 -6.559 1.00 . A A . 509 ARG HG3 1 1 8 4954 1 1 12 ARG HH11 H -16.170 0.935 -7.237 1.00 . A A . 509 ARG HH11 1 1 8 4955 1 1 12 ARG HH12 H -16.780 1.704 -8.672 1.00 . A A . 509 ARG HH12 1 1 8 4956 1 1 12 ARG HH21 H -13.623 1.968 -10.209 1.00 . A A . 509 ARG HH21 1 1 8 4957 1 1 12 ARG HH22 H -15.327 2.284 -10.380 1.00 . A A . 509 ARG HH22 1 1 8 4958 1 1 12 ARG N N -10.676 -1.869 -4.711 1.00 . A A . 509 ARG N 1 1 8 4959 1 1 12 ARG NE N -13.740 0.935 -7.935 1.00 . A A . 509 ARG NE 1 1 8 4960 1 1 12 ARG NH1 N -16.004 1.342 -8.143 1.00 . A A . 509 ARG NH1 1 1 8 4961 1 1 12 ARG NH2 N -14.557 1.928 -9.835 1.00 . A A . 509 ARG NH2 1 1 8 4962 1 1 12 ARG O O -12.083 -0.472 -1.642 1.00 . A A . 509 ARG O 1 1 8 4963 1 1 13 GLU C C -10.766 -2.520 0.175 1.00 . A A . 510 GLU C 1 1 8 4964 1 1 13 GLU CA C -11.729 -3.124 -0.870 1.00 . A A . 510 GLU CA 1 1 8 4965 1 1 13 GLU CB C -11.610 -4.648 -0.925 1.00 . A A . 510 GLU CB 1 1 8 4966 1 1 13 GLU CD C -12.810 -6.768 -0.259 1.00 . A A . 510 GLU CD 1 1 8 4967 1 1 13 GLU CG C -12.457 -5.349 0.123 1.00 . A A . 510 GLU CG 1 1 8 4968 1 1 13 GLU H H -11.256 -3.153 -2.935 1.00 . A A . 510 GLU H 1 1 8 4969 1 1 13 GLU HA H -12.734 -2.871 -0.582 1.00 . A A . 510 GLU HA 1 1 8 4970 1 1 13 GLU HB2 H -11.923 -4.988 -1.901 1.00 . A A . 510 GLU HB2 1 1 8 4971 1 1 13 GLU HB3 H -10.577 -4.924 -0.770 1.00 . A A . 510 GLU HB3 1 1 8 4972 1 1 13 GLU HG2 H -11.907 -5.373 1.052 1.00 . A A . 510 GLU HG2 1 1 8 4973 1 1 13 GLU HG3 H -13.371 -4.793 0.261 1.00 . A A . 510 GLU HG3 1 1 8 4974 1 1 13 GLU N N -11.511 -2.562 -2.200 1.00 . A A . 510 GLU N 1 1 8 4975 1 1 13 GLU O O -10.781 -2.913 1.341 1.00 . A A . 510 GLU O 1 1 8 4976 1 1 13 GLU OE1 O -13.666 -6.953 -1.152 1.00 . A A . 510 GLU OE1 1 1 8 4977 1 1 13 GLU OE2 O -12.257 -7.703 0.352 1.00 . A A . 510 GLU OE2 1 1 8 4978 1 1 14 ALA C C -9.497 -0.378 1.884 1.00 . A A . 511 ALA C 1 1 8 4979 1 1 14 ALA CA C -8.926 -0.898 0.559 1.00 . A A . 511 ALA CA 1 1 8 4980 1 1 14 ALA CB C -8.320 0.271 -0.209 1.00 . A A . 511 ALA CB 1 1 8 4981 1 1 14 ALA H H -9.968 -1.348 -1.223 1.00 . A A . 511 ALA H 1 1 8 4982 1 1 14 ALA HA H -8.131 -1.595 0.774 1.00 . A A . 511 ALA HA 1 1 8 4983 1 1 14 ALA HB1 H -7.923 -0.082 -1.149 1.00 . A A . 511 ALA HB1 1 1 8 4984 1 1 14 ALA HB2 H -9.080 1.015 -0.397 1.00 . A A . 511 ALA HB2 1 1 8 4985 1 1 14 ALA HB3 H -7.519 0.715 0.373 1.00 . A A . 511 ALA HB3 1 1 8 4986 1 1 14 ALA N N -9.913 -1.592 -0.280 1.00 . A A . 511 ALA N 1 1 8 4987 1 1 14 ALA O O -10.708 -0.240 2.058 1.00 . A A . 511 ALA O 1 1 8 4988 1 1 15 MET C C -7.644 0.743 4.937 1.00 . A A . 512 MET C 1 1 8 4989 1 1 15 MET CA C -8.910 0.421 4.138 1.00 . A A . 512 MET CA 1 1 8 4990 1 1 15 MET CB C -9.728 -0.613 4.917 1.00 . A A . 512 MET CB 1 1 8 4991 1 1 15 MET CE C -11.260 -0.401 8.780 1.00 . A A . 512 MET CE 1 1 8 4992 1 1 15 MET CG C -10.150 -0.108 6.288 1.00 . A A . 512 MET CG 1 1 8 4993 1 1 15 MET H H -7.631 -0.125 2.538 1.00 . A A . 512 MET H 1 1 8 4994 1 1 15 MET HA H -9.492 1.326 4.050 1.00 . A A . 512 MET HA 1 1 8 4995 1 1 15 MET HB2 H -10.617 -0.857 4.353 1.00 . A A . 512 MET HB2 1 1 8 4996 1 1 15 MET HB3 H -9.135 -1.506 5.050 1.00 . A A . 512 MET HB3 1 1 8 4997 1 1 15 MET HE1 H -11.876 0.454 8.543 1.00 . A A . 512 MET HE1 1 1 8 4998 1 1 15 MET HE2 H -11.764 -1.017 9.512 1.00 . A A . 512 MET HE2 1 1 8 4999 1 1 15 MET HE3 H -10.316 -0.065 9.180 1.00 . A A . 512 MET HE3 1 1 8 5000 1 1 15 MET HG2 H -9.273 0.230 6.816 1.00 . A A . 512 MET HG2 1 1 8 5001 1 1 15 MET HG3 H -10.825 0.725 6.153 1.00 . A A . 512 MET HG3 1 1 8 5002 1 1 15 MET N N -8.577 -0.057 2.794 1.00 . A A . 512 MET N 1 1 8 5003 1 1 15 MET O O -7.655 1.617 5.804 1.00 . A A . 512 MET O 1 1 8 5004 1 1 15 MET SD S -10.969 -1.354 7.294 1.00 . A A . 512 MET SD 1 1 8 5005 1 1 16 SER C C -4.195 0.728 4.600 1.00 . A A . 513 SER C 1 1 8 5006 1 1 16 SER CA C -5.346 0.197 5.446 1.00 . A A . 513 SER CA 1 1 8 5007 1 1 16 SER CB C -4.999 -1.148 6.100 1.00 . A A . 513 SER CB 1 1 8 5008 1 1 16 SER H H -6.520 -0.465 3.815 1.00 . A A . 513 SER H 1 1 8 5009 1 1 16 SER HA H -5.568 0.929 6.206 1.00 . A A . 513 SER HA 1 1 8 5010 1 1 16 SER HB2 H -5.887 -1.562 6.551 1.00 . A A . 513 SER HB2 1 1 8 5011 1 1 16 SER HB3 H -4.635 -1.829 5.344 1.00 . A A . 513 SER HB3 1 1 8 5012 1 1 16 SER HG H -4.093 -0.144 7.530 1.00 . A A . 513 SER HG 1 1 8 5013 1 1 16 SER N N -6.545 0.068 4.631 1.00 . A A . 513 SER N 1 1 8 5014 1 1 16 SER O O -4.191 0.584 3.385 1.00 . A A . 513 SER O 1 1 8 5015 1 1 16 SER OG O -4.009 -1.013 7.105 1.00 . A A . 513 SER OG 1 1 8 5016 1 1 17 GLU C C -0.791 1.582 4.955 1.00 . A A . 514 GLU C 1 1 8 5017 1 1 17 GLU CA C -2.176 2.059 4.525 1.00 . A A . 514 GLU CA 1 1 8 5018 1 1 17 GLU CB C -2.318 3.563 4.771 1.00 . A A . 514 GLU CB 1 1 8 5019 1 1 17 GLU CD C -3.081 5.333 6.376 1.00 . A A . 514 GLU CD 1 1 8 5020 1 1 17 GLU CG C -2.502 3.944 6.226 1.00 . A A . 514 GLU CG 1 1 8 5021 1 1 17 GLU H H -3.230 1.363 6.223 1.00 . A A . 514 GLU H 1 1 8 5022 1 1 17 GLU HA H -2.313 1.895 3.466 1.00 . A A . 514 GLU HA 1 1 8 5023 1 1 17 GLU HB2 H -1.430 4.057 4.406 1.00 . A A . 514 GLU HB2 1 1 8 5024 1 1 17 GLU HB3 H -3.171 3.927 4.218 1.00 . A A . 514 GLU HB3 1 1 8 5025 1 1 17 GLU HG2 H -3.170 3.234 6.692 1.00 . A A . 514 GLU HG2 1 1 8 5026 1 1 17 GLU HG3 H -1.541 3.914 6.717 1.00 . A A . 514 GLU HG3 1 1 8 5027 1 1 17 GLU N N -3.236 1.363 5.239 1.00 . A A . 514 GLU N 1 1 8 5028 1 1 17 GLU O O -0.637 0.953 6.007 1.00 . A A . 514 GLU O 1 1 8 5029 1 1 17 GLU OE1 O -2.312 6.313 6.314 1.00 . A A . 514 GLU OE1 1 1 8 5030 1 1 17 GLU OE2 O -4.314 5.452 6.545 1.00 . A A . 514 GLU OE2 1 1 8 5031 1 1 18 CYS C C 2.084 2.565 5.528 1.00 . A A . 515 CYS C 1 1 8 5032 1 1 18 CYS CA C 1.597 1.598 4.469 1.00 . A A . 515 CYS CA 1 1 8 5033 1 1 18 CYS CB C 2.512 1.688 3.234 1.00 . A A . 515 CYS CB 1 1 8 5034 1 1 18 CYS H H 0.010 2.339 3.288 1.00 . A A . 515 CYS H 1 1 8 5035 1 1 18 CYS HA H 1.668 0.619 4.919 1.00 . A A . 515 CYS HA 1 1 8 5036 1 1 18 CYS HB2 H 2.592 0.713 2.777 1.00 . A A . 515 CYS HB2 1 1 8 5037 1 1 18 CYS HB3 H 2.080 2.378 2.524 1.00 . A A . 515 CYS HB3 1 1 8 5038 1 1 18 CYS N N 0.208 1.884 4.134 1.00 . A A . 515 CYS N 1 1 8 5039 1 1 18 CYS O O 1.927 3.780 5.409 1.00 . A A . 515 CYS O 1 1 8 5040 1 1 18 CYS SG S 4.211 2.266 3.616 1.00 . A A . 515 CYS SG 1 1 8 5041 1 1 19 THR C C 4.781 2.962 7.034 1.00 . A A . 516 THR C 1 1 8 5042 1 1 19 THR CA C 3.369 2.771 7.570 1.00 . A A . 516 THR CA 1 1 8 5043 1 1 19 THR CB C 3.400 2.062 8.934 1.00 . A A . 516 THR CB 1 1 8 5044 1 1 19 THR CG2 C 4.102 2.918 9.976 1.00 . A A . 516 THR CG2 1 1 8 5045 1 1 19 THR H H 2.496 1.058 6.777 1.00 . A A . 516 THR H 1 1 8 5046 1 1 19 THR HA H 2.897 3.737 7.688 1.00 . A A . 516 THR HA 1 1 8 5047 1 1 19 THR HB H 3.933 1.127 8.831 1.00 . A A . 516 THR HB 1 1 8 5048 1 1 19 THR HG1 H 1.441 2.226 8.745 1.00 . A A . 516 THR HG1 1 1 8 5049 1 1 19 THR HG21 H 3.577 3.854 10.089 1.00 . A A . 516 THR HG21 1 1 8 5050 1 1 19 THR HG22 H 4.112 2.396 10.922 1.00 . A A . 516 THR HG22 1 1 8 5051 1 1 19 THR HG23 H 5.116 3.107 9.659 1.00 . A A . 516 THR HG23 1 1 8 5052 1 1 19 THR N N 2.608 2.008 6.614 1.00 . A A . 516 THR N 1 1 8 5053 1 1 19 THR O O 5.497 1.994 6.774 1.00 . A A . 516 THR O 1 1 8 5054 1 1 19 THR OG1 O 2.051 1.793 9.351 1.00 . A A . 516 THR OG1 1 1 8 5055 1 1 20 GLY C C 6.214 5.582 5.174 1.00 . A A . 517 GLY C 1 1 8 5056 1 1 20 GLY CA C 6.417 4.511 6.207 1.00 . A A . 517 GLY CA 1 1 8 5057 1 1 20 GLY H H 4.627 4.925 7.251 1.00 . A A . 517 GLY H 1 1 8 5058 1 1 20 GLY HA2 H 7.137 4.851 6.936 1.00 . A A . 517 GLY HA2 1 1 8 5059 1 1 20 GLY HA3 H 6.790 3.620 5.725 1.00 . A A . 517 GLY HA3 1 1 8 5060 1 1 20 GLY N N 5.174 4.206 6.876 1.00 . A A . 517 GLY N 1 1 8 5061 1 1 20 GLY O O 6.937 6.580 5.156 1.00 . A A . 517 GLY O 1 1 8 5062 1 1 21 CYS C C 3.272 6.353 3.276 1.00 . A A . 518 CYS C 1 1 8 5063 1 1 21 CYS CA C 4.786 6.417 3.411 1.00 . A A . 518 CYS CA 1 1 8 5064 1 1 21 CYS CB C 5.449 6.257 2.045 1.00 . A A . 518 CYS CB 1 1 8 5065 1 1 21 CYS H H 4.759 4.508 4.311 1.00 . A A . 518 CYS H 1 1 8 5066 1 1 21 CYS HA H 5.063 7.363 3.841 1.00 . A A . 518 CYS HA 1 1 8 5067 1 1 21 CYS HB2 H 5.392 7.196 1.516 1.00 . A A . 518 CYS HB2 1 1 8 5068 1 1 21 CYS HB3 H 6.489 5.994 2.187 1.00 . A A . 518 CYS HB3 1 1 8 5069 1 1 21 CYS N N 5.220 5.380 4.320 1.00 . A A . 518 CYS N 1 1 8 5070 1 1 21 CYS O O 2.689 5.275 3.292 1.00 . A A . 518 CYS O 1 1 8 5071 1 1 21 CYS SG S 4.693 4.978 0.990 1.00 . A A . 518 CYS SG 1 1 8 5072 1 1 22 HIS C C 0.749 8.008 1.690 1.00 . A A . 519 HIS C 1 1 8 5073 1 1 22 HIS CA C 1.183 7.524 3.059 1.00 . A A . 519 HIS CA 1 1 8 5074 1 1 22 HIS CB C 0.600 8.398 4.174 1.00 . A A . 519 HIS CB 1 1 8 5075 1 1 22 HIS CD2 C 2.108 8.058 6.256 1.00 . A A . 519 HIS CD2 1 1 8 5076 1 1 22 HIS CE1 C 0.729 6.887 7.481 1.00 . A A . 519 HIS CE1 1 1 8 5077 1 1 22 HIS CG C 0.965 7.915 5.549 1.00 . A A . 519 HIS CG 1 1 8 5078 1 1 22 HIS H H 3.145 8.333 3.078 1.00 . A A . 519 HIS H 1 1 8 5079 1 1 22 HIS HA H 0.830 6.510 3.189 1.00 . A A . 519 HIS HA 1 1 8 5080 1 1 22 HIS HB2 H 0.970 9.408 4.067 1.00 . A A . 519 HIS HB2 1 1 8 5081 1 1 22 HIS HB3 H -0.477 8.402 4.096 1.00 . A A . 519 HIS HB3 1 1 8 5082 1 1 22 HIS HD1 H -0.807 6.898 6.120 1.00 . A A . 519 HIS HD1 1 1 8 5083 1 1 22 HIS HD2 H 2.997 8.583 5.936 1.00 . A A . 519 HIS HD2 1 1 8 5084 1 1 22 HIS HE1 H 0.310 6.316 8.295 1.00 . A A . 519 HIS HE1 1 1 8 5085 1 1 22 HIS HE2 H 2.662 7.186 8.081 1.00 . A A . 519 HIS HE2 1 1 8 5086 1 1 22 HIS N N 2.634 7.493 3.136 1.00 . A A . 519 HIS N 1 1 8 5087 1 1 22 HIS ND1 N 0.119 7.176 6.349 1.00 . A A . 519 HIS ND1 1 1 8 5088 1 1 22 HIS NE2 N 1.937 7.410 7.450 1.00 . A A . 519 HIS NE2 1 1 8 5089 1 1 22 HIS O O -0.224 8.748 1.546 1.00 . A A . 519 HIS O 1 1 8 5090 1 1 23 LYS C C 0.360 6.852 -1.347 1.00 . A A . 520 LYS C 1 1 8 5091 1 1 23 LYS CA C 1.204 7.929 -0.692 1.00 . A A . 520 LYS CA 1 1 8 5092 1 1 23 LYS CB C 2.497 8.127 -1.485 1.00 . A A . 520 LYS CB 1 1 8 5093 1 1 23 LYS CD C 4.676 7.137 -2.283 1.00 . A A . 520 LYS CD 1 1 8 5094 1 1 23 LYS CE C 5.444 8.354 -1.780 1.00 . A A . 520 LYS CE 1 1 8 5095 1 1 23 LYS CG C 3.404 6.906 -1.481 1.00 . A A . 520 LYS CG 1 1 8 5096 1 1 23 LYS H H 2.270 7.006 0.879 1.00 . A A . 520 LYS H 1 1 8 5097 1 1 23 LYS HA H 0.648 8.854 -0.688 1.00 . A A . 520 LYS HA 1 1 8 5098 1 1 23 LYS HB2 H 2.245 8.358 -2.509 1.00 . A A . 520 LYS HB2 1 1 8 5099 1 1 23 LYS HB3 H 3.042 8.958 -1.060 1.00 . A A . 520 LYS HB3 1 1 8 5100 1 1 23 LYS HD2 H 5.310 6.261 -2.202 1.00 . A A . 520 LYS HD2 1 1 8 5101 1 1 23 LYS HD3 H 4.412 7.292 -3.320 1.00 . A A . 520 LYS HD3 1 1 8 5102 1 1 23 LYS HE2 H 6.407 8.380 -2.265 1.00 . A A . 520 LYS HE2 1 1 8 5103 1 1 23 LYS HE3 H 4.889 9.244 -2.040 1.00 . A A . 520 LYS HE3 1 1 8 5104 1 1 23 LYS HG2 H 3.674 6.675 -0.461 1.00 . A A . 520 LYS HG2 1 1 8 5105 1 1 23 LYS HG3 H 2.869 6.072 -1.909 1.00 . A A . 520 LYS HG3 1 1 8 5106 1 1 23 LYS HZ1 H 5.848 7.350 0.010 1.00 . A A . 520 LYS HZ1 1 1 8 5107 1 1 23 LYS HZ2 H 6.448 8.934 -0.035 1.00 . A A . 520 LYS HZ2 1 1 8 5108 1 1 23 LYS HZ3 H 4.788 8.659 0.185 1.00 . A A . 520 LYS HZ3 1 1 8 5109 1 1 23 LYS N N 1.496 7.578 0.684 1.00 . A A . 520 LYS N 1 1 8 5110 1 1 23 LYS NZ N 5.647 8.321 -0.304 1.00 . A A . 520 LYS NZ 1 1 8 5111 1 1 23 LYS O O -0.306 7.100 -2.348 1.00 . A A . 520 LYS O 1 1 8 5112 1 1 24 VAL C C -1.337 3.983 -0.324 1.00 . A A . 521 VAL C 1 1 8 5113 1 1 24 VAL CA C -0.357 4.532 -1.348 1.00 . A A . 521 VAL CA 1 1 8 5114 1 1 24 VAL CB C 0.568 3.383 -1.810 1.00 . A A . 521 VAL CB 1 1 8 5115 1 1 24 VAL CG1 C 1.451 3.825 -2.968 1.00 . A A . 521 VAL CG1 1 1 8 5116 1 1 24 VAL CG2 C 1.418 2.884 -0.650 1.00 . A A . 521 VAL CG2 1 1 8 5117 1 1 24 VAL H H 0.911 5.500 0.030 1.00 . A A . 521 VAL H 1 1 8 5118 1 1 24 VAL HA H -0.909 4.891 -2.205 1.00 . A A . 521 VAL HA 1 1 8 5119 1 1 24 VAL HB H -0.051 2.567 -2.151 1.00 . A A . 521 VAL HB 1 1 8 5120 1 1 24 VAL HG11 H 2.072 4.648 -2.651 1.00 . A A . 521 VAL HG11 1 1 8 5121 1 1 24 VAL HG12 H 2.075 3.000 -3.280 1.00 . A A . 521 VAL HG12 1 1 8 5122 1 1 24 VAL HG13 H 0.830 4.141 -3.794 1.00 . A A . 521 VAL HG13 1 1 8 5123 1 1 24 VAL HG21 H 0.775 2.522 0.140 1.00 . A A . 521 VAL HG21 1 1 8 5124 1 1 24 VAL HG22 H 2.056 2.081 -0.990 1.00 . A A . 521 VAL HG22 1 1 8 5125 1 1 24 VAL HG23 H 2.026 3.694 -0.277 1.00 . A A . 521 VAL HG23 1 1 8 5126 1 1 24 VAL N N 0.393 5.646 -0.794 1.00 . A A . 521 VAL N 1 1 8 5127 1 1 24 VAL O O -1.184 4.201 0.879 1.00 . A A . 521 VAL O 1 1 8 5128 1 1 25 ASN C C -3.520 1.196 -0.263 1.00 . A A . 522 ASN C 1 1 8 5129 1 1 25 ASN CA C -3.333 2.667 0.066 1.00 . A A . 522 ASN CA 1 1 8 5130 1 1 25 ASN CB C -4.681 3.396 -0.030 1.00 . A A . 522 ASN CB 1 1 8 5131 1 1 25 ASN CG C -4.803 4.275 -1.259 1.00 . A A . 522 ASN CG 1 1 8 5132 1 1 25 ASN H H -2.404 3.131 -1.775 1.00 . A A . 522 ASN H 1 1 8 5133 1 1 25 ASN HA H -2.968 2.736 1.082 1.00 . A A . 522 ASN HA 1 1 8 5134 1 1 25 ASN HB2 H -5.472 2.663 -0.066 1.00 . A A . 522 ASN HB2 1 1 8 5135 1 1 25 ASN HB3 H -4.813 4.011 0.845 1.00 . A A . 522 ASN HB3 1 1 8 5136 1 1 25 ASN HD21 H -5.293 2.694 -2.367 1.00 . A A . 522 ASN HD21 1 1 8 5137 1 1 25 ASN HD22 H -5.230 4.217 -3.192 1.00 . A A . 522 ASN HD22 1 1 8 5138 1 1 25 ASN N N -2.337 3.270 -0.805 1.00 . A A . 522 ASN N 1 1 8 5139 1 1 25 ASN ND2 N -5.142 3.672 -2.384 1.00 . A A . 522 ASN ND2 1 1 8 5140 1 1 25 ASN O O -3.423 0.777 -1.416 1.00 . A A . 522 ASN O 1 1 8 5141 1 1 25 ASN OD1 O -4.576 5.483 -1.204 1.00 . A A . 522 ASN OD1 1 1 8 5142 1 1 26 TYR C C -5.344 -1.333 1.305 1.00 . A A . 523 TYR C 1 1 8 5143 1 1 26 TYR CA C -4.014 -0.998 0.651 1.00 . A A . 523 TYR CA 1 1 8 5144 1 1 26 TYR CB C -2.902 -1.802 1.337 1.00 . A A . 523 TYR CB 1 1 8 5145 1 1 26 TYR CD1 C -0.727 -0.528 1.303 1.00 . A A . 523 TYR CD1 1 1 8 5146 1 1 26 TYR CD2 C -0.969 -2.376 -0.181 1.00 . A A . 523 TYR CD2 1 1 8 5147 1 1 26 TYR CE1 C 0.556 -0.319 0.840 1.00 . A A . 523 TYR CE1 1 1 8 5148 1 1 26 TYR CE2 C 0.317 -2.177 -0.642 1.00 . A A . 523 TYR CE2 1 1 8 5149 1 1 26 TYR CG C -1.510 -1.559 0.803 1.00 . A A . 523 TYR CG 1 1 8 5150 1 1 26 TYR CZ C 1.074 -1.146 -0.132 1.00 . A A . 523 TYR CZ 1 1 8 5151 1 1 26 TYR H H -3.881 0.851 1.657 1.00 . A A . 523 TYR H 1 1 8 5152 1 1 26 TYR HA H -4.056 -1.246 -0.399 1.00 . A A . 523 TYR HA 1 1 8 5153 1 1 26 TYR HB2 H -2.890 -1.555 2.387 1.00 . A A . 523 TYR HB2 1 1 8 5154 1 1 26 TYR HB3 H -3.118 -2.854 1.228 1.00 . A A . 523 TYR HB3 1 1 8 5155 1 1 26 TYR HD1 H -1.565 -3.183 -0.581 1.00 . A A . 523 TYR HD1 1 1 8 5156 1 1 26 TYR HD2 H -1.135 0.120 2.066 1.00 . A A . 523 TYR HD2 1 1 8 5157 1 1 26 TYR HE1 H 0.721 -2.822 -1.409 1.00 . A A . 523 TYR HE1 1 1 8 5158 1 1 26 TYR HE2 H 1.149 0.489 1.242 1.00 . A A . 523 TYR HE2 1 1 8 5159 1 1 26 TYR HH H 2.417 -1.193 -1.524 1.00 . A A . 523 TYR HH 1 1 8 5160 1 1 26 TYR N N -3.785 0.427 0.775 1.00 . A A . 523 TYR N 1 1 8 5161 1 1 26 TYR O O -6.097 -0.436 1.678 1.00 . A A . 523 TYR O 1 1 8 5162 1 1 26 TYR OH O 2.358 -0.946 -0.584 1.00 . A A . 523 TYR OH 1 1 8 5163 1 1 27 CYS C C -6.496 -3.664 3.483 1.00 . A A . 524 CYS C 1 1 8 5164 1 1 27 CYS CA C -6.838 -3.020 2.147 1.00 . A A . 524 CYS CA 1 1 8 5165 1 1 27 CYS CB C -7.605 -4.000 1.264 1.00 . A A . 524 CYS CB 1 1 8 5166 1 1 27 CYS H H -4.973 -3.282 1.206 1.00 . A A . 524 CYS H 1 1 8 5167 1 1 27 CYS HA H -7.443 -2.141 2.320 1.00 . A A . 524 CYS HA 1 1 8 5168 1 1 27 CYS HB2 H -8.547 -4.236 1.733 1.00 . A A . 524 CYS HB2 1 1 8 5169 1 1 27 CYS HB3 H -7.790 -3.539 0.305 1.00 . A A . 524 CYS HB3 1 1 8 5170 1 1 27 CYS N N -5.619 -2.605 1.485 1.00 . A A . 524 CYS N 1 1 8 5171 1 1 27 CYS O O -7.140 -3.409 4.502 1.00 . A A . 524 CYS O 1 1 8 5172 1 1 27 CYS SG S -6.727 -5.567 0.968 1.00 . A A . 524 CYS SG 1 1 8 5173 1 1 28 SER C C -3.496 -5.220 4.698 1.00 . A A . 525 SER C 1 1 8 5174 1 1 28 SER CA C -5.016 -5.237 4.606 1.00 . A A . 525 SER CA 1 1 8 5175 1 1 28 SER CB C -5.518 -6.680 4.480 1.00 . A A . 525 SER CB 1 1 8 5176 1 1 28 SER H H -4.939 -4.564 2.627 1.00 . A A . 525 SER H 1 1 8 5177 1 1 28 SER HA H -5.433 -4.787 5.492 1.00 . A A . 525 SER HA 1 1 8 5178 1 1 28 SER HB2 H -5.025 -7.296 5.218 1.00 . A A . 525 SER HB2 1 1 8 5179 1 1 28 SER HB3 H -6.585 -6.708 4.636 1.00 . A A . 525 SER HB3 1 1 8 5180 1 1 28 SER HG H -5.781 -6.755 2.535 1.00 . A A . 525 SER HG 1 1 8 5181 1 1 28 SER N N -5.448 -4.473 3.457 1.00 . A A . 525 SER N 1 1 8 5182 1 1 28 SER O O -2.818 -4.747 3.780 1.00 . A A . 525 SER O 1 1 8 5183 1 1 28 SER OG O -5.227 -7.201 3.193 1.00 . A A . 525 SER OG 1 1 8 5184 1 1 29 THR C C -0.951 -6.873 4.957 1.00 . A A . 526 THR C 1 1 8 5185 1 1 29 THR CA C -1.518 -5.854 5.948 1.00 . A A . 526 THR CA 1 1 8 5186 1 1 29 THR CB C -1.155 -6.266 7.389 1.00 . A A . 526 THR CB 1 1 8 5187 1 1 29 THR CG2 C 0.348 -6.220 7.619 1.00 . A A . 526 THR CG2 1 1 8 5188 1 1 29 THR H H -3.548 -6.056 6.514 1.00 . A A . 526 THR H 1 1 8 5189 1 1 29 THR HA H -1.081 -4.885 5.748 1.00 . A A . 526 THR HA 1 1 8 5190 1 1 29 THR HB H -1.501 -7.275 7.557 1.00 . A A . 526 THR HB 1 1 8 5191 1 1 29 THR HG1 H -1.396 -4.505 8.273 1.00 . A A . 526 THR HG1 1 1 8 5192 1 1 29 THR HG21 H 0.708 -5.215 7.453 1.00 . A A . 526 THR HG21 1 1 8 5193 1 1 29 THR HG22 H 0.567 -6.516 8.635 1.00 . A A . 526 THR HG22 1 1 8 5194 1 1 29 THR HG23 H 0.838 -6.895 6.934 1.00 . A A . 526 THR HG23 1 1 8 5195 1 1 29 THR N N -2.960 -5.742 5.789 1.00 . A A . 526 THR N 1 1 8 5196 1 1 29 THR O O 0.212 -6.790 4.558 1.00 . A A . 526 THR O 1 1 8 5197 1 1 29 THR OG1 O -1.806 -5.388 8.319 1.00 . A A . 526 THR OG1 1 1 8 5198 1 1 30 PHE C C -0.936 -8.251 2.271 1.00 . A A . 527 PHE C 1 1 8 5199 1 1 30 PHE CA C -1.379 -8.855 3.605 1.00 . A A . 527 PHE CA 1 1 8 5200 1 1 30 PHE CB C -2.523 -9.849 3.382 1.00 . A A . 527 PHE CB 1 1 8 5201 1 1 30 PHE CD1 C -1.392 -11.841 2.355 1.00 . A A . 527 PHE CD1 1 1 8 5202 1 1 30 PHE CD2 C -2.947 -10.608 1.034 1.00 . A A . 527 PHE CD2 1 1 8 5203 1 1 30 PHE CE1 C -1.167 -12.700 1.296 1.00 . A A . 527 PHE CE1 1 1 8 5204 1 1 30 PHE CE2 C -2.724 -11.460 -0.030 1.00 . A A . 527 PHE CE2 1 1 8 5205 1 1 30 PHE CG C -2.288 -10.791 2.237 1.00 . A A . 527 PHE CG 1 1 8 5206 1 1 30 PHE CZ C -1.831 -12.505 0.101 1.00 . A A . 527 PHE CZ 1 1 8 5207 1 1 30 PHE H H -2.702 -7.841 4.907 1.00 . A A . 527 PHE H 1 1 8 5208 1 1 30 PHE HA H -0.542 -9.379 4.038 1.00 . A A . 527 PHE HA 1 1 8 5209 1 1 30 PHE HB2 H -2.655 -10.439 4.276 1.00 . A A . 527 PHE HB2 1 1 8 5210 1 1 30 PHE HB3 H -3.433 -9.302 3.180 1.00 . A A . 527 PHE HB3 1 1 8 5211 1 1 30 PHE HD1 H -3.649 -9.791 0.935 1.00 . A A . 527 PHE HD1 1 1 8 5212 1 1 30 PHE HD2 H -0.872 -11.991 3.290 1.00 . A A . 527 PHE HD2 1 1 8 5213 1 1 30 PHE HE1 H -3.241 -11.307 -0.964 1.00 . A A . 527 PHE HE1 1 1 8 5214 1 1 30 PHE HE2 H -0.469 -13.516 1.400 1.00 . A A . 527 PHE HE2 1 1 8 5215 1 1 30 PHE HZ H -1.653 -13.170 -0.730 1.00 . A A . 527 PHE HZ 1 1 8 5216 1 1 30 PHE N N -1.789 -7.821 4.546 1.00 . A A . 527 PHE N 1 1 8 5217 1 1 30 PHE O O 0.152 -8.561 1.786 1.00 . A A . 527 PHE O 1 1 8 5218 1 1 31 CYS C C -0.164 -5.831 0.653 1.00 . A A . 528 CYS C 1 1 8 5219 1 1 31 CYS CA C -1.375 -6.732 0.436 1.00 . A A . 528 CYS CA 1 1 8 5220 1 1 31 CYS CB C -2.524 -5.925 -0.164 1.00 . A A . 528 CYS CB 1 1 8 5221 1 1 31 CYS H H -2.610 -7.156 2.109 1.00 . A A . 528 CYS H 1 1 8 5222 1 1 31 CYS HA H -1.095 -7.522 -0.244 1.00 . A A . 528 CYS HA 1 1 8 5223 1 1 31 CYS HB2 H -2.972 -5.329 0.615 1.00 . A A . 528 CYS HB2 1 1 8 5224 1 1 31 CYS HB3 H -2.120 -5.263 -0.919 1.00 . A A . 528 CYS HB3 1 1 8 5225 1 1 31 CYS N N -1.753 -7.376 1.688 1.00 . A A . 528 CYS N 1 1 8 5226 1 1 31 CYS O O 0.689 -5.709 -0.218 1.00 . A A . 528 CYS O 1 1 8 5227 1 1 31 CYS SG S -3.864 -6.895 -0.942 1.00 . A A . 528 CYS SG 1 1 8 5228 1 1 32 GLN C C 2.330 -5.080 2.116 1.00 . A A . 529 GLN C 1 1 8 5229 1 1 32 GLN CA C 1.006 -4.322 2.174 1.00 . A A . 529 GLN CA 1 1 8 5230 1 1 32 GLN CB C 0.753 -3.728 3.572 1.00 . A A . 529 GLN CB 1 1 8 5231 1 1 32 GLN CD C 2.757 -2.197 4.076 1.00 . A A . 529 GLN CD 1 1 8 5232 1 1 32 GLN CG C 1.988 -3.461 4.436 1.00 . A A . 529 GLN CG 1 1 8 5233 1 1 32 GLN H H -0.800 -5.372 2.490 1.00 . A A . 529 GLN H 1 1 8 5234 1 1 32 GLN HA H 1.027 -3.525 1.448 1.00 . A A . 529 GLN HA 1 1 8 5235 1 1 32 GLN HB2 H 0.235 -2.789 3.450 1.00 . A A . 529 GLN HB2 1 1 8 5236 1 1 32 GLN HB3 H 0.107 -4.406 4.114 1.00 . A A . 529 GLN HB3 1 1 8 5237 1 1 32 GLN HE21 H 2.611 -2.580 2.135 1.00 . A A . 529 GLN HE21 1 1 8 5238 1 1 32 GLN HE22 H 3.435 -1.123 2.561 1.00 . A A . 529 GLN HE22 1 1 8 5239 1 1 32 GLN HG2 H 1.673 -3.378 5.466 1.00 . A A . 529 GLN HG2 1 1 8 5240 1 1 32 GLN HG3 H 2.655 -4.306 4.341 1.00 . A A . 529 GLN HG3 1 1 8 5241 1 1 32 GLN N N -0.099 -5.207 1.825 1.00 . A A . 529 GLN N 1 1 8 5242 1 1 32 GLN NE2 N 2.953 -1.942 2.797 1.00 . A A . 529 GLN NE2 1 1 8 5243 1 1 32 GLN O O 3.295 -4.617 1.509 1.00 . A A . 529 GLN O 1 1 8 5244 1 1 32 GLN OE1 O 3.237 -1.491 4.961 1.00 . A A . 529 GLN OE1 1 1 8 5245 1 1 33 ARG C C 3.801 -7.717 1.386 1.00 . A A . 530 ARG C 1 1 8 5246 1 1 33 ARG CA C 3.560 -7.069 2.754 1.00 . A A . 530 ARG CA 1 1 8 5247 1 1 33 ARG CB C 3.467 -8.123 3.856 1.00 . A A . 530 ARG CB 1 1 8 5248 1 1 33 ARG CD C 4.456 -10.132 4.977 1.00 . A A . 530 ARG CD 1 1 8 5249 1 1 33 ARG CG C 4.642 -9.081 3.897 1.00 . A A . 530 ARG CG 1 1 8 5250 1 1 33 ARG CZ C 5.376 -12.344 5.538 1.00 . A A . 530 ARG CZ 1 1 8 5251 1 1 33 ARG H H 1.540 -6.575 3.170 1.00 . A A . 530 ARG H 1 1 8 5252 1 1 33 ARG HA H 4.380 -6.396 2.959 1.00 . A A . 530 ARG HA 1 1 8 5253 1 1 33 ARG HB2 H 3.408 -7.621 4.810 1.00 . A A . 530 ARG HB2 1 1 8 5254 1 1 33 ARG HB3 H 2.564 -8.701 3.710 1.00 . A A . 530 ARG HB3 1 1 8 5255 1 1 33 ARG HD2 H 4.513 -9.651 5.941 1.00 . A A . 530 ARG HD2 1 1 8 5256 1 1 33 ARG HD3 H 3.481 -10.583 4.857 1.00 . A A . 530 ARG HD3 1 1 8 5257 1 1 33 ARG HE H 6.269 -10.998 4.350 1.00 . A A . 530 ARG HE 1 1 8 5258 1 1 33 ARG HG2 H 4.731 -9.572 2.939 1.00 . A A . 530 ARG HG2 1 1 8 5259 1 1 33 ARG HG3 H 5.543 -8.521 4.103 1.00 . A A . 530 ARG HG3 1 1 8 5260 1 1 33 ARG HH11 H 3.650 -11.872 6.491 1.00 . A A . 530 ARG HH11 1 1 8 5261 1 1 33 ARG HH12 H 4.266 -13.462 6.822 1.00 . A A . 530 ARG HH12 1 1 8 5262 1 1 33 ARG HH21 H 7.100 -13.091 4.763 1.00 . A A . 530 ARG HH21 1 1 8 5263 1 1 33 ARG HH22 H 6.250 -14.143 5.862 1.00 . A A . 530 ARG HH22 1 1 8 5264 1 1 33 ARG N N 2.359 -6.249 2.737 1.00 . A A . 530 ARG N 1 1 8 5265 1 1 33 ARG NE N 5.473 -11.177 4.908 1.00 . A A . 530 ARG NE 1 1 8 5266 1 1 33 ARG NH1 N 4.351 -12.578 6.349 1.00 . A A . 530 ARG NH1 1 1 8 5267 1 1 33 ARG NH2 N 6.313 -13.269 5.372 1.00 . A A . 530 ARG NH2 1 1 8 5268 1 1 33 ARG O O 4.941 -7.959 0.988 1.00 . A A . 530 ARG O 1 1 8 5269 1 1 34 LYS C C 3.376 -7.632 -1.661 1.00 . A A . 531 LYS C 1 1 8 5270 1 1 34 LYS CA C 2.809 -8.626 -0.643 1.00 . A A . 531 LYS CA 1 1 8 5271 1 1 34 LYS CB C 1.417 -9.124 -1.072 1.00 . A A . 531 LYS CB 1 1 8 5272 1 1 34 LYS CD C 1.548 -9.378 -3.587 1.00 . A A . 531 LYS CD 1 1 8 5273 1 1 34 LYS CE C 1.517 -10.356 -4.749 1.00 . A A . 531 LYS CE 1 1 8 5274 1 1 34 LYS CG C 1.413 -10.092 -2.251 1.00 . A A . 531 LYS CG 1 1 8 5275 1 1 34 LYS H H 1.832 -7.801 1.051 1.00 . A A . 531 LYS H 1 1 8 5276 1 1 34 LYS HA H 3.480 -9.469 -0.567 1.00 . A A . 531 LYS HA 1 1 8 5277 1 1 34 LYS HB2 H 0.959 -9.623 -0.230 1.00 . A A . 531 LYS HB2 1 1 8 5278 1 1 34 LYS HB3 H 0.813 -8.268 -1.336 1.00 . A A . 531 LYS HB3 1 1 8 5279 1 1 34 LYS HD2 H 0.729 -8.681 -3.697 1.00 . A A . 531 LYS HD2 1 1 8 5280 1 1 34 LYS HD3 H 2.485 -8.841 -3.605 1.00 . A A . 531 LYS HD3 1 1 8 5281 1 1 34 LYS HE2 H 2.362 -11.024 -4.661 1.00 . A A . 531 LYS HE2 1 1 8 5282 1 1 34 LYS HE3 H 0.601 -10.926 -4.699 1.00 . A A . 531 LYS HE3 1 1 8 5283 1 1 34 LYS HG2 H 2.240 -10.776 -2.140 1.00 . A A . 531 LYS HG2 1 1 8 5284 1 1 34 LYS HG3 H 0.485 -10.649 -2.242 1.00 . A A . 531 LYS HG3 1 1 8 5285 1 1 34 LYS HZ1 H 2.483 -9.128 -6.136 1.00 . A A . 531 LYS HZ1 1 1 8 5286 1 1 34 LYS HZ2 H 1.539 -10.349 -6.838 1.00 . A A . 531 LYS HZ2 1 1 8 5287 1 1 34 LYS HZ3 H 0.790 -8.990 -6.157 1.00 . A A . 531 LYS HZ3 1 1 8 5288 1 1 34 LYS N N 2.718 -8.002 0.674 1.00 . A A . 531 LYS N 1 1 8 5289 1 1 34 LYS NZ N 1.588 -9.659 -6.058 1.00 . A A . 531 LYS NZ 1 1 8 5290 1 1 34 LYS O O 4.241 -7.976 -2.470 1.00 . A A . 531 LYS O 1 1 8 5291 1 1 35 ASP C C 4.743 -4.838 -2.063 1.00 . A A . 532 ASP C 1 1 8 5292 1 1 35 ASP CA C 3.362 -5.328 -2.478 1.00 . A A . 532 ASP CA 1 1 8 5293 1 1 35 ASP CB C 2.362 -4.167 -2.443 1.00 . A A . 532 ASP CB 1 1 8 5294 1 1 35 ASP CG C 2.672 -3.078 -3.453 1.00 . A A . 532 ASP CG 1 1 8 5295 1 1 35 ASP H H 2.184 -6.188 -0.950 1.00 . A A . 532 ASP H 1 1 8 5296 1 1 35 ASP HA H 3.411 -5.714 -3.486 1.00 . A A . 532 ASP HA 1 1 8 5297 1 1 35 ASP HB2 H 1.374 -4.550 -2.649 1.00 . A A . 532 ASP HB2 1 1 8 5298 1 1 35 ASP HB3 H 2.372 -3.729 -1.456 1.00 . A A . 532 ASP HB3 1 1 8 5299 1 1 35 ASP N N 2.900 -6.395 -1.594 1.00 . A A . 532 ASP N 1 1 8 5300 1 1 35 ASP O O 5.431 -4.168 -2.829 1.00 . A A . 532 ASP O 1 1 8 5301 1 1 35 ASP OD1 O 2.665 -3.372 -4.668 1.00 . A A . 532 ASP OD1 1 1 8 5302 1 1 35 ASP OD2 O 2.888 -1.918 -3.039 1.00 . A A . 532 ASP OD2 1 1 8 5303 1 1 36 TRP C C 7.625 -5.152 -1.178 1.00 . A A . 533 TRP C 1 1 8 5304 1 1 36 TRP CA C 6.432 -4.782 -0.291 1.00 . A A . 533 TRP CA 1 1 8 5305 1 1 36 TRP CB C 6.619 -5.366 1.111 1.00 . A A . 533 TRP CB 1 1 8 5306 1 1 36 TRP CD1 C 8.988 -5.483 2.089 1.00 . A A . 533 TRP CD1 1 1 8 5307 1 1 36 TRP CD2 C 8.000 -3.482 2.288 1.00 . A A . 533 TRP CD2 1 1 8 5308 1 1 36 TRP CE2 C 9.288 -3.403 2.848 1.00 . A A . 533 TRP CE2 1 1 8 5309 1 1 36 TRP CE3 C 7.191 -2.343 2.302 1.00 . A A . 533 TRP CE3 1 1 8 5310 1 1 36 TRP CG C 7.827 -4.819 1.807 1.00 . A A . 533 TRP CG 1 1 8 5311 1 1 36 TRP CH2 C 8.976 -1.132 3.406 1.00 . A A . 533 TRP CH2 1 1 8 5312 1 1 36 TRP CZ2 C 9.789 -2.232 3.405 1.00 . A A . 533 TRP CZ2 1 1 8 5313 1 1 36 TRP CZ3 C 7.687 -1.180 2.858 1.00 . A A . 533 TRP CZ3 1 1 8 5314 1 1 36 TRP H H 4.605 -5.849 -0.347 1.00 . A A . 533 TRP H 1 1 8 5315 1 1 36 TRP HA H 6.390 -3.706 -0.193 1.00 . A A . 533 TRP HA 1 1 8 5316 1 1 36 TRP HB2 H 5.749 -5.130 1.711 1.00 . A A . 533 TRP HB2 1 1 8 5317 1 1 36 TRP HB3 H 6.726 -6.439 1.041 1.00 . A A . 533 TRP HB3 1 1 8 5318 1 1 36 TRP HD1 H 9.170 -6.519 1.849 1.00 . A A . 533 TRP HD1 1 1 8 5319 1 1 36 TRP HE1 H 10.784 -4.874 3.009 1.00 . A A . 533 TRP HE1 1 1 8 5320 1 1 36 TRP HE3 H 6.195 -2.361 1.886 1.00 . A A . 533 TRP HE3 1 1 8 5321 1 1 36 TRP HH2 H 9.322 -0.203 3.834 1.00 . A A . 533 TRP HH2 1 1 8 5322 1 1 36 TRP HZ2 H 10.782 -2.180 3.825 1.00 . A A . 533 TRP HZ2 1 1 8 5323 1 1 36 TRP HZ3 H 7.074 -0.291 2.879 1.00 . A A . 533 TRP HZ3 1 1 8 5324 1 1 36 TRP N N 5.166 -5.237 -0.866 1.00 . A A . 533 TRP N 1 1 8 5325 1 1 36 TRP NE1 N 9.872 -4.635 2.711 1.00 . A A . 533 TRP NE1 1 1 8 5326 1 1 36 TRP O O 8.646 -4.481 -1.169 1.00 . A A . 533 TRP O 1 1 8 5327 1 1 37 LYS C C 8.850 -5.584 -3.895 1.00 . A A . 534 LYS C 1 1 8 5328 1 1 37 LYS CA C 8.525 -6.662 -2.865 1.00 . A A . 534 LYS CA 1 1 8 5329 1 1 37 LYS CB C 8.119 -7.964 -3.554 1.00 . A A . 534 LYS CB 1 1 8 5330 1 1 37 LYS CD C 7.359 -10.354 -3.317 1.00 . A A . 534 LYS CD 1 1 8 5331 1 1 37 LYS CE C 8.398 -10.860 -4.301 1.00 . A A . 534 LYS CE 1 1 8 5332 1 1 37 LYS CG C 7.830 -9.104 -2.588 1.00 . A A . 534 LYS CG 1 1 8 5333 1 1 37 LYS H H 6.641 -6.707 -1.906 1.00 . A A . 534 LYS H 1 1 8 5334 1 1 37 LYS HA H 9.443 -6.811 -2.317 1.00 . A A . 534 LYS HA 1 1 8 5335 1 1 37 LYS HB2 H 7.231 -7.784 -4.144 1.00 . A A . 534 LYS HB2 1 1 8 5336 1 1 37 LYS HB3 H 8.920 -8.271 -4.211 1.00 . A A . 534 LYS HB3 1 1 8 5337 1 1 37 LYS HD2 H 7.161 -11.129 -2.592 1.00 . A A . 534 LYS HD2 1 1 8 5338 1 1 37 LYS HD3 H 6.450 -10.124 -3.855 1.00 . A A . 534 LYS HD3 1 1 8 5339 1 1 37 LYS HE2 H 7.987 -11.705 -4.831 1.00 . A A . 534 LYS HE2 1 1 8 5340 1 1 37 LYS HE3 H 8.623 -10.071 -5.006 1.00 . A A . 534 LYS HE3 1 1 8 5341 1 1 37 LYS HG2 H 8.730 -9.339 -2.042 1.00 . A A . 534 LYS HG2 1 1 8 5342 1 1 37 LYS HG3 H 7.060 -8.791 -1.898 1.00 . A A . 534 LYS HG3 1 1 8 5343 1 1 37 LYS HZ1 H 9.453 -12.033 -2.931 1.00 . A A . 534 LYS HZ1 1 1 8 5344 1 1 37 LYS HZ2 H 10.332 -11.648 -4.328 1.00 . A A . 534 LYS HZ2 1 1 8 5345 1 1 37 LYS HZ3 H 10.090 -10.471 -3.131 1.00 . A A . 534 LYS HZ3 1 1 8 5346 1 1 37 LYS N N 7.477 -6.214 -1.949 1.00 . A A . 534 LYS N 1 1 8 5347 1 1 37 LYS NZ N 9.655 -11.281 -3.625 1.00 . A A . 534 LYS NZ 1 1 8 5348 1 1 37 LYS O O 10.011 -5.420 -4.268 1.00 . A A . 534 LYS O 1 1 8 5349 1 1 38 ASP C C 8.236 -2.455 -4.360 1.00 . A A . 535 ASP C 1 1 8 5350 1 1 38 ASP CA C 8.135 -3.696 -5.205 1.00 . A A . 535 ASP CA 1 1 8 5351 1 1 38 ASP CB C 7.033 -3.484 -6.235 1.00 . A A . 535 ASP CB 1 1 8 5352 1 1 38 ASP CG C 7.388 -2.425 -7.258 1.00 . A A . 535 ASP CG 1 1 8 5353 1 1 38 ASP H H 6.932 -5.067 -4.117 1.00 . A A . 535 ASP H 1 1 8 5354 1 1 38 ASP HA H 9.076 -3.872 -5.701 1.00 . A A . 535 ASP HA 1 1 8 5355 1 1 38 ASP HB2 H 6.846 -4.403 -6.741 1.00 . A A . 535 ASP HB2 1 1 8 5356 1 1 38 ASP HB3 H 6.135 -3.174 -5.724 1.00 . A A . 535 ASP HB3 1 1 8 5357 1 1 38 ASP N N 7.859 -4.845 -4.353 1.00 . A A . 535 ASP N 1 1 8 5358 1 1 38 ASP O O 9.066 -1.587 -4.567 1.00 . A A . 535 ASP O 1 1 8 5359 1 1 38 ASP OD1 O 8.257 -2.691 -8.115 1.00 . A A . 535 ASP OD1 1 1 8 5360 1 1 38 ASP OD2 O 6.798 -1.324 -7.217 1.00 . A A . 535 ASP OD2 1 1 8 5361 1 1 39 HIS C C 8.423 -0.840 -1.833 1.00 . A A . 536 HIS C 1 1 8 5362 1 1 39 HIS CA C 7.184 -1.198 -2.636 1.00 . A A . 536 HIS CA 1 1 8 5363 1 1 39 HIS CB C 5.977 -1.356 -1.717 1.00 . A A . 536 HIS CB 1 1 8 5364 1 1 39 HIS CD2 C 5.476 0.304 0.198 1.00 . A A . 536 HIS CD2 1 1 8 5365 1 1 39 HIS CE1 C 4.628 1.925 -0.965 1.00 . A A . 536 HIS CE1 1 1 8 5366 1 1 39 HIS CG C 5.508 -0.082 -1.104 1.00 . A A . 536 HIS CG 1 1 8 5367 1 1 39 HIS H H 6.863 -3.190 -3.163 1.00 . A A . 536 HIS H 1 1 8 5368 1 1 39 HIS HA H 6.987 -0.413 -3.358 1.00 . A A . 536 HIS HA 1 1 8 5369 1 1 39 HIS HB2 H 5.157 -1.769 -2.284 1.00 . A A . 536 HIS HB2 1 1 8 5370 1 1 39 HIS HB3 H 6.232 -2.036 -0.918 1.00 . A A . 536 HIS HB3 1 1 8 5371 1 1 39 HIS HD1 H 4.834 0.977 -2.808 1.00 . A A . 536 HIS HD1 1 1 8 5372 1 1 39 HIS HD2 H 5.834 -0.269 1.042 1.00 . A A . 536 HIS HD2 1 1 8 5373 1 1 39 HIS HE1 H 4.187 2.870 -1.243 1.00 . A A . 536 HIS HE1 1 1 8 5374 1 1 39 HIS N N 7.383 -2.398 -3.384 1.00 . A A . 536 HIS N 1 1 8 5375 1 1 39 HIS ND1 N 4.967 0.960 -1.829 1.00 . A A . 536 HIS ND1 1 1 8 5376 1 1 39 HIS NE2 N 4.912 1.566 0.266 1.00 . A A . 536 HIS NE2 1 1 8 5377 1 1 39 HIS O O 8.692 0.327 -1.616 1.00 . A A . 536 HIS O 1 1 8 5378 1 1 40 GLN C C 11.386 -0.722 -1.265 1.00 . A A . 537 GLN C 1 1 8 5379 1 1 40 GLN CA C 10.341 -1.577 -0.548 1.00 . A A . 537 GLN CA 1 1 8 5380 1 1 40 GLN CB C 10.972 -2.877 -0.051 1.00 . A A . 537 GLN CB 1 1 8 5381 1 1 40 GLN CD C 12.016 -5.093 -0.641 1.00 . A A . 537 GLN CD 1 1 8 5382 1 1 40 GLN CG C 11.582 -3.733 -1.148 1.00 . A A . 537 GLN CG 1 1 8 5383 1 1 40 GLN H H 8.935 -2.774 -1.616 1.00 . A A . 537 GLN H 1 1 8 5384 1 1 40 GLN HA H 9.983 -1.008 0.296 1.00 . A A . 537 GLN HA 1 1 8 5385 1 1 40 GLN HB2 H 11.752 -2.635 0.656 1.00 . A A . 537 GLN HB2 1 1 8 5386 1 1 40 GLN HB3 H 10.213 -3.459 0.451 1.00 . A A . 537 GLN HB3 1 1 8 5387 1 1 40 GLN HE21 H 10.210 -5.826 -1.017 1.00 . A A . 537 GLN HE21 1 1 8 5388 1 1 40 GLN HE22 H 11.354 -6.948 -0.360 1.00 . A A . 537 GLN HE22 1 1 8 5389 1 1 40 GLN HG2 H 10.853 -3.871 -1.941 1.00 . A A . 537 GLN HG2 1 1 8 5390 1 1 40 GLN HG3 H 12.447 -3.221 -1.540 1.00 . A A . 537 GLN HG3 1 1 8 5391 1 1 40 GLN N N 9.176 -1.838 -1.390 1.00 . A A . 537 GLN N 1 1 8 5392 1 1 40 GLN NE2 N 11.103 -6.051 -0.675 1.00 . A A . 537 GLN NE2 1 1 8 5393 1 1 40 GLN O O 12.028 0.115 -0.636 1.00 . A A . 537 GLN O 1 1 8 5394 1 1 40 GLN OE1 O 13.155 -5.275 -0.209 1.00 . A A . 537 GLN OE1 1 1 8 5395 1 1 41 HIS C C 11.953 1.264 -3.642 1.00 . A A . 538 HIS C 1 1 8 5396 1 1 41 HIS CA C 12.522 -0.114 -3.313 1.00 . A A . 538 HIS CA 1 1 8 5397 1 1 41 HIS CB C 13.017 -0.831 -4.590 1.00 . A A . 538 HIS CB 1 1 8 5398 1 1 41 HIS CD2 C 11.213 -1.845 -6.140 1.00 . A A . 538 HIS CD2 1 1 8 5399 1 1 41 HIS CE1 C 11.021 -0.161 -7.501 1.00 . A A . 538 HIS CE1 1 1 8 5400 1 1 41 HIS CG C 12.054 -0.862 -5.747 1.00 . A A . 538 HIS CG 1 1 8 5401 1 1 41 HIS H H 11.065 -1.633 -3.019 1.00 . A A . 538 HIS H 1 1 8 5402 1 1 41 HIS HA H 13.375 0.048 -2.670 1.00 . A A . 538 HIS HA 1 1 8 5403 1 1 41 HIS HB2 H 13.915 -0.344 -4.932 1.00 . A A . 538 HIS HB2 1 1 8 5404 1 1 41 HIS HB3 H 13.253 -1.853 -4.335 1.00 . A A . 538 HIS HB3 1 1 8 5405 1 1 41 HIS HD2 H 11.028 -2.778 -5.631 1.00 . A A . 538 HIS HD2 1 1 8 5406 1 1 41 HIS HE1 H 10.670 0.472 -8.302 1.00 . A A . 538 HIS HE1 1 1 8 5407 1 1 41 HIS HE2 H 9.742 -1.790 -7.646 1.00 . A A . 538 HIS HE2 1 1 8 5408 1 1 41 HIS N N 11.560 -0.919 -2.568 1.00 . A A . 538 HIS N 1 1 8 5409 1 1 41 HIS ND1 N 11.931 0.200 -6.610 1.00 . A A . 538 HIS ND1 1 1 8 5410 1 1 41 HIS NE2 N 10.562 -1.392 -7.260 1.00 . A A . 538 HIS NE2 1 1 8 5411 1 1 41 HIS O O 12.705 2.190 -3.950 1.00 . A A . 538 HIS O 1 1 8 5412 1 1 42 ILE C C 9.813 3.492 -2.539 1.00 . A A . 539 ILE C 1 1 8 5413 1 1 42 ILE CA C 10.023 2.706 -3.844 1.00 . A A . 539 ILE CA 1 1 8 5414 1 1 42 ILE CB C 8.689 2.555 -4.655 1.00 . A A . 539 ILE CB 1 1 8 5415 1 1 42 ILE CD1 C 6.856 3.894 -3.462 1.00 . A A . 539 ILE CD1 1 1 8 5416 1 1 42 ILE CG1 C 7.429 2.524 -3.775 1.00 . A A . 539 ILE CG1 1 1 8 5417 1 1 42 ILE CG2 C 8.732 1.306 -5.515 1.00 . A A . 539 ILE CG2 1 1 8 5418 1 1 42 ILE H H 10.058 0.631 -3.397 1.00 . A A . 539 ILE H 1 1 8 5419 1 1 42 ILE HA H 10.720 3.261 -4.459 1.00 . A A . 539 ILE HA 1 1 8 5420 1 1 42 ILE HB H 8.622 3.387 -5.323 1.00 . A A . 539 ILE HB 1 1 8 5421 1 1 42 ILE HD11 H 6.592 4.392 -4.383 1.00 . A A . 539 ILE HD11 1 1 8 5422 1 1 42 ILE HD12 H 5.975 3.784 -2.847 1.00 . A A . 539 ILE HD12 1 1 8 5423 1 1 42 ILE HD13 H 7.595 4.480 -2.935 1.00 . A A . 539 ILE HD13 1 1 8 5424 1 1 42 ILE HG12 H 6.664 1.962 -4.282 1.00 . A A . 539 ILE HG12 1 1 8 5425 1 1 42 ILE HG13 H 7.663 2.041 -2.837 1.00 . A A . 539 ILE HG13 1 1 8 5426 1 1 42 ILE HG21 H 8.889 0.443 -4.887 1.00 . A A . 539 ILE HG21 1 1 8 5427 1 1 42 ILE HG22 H 7.797 1.202 -6.044 1.00 . A A . 539 ILE HG22 1 1 8 5428 1 1 42 ILE HG23 H 9.542 1.385 -6.226 1.00 . A A . 539 ILE HG23 1 1 8 5429 1 1 42 ILE N N 10.632 1.410 -3.579 1.00 . A A . 539 ILE N 1 1 8 5430 1 1 42 ILE O O 10.106 4.690 -2.470 1.00 . A A . 539 ILE O 1 1 8 5431 1 1 43 CYS C C 10.191 4.150 0.320 1.00 . A A . 540 CYS C 1 1 8 5432 1 1 43 CYS CA C 8.972 3.426 -0.251 1.00 . A A . 540 CYS CA 1 1 8 5433 1 1 43 CYS CB C 8.519 2.330 0.717 1.00 . A A . 540 CYS CB 1 1 8 5434 1 1 43 CYS H H 9.071 1.852 -1.655 1.00 . A A . 540 CYS H 1 1 8 5435 1 1 43 CYS HA H 8.166 4.129 -0.386 1.00 . A A . 540 CYS HA 1 1 8 5436 1 1 43 CYS HB2 H 7.886 1.635 0.187 1.00 . A A . 540 CYS HB2 1 1 8 5437 1 1 43 CYS HB3 H 9.392 1.804 1.077 1.00 . A A . 540 CYS HB3 1 1 8 5438 1 1 43 CYS N N 9.289 2.809 -1.527 1.00 . A A . 540 CYS N 1 1 8 5439 1 1 43 CYS O O 11.245 3.554 0.554 1.00 . A A . 540 CYS O 1 1 8 5440 1 1 43 CYS SG S 7.589 2.919 2.163 1.00 . A A . 540 CYS SG 1 1 8 5441 1 1 44 GLY C C 11.108 7.626 0.284 1.00 . A A . 541 GLY C 1 1 8 5442 1 1 44 GLY CA C 11.125 6.276 0.961 1.00 . A A . 541 GLY CA 1 1 8 5443 1 1 44 GLY H H 9.129 5.833 0.389 1.00 . A A . 541 GLY H 1 1 8 5444 1 1 44 GLY HA2 H 11.057 6.418 2.030 1.00 . A A . 541 GLY HA2 1 1 8 5445 1 1 44 GLY HA3 H 12.057 5.779 0.731 1.00 . A A . 541 GLY HA3 1 1 8 5446 1 1 44 GLY N N 10.024 5.444 0.522 1.00 . A A . 541 GLY N 1 1 8 5447 1 1 44 GLY O O 11.575 8.618 0.843 1.00 . A A . 541 GLY O 1 1 8 5448 1 1 45 GLN C C 9.136 9.620 -1.114 1.00 . A A . 542 GLN C 1 1 8 5449 1 1 45 GLN CA C 10.376 8.912 -1.649 1.00 . A A . 542 GLN CA 1 1 8 5450 1 1 45 GLN CB C 10.225 8.634 -3.150 1.00 . A A . 542 GLN CB 1 1 8 5451 1 1 45 GLN CD C 9.027 7.310 -4.958 1.00 . A A . 542 GLN CD 1 1 8 5452 1 1 45 GLN CG C 9.108 7.652 -3.481 1.00 . A A . 542 GLN CG 1 1 8 5453 1 1 45 GLN H H 10.304 6.823 -1.358 1.00 . A A . 542 GLN H 1 1 8 5454 1 1 45 GLN HA H 11.240 9.536 -1.485 1.00 . A A . 542 GLN HA 1 1 8 5455 1 1 45 GLN HB2 H 10.020 9.565 -3.657 1.00 . A A . 542 GLN HB2 1 1 8 5456 1 1 45 GLN HB3 H 11.153 8.228 -3.523 1.00 . A A . 542 GLN HB3 1 1 8 5457 1 1 45 GLN HE21 H 10.984 7.578 -5.171 1.00 . A A . 542 GLN HE21 1 1 8 5458 1 1 45 GLN HE22 H 10.127 7.110 -6.602 1.00 . A A . 542 GLN HE22 1 1 8 5459 1 1 45 GLN HG2 H 9.275 6.740 -2.927 1.00 . A A . 542 GLN HG2 1 1 8 5460 1 1 45 GLN HG3 H 8.166 8.085 -3.176 1.00 . A A . 542 GLN HG3 1 1 8 5461 1 1 45 GLN N N 10.572 7.662 -0.930 1.00 . A A . 542 GLN N 1 1 8 5462 1 1 45 GLN NE2 N 10.159 7.340 -5.642 1.00 . A A . 542 GLN NE2 1 1 8 5463 1 1 45 GLN O O 8.211 8.973 -0.627 1.00 . A A . 542 GLN O 1 1 8 5464 1 1 45 GLN OE1 O 7.949 7.017 -5.482 1.00 . A A . 542 GLN OE1 1 1 8 5465 1 1 46 SER C C 7.282 12.416 -1.853 1.00 . A A . 543 SER C 1 1 8 5466 1 1 46 SER CA C 7.998 11.718 -0.700 1.00 . A A . 543 SER CA 1 1 8 5467 1 1 46 SER CB C 8.466 12.744 0.332 1.00 . A A . 543 SER CB 1 1 8 5468 1 1 46 SER H H 9.908 11.411 -1.563 1.00 . A A . 543 SER H 1 1 8 5469 1 1 46 SER HA H 7.307 11.037 -0.224 1.00 . A A . 543 SER HA 1 1 8 5470 1 1 46 SER HB2 H 9.159 13.431 -0.134 1.00 . A A . 543 SER HB2 1 1 8 5471 1 1 46 SER HB3 H 7.614 13.291 0.706 1.00 . A A . 543 SER HB3 1 1 8 5472 1 1 46 SER HG H 10.004 11.823 1.143 1.00 . A A . 543 SER HG 1 1 8 5473 1 1 46 SER N N 9.130 10.941 -1.181 1.00 . A A . 543 SER N 1 1 8 5474 1 1 46 SER O O 6.054 12.368 -1.950 1.00 . A A . 543 SER O 1 1 8 5475 1 1 46 SER OG O 9.116 12.106 1.420 1.00 . A A . 543 SER OG 1 1 8 5476 1 1 47 ALA C C 8.616 14.076 -4.870 1.00 . A A . 544 ALA C 1 1 8 5477 1 1 47 ALA CA C 7.512 13.771 -3.865 1.00 . A A . 544 ALA CA 1 1 8 5478 1 1 47 ALA CB C 6.827 15.057 -3.409 1.00 . A A . 544 ALA CB 1 1 8 5479 1 1 47 ALA H H 9.031 13.034 -2.596 1.00 . A A . 544 ALA H 1 1 8 5480 1 1 47 ALA HA H 6.772 13.141 -4.339 1.00 . A A . 544 ALA HA 1 1 8 5481 1 1 47 ALA HB1 H 7.551 15.700 -2.930 1.00 . A A . 544 ALA HB1 1 1 8 5482 1 1 47 ALA HB2 H 6.405 15.563 -4.264 1.00 . A A . 544 ALA HB2 1 1 8 5483 1 1 47 ALA HB3 H 6.041 14.816 -2.708 1.00 . A A . 544 ALA HB3 1 1 8 5484 1 1 47 ALA N N 8.057 13.051 -2.723 1.00 . A A . 544 ALA N 1 1 8 5485 1 1 47 ALA O O 9.252 15.147 -4.759 1.00 . A A . 544 ALA O 1 1 8 5486 1 1 47 ALA OXT O 8.868 13.233 -5.753 1.00 . A A . 544 ALA OXT 1 1 8 5487 2 2 1 ZN ZN ZN -5.667 -5.509 -1.056 1.00 . B A . 601 ZN ZN 1 1 8 5488 3 2 1 ZN ZN ZN 5.330 2.875 1.700 1.00 . C A . 602 ZN ZN 1 1 9 5489 1 1 1 GLY C C -13.325 3.616 3.917 1.00 . A A . 498 GLY C 1 1 9 5490 1 1 1 GLY CA C -12.662 4.904 4.350 1.00 . A A . 498 GLY CA 1 1 9 5491 1 1 1 GLY H1 H -13.666 5.058 6.172 1.00 . A A . 498 GLY H1 1 1 9 5492 1 1 1 GLY H2 H -14.394 5.922 4.907 1.00 . A A . 498 GLY H2 1 1 9 5493 1 1 1 GLY H3 H -12.983 6.512 5.632 1.00 . A A . 498 GLY H3 1 1 9 5494 1 1 1 GLY HA2 H -12.505 5.526 3.480 1.00 . A A . 498 GLY HA2 1 1 9 5495 1 1 1 GLY HA3 H -11.704 4.673 4.795 1.00 . A A . 498 GLY HA3 1 1 9 5496 1 1 1 GLY N N -13.482 5.649 5.332 1.00 . A A . 498 GLY N 1 1 9 5497 1 1 1 GLY O O -13.315 2.630 4.656 1.00 . A A . 498 GLY O 1 1 9 5498 1 1 2 ALA C C -14.729 2.471 0.689 1.00 . A A . 499 ALA C 1 1 9 5499 1 1 2 ALA CA C -14.609 2.451 2.214 1.00 . A A . 499 ALA CA 1 1 9 5500 1 1 2 ALA CB C -15.994 2.349 2.843 1.00 . A A . 499 ALA CB 1 1 9 5501 1 1 2 ALA H H -13.878 4.445 2.178 1.00 . A A . 499 ALA H 1 1 9 5502 1 1 2 ALA HA H -14.046 1.577 2.507 1.00 . A A . 499 ALA HA 1 1 9 5503 1 1 2 ALA HB1 H -16.589 3.198 2.542 1.00 . A A . 499 ALA HB1 1 1 9 5504 1 1 2 ALA HB2 H -16.473 1.440 2.514 1.00 . A A . 499 ALA HB2 1 1 9 5505 1 1 2 ALA HB3 H -15.900 2.339 3.919 1.00 . A A . 499 ALA HB3 1 1 9 5506 1 1 2 ALA N N -13.914 3.624 2.725 1.00 . A A . 499 ALA N 1 1 9 5507 1 1 2 ALA O O -15.151 1.484 0.088 1.00 . A A . 499 ALA O 1 1 9 5508 1 1 3 MET C C -13.628 4.767 -1.992 1.00 . A A . 500 MET C 1 1 9 5509 1 1 3 MET CA C -14.555 3.712 -1.388 1.00 . A A . 500 MET CA 1 1 9 5510 1 1 3 MET CB C -16.014 4.063 -1.694 1.00 . A A . 500 MET CB 1 1 9 5511 1 1 3 MET CE C -18.152 4.399 -5.265 1.00 . A A . 500 MET CE 1 1 9 5512 1 1 3 MET CG C -16.360 4.070 -3.173 1.00 . A A . 500 MET CG 1 1 9 5513 1 1 3 MET H H -13.997 4.339 0.568 1.00 . A A . 500 MET H 1 1 9 5514 1 1 3 MET HA H -14.328 2.755 -1.834 1.00 . A A . 500 MET HA 1 1 9 5515 1 1 3 MET HB2 H -16.652 3.344 -1.202 1.00 . A A . 500 MET HB2 1 1 9 5516 1 1 3 MET HB3 H -16.224 5.045 -1.295 1.00 . A A . 500 MET HB3 1 1 9 5517 1 1 3 MET HE1 H -17.896 3.397 -5.577 1.00 . A A . 500 MET HE1 1 1 9 5518 1 1 3 MET HE2 H -19.150 4.637 -5.603 1.00 . A A . 500 MET HE2 1 1 9 5519 1 1 3 MET HE3 H -17.451 5.099 -5.694 1.00 . A A . 500 MET HE3 1 1 9 5520 1 1 3 MET HG2 H -15.727 4.787 -3.675 1.00 . A A . 500 MET HG2 1 1 9 5521 1 1 3 MET HG3 H -16.175 3.085 -3.576 1.00 . A A . 500 MET HG3 1 1 9 5522 1 1 3 MET N N -14.376 3.588 0.057 1.00 . A A . 500 MET N 1 1 9 5523 1 1 3 MET O O -13.289 4.705 -3.175 1.00 . A A . 500 MET O 1 1 9 5524 1 1 3 MET SD S -18.085 4.505 -3.476 1.00 . A A . 500 MET SD 1 1 9 5525 1 1 4 GLU C C -10.940 6.458 -1.847 1.00 . A A . 501 GLU C 1 1 9 5526 1 1 4 GLU CA C -12.406 6.848 -1.651 1.00 . A A . 501 GLU CA 1 1 9 5527 1 1 4 GLU CB C -12.519 8.061 -0.714 1.00 . A A . 501 GLU CB 1 1 9 5528 1 1 4 GLU CD C -13.737 7.155 1.308 1.00 . A A . 501 GLU CD 1 1 9 5529 1 1 4 GLU CG C -12.443 7.733 0.772 1.00 . A A . 501 GLU CG 1 1 9 5530 1 1 4 GLU H H -13.461 5.687 -0.223 1.00 . A A . 501 GLU H 1 1 9 5531 1 1 4 GLU HA H -12.800 7.131 -2.615 1.00 . A A . 501 GLU HA 1 1 9 5532 1 1 4 GLU HB2 H -11.720 8.749 -0.945 1.00 . A A . 501 GLU HB2 1 1 9 5533 1 1 4 GLU HB3 H -13.464 8.552 -0.901 1.00 . A A . 501 GLU HB3 1 1 9 5534 1 1 4 GLU HG2 H -11.655 7.010 0.927 1.00 . A A . 501 GLU HG2 1 1 9 5535 1 1 4 GLU HG3 H -12.213 8.636 1.318 1.00 . A A . 501 GLU HG3 1 1 9 5536 1 1 4 GLU N N -13.216 5.728 -1.177 1.00 . A A . 501 GLU N 1 1 9 5537 1 1 4 GLU O O -10.133 7.264 -2.319 1.00 . A A . 501 GLU O 1 1 9 5538 1 1 4 GLU OE1 O -14.649 7.938 1.643 1.00 . A A . 501 GLU OE1 1 1 9 5539 1 1 4 GLU OE2 O -13.857 5.914 1.375 1.00 . A A . 501 GLU OE2 1 1 9 5540 1 1 5 GLN C C -9.366 3.281 -2.273 1.00 . A A . 502 GLN C 1 1 9 5541 1 1 5 GLN CA C -9.266 4.713 -1.765 1.00 . A A . 502 GLN CA 1 1 9 5542 1 1 5 GLN CB C -8.358 4.785 -0.529 1.00 . A A . 502 GLN CB 1 1 9 5543 1 1 5 GLN CD C -9.884 4.779 1.497 1.00 . A A . 502 GLN CD 1 1 9 5544 1 1 5 GLN CG C -8.876 4.005 0.671 1.00 . A A . 502 GLN CG 1 1 9 5545 1 1 5 GLN H H -11.258 4.648 -1.064 1.00 . A A . 502 GLN H 1 1 9 5546 1 1 5 GLN HA H -8.852 5.325 -2.554 1.00 . A A . 502 GLN HA 1 1 9 5547 1 1 5 GLN HB2 H -7.387 4.392 -0.789 1.00 . A A . 502 GLN HB2 1 1 9 5548 1 1 5 GLN HB3 H -8.249 5.819 -0.239 1.00 . A A . 502 GLN HB3 1 1 9 5549 1 1 5 GLN HE21 H -8.878 6.475 1.213 1.00 . A A . 502 GLN HE21 1 1 9 5550 1 1 5 GLN HE22 H -10.314 6.595 2.179 1.00 . A A . 502 GLN HE22 1 1 9 5551 1 1 5 GLN HG2 H -9.346 3.100 0.319 1.00 . A A . 502 GLN HG2 1 1 9 5552 1 1 5 GLN HG3 H -8.039 3.748 1.304 1.00 . A A . 502 GLN HG3 1 1 9 5553 1 1 5 GLN N N -10.597 5.229 -1.495 1.00 . A A . 502 GLN N 1 1 9 5554 1 1 5 GLN NE2 N -9.673 6.078 1.642 1.00 . A A . 502 GLN NE2 1 1 9 5555 1 1 5 GLN O O -10.318 2.571 -1.961 1.00 . A A . 502 GLN O 1 1 9 5556 1 1 5 GLN OE1 O -10.820 4.202 2.040 1.00 . A A . 502 GLN OE1 1 1 9 5557 1 1 6 SER C C -7.059 0.850 -3.405 1.00 . A A . 503 SER C 1 1 9 5558 1 1 6 SER CA C -8.395 1.546 -3.647 1.00 . A A . 503 SER CA 1 1 9 5559 1 1 6 SER CB C -8.683 1.654 -5.143 1.00 . A A . 503 SER CB 1 1 9 5560 1 1 6 SER H H -7.673 3.491 -3.298 1.00 . A A . 503 SER H 1 1 9 5561 1 1 6 SER HA H -9.181 0.975 -3.178 1.00 . A A . 503 SER HA 1 1 9 5562 1 1 6 SER HB2 H -8.360 0.749 -5.637 1.00 . A A . 503 SER HB2 1 1 9 5563 1 1 6 SER HB3 H -9.742 1.790 -5.296 1.00 . A A . 503 SER HB3 1 1 9 5564 1 1 6 SER HG H -7.473 2.457 -6.470 1.00 . A A . 503 SER HG 1 1 9 5565 1 1 6 SER N N -8.399 2.876 -3.073 1.00 . A A . 503 SER N 1 1 9 5566 1 1 6 SER O O -6.001 1.449 -3.597 1.00 . A A . 503 SER O 1 1 9 5567 1 1 6 SER OG O -7.993 2.757 -5.707 1.00 . A A . 503 SER OG 1 1 9 5568 1 1 7 CYS C C -5.126 -1.268 -4.055 1.00 . A A . 504 CYS C 1 1 9 5569 1 1 7 CYS CA C -5.907 -1.185 -2.757 1.00 . A A . 504 CYS CA 1 1 9 5570 1 1 7 CYS CB C -6.255 -2.596 -2.262 1.00 . A A . 504 CYS CB 1 1 9 5571 1 1 7 CYS H H -7.994 -0.832 -2.843 1.00 . A A . 504 CYS H 1 1 9 5572 1 1 7 CYS HA H -5.308 -0.680 -2.012 1.00 . A A . 504 CYS HA 1 1 9 5573 1 1 7 CYS HB2 H -6.875 -2.515 -1.382 1.00 . A A . 504 CYS HB2 1 1 9 5574 1 1 7 CYS HB3 H -6.806 -3.109 -3.034 1.00 . A A . 504 CYS HB3 1 1 9 5575 1 1 7 CYS N N -7.112 -0.410 -2.986 1.00 . A A . 504 CYS N 1 1 9 5576 1 1 7 CYS O O -5.658 -1.688 -5.084 1.00 . A A . 504 CYS O 1 1 9 5577 1 1 7 CYS SG S -4.812 -3.633 -1.826 1.00 . A A . 504 CYS SG 1 1 9 5578 1 1 8 VAL C C -2.813 -2.274 -5.689 1.00 . A A . 505 VAL C 1 1 9 5579 1 1 8 VAL CA C -3.007 -0.850 -5.168 1.00 . A A . 505 VAL CA 1 1 9 5580 1 1 8 VAL CB C -1.638 -0.204 -4.840 1.00 . A A . 505 VAL CB 1 1 9 5581 1 1 8 VAL CG1 C -0.836 -1.074 -3.884 1.00 . A A . 505 VAL CG1 1 1 9 5582 1 1 8 VAL CG2 C -0.850 0.083 -6.109 1.00 . A A . 505 VAL CG2 1 1 9 5583 1 1 8 VAL H H -3.531 -0.475 -3.156 1.00 . A A . 505 VAL H 1 1 9 5584 1 1 8 VAL HA H -3.484 -0.261 -5.937 1.00 . A A . 505 VAL HA 1 1 9 5585 1 1 8 VAL HB H -1.828 0.739 -4.347 1.00 . A A . 505 VAL HB 1 1 9 5586 1 1 8 VAL HG11 H -0.670 -2.042 -4.333 1.00 . A A . 505 VAL HG11 1 1 9 5587 1 1 8 VAL HG12 H 0.115 -0.604 -3.679 1.00 . A A . 505 VAL HG12 1 1 9 5588 1 1 8 VAL HG13 H -1.384 -1.195 -2.961 1.00 . A A . 505 VAL HG13 1 1 9 5589 1 1 8 VAL HG21 H -1.410 0.761 -6.735 1.00 . A A . 505 VAL HG21 1 1 9 5590 1 1 8 VAL HG22 H 0.098 0.533 -5.848 1.00 . A A . 505 VAL HG22 1 1 9 5591 1 1 8 VAL HG23 H -0.676 -0.840 -6.641 1.00 . A A . 505 VAL HG23 1 1 9 5592 1 1 8 VAL N N -3.874 -0.840 -4.001 1.00 . A A . 505 VAL N 1 1 9 5593 1 1 8 VAL O O -2.379 -2.483 -6.821 1.00 . A A . 505 VAL O 1 1 9 5594 1 1 9 ASN C C -4.349 -5.241 -5.663 1.00 . A A . 506 ASN C 1 1 9 5595 1 1 9 ASN CA C -3.012 -4.645 -5.232 1.00 . A A . 506 ASN CA 1 1 9 5596 1 1 9 ASN CB C -2.422 -5.431 -4.054 1.00 . A A . 506 ASN CB 1 1 9 5597 1 1 9 ASN CG C -2.156 -6.886 -4.388 1.00 . A A . 506 ASN CG 1 1 9 5598 1 1 9 ASN H H -3.523 -3.034 -3.974 1.00 . A A . 506 ASN H 1 1 9 5599 1 1 9 ASN HA H -2.324 -4.693 -6.062 1.00 . A A . 506 ASN HA 1 1 9 5600 1 1 9 ASN HB2 H -1.489 -4.976 -3.760 1.00 . A A . 506 ASN HB2 1 1 9 5601 1 1 9 ASN HB3 H -3.112 -5.392 -3.224 1.00 . A A . 506 ASN HB3 1 1 9 5602 1 1 9 ASN HD21 H -3.865 -7.433 -3.533 1.00 . A A . 506 ASN HD21 1 1 9 5603 1 1 9 ASN HD22 H -2.914 -8.711 -4.214 1.00 . A A . 506 ASN HD22 1 1 9 5604 1 1 9 ASN N N -3.160 -3.253 -4.862 1.00 . A A . 506 ASN N 1 1 9 5605 1 1 9 ASN ND2 N -3.067 -7.764 -4.008 1.00 . A A . 506 ASN ND2 1 1 9 5606 1 1 9 ASN O O -4.388 -6.141 -6.501 1.00 . A A . 506 ASN O 1 1 9 5607 1 1 9 ASN OD1 O -1.121 -7.220 -4.959 1.00 . A A . 506 ASN OD1 1 1 9 5608 1 1 10 CYS C C -7.780 -4.248 -5.837 1.00 . A A . 507 CYS C 1 1 9 5609 1 1 10 CYS CA C -6.757 -5.298 -5.379 1.00 . A A . 507 CYS CA 1 1 9 5610 1 1 10 CYS CB C -7.255 -6.018 -4.132 1.00 . A A . 507 CYS CB 1 1 9 5611 1 1 10 CYS H H -5.373 -3.931 -4.543 1.00 . A A . 507 CYS H 1 1 9 5612 1 1 10 CYS HA H -6.640 -6.025 -6.169 1.00 . A A . 507 CYS HA 1 1 9 5613 1 1 10 CYS HB2 H -7.691 -5.297 -3.458 1.00 . A A . 507 CYS HB2 1 1 9 5614 1 1 10 CYS HB3 H -8.005 -6.742 -4.415 1.00 . A A . 507 CYS HB3 1 1 9 5615 1 1 10 CYS N N -5.447 -4.720 -5.119 1.00 . A A . 507 CYS N 1 1 9 5616 1 1 10 CYS O O -7.956 -4.035 -7.041 1.00 . A A . 507 CYS O 1 1 9 5617 1 1 10 CYS SG S -5.946 -6.902 -3.230 1.00 . A A . 507 CYS SG 1 1 9 5618 1 1 11 GLY C C -9.952 -1.772 -4.082 1.00 . A A . 508 GLY C 1 1 9 5619 1 1 11 GLY CA C -9.515 -2.663 -5.237 1.00 . A A . 508 GLY CA 1 1 9 5620 1 1 11 GLY H H -8.187 -3.703 -3.945 1.00 . A A . 508 GLY H 1 1 9 5621 1 1 11 GLY HA2 H -9.182 -2.035 -6.050 1.00 . A A . 508 GLY HA2 1 1 9 5622 1 1 11 GLY HA3 H -10.365 -3.240 -5.572 1.00 . A A . 508 GLY HA3 1 1 9 5623 1 1 11 GLY N N -8.438 -3.581 -4.886 1.00 . A A . 508 GLY N 1 1 9 5624 1 1 11 GLY O O -9.320 -1.762 -3.030 1.00 . A A . 508 GLY O 1 1 9 5625 1 1 12 ARG C C -11.760 -0.475 -1.919 1.00 . A A . 509 ARG C 1 1 9 5626 1 1 12 ARG CA C -11.550 -0.005 -3.360 1.00 . A A . 509 ARG CA 1 1 9 5627 1 1 12 ARG CB C -12.875 0.545 -3.865 1.00 . A A . 509 ARG CB 1 1 9 5628 1 1 12 ARG CD C -14.176 1.627 -5.683 1.00 . A A . 509 ARG CD 1 1 9 5629 1 1 12 ARG CG C -12.789 1.277 -5.188 1.00 . A A . 509 ARG CG 1 1 9 5630 1 1 12 ARG CZ C -15.191 2.523 -7.740 1.00 . A A . 509 ARG CZ 1 1 9 5631 1 1 12 ARG H H -11.544 -1.173 -5.136 1.00 . A A . 509 ARG H 1 1 9 5632 1 1 12 ARG HA H -10.830 0.798 -3.357 1.00 . A A . 509 ARG HA 1 1 9 5633 1 1 12 ARG HB2 H -13.566 -0.276 -3.980 1.00 . A A . 509 ARG HB2 1 1 9 5634 1 1 12 ARG HB3 H -13.267 1.230 -3.128 1.00 . A A . 509 ARG HB3 1 1 9 5635 1 1 12 ARG HD2 H -14.717 0.707 -5.854 1.00 . A A . 509 ARG HD2 1 1 9 5636 1 1 12 ARG HD3 H -14.679 2.200 -4.918 1.00 . A A . 509 ARG HD3 1 1 9 5637 1 1 12 ARG HE H -13.301 2.856 -7.154 1.00 . A A . 509 ARG HE 1 1 9 5638 1 1 12 ARG HG2 H -12.219 2.184 -5.055 1.00 . A A . 509 ARG HG2 1 1 9 5639 1 1 12 ARG HG3 H -12.303 0.640 -5.915 1.00 . A A . 509 ARG HG3 1 1 9 5640 1 1 12 ARG HH11 H -16.438 1.394 -6.592 1.00 . A A . 509 ARG HH11 1 1 9 5641 1 1 12 ARG HH12 H -17.138 2.028 -8.059 1.00 . A A . 509 ARG HH12 1 1 9 5642 1 1 12 ARG HH21 H -14.221 3.708 -9.069 1.00 . A A . 509 ARG HH21 1 1 9 5643 1 1 12 ARG HH22 H -15.870 3.333 -9.473 1.00 . A A . 509 ARG HH22 1 1 9 5644 1 1 12 ARG N N -11.053 -1.043 -4.290 1.00 . A A . 509 ARG N 1 1 9 5645 1 1 12 ARG NE N -14.148 2.399 -6.922 1.00 . A A . 509 ARG NE 1 1 9 5646 1 1 12 ARG NH1 N -16.345 1.934 -7.443 1.00 . A A . 509 ARG NH1 1 1 9 5647 1 1 12 ARG NH2 N -15.085 3.245 -8.847 1.00 . A A . 509 ARG NH2 1 1 9 5648 1 1 12 ARG O O -12.010 0.343 -1.035 1.00 . A A . 509 ARG O 1 1 9 5649 1 1 13 GLU C C -10.708 -1.864 0.601 1.00 . A A . 510 GLU C 1 1 9 5650 1 1 13 GLU CA C -11.841 -2.318 -0.336 1.00 . A A . 510 GLU CA 1 1 9 5651 1 1 13 GLU CB C -11.937 -3.844 -0.386 1.00 . A A . 510 GLU CB 1 1 9 5652 1 1 13 GLU CD C -12.878 -5.914 0.705 1.00 . A A . 510 GLU CD 1 1 9 5653 1 1 13 GLU CG C -12.511 -4.460 0.880 1.00 . A A . 510 GLU CG 1 1 9 5654 1 1 13 GLU H H -11.555 -2.378 -2.440 1.00 . A A . 510 GLU H 1 1 9 5655 1 1 13 GLU HA H -12.765 -1.932 0.054 1.00 . A A . 510 GLU HA 1 1 9 5656 1 1 13 GLU HB2 H -12.568 -4.126 -1.217 1.00 . A A . 510 GLU HB2 1 1 9 5657 1 1 13 GLU HB3 H -10.949 -4.251 -0.543 1.00 . A A . 510 GLU HB3 1 1 9 5658 1 1 13 GLU HG2 H -11.775 -4.384 1.666 1.00 . A A . 510 GLU HG2 1 1 9 5659 1 1 13 GLU HG3 H -13.398 -3.911 1.163 1.00 . A A . 510 GLU HG3 1 1 9 5660 1 1 13 GLU N N -11.689 -1.770 -1.684 1.00 . A A . 510 GLU N 1 1 9 5661 1 1 13 GLU O O -10.666 -2.243 1.772 1.00 . A A . 510 GLU O 1 1 9 5662 1 1 13 GLU OE1 O -13.924 -6.193 0.084 1.00 . A A . 510 GLU OE1 1 1 9 5663 1 1 13 GLU OE2 O -12.139 -6.789 1.201 1.00 . A A . 510 GLU OE2 1 1 9 5664 1 1 14 ALA C C -9.090 0.044 2.160 1.00 . A A . 511 ALA C 1 1 9 5665 1 1 14 ALA CA C -8.660 -0.525 0.808 1.00 . A A . 511 ALA CA 1 1 9 5666 1 1 14 ALA CB C -7.977 0.558 -0.006 1.00 . A A . 511 ALA CB 1 1 9 5667 1 1 14 ALA H H -9.869 -0.848 -0.891 1.00 . A A . 511 ALA H 1 1 9 5668 1 1 14 ALA HA H -7.946 -1.317 0.974 1.00 . A A . 511 ALA HA 1 1 9 5669 1 1 14 ALA HB1 H -8.665 1.372 -0.172 1.00 . A A . 511 ALA HB1 1 1 9 5670 1 1 14 ALA HB2 H -7.113 0.919 0.531 1.00 . A A . 511 ALA HB2 1 1 9 5671 1 1 14 ALA HB3 H -7.664 0.150 -0.957 1.00 . A A . 511 ALA HB3 1 1 9 5672 1 1 14 ALA N N -9.781 -1.080 0.054 1.00 . A A . 511 ALA N 1 1 9 5673 1 1 14 ALA O O -9.901 0.970 2.234 1.00 . A A . 511 ALA O 1 1 9 5674 1 1 15 MET C C -7.591 0.263 5.357 1.00 . A A . 512 MET C 1 1 9 5675 1 1 15 MET CA C -8.857 -0.089 4.575 1.00 . A A . 512 MET CA 1 1 9 5676 1 1 15 MET CB C -9.631 -1.198 5.301 1.00 . A A . 512 MET CB 1 1 9 5677 1 1 15 MET CE C -11.261 -1.406 9.142 1.00 . A A . 512 MET CE 1 1 9 5678 1 1 15 MET CG C -10.066 -0.826 6.712 1.00 . A A . 512 MET CG 1 1 9 5679 1 1 15 MET H H -7.874 -1.224 3.093 1.00 . A A . 512 MET H 1 1 9 5680 1 1 15 MET HA H -9.482 0.789 4.502 1.00 . A A . 512 MET HA 1 1 9 5681 1 1 15 MET HB2 H -10.515 -1.436 4.728 1.00 . A A . 512 MET HB2 1 1 9 5682 1 1 15 MET HB3 H -9.006 -2.076 5.361 1.00 . A A . 512 MET HB3 1 1 9 5683 1 1 15 MET HE1 H -11.910 -0.560 8.968 1.00 . A A . 512 MET HE1 1 1 9 5684 1 1 15 MET HE2 H -11.761 -2.114 9.787 1.00 . A A . 512 MET HE2 1 1 9 5685 1 1 15 MET HE3 H -10.350 -1.070 9.614 1.00 . A A . 512 MET HE3 1 1 9 5686 1 1 15 MET HG2 H -9.194 -0.530 7.275 1.00 . A A . 512 MET HG2 1 1 9 5687 1 1 15 MET HG3 H -10.754 0.003 6.654 1.00 . A A . 512 MET HG3 1 1 9 5688 1 1 15 MET N N -8.527 -0.512 3.224 1.00 . A A . 512 MET N 1 1 9 5689 1 1 15 MET O O -7.642 0.993 6.348 1.00 . A A . 512 MET O 1 1 9 5690 1 1 15 MET SD S -10.872 -2.189 7.577 1.00 . A A . 512 MET SD 1 1 9 5691 1 1 16 SER C C -4.163 0.621 4.718 1.00 . A A . 513 SER C 1 1 9 5692 1 1 16 SER CA C -5.204 -0.017 5.630 1.00 . A A . 513 SER CA 1 1 9 5693 1 1 16 SER CB C -4.676 -1.312 6.255 1.00 . A A . 513 SER CB 1 1 9 5694 1 1 16 SER H H -6.439 -0.769 4.085 1.00 . A A . 513 SER H 1 1 9 5695 1 1 16 SER HA H -5.431 0.697 6.406 1.00 . A A . 513 SER HA 1 1 9 5696 1 1 16 SER HB2 H -4.449 -2.022 5.472 1.00 . A A . 513 SER HB2 1 1 9 5697 1 1 16 SER HB3 H -3.779 -1.100 6.819 1.00 . A A . 513 SER HB3 1 1 9 5698 1 1 16 SER HG H -5.991 -2.697 6.726 1.00 . A A . 513 SER HG 1 1 9 5699 1 1 16 SER N N -6.450 -0.256 4.918 1.00 . A A . 513 SER N 1 1 9 5700 1 1 16 SER O O -4.098 0.337 3.524 1.00 . A A . 513 SER O 1 1 9 5701 1 1 16 SER OG O -5.639 -1.884 7.124 1.00 . A A . 513 SER OG 1 1 9 5702 1 1 17 GLU C C -0.962 1.767 4.952 1.00 . A A . 514 GLU C 1 1 9 5703 1 1 17 GLU CA C -2.356 2.235 4.563 1.00 . A A . 514 GLU CA 1 1 9 5704 1 1 17 GLU CB C -2.519 3.729 4.862 1.00 . A A . 514 GLU CB 1 1 9 5705 1 1 17 GLU CD C -2.878 5.492 6.626 1.00 . A A . 514 GLU CD 1 1 9 5706 1 1 17 GLU CG C -2.440 4.073 6.340 1.00 . A A . 514 GLU CG 1 1 9 5707 1 1 17 GLU H H -3.438 1.636 6.265 1.00 . A A . 514 GLU H 1 1 9 5708 1 1 17 GLU HA H -2.517 2.083 3.505 1.00 . A A . 514 GLU HA 1 1 9 5709 1 1 17 GLU HB2 H -1.743 4.273 4.346 1.00 . A A . 514 GLU HB2 1 1 9 5710 1 1 17 GLU HB3 H -3.480 4.054 4.491 1.00 . A A . 514 GLU HB3 1 1 9 5711 1 1 17 GLU HG2 H -3.079 3.397 6.887 1.00 . A A . 514 GLU HG2 1 1 9 5712 1 1 17 GLU HG3 H -1.418 3.952 6.670 1.00 . A A . 514 GLU HG3 1 1 9 5713 1 1 17 GLU N N -3.362 1.493 5.299 1.00 . A A . 514 GLU N 1 1 9 5714 1 1 17 GLU O O -0.786 1.112 5.983 1.00 . A A . 514 GLU O 1 1 9 5715 1 1 17 GLU OE1 O -2.277 6.432 6.067 1.00 . A A . 514 GLU OE1 1 1 9 5716 1 1 17 GLU OE2 O -3.846 5.679 7.386 1.00 . A A . 514 GLU OE2 1 1 9 5717 1 1 18 CYS C C 1.897 2.792 5.497 1.00 . A A . 515 CYS C 1 1 9 5718 1 1 18 CYS CA C 1.408 1.819 4.439 1.00 . A A . 515 CYS CA 1 1 9 5719 1 1 18 CYS CB C 2.293 1.925 3.183 1.00 . A A . 515 CYS CB 1 1 9 5720 1 1 18 CYS H H -0.191 2.563 3.295 1.00 . A A . 515 CYS H 1 1 9 5721 1 1 18 CYS HA H 1.488 0.829 4.874 1.00 . A A . 515 CYS HA 1 1 9 5722 1 1 18 CYS HB2 H 2.248 0.993 2.640 1.00 . A A . 515 CYS HB2 1 1 9 5723 1 1 18 CYS HB3 H 1.917 2.719 2.554 1.00 . A A . 515 CYS HB3 1 1 9 5724 1 1 18 CYS N N 0.019 2.096 4.126 1.00 . A A . 515 CYS N 1 1 9 5725 1 1 18 CYS O O 1.801 4.011 5.342 1.00 . A A . 515 CYS O 1 1 9 5726 1 1 18 CYS SG S 4.055 2.278 3.536 1.00 . A A . 515 CYS SG 1 1 9 5727 1 1 19 THR C C 4.543 3.127 7.046 1.00 . A A . 516 THR C 1 1 9 5728 1 1 19 THR CA C 3.118 3.014 7.568 1.00 . A A . 516 THR CA 1 1 9 5729 1 1 19 THR CB C 3.093 2.351 8.954 1.00 . A A . 516 THR CB 1 1 9 5730 1 1 19 THR CG2 C 3.743 3.245 9.998 1.00 . A A . 516 THR CG2 1 1 9 5731 1 1 19 THR H H 2.189 1.309 6.803 1.00 . A A . 516 THR H 1 1 9 5732 1 1 19 THR HA H 2.682 4.002 7.642 1.00 . A A . 516 THR HA 1 1 9 5733 1 1 19 THR HB H 3.636 1.417 8.905 1.00 . A A . 516 THR HB 1 1 9 5734 1 1 19 THR HG1 H 1.163 2.240 8.562 1.00 . A A . 516 THR HG1 1 1 9 5735 1 1 19 THR HG21 H 3.229 4.195 10.030 1.00 . A A . 516 THR HG21 1 1 9 5736 1 1 19 THR HG22 H 3.683 2.769 10.964 1.00 . A A . 516 THR HG22 1 1 9 5737 1 1 19 THR HG23 H 4.779 3.404 9.740 1.00 . A A . 516 THR HG23 1 1 9 5738 1 1 19 THR N N 2.356 2.248 6.618 1.00 . A A . 516 THR N 1 1 9 5739 1 1 19 THR O O 5.249 2.126 6.896 1.00 . A A . 516 THR O 1 1 9 5740 1 1 19 THR OG1 O 1.733 2.086 9.326 1.00 . A A . 516 THR OG1 1 1 9 5741 1 1 20 GLY C C 5.974 5.589 4.984 1.00 . A A . 517 GLY C 1 1 9 5742 1 1 20 GLY CA C 6.190 4.561 6.062 1.00 . A A . 517 GLY CA 1 1 9 5743 1 1 20 GLY H H 4.478 5.104 7.183 1.00 . A A . 517 GLY H 1 1 9 5744 1 1 20 GLY HA2 H 6.961 4.907 6.737 1.00 . A A . 517 GLY HA2 1 1 9 5745 1 1 20 GLY HA3 H 6.502 3.632 5.611 1.00 . A A . 517 GLY HA3 1 1 9 5746 1 1 20 GLY N N 4.972 4.342 6.806 1.00 . A A . 517 GLY N 1 1 9 5747 1 1 20 GLY O O 6.661 6.606 4.951 1.00 . A A . 517 GLY O 1 1 9 5748 1 1 21 CYS C C 3.075 6.261 2.994 1.00 . A A . 518 CYS C 1 1 9 5749 1 1 21 CYS CA C 4.581 6.344 3.157 1.00 . A A . 518 CYS CA 1 1 9 5750 1 1 21 CYS CB C 5.267 6.166 1.800 1.00 . A A . 518 CYS CB 1 1 9 5751 1 1 21 CYS H H 4.565 4.455 4.108 1.00 . A A . 518 CYS H 1 1 9 5752 1 1 21 CYS HA H 4.837 7.302 3.579 1.00 . A A . 518 CYS HA 1 1 9 5753 1 1 21 CYS HB2 H 5.186 7.087 1.242 1.00 . A A . 518 CYS HB2 1 1 9 5754 1 1 21 CYS HB3 H 6.310 5.940 1.961 1.00 . A A . 518 CYS HB3 1 1 9 5755 1 1 21 CYS N N 5.010 5.336 4.106 1.00 . A A . 518 CYS N 1 1 9 5756 1 1 21 CYS O O 2.498 5.184 3.031 1.00 . A A . 518 CYS O 1 1 9 5757 1 1 21 CYS SG S 4.559 4.834 0.777 1.00 . A A . 518 CYS SG 1 1 9 5758 1 1 22 HIS C C 0.627 7.739 1.233 1.00 . A A . 519 HIS C 1 1 9 5759 1 1 22 HIS CA C 0.996 7.412 2.665 1.00 . A A . 519 HIS CA 1 1 9 5760 1 1 22 HIS CB C 0.375 8.432 3.627 1.00 . A A . 519 HIS CB 1 1 9 5761 1 1 22 HIS CD2 C 1.886 8.715 5.715 1.00 . A A . 519 HIS CD2 1 1 9 5762 1 1 22 HIS CE1 C 0.701 7.548 7.136 1.00 . A A . 519 HIS CE1 1 1 9 5763 1 1 22 HIS CG C 0.799 8.252 5.053 1.00 . A A . 519 HIS CG 1 1 9 5764 1 1 22 HIS H H 2.946 8.230 2.728 1.00 . A A . 519 HIS H 1 1 9 5765 1 1 22 HIS HA H 0.626 6.426 2.904 1.00 . A A . 519 HIS HA 1 1 9 5766 1 1 22 HIS HB2 H 0.661 9.427 3.320 1.00 . A A . 519 HIS HB2 1 1 9 5767 1 1 22 HIS HB3 H -0.701 8.344 3.586 1.00 . A A . 519 HIS HB3 1 1 9 5768 1 1 22 HIS HD1 H -0.781 7.056 5.804 1.00 . A A . 519 HIS HD1 1 1 9 5769 1 1 22 HIS HD2 H 2.675 9.331 5.302 1.00 . A A . 519 HIS HD2 1 1 9 5770 1 1 22 HIS HE1 H 0.368 7.063 8.042 1.00 . A A . 519 HIS HE1 1 1 9 5771 1 1 22 HIS HE2 H 2.383 8.546 7.751 1.00 . A A . 519 HIS HE2 1 1 9 5772 1 1 22 HIS N N 2.439 7.392 2.798 1.00 . A A . 519 HIS N 1 1 9 5773 1 1 22 HIS ND1 N 0.078 7.524 5.974 1.00 . A A . 519 HIS ND1 1 1 9 5774 1 1 22 HIS NE2 N 1.799 8.263 7.006 1.00 . A A . 519 HIS NE2 1 1 9 5775 1 1 22 HIS O O -0.433 8.307 0.963 1.00 . A A . 519 HIS O 1 1 9 5776 1 1 23 LYS C C 0.464 6.602 -1.766 1.00 . A A . 520 LYS C 1 1 9 5777 1 1 23 LYS CA C 1.308 7.679 -1.092 1.00 . A A . 520 LYS CA 1 1 9 5778 1 1 23 LYS CB C 2.661 7.830 -1.808 1.00 . A A . 520 LYS CB 1 1 9 5779 1 1 23 LYS CD C 4.829 6.739 -2.523 1.00 . A A . 520 LYS CD 1 1 9 5780 1 1 23 LYS CE C 4.885 7.609 -3.772 1.00 . A A . 520 LYS CE 1 1 9 5781 1 1 23 LYS CG C 3.399 6.515 -2.039 1.00 . A A . 520 LYS CG 1 1 9 5782 1 1 23 LYS H H 2.339 6.912 0.571 1.00 . A A . 520 LYS H 1 1 9 5783 1 1 23 LYS HA H 0.779 8.618 -1.149 1.00 . A A . 520 LYS HA 1 1 9 5784 1 1 23 LYS HB2 H 2.494 8.294 -2.769 1.00 . A A . 520 LYS HB2 1 1 9 5785 1 1 23 LYS HB3 H 3.298 8.472 -1.216 1.00 . A A . 520 LYS HB3 1 1 9 5786 1 1 23 LYS HD2 H 5.390 7.223 -1.739 1.00 . A A . 520 LYS HD2 1 1 9 5787 1 1 23 LYS HD3 H 5.276 5.779 -2.747 1.00 . A A . 520 LYS HD3 1 1 9 5788 1 1 23 LYS HE2 H 4.341 8.523 -3.584 1.00 . A A . 520 LYS HE2 1 1 9 5789 1 1 23 LYS HE3 H 5.919 7.844 -3.981 1.00 . A A . 520 LYS HE3 1 1 9 5790 1 1 23 LYS HG2 H 3.427 5.965 -1.110 1.00 . A A . 520 LYS HG2 1 1 9 5791 1 1 23 LYS HG3 H 2.862 5.943 -2.782 1.00 . A A . 520 LYS HG3 1 1 9 5792 1 1 23 LYS HZ1 H 3.310 6.655 -4.762 1.00 . A A . 520 LYS HZ1 1 1 9 5793 1 1 23 LYS HZ2 H 4.297 7.585 -5.773 1.00 . A A . 520 LYS HZ2 1 1 9 5794 1 1 23 LYS HZ3 H 4.845 6.086 -5.204 1.00 . A A . 520 LYS HZ3 1 1 9 5795 1 1 23 LYS N N 1.510 7.372 0.310 1.00 . A A . 520 LYS N 1 1 9 5796 1 1 23 LYS NZ N 4.293 6.936 -4.958 1.00 . A A . 520 LYS NZ 1 1 9 5797 1 1 23 LYS O O -0.127 6.842 -2.821 1.00 . A A . 520 LYS O 1 1 9 5798 1 1 24 VAL C C -1.243 3.708 -0.553 1.00 . A A . 521 VAL C 1 1 9 5799 1 1 24 VAL CA C -0.430 4.331 -1.681 1.00 . A A . 521 VAL CA 1 1 9 5800 1 1 24 VAL CB C 0.404 3.221 -2.362 1.00 . A A . 521 VAL CB 1 1 9 5801 1 1 24 VAL CG1 C 1.151 3.758 -3.574 1.00 . A A . 521 VAL CG1 1 1 9 5802 1 1 24 VAL CG2 C 1.374 2.595 -1.375 1.00 . A A . 521 VAL CG2 1 1 9 5803 1 1 24 VAL H H 0.907 5.258 -0.338 1.00 . A A . 521 VAL H 1 1 9 5804 1 1 24 VAL HA H -1.109 4.748 -2.413 1.00 . A A . 521 VAL HA 1 1 9 5805 1 1 24 VAL HB H -0.274 2.451 -2.703 1.00 . A A . 521 VAL HB 1 1 9 5806 1 1 24 VAL HG11 H 1.805 4.559 -3.265 1.00 . A A . 521 VAL HG11 1 1 9 5807 1 1 24 VAL HG12 H 1.735 2.966 -4.017 1.00 . A A . 521 VAL HG12 1 1 9 5808 1 1 24 VAL HG13 H 0.442 4.132 -4.298 1.00 . A A . 521 VAL HG13 1 1 9 5809 1 1 24 VAL HG21 H 0.824 2.173 -0.546 1.00 . A A . 521 VAL HG21 1 1 9 5810 1 1 24 VAL HG22 H 1.936 1.816 -1.868 1.00 . A A . 521 VAL HG22 1 1 9 5811 1 1 24 VAL HG23 H 2.052 3.352 -1.008 1.00 . A A . 521 VAL HG23 1 1 9 5812 1 1 24 VAL N N 0.397 5.415 -1.165 1.00 . A A . 521 VAL N 1 1 9 5813 1 1 24 VAL O O -0.916 3.863 0.623 1.00 . A A . 521 VAL O 1 1 9 5814 1 1 25 ASN C C -3.402 0.909 -0.302 1.00 . A A . 522 ASN C 1 1 9 5815 1 1 25 ASN CA C -3.166 2.372 0.056 1.00 . A A . 522 ASN CA 1 1 9 5816 1 1 25 ASN CB C -4.506 3.108 0.177 1.00 . A A . 522 ASN CB 1 1 9 5817 1 1 25 ASN CG C -4.784 4.021 -1.001 1.00 . A A . 522 ASN CG 1 1 9 5818 1 1 25 ASN H H -2.515 2.934 -1.875 1.00 . A A . 522 ASN H 1 1 9 5819 1 1 25 ASN HA H -2.662 2.410 1.009 1.00 . A A . 522 ASN HA 1 1 9 5820 1 1 25 ASN HB2 H -5.303 2.381 0.237 1.00 . A A . 522 ASN HB2 1 1 9 5821 1 1 25 ASN HB3 H -4.500 3.705 1.077 1.00 . A A . 522 ASN HB3 1 1 9 5822 1 1 25 ASN HD21 H -5.403 2.473 -2.086 1.00 . A A . 522 ASN HD21 1 1 9 5823 1 1 25 ASN HD22 H -5.433 4.020 -2.869 1.00 . A A . 522 ASN HD22 1 1 9 5824 1 1 25 ASN N N -2.305 3.018 -0.922 1.00 . A A . 522 ASN N 1 1 9 5825 1 1 25 ASN ND2 N -5.257 3.453 -2.092 1.00 . A A . 522 ASN ND2 1 1 9 5826 1 1 25 ASN O O -3.349 0.524 -1.472 1.00 . A A . 522 ASN O 1 1 9 5827 1 1 25 ASN OD1 O -4.544 5.223 -0.939 1.00 . A A . 522 ASN OD1 1 1 9 5828 1 1 26 TYR C C -5.200 -1.720 1.194 1.00 . A A . 523 TYR C 1 1 9 5829 1 1 26 TYR CA C -3.871 -1.323 0.564 1.00 . A A . 523 TYR CA 1 1 9 5830 1 1 26 TYR CB C -2.735 -2.103 1.237 1.00 . A A . 523 TYR CB 1 1 9 5831 1 1 26 TYR CD1 C -0.583 -0.778 1.184 1.00 . A A . 523 TYR CD1 1 1 9 5832 1 1 26 TYR CD2 C -0.815 -2.607 -0.326 1.00 . A A . 523 TYR CD2 1 1 9 5833 1 1 26 TYR CE1 C 0.683 -0.529 0.689 1.00 . A A . 523 TYR CE1 1 1 9 5834 1 1 26 TYR CE2 C 0.451 -2.359 -0.824 1.00 . A A . 523 TYR CE2 1 1 9 5835 1 1 26 TYR CG C -1.354 -1.820 0.684 1.00 . A A . 523 TYR CG 1 1 9 5836 1 1 26 TYR CZ C 1.193 -1.320 -0.314 1.00 . A A . 523 TYR CZ 1 1 9 5837 1 1 26 TYR H H -3.790 0.518 1.610 1.00 . A A . 523 TYR H 1 1 9 5838 1 1 26 TYR HA H -3.891 -1.543 -0.493 1.00 . A A . 523 TYR HA 1 1 9 5839 1 1 26 TYR HB2 H -2.723 -1.861 2.289 1.00 . A A . 523 TYR HB2 1 1 9 5840 1 1 26 TYR HB3 H -2.926 -3.160 1.124 1.00 . A A . 523 TYR HB3 1 1 9 5841 1 1 26 TYR HD1 H -0.985 -0.158 1.971 1.00 . A A . 523 TYR HD1 1 1 9 5842 1 1 26 TYR HD2 H -1.400 -3.424 -0.724 1.00 . A A . 523 TYR HD2 1 1 9 5843 1 1 26 TYR HE1 H 1.271 0.283 1.093 1.00 . A A . 523 TYR HE1 1 1 9 5844 1 1 26 TYR HE2 H 0.852 -2.980 -1.610 1.00 . A A . 523 TYR HE2 1 1 9 5845 1 1 26 TYR HH H 2.521 -1.379 -1.715 1.00 . A A . 523 TYR HH 1 1 9 5846 1 1 26 TYR N N -3.673 0.113 0.721 1.00 . A A . 523 TYR N 1 1 9 5847 1 1 26 TYR O O -5.889 -0.878 1.766 1.00 . A A . 523 TYR O 1 1 9 5848 1 1 26 TYR OH O 2.455 -1.076 -0.794 1.00 . A A . 523 TYR OH 1 1 9 5849 1 1 27 CYS C C -6.648 -4.466 2.760 1.00 . A A . 524 CYS C 1 1 9 5850 1 1 27 CYS CA C -6.840 -3.438 1.651 1.00 . A A . 524 CYS CA 1 1 9 5851 1 1 27 CYS CB C -7.746 -3.976 0.526 1.00 . A A . 524 CYS CB 1 1 9 5852 1 1 27 CYS H H -4.899 -3.667 0.836 1.00 . A A . 524 CYS H 1 1 9 5853 1 1 27 CYS HA H -7.315 -2.570 2.085 1.00 . A A . 524 CYS HA 1 1 9 5854 1 1 27 CYS HB2 H -8.769 -3.953 0.869 1.00 . A A . 524 CYS HB2 1 1 9 5855 1 1 27 CYS HB3 H -7.655 -3.324 -0.332 1.00 . A A . 524 CYS HB3 1 1 9 5856 1 1 27 CYS N N -5.547 -3.002 1.141 1.00 . A A . 524 CYS N 1 1 9 5857 1 1 27 CYS O O -7.597 -4.838 3.455 1.00 . A A . 524 CYS O 1 1 9 5858 1 1 27 CYS SG S -7.410 -5.677 -0.041 1.00 . A A . 524 CYS SG 1 1 9 5859 1 1 28 SER C C -3.584 -5.592 4.379 1.00 . A A . 525 SER C 1 1 9 5860 1 1 28 SER CA C -5.049 -5.796 4.022 1.00 . A A . 525 SER CA 1 1 9 5861 1 1 28 SER CB C -5.293 -7.256 3.633 1.00 . A A . 525 SER CB 1 1 9 5862 1 1 28 SER H H -4.701 -4.612 2.324 1.00 . A A . 525 SER H 1 1 9 5863 1 1 28 SER HA H -5.660 -5.545 4.878 1.00 . A A . 525 SER HA 1 1 9 5864 1 1 28 SER HB2 H -5.175 -7.879 4.505 1.00 . A A . 525 SER HB2 1 1 9 5865 1 1 28 SER HB3 H -6.295 -7.361 3.248 1.00 . A A . 525 SER HB3 1 1 9 5866 1 1 28 SER HG H -4.594 -7.282 1.785 1.00 . A A . 525 SER HG 1 1 9 5867 1 1 28 SER N N -5.405 -4.903 2.937 1.00 . A A . 525 SER N 1 1 9 5868 1 1 28 SER O O -2.834 -4.995 3.600 1.00 . A A . 525 SER O 1 1 9 5869 1 1 28 SER OG O -4.376 -7.693 2.640 1.00 . A A . 525 SER OG 1 1 9 5870 1 1 29 THR C C -0.963 -6.951 5.024 1.00 . A A . 526 THR C 1 1 9 5871 1 1 29 THR CA C -1.774 -6.027 5.927 1.00 . A A . 526 THR CA 1 1 9 5872 1 1 29 THR CB C -1.591 -6.447 7.398 1.00 . A A . 526 THR CB 1 1 9 5873 1 1 29 THR CG2 C -0.194 -6.107 7.893 1.00 . A A . 526 THR CG2 1 1 9 5874 1 1 29 THR H H -3.822 -6.490 6.153 1.00 . A A . 526 THR H 1 1 9 5875 1 1 29 THR HA H -1.421 -5.011 5.805 1.00 . A A . 526 THR HA 1 1 9 5876 1 1 29 THR HB H -1.736 -7.517 7.473 1.00 . A A . 526 THR HB 1 1 9 5877 1 1 29 THR HG1 H -2.123 -5.124 8.769 1.00 . A A . 526 THR HG1 1 1 9 5878 1 1 29 THR HG21 H -0.057 -5.035 7.872 1.00 . A A . 526 THR HG21 1 1 9 5879 1 1 29 THR HG22 H -0.074 -6.465 8.904 1.00 . A A . 526 THR HG22 1 1 9 5880 1 1 29 THR HG23 H 0.540 -6.576 7.253 1.00 . A A . 526 THR HG23 1 1 9 5881 1 1 29 THR N N -3.174 -6.079 5.541 1.00 . A A . 526 THR N 1 1 9 5882 1 1 29 THR O O 0.224 -6.724 4.773 1.00 . A A . 526 THR O 1 1 9 5883 1 1 29 THR OG1 O -2.564 -5.782 8.214 1.00 . A A . 526 THR OG1 1 1 9 5884 1 1 30 PHE C C -0.600 -8.222 2.312 1.00 . A A . 527 PHE C 1 1 9 5885 1 1 30 PHE CA C -1.014 -8.923 3.600 1.00 . A A . 527 PHE CA 1 1 9 5886 1 1 30 PHE CB C -1.967 -10.078 3.293 1.00 . A A . 527 PHE CB 1 1 9 5887 1 1 30 PHE CD1 C -0.543 -11.960 2.449 1.00 . A A . 527 PHE CD1 1 1 9 5888 1 1 30 PHE CD2 C -1.938 -10.807 0.901 1.00 . A A . 527 PHE CD2 1 1 9 5889 1 1 30 PHE CE1 C -0.082 -12.771 1.434 1.00 . A A . 527 PHE CE1 1 1 9 5890 1 1 30 PHE CE2 C -1.480 -11.612 -0.118 1.00 . A A . 527 PHE CE2 1 1 9 5891 1 1 30 PHE CG C -1.476 -10.971 2.194 1.00 . A A . 527 PHE CG 1 1 9 5892 1 1 30 PHE CZ C -0.551 -12.598 0.147 1.00 . A A . 527 PHE CZ 1 1 9 5893 1 1 30 PHE H H -2.560 -8.137 4.806 1.00 . A A . 527 PHE H 1 1 9 5894 1 1 30 PHE HA H -0.127 -9.321 4.073 1.00 . A A . 527 PHE HA 1 1 9 5895 1 1 30 PHE HB2 H -2.093 -10.680 4.180 1.00 . A A . 527 PHE HB2 1 1 9 5896 1 1 30 PHE HB3 H -2.925 -9.678 2.996 1.00 . A A . 527 PHE HB3 1 1 9 5897 1 1 30 PHE HD1 H -2.664 -10.037 0.693 1.00 . A A . 527 PHE HD1 1 1 9 5898 1 1 30 PHE HD2 H -0.175 -12.095 3.456 1.00 . A A . 527 PHE HD2 1 1 9 5899 1 1 30 PHE HE1 H -1.851 -11.469 -1.122 1.00 . A A . 527 PHE HE1 1 1 9 5900 1 1 30 PHE HE2 H 0.646 -13.541 1.645 1.00 . A A . 527 PHE HE2 1 1 9 5901 1 1 30 PHE HZ H -0.190 -13.232 -0.650 1.00 . A A . 527 PHE HZ 1 1 9 5902 1 1 30 PHE N N -1.626 -7.991 4.528 1.00 . A A . 527 PHE N 1 1 9 5903 1 1 30 PHE O O 0.528 -8.395 1.851 1.00 . A A . 527 PHE O 1 1 9 5904 1 1 31 CYS C C -0.009 -5.809 0.702 1.00 . A A . 528 CYS C 1 1 9 5905 1 1 31 CYS CA C -1.203 -6.724 0.493 1.00 . A A . 528 CYS CA 1 1 9 5906 1 1 31 CYS CB C -2.406 -5.920 -0.002 1.00 . A A . 528 CYS CB 1 1 9 5907 1 1 31 CYS H H -2.385 -7.312 2.149 1.00 . A A . 528 CYS H 1 1 9 5908 1 1 31 CYS HA H -0.940 -7.486 -0.227 1.00 . A A . 528 CYS HA 1 1 9 5909 1 1 31 CYS HB2 H -2.582 -5.094 0.672 1.00 . A A . 528 CYS HB2 1 1 9 5910 1 1 31 CYS HB3 H -2.191 -5.534 -0.989 1.00 . A A . 528 CYS HB3 1 1 9 5911 1 1 31 CYS N N -1.505 -7.425 1.736 1.00 . A A . 528 CYS N 1 1 9 5912 1 1 31 CYS O O 0.832 -5.660 -0.181 1.00 . A A . 528 CYS O 1 1 9 5913 1 1 31 CYS SG S -3.940 -6.885 -0.105 1.00 . A A . 528 CYS SG 1 1 9 5914 1 1 32 GLN C C 2.485 -5.168 2.187 1.00 . A A . 529 GLN C 1 1 9 5915 1 1 32 GLN CA C 1.185 -4.363 2.241 1.00 . A A . 529 GLN CA 1 1 9 5916 1 1 32 GLN CB C 0.984 -3.761 3.643 1.00 . A A . 529 GLN CB 1 1 9 5917 1 1 32 GLN CD C 2.722 -1.942 3.680 1.00 . A A . 529 GLN CD 1 1 9 5918 1 1 32 GLN CG C 2.267 -3.252 4.281 1.00 . A A . 529 GLN CG 1 1 9 5919 1 1 32 GLN H H -0.637 -5.385 2.555 1.00 . A A . 529 GLN H 1 1 9 5920 1 1 32 GLN HA H 1.225 -3.569 1.515 1.00 . A A . 529 GLN HA 1 1 9 5921 1 1 32 GLN HB2 H 0.304 -2.921 3.567 1.00 . A A . 529 GLN HB2 1 1 9 5922 1 1 32 GLN HB3 H 0.551 -4.511 4.287 1.00 . A A . 529 GLN HB3 1 1 9 5923 1 1 32 GLN HE21 H 4.626 -2.448 3.897 1.00 . A A . 529 GLN HE21 1 1 9 5924 1 1 32 GLN HE22 H 4.334 -0.895 3.203 1.00 . A A . 529 GLN HE22 1 1 9 5925 1 1 32 GLN HG2 H 2.099 -3.109 5.337 1.00 . A A . 529 GLN HG2 1 1 9 5926 1 1 32 GLN HG3 H 3.044 -3.988 4.136 1.00 . A A . 529 GLN HG3 1 1 9 5927 1 1 32 GLN N N 0.064 -5.216 1.889 1.00 . A A . 529 GLN N 1 1 9 5928 1 1 32 GLN NE2 N 4.026 -1.745 3.583 1.00 . A A . 529 GLN NE2 1 1 9 5929 1 1 32 GLN O O 3.476 -4.738 1.599 1.00 . A A . 529 GLN O 1 1 9 5930 1 1 32 GLN OE1 O 1.907 -1.123 3.287 1.00 . A A . 529 GLN OE1 1 1 9 5931 1 1 33 ARG C C 4.045 -7.807 1.544 1.00 . A A . 530 ARG C 1 1 9 5932 1 1 33 ARG CA C 3.670 -7.170 2.884 1.00 . A A . 530 ARG CA 1 1 9 5933 1 1 33 ARG CB C 3.541 -8.244 3.962 1.00 . A A . 530 ARG CB 1 1 9 5934 1 1 33 ARG CD C 4.746 -6.800 5.630 1.00 . A A . 530 ARG CD 1 1 9 5935 1 1 33 ARG CG C 3.546 -7.702 5.379 1.00 . A A . 530 ARG CG 1 1 9 5936 1 1 33 ARG CZ C 7.199 -7.072 5.682 1.00 . A A . 530 ARG CZ 1 1 9 5937 1 1 33 ARG H H 1.630 -6.667 3.205 1.00 . A A . 530 ARG H 1 1 9 5938 1 1 33 ARG HA H 4.461 -6.489 3.153 1.00 . A A . 530 ARG HA 1 1 9 5939 1 1 33 ARG HB2 H 2.615 -8.777 3.811 1.00 . A A . 530 ARG HB2 1 1 9 5940 1 1 33 ARG HB3 H 4.363 -8.937 3.862 1.00 . A A . 530 ARG HB3 1 1 9 5941 1 1 33 ARG HD2 H 4.604 -5.879 5.085 1.00 . A A . 530 ARG HD2 1 1 9 5942 1 1 33 ARG HD3 H 4.802 -6.584 6.687 1.00 . A A . 530 ARG HD3 1 1 9 5943 1 1 33 ARG HE H 5.962 -8.094 4.488 1.00 . A A . 530 ARG HE 1 1 9 5944 1 1 33 ARG HG2 H 2.643 -7.133 5.538 1.00 . A A . 530 ARG HG2 1 1 9 5945 1 1 33 ARG HG3 H 3.579 -8.531 6.070 1.00 . A A . 530 ARG HG3 1 1 9 5946 1 1 33 ARG HH11 H 6.466 -5.830 7.108 1.00 . A A . 530 ARG HH11 1 1 9 5947 1 1 33 ARG HH12 H 8.201 -5.965 7.064 1.00 . A A . 530 ARG HH12 1 1 9 5948 1 1 33 ARG HH21 H 8.219 -8.282 4.418 1.00 . A A . 530 ARG HH21 1 1 9 5949 1 1 33 ARG HH22 H 9.206 -7.351 5.511 1.00 . A A . 530 ARG HH22 1 1 9 5950 1 1 33 ARG N N 2.470 -6.347 2.804 1.00 . A A . 530 ARG N 1 1 9 5951 1 1 33 ARG NE N 6.006 -7.412 5.203 1.00 . A A . 530 ARG NE 1 1 9 5952 1 1 33 ARG NH1 N 7.294 -6.220 6.695 1.00 . A A . 530 ARG NH1 1 1 9 5953 1 1 33 ARG NH2 N 8.293 -7.614 5.167 1.00 . A A . 530 ARG NH2 1 1 9 5954 1 1 33 ARG O O 5.227 -7.933 1.234 1.00 . A A . 530 ARG O 1 1 9 5955 1 1 34 LYS C C 3.924 -7.817 -1.503 1.00 . A A . 531 LYS C 1 1 9 5956 1 1 34 LYS CA C 3.366 -8.848 -0.535 1.00 . A A . 531 LYS CA 1 1 9 5957 1 1 34 LYS CB C 2.146 -9.582 -1.136 1.00 . A A . 531 LYS CB 1 1 9 5958 1 1 34 LYS CD C 1.036 -7.853 -2.659 1.00 . A A . 531 LYS CD 1 1 9 5959 1 1 34 LYS CE C 1.437 -8.633 -3.906 1.00 . A A . 531 LYS CE 1 1 9 5960 1 1 34 LYS CG C 0.898 -8.740 -1.423 1.00 . A A . 531 LYS CG 1 1 9 5961 1 1 34 LYS H H 2.125 -8.144 1.054 1.00 . A A . 531 LYS H 1 1 9 5962 1 1 34 LYS HA H 4.142 -9.578 -0.356 1.00 . A A . 531 LYS HA 1 1 9 5963 1 1 34 LYS HB2 H 2.451 -10.033 -2.065 1.00 . A A . 531 LYS HB2 1 1 9 5964 1 1 34 LYS HB3 H 1.863 -10.364 -0.454 1.00 . A A . 531 LYS HB3 1 1 9 5965 1 1 34 LYS HD2 H 0.091 -7.366 -2.843 1.00 . A A . 531 LYS HD2 1 1 9 5966 1 1 34 LYS HD3 H 1.789 -7.103 -2.461 1.00 . A A . 531 LYS HD3 1 1 9 5967 1 1 34 LYS HE2 H 2.351 -9.171 -3.702 1.00 . A A . 531 LYS HE2 1 1 9 5968 1 1 34 LYS HE3 H 0.652 -9.333 -4.144 1.00 . A A . 531 LYS HE3 1 1 9 5969 1 1 34 LYS HG2 H 0.063 -9.406 -1.573 1.00 . A A . 531 LYS HG2 1 1 9 5970 1 1 34 LYS HG3 H 0.700 -8.112 -0.565 1.00 . A A . 531 LYS HG3 1 1 9 5971 1 1 34 LYS HZ1 H 2.455 -7.086 -4.888 1.00 . A A . 531 LYS HZ1 1 1 9 5972 1 1 34 LYS HZ2 H 1.871 -8.289 -5.927 1.00 . A A . 531 LYS HZ2 1 1 9 5973 1 1 34 LYS HZ3 H 0.800 -7.162 -5.250 1.00 . A A . 531 LYS HZ3 1 1 9 5974 1 1 34 LYS N N 3.060 -8.230 0.755 1.00 . A A . 531 LYS N 1 1 9 5975 1 1 34 LYS NZ N 1.654 -7.731 -5.072 1.00 . A A . 531 LYS NZ 1 1 9 5976 1 1 34 LYS O O 4.830 -8.105 -2.285 1.00 . A A . 531 LYS O 1 1 9 5977 1 1 35 ASP C C 5.191 -5.013 -1.844 1.00 . A A . 532 ASP C 1 1 9 5978 1 1 35 ASP CA C 3.828 -5.519 -2.285 1.00 . A A . 532 ASP CA 1 1 9 5979 1 1 35 ASP CB C 2.812 -4.376 -2.250 1.00 . A A . 532 ASP CB 1 1 9 5980 1 1 35 ASP CG C 3.018 -3.381 -3.378 1.00 . A A . 532 ASP CG 1 1 9 5981 1 1 35 ASP H H 2.634 -6.458 -0.816 1.00 . A A . 532 ASP H 1 1 9 5982 1 1 35 ASP HA H 3.900 -5.883 -3.299 1.00 . A A . 532 ASP HA 1 1 9 5983 1 1 35 ASP HB2 H 1.816 -4.784 -2.335 1.00 . A A . 532 ASP HB2 1 1 9 5984 1 1 35 ASP HB3 H 2.903 -3.849 -1.309 1.00 . A A . 532 ASP HB3 1 1 9 5985 1 1 35 ASP N N 3.385 -6.613 -1.432 1.00 . A A . 532 ASP N 1 1 9 5986 1 1 35 ASP O O 5.881 -4.337 -2.596 1.00 . A A . 532 ASP O 1 1 9 5987 1 1 35 ASP OD1 O 2.939 -3.797 -4.556 1.00 . A A . 532 ASP OD1 1 1 9 5988 1 1 35 ASP OD2 O 3.234 -2.185 -3.091 1.00 . A A . 532 ASP OD2 1 1 9 5989 1 1 36 TRP C C 8.039 -5.201 -0.923 1.00 . A A . 533 TRP C 1 1 9 5990 1 1 36 TRP CA C 6.828 -4.920 -0.040 1.00 . A A . 533 TRP CA 1 1 9 5991 1 1 36 TRP CB C 7.036 -5.539 1.343 1.00 . A A . 533 TRP CB 1 1 9 5992 1 1 36 TRP CD1 C 9.352 -5.546 2.438 1.00 . A A . 533 TRP CD1 1 1 9 5993 1 1 36 TRP CD2 C 8.291 -3.575 2.528 1.00 . A A . 533 TRP CD2 1 1 9 5994 1 1 36 TRP CE2 C 9.547 -3.440 3.149 1.00 . A A . 533 TRP CE2 1 1 9 5995 1 1 36 TRP CE3 C 7.445 -2.459 2.465 1.00 . A A . 533 TRP CE3 1 1 9 5996 1 1 36 TRP CG C 8.186 -4.931 2.080 1.00 . A A . 533 TRP CG 1 1 9 5997 1 1 36 TRP CH2 C 9.137 -1.164 3.623 1.00 . A A . 533 TRP CH2 1 1 9 5998 1 1 36 TRP CZ2 C 9.981 -2.239 3.700 1.00 . A A . 533 TRP CZ2 1 1 9 5999 1 1 36 TRP CZ3 C 7.879 -1.266 3.014 1.00 . A A . 533 TRP CZ3 1 1 9 6000 1 1 36 TRP H H 5.044 -6.051 -0.145 1.00 . A A . 533 TRP H 1 1 9 6001 1 1 36 TRP HA H 6.733 -3.851 0.088 1.00 . A A . 533 TRP HA 1 1 9 6002 1 1 36 TRP HB2 H 6.144 -5.394 1.934 1.00 . A A . 533 TRP HB2 1 1 9 6003 1 1 36 TRP HB3 H 7.225 -6.598 1.235 1.00 . A A . 533 TRP HB3 1 1 9 6004 1 1 36 TRP HD1 H 9.579 -6.584 2.239 1.00 . A A . 533 TRP HD1 1 1 9 6005 1 1 36 TRP HE1 H 11.071 -4.860 3.436 1.00 . A A . 533 TRP HE1 1 1 9 6006 1 1 36 TRP HE3 H 6.467 -2.517 1.999 1.00 . A A . 533 TRP HE3 1 1 9 6007 1 1 36 TRP HH2 H 9.433 -0.211 4.040 1.00 . A A . 533 TRP HH2 1 1 9 6008 1 1 36 TRP HZ2 H 10.950 -2.143 4.163 1.00 . A A . 533 TRP HZ2 1 1 9 6009 1 1 36 TRP HZ3 H 7.241 -0.394 2.976 1.00 . A A . 533 TRP HZ3 1 1 9 6010 1 1 36 TRP N N 5.597 -5.414 -0.643 1.00 . A A . 533 TRP N 1 1 9 6011 1 1 36 TRP NE1 N 10.175 -4.656 3.082 1.00 . A A . 533 TRP NE1 1 1 9 6012 1 1 36 TRP O O 8.996 -4.443 -0.929 1.00 . A A . 533 TRP O 1 1 9 6013 1 1 37 LYS C C 9.365 -5.539 -3.584 1.00 . A A . 534 LYS C 1 1 9 6014 1 1 37 LYS CA C 9.083 -6.649 -2.571 1.00 . A A . 534 LYS CA 1 1 9 6015 1 1 37 LYS CB C 8.783 -7.972 -3.280 1.00 . A A . 534 LYS CB 1 1 9 6016 1 1 37 LYS CD C 8.279 -10.431 -3.052 1.00 . A A . 534 LYS CD 1 1 9 6017 1 1 37 LYS CE C 6.882 -10.334 -3.643 1.00 . A A . 534 LYS CE 1 1 9 6018 1 1 37 LYS CG C 8.671 -9.152 -2.327 1.00 . A A . 534 LYS CG 1 1 9 6019 1 1 37 LYS H H 7.198 -6.855 -1.624 1.00 . A A . 534 LYS H 1 1 9 6020 1 1 37 LYS HA H 9.985 -6.756 -1.988 1.00 . A A . 534 LYS HA 1 1 9 6021 1 1 37 LYS HB2 H 7.850 -7.879 -3.817 1.00 . A A . 534 LYS HB2 1 1 9 6022 1 1 37 LYS HB3 H 9.575 -8.179 -3.983 1.00 . A A . 534 LYS HB3 1 1 9 6023 1 1 37 LYS HD2 H 8.984 -10.613 -3.850 1.00 . A A . 534 LYS HD2 1 1 9 6024 1 1 37 LYS HD3 H 8.307 -11.254 -2.352 1.00 . A A . 534 LYS HD3 1 1 9 6025 1 1 37 LYS HE2 H 6.186 -10.111 -2.849 1.00 . A A . 534 LYS HE2 1 1 9 6026 1 1 37 LYS HE3 H 6.867 -9.534 -4.369 1.00 . A A . 534 LYS HE3 1 1 9 6027 1 1 37 LYS HG2 H 9.626 -9.302 -1.846 1.00 . A A . 534 LYS HG2 1 1 9 6028 1 1 37 LYS HG3 H 7.922 -8.927 -1.582 1.00 . A A . 534 LYS HG3 1 1 9 6029 1 1 37 LYS HZ1 H 6.484 -12.386 -3.622 1.00 . A A . 534 LYS HZ1 1 1 9 6030 1 1 37 LYS HZ2 H 5.497 -11.501 -4.680 1.00 . A A . 534 LYS HZ2 1 1 9 6031 1 1 37 LYS HZ3 H 7.112 -11.824 -5.095 1.00 . A A . 534 LYS HZ3 1 1 9 6032 1 1 37 LYS N N 7.988 -6.284 -1.674 1.00 . A A . 534 LYS N 1 1 9 6033 1 1 37 LYS NZ N 6.466 -11.598 -4.305 1.00 . A A . 534 LYS NZ 1 1 9 6034 1 1 37 LYS O O 10.524 -5.214 -3.838 1.00 . A A . 534 LYS O 1 1 9 6035 1 1 38 ASP C C 8.450 -2.501 -4.311 1.00 . A A . 535 ASP C 1 1 9 6036 1 1 38 ASP CA C 8.518 -3.824 -5.064 1.00 . A A . 535 ASP CA 1 1 9 6037 1 1 38 ASP CB C 7.456 -3.832 -6.171 1.00 . A A . 535 ASP CB 1 1 9 6038 1 1 38 ASP CG C 7.436 -5.120 -6.967 1.00 . A A . 535 ASP CG 1 1 9 6039 1 1 38 ASP H H 7.417 -5.251 -3.935 1.00 . A A . 535 ASP H 1 1 9 6040 1 1 38 ASP HA H 9.498 -3.932 -5.503 1.00 . A A . 535 ASP HA 1 1 9 6041 1 1 38 ASP HB2 H 6.484 -3.694 -5.725 1.00 . A A . 535 ASP HB2 1 1 9 6042 1 1 38 ASP HB3 H 7.653 -3.015 -6.850 1.00 . A A . 535 ASP HB3 1 1 9 6043 1 1 38 ASP N N 8.325 -4.941 -4.142 1.00 . A A . 535 ASP N 1 1 9 6044 1 1 38 ASP O O 9.150 -1.547 -4.611 1.00 . A A . 535 ASP O 1 1 9 6045 1 1 38 ASP OD1 O 8.189 -5.225 -7.959 1.00 . A A . 535 ASP OD1 1 1 9 6046 1 1 38 ASP OD2 O 6.663 -6.036 -6.604 1.00 . A A . 535 ASP OD2 1 1 9 6047 1 1 39 HIS C C 8.524 -0.843 -1.746 1.00 . A A . 536 HIS C 1 1 9 6048 1 1 39 HIS CA C 7.322 -1.257 -2.576 1.00 . A A . 536 HIS CA 1 1 9 6049 1 1 39 HIS CB C 6.115 -1.488 -1.671 1.00 . A A . 536 HIS CB 1 1 9 6050 1 1 39 HIS CD2 C 5.463 0.173 0.201 1.00 . A A . 536 HIS CD2 1 1 9 6051 1 1 39 HIS CE1 C 4.512 1.696 -1.007 1.00 . A A . 536 HIS CE1 1 1 9 6052 1 1 39 HIS CG C 5.540 -0.239 -1.091 1.00 . A A . 536 HIS CG 1 1 9 6053 1 1 39 HIS H H 7.080 -3.265 -3.124 1.00 . A A . 536 HIS H 1 1 9 6054 1 1 39 HIS HA H 7.093 -0.458 -3.277 1.00 . A A . 536 HIS HA 1 1 9 6055 1 1 39 HIS HB2 H 5.339 -1.977 -2.241 1.00 . A A . 536 HIS HB2 1 1 9 6056 1 1 39 HIS HB3 H 6.409 -2.130 -0.853 1.00 . A A . 536 HIS HB3 1 1 9 6057 1 1 39 HIS HD1 H 4.792 0.721 -2.824 1.00 . A A . 536 HIS HD1 1 1 9 6058 1 1 39 HIS HD2 H 5.850 -0.349 1.062 1.00 . A A . 536 HIS HD2 1 1 9 6059 1 1 39 HIS HE1 H 4.005 2.599 -1.313 1.00 . A A . 536 HIS HE1 1 1 9 6060 1 1 39 HIS N N 7.588 -2.461 -3.330 1.00 . A A . 536 HIS N 1 1 9 6061 1 1 39 HIS ND1 N 4.930 0.740 -1.846 1.00 . A A . 536 HIS ND1 1 1 9 6062 1 1 39 HIS NE2 N 4.806 1.391 0.234 1.00 . A A . 536 HIS NE2 1 1 9 6063 1 1 39 HIS O O 8.765 0.336 -1.590 1.00 . A A . 536 HIS O 1 1 9 6064 1 1 40 GLN C C 11.414 -0.543 -1.011 1.00 . A A . 537 GLN C 1 1 9 6065 1 1 40 GLN CA C 10.398 -1.460 -0.334 1.00 . A A . 537 GLN CA 1 1 9 6066 1 1 40 GLN CB C 11.101 -2.713 0.188 1.00 . A A . 537 GLN CB 1 1 9 6067 1 1 40 GLN CD C 12.398 -4.797 -0.339 1.00 . A A . 537 GLN CD 1 1 9 6068 1 1 40 GLN CG C 11.834 -3.503 -0.881 1.00 . A A . 537 GLN CG 1 1 9 6069 1 1 40 GLN H H 9.091 -2.748 -1.432 1.00 . A A . 537 GLN H 1 1 9 6070 1 1 40 GLN HA H 9.976 -0.924 0.502 1.00 . A A . 537 GLN HA 1 1 9 6071 1 1 40 GLN HB2 H 11.821 -2.419 0.938 1.00 . A A . 537 GLN HB2 1 1 9 6072 1 1 40 GLN HB3 H 10.368 -3.362 0.644 1.00 . A A . 537 GLN HB3 1 1 9 6073 1 1 40 GLN HE21 H 10.691 -5.722 -0.738 1.00 . A A . 537 GLN HE21 1 1 9 6074 1 1 40 GLN HE22 H 11.928 -6.697 -0.020 1.00 . A A . 537 GLN HE22 1 1 9 6075 1 1 40 GLN HG2 H 11.148 -3.728 -1.691 1.00 . A A . 537 GLN HG2 1 1 9 6076 1 1 40 GLN HG3 H 12.647 -2.901 -1.251 1.00 . A A . 537 GLN HG3 1 1 9 6077 1 1 40 GLN N N 9.287 -1.798 -1.227 1.00 . A A . 537 GLN N 1 1 9 6078 1 1 40 GLN NE2 N 11.594 -5.844 -0.372 1.00 . A A . 537 GLN NE2 1 1 9 6079 1 1 40 GLN O O 11.998 0.322 -0.360 1.00 . A A . 537 GLN O 1 1 9 6080 1 1 40 GLN OE1 O 13.536 -4.849 0.119 1.00 . A A . 537 GLN OE1 1 1 9 6081 1 1 41 HIS C C 12.003 1.440 -3.407 1.00 . A A . 538 HIS C 1 1 9 6082 1 1 41 HIS CA C 12.608 0.098 -3.007 1.00 . A A . 538 HIS CA 1 1 9 6083 1 1 41 HIS CB C 13.218 -0.635 -4.218 1.00 . A A . 538 HIS CB 1 1 9 6084 1 1 41 HIS CD2 C 11.536 -1.658 -5.900 1.00 . A A . 538 HIS CD2 1 1 9 6085 1 1 41 HIS CE1 C 11.530 -0.010 -7.319 1.00 . A A . 538 HIS CE1 1 1 9 6086 1 1 41 HIS CG C 12.362 -0.682 -5.453 1.00 . A A . 538 HIS CG 1 1 9 6087 1 1 41 HIS H H 11.160 -1.439 -2.786 1.00 . A A . 538 HIS H 1 1 9 6088 1 1 41 HIS HA H 13.401 0.301 -2.305 1.00 . A A . 538 HIS HA 1 1 9 6089 1 1 41 HIS HB2 H 14.144 -0.151 -4.486 1.00 . A A . 538 HIS HB2 1 1 9 6090 1 1 41 HIS HB3 H 13.429 -1.654 -3.930 1.00 . A A . 538 HIS HB3 1 1 9 6091 1 1 41 HIS HD2 H 11.281 -2.574 -5.391 1.00 . A A . 538 HIS HD2 1 1 9 6092 1 1 41 HIS HE1 H 11.278 0.607 -8.166 1.00 . A A . 538 HIS HE1 1 1 9 6093 1 1 41 HIS HE2 H 10.572 -1.792 -7.767 1.00 . A A . 538 HIS HE2 1 1 9 6094 1 1 41 HIS N N 11.635 -0.727 -2.309 1.00 . A A . 538 HIS N 1 1 9 6095 1 1 41 HIS ND1 N 12.352 0.353 -6.352 1.00 . A A . 538 HIS ND1 1 1 9 6096 1 1 41 HIS NE2 N 11.016 -1.223 -7.093 1.00 . A A . 538 HIS NE2 1 1 9 6097 1 1 41 HIS O O 12.729 2.413 -3.607 1.00 . A A . 538 HIS O 1 1 9 6098 1 1 42 ILE C C 9.701 3.557 -2.588 1.00 . A A . 539 ILE C 1 1 9 6099 1 1 42 ILE CA C 10.017 2.759 -3.858 1.00 . A A . 539 ILE CA 1 1 9 6100 1 1 42 ILE CB C 8.732 2.517 -4.717 1.00 . A A . 539 ILE CB 1 1 9 6101 1 1 42 ILE CD1 C 6.696 3.419 -3.463 1.00 . A A . 539 ILE CD1 1 1 9 6102 1 1 42 ILE CG1 C 7.485 2.196 -3.884 1.00 . A A . 539 ILE CG1 1 1 9 6103 1 1 42 ILE CG2 C 8.977 1.397 -5.708 1.00 . A A . 539 ILE CG2 1 1 9 6104 1 1 42 ILE H H 10.132 0.694 -3.387 1.00 . A A . 539 ILE H 1 1 9 6105 1 1 42 ILE HA H 10.710 3.336 -4.453 1.00 . A A . 539 ILE HA 1 1 9 6106 1 1 42 ILE HB H 8.544 3.405 -5.283 1.00 . A A . 539 ILE HB 1 1 9 6107 1 1 42 ILE HD11 H 6.317 3.921 -4.340 1.00 . A A . 539 ILE HD11 1 1 9 6108 1 1 42 ILE HD12 H 5.872 3.117 -2.836 1.00 . A A . 539 ILE HD12 1 1 9 6109 1 1 42 ILE HD13 H 7.344 4.091 -2.916 1.00 . A A . 539 ILE HD13 1 1 9 6110 1 1 42 ILE HG12 H 6.829 1.574 -4.461 1.00 . A A . 539 ILE HG12 1 1 9 6111 1 1 42 ILE HG13 H 7.781 1.667 -2.992 1.00 . A A . 539 ILE HG13 1 1 9 6112 1 1 42 ILE HG21 H 9.298 0.512 -5.175 1.00 . A A . 539 ILE HG21 1 1 9 6113 1 1 42 ILE HG22 H 8.067 1.185 -6.249 1.00 . A A . 539 ILE HG22 1 1 9 6114 1 1 42 ILE HG23 H 9.750 1.694 -6.403 1.00 . A A . 539 ILE HG23 1 1 9 6115 1 1 42 ILE N N 10.676 1.505 -3.515 1.00 . A A . 539 ILE N 1 1 9 6116 1 1 42 ILE O O 9.925 4.767 -2.528 1.00 . A A . 539 ILE O 1 1 9 6117 1 1 43 CYS C C 9.910 4.250 0.265 1.00 . A A . 540 CYS C 1 1 9 6118 1 1 43 CYS CA C 8.766 3.446 -0.341 1.00 . A A . 540 CYS CA 1 1 9 6119 1 1 43 CYS CB C 8.370 2.321 0.619 1.00 . A A . 540 CYS CB 1 1 9 6120 1 1 43 CYS H H 8.982 1.894 -1.744 1.00 . A A . 540 CYS H 1 1 9 6121 1 1 43 CYS HA H 7.909 4.081 -0.498 1.00 . A A . 540 CYS HA 1 1 9 6122 1 1 43 CYS HB2 H 7.761 1.606 0.089 1.00 . A A . 540 CYS HB2 1 1 9 6123 1 1 43 CYS HB3 H 9.267 1.829 0.968 1.00 . A A . 540 CYS HB3 1 1 9 6124 1 1 43 CYS N N 9.166 2.855 -1.600 1.00 . A A . 540 CYS N 1 1 9 6125 1 1 43 CYS O O 10.998 3.728 0.526 1.00 . A A . 540 CYS O 1 1 9 6126 1 1 43 CYS SG S 7.433 2.859 2.078 1.00 . A A . 540 CYS SG 1 1 9 6127 1 1 44 GLY C C 10.533 7.792 0.396 1.00 . A A . 541 GLY C 1 1 9 6128 1 1 44 GLY CA C 10.648 6.415 0.999 1.00 . A A . 541 GLY CA 1 1 9 6129 1 1 44 GLY H H 8.726 5.845 0.320 1.00 . A A . 541 GLY H 1 1 9 6130 1 1 44 GLY HA2 H 10.539 6.490 2.072 1.00 . A A . 541 GLY HA2 1 1 9 6131 1 1 44 GLY HA3 H 11.624 6.013 0.772 1.00 . A A . 541 GLY HA3 1 1 9 6132 1 1 44 GLY N N 9.639 5.521 0.485 1.00 . A A . 541 GLY N 1 1 9 6133 1 1 44 GLY O O 10.770 8.796 1.068 1.00 . A A . 541 GLY O 1 1 9 6134 1 1 45 GLN C C 8.689 9.776 -1.188 1.00 . A A . 542 GLN C 1 1 9 6135 1 1 45 GLN CA C 9.994 9.103 -1.588 1.00 . A A . 542 GLN CA 1 1 9 6136 1 1 45 GLN CB C 10.012 8.857 -3.095 1.00 . A A . 542 GLN CB 1 1 9 6137 1 1 45 GLN CD C 11.247 7.876 -5.064 1.00 . A A . 542 GLN CD 1 1 9 6138 1 1 45 GLN CG C 11.314 8.260 -3.600 1.00 . A A . 542 GLN CG 1 1 9 6139 1 1 45 GLN H H 9.983 7.011 -1.357 1.00 . A A . 542 GLN H 1 1 9 6140 1 1 45 GLN HA H 10.820 9.746 -1.323 1.00 . A A . 542 GLN HA 1 1 9 6141 1 1 45 GLN HB2 H 9.209 8.181 -3.348 1.00 . A A . 542 GLN HB2 1 1 9 6142 1 1 45 GLN HB3 H 9.851 9.796 -3.602 1.00 . A A . 542 GLN HB3 1 1 9 6143 1 1 45 GLN HE21 H 9.878 9.270 -5.396 1.00 . A A . 542 GLN HE21 1 1 9 6144 1 1 45 GLN HE22 H 10.355 8.337 -6.773 1.00 . A A . 542 GLN HE22 1 1 9 6145 1 1 45 GLN HG2 H 12.103 8.987 -3.471 1.00 . A A . 542 GLN HG2 1 1 9 6146 1 1 45 GLN HG3 H 11.540 7.379 -3.020 1.00 . A A . 542 GLN HG3 1 1 9 6147 1 1 45 GLN N N 10.156 7.843 -0.878 1.00 . A A . 542 GLN N 1 1 9 6148 1 1 45 GLN NE2 N 10.408 8.561 -5.818 1.00 . A A . 542 GLN NE2 1 1 9 6149 1 1 45 GLN O O 7.656 9.589 -1.832 1.00 . A A . 542 GLN O 1 1 9 6150 1 1 45 GLN OE1 O 11.933 6.957 -5.511 1.00 . A A . 542 GLN OE1 1 1 9 6151 1 1 46 SER C C 7.930 12.534 1.040 1.00 . A A . 543 SER C 1 1 9 6152 1 1 46 SER CA C 7.550 11.218 0.380 1.00 . A A . 543 SER CA 1 1 9 6153 1 1 46 SER CB C 6.791 10.330 1.367 1.00 . A A . 543 SER CB 1 1 9 6154 1 1 46 SER H H 9.578 10.618 0.387 1.00 . A A . 543 SER H 1 1 9 6155 1 1 46 SER HA H 6.912 11.425 -0.465 1.00 . A A . 543 SER HA 1 1 9 6156 1 1 46 SER HB2 H 7.397 10.169 2.246 1.00 . A A . 543 SER HB2 1 1 9 6157 1 1 46 SER HB3 H 5.867 10.815 1.650 1.00 . A A . 543 SER HB3 1 1 9 6158 1 1 46 SER HG H 6.704 9.102 -0.156 1.00 . A A . 543 SER HG 1 1 9 6159 1 1 46 SER N N 8.730 10.528 -0.105 1.00 . A A . 543 SER N 1 1 9 6160 1 1 46 SER O O 8.960 12.632 1.710 1.00 . A A . 543 SER O 1 1 9 6161 1 1 46 SER OG O 6.487 9.074 0.786 1.00 . A A . 543 SER OG 1 1 9 6162 1 1 47 ALA C C 6.786 14.884 2.828 1.00 . A A . 544 ALA C 1 1 9 6163 1 1 47 ALA CA C 7.330 14.849 1.410 1.00 . A A . 544 ALA CA 1 1 9 6164 1 1 47 ALA CB C 6.681 15.928 0.558 1.00 . A A . 544 ALA CB 1 1 9 6165 1 1 47 ALA H H 6.319 13.403 0.262 1.00 . A A . 544 ALA H 1 1 9 6166 1 1 47 ALA HA H 8.394 15.030 1.437 1.00 . A A . 544 ALA HA 1 1 9 6167 1 1 47 ALA HB1 H 5.615 15.763 0.519 1.00 . A A . 544 ALA HB1 1 1 9 6168 1 1 47 ALA HB2 H 6.881 16.897 0.990 1.00 . A A . 544 ALA HB2 1 1 9 6169 1 1 47 ALA HB3 H 7.089 15.889 -0.442 1.00 . A A . 544 ALA HB3 1 1 9 6170 1 1 47 ALA N N 7.107 13.543 0.824 1.00 . A A . 544 ALA N 1 1 9 6171 1 1 47 ALA O O 7.565 15.152 3.762 1.00 . A A . 544 ALA O 1 1 9 6172 1 1 47 ALA OXT O 5.584 14.604 3.004 1.00 . A A . 544 ALA OXT 1 1 9 6173 2 2 1 ZN ZN ZN -5.515 -5.757 -1.311 1.00 . B A . 601 ZN ZN 1 1 9 6174 3 2 1 ZN ZN ZN 5.186 2.783 1.600 1.00 . C A . 602 ZN ZN 1 1 10 6175 1 1 1 GLY C C -14.229 0.541 2.855 1.00 . A A . 498 GLY C 1 1 10 6176 1 1 1 GLY CA C -13.978 -0.827 3.438 1.00 . A A . 498 GLY CA 1 1 10 6177 1 1 1 GLY H1 H -13.701 -1.836 1.638 1.00 . A A . 498 GLY H1 1 1 10 6178 1 1 1 GLY H2 H -12.970 -2.590 2.967 1.00 . A A . 498 GLY H2 1 1 10 6179 1 1 1 GLY H3 H -12.276 -1.196 2.291 1.00 . A A . 498 GLY H3 1 1 10 6180 1 1 1 GLY HA2 H -14.928 -1.308 3.624 1.00 . A A . 498 GLY HA2 1 1 10 6181 1 1 1 GLY HA3 H -13.447 -0.720 4.372 1.00 . A A . 498 GLY HA3 1 1 10 6182 1 1 1 GLY N N -13.176 -1.672 2.520 1.00 . A A . 498 GLY N 1 1 10 6183 1 1 1 GLY O O -13.291 1.330 2.710 1.00 . A A . 498 GLY O 1 1 10 6184 1 1 2 ALA C C -15.272 2.163 0.477 1.00 . A A . 499 ALA C 1 1 10 6185 1 1 2 ALA CA C -15.884 2.069 1.872 1.00 . A A . 499 ALA CA 1 1 10 6186 1 1 2 ALA CB C -15.492 3.271 2.723 1.00 . A A . 499 ALA CB 1 1 10 6187 1 1 2 ALA H H -16.183 0.146 2.701 1.00 . A A . 499 ALA H 1 1 10 6188 1 1 2 ALA HA H -16.961 2.064 1.777 1.00 . A A . 499 ALA HA 1 1 10 6189 1 1 2 ALA HB1 H -14.416 3.316 2.809 1.00 . A A . 499 ALA HB1 1 1 10 6190 1 1 2 ALA HB2 H -15.853 4.175 2.258 1.00 . A A . 499 ALA HB2 1 1 10 6191 1 1 2 ALA HB3 H -15.927 3.172 3.707 1.00 . A A . 499 ALA HB3 1 1 10 6192 1 1 2 ALA N N -15.491 0.816 2.517 1.00 . A A . 499 ALA N 1 1 10 6193 1 1 2 ALA O O -14.659 1.214 -0.004 1.00 . A A . 499 ALA O 1 1 10 6194 1 1 3 MET C C -14.144 4.781 -1.621 1.00 . A A . 500 MET C 1 1 10 6195 1 1 3 MET CA C -14.918 3.475 -1.524 1.00 . A A . 500 MET CA 1 1 10 6196 1 1 3 MET CB C -16.040 3.425 -2.567 1.00 . A A . 500 MET CB 1 1 10 6197 1 1 3 MET CE C -18.541 0.309 -3.791 1.00 . A A . 500 MET CE 1 1 10 6198 1 1 3 MET CG C -16.719 2.064 -2.670 1.00 . A A . 500 MET CG 1 1 10 6199 1 1 3 MET H H -15.934 4.042 0.254 1.00 . A A . 500 MET H 1 1 10 6200 1 1 3 MET HA H -14.232 2.661 -1.710 1.00 . A A . 500 MET HA 1 1 10 6201 1 1 3 MET HB2 H -16.789 4.158 -2.306 1.00 . A A . 500 MET HB2 1 1 10 6202 1 1 3 MET HB3 H -15.628 3.673 -3.534 1.00 . A A . 500 MET HB3 1 1 10 6203 1 1 3 MET HE1 H -18.939 0.168 -2.796 1.00 . A A . 500 MET HE1 1 1 10 6204 1 1 3 MET HE2 H -19.314 0.111 -4.519 1.00 . A A . 500 MET HE2 1 1 10 6205 1 1 3 MET HE3 H -17.715 -0.369 -3.948 1.00 . A A . 500 MET HE3 1 1 10 6206 1 1 3 MET HG2 H -15.969 1.317 -2.877 1.00 . A A . 500 MET HG2 1 1 10 6207 1 1 3 MET HG3 H -17.192 1.843 -1.725 1.00 . A A . 500 MET HG3 1 1 10 6208 1 1 3 MET N N -15.448 3.299 -0.179 1.00 . A A . 500 MET N 1 1 10 6209 1 1 3 MET O O -14.218 5.498 -2.621 1.00 . A A . 500 MET O 1 1 10 6210 1 1 3 MET SD S -17.969 1.998 -3.970 1.00 . A A . 500 MET SD 1 1 10 6211 1 1 4 GLU C C -11.220 5.940 -1.209 1.00 . A A . 501 GLU C 1 1 10 6212 1 1 4 GLU CA C -12.543 6.249 -0.520 1.00 . A A . 501 GLU CA 1 1 10 6213 1 1 4 GLU CB C -12.278 6.667 0.932 1.00 . A A . 501 GLU CB 1 1 10 6214 1 1 4 GLU CD C -10.871 8.058 2.514 1.00 . A A . 501 GLU CD 1 1 10 6215 1 1 4 GLU CG C -11.227 7.760 1.071 1.00 . A A . 501 GLU CG 1 1 10 6216 1 1 4 GLU H H -13.470 4.508 0.233 1.00 . A A . 501 GLU H 1 1 10 6217 1 1 4 GLU HA H -13.034 7.056 -1.040 1.00 . A A . 501 GLU HA 1 1 10 6218 1 1 4 GLU HB2 H -13.200 7.028 1.364 1.00 . A A . 501 GLU HB2 1 1 10 6219 1 1 4 GLU HB3 H -11.946 5.804 1.487 1.00 . A A . 501 GLU HB3 1 1 10 6220 1 1 4 GLU HG2 H -10.332 7.446 0.555 1.00 . A A . 501 GLU HG2 1 1 10 6221 1 1 4 GLU HG3 H -11.604 8.663 0.615 1.00 . A A . 501 GLU HG3 1 1 10 6222 1 1 4 GLU N N -13.414 5.085 -0.557 1.00 . A A . 501 GLU N 1 1 10 6223 1 1 4 GLU O O -10.675 6.761 -1.945 1.00 . A A . 501 GLU O 1 1 10 6224 1 1 4 GLU OE1 O -10.104 7.278 3.119 1.00 . A A . 501 GLU OE1 1 1 10 6225 1 1 4 GLU OE2 O -11.352 9.079 3.046 1.00 . A A . 501 GLU OE2 1 1 10 6226 1 1 5 GLN C C -9.441 2.982 -2.096 1.00 . A A . 502 GLN C 1 1 10 6227 1 1 5 GLN CA C -9.408 4.345 -1.425 1.00 . A A . 502 GLN CA 1 1 10 6228 1 1 5 GLN CB C -8.460 4.332 -0.226 1.00 . A A . 502 GLN CB 1 1 10 6229 1 1 5 GLN CD C -8.202 3.843 2.231 1.00 . A A . 502 GLN CD 1 1 10 6230 1 1 5 GLN CG C -9.013 3.593 0.980 1.00 . A A . 502 GLN CG 1 1 10 6231 1 1 5 GLN H H -11.293 4.073 -0.525 1.00 . A A . 502 GLN H 1 1 10 6232 1 1 5 GLN HA H -9.059 5.081 -2.132 1.00 . A A . 502 GLN HA 1 1 10 6233 1 1 5 GLN HB2 H -7.537 3.856 -0.519 1.00 . A A . 502 GLN HB2 1 1 10 6234 1 1 5 GLN HB3 H -8.253 5.350 0.066 1.00 . A A . 502 GLN HB3 1 1 10 6235 1 1 5 GLN HE21 H -9.324 5.431 2.657 1.00 . A A . 502 GLN HE21 1 1 10 6236 1 1 5 GLN HE22 H -8.048 5.079 3.775 1.00 . A A . 502 GLN HE22 1 1 10 6237 1 1 5 GLN HG2 H -10.027 3.920 1.154 1.00 . A A . 502 GLN HG2 1 1 10 6238 1 1 5 GLN HG3 H -9.009 2.534 0.771 1.00 . A A . 502 GLN HG3 1 1 10 6239 1 1 5 GLN N N -10.736 4.733 -0.986 1.00 . A A . 502 GLN N 1 1 10 6240 1 1 5 GLN NE2 N -8.562 4.884 2.962 1.00 . A A . 502 GLN NE2 1 1 10 6241 1 1 5 GLN O O -10.319 2.162 -1.814 1.00 . A A . 502 GLN O 1 1 10 6242 1 1 5 GLN OE1 O -7.257 3.115 2.536 1.00 . A A . 502 GLN OE1 1 1 10 6243 1 1 6 SER C C -7.090 0.782 -3.412 1.00 . A A . 503 SER C 1 1 10 6244 1 1 6 SER CA C -8.412 1.492 -3.703 1.00 . A A . 503 SER CA 1 1 10 6245 1 1 6 SER CB C -8.571 1.748 -5.203 1.00 . A A . 503 SER CB 1 1 10 6246 1 1 6 SER H H -7.830 3.452 -3.176 1.00 . A A . 503 SER H 1 1 10 6247 1 1 6 SER HA H -9.225 0.867 -3.367 1.00 . A A . 503 SER HA 1 1 10 6248 1 1 6 SER HB2 H -8.247 0.876 -5.750 1.00 . A A . 503 SER HB2 1 1 10 6249 1 1 6 SER HB3 H -9.609 1.946 -5.424 1.00 . A A . 503 SER HB3 1 1 10 6250 1 1 6 SER HG H -8.363 3.497 -6.081 1.00 . A A . 503 SER HG 1 1 10 6251 1 1 6 SER N N -8.495 2.751 -2.987 1.00 . A A . 503 SER N 1 1 10 6252 1 1 6 SER O O -6.019 1.356 -3.581 1.00 . A A . 503 SER O 1 1 10 6253 1 1 6 SER OG O -7.794 2.863 -5.619 1.00 . A A . 503 SER OG 1 1 10 6254 1 1 7 CYS C C -5.203 -1.407 -3.986 1.00 . A A . 504 CYS C 1 1 10 6255 1 1 7 CYS CA C -5.988 -1.252 -2.700 1.00 . A A . 504 CYS CA 1 1 10 6256 1 1 7 CYS CB C -6.346 -2.636 -2.137 1.00 . A A . 504 CYS CB 1 1 10 6257 1 1 7 CYS H H -8.067 -0.860 -2.814 1.00 . A A . 504 CYS H 1 1 10 6258 1 1 7 CYS HA H -5.383 -0.727 -1.975 1.00 . A A . 504 CYS HA 1 1 10 6259 1 1 7 CYS HB2 H -6.954 -2.511 -1.254 1.00 . A A . 504 CYS HB2 1 1 10 6260 1 1 7 CYS HB3 H -6.904 -3.183 -2.881 1.00 . A A . 504 CYS HB3 1 1 10 6261 1 1 7 CYS N N -7.175 -0.463 -2.961 1.00 . A A . 504 CYS N 1 1 10 6262 1 1 7 CYS O O -5.740 -1.839 -5.007 1.00 . A A . 504 CYS O 1 1 10 6263 1 1 7 CYS SG S -4.889 -3.646 -1.679 1.00 . A A . 504 CYS SG 1 1 10 6264 1 1 8 VAL C C -2.932 -2.546 -5.584 1.00 . A A . 505 VAL C 1 1 10 6265 1 1 8 VAL CA C -3.044 -1.108 -5.068 1.00 . A A . 505 VAL CA 1 1 10 6266 1 1 8 VAL CB C -1.649 -0.544 -4.706 1.00 . A A . 505 VAL CB 1 1 10 6267 1 1 8 VAL CG1 C -0.952 -1.422 -3.678 1.00 . A A . 505 VAL CG1 1 1 10 6268 1 1 8 VAL CG2 C -0.786 -0.359 -5.942 1.00 . A A . 505 VAL CG2 1 1 10 6269 1 1 8 VAL H H -3.596 -0.657 -3.081 1.00 . A A . 505 VAL H 1 1 10 6270 1 1 8 VAL HA H -3.465 -0.493 -5.850 1.00 . A A . 505 VAL HA 1 1 10 6271 1 1 8 VAL HB H -1.797 0.429 -4.256 1.00 . A A . 505 VAL HB 1 1 10 6272 1 1 8 VAL HG11 H -0.834 -2.419 -4.077 1.00 . A A . 505 VAL HG11 1 1 10 6273 1 1 8 VAL HG12 H 0.017 -1.008 -3.450 1.00 . A A . 505 VAL HG12 1 1 10 6274 1 1 8 VAL HG13 H -1.548 -1.461 -2.778 1.00 . A A . 505 VAL HG13 1 1 10 6275 1 1 8 VAL HG21 H -1.265 0.338 -6.613 1.00 . A A . 505 VAL HG21 1 1 10 6276 1 1 8 VAL HG22 H 0.178 0.029 -5.649 1.00 . A A . 505 VAL HG22 1 1 10 6277 1 1 8 VAL HG23 H -0.657 -1.308 -6.439 1.00 . A A . 505 VAL HG23 1 1 10 6278 1 1 8 VAL N N -3.936 -1.034 -3.922 1.00 . A A . 505 VAL N 1 1 10 6279 1 1 8 VAL O O -2.529 -2.780 -6.724 1.00 . A A . 505 VAL O 1 1 10 6280 1 1 9 ASN C C -4.717 -5.383 -5.479 1.00 . A A . 506 ASN C 1 1 10 6281 1 1 9 ASN CA C -3.309 -4.903 -5.125 1.00 . A A . 506 ASN CA 1 1 10 6282 1 1 9 ASN CB C -2.763 -5.765 -3.989 1.00 . A A . 506 ASN CB 1 1 10 6283 1 1 9 ASN CG C -2.722 -7.235 -4.354 1.00 . A A . 506 ASN CG 1 1 10 6284 1 1 9 ASN H H -3.614 -3.252 -3.841 1.00 . A A . 506 ASN H 1 1 10 6285 1 1 9 ASN HA H -2.673 -5.012 -5.987 1.00 . A A . 506 ASN HA 1 1 10 6286 1 1 9 ASN HB2 H -1.760 -5.443 -3.749 1.00 . A A . 506 ASN HB2 1 1 10 6287 1 1 9 ASN HB3 H -3.394 -5.646 -3.121 1.00 . A A . 506 ASN HB3 1 1 10 6288 1 1 9 ASN HD21 H -3.682 -7.683 -2.682 1.00 . A A . 506 ASN HD21 1 1 10 6289 1 1 9 ASN HD22 H -3.269 -9.023 -3.695 1.00 . A A . 506 ASN HD22 1 1 10 6290 1 1 9 ASN N N -3.316 -3.500 -4.743 1.00 . A A . 506 ASN N 1 1 10 6291 1 1 9 ASN ND2 N -3.277 -8.064 -3.494 1.00 . A A . 506 ASN ND2 1 1 10 6292 1 1 9 ASN O O -4.882 -6.321 -6.257 1.00 . A A . 506 ASN O 1 1 10 6293 1 1 9 ASN OD1 O -2.227 -7.616 -5.416 1.00 . A A . 506 ASN OD1 1 1 10 6294 1 1 10 CYS C C -8.018 -4.200 -5.754 1.00 . A A . 507 CYS C 1 1 10 6295 1 1 10 CYS CA C -7.100 -5.209 -5.053 1.00 . A A . 507 CYS CA 1 1 10 6296 1 1 10 CYS CB C -7.662 -5.541 -3.669 1.00 . A A . 507 CYS CB 1 1 10 6297 1 1 10 CYS H H -5.562 -3.880 -4.457 1.00 . A A . 507 CYS H 1 1 10 6298 1 1 10 CYS HA H -7.066 -6.117 -5.636 1.00 . A A . 507 CYS HA 1 1 10 6299 1 1 10 CYS HB2 H -7.688 -4.641 -3.074 1.00 . A A . 507 CYS HB2 1 1 10 6300 1 1 10 CYS HB3 H -8.666 -5.923 -3.779 1.00 . A A . 507 CYS HB3 1 1 10 6301 1 1 10 CYS N N -5.733 -4.720 -4.934 1.00 . A A . 507 CYS N 1 1 10 6302 1 1 10 CYS O O -8.263 -4.304 -6.956 1.00 . A A . 507 CYS O 1 1 10 6303 1 1 10 CYS SG S -6.697 -6.782 -2.752 1.00 . A A . 507 CYS SG 1 1 10 6304 1 1 11 GLY C C -10.131 -1.482 -4.428 1.00 . A A . 508 GLY C 1 1 10 6305 1 1 11 GLY CA C -9.448 -2.256 -5.535 1.00 . A A . 508 GLY CA 1 1 10 6306 1 1 11 GLY H H -8.236 -3.165 -4.061 1.00 . A A . 508 GLY H 1 1 10 6307 1 1 11 GLY HA2 H -8.915 -1.566 -6.172 1.00 . A A . 508 GLY HA2 1 1 10 6308 1 1 11 GLY HA3 H -10.197 -2.770 -6.119 1.00 . A A . 508 GLY HA3 1 1 10 6309 1 1 11 GLY N N -8.512 -3.228 -4.999 1.00 . A A . 508 GLY N 1 1 10 6310 1 1 11 GLY O O -9.554 -1.308 -3.361 1.00 . A A . 508 GLY O 1 1 10 6311 1 1 12 ARG C C -12.238 -0.958 -2.308 1.00 . A A . 509 ARG C 1 1 10 6312 1 1 12 ARG CA C -12.149 -0.272 -3.673 1.00 . A A . 509 ARG CA 1 1 10 6313 1 1 12 ARG CB C -13.564 -0.047 -4.192 1.00 . A A . 509 ARG CB 1 1 10 6314 1 1 12 ARG CD C -15.042 0.814 -5.997 1.00 . A A . 509 ARG CD 1 1 10 6315 1 1 12 ARG CG C -13.650 0.868 -5.398 1.00 . A A . 509 ARG CG 1 1 10 6316 1 1 12 ARG CZ C -15.956 1.696 -8.115 1.00 . A A . 509 ARG CZ 1 1 10 6317 1 1 12 ARG H H -11.772 -1.212 -5.542 1.00 . A A . 509 ARG H 1 1 10 6318 1 1 12 ARG HA H -11.669 0.686 -3.550 1.00 . A A . 509 ARG HA 1 1 10 6319 1 1 12 ARG HB2 H -13.988 -1.002 -4.464 1.00 . A A . 509 ARG HB2 1 1 10 6320 1 1 12 ARG HB3 H -14.158 0.385 -3.399 1.00 . A A . 509 ARG HB3 1 1 10 6321 1 1 12 ARG HD2 H -15.170 -0.148 -6.471 1.00 . A A . 509 ARG HD2 1 1 10 6322 1 1 12 ARG HD3 H -15.761 0.918 -5.200 1.00 . A A . 509 ARG HD3 1 1 10 6323 1 1 12 ARG HE H -14.904 2.762 -6.788 1.00 . A A . 509 ARG HE 1 1 10 6324 1 1 12 ARG HG2 H -13.433 1.880 -5.092 1.00 . A A . 509 ARG HG2 1 1 10 6325 1 1 12 ARG HG3 H -12.933 0.545 -6.139 1.00 . A A . 509 ARG HG3 1 1 10 6326 1 1 12 ARG HH11 H -16.351 -0.275 -7.792 1.00 . A A . 509 ARG HH11 1 1 10 6327 1 1 12 ARG HH12 H -16.977 0.380 -9.284 1.00 . A A . 509 ARG HH12 1 1 10 6328 1 1 12 ARG HH21 H -15.762 3.629 -8.688 1.00 . A A . 509 ARG HH21 1 1 10 6329 1 1 12 ARG HH22 H -16.655 2.618 -9.790 1.00 . A A . 509 ARG HH22 1 1 10 6330 1 1 12 ARG N N -11.370 -1.048 -4.661 1.00 . A A . 509 ARG N 1 1 10 6331 1 1 12 ARG NE N -15.270 1.866 -6.986 1.00 . A A . 509 ARG NE 1 1 10 6332 1 1 12 ARG NH1 N -16.471 0.508 -8.419 1.00 . A A . 509 ARG NH1 1 1 10 6333 1 1 12 ARG NH2 N -16.139 2.728 -8.930 1.00 . A A . 509 ARG NH2 1 1 10 6334 1 1 12 ARG O O -12.670 -0.356 -1.331 1.00 . A A . 509 ARG O 1 1 10 6335 1 1 13 GLU C C -10.854 -2.472 0.035 1.00 . A A . 510 GLU C 1 1 10 6336 1 1 13 GLU CA C -11.824 -3.007 -1.031 1.00 . A A . 510 GLU CA 1 1 10 6337 1 1 13 GLU CB C -11.476 -4.458 -1.374 1.00 . A A . 510 GLU CB 1 1 10 6338 1 1 13 GLU CD C -13.396 -5.444 -0.077 1.00 . A A . 510 GLU CD 1 1 10 6339 1 1 13 GLU CG C -11.900 -5.460 -0.315 1.00 . A A . 510 GLU CG 1 1 10 6340 1 1 13 GLU H H -11.445 -2.622 -3.051 1.00 . A A . 510 GLU H 1 1 10 6341 1 1 13 GLU HA H -12.819 -2.976 -0.631 1.00 . A A . 510 GLU HA 1 1 10 6342 1 1 13 GLU HB2 H -11.959 -4.722 -2.303 1.00 . A A . 510 GLU HB2 1 1 10 6343 1 1 13 GLU HB3 H -10.406 -4.537 -1.502 1.00 . A A . 510 GLU HB3 1 1 10 6344 1 1 13 GLU HG2 H -11.610 -6.449 -0.634 1.00 . A A . 510 GLU HG2 1 1 10 6345 1 1 13 GLU HG3 H -11.398 -5.219 0.612 1.00 . A A . 510 GLU HG3 1 1 10 6346 1 1 13 GLU N N -11.814 -2.205 -2.248 1.00 . A A . 510 GLU N 1 1 10 6347 1 1 13 GLU O O -10.706 -3.077 1.096 1.00 . A A . 510 GLU O 1 1 10 6348 1 1 13 GLU OE1 O -14.131 -6.112 -0.835 1.00 . A A . 510 GLU OE1 1 1 10 6349 1 1 13 GLU OE2 O -13.846 -4.764 0.871 1.00 . A A . 510 GLU OE2 1 1 10 6350 1 1 14 ALA C C -9.510 -0.451 1.957 1.00 . A A . 511 ALA C 1 1 10 6351 1 1 14 ALA CA C -9.062 -0.915 0.574 1.00 . A A . 511 ALA CA 1 1 10 6352 1 1 14 ALA CB C -8.306 0.203 -0.131 1.00 . A A . 511 ALA CB 1 1 10 6353 1 1 14 ALA H H -10.614 -0.689 -0.833 1.00 . A A . 511 ALA H 1 1 10 6354 1 1 14 ALA HA H -8.394 -1.758 0.687 1.00 . A A . 511 ALA HA 1 1 10 6355 1 1 14 ALA HB1 H -8.968 1.039 -0.293 1.00 . A A . 511 ALA HB1 1 1 10 6356 1 1 14 ALA HB2 H -7.467 0.520 0.480 1.00 . A A . 511 ALA HB2 1 1 10 6357 1 1 14 ALA HB3 H -7.939 -0.155 -1.080 1.00 . A A . 511 ALA HB3 1 1 10 6358 1 1 14 ALA N N -10.206 -1.340 -0.230 1.00 . A A . 511 ALA N 1 1 10 6359 1 1 14 ALA O O -10.709 -0.289 2.212 1.00 . A A . 511 ALA O 1 1 10 6360 1 1 15 MET C C -7.549 0.541 4.967 1.00 . A A . 512 MET C 1 1 10 6361 1 1 15 MET CA C -8.829 0.192 4.209 1.00 . A A . 512 MET CA 1 1 10 6362 1 1 15 MET CB C -9.601 -0.908 4.957 1.00 . A A . 512 MET CB 1 1 10 6363 1 1 15 MET CE C -12.250 0.501 6.248 1.00 . A A . 512 MET CE 1 1 10 6364 1 1 15 MET CG C -9.740 -0.668 6.457 1.00 . A A . 512 MET CG 1 1 10 6365 1 1 15 MET H H -7.607 -0.311 2.547 1.00 . A A . 512 MET H 1 1 10 6366 1 1 15 MET HA H -9.447 1.074 4.139 1.00 . A A . 512 MET HA 1 1 10 6367 1 1 15 MET HB2 H -10.593 -0.981 4.536 1.00 . A A . 512 MET HB2 1 1 10 6368 1 1 15 MET HB3 H -9.092 -1.849 4.813 1.00 . A A . 512 MET HB3 1 1 10 6369 1 1 15 MET HE1 H -12.647 -0.356 6.772 1.00 . A A . 512 MET HE1 1 1 10 6370 1 1 15 MET HE2 H -12.891 1.353 6.416 1.00 . A A . 512 MET HE2 1 1 10 6371 1 1 15 MET HE3 H -12.205 0.289 5.190 1.00 . A A . 512 MET HE3 1 1 10 6372 1 1 15 MET HG2 H -10.288 -1.494 6.887 1.00 . A A . 512 MET HG2 1 1 10 6373 1 1 15 MET HG3 H -8.752 -0.630 6.891 1.00 . A A . 512 MET HG3 1 1 10 6374 1 1 15 MET N N -8.541 -0.224 2.838 1.00 . A A . 512 MET N 1 1 10 6375 1 1 15 MET O O -7.552 1.404 5.844 1.00 . A A . 512 MET O 1 1 10 6376 1 1 15 MET SD S -10.607 0.866 6.855 1.00 . A A . 512 MET SD 1 1 10 6377 1 1 16 SER C C -4.105 0.643 4.524 1.00 . A A . 513 SER C 1 1 10 6378 1 1 16 SER CA C -5.223 0.068 5.382 1.00 . A A . 513 SER CA 1 1 10 6379 1 1 16 SER CB C -4.802 -1.258 6.016 1.00 . A A . 513 SER CB 1 1 10 6380 1 1 16 SER H H -6.433 -0.633 3.791 1.00 . A A . 513 SER H 1 1 10 6381 1 1 16 SER HA H -5.447 0.790 6.152 1.00 . A A . 513 SER HA 1 1 10 6382 1 1 16 SER HB2 H -4.577 -1.971 5.238 1.00 . A A . 513 SER HB2 1 1 10 6383 1 1 16 SER HB3 H -3.926 -1.103 6.627 1.00 . A A . 513 SER HB3 1 1 10 6384 1 1 16 SER HG H -6.411 -2.348 6.295 1.00 . A A . 513 SER HG 1 1 10 6385 1 1 16 SER N N -6.443 -0.098 4.610 1.00 . A A . 513 SER N 1 1 10 6386 1 1 16 SER O O -4.004 0.364 3.336 1.00 . A A . 513 SER O 1 1 10 6387 1 1 16 SER OG O -5.841 -1.784 6.831 1.00 . A A . 513 SER OG 1 1 10 6388 1 1 17 GLU C C -0.845 1.680 4.909 1.00 . A A . 514 GLU C 1 1 10 6389 1 1 17 GLU CA C -2.215 2.165 4.454 1.00 . A A . 514 GLU CA 1 1 10 6390 1 1 17 GLU CB C -2.360 3.666 4.714 1.00 . A A . 514 GLU CB 1 1 10 6391 1 1 17 GLU CD C -3.084 5.464 6.315 1.00 . A A . 514 GLU CD 1 1 10 6392 1 1 17 GLU CG C -2.688 4.013 6.151 1.00 . A A . 514 GLU CG 1 1 10 6393 1 1 17 GLU H H -3.372 1.580 6.113 1.00 . A A . 514 GLU H 1 1 10 6394 1 1 17 GLU HA H -2.336 2.012 3.391 1.00 . A A . 514 GLU HA 1 1 10 6395 1 1 17 GLU HB2 H -1.433 4.152 4.453 1.00 . A A . 514 GLU HB2 1 1 10 6396 1 1 17 GLU HB3 H -3.148 4.053 4.083 1.00 . A A . 514 GLU HB3 1 1 10 6397 1 1 17 GLU HG2 H -3.503 3.389 6.482 1.00 . A A . 514 GLU HG2 1 1 10 6398 1 1 17 GLU HG3 H -1.818 3.821 6.761 1.00 . A A . 514 GLU HG3 1 1 10 6399 1 1 17 GLU N N -3.276 1.457 5.146 1.00 . A A . 514 GLU N 1 1 10 6400 1 1 17 GLU O O -0.720 1.026 5.949 1.00 . A A . 514 GLU O 1 1 10 6401 1 1 17 GLU OE1 O -4.193 5.837 5.888 1.00 . A A . 514 GLU OE1 1 1 10 6402 1 1 17 GLU OE2 O -2.295 6.239 6.879 1.00 . A A . 514 GLU OE2 1 1 10 6403 1 1 18 CYS C C 2.030 2.699 5.543 1.00 . A A . 515 CYS C 1 1 10 6404 1 1 18 CYS CA C 1.547 1.715 4.486 1.00 . A A . 515 CYS CA 1 1 10 6405 1 1 18 CYS CB C 2.465 1.792 3.251 1.00 . A A . 515 CYS CB 1 1 10 6406 1 1 18 CYS H H -0.005 2.490 3.298 1.00 . A A . 515 CYS H 1 1 10 6407 1 1 18 CYS HA H 1.612 0.733 4.943 1.00 . A A . 515 CYS HA 1 1 10 6408 1 1 18 CYS HB2 H 2.531 0.813 2.798 1.00 . A A . 515 CYS HB2 1 1 10 6409 1 1 18 CYS HB3 H 2.038 2.483 2.540 1.00 . A A . 515 CYS HB3 1 1 10 6410 1 1 18 CYS N N 0.171 2.008 4.129 1.00 . A A . 515 CYS N 1 1 10 6411 1 1 18 CYS O O 1.880 3.914 5.404 1.00 . A A . 515 CYS O 1 1 10 6412 1 1 18 CYS SG S 4.170 2.350 3.617 1.00 . A A . 515 CYS SG 1 1 10 6413 1 1 19 THR C C 4.741 3.043 7.037 1.00 . A A . 516 THR C 1 1 10 6414 1 1 19 THR CA C 3.319 2.924 7.586 1.00 . A A . 516 THR CA 1 1 10 6415 1 1 19 THR CB C 3.312 2.293 8.999 1.00 . A A . 516 THR CB 1 1 10 6416 1 1 19 THR CG2 C 3.669 0.813 8.954 1.00 . A A . 516 THR CG2 1 1 10 6417 1 1 19 THR H H 2.378 1.218 6.844 1.00 . A A . 516 THR H 1 1 10 6418 1 1 19 THR HA H 2.885 3.913 7.650 1.00 . A A . 516 THR HA 1 1 10 6419 1 1 19 THR HB H 2.315 2.388 9.401 1.00 . A A . 516 THR HB 1 1 10 6420 1 1 19 THR HG1 H 3.710 3.545 10.479 1.00 . A A . 516 THR HG1 1 1 10 6421 1 1 19 THR HG21 H 4.668 0.692 8.558 1.00 . A A . 516 THR HG21 1 1 10 6422 1 1 19 THR HG22 H 3.626 0.403 9.950 1.00 . A A . 516 THR HG22 1 1 10 6423 1 1 19 THR HG23 H 2.964 0.295 8.320 1.00 . A A . 516 THR HG23 1 1 10 6424 1 1 19 THR N N 2.531 2.156 6.653 1.00 . A A . 516 THR N 1 1 10 6425 1 1 19 THR O O 5.432 2.044 6.821 1.00 . A A . 516 THR O 1 1 10 6426 1 1 19 THR OG1 O 4.218 2.992 9.861 1.00 . A A . 516 THR OG1 1 1 10 6427 1 1 20 GLY C C 6.186 5.543 5.036 1.00 . A A . 517 GLY C 1 1 10 6428 1 1 20 GLY CA C 6.401 4.499 6.102 1.00 . A A . 517 GLY CA 1 1 10 6429 1 1 20 GLY H H 4.673 5.014 7.208 1.00 . A A . 517 GLY H 1 1 10 6430 1 1 20 GLY HA2 H 7.162 4.840 6.791 1.00 . A A . 517 GLY HA2 1 1 10 6431 1 1 20 GLY HA3 H 6.726 3.581 5.637 1.00 . A A . 517 GLY HA3 1 1 10 6432 1 1 20 GLY N N 5.174 4.262 6.828 1.00 . A A . 517 GLY N 1 1 10 6433 1 1 20 GLY O O 6.880 6.561 5.001 1.00 . A A . 517 GLY O 1 1 10 6434 1 1 21 CYS C C 3.244 6.189 3.098 1.00 . A A . 518 CYS C 1 1 10 6435 1 1 21 CYS CA C 4.746 6.319 3.259 1.00 . A A . 518 CYS CA 1 1 10 6436 1 1 21 CYS CB C 5.433 6.198 1.899 1.00 . A A . 518 CYS CB 1 1 10 6437 1 1 21 CYS H H 4.771 4.412 4.171 1.00 . A A . 518 CYS H 1 1 10 6438 1 1 21 CYS HA H 4.968 7.276 3.701 1.00 . A A . 518 CYS HA 1 1 10 6439 1 1 21 CYS HB2 H 5.331 7.132 1.368 1.00 . A A . 518 CYS HB2 1 1 10 6440 1 1 21 CYS HB3 H 6.481 5.987 2.050 1.00 . A A . 518 CYS HB3 1 1 10 6441 1 1 21 CYS N N 5.206 5.301 4.177 1.00 . A A . 518 CYS N 1 1 10 6442 1 1 21 CYS O O 2.701 5.091 3.111 1.00 . A A . 518 CYS O 1 1 10 6443 1 1 21 CYS SG S 4.746 4.881 0.844 1.00 . A A . 518 CYS SG 1 1 10 6444 1 1 22 HIS C C 0.732 7.744 1.445 1.00 . A A . 519 HIS C 1 1 10 6445 1 1 22 HIS CA C 1.129 7.282 2.829 1.00 . A A . 519 HIS CA 1 1 10 6446 1 1 22 HIS CB C 0.493 8.151 3.920 1.00 . A A . 519 HIS CB 1 1 10 6447 1 1 22 HIS CD2 C 2.109 7.894 5.938 1.00 . A A . 519 HIS CD2 1 1 10 6448 1 1 22 HIS CE1 C 0.764 6.840 7.302 1.00 . A A . 519 HIS CE1 1 1 10 6449 1 1 22 HIS CG C 0.919 7.748 5.303 1.00 . A A . 519 HIS CG 1 1 10 6450 1 1 22 HIS H H 3.053 8.162 2.909 1.00 . A A . 519 HIS H 1 1 10 6451 1 1 22 HIS HA H 0.802 6.259 2.959 1.00 . A A . 519 HIS HA 1 1 10 6452 1 1 22 HIS HB2 H 0.778 9.182 3.767 1.00 . A A . 519 HIS HB2 1 1 10 6453 1 1 22 HIS HB3 H -0.582 8.064 3.863 1.00 . A A . 519 HIS HB3 1 1 10 6454 1 1 22 HIS HD1 H -0.845 6.839 6.040 1.00 . A A . 519 HIS HD1 1 1 10 6455 1 1 22 HIS HD2 H 2.993 8.370 5.539 1.00 . A A . 519 HIS HD2 1 1 10 6456 1 1 22 HIS HE1 H 0.373 6.331 8.171 1.00 . A A . 519 HIS HE1 1 1 10 6457 1 1 22 HIS HE2 H 2.737 7.096 7.776 1.00 . A A . 519 HIS HE2 1 1 10 6458 1 1 22 HIS N N 2.571 7.302 2.943 1.00 . A A . 519 HIS N 1 1 10 6459 1 1 22 HIS ND1 N 0.100 7.085 6.191 1.00 . A A . 519 HIS ND1 1 1 10 6460 1 1 22 HIS NE2 N 1.984 7.320 7.176 1.00 . A A . 519 HIS NE2 1 1 10 6461 1 1 22 HIS O O -0.304 8.378 1.254 1.00 . A A . 519 HIS O 1 1 10 6462 1 1 23 LYS C C 0.500 6.744 -1.609 1.00 . A A . 520 LYS C 1 1 10 6463 1 1 23 LYS CA C 1.347 7.801 -0.906 1.00 . A A . 520 LYS CA 1 1 10 6464 1 1 23 LYS CB C 2.687 7.990 -1.632 1.00 . A A . 520 LYS CB 1 1 10 6465 1 1 23 LYS CD C 4.888 6.908 -2.264 1.00 . A A . 520 LYS CD 1 1 10 6466 1 1 23 LYS CE C 5.130 8.078 -3.212 1.00 . A A . 520 LYS CE 1 1 10 6467 1 1 23 LYS CG C 3.404 6.688 -1.978 1.00 . A A . 520 LYS CG 1 1 10 6468 1 1 23 LYS H H 2.401 6.923 0.694 1.00 . A A . 520 LYS H 1 1 10 6469 1 1 23 LYS HA H 0.808 8.738 -0.909 1.00 . A A . 520 LYS HA 1 1 10 6470 1 1 23 LYS HB2 H 2.511 8.530 -2.549 1.00 . A A . 520 LYS HB2 1 1 10 6471 1 1 23 LYS HB3 H 3.340 8.575 -1.002 1.00 . A A . 520 LYS HB3 1 1 10 6472 1 1 23 LYS HD2 H 5.394 7.108 -1.334 1.00 . A A . 520 LYS HD2 1 1 10 6473 1 1 23 LYS HD3 H 5.294 6.004 -2.710 1.00 . A A . 520 LYS HD3 1 1 10 6474 1 1 23 LYS HE2 H 4.620 8.948 -2.825 1.00 . A A . 520 LYS HE2 1 1 10 6475 1 1 23 LYS HE3 H 6.192 8.275 -3.252 1.00 . A A . 520 LYS HE3 1 1 10 6476 1 1 23 LYS HG2 H 3.308 6.007 -1.147 1.00 . A A . 520 LYS HG2 1 1 10 6477 1 1 23 LYS HG3 H 2.938 6.257 -2.850 1.00 . A A . 520 LYS HG3 1 1 10 6478 1 1 23 LYS HZ1 H 3.628 7.554 -4.572 1.00 . A A . 520 LYS HZ1 1 1 10 6479 1 1 23 LYS HZ2 H 4.758 8.663 -5.177 1.00 . A A . 520 LYS HZ2 1 1 10 6480 1 1 23 LYS HZ3 H 5.177 7.026 -5.019 1.00 . A A . 520 LYS HZ3 1 1 10 6481 1 1 23 LYS N N 1.581 7.421 0.475 1.00 . A A . 520 LYS N 1 1 10 6482 1 1 23 LYS NZ N 4.638 7.811 -4.588 1.00 . A A . 520 LYS NZ 1 1 10 6483 1 1 23 LYS O O -0.074 6.996 -2.668 1.00 . A A . 520 LYS O 1 1 10 6484 1 1 24 VAL C C -1.282 3.867 -0.525 1.00 . A A . 521 VAL C 1 1 10 6485 1 1 24 VAL CA C -0.347 4.459 -1.573 1.00 . A A . 521 VAL CA 1 1 10 6486 1 1 24 VAL CB C 0.569 3.343 -2.114 1.00 . A A . 521 VAL CB 1 1 10 6487 1 1 24 VAL CG1 C 1.385 3.835 -3.298 1.00 . A A . 521 VAL CG1 1 1 10 6488 1 1 24 VAL CG2 C 1.478 2.824 -1.013 1.00 . A A . 521 VAL CG2 1 1 10 6489 1 1 24 VAL H H 0.887 5.429 -0.153 1.00 . A A . 521 VAL H 1 1 10 6490 1 1 24 VAL HA H -0.936 4.846 -2.392 1.00 . A A . 521 VAL HA 1 1 10 6491 1 1 24 VAL HB H -0.050 2.527 -2.453 1.00 . A A . 521 VAL HB 1 1 10 6492 1 1 24 VAL HG11 H 1.977 4.686 -2.999 1.00 . A A . 521 VAL HG11 1 1 10 6493 1 1 24 VAL HG12 H 2.036 3.045 -3.640 1.00 . A A . 521 VAL HG12 1 1 10 6494 1 1 24 VAL HG13 H 0.719 4.123 -4.097 1.00 . A A . 521 VAL HG13 1 1 10 6495 1 1 24 VAL HG21 H 0.875 2.407 -0.220 1.00 . A A . 521 VAL HG21 1 1 10 6496 1 1 24 VAL HG22 H 2.128 2.059 -1.412 1.00 . A A . 521 VAL HG22 1 1 10 6497 1 1 24 VAL HG23 H 2.074 3.636 -0.625 1.00 . A A . 521 VAL HG23 1 1 10 6498 1 1 24 VAL N N 0.420 5.563 -1.008 1.00 . A A . 521 VAL N 1 1 10 6499 1 1 24 VAL O O -1.109 4.093 0.673 1.00 . A A . 521 VAL O 1 1 10 6500 1 1 25 ASN C C -3.441 1.043 -0.405 1.00 . A A . 522 ASN C 1 1 10 6501 1 1 25 ASN CA C -3.246 2.512 -0.081 1.00 . A A . 522 ASN CA 1 1 10 6502 1 1 25 ASN CB C -4.601 3.229 -0.119 1.00 . A A . 522 ASN CB 1 1 10 6503 1 1 25 ASN CG C -4.771 4.115 -1.333 1.00 . A A . 522 ASN CG 1 1 10 6504 1 1 25 ASN H H -2.364 2.981 -1.952 1.00 . A A . 522 ASN H 1 1 10 6505 1 1 25 ASN HA H -2.848 2.580 0.923 1.00 . A A . 522 ASN HA 1 1 10 6506 1 1 25 ASN HB2 H -5.389 2.489 -0.134 1.00 . A A . 522 ASN HB2 1 1 10 6507 1 1 25 ASN HB3 H -4.709 3.836 0.767 1.00 . A A . 522 ASN HB3 1 1 10 6508 1 1 25 ASN HD21 H -5.319 2.545 -2.424 1.00 . A A . 522 ASN HD21 1 1 10 6509 1 1 25 ASN HD22 H -5.308 4.079 -3.237 1.00 . A A . 522 ASN HD22 1 1 10 6510 1 1 25 ASN N N -2.280 3.128 -0.983 1.00 . A A . 522 ASN N 1 1 10 6511 1 1 25 ASN ND2 N -5.166 3.525 -2.441 1.00 . A A . 522 ASN ND2 1 1 10 6512 1 1 25 ASN O O -3.365 0.624 -1.562 1.00 . A A . 522 ASN O 1 1 10 6513 1 1 25 ASN OD1 O -4.514 5.317 -1.281 1.00 . A A . 522 ASN OD1 1 1 10 6514 1 1 26 TYR C C -5.213 -1.503 1.200 1.00 . A A . 523 TYR C 1 1 10 6515 1 1 26 TYR CA C -3.889 -1.152 0.537 1.00 . A A . 523 TYR CA 1 1 10 6516 1 1 26 TYR CB C -2.751 -1.918 1.231 1.00 . A A . 523 TYR CB 1 1 10 6517 1 1 26 TYR CD1 C -0.720 -0.435 0.948 1.00 . A A . 523 TYR CD1 1 1 10 6518 1 1 26 TYR CD2 C -0.699 -2.582 -0.078 1.00 . A A . 523 TYR CD2 1 1 10 6519 1 1 26 TYR CE1 C 0.546 -0.183 0.459 1.00 . A A . 523 TYR CE1 1 1 10 6520 1 1 26 TYR CE2 C 0.567 -2.338 -0.570 1.00 . A A . 523 TYR CE2 1 1 10 6521 1 1 26 TYR CG C -1.365 -1.637 0.685 1.00 . A A . 523 TYR CG 1 1 10 6522 1 1 26 TYR CZ C 1.186 -1.139 -0.300 1.00 . A A . 523 TYR CZ 1 1 10 6523 1 1 26 TYR H H -3.771 0.704 1.523 1.00 . A A . 523 TYR H 1 1 10 6524 1 1 26 TYR HA H -3.928 -1.413 -0.511 1.00 . A A . 523 TYR HA 1 1 10 6525 1 1 26 TYR HB2 H -2.747 -1.660 2.279 1.00 . A A . 523 TYR HB2 1 1 10 6526 1 1 26 TYR HB3 H -2.936 -2.978 1.133 1.00 . A A . 523 TYR HB3 1 1 10 6527 1 1 26 TYR HD1 H -1.226 0.313 1.542 1.00 . A A . 523 TYR HD1 1 1 10 6528 1 1 26 TYR HD2 H -1.184 -3.524 -0.285 1.00 . A A . 523 TYR HD2 1 1 10 6529 1 1 26 TYR HE1 H 1.032 0.757 0.675 1.00 . A A . 523 TYR HE1 1 1 10 6530 1 1 26 TYR HE2 H 1.068 -3.086 -1.165 1.00 . A A . 523 TYR HE2 1 1 10 6531 1 1 26 TYR HH H 2.562 -1.319 -1.645 1.00 . A A . 523 TYR HH 1 1 10 6532 1 1 26 TYR N N -3.684 0.278 0.641 1.00 . A A . 523 TYR N 1 1 10 6533 1 1 26 TYR O O -5.969 -0.614 1.593 1.00 . A A . 523 TYR O 1 1 10 6534 1 1 26 TYR OH O 2.452 -0.895 -0.783 1.00 . A A . 523 TYR OH 1 1 10 6535 1 1 27 CYS C C -6.384 -3.871 3.342 1.00 . A A . 524 CYS C 1 1 10 6536 1 1 27 CYS CA C -6.713 -3.192 2.018 1.00 . A A . 524 CYS CA 1 1 10 6537 1 1 27 CYS CB C -7.519 -4.126 1.109 1.00 . A A . 524 CYS CB 1 1 10 6538 1 1 27 CYS H H -4.837 -3.457 1.090 1.00 . A A . 524 CYS H 1 1 10 6539 1 1 27 CYS HA H -7.296 -2.304 2.218 1.00 . A A . 524 CYS HA 1 1 10 6540 1 1 27 CYS HB2 H -8.492 -4.287 1.546 1.00 . A A . 524 CYS HB2 1 1 10 6541 1 1 27 CYS HB3 H -7.641 -3.657 0.142 1.00 . A A . 524 CYS HB3 1 1 10 6542 1 1 27 CYS N N -5.485 -2.780 1.369 1.00 . A A . 524 CYS N 1 1 10 6543 1 1 27 CYS O O -7.066 -3.675 4.349 1.00 . A A . 524 CYS O 1 1 10 6544 1 1 27 CYS SG S -6.764 -5.760 0.842 1.00 . A A . 524 CYS SG 1 1 10 6545 1 1 28 SER C C -3.346 -5.394 4.581 1.00 . A A . 525 SER C 1 1 10 6546 1 1 28 SER CA C -4.870 -5.393 4.488 1.00 . A A . 525 SER CA 1 1 10 6547 1 1 28 SER CB C -5.398 -6.826 4.379 1.00 . A A . 525 SER CB 1 1 10 6548 1 1 28 SER H H -4.772 -4.688 2.510 1.00 . A A . 525 SER H 1 1 10 6549 1 1 28 SER HA H -5.282 -4.927 5.371 1.00 . A A . 525 SER HA 1 1 10 6550 1 1 28 SER HB2 H -4.828 -7.468 5.035 1.00 . A A . 525 SER HB2 1 1 10 6551 1 1 28 SER HB3 H -6.438 -6.850 4.663 1.00 . A A . 525 SER HB3 1 1 10 6552 1 1 28 SER HG H -5.769 -6.742 2.450 1.00 . A A . 525 SER HG 1 1 10 6553 1 1 28 SER N N -5.302 -4.634 3.329 1.00 . A A . 525 SER N 1 1 10 6554 1 1 28 SER O O -2.659 -5.053 3.614 1.00 . A A . 525 SER O 1 1 10 6555 1 1 28 SER OG O -5.270 -7.313 3.053 1.00 . A A . 525 SER OG 1 1 10 6556 1 1 29 THR C C -0.774 -6.941 5.041 1.00 . A A . 526 THR C 1 1 10 6557 1 1 29 THR CA C -1.386 -5.863 5.943 1.00 . A A . 526 THR CA 1 1 10 6558 1 1 29 THR CB C -1.074 -6.156 7.422 1.00 . A A . 526 THR CB 1 1 10 6559 1 1 29 THR CG2 C 0.400 -5.937 7.730 1.00 . A A . 526 THR CG2 1 1 10 6560 1 1 29 THR H H -3.422 -6.004 6.483 1.00 . A A . 526 THR H 1 1 10 6561 1 1 29 THR HA H -0.955 -4.905 5.686 1.00 . A A . 526 THR HA 1 1 10 6562 1 1 29 THR HB H -1.327 -7.185 7.634 1.00 . A A . 526 THR HB 1 1 10 6563 1 1 29 THR HG1 H -1.850 -5.615 9.163 1.00 . A A . 526 THR HG1 1 1 10 6564 1 1 29 THR HG21 H 0.663 -4.912 7.520 1.00 . A A . 526 THR HG21 1 1 10 6565 1 1 29 THR HG22 H 0.586 -6.151 8.773 1.00 . A A . 526 THR HG22 1 1 10 6566 1 1 29 THR HG23 H 0.997 -6.596 7.116 1.00 . A A . 526 THR HG23 1 1 10 6567 1 1 29 THR N N -2.824 -5.778 5.737 1.00 . A A . 526 THR N 1 1 10 6568 1 1 29 THR O O 0.424 -6.919 4.742 1.00 . A A . 526 THR O 1 1 10 6569 1 1 29 THR OG1 O -1.866 -5.292 8.248 1.00 . A A . 526 THR OG1 1 1 10 6570 1 1 30 PHE C C -0.721 -8.307 2.370 1.00 . A A . 527 PHE C 1 1 10 6571 1 1 30 PHE CA C -1.194 -8.923 3.684 1.00 . A A . 527 PHE CA 1 1 10 6572 1 1 30 PHE CB C -2.365 -9.883 3.425 1.00 . A A . 527 PHE CB 1 1 10 6573 1 1 30 PHE CD1 C -1.544 -12.100 2.578 1.00 . A A . 527 PHE CD1 1 1 10 6574 1 1 30 PHE CD2 C -2.478 -10.565 1.013 1.00 . A A . 527 PHE CD2 1 1 10 6575 1 1 30 PHE CE1 C -1.320 -13.008 1.560 1.00 . A A . 527 PHE CE1 1 1 10 6576 1 1 30 PHE CE2 C -2.256 -11.467 -0.009 1.00 . A A . 527 PHE CE2 1 1 10 6577 1 1 30 PHE CG C -2.123 -10.871 2.317 1.00 . A A . 527 PHE CG 1 1 10 6578 1 1 30 PHE CZ C -1.676 -12.690 0.264 1.00 . A A . 527 PHE CZ 1 1 10 6579 1 1 30 PHE H H -2.519 -7.915 4.986 1.00 . A A . 527 PHE H 1 1 10 6580 1 1 30 PHE HA H -0.378 -9.473 4.127 1.00 . A A . 527 PHE HA 1 1 10 6581 1 1 30 PHE HB2 H -2.562 -10.443 4.327 1.00 . A A . 527 PHE HB2 1 1 10 6582 1 1 30 PHE HB3 H -3.242 -9.308 3.169 1.00 . A A . 527 PHE HB3 1 1 10 6583 1 1 30 PHE HD1 H -1.262 -12.349 3.591 1.00 . A A . 527 PHE HD1 1 1 10 6584 1 1 30 PHE HD2 H -2.932 -9.609 0.800 1.00 . A A . 527 PHE HD2 1 1 10 6585 1 1 30 PHE HE1 H -0.867 -13.964 1.776 1.00 . A A . 527 PHE HE1 1 1 10 6586 1 1 30 PHE HE2 H -2.533 -11.213 -1.023 1.00 . A A . 527 PHE HE2 1 1 10 6587 1 1 30 PHE HZ H -1.503 -13.397 -0.533 1.00 . A A . 527 PHE HZ 1 1 10 6588 1 1 30 PHE N N -1.607 -7.888 4.621 1.00 . A A . 527 PHE N 1 1 10 6589 1 1 30 PHE O O 0.368 -8.630 1.888 1.00 . A A . 527 PHE O 1 1 10 6590 1 1 31 CYS C C 0.056 -5.857 0.747 1.00 . A A . 528 CYS C 1 1 10 6591 1 1 31 CYS CA C -1.158 -6.755 0.557 1.00 . A A . 528 CYS CA 1 1 10 6592 1 1 31 CYS CB C -2.335 -5.977 -0.026 1.00 . A A . 528 CYS CB 1 1 10 6593 1 1 31 CYS H H -2.365 -7.168 2.244 1.00 . A A . 528 CYS H 1 1 10 6594 1 1 31 CYS HA H -0.881 -7.544 -0.126 1.00 . A A . 528 CYS HA 1 1 10 6595 1 1 31 CYS HB2 H -2.755 -5.342 0.741 1.00 . A A . 528 CYS HB2 1 1 10 6596 1 1 31 CYS HB3 H -1.985 -5.363 -0.845 1.00 . A A . 528 CYS HB3 1 1 10 6597 1 1 31 CYS N N -1.521 -7.406 1.806 1.00 . A A . 528 CYS N 1 1 10 6598 1 1 31 CYS O O 0.898 -5.754 -0.141 1.00 . A A . 528 CYS O 1 1 10 6599 1 1 31 CYS SG S -3.666 -7.039 -0.658 1.00 . A A . 528 CYS SG 1 1 10 6600 1 1 32 GLN C C 2.584 -5.132 2.128 1.00 . A A . 529 GLN C 1 1 10 6601 1 1 32 GLN CA C 1.272 -4.350 2.215 1.00 . A A . 529 GLN CA 1 1 10 6602 1 1 32 GLN CB C 1.093 -3.733 3.612 1.00 . A A . 529 GLN CB 1 1 10 6603 1 1 32 GLN CD C 2.876 -1.966 3.441 1.00 . A A . 529 GLN CD 1 1 10 6604 1 1 32 GLN CG C 2.367 -3.160 4.212 1.00 . A A . 529 GLN CG 1 1 10 6605 1 1 32 GLN H H -0.536 -5.383 2.597 1.00 . A A . 529 GLN H 1 1 10 6606 1 1 32 GLN HA H 1.286 -3.562 1.479 1.00 . A A . 529 GLN HA 1 1 10 6607 1 1 32 GLN HB2 H 0.375 -2.927 3.547 1.00 . A A . 529 GLN HB2 1 1 10 6608 1 1 32 GLN HB3 H 0.711 -4.489 4.278 1.00 . A A . 529 GLN HB3 1 1 10 6609 1 1 32 GLN HE21 H 4.745 -2.397 3.944 1.00 . A A . 529 GLN HE21 1 1 10 6610 1 1 32 GLN HE22 H 4.532 -0.996 2.958 1.00 . A A . 529 GLN HE22 1 1 10 6611 1 1 32 GLN HG2 H 2.168 -2.856 5.229 1.00 . A A . 529 GLN HG2 1 1 10 6612 1 1 32 GLN HG3 H 3.130 -3.925 4.208 1.00 . A A . 529 GLN HG3 1 1 10 6613 1 1 32 GLN N N 0.148 -5.226 1.911 1.00 . A A . 529 GLN N 1 1 10 6614 1 1 32 GLN NE2 N 4.182 -1.768 3.449 1.00 . A A . 529 GLN NE2 1 1 10 6615 1 1 32 GLN O O 3.539 -4.699 1.487 1.00 . A A . 529 GLN O 1 1 10 6616 1 1 32 GLN OE1 O 2.101 -1.233 2.843 1.00 . A A . 529 GLN OE1 1 1 10 6617 1 1 33 ARG C C 3.980 -7.812 1.387 1.00 . A A . 530 ARG C 1 1 10 6618 1 1 33 ARG CA C 3.797 -7.140 2.751 1.00 . A A . 530 ARG CA 1 1 10 6619 1 1 33 ARG CB C 3.733 -8.166 3.877 1.00 . A A . 530 ARG CB 1 1 10 6620 1 1 33 ARG CD C 3.527 -8.520 6.354 1.00 . A A . 530 ARG CD 1 1 10 6621 1 1 33 ARG CG C 3.905 -7.548 5.254 1.00 . A A . 530 ARG CG 1 1 10 6622 1 1 33 ARG CZ C 1.498 -9.613 7.234 1.00 . A A . 530 ARG CZ 1 1 10 6623 1 1 33 ARG H H 1.804 -6.589 3.240 1.00 . A A . 530 ARG H 1 1 10 6624 1 1 33 ARG HA H 4.639 -6.481 2.912 1.00 . A A . 530 ARG HA 1 1 10 6625 1 1 33 ARG HB2 H 2.774 -8.663 3.843 1.00 . A A . 530 ARG HB2 1 1 10 6626 1 1 33 ARG HB3 H 4.514 -8.896 3.732 1.00 . A A . 530 ARG HB3 1 1 10 6627 1 1 33 ARG HD2 H 4.057 -9.446 6.197 1.00 . A A . 530 ARG HD2 1 1 10 6628 1 1 33 ARG HD3 H 3.815 -8.097 7.306 1.00 . A A . 530 ARG HD3 1 1 10 6629 1 1 33 ARG HE H 1.535 -8.321 5.703 1.00 . A A . 530 ARG HE 1 1 10 6630 1 1 33 ARG HG2 H 4.937 -7.260 5.382 1.00 . A A . 530 ARG HG2 1 1 10 6631 1 1 33 ARG HG3 H 3.275 -6.675 5.326 1.00 . A A . 530 ARG HG3 1 1 10 6632 1 1 33 ARG HH11 H 3.222 -10.127 8.172 1.00 . A A . 530 ARG HH11 1 1 10 6633 1 1 33 ARG HH12 H 1.784 -10.890 8.786 1.00 . A A . 530 ARG HH12 1 1 10 6634 1 1 33 ARG HH21 H -0.380 -9.307 6.526 1.00 . A A . 530 ARG HH21 1 1 10 6635 1 1 33 ARG HH22 H -0.264 -10.409 7.860 1.00 . A A . 530 ARG HH22 1 1 10 6636 1 1 33 ARG N N 2.612 -6.292 2.767 1.00 . A A . 530 ARG N 1 1 10 6637 1 1 33 ARG NE N 2.088 -8.789 6.370 1.00 . A A . 530 ARG NE 1 1 10 6638 1 1 33 ARG NH1 N 2.225 -10.259 8.135 1.00 . A A . 530 ARG NH1 1 1 10 6639 1 1 33 ARG NH2 N 0.180 -9.791 7.202 1.00 . A A . 530 ARG NH2 1 1 10 6640 1 1 33 ARG O O 5.102 -8.087 0.964 1.00 . A A . 530 ARG O 1 1 10 6641 1 1 34 LYS C C 3.541 -7.678 -1.626 1.00 . A A . 531 LYS C 1 1 10 6642 1 1 34 LYS CA C 2.912 -8.652 -0.642 1.00 . A A . 531 LYS CA 1 1 10 6643 1 1 34 LYS CB C 1.489 -9.035 -1.091 1.00 . A A . 531 LYS CB 1 1 10 6644 1 1 34 LYS CD C 0.841 -8.009 -3.302 1.00 . A A . 531 LYS CD 1 1 10 6645 1 1 34 LYS CE C 0.874 -8.151 -4.820 1.00 . A A . 531 LYS CE 1 1 10 6646 1 1 34 LYS CG C 1.327 -9.270 -2.591 1.00 . A A . 531 LYS CG 1 1 10 6647 1 1 34 LYS H H 2.002 -7.869 1.108 1.00 . A A . 531 LYS H 1 1 10 6648 1 1 34 LYS HA H 3.519 -9.545 -0.597 1.00 . A A . 531 LYS HA 1 1 10 6649 1 1 34 LYS HB2 H 1.202 -9.938 -0.579 1.00 . A A . 531 LYS HB2 1 1 10 6650 1 1 34 LYS HB3 H 0.812 -8.244 -0.800 1.00 . A A . 531 LYS HB3 1 1 10 6651 1 1 34 LYS HD2 H -0.175 -7.806 -2.997 1.00 . A A . 531 LYS HD2 1 1 10 6652 1 1 34 LYS HD3 H 1.475 -7.183 -3.015 1.00 . A A . 531 LYS HD3 1 1 10 6653 1 1 34 LYS HE2 H 0.442 -9.104 -5.087 1.00 . A A . 531 LYS HE2 1 1 10 6654 1 1 34 LYS HE3 H 0.283 -7.357 -5.254 1.00 . A A . 531 LYS HE3 1 1 10 6655 1 1 34 LYS HG2 H 2.279 -9.563 -3.007 1.00 . A A . 531 LYS HG2 1 1 10 6656 1 1 34 LYS HG3 H 0.604 -10.060 -2.743 1.00 . A A . 531 LYS HG3 1 1 10 6657 1 1 34 LYS HZ1 H 2.752 -7.242 -4.996 1.00 . A A . 531 LYS HZ1 1 1 10 6658 1 1 34 LYS HZ2 H 2.794 -8.933 -5.103 1.00 . A A . 531 LYS HZ2 1 1 10 6659 1 1 34 LYS HZ3 H 2.230 -8.018 -6.409 1.00 . A A . 531 LYS HZ3 1 1 10 6660 1 1 34 LYS N N 2.872 -8.070 0.701 1.00 . A A . 531 LYS N 1 1 10 6661 1 1 34 LYS NZ N 2.257 -8.081 -5.367 1.00 . A A . 531 LYS NZ 1 1 10 6662 1 1 34 LYS O O 4.349 -8.058 -2.473 1.00 . A A . 531 LYS O 1 1 10 6663 1 1 35 ASP C C 5.056 -4.922 -1.938 1.00 . A A . 532 ASP C 1 1 10 6664 1 1 35 ASP CA C 3.671 -5.372 -2.376 1.00 . A A . 532 ASP CA 1 1 10 6665 1 1 35 ASP CB C 2.711 -4.185 -2.352 1.00 . A A . 532 ASP CB 1 1 10 6666 1 1 35 ASP CG C 2.986 -3.184 -3.457 1.00 . A A . 532 ASP CG 1 1 10 6667 1 1 35 ASP H H 2.491 -6.184 -0.825 1.00 . A A . 532 ASP H 1 1 10 6668 1 1 35 ASP HA H 3.722 -5.753 -3.386 1.00 . A A . 532 ASP HA 1 1 10 6669 1 1 35 ASP HB2 H 1.702 -4.547 -2.464 1.00 . A A . 532 ASP HB2 1 1 10 6670 1 1 35 ASP HB3 H 2.802 -3.679 -1.402 1.00 . A A . 532 ASP HB3 1 1 10 6671 1 1 35 ASP N N 3.165 -6.420 -1.504 1.00 . A A . 532 ASP N 1 1 10 6672 1 1 35 ASP O O 5.762 -4.257 -2.689 1.00 . A A . 532 ASP O 1 1 10 6673 1 1 35 ASP OD1 O 2.915 -3.576 -4.642 1.00 . A A . 532 ASP OD1 1 1 10 6674 1 1 35 ASP OD2 O 3.262 -2.004 -3.149 1.00 . A A . 532 ASP OD2 1 1 10 6675 1 1 36 TRP C C 7.923 -5.097 -0.942 1.00 . A A . 533 TRP C 1 1 10 6676 1 1 36 TRP CA C 6.673 -4.835 -0.113 1.00 . A A . 533 TRP CA 1 1 10 6677 1 1 36 TRP CB C 6.864 -5.430 1.282 1.00 . A A . 533 TRP CB 1 1 10 6678 1 1 36 TRP CD1 C 9.196 -5.412 2.338 1.00 . A A . 533 TRP CD1 1 1 10 6679 1 1 36 TRP CD2 C 8.138 -3.439 2.396 1.00 . A A . 533 TRP CD2 1 1 10 6680 1 1 36 TRP CE2 C 9.402 -3.288 2.989 1.00 . A A . 533 TRP CE2 1 1 10 6681 1 1 36 TRP CE3 C 7.290 -2.326 2.318 1.00 . A A . 533 TRP CE3 1 1 10 6682 1 1 36 TRP CG C 8.024 -4.808 1.990 1.00 . A A . 533 TRP CG 1 1 10 6683 1 1 36 TRP CH2 C 8.999 -1.000 3.411 1.00 . A A . 533 TRP CH2 1 1 10 6684 1 1 36 TRP CZ2 C 9.845 -2.073 3.498 1.00 . A A . 533 TRP CZ2 1 1 10 6685 1 1 36 TRP CZ3 C 7.730 -1.117 2.829 1.00 . A A . 533 TRP CZ3 1 1 10 6686 1 1 36 TRP H H 4.936 -6.024 -0.271 1.00 . A A . 533 TRP H 1 1 10 6687 1 1 36 TRP HA H 6.558 -3.766 0.008 1.00 . A A . 533 TRP HA 1 1 10 6688 1 1 36 TRP HB2 H 5.975 -5.260 1.871 1.00 . A A . 533 TRP HB2 1 1 10 6689 1 1 36 TRP HB3 H 7.047 -6.491 1.200 1.00 . A A . 533 TRP HB3 1 1 10 6690 1 1 36 TRP HD1 H 9.422 -6.451 2.159 1.00 . A A . 533 TRP HD1 1 1 10 6691 1 1 36 TRP HE1 H 10.937 -4.696 3.278 1.00 . A A . 533 TRP HE1 1 1 10 6692 1 1 36 TRP HE3 H 6.309 -2.399 1.870 1.00 . A A . 533 TRP HE3 1 1 10 6693 1 1 36 TRP HH2 H 9.302 -0.038 3.799 1.00 . A A . 533 TRP HH2 1 1 10 6694 1 1 36 TRP HZ2 H 10.823 -1.969 3.943 1.00 . A A . 533 TRP HZ2 1 1 10 6695 1 1 36 TRP HZ3 H 7.092 -0.248 2.779 1.00 . A A . 533 TRP HZ3 1 1 10 6696 1 1 36 TRP N N 5.462 -5.347 -0.745 1.00 . A A . 533 TRP N 1 1 10 6697 1 1 36 TRP NE1 N 10.031 -4.504 2.937 1.00 . A A . 533 TRP NE1 1 1 10 6698 1 1 36 TRP O O 8.868 -4.328 -0.896 1.00 . A A . 533 TRP O 1 1 10 6699 1 1 37 LYS C C 9.413 -5.539 -3.567 1.00 . A A . 534 LYS C 1 1 10 6700 1 1 37 LYS CA C 9.128 -6.537 -2.453 1.00 . A A . 534 LYS CA 1 1 10 6701 1 1 37 LYS CB C 9.023 -7.965 -2.981 1.00 . A A . 534 LYS CB 1 1 10 6702 1 1 37 LYS CD C 8.934 -10.411 -2.391 1.00 . A A . 534 LYS CD 1 1 10 6703 1 1 37 LYS CE C 9.096 -11.436 -1.276 1.00 . A A . 534 LYS CE 1 1 10 6704 1 1 37 LYS CG C 9.111 -9.000 -1.870 1.00 . A A . 534 LYS CG 1 1 10 6705 1 1 37 LYS H H 7.112 -6.686 -1.814 1.00 . A A . 534 LYS H 1 1 10 6706 1 1 37 LYS HA H 9.959 -6.483 -1.767 1.00 . A A . 534 LYS HA 1 1 10 6707 1 1 37 LYS HB2 H 8.078 -8.083 -3.490 1.00 . A A . 534 LYS HB2 1 1 10 6708 1 1 37 LYS HB3 H 9.829 -8.143 -3.679 1.00 . A A . 534 LYS HB3 1 1 10 6709 1 1 37 LYS HD2 H 7.946 -10.507 -2.816 1.00 . A A . 534 LYS HD2 1 1 10 6710 1 1 37 LYS HD3 H 9.676 -10.598 -3.154 1.00 . A A . 534 LYS HD3 1 1 10 6711 1 1 37 LYS HE2 H 10.126 -11.441 -0.951 1.00 . A A . 534 LYS HE2 1 1 10 6712 1 1 37 LYS HE3 H 8.460 -11.153 -0.449 1.00 . A A . 534 LYS HE3 1 1 10 6713 1 1 37 LYS HG2 H 10.078 -8.924 -1.397 1.00 . A A . 534 LYS HG2 1 1 10 6714 1 1 37 LYS HG3 H 8.338 -8.798 -1.144 1.00 . A A . 534 LYS HG3 1 1 10 6715 1 1 37 LYS HZ1 H 9.253 -13.056 -2.585 1.00 . A A . 534 LYS HZ1 1 1 10 6716 1 1 37 LYS HZ2 H 8.954 -13.499 -0.977 1.00 . A A . 534 LYS HZ2 1 1 10 6717 1 1 37 LYS HZ3 H 7.705 -12.852 -1.925 1.00 . A A . 534 LYS HZ3 1 1 10 6718 1 1 37 LYS N N 7.929 -6.164 -1.713 1.00 . A A . 534 LYS N 1 1 10 6719 1 1 37 LYS NZ N 8.727 -12.805 -1.721 1.00 . A A . 534 LYS NZ 1 1 10 6720 1 1 37 LYS O O 10.567 -5.334 -3.946 1.00 . A A . 534 LYS O 1 1 10 6721 1 1 38 ASP C C 8.525 -2.491 -4.245 1.00 . A A . 535 ASP C 1 1 10 6722 1 1 38 ASP CA C 8.537 -3.799 -5.010 1.00 . A A . 535 ASP CA 1 1 10 6723 1 1 38 ASP CB C 7.409 -3.769 -6.035 1.00 . A A . 535 ASP CB 1 1 10 6724 1 1 38 ASP CG C 7.900 -3.512 -7.444 1.00 . A A . 535 ASP CG 1 1 10 6725 1 1 38 ASP H H 7.462 -5.193 -3.826 1.00 . A A . 535 ASP H 1 1 10 6726 1 1 38 ASP HA H 9.487 -3.925 -5.507 1.00 . A A . 535 ASP HA 1 1 10 6727 1 1 38 ASP HB2 H 6.893 -4.707 -6.014 1.00 . A A . 535 ASP HB2 1 1 10 6728 1 1 38 ASP HB3 H 6.716 -2.982 -5.771 1.00 . A A . 535 ASP HB3 1 1 10 6729 1 1 38 ASP N N 8.367 -4.908 -4.078 1.00 . A A . 535 ASP N 1 1 10 6730 1 1 38 ASP O O 9.257 -1.561 -4.529 1.00 . A A . 535 ASP O 1 1 10 6731 1 1 38 ASP OD1 O 8.582 -2.494 -7.672 1.00 . A A . 535 ASP OD1 1 1 10 6732 1 1 38 ASP OD2 O 7.605 -4.335 -8.337 1.00 . A A . 535 ASP OD2 1 1 10 6733 1 1 39 HIS C C 8.637 -0.818 -1.701 1.00 . A A . 536 HIS C 1 1 10 6734 1 1 39 HIS CA C 7.421 -1.238 -2.512 1.00 . A A . 536 HIS CA 1 1 10 6735 1 1 39 HIS CB C 6.221 -1.449 -1.589 1.00 . A A . 536 HIS CB 1 1 10 6736 1 1 39 HIS CD2 C 5.557 0.209 0.281 1.00 . A A . 536 HIS CD2 1 1 10 6737 1 1 39 HIS CE1 C 4.655 1.755 -0.936 1.00 . A A . 536 HIS CE1 1 1 10 6738 1 1 39 HIS CG C 5.660 -0.192 -1.012 1.00 . A A . 536 HIS CG 1 1 10 6739 1 1 39 HIS H H 7.168 -3.249 -3.038 1.00 . A A . 536 HIS H 1 1 10 6740 1 1 39 HIS HA H 7.187 -0.456 -3.225 1.00 . A A . 536 HIS HA 1 1 10 6741 1 1 39 HIS HB2 H 5.433 -1.935 -2.146 1.00 . A A . 536 HIS HB2 1 1 10 6742 1 1 39 HIS HB3 H 6.519 -2.088 -0.770 1.00 . A A . 536 HIS HB3 1 1 10 6743 1 1 39 HIS HD1 H 4.988 0.801 -2.752 1.00 . A A . 536 HIS HD1 1 1 10 6744 1 1 39 HIS HD2 H 5.913 -0.329 1.148 1.00 . A A . 536 HIS HD2 1 1 10 6745 1 1 39 HIS HE1 H 4.163 2.665 -1.245 1.00 . A A . 536 HIS HE1 1 1 10 6746 1 1 39 HIS N N 7.672 -2.446 -3.258 1.00 . A A . 536 HIS N 1 1 10 6747 1 1 39 HIS ND1 N 5.084 0.802 -1.771 1.00 . A A . 536 HIS ND1 1 1 10 6748 1 1 39 HIS NE2 N 4.913 1.436 0.313 1.00 . A A . 536 HIS NE2 1 1 10 6749 1 1 39 HIS O O 8.872 0.357 -1.532 1.00 . A A . 536 HIS O 1 1 10 6750 1 1 40 GLN C C 11.593 -0.576 -1.054 1.00 . A A . 537 GLN C 1 1 10 6751 1 1 40 GLN CA C 10.557 -1.456 -0.350 1.00 . A A . 537 GLN CA 1 1 10 6752 1 1 40 GLN CB C 11.220 -2.732 0.173 1.00 . A A . 537 GLN CB 1 1 10 6753 1 1 40 GLN CD C 12.311 -4.934 -0.348 1.00 . A A . 537 GLN CD 1 1 10 6754 1 1 40 GLN CG C 11.762 -3.642 -0.912 1.00 . A A . 537 GLN CG 1 1 10 6755 1 1 40 GLN H H 9.210 -2.719 -1.421 1.00 . A A . 537 GLN H 1 1 10 6756 1 1 40 GLN HA H 10.169 -0.900 0.489 1.00 . A A . 537 GLN HA 1 1 10 6757 1 1 40 GLN HB2 H 12.036 -2.460 0.825 1.00 . A A . 537 GLN HB2 1 1 10 6758 1 1 40 GLN HB3 H 10.491 -3.289 0.744 1.00 . A A . 537 GLN HB3 1 1 10 6759 1 1 40 GLN HE21 H 10.485 -5.701 -0.293 1.00 . A A . 537 GLN HE21 1 1 10 6760 1 1 40 GLN HE22 H 11.750 -6.733 0.289 1.00 . A A . 537 GLN HE22 1 1 10 6761 1 1 40 GLN HG2 H 10.970 -3.871 -1.616 1.00 . A A . 537 GLN HG2 1 1 10 6762 1 1 40 GLN HG3 H 12.558 -3.124 -1.419 1.00 . A A . 537 GLN HG3 1 1 10 6763 1 1 40 GLN N N 9.416 -1.773 -1.215 1.00 . A A . 537 GLN N 1 1 10 6764 1 1 40 GLN NE2 N 11.428 -5.886 -0.100 1.00 . A A . 537 GLN NE2 1 1 10 6765 1 1 40 GLN O O 12.245 0.245 -0.410 1.00 . A A . 537 GLN O 1 1 10 6766 1 1 40 GLN OE1 O 13.510 -5.061 -0.101 1.00 . A A . 537 GLN OE1 1 1 10 6767 1 1 41 HIS C C 12.089 1.433 -3.458 1.00 . A A . 538 HIS C 1 1 10 6768 1 1 41 HIS CA C 12.710 0.085 -3.097 1.00 . A A . 538 HIS CA 1 1 10 6769 1 1 41 HIS CB C 13.270 -0.627 -4.352 1.00 . A A . 538 HIS CB 1 1 10 6770 1 1 41 HIS CD2 C 11.538 -1.711 -5.935 1.00 . A A . 538 HIS CD2 1 1 10 6771 1 1 41 HIS CE1 C 11.379 -0.073 -7.352 1.00 . A A . 538 HIS CE1 1 1 10 6772 1 1 41 HIS CG C 12.346 -0.702 -5.536 1.00 . A A . 538 HIS CG 1 1 10 6773 1 1 41 HIS H H 11.280 -1.467 -2.821 1.00 . A A . 538 HIS H 1 1 10 6774 1 1 41 HIS HA H 13.537 0.287 -2.433 1.00 . A A . 538 HIS HA 1 1 10 6775 1 1 41 HIS HB2 H 14.160 -0.109 -4.673 1.00 . A A . 538 HIS HB2 1 1 10 6776 1 1 41 HIS HB3 H 13.537 -1.637 -4.080 1.00 . A A . 538 HIS HB3 1 1 10 6777 1 1 41 HIS HD2 H 11.348 -2.633 -5.408 1.00 . A A . 538 HIS HD2 1 1 10 6778 1 1 41 HIS HE1 H 11.058 0.528 -8.190 1.00 . A A . 538 HIS HE1 1 1 10 6779 1 1 41 HIS HE2 H 10.100 -1.704 -7.465 1.00 . A A . 538 HIS HE2 1 1 10 6780 1 1 41 HIS N N 11.765 -0.750 -2.362 1.00 . A A . 538 HIS N 1 1 10 6781 1 1 41 HIS ND1 N 12.242 0.331 -6.436 1.00 . A A . 538 HIS ND1 1 1 10 6782 1 1 41 HIS NE2 N 10.928 -1.306 -7.093 1.00 . A A . 538 HIS NE2 1 1 10 6783 1 1 41 HIS O O 12.810 2.398 -3.717 1.00 . A A . 538 HIS O 1 1 10 6784 1 1 42 ILE C C 9.800 3.558 -2.500 1.00 . A A . 539 ILE C 1 1 10 6785 1 1 42 ILE CA C 10.093 2.770 -3.786 1.00 . A A . 539 ILE CA 1 1 10 6786 1 1 42 ILE CB C 8.793 2.537 -4.627 1.00 . A A . 539 ILE CB 1 1 10 6787 1 1 42 ILE CD1 C 6.796 3.658 -3.485 1.00 . A A . 539 ILE CD1 1 1 10 6788 1 1 42 ILE CG1 C 7.525 2.361 -3.777 1.00 . A A . 539 ILE CG1 1 1 10 6789 1 1 42 ILE CG2 C 8.969 1.336 -5.534 1.00 . A A . 539 ILE CG2 1 1 10 6790 1 1 42 ILE H H 10.219 0.702 -3.327 1.00 . A A . 539 ILE H 1 1 10 6791 1 1 42 ILE HA H 10.773 3.356 -4.388 1.00 . A A . 539 ILE HA 1 1 10 6792 1 1 42 ILE HB H 8.661 3.386 -5.261 1.00 . A A . 539 ILE HB 1 1 10 6793 1 1 42 ILE HD11 H 6.470 4.105 -4.413 1.00 . A A . 539 ILE HD11 1 1 10 6794 1 1 42 ILE HD12 H 5.939 3.458 -2.860 1.00 . A A . 539 ILE HD12 1 1 10 6795 1 1 42 ILE HD13 H 7.465 4.337 -2.975 1.00 . A A . 539 ILE HD13 1 1 10 6796 1 1 42 ILE HG12 H 6.842 1.715 -4.299 1.00 . A A . 539 ILE HG12 1 1 10 6797 1 1 42 ILE HG13 H 7.791 1.910 -2.833 1.00 . A A . 539 ILE HG13 1 1 10 6798 1 1 42 ILE HG21 H 9.173 0.460 -4.934 1.00 . A A . 539 ILE HG21 1 1 10 6799 1 1 42 ILE HG22 H 8.067 1.179 -6.105 1.00 . A A . 539 ILE HG22 1 1 10 6800 1 1 42 ILE HG23 H 9.797 1.510 -6.205 1.00 . A A . 539 ILE HG23 1 1 10 6801 1 1 42 ILE N N 10.760 1.509 -3.481 1.00 . A A . 539 ILE N 1 1 10 6802 1 1 42 ILE O O 10.018 4.769 -2.438 1.00 . A A . 539 ILE O 1 1 10 6803 1 1 43 CYS C C 10.047 4.253 0.368 1.00 . A A . 540 CYS C 1 1 10 6804 1 1 43 CYS CA C 8.900 3.445 -0.233 1.00 . A A . 540 CYS CA 1 1 10 6805 1 1 43 CYS CB C 8.507 2.317 0.721 1.00 . A A . 540 CYS CB 1 1 10 6806 1 1 43 CYS H H 9.118 1.889 -1.639 1.00 . A A . 540 CYS H 1 1 10 6807 1 1 43 CYS HA H 8.044 4.085 -0.381 1.00 . A A . 540 CYS HA 1 1 10 6808 1 1 43 CYS HB2 H 7.905 1.598 0.187 1.00 . A A . 540 CYS HB2 1 1 10 6809 1 1 43 CYS HB3 H 9.404 1.830 1.073 1.00 . A A . 540 CYS HB3 1 1 10 6810 1 1 43 CYS N N 9.288 2.853 -1.502 1.00 . A A . 540 CYS N 1 1 10 6811 1 1 43 CYS O O 11.133 3.730 0.634 1.00 . A A . 540 CYS O 1 1 10 6812 1 1 43 CYS SG S 7.560 2.842 2.178 1.00 . A A . 540 CYS SG 1 1 10 6813 1 1 44 GLY C C 10.779 7.753 0.362 1.00 . A A . 541 GLY C 1 1 10 6814 1 1 44 GLY CA C 10.783 6.429 1.089 1.00 . A A . 541 GLY CA 1 1 10 6815 1 1 44 GLY H H 8.855 5.843 0.434 1.00 . A A . 541 GLY H 1 1 10 6816 1 1 44 GLY HA2 H 10.601 6.606 2.139 1.00 . A A . 541 GLY HA2 1 1 10 6817 1 1 44 GLY HA3 H 11.754 5.968 0.974 1.00 . A A . 541 GLY HA3 1 1 10 6818 1 1 44 GLY N N 9.773 5.525 0.586 1.00 . A A . 541 GLY N 1 1 10 6819 1 1 44 GLY O O 11.305 8.747 0.866 1.00 . A A . 541 GLY O 1 1 10 6820 1 1 45 GLN C C 8.902 9.836 -1.182 1.00 . A A . 542 GLN C 1 1 10 6821 1 1 45 GLN CA C 10.099 8.998 -1.612 1.00 . A A . 542 GLN CA 1 1 10 6822 1 1 45 GLN CB C 9.991 8.664 -3.101 1.00 . A A . 542 GLN CB 1 1 10 6823 1 1 45 GLN CD C 12.477 8.246 -3.301 1.00 . A A . 542 GLN CD 1 1 10 6824 1 1 45 GLN CG C 11.080 7.728 -3.590 1.00 . A A . 542 GLN CG 1 1 10 6825 1 1 45 GLN H H 9.784 6.957 -1.179 1.00 . A A . 542 GLN H 1 1 10 6826 1 1 45 GLN HA H 11.002 9.563 -1.444 1.00 . A A . 542 GLN HA 1 1 10 6827 1 1 45 GLN HB2 H 9.034 8.198 -3.286 1.00 . A A . 542 GLN HB2 1 1 10 6828 1 1 45 GLN HB3 H 10.051 9.581 -3.672 1.00 . A A . 542 GLN HB3 1 1 10 6829 1 1 45 GLN HE21 H 13.144 6.387 -3.118 1.00 . A A . 542 GLN HE21 1 1 10 6830 1 1 45 GLN HE22 H 14.320 7.637 -2.870 1.00 . A A . 542 GLN HE22 1 1 10 6831 1 1 45 GLN HG2 H 10.962 6.773 -3.102 1.00 . A A . 542 GLN HG2 1 1 10 6832 1 1 45 GLN HG3 H 10.973 7.600 -4.658 1.00 . A A . 542 GLN HG3 1 1 10 6833 1 1 45 GLN N N 10.178 7.778 -0.823 1.00 . A A . 542 GLN N 1 1 10 6834 1 1 45 GLN NE2 N 13.406 7.332 -3.079 1.00 . A A . 542 GLN NE2 1 1 10 6835 1 1 45 GLN O O 7.808 9.694 -1.729 1.00 . A A . 542 GLN O 1 1 10 6836 1 1 45 GLN OE1 O 12.719 9.454 -3.279 1.00 . A A . 542 GLN OE1 1 1 10 6837 1 1 46 SER C C 7.644 12.539 -0.804 1.00 . A A . 543 SER C 1 1 10 6838 1 1 46 SER CA C 8.082 11.588 0.306 1.00 . A A . 543 SER CA 1 1 10 6839 1 1 46 SER CB C 8.615 12.387 1.498 1.00 . A A . 543 SER CB 1 1 10 6840 1 1 46 SER H H 9.989 10.678 0.266 1.00 . A A . 543 SER H 1 1 10 6841 1 1 46 SER HA H 7.234 11.002 0.622 1.00 . A A . 543 SER HA 1 1 10 6842 1 1 46 SER HB2 H 9.404 13.045 1.165 1.00 . A A . 543 SER HB2 1 1 10 6843 1 1 46 SER HB3 H 7.813 12.974 1.922 1.00 . A A . 543 SER HB3 1 1 10 6844 1 1 46 SER HG H 8.436 11.340 3.149 1.00 . A A . 543 SER HG 1 1 10 6845 1 1 46 SER N N 9.114 10.678 -0.176 1.00 . A A . 543 SER N 1 1 10 6846 1 1 46 SER O O 8.313 13.536 -1.084 1.00 . A A . 543 SER O 1 1 10 6847 1 1 46 SER OG O 9.132 11.526 2.499 1.00 . A A . 543 SER OG 1 1 10 6848 1 1 47 ALA C C 4.502 12.792 -2.676 1.00 . A A . 544 ALA C 1 1 10 6849 1 1 47 ALA CA C 5.999 13.027 -2.525 1.00 . A A . 544 ALA CA 1 1 10 6850 1 1 47 ALA CB C 6.725 12.728 -3.830 1.00 . A A . 544 ALA CB 1 1 10 6851 1 1 47 ALA H H 6.060 11.386 -1.195 1.00 . A A . 544 ALA H 1 1 10 6852 1 1 47 ALA HA H 6.168 14.063 -2.273 1.00 . A A . 544 ALA HA 1 1 10 6853 1 1 47 ALA HB1 H 6.544 11.701 -4.117 1.00 . A A . 544 ALA HB1 1 1 10 6854 1 1 47 ALA HB2 H 6.360 13.386 -4.604 1.00 . A A . 544 ALA HB2 1 1 10 6855 1 1 47 ALA HB3 H 7.784 12.882 -3.695 1.00 . A A . 544 ALA HB3 1 1 10 6856 1 1 47 ALA N N 6.534 12.210 -1.449 1.00 . A A . 544 ALA N 1 1 10 6857 1 1 47 ALA O O 4.109 11.901 -3.460 1.00 . A A . 544 ALA O 1 1 10 6858 1 1 47 ALA OXT O 3.721 13.493 -2.002 1.00 . A A . 544 ALA OXT 1 1 10 6859 2 2 1 ZN ZN ZN -5.512 -5.779 -1.070 1.00 . B A . 601 ZN ZN 1 1 10 6860 3 2 1 ZN ZN ZN 5.316 2.818 1.681 1.00 . C A . 602 ZN ZN 1 1 11 6861 1 1 1 GLY C C -16.841 2.156 1.901 1.00 . A A . 498 GLY C 1 1 11 6862 1 1 1 GLY CA C -17.515 3.267 2.679 1.00 . A A . 498 GLY CA 1 1 11 6863 1 1 1 GLY H1 H -18.899 4.803 2.387 1.00 . A A . 498 GLY H1 1 1 11 6864 1 1 1 GLY H2 H -19.206 3.410 1.468 1.00 . A A . 498 GLY H2 1 1 11 6865 1 1 1 GLY H3 H -17.949 4.458 1.025 1.00 . A A . 498 GLY H3 1 1 11 6866 1 1 1 GLY HA2 H -16.757 3.936 3.061 1.00 . A A . 498 GLY HA2 1 1 11 6867 1 1 1 GLY HA3 H -18.057 2.838 3.509 1.00 . A A . 498 GLY HA3 1 1 11 6868 1 1 1 GLY N N -18.458 4.039 1.835 1.00 . A A . 498 GLY N 1 1 11 6869 1 1 1 GLY O O -17.515 1.365 1.237 1.00 . A A . 498 GLY O 1 1 11 6870 1 1 2 ALA C C -14.762 1.320 -0.230 1.00 . A A . 499 ALA C 1 1 11 6871 1 1 2 ALA CA C -14.703 1.111 1.279 1.00 . A A . 499 ALA CA 1 1 11 6872 1 1 2 ALA CB C -15.127 -0.307 1.654 1.00 . A A . 499 ALA CB 1 1 11 6873 1 1 2 ALA H H -15.051 2.794 2.510 1.00 . A A . 499 ALA H 1 1 11 6874 1 1 2 ALA HA H -13.679 1.244 1.600 1.00 . A A . 499 ALA HA 1 1 11 6875 1 1 2 ALA HB1 H -15.095 -0.422 2.728 1.00 . A A . 499 ALA HB1 1 1 11 6876 1 1 2 ALA HB2 H -16.131 -0.487 1.303 1.00 . A A . 499 ALA HB2 1 1 11 6877 1 1 2 ALA HB3 H -14.455 -1.016 1.194 1.00 . A A . 499 ALA HB3 1 1 11 6878 1 1 2 ALA N N -15.512 2.111 1.977 1.00 . A A . 499 ALA N 1 1 11 6879 1 1 2 ALA O O -14.964 0.374 -0.995 1.00 . A A . 499 ALA O 1 1 11 6880 1 1 3 MET C C -13.685 4.204 -2.250 1.00 . A A . 500 MET C 1 1 11 6881 1 1 3 MET CA C -14.523 2.941 -2.060 1.00 . A A . 500 MET CA 1 1 11 6882 1 1 3 MET CB C -15.904 3.175 -2.695 1.00 . A A . 500 MET CB 1 1 11 6883 1 1 3 MET CE C -18.810 3.630 -3.644 1.00 . A A . 500 MET CE 1 1 11 6884 1 1 3 MET CG C -16.786 1.939 -2.772 1.00 . A A . 500 MET CG 1 1 11 6885 1 1 3 MET H H -14.555 3.288 0.039 1.00 . A A . 500 MET H 1 1 11 6886 1 1 3 MET HA H -14.036 2.127 -2.575 1.00 . A A . 500 MET HA 1 1 11 6887 1 1 3 MET HB2 H -16.427 3.924 -2.118 1.00 . A A . 500 MET HB2 1 1 11 6888 1 1 3 MET HB3 H -15.760 3.549 -3.697 1.00 . A A . 500 MET HB3 1 1 11 6889 1 1 3 MET HE1 H -18.068 4.414 -3.682 1.00 . A A . 500 MET HE1 1 1 11 6890 1 1 3 MET HE2 H -19.597 3.844 -4.350 1.00 . A A . 500 MET HE2 1 1 11 6891 1 1 3 MET HE3 H -19.223 3.576 -2.646 1.00 . A A . 500 MET HE3 1 1 11 6892 1 1 3 MET HG2 H -16.164 1.083 -2.983 1.00 . A A . 500 MET HG2 1 1 11 6893 1 1 3 MET HG3 H -17.275 1.802 -1.819 1.00 . A A . 500 MET HG3 1 1 11 6894 1 1 3 MET N N -14.613 2.578 -0.641 1.00 . A A . 500 MET N 1 1 11 6895 1 1 3 MET O O -13.302 4.540 -3.372 1.00 . A A . 500 MET O 1 1 11 6896 1 1 3 MET SD S -18.047 2.063 -4.057 1.00 . A A . 500 MET SD 1 1 11 6897 1 1 4 GLU C C -11.206 6.019 -1.362 1.00 . A A . 501 GLU C 1 1 11 6898 1 1 4 GLU CA C -12.714 6.185 -1.212 1.00 . A A . 501 GLU CA 1 1 11 6899 1 1 4 GLU CB C -13.045 7.048 0.019 1.00 . A A . 501 GLU CB 1 1 11 6900 1 1 4 GLU CD C -13.930 5.350 1.678 1.00 . A A . 501 GLU CD 1 1 11 6901 1 1 4 GLU CG C -12.847 6.363 1.369 1.00 . A A . 501 GLU CG 1 1 11 6902 1 1 4 GLU H H -13.633 4.522 -0.274 1.00 . A A . 501 GLU H 1 1 11 6903 1 1 4 GLU HA H -13.081 6.694 -2.091 1.00 . A A . 501 GLU HA 1 1 11 6904 1 1 4 GLU HB2 H -12.418 7.928 -0.001 1.00 . A A . 501 GLU HB2 1 1 11 6905 1 1 4 GLU HB3 H -14.077 7.361 -0.049 1.00 . A A . 501 GLU HB3 1 1 11 6906 1 1 4 GLU HG2 H -11.896 5.853 1.363 1.00 . A A . 501 GLU HG2 1 1 11 6907 1 1 4 GLU HG3 H -12.846 7.115 2.145 1.00 . A A . 501 GLU HG3 1 1 11 6908 1 1 4 GLU N N -13.394 4.894 -1.152 1.00 . A A . 501 GLU N 1 1 11 6909 1 1 4 GLU O O -10.498 6.970 -1.701 1.00 . A A . 501 GLU O 1 1 11 6910 1 1 4 GLU OE1 O -15.014 5.754 2.142 1.00 . A A . 501 GLU OE1 1 1 11 6911 1 1 4 GLU OE2 O -13.714 4.151 1.428 1.00 . A A . 501 GLU OE2 1 1 11 6912 1 1 5 GLN C C -9.269 3.083 -1.961 1.00 . A A . 502 GLN C 1 1 11 6913 1 1 5 GLN CA C -9.335 4.476 -1.349 1.00 . A A . 502 GLN CA 1 1 11 6914 1 1 5 GLN CB C -8.482 4.562 -0.070 1.00 . A A . 502 GLN CB 1 1 11 6915 1 1 5 GLN CD C -10.147 3.799 1.696 1.00 . A A . 502 GLN CD 1 1 11 6916 1 1 5 GLN CG C -8.814 3.548 1.021 1.00 . A A . 502 GLN CG 1 1 11 6917 1 1 5 GLN H H -11.319 4.139 -0.718 1.00 . A A . 502 GLN H 1 1 11 6918 1 1 5 GLN HA H -8.954 5.185 -2.073 1.00 . A A . 502 GLN HA 1 1 11 6919 1 1 5 GLN HB2 H -7.450 4.421 -0.344 1.00 . A A . 502 GLN HB2 1 1 11 6920 1 1 5 GLN HB3 H -8.593 5.553 0.348 1.00 . A A . 502 GLN HB3 1 1 11 6921 1 1 5 GLN HE21 H -11.044 2.521 0.468 1.00 . A A . 502 GLN HE21 1 1 11 6922 1 1 5 GLN HE22 H -12.073 3.303 1.626 1.00 . A A . 502 GLN HE22 1 1 11 6923 1 1 5 GLN HG2 H -8.834 2.565 0.584 1.00 . A A . 502 GLN HG2 1 1 11 6924 1 1 5 GLN HG3 H -8.037 3.588 1.771 1.00 . A A . 502 GLN HG3 1 1 11 6925 1 1 5 GLN N N -10.724 4.818 -1.096 1.00 . A A . 502 GLN N 1 1 11 6926 1 1 5 GLN NE2 N -11.190 3.138 1.217 1.00 . A A . 502 GLN NE2 1 1 11 6927 1 1 5 GLN O O -10.110 2.232 -1.661 1.00 . A A . 502 GLN O 1 1 11 6928 1 1 5 GLN OE1 O -10.229 4.555 2.664 1.00 . A A . 502 GLN OE1 1 1 11 6929 1 1 6 SER C C -6.895 0.864 -3.294 1.00 . A A . 503 SER C 1 1 11 6930 1 1 6 SER CA C -8.208 1.603 -3.561 1.00 . A A . 503 SER CA 1 1 11 6931 1 1 6 SER CB C -8.375 1.877 -5.056 1.00 . A A . 503 SER CB 1 1 11 6932 1 1 6 SER H H -7.613 3.548 -2.983 1.00 . A A . 503 SER H 1 1 11 6933 1 1 6 SER HA H -9.024 0.978 -3.233 1.00 . A A . 503 SER HA 1 1 11 6934 1 1 6 SER HB2 H -8.063 1.009 -5.616 1.00 . A A . 503 SER HB2 1 1 11 6935 1 1 6 SER HB3 H -9.412 2.088 -5.268 1.00 . A A . 503 SER HB3 1 1 11 6936 1 1 6 SER HG H -7.934 3.321 -6.310 1.00 . A A . 503 SER HG 1 1 11 6937 1 1 6 SER N N -8.292 2.855 -2.826 1.00 . A A . 503 SER N 1 1 11 6938 1 1 6 SER O O -5.811 1.435 -3.398 1.00 . A A . 503 SER O 1 1 11 6939 1 1 6 SER OG O -7.592 2.988 -5.468 1.00 . A A . 503 SER OG 1 1 11 6940 1 1 7 CYS C C -5.130 -1.426 -4.071 1.00 . A A . 504 CYS C 1 1 11 6941 1 1 7 CYS CA C -5.847 -1.262 -2.742 1.00 . A A . 504 CYS CA 1 1 11 6942 1 1 7 CYS CB C -6.256 -2.643 -2.194 1.00 . A A . 504 CYS CB 1 1 11 6943 1 1 7 CYS H H -7.906 -0.793 -2.809 1.00 . A A . 504 CYS H 1 1 11 6944 1 1 7 CYS HA H -5.185 -0.780 -2.037 1.00 . A A . 504 CYS HA 1 1 11 6945 1 1 7 CYS HB2 H -6.816 -2.512 -1.280 1.00 . A A . 504 CYS HB2 1 1 11 6946 1 1 7 CYS HB3 H -6.875 -3.144 -2.924 1.00 . A A . 504 CYS HB3 1 1 11 6947 1 1 7 CYS N N -7.006 -0.413 -2.935 1.00 . A A . 504 CYS N 1 1 11 6948 1 1 7 CYS O O -5.753 -1.743 -5.088 1.00 . A A . 504 CYS O 1 1 11 6949 1 1 7 CYS SG S -4.831 -3.729 -1.832 1.00 . A A . 504 CYS SG 1 1 11 6950 1 1 8 VAL C C -3.091 -2.775 -5.768 1.00 . A A . 505 VAL C 1 1 11 6951 1 1 8 VAL CA C -2.998 -1.353 -5.248 1.00 . A A . 505 VAL CA 1 1 11 6952 1 1 8 VAL CB C -1.508 -1.056 -4.984 1.00 . A A . 505 VAL CB 1 1 11 6953 1 1 8 VAL CG1 C -0.949 -0.145 -6.060 1.00 . A A . 505 VAL CG1 1 1 11 6954 1 1 8 VAL CG2 C -1.290 -0.471 -3.600 1.00 . A A . 505 VAL CG2 1 1 11 6955 1 1 8 VAL H H -3.419 -0.832 -3.238 1.00 . A A . 505 VAL H 1 1 11 6956 1 1 8 VAL HA H -3.354 -0.673 -6.008 1.00 . A A . 505 VAL HA 1 1 11 6957 1 1 8 VAL HB H -0.972 -1.991 -5.037 1.00 . A A . 505 VAL HB 1 1 11 6958 1 1 8 VAL HG11 H -1.481 0.795 -6.049 1.00 . A A . 505 VAL HG11 1 1 11 6959 1 1 8 VAL HG12 H 0.100 0.032 -5.875 1.00 . A A . 505 VAL HG12 1 1 11 6960 1 1 8 VAL HG13 H -1.070 -0.617 -7.026 1.00 . A A . 505 VAL HG13 1 1 11 6961 1 1 8 VAL HG21 H -1.587 -1.198 -2.858 1.00 . A A . 505 VAL HG21 1 1 11 6962 1 1 8 VAL HG22 H -0.245 -0.231 -3.471 1.00 . A A . 505 VAL HG22 1 1 11 6963 1 1 8 VAL HG23 H -1.883 0.423 -3.488 1.00 . A A . 505 VAL HG23 1 1 11 6964 1 1 8 VAL N N -3.826 -1.182 -4.057 1.00 . A A . 505 VAL N 1 1 11 6965 1 1 8 VAL O O -2.804 -3.038 -6.935 1.00 . A A . 505 VAL O 1 1 11 6966 1 1 9 ASN C C -4.983 -5.508 -5.605 1.00 . A A . 506 ASN C 1 1 11 6967 1 1 9 ASN CA C -3.555 -5.089 -5.266 1.00 . A A . 506 ASN CA 1 1 11 6968 1 1 9 ASN CB C -3.034 -5.973 -4.136 1.00 . A A . 506 ASN CB 1 1 11 6969 1 1 9 ASN CG C -2.993 -7.441 -4.522 1.00 . A A . 506 ASN CG 1 1 11 6970 1 1 9 ASN H H -3.721 -3.418 -3.982 1.00 . A A . 506 ASN H 1 1 11 6971 1 1 9 ASN HA H -2.929 -5.222 -6.130 1.00 . A A . 506 ASN HA 1 1 11 6972 1 1 9 ASN HB2 H -2.035 -5.662 -3.875 1.00 . A A . 506 ASN HB2 1 1 11 6973 1 1 9 ASN HB3 H -3.677 -5.865 -3.274 1.00 . A A . 506 ASN HB3 1 1 11 6974 1 1 9 ASN HD21 H -3.865 -7.924 -2.809 1.00 . A A . 506 ASN HD21 1 1 11 6975 1 1 9 ASN HD22 H -3.487 -9.248 -3.862 1.00 . A A . 506 ASN HD22 1 1 11 6976 1 1 9 ASN N N -3.480 -3.691 -4.896 1.00 . A A . 506 ASN N 1 1 11 6977 1 1 9 ASN ND2 N -3.495 -8.290 -3.646 1.00 . A A . 506 ASN ND2 1 1 11 6978 1 1 9 ASN O O -5.197 -6.388 -6.440 1.00 . A A . 506 ASN O 1 1 11 6979 1 1 9 ASN OD1 O -2.537 -7.803 -5.605 1.00 . A A . 506 ASN OD1 1 1 11 6980 1 1 10 CYS C C -8.321 -4.357 -5.642 1.00 . A A . 507 CYS C 1 1 11 6981 1 1 10 CYS CA C -7.330 -5.349 -5.025 1.00 . A A . 507 CYS CA 1 1 11 6982 1 1 10 CYS CB C -7.777 -5.689 -3.609 1.00 . A A . 507 CYS CB 1 1 11 6983 1 1 10 CYS H H -5.759 -4.026 -4.509 1.00 . A A . 507 CYS H 1 1 11 6984 1 1 10 CYS HA H -7.331 -6.257 -5.608 1.00 . A A . 507 CYS HA 1 1 11 6985 1 1 10 CYS HB2 H -7.784 -4.789 -3.014 1.00 . A A . 507 CYS HB2 1 1 11 6986 1 1 10 CYS HB3 H -8.773 -6.105 -3.643 1.00 . A A . 507 CYS HB3 1 1 11 6987 1 1 10 CYS N N -5.961 -4.852 -4.991 1.00 . A A . 507 CYS N 1 1 11 6988 1 1 10 CYS O O -9.123 -4.727 -6.502 1.00 . A A . 507 CYS O 1 1 11 6989 1 1 10 CYS SG S -6.700 -6.894 -2.779 1.00 . A A . 507 CYS SG 1 1 11 6990 1 1 11 GLY C C -9.936 -1.437 -4.495 1.00 . A A . 508 GLY C 1 1 11 6991 1 1 11 GLY CA C -9.256 -2.135 -5.653 1.00 . A A . 508 GLY CA 1 1 11 6992 1 1 11 GLY H H -7.597 -2.848 -4.549 1.00 . A A . 508 GLY H 1 1 11 6993 1 1 11 GLY HA2 H -8.752 -1.398 -6.262 1.00 . A A . 508 GLY HA2 1 1 11 6994 1 1 11 GLY HA3 H -10.004 -2.634 -6.251 1.00 . A A . 508 GLY HA3 1 1 11 6995 1 1 11 GLY N N -8.287 -3.111 -5.193 1.00 . A A . 508 GLY N 1 1 11 6996 1 1 11 GLY O O -9.349 -1.313 -3.426 1.00 . A A . 508 GLY O 1 1 11 6997 1 1 12 ARG C C -11.972 -0.888 -2.307 1.00 . A A . 509 ARG C 1 1 11 6998 1 1 12 ARG CA C -11.922 -0.226 -3.694 1.00 . A A . 509 ARG CA 1 1 11 6999 1 1 12 ARG CB C -13.353 0.007 -4.188 1.00 . A A . 509 ARG CB 1 1 11 7000 1 1 12 ARG CD C -15.630 -0.975 -4.632 1.00 . A A . 509 ARG CD 1 1 11 7001 1 1 12 ARG CG C -14.269 -1.195 -3.998 1.00 . A A . 509 ARG CG 1 1 11 7002 1 1 12 ARG CZ C -16.470 -0.765 -6.946 1.00 . A A . 509 ARG CZ 1 1 11 7003 1 1 12 ARG H H -11.592 -1.142 -5.575 1.00 . A A . 509 ARG H 1 1 11 7004 1 1 12 ARG HA H -11.435 0.730 -3.601 1.00 . A A . 509 ARG HA 1 1 11 7005 1 1 12 ARG HB2 H -13.775 0.844 -3.649 1.00 . A A . 509 ARG HB2 1 1 11 7006 1 1 12 ARG HB3 H -13.324 0.247 -5.241 1.00 . A A . 509 ARG HB3 1 1 11 7007 1 1 12 ARG HD2 H -16.349 -1.609 -4.137 1.00 . A A . 509 ARG HD2 1 1 11 7008 1 1 12 ARG HD3 H -15.909 0.060 -4.497 1.00 . A A . 509 ARG HD3 1 1 11 7009 1 1 12 ARG HE H -14.960 -1.948 -6.373 1.00 . A A . 509 ARG HE 1 1 11 7010 1 1 12 ARG HG2 H -13.809 -2.058 -4.454 1.00 . A A . 509 ARG HG2 1 1 11 7011 1 1 12 ARG HG3 H -14.398 -1.372 -2.938 1.00 . A A . 509 ARG HG3 1 1 11 7012 1 1 12 ARG HH11 H -17.374 0.483 -5.626 1.00 . A A . 509 ARG HH11 1 1 11 7013 1 1 12 ARG HH12 H -17.996 0.540 -7.247 1.00 . A A . 509 ARG HH12 1 1 11 7014 1 1 12 ARG HH21 H -15.766 -1.867 -8.502 1.00 . A A . 509 ARG HH21 1 1 11 7015 1 1 12 ARG HH22 H -17.053 -0.764 -8.887 1.00 . A A . 509 ARG HH22 1 1 11 7016 1 1 12 ARG N N -11.179 -1.006 -4.695 1.00 . A A . 509 ARG N 1 1 11 7017 1 1 12 ARG NE N -15.624 -1.286 -6.060 1.00 . A A . 509 ARG NE 1 1 11 7018 1 1 12 ARG NH1 N -17.347 0.163 -6.575 1.00 . A A . 509 ARG NH1 1 1 11 7019 1 1 12 ARG NH2 N -16.430 -1.166 -8.209 1.00 . A A . 509 ARG NH2 1 1 11 7020 1 1 12 ARG O O -12.335 -0.246 -1.329 1.00 . A A . 509 ARG O 1 1 11 7021 1 1 13 GLU C C -10.646 -2.410 0.064 1.00 . A A . 510 GLU C 1 1 11 7022 1 1 13 GLU CA C -11.665 -2.906 -0.973 1.00 . A A . 510 GLU CA 1 1 11 7023 1 1 13 GLU CB C -11.457 -4.393 -1.279 1.00 . A A . 510 GLU CB 1 1 11 7024 1 1 13 GLU CD C -11.922 -6.746 -0.525 1.00 . A A . 510 GLU CD 1 1 11 7025 1 1 13 GLU CG C -11.696 -5.315 -0.097 1.00 . A A . 510 GLU CG 1 1 11 7026 1 1 13 GLU H H -11.208 -2.592 -3.007 1.00 . A A . 510 GLU H 1 1 11 7027 1 1 13 GLU HA H -12.655 -2.768 -0.573 1.00 . A A . 510 GLU HA 1 1 11 7028 1 1 13 GLU HB2 H -12.133 -4.681 -2.071 1.00 . A A . 510 GLU HB2 1 1 11 7029 1 1 13 GLU HB3 H -10.443 -4.537 -1.619 1.00 . A A . 510 GLU HB3 1 1 11 7030 1 1 13 GLU HG2 H -10.835 -5.280 0.552 1.00 . A A . 510 GLU HG2 1 1 11 7031 1 1 13 GLU HG3 H -12.567 -4.974 0.441 1.00 . A A . 510 GLU HG3 1 1 11 7032 1 1 13 GLU N N -11.582 -2.151 -2.218 1.00 . A A . 510 GLU N 1 1 11 7033 1 1 13 GLU O O -10.623 -2.886 1.202 1.00 . A A . 510 GLU O 1 1 11 7034 1 1 13 GLU OE1 O -10.944 -7.427 -0.891 1.00 . A A . 510 GLU OE1 1 1 11 7035 1 1 13 GLU OE2 O -13.091 -7.187 -0.520 1.00 . A A . 510 GLU OE2 1 1 11 7036 1 1 14 ALA C C -9.346 -0.403 1.868 1.00 . A A . 511 ALA C 1 1 11 7037 1 1 14 ALA CA C -8.788 -0.879 0.529 1.00 . A A . 511 ALA CA 1 1 11 7038 1 1 14 ALA CB C -8.097 0.276 -0.169 1.00 . A A . 511 ALA CB 1 1 11 7039 1 1 14 ALA H H -9.859 -1.160 -1.274 1.00 . A A . 511 ALA H 1 1 11 7040 1 1 14 ALA HA H -8.046 -1.639 0.716 1.00 . A A . 511 ALA HA 1 1 11 7041 1 1 14 ALA HB1 H -8.820 1.042 -0.396 1.00 . A A . 511 ALA HB1 1 1 11 7042 1 1 14 ALA HB2 H -7.330 0.682 0.478 1.00 . A A . 511 ALA HB2 1 1 11 7043 1 1 14 ALA HB3 H -7.646 -0.075 -1.084 1.00 . A A . 511 ALA HB3 1 1 11 7044 1 1 14 ALA N N -9.807 -1.462 -0.344 1.00 . A A . 511 ALA N 1 1 11 7045 1 1 14 ALA O O -10.502 0.010 1.975 1.00 . A A . 511 ALA O 1 1 11 7046 1 1 15 MET C C -7.652 0.419 5.034 1.00 . A A . 512 MET C 1 1 11 7047 1 1 15 MET CA C -8.866 -0.063 4.233 1.00 . A A . 512 MET CA 1 1 11 7048 1 1 15 MET CB C -9.521 -1.246 4.956 1.00 . A A . 512 MET CB 1 1 11 7049 1 1 15 MET CE C -11.896 -2.884 6.291 1.00 . A A . 512 MET CE 1 1 11 7050 1 1 15 MET CG C -9.941 -0.925 6.382 1.00 . A A . 512 MET CG 1 1 11 7051 1 1 15 MET H H -7.573 -0.724 2.696 1.00 . A A . 512 MET H 1 1 11 7052 1 1 15 MET HA H -9.580 0.743 4.164 1.00 . A A . 512 MET HA 1 1 11 7053 1 1 15 MET HB2 H -10.399 -1.547 4.405 1.00 . A A . 512 MET HB2 1 1 11 7054 1 1 15 MET HB3 H -8.823 -2.070 4.985 1.00 . A A . 512 MET HB3 1 1 11 7055 1 1 15 MET HE1 H -11.552 -3.134 5.298 1.00 . A A . 512 MET HE1 1 1 11 7056 1 1 15 MET HE2 H -12.363 -3.749 6.738 1.00 . A A . 512 MET HE2 1 1 11 7057 1 1 15 MET HE3 H -12.610 -2.076 6.233 1.00 . A A . 512 MET HE3 1 1 11 7058 1 1 15 MET HG2 H -9.096 -0.496 6.903 1.00 . A A . 512 MET HG2 1 1 11 7059 1 1 15 MET HG3 H -10.745 -0.205 6.351 1.00 . A A . 512 MET HG3 1 1 11 7060 1 1 15 MET N N -8.490 -0.442 2.877 1.00 . A A . 512 MET N 1 1 11 7061 1 1 15 MET O O -7.785 1.247 5.935 1.00 . A A . 512 MET O 1 1 11 7062 1 1 15 MET SD S -10.501 -2.375 7.293 1.00 . A A . 512 MET SD 1 1 11 7063 1 1 16 SER C C -4.198 0.850 4.634 1.00 . A A . 513 SER C 1 1 11 7064 1 1 16 SER CA C -5.280 0.188 5.485 1.00 . A A . 513 SER CA 1 1 11 7065 1 1 16 SER CB C -4.769 -1.111 6.115 1.00 . A A . 513 SER CB 1 1 11 7066 1 1 16 SER H H -6.376 -0.559 3.847 1.00 . A A . 513 SER H 1 1 11 7067 1 1 16 SER HA H -5.567 0.881 6.262 1.00 . A A . 513 SER HA 1 1 11 7068 1 1 16 SER HB2 H -5.582 -1.602 6.628 1.00 . A A . 513 SER HB2 1 1 11 7069 1 1 16 SER HB3 H -4.392 -1.758 5.337 1.00 . A A . 513 SER HB3 1 1 11 7070 1 1 16 SER HG H -3.407 -1.714 7.403 1.00 . A A . 513 SER HG 1 1 11 7071 1 1 16 SER N N -6.466 -0.073 4.688 1.00 . A A . 513 SER N 1 1 11 7072 1 1 16 SER O O -4.181 0.715 3.413 1.00 . A A . 513 SER O 1 1 11 7073 1 1 16 SER OG O -3.726 -0.864 7.046 1.00 . A A . 513 SER OG 1 1 11 7074 1 1 17 GLU C C -0.883 1.797 4.999 1.00 . A A . 514 GLU C 1 1 11 7075 1 1 17 GLU CA C -2.259 2.315 4.600 1.00 . A A . 514 GLU CA 1 1 11 7076 1 1 17 GLU CB C -2.365 3.799 4.949 1.00 . A A . 514 GLU CB 1 1 11 7077 1 1 17 GLU CD C -2.320 5.514 6.810 1.00 . A A . 514 GLU CD 1 1 11 7078 1 1 17 GLU CG C -2.440 4.051 6.444 1.00 . A A . 514 GLU CG 1 1 11 7079 1 1 17 GLU H H -3.348 1.606 6.266 1.00 . A A . 514 GLU H 1 1 11 7080 1 1 17 GLU HA H -2.394 2.191 3.537 1.00 . A A . 514 GLU HA 1 1 11 7081 1 1 17 GLU HB2 H -1.502 4.314 4.556 1.00 . A A . 514 GLU HB2 1 1 11 7082 1 1 17 GLU HB3 H -3.256 4.203 4.492 1.00 . A A . 514 GLU HB3 1 1 11 7083 1 1 17 GLU HG2 H -3.384 3.684 6.806 1.00 . A A . 514 GLU HG2 1 1 11 7084 1 1 17 GLU HG3 H -1.639 3.509 6.926 1.00 . A A . 514 GLU HG3 1 1 11 7085 1 1 17 GLU N N -3.309 1.576 5.285 1.00 . A A . 514 GLU N 1 1 11 7086 1 1 17 GLU O O -0.737 1.095 6.002 1.00 . A A . 514 GLU O 1 1 11 7087 1 1 17 GLU OE1 O -2.572 6.382 5.943 1.00 . A A . 514 GLU OE1 1 1 11 7088 1 1 17 GLU OE2 O -1.956 5.805 7.967 1.00 . A A . 514 GLU OE2 1 1 11 7089 1 1 18 CYS C C 2.015 2.790 5.575 1.00 . A A . 515 CYS C 1 1 11 7090 1 1 18 CYS CA C 1.496 1.832 4.517 1.00 . A A . 515 CYS CA 1 1 11 7091 1 1 18 CYS CB C 2.382 1.925 3.262 1.00 . A A . 515 CYS CB 1 1 11 7092 1 1 18 CYS H H -0.083 2.660 3.395 1.00 . A A . 515 CYS H 1 1 11 7093 1 1 18 CYS HA H 1.556 0.838 4.951 1.00 . A A . 515 CYS HA 1 1 11 7094 1 1 18 CYS HB2 H 2.316 0.996 2.715 1.00 . A A . 515 CYS HB2 1 1 11 7095 1 1 18 CYS HB3 H 2.023 2.730 2.637 1.00 . A A . 515 CYS HB3 1 1 11 7096 1 1 18 CYS N N 0.113 2.148 4.205 1.00 . A A . 515 CYS N 1 1 11 7097 1 1 18 CYS O O 1.928 4.011 5.431 1.00 . A A . 515 CYS O 1 1 11 7098 1 1 18 CYS SG S 4.154 2.237 3.611 1.00 . A A . 515 CYS SG 1 1 11 7099 1 1 19 THR C C 4.680 3.175 7.072 1.00 . A A . 516 THR C 1 1 11 7100 1 1 19 THR CA C 3.276 2.989 7.627 1.00 . A A . 516 THR CA 1 1 11 7101 1 1 19 THR CB C 3.322 2.282 8.996 1.00 . A A . 516 THR CB 1 1 11 7102 1 1 19 THR CG2 C 4.070 3.120 10.025 1.00 . A A . 516 THR CG2 1 1 11 7103 1 1 19 THR H H 2.359 1.285 6.841 1.00 . A A . 516 THR H 1 1 11 7104 1 1 19 THR HA H 2.807 3.956 7.747 1.00 . A A . 516 THR HA 1 1 11 7105 1 1 19 THR HB H 3.828 1.333 8.882 1.00 . A A . 516 THR HB 1 1 11 7106 1 1 19 THR HG1 H 1.369 2.610 8.942 1.00 . A A . 516 THR HG1 1 1 11 7107 1 1 19 THR HG21 H 3.581 4.076 10.134 1.00 . A A . 516 THR HG21 1 1 11 7108 1 1 19 THR HG22 H 4.071 2.607 10.975 1.00 . A A . 516 THR HG22 1 1 11 7109 1 1 19 THR HG23 H 5.088 3.272 9.695 1.00 . A A . 516 THR HG23 1 1 11 7110 1 1 19 THR N N 2.510 2.229 6.672 1.00 . A A . 516 THR N 1 1 11 7111 1 1 19 THR O O 5.394 2.203 6.812 1.00 . A A . 516 THR O 1 1 11 7112 1 1 19 THR OG1 O 1.981 2.049 9.451 1.00 . A A . 516 THR OG1 1 1 11 7113 1 1 20 GLY C C 5.989 5.764 5.105 1.00 . A A . 517 GLY C 1 1 11 7114 1 1 20 GLY CA C 6.269 4.727 6.161 1.00 . A A . 517 GLY CA 1 1 11 7115 1 1 20 GLY H H 4.543 5.142 7.299 1.00 . A A . 517 GLY H 1 1 11 7116 1 1 20 GLY HA2 H 7.015 5.103 6.846 1.00 . A A . 517 GLY HA2 1 1 11 7117 1 1 20 GLY HA3 H 6.636 3.830 5.688 1.00 . A A . 517 GLY HA3 1 1 11 7118 1 1 20 GLY N N 5.066 4.419 6.895 1.00 . A A . 517 GLY N 1 1 11 7119 1 1 20 GLY O O 6.558 6.858 5.133 1.00 . A A . 517 GLY O 1 1 11 7120 1 1 21 CYS C C 3.138 6.393 3.095 1.00 . A A . 518 CYS C 1 1 11 7121 1 1 21 CYS CA C 4.652 6.437 3.221 1.00 . A A . 518 CYS CA 1 1 11 7122 1 1 21 CYS CB C 5.318 6.209 1.862 1.00 . A A . 518 CYS CB 1 1 11 7123 1 1 21 CYS H H 4.693 4.545 4.170 1.00 . A A . 518 CYS H 1 1 11 7124 1 1 21 CYS HA H 4.939 7.394 3.620 1.00 . A A . 518 CYS HA 1 1 11 7125 1 1 21 CYS HB2 H 5.231 7.110 1.273 1.00 . A A . 518 CYS HB2 1 1 11 7126 1 1 21 CYS HB3 H 6.363 5.986 2.016 1.00 . A A . 518 CYS HB3 1 1 11 7127 1 1 21 CYS N N 5.087 5.449 4.184 1.00 . A A . 518 CYS N 1 1 11 7128 1 1 21 CYS O O 2.533 5.331 3.163 1.00 . A A . 518 CYS O 1 1 11 7129 1 1 21 CYS SG S 4.595 4.844 0.891 1.00 . A A . 518 CYS SG 1 1 11 7130 1 1 22 HIS C C 0.677 7.984 1.384 1.00 . A A . 519 HIS C 1 1 11 7131 1 1 22 HIS CA C 1.077 7.599 2.794 1.00 . A A . 519 HIS CA 1 1 11 7132 1 1 22 HIS CB C 0.485 8.584 3.805 1.00 . A A . 519 HIS CB 1 1 11 7133 1 1 22 HIS CD2 C 1.875 8.500 5.992 1.00 . A A . 519 HIS CD2 1 1 11 7134 1 1 22 HIS CE1 C 0.462 7.394 7.237 1.00 . A A . 519 HIS CE1 1 1 11 7135 1 1 22 HIS CG C 0.787 8.235 5.231 1.00 . A A . 519 HIS CG 1 1 11 7136 1 1 22 HIS H H 3.051 8.367 2.837 1.00 . A A . 519 HIS H 1 1 11 7137 1 1 22 HIS HA H 0.694 6.611 3.002 1.00 . A A . 519 HIS HA 1 1 11 7138 1 1 22 HIS HB2 H 0.882 9.570 3.613 1.00 . A A . 519 HIS HB2 1 1 11 7139 1 1 22 HIS HB3 H -0.589 8.607 3.688 1.00 . A A . 519 HIS HB3 1 1 11 7140 1 1 22 HIS HD1 H -0.970 7.188 5.782 1.00 . A A . 519 HIS HD1 1 1 11 7141 1 1 22 HIS HD2 H 2.764 9.029 5.675 1.00 . A A . 519 HIS HD2 1 1 11 7142 1 1 22 HIS HE1 H 0.011 6.887 8.076 1.00 . A A . 519 HIS HE1 1 1 11 7143 1 1 22 HIS HE2 H 2.144 8.216 8.051 1.00 . A A . 519 HIS HE2 1 1 11 7144 1 1 22 HIS N N 2.524 7.543 2.904 1.00 . A A . 519 HIS N 1 1 11 7145 1 1 22 HIS ND1 N -0.080 7.539 6.043 1.00 . A A . 519 HIS ND1 1 1 11 7146 1 1 22 HIS NE2 N 1.649 7.970 7.235 1.00 . A A . 519 HIS NE2 1 1 11 7147 1 1 22 HIS O O -0.334 8.652 1.171 1.00 . A A . 519 HIS O 1 1 11 7148 1 1 23 LYS C C 0.278 6.782 -1.567 1.00 . A A . 520 LYS C 1 1 11 7149 1 1 23 LYS CA C 1.190 7.845 -0.975 1.00 . A A . 520 LYS CA 1 1 11 7150 1 1 23 LYS CB C 2.482 7.929 -1.796 1.00 . A A . 520 LYS CB 1 1 11 7151 1 1 23 LYS CD C 4.378 6.535 -2.711 1.00 . A A . 520 LYS CD 1 1 11 7152 1 1 23 LYS CE C 5.067 7.808 -3.184 1.00 . A A . 520 LYS CE 1 1 11 7153 1 1 23 LYS CG C 3.448 6.786 -1.532 1.00 . A A . 520 LYS CG 1 1 11 7154 1 1 23 LYS H H 2.298 7.071 0.641 1.00 . A A . 520 LYS H 1 1 11 7155 1 1 23 LYS HA H 0.686 8.798 -1.022 1.00 . A A . 520 LYS HA 1 1 11 7156 1 1 23 LYS HB2 H 2.228 7.920 -2.845 1.00 . A A . 520 LYS HB2 1 1 11 7157 1 1 23 LYS HB3 H 2.983 8.857 -1.564 1.00 . A A . 520 LYS HB3 1 1 11 7158 1 1 23 LYS HD2 H 5.134 5.822 -2.414 1.00 . A A . 520 LYS HD2 1 1 11 7159 1 1 23 LYS HD3 H 3.801 6.126 -3.527 1.00 . A A . 520 LYS HD3 1 1 11 7160 1 1 23 LYS HE2 H 4.312 8.526 -3.469 1.00 . A A . 520 LYS HE2 1 1 11 7161 1 1 23 LYS HE3 H 5.656 8.206 -2.373 1.00 . A A . 520 LYS HE3 1 1 11 7162 1 1 23 LYS HG2 H 4.043 7.029 -0.664 1.00 . A A . 520 LYS HG2 1 1 11 7163 1 1 23 LYS HG3 H 2.878 5.887 -1.337 1.00 . A A . 520 LYS HG3 1 1 11 7164 1 1 23 LYS HZ1 H 5.503 6.873 -5.003 1.00 . A A . 520 LYS HZ1 1 1 11 7165 1 1 23 LYS HZ2 H 6.136 8.440 -4.864 1.00 . A A . 520 LYS HZ2 1 1 11 7166 1 1 23 LYS HZ3 H 6.868 7.158 -4.031 1.00 . A A . 520 LYS HZ3 1 1 11 7167 1 1 23 LYS N N 1.479 7.565 0.419 1.00 . A A . 520 LYS N 1 1 11 7168 1 1 23 LYS NZ N 5.954 7.552 -4.349 1.00 . A A . 520 LYS NZ 1 1 11 7169 1 1 23 LYS O O -0.493 7.061 -2.486 1.00 . A A . 520 LYS O 1 1 11 7170 1 1 24 VAL C C -1.280 3.846 -0.451 1.00 . A A . 521 VAL C 1 1 11 7171 1 1 24 VAL CA C -0.451 4.464 -1.570 1.00 . A A . 521 VAL CA 1 1 11 7172 1 1 24 VAL CB C 0.421 3.365 -2.216 1.00 . A A . 521 VAL CB 1 1 11 7173 1 1 24 VAL CG1 C 1.193 3.913 -3.407 1.00 . A A . 521 VAL CG1 1 1 11 7174 1 1 24 VAL CG2 C 1.374 2.759 -1.195 1.00 . A A . 521 VAL CG2 1 1 11 7175 1 1 24 VAL H H 0.920 5.385 -0.267 1.00 . A A . 521 VAL H 1 1 11 7176 1 1 24 VAL HA H -1.116 4.862 -2.322 1.00 . A A . 521 VAL HA 1 1 11 7177 1 1 24 VAL HB H -0.233 2.579 -2.572 1.00 . A A . 521 VAL HB 1 1 11 7178 1 1 24 VAL HG11 H 1.853 4.703 -3.076 1.00 . A A . 521 VAL HG11 1 1 11 7179 1 1 24 VAL HG12 H 1.775 3.121 -3.854 1.00 . A A . 521 VAL HG12 1 1 11 7180 1 1 24 VAL HG13 H 0.500 4.307 -4.136 1.00 . A A . 521 VAL HG13 1 1 11 7181 1 1 24 VAL HG21 H 0.806 2.315 -0.390 1.00 . A A . 521 VAL HG21 1 1 11 7182 1 1 24 VAL HG22 H 1.977 2.001 -1.670 1.00 . A A . 521 VAL HG22 1 1 11 7183 1 1 24 VAL HG23 H 2.017 3.531 -0.799 1.00 . A A . 521 VAL HG23 1 1 11 7184 1 1 24 VAL N N 0.351 5.559 -1.050 1.00 . A A . 521 VAL N 1 1 11 7185 1 1 24 VAL O O -0.943 3.980 0.728 1.00 . A A . 521 VAL O 1 1 11 7186 1 1 25 ASN C C -3.433 1.064 -0.214 1.00 . A A . 522 ASN C 1 1 11 7187 1 1 25 ASN CA C -3.217 2.520 0.154 1.00 . A A . 522 ASN CA 1 1 11 7188 1 1 25 ASN CB C -4.574 3.227 0.288 1.00 . A A . 522 ASN CB 1 1 11 7189 1 1 25 ASN CG C -4.873 4.181 -0.849 1.00 . A A . 522 ASN CG 1 1 11 7190 1 1 25 ASN H H -2.575 3.100 -1.772 1.00 . A A . 522 ASN H 1 1 11 7191 1 1 25 ASN HA H -2.714 2.553 1.108 1.00 . A A . 522 ASN HA 1 1 11 7192 1 1 25 ASN HB2 H -5.354 2.483 0.315 1.00 . A A . 522 ASN HB2 1 1 11 7193 1 1 25 ASN HB3 H -4.589 3.786 1.213 1.00 . A A . 522 ASN HB3 1 1 11 7194 1 1 25 ASN HD21 H -5.411 2.663 -2.021 1.00 . A A . 522 ASN HD21 1 1 11 7195 1 1 25 ASN HD22 H -5.521 4.252 -2.724 1.00 . A A . 522 ASN HD22 1 1 11 7196 1 1 25 ASN N N -2.359 3.176 -0.820 1.00 . A A . 522 ASN N 1 1 11 7197 1 1 25 ASN ND2 N -5.310 3.647 -1.975 1.00 . A A . 522 ASN ND2 1 1 11 7198 1 1 25 ASN O O -3.390 0.686 -1.386 1.00 . A A . 522 ASN O 1 1 11 7199 1 1 25 ASN OD1 O -4.687 5.392 -0.721 1.00 . A A . 522 ASN OD1 1 1 11 7200 1 1 26 TYR C C -5.206 -1.544 1.292 1.00 . A A . 523 TYR C 1 1 11 7201 1 1 26 TYR CA C -3.885 -1.164 0.642 1.00 . A A . 523 TYR CA 1 1 11 7202 1 1 26 TYR CB C -2.751 -1.972 1.286 1.00 . A A . 523 TYR CB 1 1 11 7203 1 1 26 TYR CD1 C -0.890 -2.441 -0.352 1.00 . A A . 523 TYR CD1 1 1 11 7204 1 1 26 TYR CD2 C -0.553 -0.726 1.264 1.00 . A A . 523 TYR CD2 1 1 11 7205 1 1 26 TYR CE1 C 0.372 -2.211 -0.865 1.00 . A A . 523 TYR CE1 1 1 11 7206 1 1 26 TYR CE2 C 0.711 -0.493 0.757 1.00 . A A . 523 TYR CE2 1 1 11 7207 1 1 26 TYR CG C -1.375 -1.704 0.717 1.00 . A A . 523 TYR CG 1 1 11 7208 1 1 26 TYR CZ C 1.168 -1.236 -0.307 1.00 . A A . 523 TYR CZ 1 1 11 7209 1 1 26 TYR H H -3.761 0.660 1.699 1.00 . A A . 523 TYR H 1 1 11 7210 1 1 26 TYR HA H -3.934 -1.374 -0.417 1.00 . A A . 523 TYR HA 1 1 11 7211 1 1 26 TYR HB2 H -2.718 -1.747 2.341 1.00 . A A . 523 TYR HB2 1 1 11 7212 1 1 26 TYR HB3 H -2.961 -3.024 1.159 1.00 . A A . 523 TYR HB3 1 1 11 7213 1 1 26 TYR HD1 H -0.914 -0.147 2.101 1.00 . A A . 523 TYR HD1 1 1 11 7214 1 1 26 TYR HD2 H -1.517 -3.205 -0.786 1.00 . A A . 523 TYR HD2 1 1 11 7215 1 1 26 TYR HE1 H 1.337 0.271 1.197 1.00 . A A . 523 TYR HE1 1 1 11 7216 1 1 26 TYR HE2 H 0.729 -2.795 -1.700 1.00 . A A . 523 TYR HE2 1 1 11 7217 1 1 26 TYR HH H 2.472 -1.273 -1.740 1.00 . A A . 523 TYR HH 1 1 11 7218 1 1 26 TYR N N -3.672 0.261 0.806 1.00 . A A . 523 TYR N 1 1 11 7219 1 1 26 TYR O O -5.943 -0.677 1.760 1.00 . A A . 523 TYR O 1 1 11 7220 1 1 26 TYR OH O 2.431 -1.009 -0.804 1.00 . A A . 523 TYR OH 1 1 11 7221 1 1 27 CYS C C -6.409 -3.932 3.320 1.00 . A A . 524 CYS C 1 1 11 7222 1 1 27 CYS CA C -6.725 -3.272 1.984 1.00 . A A . 524 CYS CA 1 1 11 7223 1 1 27 CYS CB C -7.464 -4.239 1.056 1.00 . A A . 524 CYS CB 1 1 11 7224 1 1 27 CYS H H -4.840 -3.490 1.069 1.00 . A A . 524 CYS H 1 1 11 7225 1 1 27 CYS HA H -7.342 -2.404 2.159 1.00 . A A . 524 CYS HA 1 1 11 7226 1 1 27 CYS HB2 H -8.440 -4.445 1.468 1.00 . A A . 524 CYS HB2 1 1 11 7227 1 1 27 CYS HB3 H -7.581 -3.775 0.086 1.00 . A A . 524 CYS HB3 1 1 11 7228 1 1 27 CYS N N -5.491 -2.827 1.371 1.00 . A A . 524 CYS N 1 1 11 7229 1 1 27 CYS O O -7.126 -3.756 4.306 1.00 . A A . 524 CYS O 1 1 11 7230 1 1 27 CYS SG S -6.616 -5.829 0.811 1.00 . A A . 524 CYS SG 1 1 11 7231 1 1 28 SER C C -3.351 -5.404 4.634 1.00 . A A . 525 SER C 1 1 11 7232 1 1 28 SER CA C -4.873 -5.391 4.512 1.00 . A A . 525 SER CA 1 1 11 7233 1 1 28 SER CB C -5.398 -6.820 4.431 1.00 . A A . 525 SER CB 1 1 11 7234 1 1 28 SER H H -4.749 -4.694 2.532 1.00 . A A . 525 SER H 1 1 11 7235 1 1 28 SER HA H -5.294 -4.908 5.382 1.00 . A A . 525 SER HA 1 1 11 7236 1 1 28 SER HB2 H -4.859 -7.437 5.134 1.00 . A A . 525 SER HB2 1 1 11 7237 1 1 28 SER HB3 H -6.451 -6.831 4.669 1.00 . A A . 525 SER HB3 1 1 11 7238 1 1 28 SER HG H -5.719 -6.819 2.489 1.00 . A A . 525 SER HG 1 1 11 7239 1 1 28 SER N N -5.297 -4.654 3.339 1.00 . A A . 525 SER N 1 1 11 7240 1 1 28 SER O O -2.647 -4.982 3.713 1.00 . A A . 525 SER O 1 1 11 7241 1 1 28 SER OG O -5.216 -7.354 3.128 1.00 . A A . 525 SER OG 1 1 11 7242 1 1 29 THR C C -0.809 -7.002 4.937 1.00 . A A . 526 THR C 1 1 11 7243 1 1 29 THR CA C -1.414 -6.043 5.964 1.00 . A A . 526 THR CA 1 1 11 7244 1 1 29 THR CB C -1.116 -6.562 7.384 1.00 . A A . 526 THR CB 1 1 11 7245 1 1 29 THR CG2 C 0.367 -6.449 7.706 1.00 . A A . 526 THR CG2 1 1 11 7246 1 1 29 THR H H -3.460 -6.172 6.479 1.00 . A A . 526 THR H 1 1 11 7247 1 1 29 THR HA H -0.960 -5.071 5.853 1.00 . A A . 526 THR HA 1 1 11 7248 1 1 29 THR HB H -1.405 -7.603 7.439 1.00 . A A . 526 THR HB 1 1 11 7249 1 1 29 THR HG1 H -1.348 -5.676 9.141 1.00 . A A . 526 THR HG1 1 1 11 7250 1 1 29 THR HG21 H 0.662 -5.410 7.680 1.00 . A A . 526 THR HG21 1 1 11 7251 1 1 29 THR HG22 H 0.556 -6.854 8.689 1.00 . A A . 526 THR HG22 1 1 11 7252 1 1 29 THR HG23 H 0.936 -7.001 6.973 1.00 . A A . 526 THR HG23 1 1 11 7253 1 1 29 THR N N -2.850 -5.904 5.758 1.00 . A A . 526 THR N 1 1 11 7254 1 1 29 THR O O 0.347 -6.851 4.532 1.00 . A A . 526 THR O 1 1 11 7255 1 1 29 THR OG1 O -1.880 -5.815 8.343 1.00 . A A . 526 THR OG1 1 1 11 7256 1 1 30 PHE C C -0.692 -8.326 2.245 1.00 . A A . 527 PHE C 1 1 11 7257 1 1 30 PHE CA C -1.156 -8.970 3.546 1.00 . A A . 527 PHE CA 1 1 11 7258 1 1 30 PHE CB C -2.284 -9.970 3.268 1.00 . A A . 527 PHE CB 1 1 11 7259 1 1 30 PHE CD1 C -1.067 -11.792 2.032 1.00 . A A . 527 PHE CD1 1 1 11 7260 1 1 30 PHE CD2 C -2.836 -10.644 0.918 1.00 . A A . 527 PHE CD2 1 1 11 7261 1 1 30 PHE CE1 C -0.858 -12.567 0.906 1.00 . A A . 527 PHE CE1 1 1 11 7262 1 1 30 PHE CE2 C -2.631 -11.413 -0.211 1.00 . A A . 527 PHE CE2 1 1 11 7263 1 1 30 PHE CG C -2.059 -10.824 2.051 1.00 . A A . 527 PHE CG 1 1 11 7264 1 1 30 PHE CZ C -1.642 -12.377 -0.217 1.00 . A A . 527 PHE CZ 1 1 11 7265 1 1 30 PHE H H -2.528 -8.012 4.831 1.00 . A A . 527 PHE H 1 1 11 7266 1 1 30 PHE HA H -0.324 -9.495 3.989 1.00 . A A . 527 PHE HA 1 1 11 7267 1 1 30 PHE HB2 H -2.386 -10.627 4.116 1.00 . A A . 527 PHE HB2 1 1 11 7268 1 1 30 PHE HB3 H -3.208 -9.426 3.125 1.00 . A A . 527 PHE HB3 1 1 11 7269 1 1 30 PHE HD1 H -3.613 -9.893 0.924 1.00 . A A . 527 PHE HD1 1 1 11 7270 1 1 30 PHE HD2 H -0.454 -11.940 2.907 1.00 . A A . 527 PHE HD2 1 1 11 7271 1 1 30 PHE HE1 H -3.244 -11.262 -1.088 1.00 . A A . 527 PHE HE1 1 1 11 7272 1 1 30 PHE HE2 H -0.084 -13.322 0.903 1.00 . A A . 527 PHE HE2 1 1 11 7273 1 1 30 PHE HZ H -1.479 -12.980 -1.099 1.00 . A A . 527 PHE HZ 1 1 11 7274 1 1 30 PHE N N -1.611 -7.966 4.495 1.00 . A A . 527 PHE N 1 1 11 7275 1 1 30 PHE O O 0.406 -8.608 1.766 1.00 . A A . 527 PHE O 1 1 11 7276 1 1 31 CYS C C 0.067 -5.866 0.676 1.00 . A A . 528 CYS C 1 1 11 7277 1 1 31 CYS CA C -1.133 -6.768 0.457 1.00 . A A . 528 CYS CA 1 1 11 7278 1 1 31 CYS CB C -2.299 -5.996 -0.128 1.00 . A A . 528 CYS CB 1 1 11 7279 1 1 31 CYS H H -2.357 -7.223 2.120 1.00 . A A . 528 CYS H 1 1 11 7280 1 1 31 CYS HA H -0.846 -7.546 -0.237 1.00 . A A . 528 CYS HA 1 1 11 7281 1 1 31 CYS HB2 H -2.761 -5.405 0.649 1.00 . A A . 528 CYS HB2 1 1 11 7282 1 1 31 CYS HB3 H -1.938 -5.341 -0.908 1.00 . A A . 528 CYS HB3 1 1 11 7283 1 1 31 CYS N N -1.505 -7.440 1.687 1.00 . A A . 528 CYS N 1 1 11 7284 1 1 31 CYS O O 0.911 -5.746 -0.205 1.00 . A A . 528 CYS O 1 1 11 7285 1 1 31 CYS SG S -3.574 -7.067 -0.848 1.00 . A A . 528 CYS SG 1 1 11 7286 1 1 32 GLN C C 2.574 -5.172 2.134 1.00 . A A . 529 GLN C 1 1 11 7287 1 1 32 GLN CA C 1.268 -4.383 2.187 1.00 . A A . 529 GLN CA 1 1 11 7288 1 1 32 GLN CB C 1.084 -3.775 3.590 1.00 . A A . 529 GLN CB 1 1 11 7289 1 1 32 GLN CD C 2.741 -1.894 3.755 1.00 . A A . 529 GLN CD 1 1 11 7290 1 1 32 GLN CG C 2.382 -3.286 4.212 1.00 . A A . 529 GLN CG 1 1 11 7291 1 1 32 GLN H H -0.543 -5.427 2.536 1.00 . A A . 529 GLN H 1 1 11 7292 1 1 32 GLN HA H 1.303 -3.589 1.456 1.00 . A A . 529 GLN HA 1 1 11 7293 1 1 32 GLN HB2 H 0.417 -2.920 3.519 1.00 . A A . 529 GLN HB2 1 1 11 7294 1 1 32 GLN HB3 H 0.644 -4.514 4.240 1.00 . A A . 529 GLN HB3 1 1 11 7295 1 1 32 GLN HE21 H 4.669 -2.358 3.718 1.00 . A A . 529 GLN HE21 1 1 11 7296 1 1 32 GLN HE22 H 4.276 -0.735 3.276 1.00 . A A . 529 GLN HE22 1 1 11 7297 1 1 32 GLN HG2 H 2.274 -3.281 5.287 1.00 . A A . 529 GLN HG2 1 1 11 7298 1 1 32 GLN HG3 H 3.179 -3.959 3.933 1.00 . A A . 529 GLN HG3 1 1 11 7299 1 1 32 GLN N N 0.147 -5.256 1.857 1.00 . A A . 529 GLN N 1 1 11 7300 1 1 32 GLN NE2 N 4.024 -1.639 3.562 1.00 . A A . 529 GLN NE2 1 1 11 7301 1 1 32 GLN O O 3.547 -4.752 1.510 1.00 . A A . 529 GLN O 1 1 11 7302 1 1 32 GLN OE1 O 1.862 -1.070 3.540 1.00 . A A . 529 GLN OE1 1 1 11 7303 1 1 33 ARG C C 4.059 -7.826 1.519 1.00 . A A . 530 ARG C 1 1 11 7304 1 1 33 ARG CA C 3.779 -7.151 2.861 1.00 . A A . 530 ARG CA 1 1 11 7305 1 1 33 ARG CB C 3.655 -8.185 3.980 1.00 . A A . 530 ARG CB 1 1 11 7306 1 1 33 ARG CD C 4.603 -6.595 5.675 1.00 . A A . 530 ARG CD 1 1 11 7307 1 1 33 ARG CG C 3.474 -7.561 5.354 1.00 . A A . 530 ARG CG 1 1 11 7308 1 1 33 ARG CZ C 4.728 -4.534 7.023 1.00 . A A . 530 ARG CZ 1 1 11 7309 1 1 33 ARG H H 1.758 -6.627 3.231 1.00 . A A . 530 ARG H 1 1 11 7310 1 1 33 ARG HA H 4.598 -6.481 3.080 1.00 . A A . 530 ARG HA 1 1 11 7311 1 1 33 ARG HB2 H 2.799 -8.812 3.776 1.00 . A A . 530 ARG HB2 1 1 11 7312 1 1 33 ARG HB3 H 4.545 -8.795 3.996 1.00 . A A . 530 ARG HB3 1 1 11 7313 1 1 33 ARG HD2 H 5.507 -7.162 5.845 1.00 . A A . 530 ARG HD2 1 1 11 7314 1 1 33 ARG HD3 H 4.746 -5.936 4.830 1.00 . A A . 530 ARG HD3 1 1 11 7315 1 1 33 ARG HE H 3.773 -6.209 7.574 1.00 . A A . 530 ARG HE 1 1 11 7316 1 1 33 ARG HG2 H 2.539 -7.023 5.374 1.00 . A A . 530 ARG HG2 1 1 11 7317 1 1 33 ARG HG3 H 3.458 -8.346 6.098 1.00 . A A . 530 ARG HG3 1 1 11 7318 1 1 33 ARG HH11 H 5.779 -4.468 5.291 1.00 . A A . 530 ARG HH11 1 1 11 7319 1 1 33 ARG HH12 H 5.794 -2.994 6.218 1.00 . A A . 530 ARG HH12 1 1 11 7320 1 1 33 ARG HH21 H 3.811 -4.312 8.814 1.00 . A A . 530 ARG HH21 1 1 11 7321 1 1 33 ARG HH22 H 4.686 -2.914 8.250 1.00 . A A . 530 ARG HH22 1 1 11 7322 1 1 33 ARG N N 2.583 -6.324 2.792 1.00 . A A . 530 ARG N 1 1 11 7323 1 1 33 ARG NE N 4.318 -5.792 6.860 1.00 . A A . 530 ARG NE 1 1 11 7324 1 1 33 ARG NH1 N 5.497 -3.957 6.104 1.00 . A A . 530 ARG NH1 1 1 11 7325 1 1 33 ARG NH2 N 4.381 -3.867 8.114 1.00 . A A . 530 ARG NH2 1 1 11 7326 1 1 33 ARG O O 5.209 -8.058 1.156 1.00 . A A . 530 ARG O 1 1 11 7327 1 1 34 LYS C C 3.695 -7.760 -1.526 1.00 . A A . 531 LYS C 1 1 11 7328 1 1 34 LYS CA C 3.128 -8.762 -0.523 1.00 . A A . 531 LYS CA 1 1 11 7329 1 1 34 LYS CB C 1.761 -9.285 -0.989 1.00 . A A . 531 LYS CB 1 1 11 7330 1 1 34 LYS CD C 1.728 -9.335 -3.532 1.00 . A A . 531 LYS CD 1 1 11 7331 1 1 34 LYS CE C 0.346 -8.726 -3.748 1.00 . A A . 531 LYS CE 1 1 11 7332 1 1 34 LYS CG C 1.802 -10.152 -2.244 1.00 . A A . 531 LYS CG 1 1 11 7333 1 1 34 LYS H H 2.103 -7.978 1.161 1.00 . A A . 531 LYS H 1 1 11 7334 1 1 34 LYS HA H 3.812 -9.592 -0.434 1.00 . A A . 531 LYS HA 1 1 11 7335 1 1 34 LYS HB2 H 1.326 -9.871 -0.192 1.00 . A A . 531 LYS HB2 1 1 11 7336 1 1 34 LYS HB3 H 1.121 -8.438 -1.186 1.00 . A A . 531 LYS HB3 1 1 11 7337 1 1 34 LYS HD2 H 2.452 -8.535 -3.479 1.00 . A A . 531 LYS HD2 1 1 11 7338 1 1 34 LYS HD3 H 1.962 -9.979 -4.368 1.00 . A A . 531 LYS HD3 1 1 11 7339 1 1 34 LYS HE2 H 0.234 -8.488 -4.794 1.00 . A A . 531 LYS HE2 1 1 11 7340 1 1 34 LYS HE3 H -0.398 -9.457 -3.470 1.00 . A A . 531 LYS HE3 1 1 11 7341 1 1 34 LYS HG2 H 2.724 -10.714 -2.248 1.00 . A A . 531 LYS HG2 1 1 11 7342 1 1 34 LYS HG3 H 0.966 -10.837 -2.217 1.00 . A A . 531 LYS HG3 1 1 11 7343 1 1 34 LYS HZ1 H 0.481 -7.614 -1.980 1.00 . A A . 531 LYS HZ1 1 1 11 7344 1 1 34 LYS HZ2 H 0.628 -6.686 -3.391 1.00 . A A . 531 LYS HZ2 1 1 11 7345 1 1 34 LYS HZ3 H -0.887 -7.264 -2.910 1.00 . A A . 531 LYS HZ3 1 1 11 7346 1 1 34 LYS N N 2.999 -8.144 0.792 1.00 . A A . 531 LYS N 1 1 11 7347 1 1 34 LYS NZ N 0.126 -7.489 -2.948 1.00 . A A . 531 LYS NZ 1 1 11 7348 1 1 34 LYS O O 4.559 -8.097 -2.337 1.00 . A A . 531 LYS O 1 1 11 7349 1 1 35 ASP C C 5.053 -4.978 -1.952 1.00 . A A . 532 ASP C 1 1 11 7350 1 1 35 ASP CA C 3.658 -5.451 -2.340 1.00 . A A . 532 ASP CA 1 1 11 7351 1 1 35 ASP CB C 2.679 -4.280 -2.257 1.00 . A A . 532 ASP CB 1 1 11 7352 1 1 35 ASP CG C 2.830 -3.299 -3.400 1.00 . A A . 532 ASP CG 1 1 11 7353 1 1 35 ASP H H 2.515 -6.316 -0.788 1.00 . A A . 532 ASP H 1 1 11 7354 1 1 35 ASP HA H 3.672 -5.822 -3.355 1.00 . A A . 532 ASP HA 1 1 11 7355 1 1 35 ASP HB2 H 1.668 -4.663 -2.269 1.00 . A A . 532 ASP HB2 1 1 11 7356 1 1 35 ASP HB3 H 2.844 -3.749 -1.327 1.00 . A A . 532 ASP HB3 1 1 11 7357 1 1 35 ASP N N 3.213 -6.524 -1.452 1.00 . A A . 532 ASP N 1 1 11 7358 1 1 35 ASP O O 5.733 -4.315 -2.728 1.00 . A A . 532 ASP O 1 1 11 7359 1 1 35 ASP OD1 O 2.595 -3.704 -4.560 1.00 . A A . 532 ASP OD1 1 1 11 7360 1 1 35 ASP OD2 O 3.145 -2.117 -3.142 1.00 . A A . 532 ASP OD2 1 1 11 7361 1 1 36 TRP C C 7.937 -5.201 -1.074 1.00 . A A . 533 TRP C 1 1 11 7362 1 1 36 TRP CA C 6.732 -4.919 -0.177 1.00 . A A . 533 TRP CA 1 1 11 7363 1 1 36 TRP CB C 6.945 -5.560 1.196 1.00 . A A . 533 TRP CB 1 1 11 7364 1 1 36 TRP CD1 C 9.269 -5.626 2.268 1.00 . A A . 533 TRP CD1 1 1 11 7365 1 1 36 TRP CD2 C 8.244 -3.641 2.406 1.00 . A A . 533 TRP CD2 1 1 11 7366 1 1 36 TRP CE2 C 9.504 -3.540 3.022 1.00 . A A . 533 TRP CE2 1 1 11 7367 1 1 36 TRP CE3 C 7.416 -2.512 2.368 1.00 . A A . 533 TRP CE3 1 1 11 7368 1 1 36 TRP CG C 8.112 -4.985 1.933 1.00 . A A . 533 TRP CG 1 1 11 7369 1 1 36 TRP CH2 C 9.134 -1.267 3.543 1.00 . A A . 533 TRP CH2 1 1 11 7370 1 1 36 TRP CZ2 C 9.959 -2.356 3.594 1.00 . A A . 533 TRP CZ2 1 1 11 7371 1 1 36 TRP CZ3 C 7.871 -1.337 2.939 1.00 . A A . 533 TRP CZ3 1 1 11 7372 1 1 36 TRP H H 4.938 -6.034 -0.267 1.00 . A A . 533 TRP H 1 1 11 7373 1 1 36 TRP HA H 6.647 -3.851 -0.034 1.00 . A A . 533 TRP HA 1 1 11 7374 1 1 36 TRP HB2 H 6.060 -5.410 1.798 1.00 . A A . 533 TRP HB2 1 1 11 7375 1 1 36 TRP HB3 H 7.116 -6.618 1.069 1.00 . A A . 533 TRP HB3 1 1 11 7376 1 1 36 TRP HD1 H 9.476 -6.662 2.045 1.00 . A A . 533 TRP HD1 1 1 11 7377 1 1 36 TRP HE1 H 11.004 -4.992 3.277 1.00 . A A . 533 TRP HE1 1 1 11 7378 1 1 36 TRP HE3 H 6.438 -2.547 1.908 1.00 . A A . 533 TRP HE3 1 1 11 7379 1 1 36 TRP HH2 H 9.448 -0.329 3.976 1.00 . A A . 533 TRP HH2 1 1 11 7380 1 1 36 TRP HZ2 H 10.933 -2.286 4.056 1.00 . A A . 533 TRP HZ2 1 1 11 7381 1 1 36 TRP HZ3 H 7.249 -0.455 2.920 1.00 . A A . 533 TRP HZ3 1 1 11 7382 1 1 36 TRP N N 5.486 -5.394 -0.767 1.00 . A A . 533 TRP N 1 1 11 7383 1 1 36 TRP NE1 N 10.108 -4.765 2.927 1.00 . A A . 533 TRP NE1 1 1 11 7384 1 1 36 TRP O O 8.902 -4.455 -1.075 1.00 . A A . 533 TRP O 1 1 11 7385 1 1 37 LYS C C 9.263 -5.534 -3.736 1.00 . A A . 534 LYS C 1 1 11 7386 1 1 37 LYS CA C 8.965 -6.647 -2.736 1.00 . A A . 534 LYS CA 1 1 11 7387 1 1 37 LYS CB C 8.663 -7.958 -3.465 1.00 . A A . 534 LYS CB 1 1 11 7388 1 1 37 LYS CD C 8.235 -10.441 -3.292 1.00 . A A . 534 LYS CD 1 1 11 7389 1 1 37 LYS CE C 6.972 -10.371 -4.134 1.00 . A A . 534 LYS CE 1 1 11 7390 1 1 37 LYS CG C 8.475 -9.144 -2.530 1.00 . A A . 534 LYS CG 1 1 11 7391 1 1 37 LYS H H 7.078 -6.836 -1.791 1.00 . A A . 534 LYS H 1 1 11 7392 1 1 37 LYS HA H 9.870 -6.756 -2.160 1.00 . A A . 534 LYS HA 1 1 11 7393 1 1 37 LYS HB2 H 7.759 -7.833 -4.042 1.00 . A A . 534 LYS HB2 1 1 11 7394 1 1 37 LYS HB3 H 9.480 -8.180 -4.136 1.00 . A A . 534 LYS HB3 1 1 11 7395 1 1 37 LYS HD2 H 9.076 -10.628 -3.943 1.00 . A A . 534 LYS HD2 1 1 11 7396 1 1 37 LYS HD3 H 8.139 -11.250 -2.581 1.00 . A A . 534 LYS HD3 1 1 11 7397 1 1 37 LYS HE2 H 6.125 -10.231 -3.478 1.00 . A A . 534 LYS HE2 1 1 11 7398 1 1 37 LYS HE3 H 7.050 -9.527 -4.805 1.00 . A A . 534 LYS HE3 1 1 11 7399 1 1 37 LYS HG2 H 9.360 -9.255 -1.925 1.00 . A A . 534 LYS HG2 1 1 11 7400 1 1 37 LYS HG3 H 7.625 -8.952 -1.891 1.00 . A A . 534 LYS HG3 1 1 11 7401 1 1 37 LYS HZ1 H 6.705 -12.439 -4.302 1.00 . A A . 534 LYS HZ1 1 1 11 7402 1 1 37 LYS HZ2 H 5.886 -11.538 -5.484 1.00 . A A . 534 LYS HZ2 1 1 11 7403 1 1 37 LYS HZ3 H 7.564 -11.748 -5.589 1.00 . A A . 534 LYS HZ3 1 1 11 7404 1 1 37 LYS N N 7.873 -6.276 -1.836 1.00 . A A . 534 LYS N 1 1 11 7405 1 1 37 LYS NZ N 6.769 -11.608 -4.932 1.00 . A A . 534 LYS NZ 1 1 11 7406 1 1 37 LYS O O 10.430 -5.273 -4.029 1.00 . A A . 534 LYS O 1 1 11 7407 1 1 38 ASP C C 8.475 -2.453 -4.273 1.00 . A A . 535 ASP C 1 1 11 7408 1 1 38 ASP CA C 8.475 -3.710 -5.102 1.00 . A A . 535 ASP CA 1 1 11 7409 1 1 38 ASP CB C 7.400 -3.575 -6.172 1.00 . A A . 535 ASP CB 1 1 11 7410 1 1 38 ASP CG C 7.796 -2.597 -7.262 1.00 . A A . 535 ASP CG 1 1 11 7411 1 1 38 ASP H H 7.323 -5.139 -4.031 1.00 . A A . 535 ASP H 1 1 11 7412 1 1 38 ASP HA H 9.439 -3.836 -5.571 1.00 . A A . 535 ASP HA 1 1 11 7413 1 1 38 ASP HB2 H 7.220 -4.527 -6.609 1.00 . A A . 535 ASP HB2 1 1 11 7414 1 1 38 ASP HB3 H 6.489 -3.219 -5.711 1.00 . A A . 535 ASP HB3 1 1 11 7415 1 1 38 ASP N N 8.241 -4.864 -4.243 1.00 . A A . 535 ASP N 1 1 11 7416 1 1 38 ASP O O 9.243 -1.529 -4.488 1.00 . A A . 535 ASP O 1 1 11 7417 1 1 38 ASP OD1 O 8.827 -2.834 -7.934 1.00 . A A . 535 ASP OD1 1 1 11 7418 1 1 38 ASP OD2 O 7.079 -1.594 -7.462 1.00 . A A . 535 ASP OD2 1 1 11 7419 1 1 39 HIS C C 8.536 -0.852 -1.714 1.00 . A A . 536 HIS C 1 1 11 7420 1 1 39 HIS CA C 7.336 -1.253 -2.558 1.00 . A A . 536 HIS CA 1 1 11 7421 1 1 39 HIS CB C 6.103 -1.458 -1.674 1.00 . A A . 536 HIS CB 1 1 11 7422 1 1 39 HIS CD2 C 5.505 0.189 0.233 1.00 . A A . 536 HIS CD2 1 1 11 7423 1 1 39 HIS CE1 C 4.600 1.760 -0.954 1.00 . A A . 536 HIS CE1 1 1 11 7424 1 1 39 HIS CG C 5.572 -0.204 -1.068 1.00 . A A . 536 HIS CG 1 1 11 7425 1 1 39 HIS H H 7.096 -3.252 -3.116 1.00 . A A . 536 HIS H 1 1 11 7426 1 1 39 HIS HA H 7.133 -0.469 -3.279 1.00 . A A . 536 HIS HA 1 1 11 7427 1 1 39 HIS HB2 H 5.314 -1.892 -2.270 1.00 . A A . 536 HIS HB2 1 1 11 7428 1 1 39 HIS HB3 H 6.353 -2.138 -0.872 1.00 . A A . 536 HIS HB3 1 1 11 7429 1 1 39 HIS HD1 H 4.869 0.812 -2.779 1.00 . A A . 536 HIS HD1 1 1 11 7430 1 1 39 HIS HD2 H 5.865 -0.363 1.087 1.00 . A A . 536 HIS HD2 1 1 11 7431 1 1 39 HIS HE1 H 4.126 2.684 -1.246 1.00 . A A . 536 HIS HE1 1 1 11 7432 1 1 39 HIS N N 7.600 -2.441 -3.310 1.00 . A A . 536 HIS N 1 1 11 7433 1 1 39 HIS ND1 N 4.993 0.807 -1.806 1.00 . A A . 536 HIS ND1 1 1 11 7434 1 1 39 HIS NE2 N 4.883 1.426 0.284 1.00 . A A . 536 HIS NE2 1 1 11 7435 1 1 39 HIS O O 8.766 0.321 -1.509 1.00 . A A . 536 HIS O 1 1 11 7436 1 1 40 GLN C C 11.456 -0.603 -1.023 1.00 . A A . 537 GLN C 1 1 11 7437 1 1 40 GLN CA C 10.433 -1.520 -0.352 1.00 . A A . 537 GLN CA 1 1 11 7438 1 1 40 GLN CB C 11.115 -2.801 0.127 1.00 . A A . 537 GLN CB 1 1 11 7439 1 1 40 GLN CD C 12.337 -4.914 -0.511 1.00 . A A . 537 GLN CD 1 1 11 7440 1 1 40 GLN CG C 11.778 -3.591 -0.986 1.00 . A A . 537 GLN CG 1 1 11 7441 1 1 40 GLN H H 9.102 -2.767 -1.463 1.00 . A A . 537 GLN H 1 1 11 7442 1 1 40 GLN HA H 10.028 -0.995 0.500 1.00 . A A . 537 GLN HA 1 1 11 7443 1 1 40 GLN HB2 H 11.868 -2.544 0.854 1.00 . A A . 537 GLN HB2 1 1 11 7444 1 1 40 GLN HB3 H 10.376 -3.433 0.596 1.00 . A A . 537 GLN HB3 1 1 11 7445 1 1 40 GLN HE21 H 10.584 -5.794 -0.815 1.00 . A A . 537 GLN HE21 1 1 11 7446 1 1 40 GLN HE22 H 11.853 -6.820 -0.233 1.00 . A A . 537 GLN HE22 1 1 11 7447 1 1 40 GLN HG2 H 11.053 -3.778 -1.768 1.00 . A A . 537 GLN HG2 1 1 11 7448 1 1 40 GLN HG3 H 12.588 -3.001 -1.383 1.00 . A A . 537 GLN HG3 1 1 11 7449 1 1 40 GLN N N 9.306 -1.823 -1.236 1.00 . A A . 537 GLN N 1 1 11 7450 1 1 40 GLN NE2 N 11.507 -5.943 -0.515 1.00 . A A . 537 GLN NE2 1 1 11 7451 1 1 40 GLN O O 12.013 0.281 -0.374 1.00 . A A . 537 GLN O 1 1 11 7452 1 1 40 GLN OE1 O 13.503 -5.009 -0.132 1.00 . A A . 537 GLN OE1 1 1 11 7453 1 1 41 HIS C C 12.090 1.385 -3.371 1.00 . A A . 538 HIS C 1 1 11 7454 1 1 41 HIS CA C 12.686 0.035 -2.999 1.00 . A A . 538 HIS CA 1 1 11 7455 1 1 41 HIS CB C 13.296 -0.668 -4.234 1.00 . A A . 538 HIS CB 1 1 11 7456 1 1 41 HIS CD2 C 11.580 -1.718 -5.856 1.00 . A A . 538 HIS CD2 1 1 11 7457 1 1 41 HIS CE1 C 11.541 -0.106 -7.314 1.00 . A A . 538 HIS CE1 1 1 11 7458 1 1 41 HIS CG C 12.418 -0.737 -5.451 1.00 . A A . 538 HIS CG 1 1 11 7459 1 1 41 HIS H H 11.245 -1.512 -2.797 1.00 . A A . 538 HIS H 1 1 11 7460 1 1 41 HIS HA H 13.484 0.232 -2.299 1.00 . A A . 538 HIS HA 1 1 11 7461 1 1 41 HIS HB2 H 14.197 -0.147 -4.516 1.00 . A A . 538 HIS HB2 1 1 11 7462 1 1 41 HIS HB3 H 13.552 -1.679 -3.957 1.00 . A A . 538 HIS HB3 1 1 11 7463 1 1 41 HIS HD2 H 11.344 -2.624 -5.321 1.00 . A A . 538 HIS HD2 1 1 11 7464 1 1 41 HIS HE1 H 11.270 0.490 -8.173 1.00 . A A . 538 HIS HE1 1 1 11 7465 1 1 41 HIS HE2 H 10.222 -1.699 -7.458 1.00 . A A . 538 HIS HE2 1 1 11 7466 1 1 41 HIS N N 11.707 -0.796 -2.314 1.00 . A A . 538 HIS N 1 1 11 7467 1 1 41 HIS ND1 N 12.391 0.279 -6.377 1.00 . A A . 538 HIS ND1 1 1 11 7468 1 1 41 HIS NE2 N 11.029 -1.312 -7.042 1.00 . A A . 538 HIS NE2 1 1 11 7469 1 1 41 HIS O O 12.826 2.351 -3.571 1.00 . A A . 538 HIS O 1 1 11 7470 1 1 42 ILE C C 9.818 3.521 -2.500 1.00 . A A . 539 ILE C 1 1 11 7471 1 1 42 ILE CA C 10.121 2.734 -3.779 1.00 . A A . 539 ILE CA 1 1 11 7472 1 1 42 ILE CB C 8.837 2.512 -4.642 1.00 . A A . 539 ILE CB 1 1 11 7473 1 1 42 ILE CD1 C 6.803 3.476 -3.435 1.00 . A A . 539 ILE CD1 1 1 11 7474 1 1 42 ILE CG1 C 7.581 2.232 -3.808 1.00 . A A . 539 ILE CG1 1 1 11 7475 1 1 42 ILE CG2 C 9.064 1.376 -5.620 1.00 . A A . 539 ILE CG2 1 1 11 7476 1 1 42 ILE H H 10.211 0.663 -3.321 1.00 . A A . 539 ILE H 1 1 11 7477 1 1 42 ILE HA H 10.820 3.309 -4.369 1.00 . A A . 539 ILE HA 1 1 11 7478 1 1 42 ILE HB H 8.674 3.397 -5.221 1.00 . A A . 539 ILE HB 1 1 11 7479 1 1 42 ILE HD11 H 6.424 3.944 -4.330 1.00 . A A . 539 ILE HD11 1 1 11 7480 1 1 42 ILE HD12 H 5.980 3.205 -2.791 1.00 . A A . 539 ILE HD12 1 1 11 7481 1 1 42 ILE HD13 H 7.457 4.164 -2.917 1.00 . A A . 539 ILE HD13 1 1 11 7482 1 1 42 ILE HG12 H 6.926 1.596 -4.368 1.00 . A A . 539 ILE HG12 1 1 11 7483 1 1 42 ILE HG13 H 7.866 1.732 -2.896 1.00 . A A . 539 ILE HG13 1 1 11 7484 1 1 42 ILE HG21 H 9.353 0.486 -5.077 1.00 . A A . 539 ILE HG21 1 1 11 7485 1 1 42 ILE HG22 H 8.155 1.183 -6.170 1.00 . A A . 539 ILE HG22 1 1 11 7486 1 1 42 ILE HG23 H 9.851 1.646 -6.309 1.00 . A A . 539 ILE HG23 1 1 11 7487 1 1 42 ILE N N 10.763 1.467 -3.454 1.00 . A A . 539 ILE N 1 1 11 7488 1 1 42 ILE O O 10.046 4.732 -2.433 1.00 . A A . 539 ILE O 1 1 11 7489 1 1 43 CYS C C 10.099 4.172 0.353 1.00 . A A . 540 CYS C 1 1 11 7490 1 1 43 CYS CA C 8.917 3.412 -0.240 1.00 . A A . 540 CYS CA 1 1 11 7491 1 1 43 CYS CB C 8.489 2.301 0.724 1.00 . A A . 540 CYS CB 1 1 11 7492 1 1 43 CYS H H 9.084 1.861 -1.658 1.00 . A A . 540 CYS H 1 1 11 7493 1 1 43 CYS HA H 8.082 4.082 -0.372 1.00 . A A . 540 CYS HA 1 1 11 7494 1 1 43 CYS HB2 H 7.876 1.592 0.189 1.00 . A A . 540 CYS HB2 1 1 11 7495 1 1 43 CYS HB3 H 9.371 1.798 1.093 1.00 . A A . 540 CYS HB3 1 1 11 7496 1 1 43 CYS N N 9.284 2.819 -1.511 1.00 . A A . 540 CYS N 1 1 11 7497 1 1 43 CYS O O 11.175 3.616 0.584 1.00 . A A . 540 CYS O 1 1 11 7498 1 1 43 CYS SG S 7.533 2.873 2.165 1.00 . A A . 540 CYS SG 1 1 11 7499 1 1 44 GLY C C 10.795 7.704 0.482 1.00 . A A . 541 GLY C 1 1 11 7500 1 1 44 GLY CA C 10.923 6.317 1.064 1.00 . A A . 541 GLY CA 1 1 11 7501 1 1 44 GLY H H 8.966 5.799 0.452 1.00 . A A . 541 GLY H 1 1 11 7502 1 1 44 GLY HA2 H 10.869 6.379 2.141 1.00 . A A . 541 GLY HA2 1 1 11 7503 1 1 44 GLY HA3 H 11.880 5.905 0.780 1.00 . A A . 541 GLY HA3 1 1 11 7504 1 1 44 GLY N N 9.874 5.449 0.585 1.00 . A A . 541 GLY N 1 1 11 7505 1 1 44 GLY O O 11.147 8.690 1.132 1.00 . A A . 541 GLY O 1 1 11 7506 1 1 45 GLN C C 11.343 9.720 -1.818 1.00 . A A . 542 GLN C 1 1 11 7507 1 1 45 GLN CA C 10.033 9.017 -1.467 1.00 . A A . 542 GLN CA 1 1 11 7508 1 1 45 GLN CB C 9.100 9.946 -0.688 1.00 . A A . 542 GLN CB 1 1 11 7509 1 1 45 GLN CD C 6.697 10.284 0.056 1.00 . A A . 542 GLN CD 1 1 11 7510 1 1 45 GLN CG C 7.792 9.286 -0.273 1.00 . A A . 542 GLN CG 1 1 11 7511 1 1 45 GLN H H 10.042 6.935 -1.201 1.00 . A A . 542 GLN H 1 1 11 7512 1 1 45 GLN HA H 9.544 8.752 -2.395 1.00 . A A . 542 GLN HA 1 1 11 7513 1 1 45 GLN HB2 H 9.609 10.278 0.202 1.00 . A A . 542 GLN HB2 1 1 11 7514 1 1 45 GLN HB3 H 8.868 10.804 -1.303 1.00 . A A . 542 GLN HB3 1 1 11 7515 1 1 45 GLN HE21 H 8.047 11.685 0.501 1.00 . A A . 542 GLN HE21 1 1 11 7516 1 1 45 GLN HE22 H 6.383 12.156 0.649 1.00 . A A . 542 GLN HE22 1 1 11 7517 1 1 45 GLN HG2 H 7.450 8.660 -1.083 1.00 . A A . 542 GLN HG2 1 1 11 7518 1 1 45 GLN HG3 H 7.976 8.673 0.598 1.00 . A A . 542 GLN HG3 1 1 11 7519 1 1 45 GLN N N 10.271 7.769 -0.748 1.00 . A A . 542 GLN N 1 1 11 7520 1 1 45 GLN NE2 N 7.079 11.493 0.446 1.00 . A A . 542 GLN NE2 1 1 11 7521 1 1 45 GLN O O 11.821 9.609 -2.946 1.00 . A A . 542 GLN O 1 1 11 7522 1 1 45 GLN OE1 O 5.511 9.978 -0.064 1.00 . A A . 542 GLN OE1 1 1 11 7523 1 1 46 SER C C 14.380 10.176 -0.913 1.00 . A A . 543 SER C 1 1 11 7524 1 1 46 SER CA C 13.189 11.120 -1.095 1.00 . A A . 543 SER CA 1 1 11 7525 1 1 46 SER CB C 13.292 12.335 -0.171 1.00 . A A . 543 SER CB 1 1 11 7526 1 1 46 SER H H 11.521 10.468 0.029 1.00 . A A . 543 SER H 1 1 11 7527 1 1 46 SER HA H 13.181 11.463 -2.118 1.00 . A A . 543 SER HA 1 1 11 7528 1 1 46 SER HB2 H 14.324 12.646 -0.102 1.00 . A A . 543 SER HB2 1 1 11 7529 1 1 46 SER HB3 H 12.700 13.143 -0.576 1.00 . A A . 543 SER HB3 1 1 11 7530 1 1 46 SER HG H 12.296 12.778 1.464 1.00 . A A . 543 SER HG 1 1 11 7531 1 1 46 SER N N 11.933 10.422 -0.861 1.00 . A A . 543 SER N 1 1 11 7532 1 1 46 SER O O 15.205 10.349 -0.011 1.00 . A A . 543 SER O 1 1 11 7533 1 1 46 SER OG O 12.819 12.030 1.132 1.00 . A A . 543 SER OG 1 1 11 7534 1 1 47 ALA C C 16.027 7.933 -3.174 1.00 . A A . 544 ALA C 1 1 11 7535 1 1 47 ALA CA C 15.533 8.202 -1.757 1.00 . A A . 544 ALA CA 1 1 11 7536 1 1 47 ALA CB C 15.077 6.910 -1.092 1.00 . A A . 544 ALA CB 1 1 11 7537 1 1 47 ALA H H 13.750 9.086 -2.458 1.00 . A A . 544 ALA H 1 1 11 7538 1 1 47 ALA HA H 16.343 8.617 -1.174 1.00 . A A . 544 ALA HA 1 1 11 7539 1 1 47 ALA HB1 H 14.276 6.471 -1.667 1.00 . A A . 544 ALA HB1 1 1 11 7540 1 1 47 ALA HB2 H 15.906 6.219 -1.045 1.00 . A A . 544 ALA HB2 1 1 11 7541 1 1 47 ALA HB3 H 14.729 7.123 -0.093 1.00 . A A . 544 ALA HB3 1 1 11 7542 1 1 47 ALA N N 14.452 9.173 -1.779 1.00 . A A . 544 ALA N 1 1 11 7543 1 1 47 ALA O O 17.044 8.539 -3.573 1.00 . A A . 544 ALA O 1 1 11 7544 1 1 47 ALA OXT O 15.381 7.141 -3.895 1.00 . A A . 544 ALA OXT 1 1 11 7545 2 2 1 ZN ZN ZN -5.464 -5.849 -1.167 1.00 . B A . 601 ZN ZN 1 1 11 7546 3 2 1 ZN ZN ZN 5.274 2.789 1.679 1.00 . C A . 602 ZN ZN 1 1 12 7547 1 1 1 GLY C C -16.738 3.380 4.287 1.00 . A A . 498 GLY C 1 1 12 7548 1 1 1 GLY CA C -17.712 2.742 5.250 1.00 . A A . 498 GLY CA 1 1 12 7549 1 1 1 GLY H1 H -18.837 4.452 5.629 1.00 . A A . 498 GLY H1 1 1 12 7550 1 1 1 GLY H2 H -17.563 4.212 6.720 1.00 . A A . 498 GLY H2 1 1 12 7551 1 1 1 GLY H3 H -18.965 3.262 6.834 1.00 . A A . 498 GLY H3 1 1 12 7552 1 1 1 GLY HA2 H -17.194 1.993 5.828 1.00 . A A . 498 GLY HA2 1 1 12 7553 1 1 1 GLY HA3 H -18.502 2.267 4.685 1.00 . A A . 498 GLY HA3 1 1 12 7554 1 1 1 GLY N N -18.310 3.735 6.172 1.00 . A A . 498 GLY N 1 1 12 7555 1 1 1 GLY O O -16.863 4.562 3.966 1.00 . A A . 498 GLY O 1 1 12 7556 1 1 2 ALA C C -14.959 2.600 1.498 1.00 . A A . 499 ALA C 1 1 12 7557 1 1 2 ALA CA C -14.749 3.106 2.924 1.00 . A A . 499 ALA CA 1 1 12 7558 1 1 2 ALA CB C -13.368 2.716 3.430 1.00 . A A . 499 ALA CB 1 1 12 7559 1 1 2 ALA H H -15.740 1.658 4.108 1.00 . A A . 499 ALA H 1 1 12 7560 1 1 2 ALA HA H -14.811 4.184 2.923 1.00 . A A . 499 ALA HA 1 1 12 7561 1 1 2 ALA HB1 H -13.296 1.639 3.484 1.00 . A A . 499 ALA HB1 1 1 12 7562 1 1 2 ALA HB2 H -12.617 3.094 2.752 1.00 . A A . 499 ALA HB2 1 1 12 7563 1 1 2 ALA HB3 H -13.212 3.138 4.412 1.00 . A A . 499 ALA HB3 1 1 12 7564 1 1 2 ALA N N -15.771 2.603 3.826 1.00 . A A . 499 ALA N 1 1 12 7565 1 1 2 ALA O O -15.079 1.398 1.263 1.00 . A A . 499 ALA O 1 1 12 7566 1 1 3 MET C C -14.493 4.321 -1.701 1.00 . A A . 500 MET C 1 1 12 7567 1 1 3 MET CA C -15.116 3.205 -0.867 1.00 . A A . 500 MET CA 1 1 12 7568 1 1 3 MET CB C -16.576 2.982 -1.288 1.00 . A A . 500 MET CB 1 1 12 7569 1 1 3 MET CE C -19.850 5.561 -1.570 1.00 . A A . 500 MET CE 1 1 12 7570 1 1 3 MET CG C -17.455 4.221 -1.182 1.00 . A A . 500 MET CG 1 1 12 7571 1 1 3 MET H H -15.043 4.485 0.826 1.00 . A A . 500 MET H 1 1 12 7572 1 1 3 MET HA H -14.559 2.294 -1.032 1.00 . A A . 500 MET HA 1 1 12 7573 1 1 3 MET HB2 H -16.594 2.645 -2.312 1.00 . A A . 500 MET HB2 1 1 12 7574 1 1 3 MET HB3 H -17.001 2.213 -0.660 1.00 . A A . 500 MET HB3 1 1 12 7575 1 1 3 MET HE1 H -19.284 6.290 -2.131 1.00 . A A . 500 MET HE1 1 1 12 7576 1 1 3 MET HE2 H -20.873 5.552 -1.918 1.00 . A A . 500 MET HE2 1 1 12 7577 1 1 3 MET HE3 H -19.828 5.816 -0.522 1.00 . A A . 500 MET HE3 1 1 12 7578 1 1 3 MET HG2 H -17.518 4.514 -0.145 1.00 . A A . 500 MET HG2 1 1 12 7579 1 1 3 MET HG3 H -17.001 5.018 -1.754 1.00 . A A . 500 MET HG3 1 1 12 7580 1 1 3 MET N N -15.028 3.534 0.555 1.00 . A A . 500 MET N 1 1 12 7581 1 1 3 MET O O -14.734 4.439 -2.901 1.00 . A A . 500 MET O 1 1 12 7582 1 1 3 MET SD S -19.126 3.938 -1.807 1.00 . A A . 500 MET SD 1 1 12 7583 1 1 4 GLU C C -11.623 6.064 -2.027 1.00 . A A . 501 GLU C 1 1 12 7584 1 1 4 GLU CA C -13.084 6.310 -1.669 1.00 . A A . 501 GLU CA 1 1 12 7585 1 1 4 GLU CB C -13.207 7.500 -0.725 1.00 . A A . 501 GLU CB 1 1 12 7586 1 1 4 GLU CD C -12.860 8.368 1.606 1.00 . A A . 501 GLU CD 1 1 12 7587 1 1 4 GLU CG C -12.477 7.316 0.592 1.00 . A A . 501 GLU CG 1 1 12 7588 1 1 4 GLU H H -13.473 4.944 -0.111 1.00 . A A . 501 GLU H 1 1 12 7589 1 1 4 GLU HA H -13.636 6.521 -2.573 1.00 . A A . 501 GLU HA 1 1 12 7590 1 1 4 GLU HB2 H -12.805 8.373 -1.214 1.00 . A A . 501 GLU HB2 1 1 12 7591 1 1 4 GLU HB3 H -14.250 7.665 -0.511 1.00 . A A . 501 GLU HB3 1 1 12 7592 1 1 4 GLU HG2 H -12.718 6.343 0.993 1.00 . A A . 501 GLU HG2 1 1 12 7593 1 1 4 GLU HG3 H -11.414 7.380 0.412 1.00 . A A . 501 GLU HG3 1 1 12 7594 1 1 4 GLU N N -13.679 5.134 -1.047 1.00 . A A . 501 GLU N 1 1 12 7595 1 1 4 GLU O O -10.946 6.932 -2.579 1.00 . A A . 501 GLU O 1 1 12 7596 1 1 4 GLU OE1 O -12.378 9.512 1.490 1.00 . A A . 501 GLU OE1 1 1 12 7597 1 1 4 GLU OE2 O -13.671 8.061 2.507 1.00 . A A . 501 GLU OE2 1 1 12 7598 1 1 5 GLN C C -9.677 3.041 -2.283 1.00 . A A . 502 GLN C 1 1 12 7599 1 1 5 GLN CA C -9.760 4.506 -1.889 1.00 . A A . 502 GLN CA 1 1 12 7600 1 1 5 GLN CB C -8.946 4.769 -0.609 1.00 . A A . 502 GLN CB 1 1 12 7601 1 1 5 GLN CD C -10.682 4.098 1.146 1.00 . A A . 502 GLN CD 1 1 12 7602 1 1 5 GLN CG C -9.290 3.873 0.582 1.00 . A A . 502 GLN CG 1 1 12 7603 1 1 5 GLN H H -11.767 4.206 -1.346 1.00 . A A . 502 GLN H 1 1 12 7604 1 1 5 GLN HA H -9.352 5.106 -2.691 1.00 . A A . 502 GLN HA 1 1 12 7605 1 1 5 GLN HB2 H -7.904 4.629 -0.837 1.00 . A A . 502 GLN HB2 1 1 12 7606 1 1 5 GLN HB3 H -9.099 5.795 -0.311 1.00 . A A . 502 GLN HB3 1 1 12 7607 1 1 5 GLN HE21 H -11.425 2.686 -0.037 1.00 . A A . 502 GLN HE21 1 1 12 7608 1 1 5 GLN HE22 H -12.550 3.445 1.029 1.00 . A A . 502 GLN HE22 1 1 12 7609 1 1 5 GLN HG2 H -9.219 2.846 0.267 1.00 . A A . 502 GLN HG2 1 1 12 7610 1 1 5 GLN HG3 H -8.568 4.054 1.367 1.00 . A A . 502 GLN HG3 1 1 12 7611 1 1 5 GLN N N -11.150 4.876 -1.700 1.00 . A A . 502 GLN N 1 1 12 7612 1 1 5 GLN NE2 N -11.654 3.341 0.658 1.00 . A A . 502 GLN NE2 1 1 12 7613 1 1 5 GLN O O -10.499 2.233 -1.845 1.00 . A A . 502 GLN O 1 1 12 7614 1 1 5 GLN OE1 O -10.882 4.937 2.020 1.00 . A A . 502 GLN OE1 1 1 12 7615 1 1 6 SER C C -7.204 0.748 -3.333 1.00 . A A . 503 SER C 1 1 12 7616 1 1 6 SER CA C -8.580 1.342 -3.609 1.00 . A A . 503 SER CA 1 1 12 7617 1 1 6 SER CB C -8.873 1.318 -5.110 1.00 . A A . 503 SER CB 1 1 12 7618 1 1 6 SER H H -8.044 3.379 -3.386 1.00 . A A . 503 SER H 1 1 12 7619 1 1 6 SER HA H -9.319 0.742 -3.103 1.00 . A A . 503 SER HA 1 1 12 7620 1 1 6 SER HB2 H -8.229 2.024 -5.614 1.00 . A A . 503 SER HB2 1 1 12 7621 1 1 6 SER HB3 H -8.690 0.324 -5.494 1.00 . A A . 503 SER HB3 1 1 12 7622 1 1 6 SER HG H -10.271 2.605 -5.605 1.00 . A A . 503 SER HG 1 1 12 7623 1 1 6 SER N N -8.700 2.699 -3.105 1.00 . A A . 503 SER N 1 1 12 7624 1 1 6 SER O O -6.183 1.416 -3.478 1.00 . A A . 503 SER O 1 1 12 7625 1 1 6 SER OG O -10.221 1.666 -5.365 1.00 . A A . 503 SER OG 1 1 12 7626 1 1 7 CYS C C -5.181 -1.309 -3.980 1.00 . A A . 504 CYS C 1 1 12 7627 1 1 7 CYS CA C -5.975 -1.252 -2.691 1.00 . A A . 504 CYS CA 1 1 12 7628 1 1 7 CYS CB C -6.295 -2.675 -2.220 1.00 . A A . 504 CYS CB 1 1 12 7629 1 1 7 CYS H H -8.071 -0.972 -2.795 1.00 . A A . 504 CYS H 1 1 12 7630 1 1 7 CYS HA H -5.400 -0.745 -1.930 1.00 . A A . 504 CYS HA 1 1 12 7631 1 1 7 CYS HB2 H -6.903 -2.620 -1.331 1.00 . A A . 504 CYS HB2 1 1 12 7632 1 1 7 CYS HB3 H -6.848 -3.180 -2.995 1.00 . A A . 504 CYS HB3 1 1 12 7633 1 1 7 CYS N N -7.202 -0.515 -2.925 1.00 . A A . 504 CYS N 1 1 12 7634 1 1 7 CYS O O -5.711 -1.690 -5.027 1.00 . A A . 504 CYS O 1 1 12 7635 1 1 7 CYS SG S -4.834 -3.702 -1.824 1.00 . A A . 504 CYS SG 1 1 12 7636 1 1 8 VAL C C -2.839 -2.364 -5.565 1.00 . A A . 505 VAL C 1 1 12 7637 1 1 8 VAL CA C -3.044 -0.932 -5.058 1.00 . A A . 505 VAL CA 1 1 12 7638 1 1 8 VAL CB C -1.686 -0.270 -4.723 1.00 . A A . 505 VAL CB 1 1 12 7639 1 1 8 VAL CG1 C -0.874 -1.126 -3.761 1.00 . A A . 505 VAL CG1 1 1 12 7640 1 1 8 VAL CG2 C -0.899 0.036 -5.990 1.00 . A A . 505 VAL CG2 1 1 12 7641 1 1 8 VAL H H -3.586 -0.557 -3.051 1.00 . A A . 505 VAL H 1 1 12 7642 1 1 8 VAL HA H -3.517 -0.352 -5.841 1.00 . A A . 505 VAL HA 1 1 12 7643 1 1 8 VAL HB H -1.890 0.669 -4.230 1.00 . A A . 505 VAL HB 1 1 12 7644 1 1 8 VAL HG11 H -0.674 -2.087 -4.213 1.00 . A A . 505 VAL HG11 1 1 12 7645 1 1 8 VAL HG12 H 0.059 -0.630 -3.535 1.00 . A A . 505 VAL HG12 1 1 12 7646 1 1 8 VAL HG13 H -1.434 -1.269 -2.848 1.00 . A A . 505 VAL HG13 1 1 12 7647 1 1 8 VAL HG21 H -1.472 0.703 -6.616 1.00 . A A . 505 VAL HG21 1 1 12 7648 1 1 8 VAL HG22 H 0.038 0.506 -5.727 1.00 . A A . 505 VAL HG22 1 1 12 7649 1 1 8 VAL HG23 H -0.705 -0.882 -6.523 1.00 . A A . 505 VAL HG23 1 1 12 7650 1 1 8 VAL N N -3.924 -0.913 -3.903 1.00 . A A . 505 VAL N 1 1 12 7651 1 1 8 VAL O O -2.325 -2.579 -6.662 1.00 . A A . 505 VAL O 1 1 12 7652 1 1 9 ASN C C -4.543 -5.273 -5.589 1.00 . A A . 506 ASN C 1 1 12 7653 1 1 9 ASN CA C -3.172 -4.734 -5.183 1.00 . A A . 506 ASN CA 1 1 12 7654 1 1 9 ASN CB C -2.565 -5.592 -4.062 1.00 . A A . 506 ASN CB 1 1 12 7655 1 1 9 ASN CG C -2.452 -7.059 -4.437 1.00 . A A . 506 ASN CG 1 1 12 7656 1 1 9 ASN H H -3.624 -3.131 -3.881 1.00 . A A . 506 ASN H 1 1 12 7657 1 1 9 ASN HA H -2.520 -4.777 -6.043 1.00 . A A . 506 ASN HA 1 1 12 7658 1 1 9 ASN HB2 H -1.576 -5.225 -3.833 1.00 . A A . 506 ASN HB2 1 1 12 7659 1 1 9 ASN HB3 H -3.185 -5.513 -3.180 1.00 . A A . 506 ASN HB3 1 1 12 7660 1 1 9 ASN HD21 H -4.096 -7.488 -3.407 1.00 . A A . 506 ASN HD21 1 1 12 7661 1 1 9 ASN HD22 H -3.349 -8.818 -4.218 1.00 . A A . 506 ASN HD22 1 1 12 7662 1 1 9 ASN N N -3.260 -3.345 -4.771 1.00 . A A . 506 ASN N 1 1 12 7663 1 1 9 ASN ND2 N -3.387 -7.871 -3.972 1.00 . A A . 506 ASN ND2 1 1 12 7664 1 1 9 ASN O O -4.641 -6.111 -6.486 1.00 . A A . 506 ASN O 1 1 12 7665 1 1 9 ASN OD1 O -1.507 -7.468 -5.110 1.00 . A A . 506 ASN OD1 1 1 12 7666 1 1 10 CYS C C -7.930 -4.250 -5.687 1.00 . A A . 507 CYS C 1 1 12 7667 1 1 10 CYS CA C -6.940 -5.308 -5.191 1.00 . A A . 507 CYS CA 1 1 12 7668 1 1 10 CYS CB C -7.463 -5.951 -3.912 1.00 . A A . 507 CYS CB 1 1 12 7669 1 1 10 CYS H H -5.486 -4.015 -4.344 1.00 . A A . 507 CYS H 1 1 12 7670 1 1 10 CYS HA H -6.854 -6.073 -5.947 1.00 . A A . 507 CYS HA 1 1 12 7671 1 1 10 CYS HB2 H -7.795 -5.176 -3.234 1.00 . A A . 507 CYS HB2 1 1 12 7672 1 1 10 CYS HB3 H -8.297 -6.594 -4.154 1.00 . A A . 507 CYS HB3 1 1 12 7673 1 1 10 CYS N N -5.604 -4.765 -4.962 1.00 . A A . 507 CYS N 1 1 12 7674 1 1 10 CYS O O -8.117 -4.087 -6.893 1.00 . A A . 507 CYS O 1 1 12 7675 1 1 10 CYS SG S -6.222 -6.956 -3.050 1.00 . A A . 507 CYS SG 1 1 12 7676 1 1 11 GLY C C -10.145 -1.801 -3.954 1.00 . A A . 508 GLY C 1 1 12 7677 1 1 11 GLY CA C -9.597 -2.590 -5.133 1.00 . A A . 508 GLY CA 1 1 12 7678 1 1 11 GLY H H -8.308 -3.637 -3.817 1.00 . A A . 508 GLY H 1 1 12 7679 1 1 11 GLY HA2 H -9.194 -1.896 -5.855 1.00 . A A . 508 GLY HA2 1 1 12 7680 1 1 11 GLY HA3 H -10.408 -3.136 -5.592 1.00 . A A . 508 GLY HA3 1 1 12 7681 1 1 11 GLY N N -8.558 -3.532 -4.758 1.00 . A A . 508 GLY N 1 1 12 7682 1 1 11 GLY O O -9.496 -1.708 -2.915 1.00 . A A . 508 GLY O 1 1 12 7683 1 1 12 ARG C C -12.048 -0.871 -1.719 1.00 . A A . 509 ARG C 1 1 12 7684 1 1 12 ARG CA C -12.001 -0.350 -3.154 1.00 . A A . 509 ARG CA 1 1 12 7685 1 1 12 ARG CB C -13.434 -0.094 -3.595 1.00 . A A . 509 ARG CB 1 1 12 7686 1 1 12 ARG CD C -14.939 0.364 -5.520 1.00 . A A . 509 ARG CD 1 1 12 7687 1 1 12 ARG CG C -13.566 0.610 -4.927 1.00 . A A . 509 ARG CG 1 1 12 7688 1 1 12 ARG CZ C -17.021 1.487 -4.816 1.00 . A A . 509 ARG CZ 1 1 12 7689 1 1 12 ARG H H -11.810 -1.399 -4.987 1.00 . A A . 509 ARG H 1 1 12 7690 1 1 12 ARG HA H -11.468 0.584 -3.168 1.00 . A A . 509 ARG HA 1 1 12 7691 1 1 12 ARG HB2 H -13.947 -1.041 -3.667 1.00 . A A . 509 ARG HB2 1 1 12 7692 1 1 12 ARG HB3 H -13.923 0.510 -2.845 1.00 . A A . 509 ARG HB3 1 1 12 7693 1 1 12 ARG HD2 H -15.063 0.990 -6.389 1.00 . A A . 509 ARG HD2 1 1 12 7694 1 1 12 ARG HD3 H -15.003 -0.676 -5.810 1.00 . A A . 509 ARG HD3 1 1 12 7695 1 1 12 ARG HE H -15.988 0.178 -3.705 1.00 . A A . 509 ARG HE 1 1 12 7696 1 1 12 ARG HG2 H -13.427 1.672 -4.781 1.00 . A A . 509 ARG HG2 1 1 12 7697 1 1 12 ARG HG3 H -12.814 0.233 -5.606 1.00 . A A . 509 ARG HG3 1 1 12 7698 1 1 12 ARG HH11 H -16.308 2.079 -6.626 1.00 . A A . 509 ARG HH11 1 1 12 7699 1 1 12 ARG HH12 H -17.816 2.805 -6.146 1.00 . A A . 509 ARG HH12 1 1 12 7700 1 1 12 ARG HH21 H -17.976 1.124 -3.060 1.00 . A A . 509 ARG HH21 1 1 12 7701 1 1 12 ARG HH22 H -18.752 2.262 -4.111 1.00 . A A . 509 ARG HH22 1 1 12 7702 1 1 12 ARG N N -11.354 -1.260 -4.124 1.00 . A A . 509 ARG N 1 1 12 7703 1 1 12 ARG NE N -16.013 0.654 -4.568 1.00 . A A . 509 ARG NE 1 1 12 7704 1 1 12 ARG NH1 N -17.051 2.178 -5.951 1.00 . A A . 509 ARG NH1 1 1 12 7705 1 1 12 ARG NH2 N -17.994 1.637 -3.926 1.00 . A A . 509 ARG NH2 1 1 12 7706 1 1 12 ARG O O -12.373 -0.120 -0.798 1.00 . A A . 509 ARG O 1 1 12 7707 1 1 13 GLU C C -10.573 -2.135 0.654 1.00 . A A . 510 GLU C 1 1 12 7708 1 1 13 GLU CA C -11.710 -2.726 -0.197 1.00 . A A . 510 GLU CA 1 1 12 7709 1 1 13 GLU CB C -11.607 -4.252 -0.296 1.00 . A A . 510 GLU CB 1 1 12 7710 1 1 13 GLU CD C -12.223 -6.416 0.846 1.00 . A A . 510 GLU CD 1 1 12 7711 1 1 13 GLU CG C -11.828 -4.970 1.026 1.00 . A A . 510 GLU CG 1 1 12 7712 1 1 13 GLU H H -11.525 -2.694 -2.301 1.00 . A A . 510 GLU H 1 1 12 7713 1 1 13 GLU HA H -12.639 -2.474 0.275 1.00 . A A . 510 GLU HA 1 1 12 7714 1 1 13 GLU HB2 H -12.346 -4.606 -1.000 1.00 . A A . 510 GLU HB2 1 1 12 7715 1 1 13 GLU HB3 H -10.623 -4.510 -0.660 1.00 . A A . 510 GLU HB3 1 1 12 7716 1 1 13 GLU HG2 H -10.915 -4.932 1.598 1.00 . A A . 510 GLU HG2 1 1 12 7717 1 1 13 GLU HG3 H -12.612 -4.462 1.569 1.00 . A A . 510 GLU HG3 1 1 12 7718 1 1 13 GLU N N -11.738 -2.137 -1.527 1.00 . A A . 510 GLU N 1 1 12 7719 1 1 13 GLU O O -10.397 -2.509 1.813 1.00 . A A . 510 GLU O 1 1 12 7720 1 1 13 GLU OE1 O -11.433 -7.188 0.270 1.00 . A A . 510 GLU OE1 1 1 12 7721 1 1 13 GLU OE2 O -13.332 -6.791 1.285 1.00 . A A . 510 GLU OE2 1 1 12 7722 1 1 14 ALA C C -9.169 0.053 2.084 1.00 . A A . 511 ALA C 1 1 12 7723 1 1 14 ALA CA C -8.709 -0.547 0.758 1.00 . A A . 511 ALA CA 1 1 12 7724 1 1 14 ALA CB C -8.119 0.541 -0.117 1.00 . A A . 511 ALA CB 1 1 12 7725 1 1 14 ALA H H -9.949 -1.030 -0.887 1.00 . A A . 511 ALA H 1 1 12 7726 1 1 14 ALA HA H -7.933 -1.267 0.954 1.00 . A A . 511 ALA HA 1 1 12 7727 1 1 14 ALA HB1 H -8.896 1.230 -0.407 1.00 . A A . 511 ALA HB1 1 1 12 7728 1 1 14 ALA HB2 H -7.350 1.069 0.430 1.00 . A A . 511 ALA HB2 1 1 12 7729 1 1 14 ALA HB3 H -7.687 0.093 -1.001 1.00 . A A . 511 ALA HB3 1 1 12 7730 1 1 14 ALA N N -9.790 -1.237 0.057 1.00 . A A . 511 ALA N 1 1 12 7731 1 1 14 ALA O O -9.997 0.963 2.119 1.00 . A A . 511 ALA O 1 1 12 7732 1 1 15 MET C C -7.704 0.478 5.247 1.00 . A A . 512 MET C 1 1 12 7733 1 1 15 MET CA C -8.945 -0.005 4.509 1.00 . A A . 512 MET CA 1 1 12 7734 1 1 15 MET CB C -9.595 -1.139 5.310 1.00 . A A . 512 MET CB 1 1 12 7735 1 1 15 MET CE C -13.406 -1.331 3.655 1.00 . A A . 512 MET CE 1 1 12 7736 1 1 15 MET CG C -10.871 -1.681 4.690 1.00 . A A . 512 MET CG 1 1 12 7737 1 1 15 MET H H -7.939 -1.161 3.064 1.00 . A A . 512 MET H 1 1 12 7738 1 1 15 MET HA H -9.646 0.813 4.428 1.00 . A A . 512 MET HA 1 1 12 7739 1 1 15 MET HB2 H -8.889 -1.952 5.394 1.00 . A A . 512 MET HB2 1 1 12 7740 1 1 15 MET HB3 H -9.827 -0.773 6.298 1.00 . A A . 512 MET HB3 1 1 12 7741 1 1 15 MET HE1 H -13.652 -2.281 4.107 1.00 . A A . 512 MET HE1 1 1 12 7742 1 1 15 MET HE2 H -14.300 -0.731 3.570 1.00 . A A . 512 MET HE2 1 1 12 7743 1 1 15 MET HE3 H -12.985 -1.497 2.674 1.00 . A A . 512 MET HE3 1 1 12 7744 1 1 15 MET HG2 H -10.664 -1.975 3.672 1.00 . A A . 512 MET HG2 1 1 12 7745 1 1 15 MET HG3 H -11.187 -2.548 5.255 1.00 . A A . 512 MET HG3 1 1 12 7746 1 1 15 MET N N -8.603 -0.457 3.169 1.00 . A A . 512 MET N 1 1 12 7747 1 1 15 MET O O -7.798 1.263 6.191 1.00 . A A . 512 MET O 1 1 12 7748 1 1 15 MET SD S -12.211 -0.479 4.678 1.00 . A A . 512 MET SD 1 1 12 7749 1 1 16 SER C C -4.274 0.975 4.617 1.00 . A A . 513 SER C 1 1 12 7750 1 1 16 SER CA C -5.305 0.313 5.533 1.00 . A A . 513 SER CA 1 1 12 7751 1 1 16 SER CB C -4.732 -0.958 6.165 1.00 . A A . 513 SER CB 1 1 12 7752 1 1 16 SER H H -6.495 -0.492 3.979 1.00 . A A . 513 SER H 1 1 12 7753 1 1 16 SER HA H -5.559 1.022 6.306 1.00 . A A . 513 SER HA 1 1 12 7754 1 1 16 SER HB2 H -4.425 -1.638 5.385 1.00 . A A . 513 SER HB2 1 1 12 7755 1 1 16 SER HB3 H -3.878 -0.702 6.775 1.00 . A A . 513 SER HB3 1 1 12 7756 1 1 16 SER HG H -6.131 -2.303 6.473 1.00 . A A . 513 SER HG 1 1 12 7757 1 1 16 SER N N -6.536 0.011 4.818 1.00 . A A . 513 SER N 1 1 12 7758 1 1 16 SER O O -4.279 0.776 3.404 1.00 . A A . 513 SER O 1 1 12 7759 1 1 16 SER OG O -5.700 -1.603 6.979 1.00 . A A . 513 SER OG 1 1 12 7760 1 1 17 GLU C C -0.984 1.875 4.863 1.00 . A A . 514 GLU C 1 1 12 7761 1 1 17 GLU CA C -2.344 2.448 4.477 1.00 . A A . 514 GLU CA 1 1 12 7762 1 1 17 GLU CB C -2.369 3.951 4.776 1.00 . A A . 514 GLU CB 1 1 12 7763 1 1 17 GLU CD C -2.053 5.764 6.511 1.00 . A A . 514 GLU CD 1 1 12 7764 1 1 17 GLU CG C -2.196 4.280 6.249 1.00 . A A . 514 GLU CG 1 1 12 7765 1 1 17 GLU H H -3.462 1.905 6.180 1.00 . A A . 514 GLU H 1 1 12 7766 1 1 17 GLU HA H -2.515 2.302 3.419 1.00 . A A . 514 GLU HA 1 1 12 7767 1 1 17 GLU HB2 H -1.571 4.428 4.225 1.00 . A A . 514 GLU HB2 1 1 12 7768 1 1 17 GLU HB3 H -3.314 4.356 4.446 1.00 . A A . 514 GLU HB3 1 1 12 7769 1 1 17 GLU HG2 H -3.058 3.918 6.787 1.00 . A A . 514 GLU HG2 1 1 12 7770 1 1 17 GLU HG3 H -1.311 3.778 6.613 1.00 . A A . 514 GLU HG3 1 1 12 7771 1 1 17 GLU N N -3.401 1.770 5.212 1.00 . A A . 514 GLU N 1 1 12 7772 1 1 17 GLU O O -0.862 1.172 5.873 1.00 . A A . 514 GLU O 1 1 12 7773 1 1 17 GLU OE1 O -2.240 6.570 5.570 1.00 . A A . 514 GLU OE1 1 1 12 7774 1 1 17 GLU OE2 O -1.754 6.135 7.664 1.00 . A A . 514 GLU OE2 1 1 12 7775 1 1 18 CYS C C 1.946 2.759 5.425 1.00 . A A . 515 CYS C 1 1 12 7776 1 1 18 CYS CA C 1.393 1.799 4.383 1.00 . A A . 515 CYS CA 1 1 12 7777 1 1 18 CYS CB C 2.287 1.824 3.138 1.00 . A A . 515 CYS CB 1 1 12 7778 1 1 18 CYS H H -0.148 2.649 3.225 1.00 . A A . 515 CYS H 1 1 12 7779 1 1 18 CYS HA H 1.415 0.816 4.839 1.00 . A A . 515 CYS HA 1 1 12 7780 1 1 18 CYS HB2 H 2.152 0.906 2.587 1.00 . A A . 515 CYS HB2 1 1 12 7781 1 1 18 CYS HB3 H 2.001 2.660 2.515 1.00 . A A . 515 CYS HB3 1 1 12 7782 1 1 18 CYS N N 0.025 2.159 4.056 1.00 . A A . 515 CYS N 1 1 12 7783 1 1 18 CYS O O 1.857 3.976 5.285 1.00 . A A . 515 CYS O 1 1 12 7784 1 1 18 CYS SG S 4.068 1.991 3.510 1.00 . A A . 515 CYS SG 1 1 12 7785 1 1 19 THR C C 4.634 3.181 6.903 1.00 . A A . 516 THR C 1 1 12 7786 1 1 19 THR CA C 3.236 2.962 7.466 1.00 . A A . 516 THR CA 1 1 12 7787 1 1 19 THR CB C 3.325 2.229 8.817 1.00 . A A . 516 THR CB 1 1 12 7788 1 1 19 THR CG2 C 3.958 3.114 9.878 1.00 . A A . 516 THR CG2 1 1 12 7789 1 1 19 THR H H 2.333 1.249 6.677 1.00 . A A . 516 THR H 1 1 12 7790 1 1 19 THR HA H 2.752 3.917 7.612 1.00 . A A . 516 THR HA 1 1 12 7791 1 1 19 THR HB H 3.934 1.346 8.692 1.00 . A A . 516 THR HB 1 1 12 7792 1 1 19 THR HG1 H 1.366 2.099 8.574 1.00 . A A . 516 THR HG1 1 1 12 7793 1 1 19 THR HG21 H 3.360 4.003 10.011 1.00 . A A . 516 THR HG21 1 1 12 7794 1 1 19 THR HG22 H 4.012 2.573 10.811 1.00 . A A . 516 THR HG22 1 1 12 7795 1 1 19 THR HG23 H 4.954 3.393 9.567 1.00 . A A . 516 THR HG23 1 1 12 7796 1 1 19 THR N N 2.465 2.198 6.512 1.00 . A A . 516 THR N 1 1 12 7797 1 1 19 THR O O 5.359 2.227 6.627 1.00 . A A . 516 THR O 1 1 12 7798 1 1 19 THR OG1 O 2.013 1.840 9.242 1.00 . A A . 516 THR OG1 1 1 12 7799 1 1 20 GLY C C 6.007 5.751 4.957 1.00 . A A . 517 GLY C 1 1 12 7800 1 1 20 GLY CA C 6.238 4.740 6.049 1.00 . A A . 517 GLY CA 1 1 12 7801 1 1 20 GLY H H 4.469 5.147 7.129 1.00 . A A . 517 GLY H 1 1 12 7802 1 1 20 GLY HA2 H 6.951 5.135 6.759 1.00 . A A . 517 GLY HA2 1 1 12 7803 1 1 20 GLY HA3 H 6.635 3.836 5.613 1.00 . A A . 517 GLY HA3 1 1 12 7804 1 1 20 GLY N N 5.010 4.431 6.741 1.00 . A A . 517 GLY N 1 1 12 7805 1 1 20 GLY O O 6.679 6.783 4.906 1.00 . A A . 517 GLY O 1 1 12 7806 1 1 21 CYS C C 3.133 6.495 2.999 1.00 . A A . 518 CYS C 1 1 12 7807 1 1 21 CYS CA C 4.650 6.450 3.092 1.00 . A A . 518 CYS CA 1 1 12 7808 1 1 21 CYS CB C 5.263 6.113 1.731 1.00 . A A . 518 CYS CB 1 1 12 7809 1 1 21 CYS H H 4.574 4.614 4.132 1.00 . A A . 518 CYS H 1 1 12 7810 1 1 21 CYS HA H 5.013 7.399 3.444 1.00 . A A . 518 CYS HA 1 1 12 7811 1 1 21 CYS HB2 H 5.188 6.977 1.088 1.00 . A A . 518 CYS HB2 1 1 12 7812 1 1 21 CYS HB3 H 6.303 5.859 1.864 1.00 . A A . 518 CYS HB3 1 1 12 7813 1 1 21 CYS N N 5.040 5.477 4.089 1.00 . A A . 518 CYS N 1 1 12 7814 1 1 21 CYS O O 2.466 5.480 3.167 1.00 . A A . 518 CYS O 1 1 12 7815 1 1 21 CYS SG S 4.452 4.717 0.877 1.00 . A A . 518 CYS SG 1 1 12 7816 1 1 22 HIS C C 0.731 8.036 1.196 1.00 . A A . 519 HIS C 1 1 12 7817 1 1 22 HIS CA C 1.138 7.788 2.635 1.00 . A A . 519 HIS CA 1 1 12 7818 1 1 22 HIS CB C 0.620 8.914 3.531 1.00 . A A . 519 HIS CB 1 1 12 7819 1 1 22 HIS CD2 C 2.029 9.121 5.692 1.00 . A A . 519 HIS CD2 1 1 12 7820 1 1 22 HIS CE1 C 0.646 8.145 7.079 1.00 . A A . 519 HIS CE1 1 1 12 7821 1 1 22 HIS CG C 0.945 8.736 4.980 1.00 . A A . 519 HIS CG 1 1 12 7822 1 1 22 HIS H H 3.157 8.453 2.590 1.00 . A A . 519 HIS H 1 1 12 7823 1 1 22 HIS HA H 0.706 6.853 2.961 1.00 . A A . 519 HIS HA 1 1 12 7824 1 1 22 HIS HB2 H 1.053 9.849 3.208 1.00 . A A . 519 HIS HB2 1 1 12 7825 1 1 22 HIS HB3 H -0.455 8.972 3.438 1.00 . A A . 519 HIS HB3 1 1 12 7826 1 1 22 HIS HD1 H -0.778 7.713 5.665 1.00 . A A . 519 HIS HD1 1 1 12 7827 1 1 22 HIS HD2 H 2.906 9.615 5.299 1.00 . A A . 519 HIS HD2 1 1 12 7828 1 1 22 HIS HE1 H 0.207 7.742 7.979 1.00 . A A . 519 HIS HE1 1 1 12 7829 1 1 22 HIS HE2 H 2.330 9.086 7.769 1.00 . A A . 519 HIS HE2 1 1 12 7830 1 1 22 HIS N N 2.582 7.661 2.733 1.00 . A A . 519 HIS N 1 1 12 7831 1 1 22 HIS ND1 N 0.098 8.123 5.878 1.00 . A A . 519 HIS ND1 1 1 12 7832 1 1 22 HIS NE2 N 1.820 8.745 6.995 1.00 . A A . 519 HIS NE2 1 1 12 7833 1 1 22 HIS O O -0.315 8.628 0.929 1.00 . A A . 519 HIS O 1 1 12 7834 1 1 23 LYS C C 0.398 6.734 -1.738 1.00 . A A . 520 LYS C 1 1 12 7835 1 1 23 LYS CA C 1.279 7.824 -1.145 1.00 . A A . 520 LYS CA 1 1 12 7836 1 1 23 LYS CB C 2.574 7.951 -1.953 1.00 . A A . 520 LYS CB 1 1 12 7837 1 1 23 LYS CD C 4.682 6.885 -2.809 1.00 . A A . 520 LYS CD 1 1 12 7838 1 1 23 LYS CE C 5.423 8.200 -2.634 1.00 . A A . 520 LYS CE 1 1 12 7839 1 1 23 LYS CG C 3.520 6.765 -1.830 1.00 . A A . 520 LYS CG 1 1 12 7840 1 1 23 LYS H H 2.385 7.122 0.507 1.00 . A A . 520 LYS H 1 1 12 7841 1 1 23 LYS HA H 0.744 8.760 -1.212 1.00 . A A . 520 LYS HA 1 1 12 7842 1 1 23 LYS HB2 H 2.321 8.067 -2.995 1.00 . A A . 520 LYS HB2 1 1 12 7843 1 1 23 LYS HB3 H 3.101 8.837 -1.624 1.00 . A A . 520 LYS HB3 1 1 12 7844 1 1 23 LYS HD2 H 5.372 6.069 -2.635 1.00 . A A . 520 LYS HD2 1 1 12 7845 1 1 23 LYS HD3 H 4.299 6.824 -3.819 1.00 . A A . 520 LYS HD3 1 1 12 7846 1 1 23 LYS HE2 H 4.701 8.992 -2.501 1.00 . A A . 520 LYS HE2 1 1 12 7847 1 1 23 LYS HE3 H 6.047 8.134 -1.756 1.00 . A A . 520 LYS HE3 1 1 12 7848 1 1 23 LYS HG2 H 3.909 6.730 -0.823 1.00 . A A . 520 LYS HG2 1 1 12 7849 1 1 23 LYS HG3 H 2.975 5.858 -2.039 1.00 . A A . 520 LYS HG3 1 1 12 7850 1 1 23 LYS HZ1 H 5.705 8.523 -4.675 1.00 . A A . 520 LYS HZ1 1 1 12 7851 1 1 23 LYS HZ2 H 6.696 9.474 -3.686 1.00 . A A . 520 LYS HZ2 1 1 12 7852 1 1 23 LYS HZ3 H 7.044 7.826 -3.903 1.00 . A A . 520 LYS HZ3 1 1 12 7853 1 1 23 LYS N N 1.557 7.593 0.259 1.00 . A A . 520 LYS N 1 1 12 7854 1 1 23 LYS NZ N 6.277 8.524 -3.805 1.00 . A A . 520 LYS NZ 1 1 12 7855 1 1 23 LYS O O -0.330 6.987 -2.697 1.00 . A A . 520 LYS O 1 1 12 7856 1 1 24 VAL C C -1.164 3.783 -0.582 1.00 . A A . 521 VAL C 1 1 12 7857 1 1 24 VAL CA C -0.355 4.422 -1.706 1.00 . A A . 521 VAL CA 1 1 12 7858 1 1 24 VAL CB C 0.516 3.338 -2.382 1.00 . A A . 521 VAL CB 1 1 12 7859 1 1 24 VAL CG1 C 1.240 3.904 -3.596 1.00 . A A . 521 VAL CG1 1 1 12 7860 1 1 24 VAL CG2 C 1.507 2.742 -1.391 1.00 . A A . 521 VAL CG2 1 1 12 7861 1 1 24 VAL H H 0.991 5.358 -0.386 1.00 . A A . 521 VAL H 1 1 12 7862 1 1 24 VAL HA H -1.035 4.823 -2.444 1.00 . A A . 521 VAL HA 1 1 12 7863 1 1 24 VAL HB H -0.139 2.547 -2.721 1.00 . A A . 521 VAL HB 1 1 12 7864 1 1 24 VAL HG11 H 1.870 4.726 -3.287 1.00 . A A . 521 VAL HG11 1 1 12 7865 1 1 24 VAL HG12 H 1.848 3.132 -4.046 1.00 . A A . 521 VAL HG12 1 1 12 7866 1 1 24 VAL HG13 H 0.515 4.255 -4.315 1.00 . A A . 521 VAL HG13 1 1 12 7867 1 1 24 VAL HG21 H 0.971 2.321 -0.553 1.00 . A A . 521 VAL HG21 1 1 12 7868 1 1 24 VAL HG22 H 2.081 1.967 -1.876 1.00 . A A . 521 VAL HG22 1 1 12 7869 1 1 24 VAL HG23 H 2.173 3.516 -1.038 1.00 . A A . 521 VAL HG23 1 1 12 7870 1 1 24 VAL N N 0.444 5.524 -1.187 1.00 . A A . 521 VAL N 1 1 12 7871 1 1 24 VAL O O -0.813 3.901 0.593 1.00 . A A . 521 VAL O 1 1 12 7872 1 1 25 ASN C C -3.377 1.026 -0.308 1.00 . A A . 522 ASN C 1 1 12 7873 1 1 25 ASN CA C -3.111 2.483 0.043 1.00 . A A . 522 ASN CA 1 1 12 7874 1 1 25 ASN CB C -4.436 3.242 0.212 1.00 . A A . 522 ASN CB 1 1 12 7875 1 1 25 ASN CG C -4.800 4.095 -0.987 1.00 . A A . 522 ASN CG 1 1 12 7876 1 1 25 ASN H H -2.471 3.036 -1.904 1.00 . A A . 522 ASN H 1 1 12 7877 1 1 25 ASN HA H -2.586 2.509 0.985 1.00 . A A . 522 ASN HA 1 1 12 7878 1 1 25 ASN HB2 H -5.232 2.529 0.369 1.00 . A A . 522 ASN HB2 1 1 12 7879 1 1 25 ASN HB3 H -4.365 3.886 1.077 1.00 . A A . 522 ASN HB3 1 1 12 7880 1 1 25 ASN HD21 H -5.619 2.529 -1.893 1.00 . A A . 522 ASN HD21 1 1 12 7881 1 1 25 ASN HD22 H -5.686 4.029 -2.760 1.00 . A A . 522 ASN HD22 1 1 12 7882 1 1 25 ASN N N -2.250 3.119 -0.945 1.00 . A A . 522 ASN N 1 1 12 7883 1 1 25 ASN ND2 N -5.429 3.492 -1.977 1.00 . A A . 522 ASN ND2 1 1 12 7884 1 1 25 ASN O O -3.344 0.630 -1.476 1.00 . A A . 522 ASN O 1 1 12 7885 1 1 25 ASN OD1 O -4.499 5.289 -1.028 1.00 . A A . 522 ASN OD1 1 1 12 7886 1 1 26 TYR C C -5.200 -1.566 1.205 1.00 . A A . 523 TYR C 1 1 12 7887 1 1 26 TYR CA C -3.861 -1.193 0.585 1.00 . A A . 523 TYR CA 1 1 12 7888 1 1 26 TYR CB C -2.749 -1.981 1.285 1.00 . A A . 523 TYR CB 1 1 12 7889 1 1 26 TYR CD1 C -0.576 -0.690 1.244 1.00 . A A . 523 TYR CD1 1 1 12 7890 1 1 26 TYR CD2 C -0.810 -2.545 -0.233 1.00 . A A . 523 TYR CD2 1 1 12 7891 1 1 26 TYR CE1 C 0.702 -0.470 0.769 1.00 . A A . 523 TYR CE1 1 1 12 7892 1 1 26 TYR CE2 C 0.471 -2.334 -0.706 1.00 . A A . 523 TYR CE2 1 1 12 7893 1 1 26 TYR CG C -1.354 -1.728 0.750 1.00 . A A . 523 TYR CG 1 1 12 7894 1 1 26 TYR CZ C 1.222 -1.297 -0.201 1.00 . A A . 523 TYR CZ 1 1 12 7895 1 1 26 TYR H H -3.742 0.652 1.613 1.00 . A A . 523 TYR H 1 1 12 7896 1 1 26 TYR HA H -3.872 -1.431 -0.469 1.00 . A A . 523 TYR HA 1 1 12 7897 1 1 26 TYR HB2 H -2.747 -1.722 2.333 1.00 . A A . 523 TYR HB2 1 1 12 7898 1 1 26 TYR HB3 H -2.956 -3.037 1.186 1.00 . A A . 523 TYR HB3 1 1 12 7899 1 1 26 TYR HD1 H -1.401 -3.359 -0.626 1.00 . A A . 523 TYR HD1 1 1 12 7900 1 1 26 TYR HD2 H -0.984 -0.041 2.006 1.00 . A A . 523 TYR HD2 1 1 12 7901 1 1 26 TYR HE1 H 0.876 -2.979 -1.470 1.00 . A A . 523 TYR HE1 1 1 12 7902 1 1 26 TYR HE2 H 1.291 0.343 1.164 1.00 . A A . 523 TYR HE2 1 1 12 7903 1 1 26 TYR HH H 2.572 -1.382 -1.584 1.00 . A A . 523 TYR HH 1 1 12 7904 1 1 26 TYR N N -3.644 0.240 0.725 1.00 . A A . 523 TYR N 1 1 12 7905 1 1 26 TYR O O -5.904 -0.705 1.727 1.00 . A A . 523 TYR O 1 1 12 7906 1 1 26 TYR OH O 2.501 -1.085 -0.662 1.00 . A A . 523 TYR OH 1 1 12 7907 1 1 27 CYS C C -6.599 -4.212 2.904 1.00 . A A . 524 CYS C 1 1 12 7908 1 1 27 CYS CA C -6.812 -3.286 1.720 1.00 . A A . 524 CYS CA 1 1 12 7909 1 1 27 CYS CB C -7.652 -3.977 0.642 1.00 . A A . 524 CYS CB 1 1 12 7910 1 1 27 CYS H H -4.882 -3.511 0.891 1.00 . A A . 524 CYS H 1 1 12 7911 1 1 27 CYS HA H -7.338 -2.416 2.067 1.00 . A A . 524 CYS HA 1 1 12 7912 1 1 27 CYS HB2 H -8.687 -3.967 0.946 1.00 . A A . 524 CYS HB2 1 1 12 7913 1 1 27 CYS HB3 H -7.551 -3.429 -0.284 1.00 . A A . 524 CYS HB3 1 1 12 7914 1 1 27 CYS N N -5.531 -2.847 1.195 1.00 . A A . 524 CYS N 1 1 12 7915 1 1 27 CYS O O -7.453 -4.328 3.781 1.00 . A A . 524 CYS O 1 1 12 7916 1 1 27 CYS SG S -7.199 -5.707 0.313 1.00 . A A . 524 CYS SG 1 1 12 7917 1 1 28 SER C C -3.607 -5.666 4.269 1.00 . A A . 525 SER C 1 1 12 7918 1 1 28 SER CA C -5.098 -5.784 3.980 1.00 . A A . 525 SER CA 1 1 12 7919 1 1 28 SER CB C -5.441 -7.211 3.546 1.00 . A A . 525 SER CB 1 1 12 7920 1 1 28 SER H H -4.793 -4.711 2.214 1.00 . A A . 525 SER H 1 1 12 7921 1 1 28 SER HA H -5.662 -5.526 4.864 1.00 . A A . 525 SER HA 1 1 12 7922 1 1 28 SER HB2 H -4.766 -7.517 2.761 1.00 . A A . 525 SER HB2 1 1 12 7923 1 1 28 SER HB3 H -5.338 -7.877 4.390 1.00 . A A . 525 SER HB3 1 1 12 7924 1 1 28 SER HG H -6.936 -6.556 2.444 1.00 . A A . 525 SER HG 1 1 12 7925 1 1 28 SER N N -5.445 -4.859 2.926 1.00 . A A . 525 SER N 1 1 12 7926 1 1 28 SER O O -2.858 -5.133 3.445 1.00 . A A . 525 SER O 1 1 12 7927 1 1 28 SER OG O -6.772 -7.292 3.058 1.00 . A A . 525 SER OG 1 1 12 7928 1 1 29 THR C C -0.984 -7.067 4.822 1.00 . A A . 526 THR C 1 1 12 7929 1 1 29 THR CA C -1.760 -6.141 5.759 1.00 . A A . 526 THR CA 1 1 12 7930 1 1 29 THR CB C -1.539 -6.572 7.223 1.00 . A A . 526 THR CB 1 1 12 7931 1 1 29 THR CG2 C -0.084 -6.411 7.630 1.00 . A A . 526 THR CG2 1 1 12 7932 1 1 29 THR H H -3.816 -6.541 6.056 1.00 . A A . 526 THR H 1 1 12 7933 1 1 29 THR HA H -1.394 -5.130 5.637 1.00 . A A . 526 THR HA 1 1 12 7934 1 1 29 THR HB H -1.813 -7.612 7.320 1.00 . A A . 526 THR HB 1 1 12 7935 1 1 29 THR HG1 H -1.838 -5.485 8.845 1.00 . A A . 526 THR HG1 1 1 12 7936 1 1 29 THR HG21 H 0.210 -5.378 7.517 1.00 . A A . 526 THR HG21 1 1 12 7937 1 1 29 THR HG22 H 0.036 -6.709 8.660 1.00 . A A . 526 THR HG22 1 1 12 7938 1 1 29 THR HG23 H 0.537 -7.033 7.001 1.00 . A A . 526 THR HG23 1 1 12 7939 1 1 29 THR N N -3.174 -6.156 5.420 1.00 . A A . 526 THR N 1 1 12 7940 1 1 29 THR O O 0.199 -6.852 4.550 1.00 . A A . 526 THR O 1 1 12 7941 1 1 29 THR OG1 O -2.365 -5.788 8.095 1.00 . A A . 526 THR OG1 1 1 12 7942 1 1 30 PHE C C -0.607 -8.288 2.109 1.00 . A A . 527 PHE C 1 1 12 7943 1 1 30 PHE CA C -1.080 -9.011 3.361 1.00 . A A . 527 PHE CA 1 1 12 7944 1 1 30 PHE CB C -2.087 -10.103 2.985 1.00 . A A . 527 PHE CB 1 1 12 7945 1 1 30 PHE CD1 C -0.610 -11.745 1.778 1.00 . A A . 527 PHE CD1 1 1 12 7946 1 1 30 PHE CD2 C -2.420 -10.751 0.583 1.00 . A A . 527 PHE CD2 1 1 12 7947 1 1 30 PHE CE1 C -0.252 -12.453 0.648 1.00 . A A . 527 PHE CE1 1 1 12 7948 1 1 30 PHE CE2 C -2.066 -11.458 -0.548 1.00 . A A . 527 PHE CE2 1 1 12 7949 1 1 30 PHE CG C -1.697 -10.885 1.759 1.00 . A A . 527 PHE CG 1 1 12 7950 1 1 30 PHE CZ C -0.980 -12.310 -0.516 1.00 . A A . 527 PHE CZ 1 1 12 7951 1 1 30 PHE H H -2.601 -8.226 4.598 1.00 . A A . 527 PHE H 1 1 12 7952 1 1 30 PHE HA H -0.229 -9.472 3.840 1.00 . A A . 527 PHE HA 1 1 12 7953 1 1 30 PHE HB2 H -2.180 -10.798 3.806 1.00 . A A . 527 PHE HB2 1 1 12 7954 1 1 30 PHE HB3 H -3.049 -9.646 2.798 1.00 . A A . 527 PHE HB3 1 1 12 7955 1 1 30 PHE HD1 H -0.038 -11.858 2.686 1.00 . A A . 527 PHE HD1 1 1 12 7956 1 1 30 PHE HD2 H -3.268 -10.084 0.558 1.00 . A A . 527 PHE HD2 1 1 12 7957 1 1 30 PHE HE1 H 0.599 -13.118 0.675 1.00 . A A . 527 PHE HE1 1 1 12 7958 1 1 30 PHE HE2 H -2.638 -11.342 -1.457 1.00 . A A . 527 PHE HE2 1 1 12 7959 1 1 30 PHE HZ H -0.700 -12.864 -1.399 1.00 . A A . 527 PHE HZ 1 1 12 7960 1 1 30 PHE N N -1.674 -8.082 4.308 1.00 . A A . 527 PHE N 1 1 12 7961 1 1 30 PHE O O 0.524 -8.481 1.681 1.00 . A A . 527 PHE O 1 1 12 7962 1 1 31 CYS C C 0.077 -5.809 0.558 1.00 . A A . 528 CYS C 1 1 12 7963 1 1 31 CYS CA C -1.105 -6.735 0.313 1.00 . A A . 528 CYS CA 1 1 12 7964 1 1 31 CYS CB C -2.305 -5.963 -0.208 1.00 . A A . 528 CYS CB 1 1 12 7965 1 1 31 CYS H H -2.335 -7.293 1.939 1.00 . A A . 528 CYS H 1 1 12 7966 1 1 31 CYS HA H -0.820 -7.494 -0.403 1.00 . A A . 528 CYS HA 1 1 12 7967 1 1 31 CYS HB2 H -2.490 -5.113 0.432 1.00 . A A . 528 CYS HB2 1 1 12 7968 1 1 31 CYS HB3 H -2.101 -5.620 -1.212 1.00 . A A . 528 CYS HB3 1 1 12 7969 1 1 31 CYS N N -1.456 -7.440 1.536 1.00 . A A . 528 CYS N 1 1 12 7970 1 1 31 CYS O O 0.936 -5.649 -0.303 1.00 . A A . 528 CYS O 1 1 12 7971 1 1 31 CYS SG S -3.809 -6.973 -0.254 1.00 . A A . 528 CYS SG 1 1 12 7972 1 1 32 GLN C C 2.537 -5.099 2.091 1.00 . A A . 529 GLN C 1 1 12 7973 1 1 32 GLN CA C 1.213 -4.338 2.137 1.00 . A A . 529 GLN CA 1 1 12 7974 1 1 32 GLN CB C 0.968 -3.784 3.553 1.00 . A A . 529 GLN CB 1 1 12 7975 1 1 32 GLN CD C 2.642 -1.949 3.977 1.00 . A A . 529 GLN CD 1 1 12 7976 1 1 32 GLN CG C 2.231 -3.365 4.289 1.00 . A A . 529 GLN CG 1 1 12 7977 1 1 32 GLN H H -0.593 -5.407 2.398 1.00 . A A . 529 GLN H 1 1 12 7978 1 1 32 GLN HA H 1.237 -3.525 1.429 1.00 . A A . 529 GLN HA 1 1 12 7979 1 1 32 GLN HB2 H 0.330 -2.909 3.481 1.00 . A A . 529 GLN HB2 1 1 12 7980 1 1 32 GLN HB3 H 0.465 -4.537 4.141 1.00 . A A . 529 GLN HB3 1 1 12 7981 1 1 32 GLN HE21 H 3.710 -2.559 2.416 1.00 . A A . 529 GLN HE21 1 1 12 7982 1 1 32 GLN HE22 H 3.714 -0.853 2.717 1.00 . A A . 529 GLN HE22 1 1 12 7983 1 1 32 GLN HG2 H 2.057 -3.446 5.352 1.00 . A A . 529 GLN HG2 1 1 12 7984 1 1 32 GLN HG3 H 3.035 -4.029 4.007 1.00 . A A . 529 GLN HG3 1 1 12 7985 1 1 32 GLN N N 0.117 -5.218 1.750 1.00 . A A . 529 GLN N 1 1 12 7986 1 1 32 GLN NE2 N 3.435 -1.770 2.933 1.00 . A A . 529 GLN NE2 1 1 12 7987 1 1 32 GLN O O 3.527 -4.628 1.532 1.00 . A A . 529 GLN O 1 1 12 7988 1 1 32 GLN OE1 O 2.243 -1.022 4.672 1.00 . A A . 529 GLN OE1 1 1 12 7989 1 1 33 ARG C C 4.016 -7.793 1.438 1.00 . A A . 530 ARG C 1 1 12 7990 1 1 33 ARG CA C 3.716 -7.121 2.785 1.00 . A A . 530 ARG CA 1 1 12 7991 1 1 33 ARG CB C 3.508 -8.146 3.899 1.00 . A A . 530 ARG CB 1 1 12 7992 1 1 33 ARG CD C 4.232 -10.140 5.171 1.00 . A A . 530 ARG CD 1 1 12 7993 1 1 33 ARG CG C 4.573 -9.217 4.015 1.00 . A A . 530 ARG CG 1 1 12 7994 1 1 33 ARG CZ C 5.390 -11.907 6.424 1.00 . A A . 530 ARG CZ 1 1 12 7995 1 1 33 ARG H H 1.697 -6.587 3.115 1.00 . A A . 530 ARG H 1 1 12 7996 1 1 33 ARG HA H 4.537 -6.469 3.032 1.00 . A A . 530 ARG HA 1 1 12 7997 1 1 33 ARG HB2 H 3.467 -7.621 4.841 1.00 . A A . 530 ARG HB2 1 1 12 7998 1 1 33 ARG HB3 H 2.559 -8.634 3.736 1.00 . A A . 530 ARG HB3 1 1 12 7999 1 1 33 ARG HD2 H 4.287 -9.575 6.088 1.00 . A A . 530 ARG HD2 1 1 12 8000 1 1 33 ARG HD3 H 3.222 -10.499 5.036 1.00 . A A . 530 ARG HD3 1 1 12 8001 1 1 33 ARG HE H 5.528 -11.629 4.442 1.00 . A A . 530 ARG HE 1 1 12 8002 1 1 33 ARG HG2 H 4.606 -9.787 3.098 1.00 . A A . 530 ARG HG2 1 1 12 8003 1 1 33 ARG HG3 H 5.529 -8.754 4.199 1.00 . A A . 530 ARG HG3 1 1 12 8004 1 1 33 ARG HH11 H 4.366 -10.586 7.581 1.00 . A A . 530 ARG HH11 1 1 12 8005 1 1 33 ARG HH12 H 5.113 -11.903 8.436 1.00 . A A . 530 ARG HH12 1 1 12 8006 1 1 33 ARG HH21 H 6.527 -13.348 5.573 1.00 . A A . 530 ARG HH21 1 1 12 8007 1 1 33 ARG HH22 H 6.347 -13.465 7.296 1.00 . A A . 530 ARG HH22 1 1 12 8008 1 1 33 ARG N N 2.534 -6.273 2.707 1.00 . A A . 530 ARG N 1 1 12 8009 1 1 33 ARG NE N 5.127 -11.285 5.277 1.00 . A A . 530 ARG NE 1 1 12 8010 1 1 33 ARG NH1 N 4.920 -11.427 7.571 1.00 . A A . 530 ARG NH1 1 1 12 8011 1 1 33 ARG NH2 N 6.148 -12.993 6.430 1.00 . A A . 530 ARG NH2 1 1 12 8012 1 1 33 ARG O O 5.171 -7.986 1.069 1.00 . A A . 530 ARG O 1 1 12 8013 1 1 34 LYS C C 3.742 -7.838 -1.607 1.00 . A A . 531 LYS C 1 1 12 8014 1 1 34 LYS CA C 3.093 -8.782 -0.595 1.00 . A A . 531 LYS CA 1 1 12 8015 1 1 34 LYS CB C 1.705 -9.182 -1.094 1.00 . A A . 531 LYS CB 1 1 12 8016 1 1 34 LYS CD C 0.374 -9.652 -3.154 1.00 . A A . 531 LYS CD 1 1 12 8017 1 1 34 LYS CE C 0.344 -10.350 -4.502 1.00 . A A . 531 LYS CE 1 1 12 8018 1 1 34 LYS CG C 1.706 -9.854 -2.451 1.00 . A A . 531 LYS CG 1 1 12 8019 1 1 34 LYS H H 2.063 -7.975 1.073 1.00 . A A . 531 LYS H 1 1 12 8020 1 1 34 LYS HA H 3.704 -9.665 -0.484 1.00 . A A . 531 LYS HA 1 1 12 8021 1 1 34 LYS HB2 H 1.265 -9.865 -0.383 1.00 . A A . 531 LYS HB2 1 1 12 8022 1 1 34 LYS HB3 H 1.090 -8.296 -1.157 1.00 . A A . 531 LYS HB3 1 1 12 8023 1 1 34 LYS HD2 H -0.413 -10.052 -2.534 1.00 . A A . 531 LYS HD2 1 1 12 8024 1 1 34 LYS HD3 H 0.218 -8.590 -3.301 1.00 . A A . 531 LYS HD3 1 1 12 8025 1 1 34 LYS HE2 H 1.138 -9.954 -5.117 1.00 . A A . 531 LYS HE2 1 1 12 8026 1 1 34 LYS HE3 H 0.502 -11.407 -4.350 1.00 . A A . 531 LYS HE3 1 1 12 8027 1 1 34 LYS HG2 H 2.493 -9.430 -3.056 1.00 . A A . 531 LYS HG2 1 1 12 8028 1 1 34 LYS HG3 H 1.875 -10.912 -2.317 1.00 . A A . 531 LYS HG3 1 1 12 8029 1 1 34 LYS HZ1 H -1.191 -9.135 -5.226 1.00 . A A . 531 LYS HZ1 1 1 12 8030 1 1 34 LYS HZ2 H -0.896 -10.504 -6.179 1.00 . A A . 531 LYS HZ2 1 1 12 8031 1 1 34 LYS HZ3 H -1.713 -10.662 -4.700 1.00 . A A . 531 LYS HZ3 1 1 12 8032 1 1 34 LYS N N 2.965 -8.140 0.711 1.00 . A A . 531 LYS N 1 1 12 8033 1 1 34 LYS NZ N -0.953 -10.149 -5.199 1.00 . A A . 531 LYS NZ 1 1 12 8034 1 1 34 LYS O O 4.620 -8.233 -2.373 1.00 . A A . 531 LYS O 1 1 12 8035 1 1 35 ASP C C 5.150 -5.023 -2.010 1.00 . A A . 532 ASP C 1 1 12 8036 1 1 35 ASP CA C 3.790 -5.539 -2.466 1.00 . A A . 532 ASP CA 1 1 12 8037 1 1 35 ASP CB C 2.772 -4.397 -2.466 1.00 . A A . 532 ASP CB 1 1 12 8038 1 1 35 ASP CG C 3.111 -3.287 -3.444 1.00 . A A . 532 ASP CG 1 1 12 8039 1 1 35 ASP H H 2.577 -6.359 -0.949 1.00 . A A . 532 ASP H 1 1 12 8040 1 1 35 ASP HA H 3.862 -5.906 -3.478 1.00 . A A . 532 ASP HA 1 1 12 8041 1 1 35 ASP HB2 H 1.807 -4.799 -2.732 1.00 . A A . 532 ASP HB2 1 1 12 8042 1 1 35 ASP HB3 H 2.714 -3.981 -1.473 1.00 . A A . 532 ASP HB3 1 1 12 8043 1 1 35 ASP N N 3.294 -6.591 -1.582 1.00 . A A . 532 ASP N 1 1 12 8044 1 1 35 ASP O O 5.837 -4.311 -2.740 1.00 . A A . 532 ASP O 1 1 12 8045 1 1 35 ASP OD1 O 3.262 -3.576 -4.654 1.00 . A A . 532 ASP OD1 1 1 12 8046 1 1 35 ASP OD2 O 3.207 -2.116 -3.018 1.00 . A A . 532 ASP OD2 1 1 12 8047 1 1 36 TRP C C 8.017 -5.229 -1.021 1.00 . A A . 533 TRP C 1 1 12 8048 1 1 36 TRP CA C 6.775 -4.949 -0.181 1.00 . A A . 533 TRP CA 1 1 12 8049 1 1 36 TRP CB C 6.947 -5.566 1.207 1.00 . A A . 533 TRP CB 1 1 12 8050 1 1 36 TRP CD1 C 9.268 -5.610 2.298 1.00 . A A . 533 TRP CD1 1 1 12 8051 1 1 36 TRP CD2 C 8.216 -3.636 2.444 1.00 . A A . 533 TRP CD2 1 1 12 8052 1 1 36 TRP CE2 C 9.475 -3.523 3.063 1.00 . A A . 533 TRP CE2 1 1 12 8053 1 1 36 TRP CE3 C 7.376 -2.516 2.412 1.00 . A A . 533 TRP CE3 1 1 12 8054 1 1 36 TRP CG C 8.104 -4.982 1.960 1.00 . A A . 533 TRP CG 1 1 12 8055 1 1 36 TRP CH2 C 9.073 -1.258 3.600 1.00 . A A . 533 TRP CH2 1 1 12 8056 1 1 36 TRP CZ2 C 9.913 -2.337 3.646 1.00 . A A . 533 TRP CZ2 1 1 12 8057 1 1 36 TRP CZ3 C 7.811 -1.341 2.994 1.00 . A A . 533 TRP CZ3 1 1 12 8058 1 1 36 TRP H H 5.013 -6.112 -0.348 1.00 . A A . 533 TRP H 1 1 12 8059 1 1 36 TRP HA H 6.677 -3.880 -0.050 1.00 . A A . 533 TRP HA 1 1 12 8060 1 1 36 TRP HB2 H 6.051 -5.400 1.785 1.00 . A A . 533 TRP HB2 1 1 12 8061 1 1 36 TRP HB3 H 7.114 -6.628 1.104 1.00 . A A . 533 TRP HB3 1 1 12 8062 1 1 36 TRP HD1 H 9.492 -6.641 2.070 1.00 . A A . 533 TRP HD1 1 1 12 8063 1 1 36 TRP HE1 H 10.991 -4.955 3.307 1.00 . A A . 533 TRP HE1 1 1 12 8064 1 1 36 TRP HE3 H 6.402 -2.560 1.947 1.00 . A A . 533 TRP HE3 1 1 12 8065 1 1 36 TRP HH2 H 9.374 -0.318 4.045 1.00 . A A . 533 TRP HH2 1 1 12 8066 1 1 36 TRP HZ2 H 10.884 -2.256 4.110 1.00 . A A . 533 TRP HZ2 1 1 12 8067 1 1 36 TRP HZ3 H 7.177 -0.466 2.980 1.00 . A A . 533 TRP HZ3 1 1 12 8068 1 1 36 TRP N N 5.555 -5.444 -0.818 1.00 . A A . 533 TRP N 1 1 12 8069 1 1 36 TRP NE1 N 10.096 -4.739 2.960 1.00 . A A . 533 TRP NE1 1 1 12 8070 1 1 36 TRP O O 9.007 -4.516 -0.939 1.00 . A A . 533 TRP O 1 1 12 8071 1 1 37 LYS C C 9.446 -5.635 -3.688 1.00 . A A . 534 LYS C 1 1 12 8072 1 1 37 LYS CA C 9.112 -6.675 -2.620 1.00 . A A . 534 LYS CA 1 1 12 8073 1 1 37 LYS CB C 8.877 -8.056 -3.226 1.00 . A A . 534 LYS CB 1 1 12 8074 1 1 37 LYS CD C 8.201 -10.438 -2.782 1.00 . A A . 534 LYS CD 1 1 12 8075 1 1 37 LYS CE C 7.998 -11.499 -1.713 1.00 . A A . 534 LYS CE 1 1 12 8076 1 1 37 LYS CG C 8.647 -9.123 -2.172 1.00 . A A . 534 LYS CG 1 1 12 8077 1 1 37 LYS H H 7.103 -6.717 -1.960 1.00 . A A . 534 LYS H 1 1 12 8078 1 1 37 LYS HA H 9.971 -6.708 -1.969 1.00 . A A . 534 LYS HA 1 1 12 8079 1 1 37 LYS HB2 H 8.009 -8.014 -3.868 1.00 . A A . 534 LYS HB2 1 1 12 8080 1 1 37 LYS HB3 H 9.740 -8.335 -3.812 1.00 . A A . 534 LYS HB3 1 1 12 8081 1 1 37 LYS HD2 H 7.267 -10.285 -3.305 1.00 . A A . 534 LYS HD2 1 1 12 8082 1 1 37 LYS HD3 H 8.955 -10.777 -3.478 1.00 . A A . 534 LYS HD3 1 1 12 8083 1 1 37 LYS HE2 H 7.675 -12.414 -2.186 1.00 . A A . 534 LYS HE2 1 1 12 8084 1 1 37 LYS HE3 H 8.941 -11.664 -1.214 1.00 . A A . 534 LYS HE3 1 1 12 8085 1 1 37 LYS HG2 H 9.566 -9.284 -1.629 1.00 . A A . 534 LYS HG2 1 1 12 8086 1 1 37 LYS HG3 H 7.884 -8.778 -1.489 1.00 . A A . 534 LYS HG3 1 1 12 8087 1 1 37 LYS HZ1 H 6.119 -10.760 -1.175 1.00 . A A . 534 LYS HZ1 1 1 12 8088 1 1 37 LYS HZ2 H 6.742 -11.896 -0.089 1.00 . A A . 534 LYS HZ2 1 1 12 8089 1 1 37 LYS HZ3 H 7.356 -10.316 -0.105 1.00 . A A . 534 LYS HZ3 1 1 12 8090 1 1 37 LYS N N 7.956 -6.256 -1.840 1.00 . A A . 534 LYS N 1 1 12 8091 1 1 37 LYS NZ N 6.983 -11.089 -0.704 1.00 . A A . 534 LYS NZ 1 1 12 8092 1 1 37 LYS O O 10.618 -5.436 -4.013 1.00 . A A . 534 LYS O 1 1 12 8093 1 1 38 ASP C C 8.677 -2.547 -4.273 1.00 . A A . 535 ASP C 1 1 12 8094 1 1 38 ASP CA C 8.693 -3.820 -5.092 1.00 . A A . 535 ASP CA 1 1 12 8095 1 1 38 ASP CB C 7.617 -3.711 -6.167 1.00 . A A . 535 ASP CB 1 1 12 8096 1 1 38 ASP CG C 8.153 -3.214 -7.496 1.00 . A A . 535 ASP CG 1 1 12 8097 1 1 38 ASP H H 7.514 -5.240 -4.038 1.00 . A A . 535 ASP H 1 1 12 8098 1 1 38 ASP HA H 9.661 -3.954 -5.548 1.00 . A A . 535 ASP HA 1 1 12 8099 1 1 38 ASP HB2 H 7.168 -4.672 -6.312 1.00 . A A . 535 ASP HB2 1 1 12 8100 1 1 38 ASP HB3 H 6.860 -3.019 -5.829 1.00 . A A . 535 ASP HB3 1 1 12 8101 1 1 38 ASP N N 8.442 -4.961 -4.220 1.00 . A A . 535 ASP N 1 1 12 8102 1 1 38 ASP O O 9.439 -1.621 -4.488 1.00 . A A . 535 ASP O 1 1 12 8103 1 1 38 ASP OD1 O 8.785 -2.138 -7.534 1.00 . A A . 535 ASP OD1 1 1 12 8104 1 1 38 ASP OD2 O 7.928 -3.893 -8.519 1.00 . A A . 535 ASP OD2 1 1 12 8105 1 1 39 HIS C C 8.668 -0.897 -1.706 1.00 . A A . 536 HIS C 1 1 12 8106 1 1 39 HIS CA C 7.498 -1.325 -2.573 1.00 . A A . 536 HIS CA 1 1 12 8107 1 1 39 HIS CB C 6.258 -1.540 -1.706 1.00 . A A . 536 HIS CB 1 1 12 8108 1 1 39 HIS CD2 C 5.567 0.101 0.173 1.00 . A A . 536 HIS CD2 1 1 12 8109 1 1 39 HIS CE1 C 4.732 1.683 -1.050 1.00 . A A . 536 HIS CE1 1 1 12 8110 1 1 39 HIS CG C 5.698 -0.286 -1.124 1.00 . A A . 536 HIS CG 1 1 12 8111 1 1 39 HIS H H 7.293 -3.337 -3.122 1.00 . A A . 536 HIS H 1 1 12 8112 1 1 39 HIS HA H 7.294 -0.543 -3.296 1.00 . A A . 536 HIS HA 1 1 12 8113 1 1 39 HIS HB2 H 5.486 -2.000 -2.305 1.00 . A A . 536 HIS HB2 1 1 12 8114 1 1 39 HIS HB3 H 6.513 -2.201 -0.890 1.00 . A A . 536 HIS HB3 1 1 12 8115 1 1 39 HIS HD1 H 5.085 0.739 -2.868 1.00 . A A . 536 HIS HD1 1 1 12 8116 1 1 39 HIS HD2 H 5.884 -0.451 1.041 1.00 . A A . 536 HIS HD2 1 1 12 8117 1 1 39 HIS HE1 H 4.279 2.614 -1.359 1.00 . A A . 536 HIS HE1 1 1 12 8118 1 1 39 HIS N N 7.790 -2.525 -3.317 1.00 . A A . 536 HIS N 1 1 12 8119 1 1 39 HIS ND1 N 5.161 0.729 -1.885 1.00 . A A . 536 HIS ND1 1 1 12 8120 1 1 39 HIS NE2 N 4.950 1.338 0.198 1.00 . A A . 536 HIS NE2 1 1 12 8121 1 1 39 HIS O O 8.872 0.285 -1.507 1.00 . A A . 536 HIS O 1 1 12 8122 1 1 40 GLN C C 11.535 -0.562 -0.888 1.00 . A A . 537 GLN C 1 1 12 8123 1 1 40 GLN CA C 10.519 -1.521 -0.268 1.00 . A A . 537 GLN CA 1 1 12 8124 1 1 40 GLN CB C 11.223 -2.784 0.222 1.00 . A A . 537 GLN CB 1 1 12 8125 1 1 40 GLN CD C 12.488 -4.874 -0.394 1.00 . A A . 537 GLN CD 1 1 12 8126 1 1 40 GLN CG C 11.913 -3.565 -0.883 1.00 . A A . 537 GLN CG 1 1 12 8127 1 1 40 GLN H H 9.255 -2.796 -1.420 1.00 . A A . 537 GLN H 1 1 12 8128 1 1 40 GLN HA H 10.065 -1.018 0.570 1.00 . A A . 537 GLN HA 1 1 12 8129 1 1 40 GLN HB2 H 11.965 -2.507 0.957 1.00 . A A . 537 GLN HB2 1 1 12 8130 1 1 40 GLN HB3 H 10.494 -3.430 0.689 1.00 . A A . 537 GLN HB3 1 1 12 8131 1 1 40 GLN HE21 H 10.743 -5.763 -0.689 1.00 . A A . 537 GLN HE21 1 1 12 8132 1 1 40 GLN HE22 H 12.008 -6.776 -0.082 1.00 . A A . 537 GLN HE22 1 1 12 8133 1 1 40 GLN HG2 H 11.199 -3.771 -1.674 1.00 . A A . 537 GLN HG2 1 1 12 8134 1 1 40 GLN HG3 H 12.717 -2.960 -1.273 1.00 . A A . 537 GLN HG3 1 1 12 8135 1 1 40 GLN N N 9.434 -1.849 -1.193 1.00 . A A . 537 GLN N 1 1 12 8136 1 1 40 GLN NE2 N 11.665 -5.907 -0.386 1.00 . A A . 537 GLN NE2 1 1 12 8137 1 1 40 GLN O O 12.040 0.330 -0.207 1.00 . A A . 537 GLN O 1 1 12 8138 1 1 40 GLN OE1 O 13.652 -4.951 -0.004 1.00 . A A . 537 GLN OE1 1 1 12 8139 1 1 41 HIS C C 12.175 1.482 -3.182 1.00 . A A . 538 HIS C 1 1 12 8140 1 1 41 HIS CA C 12.804 0.143 -2.820 1.00 . A A . 538 HIS CA 1 1 12 8141 1 1 41 HIS CB C 13.448 -0.520 -4.055 1.00 . A A . 538 HIS CB 1 1 12 8142 1 1 41 HIS CD2 C 11.810 -1.582 -5.743 1.00 . A A . 538 HIS CD2 1 1 12 8143 1 1 41 HIS CE1 C 11.673 0.101 -7.111 1.00 . A A . 538 HIS CE1 1 1 12 8144 1 1 41 HIS CG C 12.586 -0.577 -5.285 1.00 . A A . 538 HIS CG 1 1 12 8145 1 1 41 HIS H H 11.411 -1.452 -2.680 1.00 . A A . 538 HIS H 1 1 12 8146 1 1 41 HIS HA H 13.584 0.348 -2.104 1.00 . A A . 538 HIS HA 1 1 12 8147 1 1 41 HIS HB2 H 14.344 0.021 -4.312 1.00 . A A . 538 HIS HB2 1 1 12 8148 1 1 41 HIS HB3 H 13.714 -1.533 -3.796 1.00 . A A . 538 HIS HB3 1 1 12 8149 1 1 41 HIS HD2 H 11.621 -2.527 -5.255 1.00 . A A . 538 HIS HD2 1 1 12 8150 1 1 41 HIS HE1 H 11.370 0.725 -7.938 1.00 . A A . 538 HIS HE1 1 1 12 8151 1 1 41 HIS HE2 H 10.404 -1.525 -7.299 1.00 . A A . 538 HIS HE2 1 1 12 8152 1 1 41 HIS N N 11.834 -0.728 -2.172 1.00 . A A . 538 HIS N 1 1 12 8153 1 1 41 HIS ND1 N 12.500 0.483 -6.154 1.00 . A A . 538 HIS ND1 1 1 12 8154 1 1 41 HIS NE2 N 11.229 -1.146 -6.907 1.00 . A A . 538 HIS NE2 1 1 12 8155 1 1 41 HIS O O 12.883 2.481 -3.332 1.00 . A A . 538 HIS O 1 1 12 8156 1 1 42 ILE C C 9.864 3.528 -2.333 1.00 . A A . 539 ILE C 1 1 12 8157 1 1 42 ILE CA C 10.181 2.768 -3.623 1.00 . A A . 539 ILE CA 1 1 12 8158 1 1 42 ILE CB C 8.900 2.530 -4.491 1.00 . A A . 539 ILE CB 1 1 12 8159 1 1 42 ILE CD1 C 6.881 3.654 -3.395 1.00 . A A . 539 ILE CD1 1 1 12 8160 1 1 42 ILE CG1 C 7.618 2.356 -3.665 1.00 . A A . 539 ILE CG1 1 1 12 8161 1 1 42 ILE CG2 C 9.093 1.320 -5.386 1.00 . A A . 539 ILE CG2 1 1 12 8162 1 1 42 ILE H H 10.322 0.696 -3.198 1.00 . A A . 539 ILE H 1 1 12 8163 1 1 42 ILE HA H 10.871 3.365 -4.204 1.00 . A A . 539 ILE HA 1 1 12 8164 1 1 42 ILE HB H 8.780 3.378 -5.132 1.00 . A A . 539 ILE HB 1 1 12 8165 1 1 42 ILE HD11 H 6.597 4.110 -4.332 1.00 . A A . 539 ILE HD11 1 1 12 8166 1 1 42 ILE HD12 H 5.996 3.451 -2.811 1.00 . A A . 539 ILE HD12 1 1 12 8167 1 1 42 ILE HD13 H 7.527 4.324 -2.849 1.00 . A A . 539 ILE HD13 1 1 12 8168 1 1 42 ILE HG12 H 6.948 1.706 -4.195 1.00 . A A . 539 ILE HG12 1 1 12 8169 1 1 42 ILE HG13 H 7.867 1.912 -2.715 1.00 . A A . 539 ILE HG13 1 1 12 8170 1 1 42 ILE HG21 H 9.321 0.454 -4.779 1.00 . A A . 539 ILE HG21 1 1 12 8171 1 1 42 ILE HG22 H 8.189 1.139 -5.948 1.00 . A A . 539 ILE HG22 1 1 12 8172 1 1 42 ILE HG23 H 9.912 1.503 -6.068 1.00 . A A . 539 ILE HG23 1 1 12 8173 1 1 42 ILE N N 10.853 1.519 -3.308 1.00 . A A . 539 ILE N 1 1 12 8174 1 1 42 ILE O O 10.093 4.735 -2.238 1.00 . A A . 539 ILE O 1 1 12 8175 1 1 43 CYS C C 10.174 4.070 0.557 1.00 . A A . 540 CYS C 1 1 12 8176 1 1 43 CYS CA C 8.973 3.368 -0.078 1.00 . A A . 540 CYS CA 1 1 12 8177 1 1 43 CYS CB C 8.482 2.255 0.844 1.00 . A A . 540 CYS CB 1 1 12 8178 1 1 43 CYS H H 9.153 1.842 -1.515 1.00 . A A . 540 CYS H 1 1 12 8179 1 1 43 CYS HA H 8.168 4.077 -0.205 1.00 . A A . 540 CYS HA 1 1 12 8180 1 1 43 CYS HB2 H 7.901 1.551 0.268 1.00 . A A . 540 CYS HB2 1 1 12 8181 1 1 43 CYS HB3 H 9.337 1.746 1.268 1.00 . A A . 540 CYS HB3 1 1 12 8182 1 1 43 CYS N N 9.333 2.803 -1.359 1.00 . A A . 540 CYS N 1 1 12 8183 1 1 43 CYS O O 11.235 3.474 0.770 1.00 . A A . 540 CYS O 1 1 12 8184 1 1 43 CYS SG S 7.447 2.844 2.217 1.00 . A A . 540 CYS SG 1 1 12 8185 1 1 44 GLY C C 10.980 7.555 0.788 1.00 . A A . 541 GLY C 1 1 12 8186 1 1 44 GLY CA C 11.056 6.164 1.347 1.00 . A A . 541 GLY CA 1 1 12 8187 1 1 44 GLY H H 9.091 5.729 0.672 1.00 . A A . 541 GLY H 1 1 12 8188 1 1 44 GLY HA2 H 10.972 6.205 2.423 1.00 . A A . 541 GLY HA2 1 1 12 8189 1 1 44 GLY HA3 H 12.006 5.727 1.080 1.00 . A A . 541 GLY HA3 1 1 12 8190 1 1 44 GLY N N 9.988 5.344 0.815 1.00 . A A . 541 GLY N 1 1 12 8191 1 1 44 GLY O O 11.521 8.505 1.352 1.00 . A A . 541 GLY O 1 1 12 8192 1 1 45 GLN C C 9.020 9.714 -0.119 1.00 . A A . 542 GLN C 1 1 12 8193 1 1 45 GLN CA C 10.032 8.943 -0.951 1.00 . A A . 542 GLN CA 1 1 12 8194 1 1 45 GLN CB C 9.494 8.737 -2.362 1.00 . A A . 542 GLN CB 1 1 12 8195 1 1 45 GLN CD C 9.803 7.567 -4.565 1.00 . A A . 542 GLN CD 1 1 12 8196 1 1 45 GLN CG C 10.431 7.937 -3.242 1.00 . A A . 542 GLN CG 1 1 12 8197 1 1 45 GLN H H 9.967 6.844 -0.765 1.00 . A A . 542 GLN H 1 1 12 8198 1 1 45 GLN HA H 10.958 9.499 -0.998 1.00 . A A . 542 GLN HA 1 1 12 8199 1 1 45 GLN HB2 H 8.552 8.213 -2.304 1.00 . A A . 542 GLN HB2 1 1 12 8200 1 1 45 GLN HB3 H 9.335 9.701 -2.821 1.00 . A A . 542 GLN HB3 1 1 12 8201 1 1 45 GLN HE21 H 11.582 7.613 -5.433 1.00 . A A . 542 GLN HE21 1 1 12 8202 1 1 45 GLN HE22 H 10.247 7.216 -6.466 1.00 . A A . 542 GLN HE22 1 1 12 8203 1 1 45 GLN HG2 H 11.315 8.526 -3.432 1.00 . A A . 542 GLN HG2 1 1 12 8204 1 1 45 GLN HG3 H 10.706 7.030 -2.724 1.00 . A A . 542 GLN HG3 1 1 12 8205 1 1 45 GLN N N 10.298 7.662 -0.335 1.00 . A A . 542 GLN N 1 1 12 8206 1 1 45 GLN NE2 N 10.625 7.452 -5.589 1.00 . A A . 542 GLN NE2 1 1 12 8207 1 1 45 GLN O O 8.116 9.122 0.471 1.00 . A A . 542 GLN O 1 1 12 8208 1 1 45 GLN OE1 O 8.588 7.388 -4.663 1.00 . A A . 542 GLN OE1 1 1 12 8209 1 1 46 SER C C 7.442 12.717 -0.297 1.00 . A A . 543 SER C 1 1 12 8210 1 1 46 SER CA C 8.248 11.862 0.672 1.00 . A A . 543 SER CA 1 1 12 8211 1 1 46 SER CB C 9.028 12.734 1.661 1.00 . A A . 543 SER CB 1 1 12 8212 1 1 46 SER H H 9.897 11.447 -0.588 1.00 . A A . 543 SER H 1 1 12 8213 1 1 46 SER HA H 7.574 11.217 1.219 1.00 . A A . 543 SER HA 1 1 12 8214 1 1 46 SER HB2 H 9.794 12.138 2.135 1.00 . A A . 543 SER HB2 1 1 12 8215 1 1 46 SER HB3 H 9.489 13.551 1.126 1.00 . A A . 543 SER HB3 1 1 12 8216 1 1 46 SER HG H 7.444 12.652 2.820 1.00 . A A . 543 SER HG 1 1 12 8217 1 1 46 SER N N 9.162 11.024 -0.082 1.00 . A A . 543 SER N 1 1 12 8218 1 1 46 SER O O 6.582 13.504 0.097 1.00 . A A . 543 SER O 1 1 12 8219 1 1 46 SER OG O 8.182 13.267 2.667 1.00 . A A . 543 SER OG 1 1 12 8220 1 1 47 ALA C C 6.917 12.357 -3.857 1.00 . A A . 544 ALA C 1 1 12 8221 1 1 47 ALA CA C 7.042 13.251 -2.631 1.00 . A A . 544 ALA CA 1 1 12 8222 1 1 47 ALA CB C 7.778 14.538 -2.972 1.00 . A A . 544 ALA CB 1 1 12 8223 1 1 47 ALA H H 8.435 11.901 -1.822 1.00 . A A . 544 ALA H 1 1 12 8224 1 1 47 ALA HA H 6.055 13.507 -2.274 1.00 . A A . 544 ALA HA 1 1 12 8225 1 1 47 ALA HB1 H 8.757 14.300 -3.362 1.00 . A A . 544 ALA HB1 1 1 12 8226 1 1 47 ALA HB2 H 7.218 15.084 -3.717 1.00 . A A . 544 ALA HB2 1 1 12 8227 1 1 47 ALA HB3 H 7.881 15.144 -2.084 1.00 . A A . 544 ALA HB3 1 1 12 8228 1 1 47 ALA N N 7.736 12.541 -1.578 1.00 . A A . 544 ALA N 1 1 12 8229 1 1 47 ALA O O 7.142 12.842 -4.984 1.00 . A A . 544 ALA O 1 1 12 8230 1 1 47 ALA OXT O 6.619 11.156 -3.683 1.00 . A A . 544 ALA OXT 1 1 12 8231 2 2 1 ZN ZN ZN -5.511 -5.819 -1.213 1.00 . B A . 601 ZN ZN 1 1 12 8232 3 2 1 ZN ZN ZN 5.223 2.678 1.641 1.00 . C A . 602 ZN ZN 1 1 13 8233 1 1 1 GLY C C -16.886 2.188 2.854 1.00 . A A . 498 GLY C 1 1 13 8234 1 1 1 GLY CA C -17.453 0.853 3.292 1.00 . A A . 498 GLY CA 1 1 13 8235 1 1 1 GLY H1 H -15.924 0.323 4.612 1.00 . A A . 498 GLY H1 1 1 13 8236 1 1 1 GLY H2 H -15.691 -0.247 3.032 1.00 . A A . 498 GLY H2 1 1 13 8237 1 1 1 GLY H3 H -16.830 -0.995 4.042 1.00 . A A . 498 GLY H3 1 1 13 8238 1 1 1 GLY HA2 H -17.966 0.400 2.456 1.00 . A A . 498 GLY HA2 1 1 13 8239 1 1 1 GLY HA3 H -18.164 1.021 4.088 1.00 . A A . 498 GLY HA3 1 1 13 8240 1 1 1 GLY N N -16.402 -0.080 3.776 1.00 . A A . 498 GLY N 1 1 13 8241 1 1 1 GLY O O -17.298 2.738 1.833 1.00 . A A . 498 GLY O 1 1 13 8242 1 1 2 ALA C C -14.294 3.773 2.152 1.00 . A A . 499 ALA C 1 1 13 8243 1 1 2 ALA CA C -15.289 3.974 3.288 1.00 . A A . 499 ALA CA 1 1 13 8244 1 1 2 ALA CB C -14.595 4.556 4.511 1.00 . A A . 499 ALA CB 1 1 13 8245 1 1 2 ALA H H -15.668 2.242 4.443 1.00 . A A . 499 ALA H 1 1 13 8246 1 1 2 ALA HA H -16.052 4.671 2.970 1.00 . A A . 499 ALA HA 1 1 13 8247 1 1 2 ALA HB1 H -13.814 3.883 4.834 1.00 . A A . 499 ALA HB1 1 1 13 8248 1 1 2 ALA HB2 H -14.164 5.513 4.262 1.00 . A A . 499 ALA HB2 1 1 13 8249 1 1 2 ALA HB3 H -15.314 4.682 5.309 1.00 . A A . 499 ALA HB3 1 1 13 8250 1 1 2 ALA N N -15.938 2.714 3.623 1.00 . A A . 499 ALA N 1 1 13 8251 1 1 2 ALA O O -13.081 3.767 2.359 1.00 . A A . 499 ALA O 1 1 13 8252 1 1 3 MET C C -13.417 4.591 -0.809 1.00 . A A . 500 MET C 1 1 13 8253 1 1 3 MET CA C -14.009 3.314 -0.219 1.00 . A A . 500 MET CA 1 1 13 8254 1 1 3 MET CB C -14.850 2.576 -1.264 1.00 . A A . 500 MET CB 1 1 13 8255 1 1 3 MET CE C -17.870 1.747 -1.961 1.00 . A A . 500 MET CE 1 1 13 8256 1 1 3 MET CG C -15.417 1.259 -0.759 1.00 . A A . 500 MET CG 1 1 13 8257 1 1 3 MET H H -15.797 3.679 0.850 1.00 . A A . 500 MET H 1 1 13 8258 1 1 3 MET HA H -13.202 2.671 0.097 1.00 . A A . 500 MET HA 1 1 13 8259 1 1 3 MET HB2 H -15.672 3.210 -1.560 1.00 . A A . 500 MET HB2 1 1 13 8260 1 1 3 MET HB3 H -14.233 2.371 -2.128 1.00 . A A . 500 MET HB3 1 1 13 8261 1 1 3 MET HE1 H -17.453 2.690 -2.282 1.00 . A A . 500 MET HE1 1 1 13 8262 1 1 3 MET HE2 H -18.642 1.441 -2.651 1.00 . A A . 500 MET HE2 1 1 13 8263 1 1 3 MET HE3 H -18.294 1.859 -0.972 1.00 . A A . 500 MET HE3 1 1 13 8264 1 1 3 MET HG2 H -14.602 0.572 -0.593 1.00 . A A . 500 MET HG2 1 1 13 8265 1 1 3 MET HG3 H -15.931 1.438 0.175 1.00 . A A . 500 MET HG3 1 1 13 8266 1 1 3 MET N N -14.822 3.607 0.951 1.00 . A A . 500 MET N 1 1 13 8267 1 1 3 MET O O -13.669 4.934 -1.963 1.00 . A A . 500 MET O 1 1 13 8268 1 1 3 MET SD S -16.577 0.505 -1.918 1.00 . A A . 500 MET SD 1 1 13 8269 1 1 4 GLU C C -10.679 6.121 -1.210 1.00 . A A . 501 GLU C 1 1 13 8270 1 1 4 GLU CA C -11.930 6.495 -0.427 1.00 . A A . 501 GLU CA 1 1 13 8271 1 1 4 GLU CB C -11.539 7.328 0.798 1.00 . A A . 501 GLU CB 1 1 13 8272 1 1 4 GLU CD C -10.392 7.351 3.050 1.00 . A A . 501 GLU CD 1 1 13 8273 1 1 4 GLU CG C -10.892 6.506 1.904 1.00 . A A . 501 GLU CG 1 1 13 8274 1 1 4 GLU H H -12.529 4.987 0.935 1.00 . A A . 501 GLU H 1 1 13 8275 1 1 4 GLU HA H -12.590 7.070 -1.059 1.00 . A A . 501 GLU HA 1 1 13 8276 1 1 4 GLU HB2 H -10.837 8.091 0.496 1.00 . A A . 501 GLU HB2 1 1 13 8277 1 1 4 GLU HB3 H -12.423 7.800 1.201 1.00 . A A . 501 GLU HB3 1 1 13 8278 1 1 4 GLU HG2 H -11.620 5.808 2.287 1.00 . A A . 501 GLU HG2 1 1 13 8279 1 1 4 GLU HG3 H -10.058 5.961 1.487 1.00 . A A . 501 GLU HG3 1 1 13 8280 1 1 4 GLU N N -12.635 5.292 0.004 1.00 . A A . 501 GLU N 1 1 13 8281 1 1 4 GLU O O -10.139 6.911 -1.987 1.00 . A A . 501 GLU O 1 1 13 8282 1 1 4 GLU OE1 O -11.195 7.682 3.946 1.00 . A A . 501 GLU OE1 1 1 13 8283 1 1 4 GLU OE2 O -9.192 7.690 3.058 1.00 . A A . 501 GLU OE2 1 1 13 8284 1 1 5 GLN C C -9.167 3.064 -2.209 1.00 . A A . 502 GLN C 1 1 13 8285 1 1 5 GLN CA C -8.987 4.414 -1.532 1.00 . A A . 502 GLN CA 1 1 13 8286 1 1 5 GLN CB C -7.980 4.313 -0.384 1.00 . A A . 502 GLN CB 1 1 13 8287 1 1 5 GLN CD C -7.638 3.922 2.082 1.00 . A A . 502 GLN CD 1 1 13 8288 1 1 5 GLN CG C -8.561 3.734 0.897 1.00 . A A . 502 GLN CG 1 1 13 8289 1 1 5 GLN H H -10.800 4.281 -0.484 1.00 . A A . 502 GLN H 1 1 13 8290 1 1 5 GLN HA H -8.608 5.131 -2.245 1.00 . A A . 502 GLN HA 1 1 13 8291 1 1 5 GLN HB2 H -7.160 3.683 -0.697 1.00 . A A . 502 GLN HB2 1 1 13 8292 1 1 5 GLN HB3 H -7.601 5.301 -0.167 1.00 . A A . 502 GLN HB3 1 1 13 8293 1 1 5 GLN HE21 H -8.464 5.691 2.468 1.00 . A A . 502 GLN HE21 1 1 13 8294 1 1 5 GLN HE22 H -7.200 5.202 3.538 1.00 . A A . 502 GLN HE22 1 1 13 8295 1 1 5 GLN HG2 H -9.497 4.229 1.109 1.00 . A A . 502 GLN HG2 1 1 13 8296 1 1 5 GLN HG3 H -8.736 2.677 0.757 1.00 . A A . 502 GLN HG3 1 1 13 8297 1 1 5 GLN N N -10.245 4.895 -1.007 1.00 . A A . 502 GLN N 1 1 13 8298 1 1 5 GLN NE2 N -7.781 5.049 2.765 1.00 . A A . 502 GLN NE2 1 1 13 8299 1 1 5 GLN O O -10.168 2.384 -1.990 1.00 . A A . 502 GLN O 1 1 13 8300 1 1 5 GLN OE1 O -6.800 3.069 2.375 1.00 . A A . 502 GLN OE1 1 1 13 8301 1 1 6 SER C C -6.927 0.649 -3.480 1.00 . A A . 503 SER C 1 1 13 8302 1 1 6 SER CA C -8.244 1.389 -3.694 1.00 . A A . 503 SER CA 1 1 13 8303 1 1 6 SER CB C -8.536 1.578 -5.184 1.00 . A A . 503 SER CB 1 1 13 8304 1 1 6 SER H H -7.460 3.285 -3.211 1.00 . A A . 503 SER H 1 1 13 8305 1 1 6 SER HA H -9.041 0.813 -3.249 1.00 . A A . 503 SER HA 1 1 13 8306 1 1 6 SER HB2 H -8.312 0.662 -5.712 1.00 . A A . 503 SER HB2 1 1 13 8307 1 1 6 SER HB3 H -9.579 1.823 -5.317 1.00 . A A . 503 SER HB3 1 1 13 8308 1 1 6 SER HG H -6.943 2.247 -6.117 1.00 . A A . 503 SER HG 1 1 13 8309 1 1 6 SER N N -8.208 2.681 -3.032 1.00 . A A . 503 SER N 1 1 13 8310 1 1 6 SER O O -5.854 1.198 -3.716 1.00 . A A . 503 SER O 1 1 13 8311 1 1 6 SER OG O -7.749 2.623 -5.732 1.00 . A A . 503 SER OG 1 1 13 8312 1 1 7 CYS C C -5.004 -1.554 -3.974 1.00 . A A . 504 CYS C 1 1 13 8313 1 1 7 CYS CA C -5.839 -1.383 -2.723 1.00 . A A . 504 CYS CA 1 1 13 8314 1 1 7 CYS CB C -6.228 -2.756 -2.166 1.00 . A A . 504 CYS CB 1 1 13 8315 1 1 7 CYS H H -7.911 -0.999 -2.908 1.00 . A A . 504 CYS H 1 1 13 8316 1 1 7 CYS HA H -5.258 -0.856 -1.982 1.00 . A A . 504 CYS HA 1 1 13 8317 1 1 7 CYS HB2 H -6.873 -2.620 -1.312 1.00 . A A . 504 CYS HB2 1 1 13 8318 1 1 7 CYS HB3 H -6.759 -3.303 -2.926 1.00 . A A . 504 CYS HB3 1 1 13 8319 1 1 7 CYS N N -7.018 -0.594 -3.025 1.00 . A A . 504 CYS N 1 1 13 8320 1 1 7 CYS O O -5.487 -2.055 -4.991 1.00 . A A . 504 CYS O 1 1 13 8321 1 1 7 CYS SG S -4.810 -3.778 -1.636 1.00 . A A . 504 CYS SG 1 1 13 8322 1 1 8 VAL C C -2.594 -2.653 -5.428 1.00 . A A . 505 VAL C 1 1 13 8323 1 1 8 VAL CA C -2.838 -1.202 -5.010 1.00 . A A . 505 VAL CA 1 1 13 8324 1 1 8 VAL CB C -1.499 -0.504 -4.669 1.00 . A A . 505 VAL CB 1 1 13 8325 1 1 8 VAL CG1 C -0.694 -1.315 -3.665 1.00 . A A . 505 VAL CG1 1 1 13 8326 1 1 8 VAL CG2 C -0.689 -0.222 -5.923 1.00 . A A . 505 VAL CG2 1 1 13 8327 1 1 8 VAL H H -3.446 -0.737 -3.040 1.00 . A A . 505 VAL H 1 1 13 8328 1 1 8 VAL HA H -3.291 -0.676 -5.837 1.00 . A A . 505 VAL HA 1 1 13 8329 1 1 8 VAL HB H -1.733 0.444 -4.209 1.00 . A A . 505 VAL HB 1 1 13 8330 1 1 8 VAL HG11 H -0.444 -2.274 -4.094 1.00 . A A . 505 VAL HG11 1 1 13 8331 1 1 8 VAL HG12 H 0.212 -0.782 -3.418 1.00 . A A . 505 VAL HG12 1 1 13 8332 1 1 8 VAL HG13 H -1.281 -1.462 -2.771 1.00 . A A . 505 VAL HG13 1 1 13 8333 1 1 8 VAL HG21 H -1.267 0.401 -6.589 1.00 . A A . 505 VAL HG21 1 1 13 8334 1 1 8 VAL HG22 H 0.223 0.289 -5.653 1.00 . A A . 505 VAL HG22 1 1 13 8335 1 1 8 VAL HG23 H -0.450 -1.152 -6.417 1.00 . A A . 505 VAL HG23 1 1 13 8336 1 1 8 VAL N N -3.754 -1.133 -3.886 1.00 . A A . 505 VAL N 1 1 13 8337 1 1 8 VAL O O -2.084 -2.921 -6.514 1.00 . A A . 505 VAL O 1 1 13 8338 1 1 9 ASN C C -4.126 -5.616 -5.337 1.00 . A A . 506 ASN C 1 1 13 8339 1 1 9 ASN CA C -2.812 -5.001 -4.858 1.00 . A A . 506 ASN CA 1 1 13 8340 1 1 9 ASN CB C -2.308 -5.740 -3.612 1.00 . A A . 506 ASN CB 1 1 13 8341 1 1 9 ASN CG C -1.995 -7.200 -3.876 1.00 . A A . 506 ASN CG 1 1 13 8342 1 1 9 ASN H H -3.352 -3.328 -3.695 1.00 . A A . 506 ASN H 1 1 13 8343 1 1 9 ASN HA H -2.077 -5.093 -5.642 1.00 . A A . 506 ASN HA 1 1 13 8344 1 1 9 ASN HB2 H -1.406 -5.261 -3.259 1.00 . A A . 506 ASN HB2 1 1 13 8345 1 1 9 ASN HB3 H -3.061 -5.687 -2.840 1.00 . A A . 506 ASN HB3 1 1 13 8346 1 1 9 ASN HD21 H -3.838 -7.729 -3.336 1.00 . A A . 506 ASN HD21 1 1 13 8347 1 1 9 ASN HD22 H -2.790 -9.019 -3.818 1.00 . A A . 506 ASN HD22 1 1 13 8348 1 1 9 ASN N N -2.973 -3.589 -4.563 1.00 . A A . 506 ASN N 1 1 13 8349 1 1 9 ASN ND2 N -2.969 -8.070 -3.655 1.00 . A A . 506 ASN ND2 1 1 13 8350 1 1 9 ASN O O -4.129 -6.493 -6.203 1.00 . A A . 506 ASN O 1 1 13 8351 1 1 9 ASN OD1 O -0.880 -7.545 -4.263 1.00 . A A . 506 ASN OD1 1 1 13 8352 1 1 10 CYS C C -7.521 -4.756 -5.695 1.00 . A A . 507 CYS C 1 1 13 8353 1 1 10 CYS CA C -6.533 -5.753 -5.087 1.00 . A A . 507 CYS CA 1 1 13 8354 1 1 10 CYS CB C -7.121 -6.359 -3.815 1.00 . A A . 507 CYS CB 1 1 13 8355 1 1 10 CYS H H -5.199 -4.364 -4.201 1.00 . A A . 507 CYS H 1 1 13 8356 1 1 10 CYS HA H -6.365 -6.546 -5.800 1.00 . A A . 507 CYS HA 1 1 13 8357 1 1 10 CYS HB2 H -7.588 -5.577 -3.236 1.00 . A A . 507 CYS HB2 1 1 13 8358 1 1 10 CYS HB3 H -7.865 -7.096 -4.084 1.00 . A A . 507 CYS HB3 1 1 13 8359 1 1 10 CYS N N -5.243 -5.140 -4.797 1.00 . A A . 507 CYS N 1 1 13 8360 1 1 10 CYS O O -7.660 -4.681 -6.917 1.00 . A A . 507 CYS O 1 1 13 8361 1 1 10 CYS SG S -5.888 -7.176 -2.750 1.00 . A A . 507 CYS SG 1 1 13 8362 1 1 11 GLY C C -9.743 -2.107 -4.326 1.00 . A A . 508 GLY C 1 1 13 8363 1 1 11 GLY CA C -9.230 -3.097 -5.355 1.00 . A A . 508 GLY CA 1 1 13 8364 1 1 11 GLY H H -8.004 -4.022 -3.892 1.00 . A A . 508 GLY H 1 1 13 8365 1 1 11 GLY HA2 H -8.826 -2.544 -6.191 1.00 . A A . 508 GLY HA2 1 1 13 8366 1 1 11 GLY HA3 H -10.060 -3.692 -5.703 1.00 . A A . 508 GLY HA3 1 1 13 8367 1 1 11 GLY N N -8.202 -3.988 -4.851 1.00 . A A . 508 GLY N 1 1 13 8368 1 1 11 GLY O O -9.192 -1.997 -3.235 1.00 . A A . 508 GLY O 1 1 13 8369 1 1 12 ARG C C -11.779 -0.754 -2.431 1.00 . A A . 509 ARG C 1 1 13 8370 1 1 12 ARG CA C -11.435 -0.337 -3.871 1.00 . A A . 509 ARG CA 1 1 13 8371 1 1 12 ARG CB C -12.689 0.188 -4.589 1.00 . A A . 509 ARG CB 1 1 13 8372 1 1 12 ARG CD C -14.509 -1.387 -3.828 1.00 . A A . 509 ARG CD 1 1 13 8373 1 1 12 ARG CG C -13.673 -0.901 -5.001 1.00 . A A . 509 ARG CG 1 1 13 8374 1 1 12 ARG CZ C -15.650 -3.455 -3.135 1.00 . A A . 509 ARG CZ 1 1 13 8375 1 1 12 ARG H H -11.209 -1.579 -5.577 1.00 . A A . 509 ARG H 1 1 13 8376 1 1 12 ARG HA H -10.719 0.470 -3.823 1.00 . A A . 509 ARG HA 1 1 13 8377 1 1 12 ARG HB2 H -13.203 0.873 -3.933 1.00 . A A . 509 ARG HB2 1 1 13 8378 1 1 12 ARG HB3 H -12.383 0.717 -5.478 1.00 . A A . 509 ARG HB3 1 1 13 8379 1 1 12 ARG HD2 H -13.873 -1.472 -2.960 1.00 . A A . 509 ARG HD2 1 1 13 8380 1 1 12 ARG HD3 H -15.286 -0.660 -3.633 1.00 . A A . 509 ARG HD3 1 1 13 8381 1 1 12 ARG HE H -15.137 -3.003 -5.022 1.00 . A A . 509 ARG HE 1 1 13 8382 1 1 12 ARG HG2 H -14.334 -0.505 -5.757 1.00 . A A . 509 ARG HG2 1 1 13 8383 1 1 12 ARG HG3 H -13.120 -1.736 -5.408 1.00 . A A . 509 ARG HG3 1 1 13 8384 1 1 12 ARG HH11 H -15.345 -2.120 -1.642 1.00 . A A . 509 ARG HH11 1 1 13 8385 1 1 12 ARG HH12 H -16.087 -3.614 -1.163 1.00 . A A . 509 ARG HH12 1 1 13 8386 1 1 12 ARG HH21 H -16.105 -4.982 -4.390 1.00 . A A . 509 ARG HH21 1 1 13 8387 1 1 12 ARG HH22 H -16.530 -5.232 -2.719 1.00 . A A . 509 ARG HH22 1 1 13 8388 1 1 12 ARG N N -10.823 -1.407 -4.687 1.00 . A A . 509 ARG N 1 1 13 8389 1 1 12 ARG NE N -15.128 -2.682 -4.087 1.00 . A A . 509 ARG NE 1 1 13 8390 1 1 12 ARG NH1 N -15.697 -3.026 -1.881 1.00 . A A . 509 ARG NH1 1 1 13 8391 1 1 12 ARG NH2 N -16.134 -4.650 -3.436 1.00 . A A . 509 ARG NH2 1 1 13 8392 1 1 12 ARG O O -12.191 0.078 -1.626 1.00 . A A . 509 ARG O 1 1 13 8393 1 1 13 GLU C C -10.872 -1.966 0.235 1.00 . A A . 510 GLU C 1 1 13 8394 1 1 13 GLU CA C -11.873 -2.557 -0.776 1.00 . A A . 510 GLU CA 1 1 13 8395 1 1 13 GLU CB C -11.775 -4.086 -0.781 1.00 . A A . 510 GLU CB 1 1 13 8396 1 1 13 GLU CD C -13.758 -4.665 0.680 1.00 . A A . 510 GLU CD 1 1 13 8397 1 1 13 GLU CG C -12.256 -4.741 0.506 1.00 . A A . 510 GLU CG 1 1 13 8398 1 1 13 GLU H H -11.395 -2.660 -2.839 1.00 . A A . 510 GLU H 1 1 13 8399 1 1 13 GLU HA H -12.867 -2.271 -0.483 1.00 . A A . 510 GLU HA 1 1 13 8400 1 1 13 GLU HB2 H -12.369 -4.470 -1.597 1.00 . A A . 510 GLU HB2 1 1 13 8401 1 1 13 GLU HB3 H -10.744 -4.366 -0.937 1.00 . A A . 510 GLU HB3 1 1 13 8402 1 1 13 GLU HG2 H -11.964 -5.780 0.498 1.00 . A A . 510 GLU HG2 1 1 13 8403 1 1 13 GLU HG3 H -11.787 -4.244 1.342 1.00 . A A . 510 GLU HG3 1 1 13 8404 1 1 13 GLU N N -11.646 -2.039 -2.128 1.00 . A A . 510 GLU N 1 1 13 8405 1 1 13 GLU O O -10.939 -2.256 1.431 1.00 . A A . 510 GLU O 1 1 13 8406 1 1 13 GLU OE1 O -14.277 -3.595 1.067 1.00 . A A . 510 GLU OE1 1 1 13 8407 1 1 13 GLU OE2 O -14.432 -5.688 0.433 1.00 . A A . 510 GLU OE2 1 1 13 8408 1 1 14 ALA C C -9.430 0.133 1.808 1.00 . A A . 511 ALA C 1 1 13 8409 1 1 14 ALA CA C -8.893 -0.552 0.555 1.00 . A A . 511 ALA CA 1 1 13 8410 1 1 14 ALA CB C -8.093 0.437 -0.263 1.00 . A A . 511 ALA CB 1 1 13 8411 1 1 14 ALA H H -9.979 -0.933 -1.213 1.00 . A A . 511 ALA H 1 1 13 8412 1 1 14 ALA HA H -8.222 -1.344 0.858 1.00 . A A . 511 ALA HA 1 1 13 8413 1 1 14 ALA HB1 H -8.728 1.259 -0.556 1.00 . A A . 511 ALA HB1 1 1 13 8414 1 1 14 ALA HB2 H -7.269 0.810 0.327 1.00 . A A . 511 ALA HB2 1 1 13 8415 1 1 14 ALA HB3 H -7.708 -0.053 -1.145 1.00 . A A . 511 ALA HB3 1 1 13 8416 1 1 14 ALA N N -9.944 -1.151 -0.263 1.00 . A A . 511 ALA N 1 1 13 8417 1 1 14 ALA O O -10.572 0.601 1.849 1.00 . A A . 511 ALA O 1 1 13 8418 1 1 15 MET C C -7.714 1.034 4.989 1.00 . A A . 512 MET C 1 1 13 8419 1 1 15 MET CA C -8.940 0.713 4.126 1.00 . A A . 512 MET CA 1 1 13 8420 1 1 15 MET CB C -9.822 -0.311 4.848 1.00 . A A . 512 MET CB 1 1 13 8421 1 1 15 MET CE C -11.455 -3.081 4.651 1.00 . A A . 512 MET CE 1 1 13 8422 1 1 15 MET CG C -9.137 -1.639 5.124 1.00 . A A . 512 MET CG 1 1 13 8423 1 1 15 MET H H -7.645 -0.066 2.648 1.00 . A A . 512 MET H 1 1 13 8424 1 1 15 MET HA H -9.509 1.623 4.002 1.00 . A A . 512 MET HA 1 1 13 8425 1 1 15 MET HB2 H -10.132 0.107 5.791 1.00 . A A . 512 MET HB2 1 1 13 8426 1 1 15 MET HB3 H -10.697 -0.502 4.245 1.00 . A A . 512 MET HB3 1 1 13 8427 1 1 15 MET HE1 H -10.975 -3.481 3.768 1.00 . A A . 512 MET HE1 1 1 13 8428 1 1 15 MET HE2 H -12.202 -3.777 5.000 1.00 . A A . 512 MET HE2 1 1 13 8429 1 1 15 MET HE3 H -11.927 -2.140 4.408 1.00 . A A . 512 MET HE3 1 1 13 8430 1 1 15 MET HG2 H -8.804 -2.060 4.187 1.00 . A A . 512 MET HG2 1 1 13 8431 1 1 15 MET HG3 H -8.281 -1.461 5.761 1.00 . A A . 512 MET HG3 1 1 13 8432 1 1 15 MET N N -8.566 0.212 2.810 1.00 . A A . 512 MET N 1 1 13 8433 1 1 15 MET O O -7.816 1.794 5.947 1.00 . A A . 512 MET O 1 1 13 8434 1 1 15 MET SD S -10.231 -2.823 5.935 1.00 . A A . 512 MET SD 1 1 13 8435 1 1 16 SER C C -4.225 1.227 4.609 1.00 . A A . 513 SER C 1 1 13 8436 1 1 16 SER CA C -5.363 0.689 5.471 1.00 . A A . 513 SER CA 1 1 13 8437 1 1 16 SER CB C -4.945 -0.595 6.190 1.00 . A A . 513 SER CB 1 1 13 8438 1 1 16 SER H H -6.492 -0.079 3.857 1.00 . A A . 513 SER H 1 1 13 8439 1 1 16 SER HA H -5.617 1.445 6.198 1.00 . A A . 513 SER HA 1 1 13 8440 1 1 16 SER HB2 H -4.639 -1.333 5.464 1.00 . A A . 513 SER HB2 1 1 13 8441 1 1 16 SER HB3 H -4.125 -0.381 6.859 1.00 . A A . 513 SER HB3 1 1 13 8442 1 1 16 SER HG H -6.782 -0.522 6.856 1.00 . A A . 513 SER HG 1 1 13 8443 1 1 16 SER N N -6.558 0.458 4.668 1.00 . A A . 513 SER N 1 1 13 8444 1 1 16 SER O O -4.187 1.000 3.400 1.00 . A A . 513 SER O 1 1 13 8445 1 1 16 SER OG O -6.025 -1.114 6.944 1.00 . A A . 513 SER OG 1 1 13 8446 1 1 17 GLU C C -0.860 1.939 5.015 1.00 . A A . 514 GLU C 1 1 13 8447 1 1 17 GLU CA C -2.178 2.549 4.539 1.00 . A A . 514 GLU CA 1 1 13 8448 1 1 17 GLU CB C -2.188 4.067 4.759 1.00 . A A . 514 GLU CB 1 1 13 8449 1 1 17 GLU CD C -2.706 5.868 6.444 1.00 . A A . 514 GLU CD 1 1 13 8450 1 1 17 GLU CG C -2.119 4.488 6.216 1.00 . A A . 514 GLU CG 1 1 13 8451 1 1 17 GLU H H -3.389 2.084 6.206 1.00 . A A . 514 GLU H 1 1 13 8452 1 1 17 GLU HA H -2.301 2.363 3.482 1.00 . A A . 514 GLU HA 1 1 13 8453 1 1 17 GLU HB2 H -1.341 4.498 4.244 1.00 . A A . 514 GLU HB2 1 1 13 8454 1 1 17 GLU HB3 H -3.095 4.472 4.334 1.00 . A A . 514 GLU HB3 1 1 13 8455 1 1 17 GLU HG2 H -2.670 3.775 6.810 1.00 . A A . 514 GLU HG2 1 1 13 8456 1 1 17 GLU HG3 H -1.085 4.496 6.529 1.00 . A A . 514 GLU HG3 1 1 13 8457 1 1 17 GLU N N -3.307 1.949 5.238 1.00 . A A . 514 GLU N 1 1 13 8458 1 1 17 GLU O O -0.771 1.424 6.133 1.00 . A A . 514 GLU O 1 1 13 8459 1 1 17 GLU OE1 O -1.980 6.875 6.283 1.00 . A A . 514 GLU OE1 1 1 13 8460 1 1 17 GLU OE2 O -3.909 5.949 6.774 1.00 . A A . 514 GLU OE2 1 1 13 8461 1 1 18 CYS C C 2.176 2.470 5.422 1.00 . A A . 515 CYS C 1 1 13 8462 1 1 18 CYS CA C 1.479 1.506 4.489 1.00 . A A . 515 CYS CA 1 1 13 8463 1 1 18 CYS CB C 2.315 1.316 3.216 1.00 . A A . 515 CYS CB 1 1 13 8464 1 1 18 CYS H H 0.000 2.388 3.277 1.00 . A A . 515 CYS H 1 1 13 8465 1 1 18 CYS HA H 1.407 0.573 5.025 1.00 . A A . 515 CYS HA 1 1 13 8466 1 1 18 CYS HB2 H 2.159 0.316 2.845 1.00 . A A . 515 CYS HB2 1 1 13 8467 1 1 18 CYS HB3 H 1.982 2.024 2.469 1.00 . A A . 515 CYS HB3 1 1 13 8468 1 1 18 CYS N N 0.148 1.989 4.157 1.00 . A A . 515 CYS N 1 1 13 8469 1 1 18 CYS O O 2.266 3.656 5.146 1.00 . A A . 515 CYS O 1 1 13 8470 1 1 18 CYS SG S 4.118 1.544 3.435 1.00 . A A . 515 CYS SG 1 1 13 8471 1 1 19 THR C C 4.889 2.784 6.873 1.00 . A A . 516 THR C 1 1 13 8472 1 1 19 THR CA C 3.480 2.718 7.446 1.00 . A A . 516 THR CA 1 1 13 8473 1 1 19 THR CB C 3.498 2.090 8.850 1.00 . A A . 516 THR CB 1 1 13 8474 1 1 19 THR CG2 C 4.164 3.018 9.856 1.00 . A A . 516 THR CG2 1 1 13 8475 1 1 19 THR H H 2.434 1.036 6.788 1.00 . A A . 516 THR H 1 1 13 8476 1 1 19 THR HA H 3.075 3.718 7.517 1.00 . A A . 516 THR HA 1 1 13 8477 1 1 19 THR HB H 4.047 1.162 8.811 1.00 . A A . 516 THR HB 1 1 13 8478 1 1 19 THR HG1 H 1.546 2.047 8.538 1.00 . A A . 516 THR HG1 1 1 13 8479 1 1 19 THR HG21 H 3.637 3.961 9.879 1.00 . A A . 516 THR HG21 1 1 13 8480 1 1 19 THR HG22 H 4.137 2.566 10.836 1.00 . A A . 516 THR HG22 1 1 13 8481 1 1 19 THR HG23 H 5.191 3.186 9.565 1.00 . A A . 516 THR HG23 1 1 13 8482 1 1 19 THR N N 2.645 1.954 6.553 1.00 . A A . 516 THR N 1 1 13 8483 1 1 19 THR O O 5.532 1.758 6.651 1.00 . A A . 516 THR O 1 1 13 8484 1 1 19 THR OG1 O 2.149 1.824 9.262 1.00 . A A . 516 THR OG1 1 1 13 8485 1 1 20 GLY C C 6.401 5.284 4.880 1.00 . A A . 517 GLY C 1 1 13 8486 1 1 20 GLY CA C 6.585 4.202 5.911 1.00 . A A . 517 GLY CA 1 1 13 8487 1 1 20 GLY H H 4.859 4.763 6.992 1.00 . A A . 517 GLY H 1 1 13 8488 1 1 20 GLY HA2 H 7.364 4.491 6.601 1.00 . A A . 517 GLY HA2 1 1 13 8489 1 1 20 GLY HA3 H 6.865 3.284 5.416 1.00 . A A . 517 GLY HA3 1 1 13 8490 1 1 20 GLY N N 5.351 3.995 6.640 1.00 . A A . 517 GLY N 1 1 13 8491 1 1 20 GLY O O 7.332 6.024 4.557 1.00 . A A . 517 GLY O 1 1 13 8492 1 1 21 CYS C C 3.294 6.720 3.806 1.00 . A A . 518 CYS C 1 1 13 8493 1 1 21 CYS CA C 4.761 6.450 3.514 1.00 . A A . 518 CYS CA 1 1 13 8494 1 1 21 CYS CB C 4.954 6.102 2.032 1.00 . A A . 518 CYS CB 1 1 13 8495 1 1 21 CYS H H 4.538 4.646 4.570 1.00 . A A . 518 CYS H 1 1 13 8496 1 1 21 CYS HA H 5.338 7.319 3.779 1.00 . A A . 518 CYS HA 1 1 13 8497 1 1 21 CYS HB2 H 4.741 6.974 1.435 1.00 . A A . 518 CYS HB2 1 1 13 8498 1 1 21 CYS HB3 H 5.979 5.804 1.867 1.00 . A A . 518 CYS HB3 1 1 13 8499 1 1 21 CYS N N 5.186 5.358 4.364 1.00 . A A . 518 CYS N 1 1 13 8500 1 1 21 CYS O O 2.705 6.075 4.659 1.00 . A A . 518 CYS O 1 1 13 8501 1 1 21 CYS SG S 3.881 4.749 1.440 1.00 . A A . 518 CYS SG 1 1 13 8502 1 1 22 HIS C C 0.841 8.033 1.711 1.00 . A A . 519 HIS C 1 1 13 8503 1 1 22 HIS CA C 1.277 7.832 3.144 1.00 . A A . 519 HIS CA 1 1 13 8504 1 1 22 HIS CB C 0.778 8.973 4.031 1.00 . A A . 519 HIS CB 1 1 13 8505 1 1 22 HIS CD2 C 2.276 9.038 6.133 1.00 . A A . 519 HIS CD2 1 1 13 8506 1 1 22 HIS CE1 C 0.828 8.287 7.594 1.00 . A A . 519 HIS CE1 1 1 13 8507 1 1 22 HIS CG C 1.122 8.794 5.475 1.00 . A A . 519 HIS CG 1 1 13 8508 1 1 22 HIS H H 3.276 8.410 2.766 1.00 . A A . 519 HIS H 1 1 13 8509 1 1 22 HIS HA H 0.866 6.899 3.504 1.00 . A A . 519 HIS HA 1 1 13 8510 1 1 22 HIS HB2 H 1.219 9.900 3.696 1.00 . A A . 519 HIS HB2 1 1 13 8511 1 1 22 HIS HB3 H -0.296 9.040 3.951 1.00 . A A . 519 HIS HB3 1 1 13 8512 1 1 22 HIS HD1 H -0.690 8.009 6.242 1.00 . A A . 519 HIS HD1 1 1 13 8513 1 1 22 HIS HD2 H 3.201 9.385 5.689 1.00 . A A . 519 HIS HD2 1 1 13 8514 1 1 22 HIS HE1 H 0.376 7.959 8.518 1.00 . A A . 519 HIS HE1 1 1 13 8515 1 1 22 HIS HE2 H 2.663 8.968 8.199 1.00 . A A . 519 HIS HE2 1 1 13 8516 1 1 22 HIS N N 2.723 7.717 3.178 1.00 . A A . 519 HIS N 1 1 13 8517 1 1 22 HIS ND1 N 0.236 8.320 6.417 1.00 . A A . 519 HIS ND1 1 1 13 8518 1 1 22 HIS NE2 N 2.069 8.718 7.453 1.00 . A A . 519 HIS NE2 1 1 13 8519 1 1 22 HIS O O -0.172 8.671 1.433 1.00 . A A . 519 HIS O 1 1 13 8520 1 1 23 LYS C C 0.534 6.565 -1.197 1.00 . A A . 520 LYS C 1 1 13 8521 1 1 23 LYS CA C 1.419 7.668 -0.616 1.00 . A A . 520 LYS CA 1 1 13 8522 1 1 23 LYS CB C 2.785 7.713 -1.315 1.00 . A A . 520 LYS CB 1 1 13 8523 1 1 23 LYS CD C 4.229 7.038 -3.270 1.00 . A A . 520 LYS CD 1 1 13 8524 1 1 23 LYS CE C 4.607 8.447 -3.701 1.00 . A A . 520 LYS CE 1 1 13 8525 1 1 23 LYS CG C 2.838 6.993 -2.653 1.00 . A A . 520 LYS CG 1 1 13 8526 1 1 23 LYS H H 2.428 6.977 1.070 1.00 . A A . 520 LYS H 1 1 13 8527 1 1 23 LYS HA H 0.927 8.618 -0.758 1.00 . A A . 520 LYS HA 1 1 13 8528 1 1 23 LYS HB2 H 3.054 8.745 -1.479 1.00 . A A . 520 LYS HB2 1 1 13 8529 1 1 23 LYS HB3 H 3.518 7.262 -0.662 1.00 . A A . 520 LYS HB3 1 1 13 8530 1 1 23 LYS HD2 H 4.949 6.691 -2.539 1.00 . A A . 520 LYS HD2 1 1 13 8531 1 1 23 LYS HD3 H 4.252 6.389 -4.134 1.00 . A A . 520 LYS HD3 1 1 13 8532 1 1 23 LYS HE2 H 4.575 9.093 -2.836 1.00 . A A . 520 LYS HE2 1 1 13 8533 1 1 23 LYS HE3 H 5.612 8.431 -4.097 1.00 . A A . 520 LYS HE3 1 1 13 8534 1 1 23 LYS HG2 H 2.558 5.965 -2.499 1.00 . A A . 520 LYS HG2 1 1 13 8535 1 1 23 LYS HG3 H 2.137 7.462 -3.329 1.00 . A A . 520 LYS HG3 1 1 13 8536 1 1 23 LYS HZ1 H 2.703 8.979 -4.388 1.00 . A A . 520 LYS HZ1 1 1 13 8537 1 1 23 LYS HZ2 H 3.952 9.960 -4.984 1.00 . A A . 520 LYS HZ2 1 1 13 8538 1 1 23 LYS HZ3 H 3.742 8.399 -5.600 1.00 . A A . 520 LYS HZ3 1 1 13 8539 1 1 23 LYS N N 1.638 7.494 0.799 1.00 . A A . 520 LYS N 1 1 13 8540 1 1 23 LYS NZ N 3.687 8.981 -4.738 1.00 . A A . 520 LYS NZ 1 1 13 8541 1 1 23 LYS O O -0.203 6.804 -2.158 1.00 . A A . 520 LYS O 1 1 13 8542 1 1 24 VAL C C -1.190 3.701 -0.189 1.00 . A A . 521 VAL C 1 1 13 8543 1 1 24 VAL CA C -0.163 4.234 -1.181 1.00 . A A . 521 VAL CA 1 1 13 8544 1 1 24 VAL CB C 0.758 3.066 -1.596 1.00 . A A . 521 VAL CB 1 1 13 8545 1 1 24 VAL CG1 C 1.741 3.499 -2.669 1.00 . A A . 521 VAL CG1 1 1 13 8546 1 1 24 VAL CG2 C 1.495 2.509 -0.388 1.00 . A A . 521 VAL CG2 1 1 13 8547 1 1 24 VAL H H 1.102 5.225 0.201 1.00 . A A . 521 VAL H 1 1 13 8548 1 1 24 VAL HA H -0.683 4.582 -2.061 1.00 . A A . 521 VAL HA 1 1 13 8549 1 1 24 VAL HB H 0.141 2.279 -2.005 1.00 . A A . 521 VAL HB 1 1 13 8550 1 1 24 VAL HG11 H 1.202 3.939 -3.496 1.00 . A A . 521 VAL HG11 1 1 13 8551 1 1 24 VAL HG12 H 2.424 4.225 -2.258 1.00 . A A . 521 VAL HG12 1 1 13 8552 1 1 24 VAL HG13 H 2.295 2.641 -3.018 1.00 . A A . 521 VAL HG13 1 1 13 8553 1 1 24 VAL HG21 H 0.780 2.134 0.328 1.00 . A A . 521 VAL HG21 1 1 13 8554 1 1 24 VAL HG22 H 2.144 1.704 -0.702 1.00 . A A . 521 VAL HG22 1 1 13 8555 1 1 24 VAL HG23 H 2.086 3.290 0.066 1.00 . A A . 521 VAL HG23 1 1 13 8556 1 1 24 VAL N N 0.582 5.362 -0.626 1.00 . A A . 521 VAL N 1 1 13 8557 1 1 24 VAL O O -1.093 3.933 1.017 1.00 . A A . 521 VAL O 1 1 13 8558 1 1 25 ASN C C -3.479 0.960 -0.210 1.00 . A A . 522 ASN C 1 1 13 8559 1 1 25 ASN CA C -3.242 2.433 0.103 1.00 . A A . 522 ASN CA 1 1 13 8560 1 1 25 ASN CB C -4.537 3.229 -0.098 1.00 . A A . 522 ASN CB 1 1 13 8561 1 1 25 ASN CG C -4.558 4.000 -1.405 1.00 . A A . 522 ASN CG 1 1 13 8562 1 1 25 ASN H H -2.170 2.803 -1.679 1.00 . A A . 522 ASN H 1 1 13 8563 1 1 25 ASN HA H -2.939 2.518 1.136 1.00 . A A . 522 ASN HA 1 1 13 8564 1 1 25 ASN HB2 H -5.375 2.547 -0.093 1.00 . A A . 522 ASN HB2 1 1 13 8565 1 1 25 ASN HB3 H -4.649 3.933 0.715 1.00 . A A . 522 ASN HB3 1 1 13 8566 1 1 25 ASN HD21 H -5.130 2.371 -2.395 1.00 . A A . 522 ASN HD21 1 1 13 8567 1 1 25 ASN HD22 H -4.933 3.810 -3.343 1.00 . A A . 522 ASN HD22 1 1 13 8568 1 1 25 ASN N N -2.170 2.980 -0.714 1.00 . A A . 522 ASN N 1 1 13 8569 1 1 25 ASN ND2 N -4.907 3.330 -2.488 1.00 . A A . 522 ASN ND2 1 1 13 8570 1 1 25 ASN O O -3.384 0.526 -1.361 1.00 . A A . 522 ASN O 1 1 13 8571 1 1 25 ASN OD1 O -4.232 5.184 -1.444 1.00 . A A . 522 ASN OD1 1 1 13 8572 1 1 26 TYR C C -5.371 -1.582 1.326 1.00 . A A . 523 TYR C 1 1 13 8573 1 1 26 TYR CA C -4.010 -1.231 0.738 1.00 . A A . 523 TYR CA 1 1 13 8574 1 1 26 TYR CB C -2.924 -2.003 1.493 1.00 . A A . 523 TYR CB 1 1 13 8575 1 1 26 TYR CD1 C -1.023 -2.648 -0.034 1.00 . A A . 523 TYR CD1 1 1 13 8576 1 1 26 TYR CD2 C -0.702 -0.806 1.442 1.00 . A A . 523 TYR CD2 1 1 13 8577 1 1 26 TYR CE1 C 0.260 -2.485 -0.521 1.00 . A A . 523 TYR CE1 1 1 13 8578 1 1 26 TYR CE2 C 0.582 -0.640 0.962 1.00 . A A . 523 TYR CE2 1 1 13 8579 1 1 26 TYR CG C -1.526 -1.812 0.954 1.00 . A A . 523 TYR CG 1 1 13 8580 1 1 26 TYR CZ C 1.059 -1.480 -0.020 1.00 . A A . 523 TYR CZ 1 1 13 8581 1 1 26 TYR H H -3.915 0.652 1.706 1.00 . A A . 523 TYR H 1 1 13 8582 1 1 26 TYR HA H -3.991 -1.505 -0.308 1.00 . A A . 523 TYR HA 1 1 13 8583 1 1 26 TYR HB2 H -2.920 -1.685 2.525 1.00 . A A . 523 TYR HB2 1 1 13 8584 1 1 26 TYR HB3 H -3.152 -3.058 1.454 1.00 . A A . 523 TYR HB3 1 1 13 8585 1 1 26 TYR HD1 H -1.077 -0.148 2.210 1.00 . A A . 523 TYR HD1 1 1 13 8586 1 1 26 TYR HD2 H -1.651 -3.436 -0.424 1.00 . A A . 523 TYR HD2 1 1 13 8587 1 1 26 TYR HE1 H 1.205 0.149 1.354 1.00 . A A . 523 TYR HE1 1 1 13 8588 1 1 26 TYR HE2 H 0.632 -3.147 -1.290 1.00 . A A . 523 TYR HE2 1 1 13 8589 1 1 26 TYR HH H 2.375 -1.517 -1.440 1.00 . A A . 523 TYR HH 1 1 13 8590 1 1 26 TYR N N -3.786 0.208 0.836 1.00 . A A . 523 TYR N 1 1 13 8591 1 1 26 TYR O O -6.069 -0.713 1.853 1.00 . A A . 523 TYR O 1 1 13 8592 1 1 26 TYR OH O 2.344 -1.318 -0.487 1.00 . A A . 523 TYR OH 1 1 13 8593 1 1 27 CYS C C -6.882 -4.294 2.889 1.00 . A A . 524 CYS C 1 1 13 8594 1 1 27 CYS CA C -7.039 -3.291 1.752 1.00 . A A . 524 CYS CA 1 1 13 8595 1 1 27 CYS CB C -7.857 -3.905 0.606 1.00 . A A . 524 CYS CB 1 1 13 8596 1 1 27 CYS H H -5.070 -3.531 1.013 1.00 . A A . 524 CYS H 1 1 13 8597 1 1 27 CYS HA H -7.559 -2.423 2.128 1.00 . A A . 524 CYS HA 1 1 13 8598 1 1 27 CYS HB2 H -8.906 -3.843 0.852 1.00 . A A . 524 CYS HB2 1 1 13 8599 1 1 27 CYS HB3 H -7.674 -3.334 -0.293 1.00 . A A . 524 CYS HB3 1 1 13 8600 1 1 27 CYS N N -5.727 -2.859 1.287 1.00 . A A . 524 CYS N 1 1 13 8601 1 1 27 CYS O O -7.839 -4.619 3.591 1.00 . A A . 524 CYS O 1 1 13 8602 1 1 27 CYS SG S -7.485 -5.653 0.236 1.00 . A A . 524 CYS SG 1 1 13 8603 1 1 28 SER C C -3.855 -5.636 4.420 1.00 . A A . 525 SER C 1 1 13 8604 1 1 28 SER CA C -5.340 -5.749 4.087 1.00 . A A . 525 SER CA 1 1 13 8605 1 1 28 SER CB C -5.656 -7.167 3.605 1.00 . A A . 525 SER CB 1 1 13 8606 1 1 28 SER H H -4.941 -4.486 2.467 1.00 . A A . 525 SER H 1 1 13 8607 1 1 28 SER HA H -5.925 -5.521 4.967 1.00 . A A . 525 SER HA 1 1 13 8608 1 1 28 SER HB2 H -4.995 -7.421 2.789 1.00 . A A . 525 SER HB2 1 1 13 8609 1 1 28 SER HB3 H -5.506 -7.863 4.417 1.00 . A A . 525 SER HB3 1 1 13 8610 1 1 28 SER HG H -7.295 -6.421 2.812 1.00 . A A . 525 SER HG 1 1 13 8611 1 1 28 SER N N -5.662 -4.786 3.053 1.00 . A A . 525 SER N 1 1 13 8612 1 1 28 SER O O -3.090 -5.050 3.652 1.00 . A A . 525 SER O 1 1 13 8613 1 1 28 SER OG O -6.997 -7.280 3.151 1.00 . A A . 525 SER OG 1 1 13 8614 1 1 29 THR C C -1.233 -7.109 5.055 1.00 . A A . 526 THR C 1 1 13 8615 1 1 29 THR CA C -2.045 -6.168 5.941 1.00 . A A . 526 THR CA 1 1 13 8616 1 1 29 THR CB C -1.875 -6.576 7.415 1.00 . A A . 526 THR CB 1 1 13 8617 1 1 29 THR CG2 C -0.470 -6.252 7.902 1.00 . A A . 526 THR CG2 1 1 13 8618 1 1 29 THR H H -4.101 -6.616 6.146 1.00 . A A . 526 THR H 1 1 13 8619 1 1 29 THR HA H -1.672 -5.162 5.816 1.00 . A A . 526 THR HA 1 1 13 8620 1 1 29 THR HB H -2.035 -7.642 7.505 1.00 . A A . 526 THR HB 1 1 13 8621 1 1 29 THR HG1 H -2.396 -5.172 8.699 1.00 . A A . 526 THR HG1 1 1 13 8622 1 1 29 THR HG21 H 0.256 -6.710 7.242 1.00 . A A . 526 THR HG21 1 1 13 8623 1 1 29 THR HG22 H -0.331 -5.182 7.898 1.00 . A A . 526 THR HG22 1 1 13 8624 1 1 29 THR HG23 H -0.341 -6.629 8.904 1.00 . A A . 526 THR HG23 1 1 13 8625 1 1 29 THR N N -3.448 -6.188 5.552 1.00 . A A . 526 THR N 1 1 13 8626 1 1 29 THR O O -0.041 -6.893 4.820 1.00 . A A . 526 THR O 1 1 13 8627 1 1 29 THR OG1 O -2.834 -5.882 8.222 1.00 . A A . 526 THR OG1 1 1 13 8628 1 1 30 PHE C C -0.736 -8.421 2.410 1.00 . A A . 527 PHE C 1 1 13 8629 1 1 30 PHE CA C -1.262 -9.107 3.667 1.00 . A A . 527 PHE CA 1 1 13 8630 1 1 30 PHE CB C -2.261 -10.209 3.297 1.00 . A A . 527 PHE CB 1 1 13 8631 1 1 30 PHE CD1 C -0.952 -12.193 2.477 1.00 . A A . 527 PHE CD1 1 1 13 8632 1 1 30 PHE CD2 C -2.186 -10.906 0.891 1.00 . A A . 527 PHE CD2 1 1 13 8633 1 1 30 PHE CE1 C -0.521 -13.028 1.463 1.00 . A A . 527 PHE CE1 1 1 13 8634 1 1 30 PHE CE2 C -1.760 -11.734 -0.124 1.00 . A A . 527 PHE CE2 1 1 13 8635 1 1 30 PHE CG C -1.790 -11.124 2.201 1.00 . A A . 527 PHE CG 1 1 13 8636 1 1 30 PHE CZ C -0.923 -12.798 0.161 1.00 . A A . 527 PHE CZ 1 1 13 8637 1 1 30 PHE H H -2.835 -8.280 4.806 1.00 . A A . 527 PHE H 1 1 13 8638 1 1 30 PHE HA H -0.431 -9.549 4.198 1.00 . A A . 527 PHE HA 1 1 13 8639 1 1 30 PHE HB2 H -2.457 -10.815 4.169 1.00 . A A . 527 PHE HB2 1 1 13 8640 1 1 30 PHE HB3 H -3.183 -9.751 2.971 1.00 . A A . 527 PHE HB3 1 1 13 8641 1 1 30 PHE HD1 H -2.838 -10.074 0.667 1.00 . A A . 527 PHE HD1 1 1 13 8642 1 1 30 PHE HD2 H -0.638 -12.372 3.494 1.00 . A A . 527 PHE HD2 1 1 13 8643 1 1 30 PHE HE1 H -2.077 -11.550 -1.138 1.00 . A A . 527 PHE HE1 1 1 13 8644 1 1 30 PHE HE2 H 0.133 -13.857 1.689 1.00 . A A . 527 PHE HE2 1 1 13 8645 1 1 30 PHE HZ H -0.589 -13.448 -0.633 1.00 . A A . 527 PHE HZ 1 1 13 8646 1 1 30 PHE N N -1.896 -8.145 4.553 1.00 . A A . 527 PHE N 1 1 13 8647 1 1 30 PHE O O 0.414 -8.631 2.023 1.00 . A A . 527 PHE O 1 1 13 8648 1 1 31 CYS C C 0.012 -5.996 0.806 1.00 . A A . 528 CYS C 1 1 13 8649 1 1 31 CYS CA C -1.177 -6.915 0.559 1.00 . A A . 528 CYS CA 1 1 13 8650 1 1 31 CYS CB C -2.344 -6.112 0.002 1.00 . A A . 528 CYS CB 1 1 13 8651 1 1 31 CYS H H -2.450 -7.413 2.168 1.00 . A A . 528 CYS H 1 1 13 8652 1 1 31 CYS HA H -0.890 -7.694 -0.128 1.00 . A A . 528 CYS HA 1 1 13 8653 1 1 31 CYS HB2 H -2.306 -5.108 0.402 1.00 . A A . 528 CYS HB2 1 1 13 8654 1 1 31 CYS HB3 H -2.262 -6.069 -1.074 1.00 . A A . 528 CYS HB3 1 1 13 8655 1 1 31 CYS N N -1.564 -7.580 1.792 1.00 . A A . 528 CYS N 1 1 13 8656 1 1 31 CYS O O 0.891 -5.866 -0.043 1.00 . A A . 528 CYS O 1 1 13 8657 1 1 31 CYS SG S -3.973 -6.806 0.406 1.00 . A A . 528 CYS SG 1 1 13 8658 1 1 32 GLN C C 2.444 -5.160 2.271 1.00 . A A . 529 GLN C 1 1 13 8659 1 1 32 GLN CA C 1.096 -4.453 2.357 1.00 . A A . 529 GLN CA 1 1 13 8660 1 1 32 GLN CB C 0.868 -3.929 3.784 1.00 . A A . 529 GLN CB 1 1 13 8661 1 1 32 GLN CD C 2.596 -2.143 4.323 1.00 . A A . 529 GLN CD 1 1 13 8662 1 1 32 GLN CG C 2.152 -3.576 4.529 1.00 . A A . 529 GLN CG 1 1 13 8663 1 1 32 GLN H H -0.698 -5.541 2.617 1.00 . A A . 529 GLN H 1 1 13 8664 1 1 32 GLN HA H 1.071 -3.631 1.660 1.00 . A A . 529 GLN HA 1 1 13 8665 1 1 32 GLN HB2 H 0.255 -3.039 3.735 1.00 . A A . 529 GLN HB2 1 1 13 8666 1 1 32 GLN HB3 H 0.344 -4.683 4.352 1.00 . A A . 529 GLN HB3 1 1 13 8667 1 1 32 GLN HE21 H 3.564 -2.633 2.654 1.00 . A A . 529 GLN HE21 1 1 13 8668 1 1 32 GLN HE22 H 3.625 -0.958 3.103 1.00 . A A . 529 GLN HE22 1 1 13 8669 1 1 32 GLN HG2 H 1.992 -3.732 5.585 1.00 . A A . 529 GLN HG2 1 1 13 8670 1 1 32 GLN HG3 H 2.939 -4.232 4.189 1.00 . A A . 529 GLN HG3 1 1 13 8671 1 1 32 GLN N N 0.024 -5.368 1.978 1.00 . A A . 529 GLN N 1 1 13 8672 1 1 32 GLN NE2 N 3.339 -1.889 3.256 1.00 . A A . 529 GLN NE2 1 1 13 8673 1 1 32 GLN O O 3.402 -4.642 1.694 1.00 . A A . 529 GLN O 1 1 13 8674 1 1 32 GLN OE1 O 2.266 -1.270 5.119 1.00 . A A . 529 GLN OE1 1 1 13 8675 1 1 33 ARG C C 4.010 -7.734 1.496 1.00 . A A . 530 ARG C 1 1 13 8676 1 1 33 ARG CA C 3.728 -7.126 2.869 1.00 . A A . 530 ARG CA 1 1 13 8677 1 1 33 ARG CB C 3.697 -8.212 3.942 1.00 . A A . 530 ARG CB 1 1 13 8678 1 1 33 ARG CD C 4.388 -8.683 6.307 1.00 . A A . 530 ARG CD 1 1 13 8679 1 1 33 ARG CG C 3.772 -7.667 5.357 1.00 . A A . 530 ARG CG 1 1 13 8680 1 1 33 ARG CZ C 6.625 -9.657 6.723 1.00 . A A . 530 ARG CZ 1 1 13 8681 1 1 33 ARG H H 1.679 -6.709 3.268 1.00 . A A . 530 ARG H 1 1 13 8682 1 1 33 ARG HA H 4.525 -6.430 3.094 1.00 . A A . 530 ARG HA 1 1 13 8683 1 1 33 ARG HB2 H 2.776 -8.767 3.842 1.00 . A A . 530 ARG HB2 1 1 13 8684 1 1 33 ARG HB3 H 4.530 -8.880 3.789 1.00 . A A . 530 ARG HB3 1 1 13 8685 1 1 33 ARG HD2 H 4.357 -8.283 7.310 1.00 . A A . 530 ARG HD2 1 1 13 8686 1 1 33 ARG HD3 H 3.811 -9.595 6.265 1.00 . A A . 530 ARG HD3 1 1 13 8687 1 1 33 ARG HE H 6.102 -8.638 5.079 1.00 . A A . 530 ARG HE 1 1 13 8688 1 1 33 ARG HG2 H 4.378 -6.774 5.358 1.00 . A A . 530 ARG HG2 1 1 13 8689 1 1 33 ARG HG3 H 2.774 -7.429 5.692 1.00 . A A . 530 ARG HG3 1 1 13 8690 1 1 33 ARG HH11 H 5.263 -10.053 8.176 1.00 . A A . 530 ARG HH11 1 1 13 8691 1 1 33 ARG HH12 H 6.862 -10.682 8.463 1.00 . A A . 530 ARG HH12 1 1 13 8692 1 1 33 ARG HH21 H 8.193 -9.458 5.445 1.00 . A A . 530 ARG HH21 1 1 13 8693 1 1 33 ARG HH22 H 8.530 -10.333 6.908 1.00 . A A . 530 ARG HH22 1 1 13 8694 1 1 33 ARG N N 2.502 -6.346 2.864 1.00 . A A . 530 ARG N 1 1 13 8695 1 1 33 ARG NE N 5.778 -8.980 5.950 1.00 . A A . 530 ARG NE 1 1 13 8696 1 1 33 ARG NH1 N 6.218 -10.170 7.877 1.00 . A A . 530 ARG NH1 1 1 13 8697 1 1 33 ARG NH2 N 7.882 -9.834 6.327 1.00 . A A . 530 ARG NH2 1 1 13 8698 1 1 33 ARG O O 5.165 -7.944 1.127 1.00 . A A . 530 ARG O 1 1 13 8699 1 1 34 LYS C C 3.638 -7.664 -1.589 1.00 . A A . 531 LYS C 1 1 13 8700 1 1 34 LYS CA C 3.086 -8.652 -0.562 1.00 . A A . 531 LYS CA 1 1 13 8701 1 1 34 LYS CB C 1.726 -9.213 -1.005 1.00 . A A . 531 LYS CB 1 1 13 8702 1 1 34 LYS CD C 1.900 -9.623 -3.496 1.00 . A A . 531 LYS CD 1 1 13 8703 1 1 34 LYS CE C 1.945 -10.684 -4.582 1.00 . A A . 531 LYS CE 1 1 13 8704 1 1 34 LYS CG C 1.795 -10.254 -2.117 1.00 . A A . 531 LYS CG 1 1 13 8705 1 1 34 LYS H H 2.057 -7.786 1.080 1.00 . A A . 531 LYS H 1 1 13 8706 1 1 34 LYS HA H 3.784 -9.471 -0.457 1.00 . A A . 531 LYS HA 1 1 13 8707 1 1 34 LYS HB2 H 1.245 -9.669 -0.152 1.00 . A A . 531 LYS HB2 1 1 13 8708 1 1 34 LYS HB3 H 1.113 -8.393 -1.351 1.00 . A A . 531 LYS HB3 1 1 13 8709 1 1 34 LYS HD2 H 1.041 -8.990 -3.659 1.00 . A A . 531 LYS HD2 1 1 13 8710 1 1 34 LYS HD3 H 2.802 -9.030 -3.546 1.00 . A A . 531 LYS HD3 1 1 13 8711 1 1 34 LYS HE2 H 2.846 -11.266 -4.459 1.00 . A A . 531 LYS HE2 1 1 13 8712 1 1 34 LYS HE3 H 1.084 -11.328 -4.473 1.00 . A A . 531 LYS HE3 1 1 13 8713 1 1 34 LYS HG2 H 2.662 -10.877 -1.956 1.00 . A A . 531 LYS HG2 1 1 13 8714 1 1 34 LYS HG3 H 0.903 -10.865 -2.078 1.00 . A A . 531 LYS HG3 1 1 13 8715 1 1 34 LYS HZ1 H 2.803 -9.531 -6.102 1.00 . A A . 531 LYS HZ1 1 1 13 8716 1 1 34 LYS HZ2 H 1.891 -10.849 -6.660 1.00 . A A . 531 LYS HZ2 1 1 13 8717 1 1 34 LYS HZ3 H 1.106 -9.476 -6.060 1.00 . A A . 531 LYS HZ3 1 1 13 8718 1 1 34 LYS N N 2.952 -8.012 0.743 1.00 . A A . 531 LYS N 1 1 13 8719 1 1 34 LYS NZ N 1.938 -10.092 -5.944 1.00 . A A . 531 LYS NZ 1 1 13 8720 1 1 34 LYS O O 4.530 -7.996 -2.369 1.00 . A A . 531 LYS O 1 1 13 8721 1 1 35 ASP C C 4.942 -4.844 -2.029 1.00 . A A . 532 ASP C 1 1 13 8722 1 1 35 ASP CA C 3.583 -5.384 -2.465 1.00 . A A . 532 ASP CA 1 1 13 8723 1 1 35 ASP CB C 2.546 -4.255 -2.483 1.00 . A A . 532 ASP CB 1 1 13 8724 1 1 35 ASP CG C 2.889 -3.133 -3.449 1.00 . A A . 532 ASP CG 1 1 13 8725 1 1 35 ASP H H 2.379 -6.239 -0.951 1.00 . A A . 532 ASP H 1 1 13 8726 1 1 35 ASP HA H 3.666 -5.789 -3.462 1.00 . A A . 532 ASP HA 1 1 13 8727 1 1 35 ASP HB2 H 1.591 -4.666 -2.765 1.00 . A A . 532 ASP HB2 1 1 13 8728 1 1 35 ASP HB3 H 2.468 -3.836 -1.491 1.00 . A A . 532 ASP HB3 1 1 13 8729 1 1 35 ASP N N 3.124 -6.442 -1.565 1.00 . A A . 532 ASP N 1 1 13 8730 1 1 35 ASP O O 5.626 -4.166 -2.791 1.00 . A A . 532 ASP O 1 1 13 8731 1 1 35 ASP OD1 O 3.125 -3.415 -4.644 1.00 . A A . 532 ASP OD1 1 1 13 8732 1 1 35 ASP OD2 O 2.915 -1.961 -3.015 1.00 . A A . 532 ASP OD2 1 1 13 8733 1 1 36 TRP C C 7.799 -4.997 -1.081 1.00 . A A . 533 TRP C 1 1 13 8734 1 1 36 TRP CA C 6.574 -4.690 -0.217 1.00 . A A . 533 TRP CA 1 1 13 8735 1 1 36 TRP CB C 6.771 -5.264 1.189 1.00 . A A . 533 TRP CB 1 1 13 8736 1 1 36 TRP CD1 C 9.086 -5.194 2.288 1.00 . A A . 533 TRP CD1 1 1 13 8737 1 1 36 TRP CD2 C 7.971 -3.254 2.349 1.00 . A A . 533 TRP CD2 1 1 13 8738 1 1 36 TRP CE2 C 9.216 -3.074 2.973 1.00 . A A . 533 TRP CE2 1 1 13 8739 1 1 36 TRP CE3 C 7.095 -2.167 2.265 1.00 . A A . 533 TRP CE3 1 1 13 8740 1 1 36 TRP CG C 7.905 -4.617 1.921 1.00 . A A . 533 TRP CG 1 1 13 8741 1 1 36 TRP CH2 C 8.736 -0.806 3.412 1.00 . A A . 533 TRP CH2 1 1 13 8742 1 1 36 TRP CZ2 C 9.610 -1.854 3.509 1.00 . A A . 533 TRP CZ2 1 1 13 8743 1 1 36 TRP CZ3 C 7.488 -0.955 2.798 1.00 . A A . 533 TRP CZ3 1 1 13 8744 1 1 36 TRP H H 4.784 -5.828 -0.308 1.00 . A A . 533 TRP H 1 1 13 8745 1 1 36 TRP HA H 6.474 -3.618 -0.131 1.00 . A A . 533 TRP HA 1 1 13 8746 1 1 36 TRP HB2 H 5.871 -5.114 1.767 1.00 . A A . 533 TRP HB2 1 1 13 8747 1 1 36 TRP HB3 H 6.978 -6.321 1.116 1.00 . A A . 533 TRP HB3 1 1 13 8748 1 1 36 TRP HD1 H 9.345 -6.225 2.101 1.00 . A A . 533 TRP HD1 1 1 13 8749 1 1 36 TRP HE1 H 10.779 -4.444 3.286 1.00 . A A . 533 TRP HE1 1 1 13 8750 1 1 36 TRP HE3 H 6.128 -2.264 1.795 1.00 . A A . 533 TRP HE3 1 1 13 8751 1 1 36 TRP HH2 H 9.002 0.160 3.816 1.00 . A A . 533 TRP HH2 1 1 13 8752 1 1 36 TRP HZ2 H 10.573 -1.722 3.981 1.00 . A A . 533 TRP HZ2 1 1 13 8753 1 1 36 TRP HZ3 H 6.826 -0.104 2.741 1.00 . A A . 533 TRP HZ3 1 1 13 8754 1 1 36 TRP N N 5.344 -5.207 -0.818 1.00 . A A . 533 TRP N 1 1 13 8755 1 1 36 TRP NE1 N 9.878 -4.272 2.927 1.00 . A A . 533 TRP NE1 1 1 13 8756 1 1 36 TRP O O 8.763 -4.245 -1.095 1.00 . A A . 533 TRP O 1 1 13 8757 1 1 37 LYS C C 9.170 -5.454 -3.716 1.00 . A A . 534 LYS C 1 1 13 8758 1 1 37 LYS CA C 8.848 -6.516 -2.664 1.00 . A A . 534 LYS CA 1 1 13 8759 1 1 37 LYS CB C 8.528 -7.856 -3.319 1.00 . A A . 534 LYS CB 1 1 13 8760 1 1 37 LYS CD C 7.848 -10.257 -3.006 1.00 . A A . 534 LYS CD 1 1 13 8761 1 1 37 LYS CE C 8.981 -10.778 -3.874 1.00 . A A . 534 LYS CE 1 1 13 8762 1 1 37 LYS CG C 8.218 -8.955 -2.316 1.00 . A A . 534 LYS CG 1 1 13 8763 1 1 37 LYS H H 6.941 -6.643 -1.758 1.00 . A A . 534 LYS H 1 1 13 8764 1 1 37 LYS HA H 9.739 -6.615 -2.066 1.00 . A A . 534 LYS HA 1 1 13 8765 1 1 37 LYS HB2 H 7.672 -7.733 -3.966 1.00 . A A . 534 LYS HB2 1 1 13 8766 1 1 37 LYS HB3 H 9.376 -8.167 -3.912 1.00 . A A . 534 LYS HB3 1 1 13 8767 1 1 37 LYS HD2 H 7.620 -10.997 -2.253 1.00 . A A . 534 LYS HD2 1 1 13 8768 1 1 37 LYS HD3 H 6.977 -10.090 -3.625 1.00 . A A . 534 LYS HD3 1 1 13 8769 1 1 37 LYS HE2 H 8.672 -11.709 -4.326 1.00 . A A . 534 LYS HE2 1 1 13 8770 1 1 37 LYS HE3 H 9.186 -10.052 -4.649 1.00 . A A . 534 LYS HE3 1 1 13 8771 1 1 37 LYS HG2 H 9.088 -9.121 -1.698 1.00 . A A . 534 LYS HG2 1 1 13 8772 1 1 37 LYS HG3 H 7.392 -8.638 -1.698 1.00 . A A . 534 LYS HG3 1 1 13 8773 1 1 37 LYS HZ1 H 10.019 -11.610 -2.258 1.00 . A A . 534 LYS HZ1 1 1 13 8774 1 1 37 LYS HZ2 H 10.935 -11.492 -3.683 1.00 . A A . 534 LYS HZ2 1 1 13 8775 1 1 37 LYS HZ3 H 10.618 -10.105 -2.758 1.00 . A A . 534 LYS HZ3 1 1 13 8776 1 1 37 LYS N N 7.745 -6.096 -1.805 1.00 . A A . 534 LYS N 1 1 13 8777 1 1 37 LYS NZ N 10.221 -11.013 -3.088 1.00 . A A . 534 LYS NZ 1 1 13 8778 1 1 37 LYS O O 10.343 -5.217 -4.012 1.00 . A A . 534 LYS O 1 1 13 8779 1 1 38 ASP C C 8.387 -2.390 -4.383 1.00 . A A . 535 ASP C 1 1 13 8780 1 1 38 ASP CA C 8.395 -3.679 -5.164 1.00 . A A . 535 ASP CA 1 1 13 8781 1 1 38 ASP CB C 7.321 -3.589 -6.244 1.00 . A A . 535 ASP CB 1 1 13 8782 1 1 38 ASP CG C 7.511 -2.393 -7.159 1.00 . A A . 535 ASP CG 1 1 13 8783 1 1 38 ASP H H 7.235 -5.078 -4.061 1.00 . A A . 535 ASP H 1 1 13 8784 1 1 38 ASP HA H 9.364 -3.824 -5.615 1.00 . A A . 535 ASP HA 1 1 13 8785 1 1 38 ASP HB2 H 7.347 -4.472 -6.835 1.00 . A A . 535 ASP HB2 1 1 13 8786 1 1 38 ASP HB3 H 6.353 -3.506 -5.773 1.00 . A A . 535 ASP HB3 1 1 13 8787 1 1 38 ASP N N 8.155 -4.805 -4.265 1.00 . A A . 535 ASP N 1 1 13 8788 1 1 38 ASP O O 9.207 -1.506 -4.569 1.00 . A A . 535 ASP O 1 1 13 8789 1 1 38 ASP OD1 O 8.337 -2.475 -8.090 1.00 . A A . 535 ASP OD1 1 1 13 8790 1 1 38 ASP OD2 O 6.830 -1.367 -6.954 1.00 . A A . 535 ASP OD2 1 1 13 8791 1 1 39 HIS C C 8.358 -0.645 -1.951 1.00 . A A . 536 HIS C 1 1 13 8792 1 1 39 HIS CA C 7.181 -1.084 -2.802 1.00 . A A . 536 HIS CA 1 1 13 8793 1 1 39 HIS CB C 5.917 -1.229 -1.956 1.00 . A A . 536 HIS CB 1 1 13 8794 1 1 39 HIS CD2 C 5.066 0.321 -0.070 1.00 . A A . 536 HIS CD2 1 1 13 8795 1 1 39 HIS CE1 C 4.804 2.149 -1.202 1.00 . A A . 536 HIS CE1 1 1 13 8796 1 1 39 HIS CG C 5.431 0.047 -1.347 1.00 . A A . 536 HIS CG 1 1 13 8797 1 1 39 HIS H H 6.950 -3.107 -3.256 1.00 . A A . 536 HIS H 1 1 13 8798 1 1 39 HIS HA H 7.008 -0.342 -3.576 1.00 . A A . 536 HIS HA 1 1 13 8799 1 1 39 HIS HB2 H 5.126 -1.618 -2.576 1.00 . A A . 536 HIS HB2 1 1 13 8800 1 1 39 HIS HB3 H 6.112 -1.928 -1.154 1.00 . A A . 536 HIS HB3 1 1 13 8801 1 1 39 HIS HD1 H 5.413 1.342 -3.014 1.00 . A A . 536 HIS HD1 1 1 13 8802 1 1 39 HIS HD2 H 5.073 -0.373 0.758 1.00 . A A . 536 HIS HD2 1 1 13 8803 1 1 39 HIS HE1 H 4.577 3.170 -1.470 1.00 . A A . 536 HIS HE1 1 1 13 8804 1 1 39 HIS N N 7.465 -2.313 -3.476 1.00 . A A . 536 HIS N 1 1 13 8805 1 1 39 HIS ND1 N 5.257 1.218 -2.054 1.00 . A A . 536 HIS ND1 1 1 13 8806 1 1 39 HIS NE2 N 4.671 1.647 0.005 1.00 . A A . 536 HIS NE2 1 1 13 8807 1 1 39 HIS O O 8.584 0.536 -1.796 1.00 . A A . 536 HIS O 1 1 13 8808 1 1 40 GLN C C 11.274 -0.371 -1.234 1.00 . A A . 537 GLN C 1 1 13 8809 1 1 40 GLN CA C 10.232 -1.245 -0.529 1.00 . A A . 537 GLN CA 1 1 13 8810 1 1 40 GLN CB C 10.901 -2.494 0.049 1.00 . A A . 537 GLN CB 1 1 13 8811 1 1 40 GLN CD C 12.198 -4.604 -0.370 1.00 . A A . 537 GLN CD 1 1 13 8812 1 1 40 GLN CG C 11.691 -3.306 -0.961 1.00 . A A . 537 GLN CG 1 1 13 8813 1 1 40 GLN H H 8.915 -2.546 -1.599 1.00 . A A . 537 GLN H 1 1 13 8814 1 1 40 GLN HA H 9.816 -0.665 0.280 1.00 . A A . 537 GLN HA 1 1 13 8815 1 1 40 GLN HB2 H 11.578 -2.190 0.834 1.00 . A A . 537 GLN HB2 1 1 13 8816 1 1 40 GLN HB3 H 10.140 -3.131 0.473 1.00 . A A . 537 GLN HB3 1 1 13 8817 1 1 40 GLN HE21 H 10.523 -5.518 -0.900 1.00 . A A . 537 GLN HE21 1 1 13 8818 1 1 40 GLN HE22 H 11.697 -6.508 -0.098 1.00 . A A . 537 GLN HE22 1 1 13 8819 1 1 40 GLN HG2 H 11.058 -3.530 -1.813 1.00 . A A . 537 GLN HG2 1 1 13 8820 1 1 40 GLN HG3 H 12.538 -2.721 -1.284 1.00 . A A . 537 GLN HG3 1 1 13 8821 1 1 40 GLN N N 9.117 -1.593 -1.413 1.00 . A A . 537 GLN N 1 1 13 8822 1 1 40 GLN NE2 N 11.391 -5.645 -0.466 1.00 . A A . 537 GLN NE2 1 1 13 8823 1 1 40 GLN O O 11.868 0.506 -0.606 1.00 . A A . 537 GLN O 1 1 13 8824 1 1 40 GLN OE1 O 13.296 -4.667 0.184 1.00 . A A . 537 GLN OE1 1 1 13 8825 1 1 41 HIS C C 11.878 1.571 -3.623 1.00 . A A . 538 HIS C 1 1 13 8826 1 1 41 HIS CA C 12.473 0.219 -3.246 1.00 . A A . 538 HIS CA 1 1 13 8827 1 1 41 HIS CB C 13.050 -0.500 -4.488 1.00 . A A . 538 HIS CB 1 1 13 8828 1 1 41 HIS CD2 C 11.358 -1.531 -6.158 1.00 . A A . 538 HIS CD2 1 1 13 8829 1 1 41 HIS CE1 C 11.254 0.149 -7.534 1.00 . A A . 538 HIS CE1 1 1 13 8830 1 1 41 HIS CG C 12.164 -0.539 -5.706 1.00 . A A . 538 HIS CG 1 1 13 8831 1 1 41 HIS H H 11.027 -1.321 -2.985 1.00 . A A . 538 HIS H 1 1 13 8832 1 1 41 HIS HA H 13.288 0.412 -2.564 1.00 . A A . 538 HIS HA 1 1 13 8833 1 1 41 HIS HB2 H 13.964 -0.007 -4.773 1.00 . A A . 538 HIS HB2 1 1 13 8834 1 1 41 HIS HB3 H 13.279 -1.521 -4.216 1.00 . A A . 538 HIS HB3 1 1 13 8835 1 1 41 HIS HD2 H 11.149 -2.471 -5.665 1.00 . A A . 538 HIS HD2 1 1 13 8836 1 1 41 HIS HE1 H 10.959 0.776 -8.360 1.00 . A A . 538 HIS HE1 1 1 13 8837 1 1 41 HIS HE2 H 9.988 -1.479 -7.752 1.00 . A A . 538 HIS HE2 1 1 13 8838 1 1 41 HIS N N 11.500 -0.594 -2.527 1.00 . A A . 538 HIS N 1 1 13 8839 1 1 41 HIS ND1 N 12.094 0.521 -6.581 1.00 . A A . 538 HIS ND1 1 1 13 8840 1 1 41 HIS NE2 N 10.785 -1.085 -7.321 1.00 . A A . 538 HIS NE2 1 1 13 8841 1 1 41 HIS O O 12.615 2.522 -3.877 1.00 . A A . 538 HIS O 1 1 13 8842 1 1 42 ILE C C 9.583 3.723 -2.689 1.00 . A A . 539 ILE C 1 1 13 8843 1 1 42 ILE CA C 9.902 2.935 -3.972 1.00 . A A . 539 ILE CA 1 1 13 8844 1 1 42 ILE CB C 8.624 2.717 -4.853 1.00 . A A . 539 ILE CB 1 1 13 8845 1 1 42 ILE CD1 C 6.638 3.934 -3.809 1.00 . A A . 539 ILE CD1 1 1 13 8846 1 1 42 ILE CG1 C 7.331 2.606 -4.043 1.00 . A A . 539 ILE CG1 1 1 13 8847 1 1 42 ILE CG2 C 8.780 1.480 -5.715 1.00 . A A . 539 ILE CG2 1 1 13 8848 1 1 42 ILE H H 9.993 0.872 -3.483 1.00 . A A . 539 ILE H 1 1 13 8849 1 1 42 ILE HA H 10.610 3.514 -4.552 1.00 . A A . 539 ILE HA 1 1 13 8850 1 1 42 ILE HB H 8.537 3.549 -5.519 1.00 . A A . 539 ILE HB 1 1 13 8851 1 1 42 ILE HD11 H 6.391 4.386 -4.759 1.00 . A A . 539 ILE HD11 1 1 13 8852 1 1 42 ILE HD12 H 5.735 3.772 -3.241 1.00 . A A . 539 ILE HD12 1 1 13 8853 1 1 42 ILE HD13 H 7.297 4.589 -3.259 1.00 . A A . 539 ILE HD13 1 1 13 8854 1 1 42 ILE HG12 H 6.644 1.968 -4.569 1.00 . A A . 539 ILE HG12 1 1 13 8855 1 1 42 ILE HG13 H 7.554 2.172 -3.078 1.00 . A A . 539 ILE HG13 1 1 13 8856 1 1 42 ILE HG21 H 8.949 0.620 -5.082 1.00 . A A . 539 ILE HG21 1 1 13 8857 1 1 42 ILE HG22 H 7.882 1.329 -6.297 1.00 . A A . 539 ILE HG22 1 1 13 8858 1 1 42 ILE HG23 H 9.622 1.609 -6.377 1.00 . A A . 539 ILE HG23 1 1 13 8859 1 1 42 ILE N N 10.549 1.668 -3.650 1.00 . A A . 539 ILE N 1 1 13 8860 1 1 42 ILE O O 9.825 4.927 -2.611 1.00 . A A . 539 ILE O 1 1 13 8861 1 1 43 CYS C C 9.784 4.374 0.212 1.00 . A A . 540 CYS C 1 1 13 8862 1 1 43 CYS CA C 8.625 3.631 -0.445 1.00 . A A . 540 CYS CA 1 1 13 8863 1 1 43 CYS CB C 8.138 2.525 0.493 1.00 . A A . 540 CYS CB 1 1 13 8864 1 1 43 CYS H H 8.869 2.060 -1.832 1.00 . A A . 540 CYS H 1 1 13 8865 1 1 43 CYS HA H 7.810 4.315 -0.623 1.00 . A A . 540 CYS HA 1 1 13 8866 1 1 43 CYS HB2 H 7.491 1.862 -0.060 1.00 . A A . 540 CYS HB2 1 1 13 8867 1 1 43 CYS HB3 H 8.995 1.969 0.840 1.00 . A A . 540 CYS HB3 1 1 13 8868 1 1 43 CYS N N 9.031 3.027 -1.705 1.00 . A A . 540 CYS N 1 1 13 8869 1 1 43 CYS O O 10.838 3.797 0.499 1.00 . A A . 540 CYS O 1 1 13 8870 1 1 43 CYS SG S 7.220 3.099 1.959 1.00 . A A . 540 CYS SG 1 1 13 8871 1 1 44 GLY C C 11.238 7.465 0.177 1.00 . A A . 541 GLY C 1 1 13 8872 1 1 44 GLY CA C 10.584 6.455 1.087 1.00 . A A . 541 GLY CA 1 1 13 8873 1 1 44 GLY H H 8.680 6.026 0.242 1.00 . A A . 541 GLY H 1 1 13 8874 1 1 44 GLY HA2 H 10.125 6.980 1.911 1.00 . A A . 541 GLY HA2 1 1 13 8875 1 1 44 GLY HA3 H 11.345 5.797 1.480 1.00 . A A . 541 GLY HA3 1 1 13 8876 1 1 44 GLY N N 9.570 5.653 0.435 1.00 . A A . 541 GLY N 1 1 13 8877 1 1 44 GLY O O 11.965 8.338 0.647 1.00 . A A . 541 GLY O 1 1 13 8878 1 1 45 GLN C C 10.681 9.573 -2.052 1.00 . A A . 542 GLN C 1 1 13 8879 1 1 45 GLN CA C 11.558 8.332 -2.051 1.00 . A A . 542 GLN CA 1 1 13 8880 1 1 45 GLN CB C 11.673 7.743 -3.460 1.00 . A A . 542 GLN CB 1 1 13 8881 1 1 45 GLN CD C 13.895 6.616 -2.999 1.00 . A A . 542 GLN CD 1 1 13 8882 1 1 45 GLN CG C 12.479 6.454 -3.519 1.00 . A A . 542 GLN CG 1 1 13 8883 1 1 45 GLN H H 10.434 6.635 -1.462 1.00 . A A . 542 GLN H 1 1 13 8884 1 1 45 GLN HA H 12.542 8.603 -1.698 1.00 . A A . 542 GLN HA 1 1 13 8885 1 1 45 GLN HB2 H 10.679 7.540 -3.834 1.00 . A A . 542 GLN HB2 1 1 13 8886 1 1 45 GLN HB3 H 12.147 8.469 -4.102 1.00 . A A . 542 GLN HB3 1 1 13 8887 1 1 45 GLN HE21 H 13.312 6.108 -1.172 1.00 . A A . 542 GLN HE21 1 1 13 8888 1 1 45 GLN HE22 H 14.989 6.479 -1.348 1.00 . A A . 542 GLN HE22 1 1 13 8889 1 1 45 GLN HG2 H 11.979 5.705 -2.923 1.00 . A A . 542 GLN HG2 1 1 13 8890 1 1 45 GLN HG3 H 12.524 6.123 -4.546 1.00 . A A . 542 GLN HG3 1 1 13 8891 1 1 45 GLN N N 11.003 7.362 -1.122 1.00 . A A . 542 GLN N 1 1 13 8892 1 1 45 GLN NE2 N 14.085 6.376 -1.712 1.00 . A A . 542 GLN NE2 1 1 13 8893 1 1 45 GLN O O 10.972 10.549 -1.361 1.00 . A A . 542 GLN O 1 1 13 8894 1 1 45 GLN OE1 O 14.812 6.940 -3.753 1.00 . A A . 542 GLN OE1 1 1 13 8895 1 1 46 SER C C 7.385 10.073 -2.000 1.00 . A A . 543 SER C 1 1 13 8896 1 1 46 SER CA C 8.602 10.577 -2.773 1.00 . A A . 543 SER CA 1 1 13 8897 1 1 46 SER CB C 8.212 10.981 -4.199 1.00 . A A . 543 SER CB 1 1 13 8898 1 1 46 SER H H 9.466 8.769 -3.425 1.00 . A A . 543 SER H 1 1 13 8899 1 1 46 SER HA H 9.024 11.429 -2.259 1.00 . A A . 543 SER HA 1 1 13 8900 1 1 46 SER HB2 H 9.104 11.222 -4.757 1.00 . A A . 543 SER HB2 1 1 13 8901 1 1 46 SER HB3 H 7.705 10.154 -4.675 1.00 . A A . 543 SER HB3 1 1 13 8902 1 1 46 SER HG H 7.153 12.346 -5.131 1.00 . A A . 543 SER HG 1 1 13 8903 1 1 46 SER N N 9.599 9.527 -2.810 1.00 . A A . 543 SER N 1 1 13 8904 1 1 46 SER O O 7.126 8.868 -1.962 1.00 . A A . 543 SER O 1 1 13 8905 1 1 46 SER OG O 7.353 12.109 -4.211 1.00 . A A . 543 SER OG 1 1 13 8906 1 1 47 ALA C C 4.528 11.799 -0.499 1.00 . A A . 544 ALA C 1 1 13 8907 1 1 47 ALA CA C 5.479 10.618 -0.601 1.00 . A A . 544 ALA CA 1 1 13 8908 1 1 47 ALA CB C 5.879 10.133 0.788 1.00 . A A . 544 ALA CB 1 1 13 8909 1 1 47 ALA H H 6.904 11.927 -1.445 1.00 . A A . 544 ALA H 1 1 13 8910 1 1 47 ALA HA H 4.980 9.809 -1.112 1.00 . A A . 544 ALA HA 1 1 13 8911 1 1 47 ALA HB1 H 6.390 10.927 1.313 1.00 . A A . 544 ALA HB1 1 1 13 8912 1 1 47 ALA HB2 H 4.995 9.848 1.338 1.00 . A A . 544 ALA HB2 1 1 13 8913 1 1 47 ALA HB3 H 6.537 9.282 0.697 1.00 . A A . 544 ALA HB3 1 1 13 8914 1 1 47 ALA N N 6.655 10.983 -1.376 1.00 . A A . 544 ALA N 1 1 13 8915 1 1 47 ALA O O 3.581 11.875 -1.304 1.00 . A A . 544 ALA O 1 1 13 8916 1 1 47 ALA OXT O 4.751 12.662 0.374 1.00 . A A . 544 ALA OXT 1 1 13 8917 2 2 1 ZN ZN ZN -5.540 -5.839 -0.940 1.00 . B A . 601 ZN ZN 1 1 13 8918 3 2 1 ZN ZN ZN 4.964 2.722 1.645 1.00 . C A . 602 ZN ZN 1 1 14 8919 1 1 1 GLY C C -16.162 0.770 2.032 1.00 . A A . 498 GLY C 1 1 14 8920 1 1 1 GLY CA C -16.513 -0.699 2.106 1.00 . A A . 498 GLY CA 1 1 14 8921 1 1 1 GLY H1 H -17.237 -0.665 4.061 1.00 . A A . 498 GLY H1 1 1 14 8922 1 1 1 GLY H2 H -17.801 -1.976 3.141 1.00 . A A . 498 GLY H2 1 1 14 8923 1 1 1 GLY H3 H -18.431 -0.424 2.879 1.00 . A A . 498 GLY H3 1 1 14 8924 1 1 1 GLY HA2 H -15.628 -1.258 2.369 1.00 . A A . 498 GLY HA2 1 1 14 8925 1 1 1 GLY HA3 H -16.862 -1.026 1.138 1.00 . A A . 498 GLY HA3 1 1 14 8926 1 1 1 GLY N N -17.567 -0.961 3.115 1.00 . A A . 498 GLY N 1 1 14 8927 1 1 1 GLY O O -17.033 1.604 1.788 1.00 . A A . 498 GLY O 1 1 14 8928 1 1 2 ALA C C -14.654 3.076 0.827 1.00 . A A . 499 ALA C 1 1 14 8929 1 1 2 ALA CA C -14.438 2.480 2.210 1.00 . A A . 499 ALA CA 1 1 14 8930 1 1 2 ALA CB C -12.972 2.583 2.611 1.00 . A A . 499 ALA CB 1 1 14 8931 1 1 2 ALA H H -14.241 0.386 2.455 1.00 . A A . 499 ALA H 1 1 14 8932 1 1 2 ALA HA H -15.022 3.040 2.928 1.00 . A A . 499 ALA HA 1 1 14 8933 1 1 2 ALA HB1 H -12.363 2.062 1.887 1.00 . A A . 499 ALA HB1 1 1 14 8934 1 1 2 ALA HB2 H -12.679 3.622 2.646 1.00 . A A . 499 ALA HB2 1 1 14 8935 1 1 2 ALA HB3 H -12.833 2.135 3.585 1.00 . A A . 499 ALA HB3 1 1 14 8936 1 1 2 ALA N N -14.889 1.094 2.252 1.00 . A A . 499 ALA N 1 1 14 8937 1 1 2 ALA O O -15.333 4.089 0.679 1.00 . A A . 499 ALA O 1 1 14 8938 1 1 3 MET C C -13.657 4.130 -1.968 1.00 . A A . 500 MET C 1 1 14 8939 1 1 3 MET CA C -14.256 2.771 -1.594 1.00 . A A . 500 MET CA 1 1 14 8940 1 1 3 MET CB C -15.742 2.728 -1.960 1.00 . A A . 500 MET CB 1 1 14 8941 1 1 3 MET CE C -18.511 -0.406 -1.917 1.00 . A A . 500 MET CE 1 1 14 8942 1 1 3 MET CG C -16.361 1.347 -1.805 1.00 . A A . 500 MET CG 1 1 14 8943 1 1 3 MET H H -13.456 1.683 0.037 1.00 . A A . 500 MET H 1 1 14 8944 1 1 3 MET HA H -13.747 2.016 -2.174 1.00 . A A . 500 MET HA 1 1 14 8945 1 1 3 MET HB2 H -16.280 3.415 -1.323 1.00 . A A . 500 MET HB2 1 1 14 8946 1 1 3 MET HB3 H -15.857 3.038 -2.988 1.00 . A A . 500 MET HB3 1 1 14 8947 1 1 3 MET HE1 H -18.336 -0.620 -0.873 1.00 . A A . 500 MET HE1 1 1 14 8948 1 1 3 MET HE2 H -19.551 -0.582 -2.151 1.00 . A A . 500 MET HE2 1 1 14 8949 1 1 3 MET HE3 H -17.892 -1.048 -2.525 1.00 . A A . 500 MET HE3 1 1 14 8950 1 1 3 MET HG2 H -15.827 0.657 -2.439 1.00 . A A . 500 MET HG2 1 1 14 8951 1 1 3 MET HG3 H -16.260 1.038 -0.775 1.00 . A A . 500 MET HG3 1 1 14 8952 1 1 3 MET N N -14.057 2.428 -0.179 1.00 . A A . 500 MET N 1 1 14 8953 1 1 3 MET O O -13.507 4.435 -3.149 1.00 . A A . 500 MET O 1 1 14 8954 1 1 3 MET SD S -18.108 1.309 -2.252 1.00 . A A . 500 MET SD 1 1 14 8955 1 1 4 GLU C C -11.246 6.022 -1.704 1.00 . A A . 501 GLU C 1 1 14 8956 1 1 4 GLU CA C -12.661 6.225 -1.186 1.00 . A A . 501 GLU CA 1 1 14 8957 1 1 4 GLU CB C -12.615 7.025 0.116 1.00 . A A . 501 GLU CB 1 1 14 8958 1 1 4 GLU CD C -11.788 7.134 2.494 1.00 . A A . 501 GLU CD 1 1 14 8959 1 1 4 GLU CG C -12.022 6.256 1.285 1.00 . A A . 501 GLU CG 1 1 14 8960 1 1 4 GLU H H -13.526 4.663 -0.048 1.00 . A A . 501 GLU H 1 1 14 8961 1 1 4 GLU HA H -13.233 6.772 -1.920 1.00 . A A . 501 GLU HA 1 1 14 8962 1 1 4 GLU HB2 H -12.013 7.909 -0.040 1.00 . A A . 501 GLU HB2 1 1 14 8963 1 1 4 GLU HB3 H -13.619 7.322 0.379 1.00 . A A . 501 GLU HB3 1 1 14 8964 1 1 4 GLU HG2 H -12.702 5.464 1.561 1.00 . A A . 501 GLU HG2 1 1 14 8965 1 1 4 GLU HG3 H -11.078 5.829 0.978 1.00 . A A . 501 GLU HG3 1 1 14 8966 1 1 4 GLU N N -13.314 4.935 -0.965 1.00 . A A . 501 GLU N 1 1 14 8967 1 1 4 GLU O O -10.653 6.911 -2.312 1.00 . A A . 501 GLU O 1 1 14 8968 1 1 4 GLU OE1 O -12.749 7.385 3.249 1.00 . A A . 501 GLU OE1 1 1 14 8969 1 1 4 GLU OE2 O -10.642 7.584 2.689 1.00 . A A . 501 GLU OE2 1 1 14 8970 1 1 5 GLN C C -9.361 3.069 -2.377 1.00 . A A . 502 GLN C 1 1 14 8971 1 1 5 GLN CA C -9.375 4.479 -1.818 1.00 . A A . 502 GLN CA 1 1 14 8972 1 1 5 GLN CB C -8.468 4.588 -0.591 1.00 . A A . 502 GLN CB 1 1 14 8973 1 1 5 GLN CD C -8.277 4.285 1.901 1.00 . A A . 502 GLN CD 1 1 14 8974 1 1 5 GLN CG C -9.004 3.872 0.639 1.00 . A A . 502 GLN CG 1 1 14 8975 1 1 5 GLN H H -11.291 4.157 -1.035 1.00 . A A . 502 GLN H 1 1 14 8976 1 1 5 GLN HA H -9.020 5.165 -2.574 1.00 . A A . 502 GLN HA 1 1 14 8977 1 1 5 GLN HB2 H -7.506 4.164 -0.833 1.00 . A A . 502 GLN HB2 1 1 14 8978 1 1 5 GLN HB3 H -8.340 5.632 -0.344 1.00 . A A . 502 GLN HB3 1 1 14 8979 1 1 5 GLN HE21 H -9.531 5.807 2.132 1.00 . A A . 502 GLN HE21 1 1 14 8980 1 1 5 GLN HE22 H -8.317 5.644 3.351 1.00 . A A . 502 GLN HE22 1 1 14 8981 1 1 5 GLN HG2 H -10.052 4.108 0.753 1.00 . A A . 502 GLN HG2 1 1 14 8982 1 1 5 GLN HG3 H -8.886 2.807 0.505 1.00 . A A . 502 GLN HG3 1 1 14 8983 1 1 5 GLN N N -10.729 4.835 -1.460 1.00 . A A . 502 GLN N 1 1 14 8984 1 1 5 GLN NE2 N -8.755 5.353 2.522 1.00 . A A . 502 GLN NE2 1 1 14 8985 1 1 5 GLN O O -10.242 2.266 -2.061 1.00 . A A . 502 GLN O 1 1 14 8986 1 1 5 GLN OE1 O -7.288 3.669 2.300 1.00 . A A . 502 GLN OE1 1 1 14 8987 1 1 6 SER C C -6.957 0.805 -3.468 1.00 . A A . 503 SER C 1 1 14 8988 1 1 6 SER CA C -8.283 1.461 -3.816 1.00 . A A . 503 SER CA 1 1 14 8989 1 1 6 SER CB C -8.448 1.572 -5.336 1.00 . A A . 503 SER CB 1 1 14 8990 1 1 6 SER H H -7.712 3.455 -3.426 1.00 . A A . 503 SER H 1 1 14 8991 1 1 6 SER HA H -9.085 0.852 -3.423 1.00 . A A . 503 SER HA 1 1 14 8992 1 1 6 SER HB2 H -8.093 0.665 -5.802 1.00 . A A . 503 SER HB2 1 1 14 8993 1 1 6 SER HB3 H -9.493 1.712 -5.572 1.00 . A A . 503 SER HB3 1 1 14 8994 1 1 6 SER HG H -6.925 2.820 -5.313 1.00 . A A . 503 SER HG 1 1 14 8995 1 1 6 SER N N -8.385 2.773 -3.210 1.00 . A A . 503 SER N 1 1 14 8996 1 1 6 SER O O -5.900 1.410 -3.628 1.00 . A A . 503 SER O 1 1 14 8997 1 1 6 SER OG O -7.712 2.671 -5.856 1.00 . A A . 503 SER OG 1 1 14 8998 1 1 7 CYS C C -5.001 -1.322 -3.927 1.00 . A A . 504 CYS C 1 1 14 8999 1 1 7 CYS CA C -5.830 -1.190 -2.669 1.00 . A A . 504 CYS CA 1 1 14 9000 1 1 7 CYS CB C -6.206 -2.580 -2.137 1.00 . A A . 504 CYS CB 1 1 14 9001 1 1 7 CYS H H -7.908 -0.847 -2.850 1.00 . A A . 504 CYS H 1 1 14 9002 1 1 7 CYS HA H -5.265 -0.662 -1.916 1.00 . A A . 504 CYS HA 1 1 14 9003 1 1 7 CYS HB2 H -6.876 -2.464 -1.298 1.00 . A A . 504 CYS HB2 1 1 14 9004 1 1 7 CYS HB3 H -6.710 -3.128 -2.916 1.00 . A A . 504 CYS HB3 1 1 14 9005 1 1 7 CYS N N -7.021 -0.430 -2.986 1.00 . A A . 504 CYS N 1 1 14 9006 1 1 7 CYS O O -5.488 -1.800 -4.950 1.00 . A A . 504 CYS O 1 1 14 9007 1 1 7 CYS SG S -4.794 -3.597 -1.575 1.00 . A A . 504 CYS SG 1 1 14 9008 1 1 8 VAL C C -2.670 -2.296 -5.507 1.00 . A A . 505 VAL C 1 1 14 9009 1 1 8 VAL CA C -2.866 -0.873 -4.988 1.00 . A A . 505 VAL CA 1 1 14 9010 1 1 8 VAL CB C -1.503 -0.230 -4.632 1.00 . A A . 505 VAL CB 1 1 14 9011 1 1 8 VAL CG1 C -0.739 -1.080 -3.630 1.00 . A A . 505 VAL CG1 1 1 14 9012 1 1 8 VAL CG2 C -0.671 0.025 -5.879 1.00 . A A . 505 VAL CG2 1 1 14 9013 1 1 8 VAL H H -3.443 -0.493 -2.992 1.00 . A A . 505 VAL H 1 1 14 9014 1 1 8 VAL HA H -3.323 -0.279 -5.767 1.00 . A A . 505 VAL HA 1 1 14 9015 1 1 8 VAL HB H -1.699 0.725 -4.165 1.00 . A A . 505 VAL HB 1 1 14 9016 1 1 8 VAL HG11 H -0.589 -2.069 -4.037 1.00 . A A . 505 VAL HG11 1 1 14 9017 1 1 8 VAL HG12 H 0.218 -0.624 -3.430 1.00 . A A . 505 VAL HG12 1 1 14 9018 1 1 8 VAL HG13 H -1.306 -1.148 -2.713 1.00 . A A . 505 VAL HG13 1 1 14 9019 1 1 8 VAL HG21 H -1.203 0.699 -6.532 1.00 . A A . 505 VAL HG21 1 1 14 9020 1 1 8 VAL HG22 H 0.272 0.467 -5.595 1.00 . A A . 505 VAL HG22 1 1 14 9021 1 1 8 VAL HG23 H -0.490 -0.910 -6.390 1.00 . A A . 505 VAL HG23 1 1 14 9022 1 1 8 VAL N N -3.760 -0.867 -3.845 1.00 . A A . 505 VAL N 1 1 14 9023 1 1 8 VAL O O -2.261 -2.503 -6.648 1.00 . A A . 505 VAL O 1 1 14 9024 1 1 9 ASN C C -4.193 -5.249 -5.511 1.00 . A A . 506 ASN C 1 1 14 9025 1 1 9 ASN CA C -2.861 -4.669 -5.042 1.00 . A A . 506 ASN CA 1 1 14 9026 1 1 9 ASN CB C -2.324 -5.477 -3.856 1.00 . A A . 506 ASN CB 1 1 14 9027 1 1 9 ASN CG C -2.177 -6.950 -4.173 1.00 . A A . 506 ASN CG 1 1 14 9028 1 1 9 ASN H H -3.330 -3.054 -3.774 1.00 . A A . 506 ASN H 1 1 14 9029 1 1 9 ASN HA H -2.151 -4.728 -5.852 1.00 . A A . 506 ASN HA 1 1 14 9030 1 1 9 ASN HB2 H -1.355 -5.091 -3.576 1.00 . A A . 506 ASN HB2 1 1 14 9031 1 1 9 ASN HB3 H -3.001 -5.372 -3.022 1.00 . A A . 506 ASN HB3 1 1 14 9032 1 1 9 ASN HD21 H -3.939 -7.345 -3.338 1.00 . A A . 506 ASN HD21 1 1 14 9033 1 1 9 ASN HD22 H -3.090 -8.706 -3.997 1.00 . A A . 506 ASN HD22 1 1 14 9034 1 1 9 ASN N N -2.996 -3.275 -4.670 1.00 . A A . 506 ASN N 1 1 14 9035 1 1 9 ASN ND2 N -3.166 -7.745 -3.798 1.00 . A A . 506 ASN ND2 1 1 14 9036 1 1 9 ASN O O -4.220 -6.127 -6.372 1.00 . A A . 506 ASN O 1 1 14 9037 1 1 9 ASN OD1 O -1.170 -7.371 -4.735 1.00 . A A . 506 ASN OD1 1 1 14 9038 1 1 10 CYS C C -7.578 -4.304 -5.834 1.00 . A A . 507 CYS C 1 1 14 9039 1 1 10 CYS CA C -6.604 -5.324 -5.232 1.00 . A A . 507 CYS CA 1 1 14 9040 1 1 10 CYS CB C -7.184 -5.906 -3.944 1.00 . A A . 507 CYS CB 1 1 14 9041 1 1 10 CYS H H -5.227 -3.948 -4.389 1.00 . A A . 507 CYS H 1 1 14 9042 1 1 10 CYS HA H -6.463 -6.125 -5.942 1.00 . A A . 507 CYS HA 1 1 14 9043 1 1 10 CYS HB2 H -7.544 -5.099 -3.325 1.00 . A A . 507 CYS HB2 1 1 14 9044 1 1 10 CYS HB3 H -8.010 -6.559 -4.193 1.00 . A A . 507 CYS HB3 1 1 14 9045 1 1 10 CYS N N -5.294 -4.739 -4.965 1.00 . A A . 507 CYS N 1 1 14 9046 1 1 10 CYS O O -7.745 -4.242 -7.052 1.00 . A A . 507 CYS O 1 1 14 9047 1 1 10 CYS SG S -5.988 -6.867 -2.956 1.00 . A A . 507 CYS SG 1 1 14 9048 1 1 11 GLY C C -9.830 -1.731 -4.342 1.00 . A A . 508 GLY C 1 1 14 9049 1 1 11 GLY CA C -9.216 -2.563 -5.457 1.00 . A A . 508 GLY CA 1 1 14 9050 1 1 11 GLY H H -7.992 -3.539 -4.029 1.00 . A A . 508 GLY H 1 1 14 9051 1 1 11 GLY HA2 H -8.758 -1.898 -6.174 1.00 . A A . 508 GLY HA2 1 1 14 9052 1 1 11 GLY HA3 H -10.000 -3.117 -5.950 1.00 . A A . 508 GLY HA3 1 1 14 9053 1 1 11 GLY N N -8.212 -3.500 -4.981 1.00 . A A . 508 GLY N 1 1 14 9054 1 1 11 GLY O O -9.278 -1.657 -3.244 1.00 . A A . 508 GLY O 1 1 14 9055 1 1 12 ARG C C -11.941 -0.752 -2.314 1.00 . A A . 509 ARG C 1 1 14 9056 1 1 12 ARG CA C -11.670 -0.184 -3.714 1.00 . A A . 509 ARG CA 1 1 14 9057 1 1 12 ARG CB C -12.986 0.291 -4.335 1.00 . A A . 509 ARG CB 1 1 14 9058 1 1 12 ARG CD C -15.254 -0.299 -5.233 1.00 . A A . 509 ARG CD 1 1 14 9059 1 1 12 ARG CG C -13.974 -0.831 -4.613 1.00 . A A . 509 ARG CG 1 1 14 9060 1 1 12 ARG CZ C -17.525 -1.143 -5.700 1.00 . A A . 509 ARG CZ 1 1 14 9061 1 1 12 ARG H H -11.390 -1.276 -5.515 1.00 . A A . 509 ARG H 1 1 14 9062 1 1 12 ARG HA H -11.023 0.674 -3.604 1.00 . A A . 509 ARG HA 1 1 14 9063 1 1 12 ARG HB2 H -13.455 0.992 -3.662 1.00 . A A . 509 ARG HB2 1 1 14 9064 1 1 12 ARG HB3 H -12.771 0.791 -5.268 1.00 . A A . 509 ARG HB3 1 1 14 9065 1 1 12 ARG HD2 H -15.693 0.421 -4.557 1.00 . A A . 509 ARG HD2 1 1 14 9066 1 1 12 ARG HD3 H -15.010 0.189 -6.164 1.00 . A A . 509 ARG HD3 1 1 14 9067 1 1 12 ARG HE H -15.885 -2.290 -5.521 1.00 . A A . 509 ARG HE 1 1 14 9068 1 1 12 ARG HG2 H -13.520 -1.535 -5.295 1.00 . A A . 509 ARG HG2 1 1 14 9069 1 1 12 ARG HG3 H -14.211 -1.327 -3.684 1.00 . A A . 509 ARG HG3 1 1 14 9070 1 1 12 ARG HH11 H -17.416 0.873 -5.437 1.00 . A A . 509 ARG HH11 1 1 14 9071 1 1 12 ARG HH12 H -19.001 0.243 -5.782 1.00 . A A . 509 ARG HH12 1 1 14 9072 1 1 12 ARG HH21 H -17.982 -3.104 -6.003 1.00 . A A . 509 ARG HH21 1 1 14 9073 1 1 12 ARG HH22 H -19.321 -1.990 -6.122 1.00 . A A . 509 ARG HH22 1 1 14 9074 1 1 12 ARG N N -10.988 -1.123 -4.627 1.00 . A A . 509 ARG N 1 1 14 9075 1 1 12 ARG NE N -16.226 -1.359 -5.492 1.00 . A A . 509 ARG NE 1 1 14 9076 1 1 12 ARG NH1 N -18.020 0.089 -5.637 1.00 . A A . 509 ARG NH1 1 1 14 9077 1 1 12 ARG NH2 N -18.339 -2.159 -5.960 1.00 . A A . 509 ARG NH2 1 1 14 9078 1 1 12 ARG O O -12.387 -0.025 -1.422 1.00 . A A . 509 ARG O 1 1 14 9079 1 1 13 GLU C C -10.774 -2.165 0.160 1.00 . A A . 510 GLU C 1 1 14 9080 1 1 13 GLU CA C -11.837 -2.681 -0.825 1.00 . A A . 510 GLU CA 1 1 14 9081 1 1 13 GLU CB C -11.736 -4.200 -0.983 1.00 . A A . 510 GLU CB 1 1 14 9082 1 1 13 GLU CD C -13.564 -4.789 0.660 1.00 . A A . 510 GLU CD 1 1 14 9083 1 1 13 GLU CG C -12.117 -4.990 0.260 1.00 . A A . 510 GLU CG 1 1 14 9084 1 1 13 GLU H H -11.417 -2.581 -2.898 1.00 . A A . 510 GLU H 1 1 14 9085 1 1 13 GLU HA H -12.810 -2.429 -0.444 1.00 . A A . 510 GLU HA 1 1 14 9086 1 1 13 GLU HB2 H -12.387 -4.507 -1.788 1.00 . A A . 510 GLU HB2 1 1 14 9087 1 1 13 GLU HB3 H -10.720 -4.452 -1.243 1.00 . A A . 510 GLU HB3 1 1 14 9088 1 1 13 GLU HG2 H -11.959 -6.041 0.063 1.00 . A A . 510 GLU HG2 1 1 14 9089 1 1 13 GLU HG3 H -11.484 -4.678 1.078 1.00 . A A . 510 GLU HG3 1 1 14 9090 1 1 13 GLU N N -11.699 -2.040 -2.130 1.00 . A A . 510 GLU N 1 1 14 9091 1 1 13 GLU O O -10.731 -2.587 1.316 1.00 . A A . 510 GLU O 1 1 14 9092 1 1 13 GLU OE1 O -14.451 -5.392 0.012 1.00 . A A . 510 GLU OE1 1 1 14 9093 1 1 13 GLU OE2 O -13.824 -4.048 1.628 1.00 . A A . 510 GLU OE2 1 1 14 9094 1 1 14 ALA C C -9.356 -0.162 1.823 1.00 . A A . 511 ALA C 1 1 14 9095 1 1 14 ALA CA C -8.839 -0.688 0.489 1.00 . A A . 511 ALA CA 1 1 14 9096 1 1 14 ALA CB C -8.158 0.435 -0.264 1.00 . A A . 511 ALA CB 1 1 14 9097 1 1 14 ALA H H -9.975 -1.018 -1.263 1.00 . A A . 511 ALA H 1 1 14 9098 1 1 14 ALA HA H -8.103 -1.455 0.679 1.00 . A A . 511 ALA HA 1 1 14 9099 1 1 14 ALA HB1 H -8.870 1.224 -0.453 1.00 . A A . 511 ALA HB1 1 1 14 9100 1 1 14 ALA HB2 H -7.340 0.819 0.330 1.00 . A A . 511 ALA HB2 1 1 14 9101 1 1 14 ALA HB3 H -7.776 0.062 -1.201 1.00 . A A . 511 ALA HB3 1 1 14 9102 1 1 14 ALA N N -9.901 -1.281 -0.324 1.00 . A A . 511 ALA N 1 1 14 9103 1 1 14 ALA O O -10.407 0.477 1.895 1.00 . A A . 511 ALA O 1 1 14 9104 1 1 15 MET C C -7.738 0.396 5.034 1.00 . A A . 512 MET C 1 1 14 9105 1 1 15 MET CA C -8.957 -0.047 4.228 1.00 . A A . 512 MET CA 1 1 14 9106 1 1 15 MET CB C -9.608 -1.231 4.953 1.00 . A A . 512 MET CB 1 1 14 9107 1 1 15 MET CE C -13.606 -1.536 3.866 1.00 . A A . 512 MET CE 1 1 14 9108 1 1 15 MET CG C -10.906 -1.723 4.338 1.00 . A A . 512 MET CG 1 1 14 9109 1 1 15 MET H H -7.725 -0.854 2.712 1.00 . A A . 512 MET H 1 1 14 9110 1 1 15 MET HA H -9.661 0.767 4.166 1.00 . A A . 512 MET HA 1 1 14 9111 1 1 15 MET HB2 H -8.911 -2.056 4.959 1.00 . A A . 512 MET HB2 1 1 14 9112 1 1 15 MET HB3 H -9.809 -0.940 5.974 1.00 . A A . 512 MET HB3 1 1 14 9113 1 1 15 MET HE1 H -13.713 -2.420 4.476 1.00 . A A . 512 MET HE1 1 1 14 9114 1 1 15 MET HE2 H -14.520 -0.962 3.897 1.00 . A A . 512 MET HE2 1 1 14 9115 1 1 15 MET HE3 H -13.398 -1.828 2.846 1.00 . A A . 512 MET HE3 1 1 14 9116 1 1 15 MET HG2 H -10.738 -1.918 3.290 1.00 . A A . 512 MET HG2 1 1 14 9117 1 1 15 MET HG3 H -11.194 -2.641 4.829 1.00 . A A . 512 MET HG3 1 1 14 9118 1 1 15 MET N N -8.581 -0.419 2.867 1.00 . A A . 512 MET N 1 1 14 9119 1 1 15 MET O O -7.856 1.194 5.962 1.00 . A A . 512 MET O 1 1 14 9120 1 1 15 MET SD S -12.256 -0.540 4.487 1.00 . A A . 512 MET SD 1 1 14 9121 1 1 16 SER C C -4.255 0.700 4.651 1.00 . A A . 513 SER C 1 1 14 9122 1 1 16 SER CA C -5.373 0.079 5.490 1.00 . A A . 513 SER CA 1 1 14 9123 1 1 16 SER CB C -4.923 -1.242 6.111 1.00 . A A . 513 SER CB 1 1 14 9124 1 1 16 SER H H -6.496 -0.625 3.850 1.00 . A A . 513 SER H 1 1 14 9125 1 1 16 SER HA H -5.637 0.779 6.266 1.00 . A A . 513 SER HA 1 1 14 9126 1 1 16 SER HB2 H -4.539 -1.892 5.338 1.00 . A A . 513 SER HB2 1 1 14 9127 1 1 16 SER HB3 H -4.147 -1.052 6.839 1.00 . A A . 513 SER HB3 1 1 14 9128 1 1 16 SER HG H -6.503 -1.238 7.280 1.00 . A A . 513 SER HG 1 1 14 9129 1 1 16 SER N N -6.569 -0.133 4.686 1.00 . A A . 513 SER N 1 1 14 9130 1 1 16 SER O O -4.225 0.554 3.435 1.00 . A A . 513 SER O 1 1 14 9131 1 1 16 SER OG O -6.008 -1.889 6.759 1.00 . A A . 513 SER OG 1 1 14 9132 1 1 17 GLU C C -0.905 1.645 5.054 1.00 . A A . 514 GLU C 1 1 14 9133 1 1 17 GLU CA C -2.288 2.127 4.625 1.00 . A A . 514 GLU CA 1 1 14 9134 1 1 17 GLU CB C -2.436 3.619 4.925 1.00 . A A . 514 GLU CB 1 1 14 9135 1 1 17 GLU CD C -2.849 5.342 6.699 1.00 . A A . 514 GLU CD 1 1 14 9136 1 1 17 GLU CG C -2.297 3.971 6.392 1.00 . A A . 514 GLU CG 1 1 14 9137 1 1 17 GLU H H -3.371 1.404 6.290 1.00 . A A . 514 GLU H 1 1 14 9138 1 1 17 GLU HA H -2.414 1.988 3.561 1.00 . A A . 514 GLU HA 1 1 14 9139 1 1 17 GLU HB2 H -1.679 4.157 4.376 1.00 . A A . 514 GLU HB2 1 1 14 9140 1 1 17 GLU HB3 H -3.410 3.943 4.590 1.00 . A A . 514 GLU HB3 1 1 14 9141 1 1 17 GLU HG2 H -2.834 3.241 6.977 1.00 . A A . 514 GLU HG2 1 1 14 9142 1 1 17 GLU HG3 H -1.250 3.951 6.659 1.00 . A A . 514 GLU HG3 1 1 14 9143 1 1 17 GLU N N -3.343 1.391 5.310 1.00 . A A . 514 GLU N 1 1 14 9144 1 1 17 GLU O O -0.761 0.955 6.065 1.00 . A A . 514 GLU O 1 1 14 9145 1 1 17 GLU OE1 O -2.296 6.340 6.196 1.00 . A A . 514 GLU OE1 1 1 14 9146 1 1 17 GLU OE2 O -3.853 5.425 7.432 1.00 . A A . 514 GLU OE2 1 1 14 9147 1 1 18 CYS C C 2.014 2.690 5.631 1.00 . A A . 515 CYS C 1 1 14 9148 1 1 18 CYS CA C 1.484 1.708 4.598 1.00 . A A . 515 CYS CA 1 1 14 9149 1 1 18 CYS CB C 2.357 1.747 3.331 1.00 . A A . 515 CYS CB 1 1 14 9150 1 1 18 CYS H H -0.085 2.541 3.474 1.00 . A A . 515 CYS H 1 1 14 9151 1 1 18 CYS HA H 1.544 0.735 5.057 1.00 . A A . 515 CYS HA 1 1 14 9152 1 1 18 CYS HB2 H 2.297 0.789 2.835 1.00 . A A . 515 CYS HB2 1 1 14 9153 1 1 18 CYS HB3 H 1.982 2.513 2.667 1.00 . A A . 515 CYS HB3 1 1 14 9154 1 1 18 CYS N N 0.103 2.014 4.277 1.00 . A A . 515 CYS N 1 1 14 9155 1 1 18 CYS O O 1.924 3.905 5.464 1.00 . A A . 515 CYS O 1 1 14 9156 1 1 18 CYS SG S 4.122 2.099 3.644 1.00 . A A . 515 CYS SG 1 1 14 9157 1 1 19 THR C C 4.700 3.035 7.169 1.00 . A A . 516 THR C 1 1 14 9158 1 1 19 THR CA C 3.271 2.924 7.689 1.00 . A A . 516 THR CA 1 1 14 9159 1 1 19 THR CB C 3.247 2.269 9.082 1.00 . A A . 516 THR CB 1 1 14 9160 1 1 19 THR CG2 C 3.846 3.193 10.133 1.00 . A A . 516 THR CG2 1 1 14 9161 1 1 19 THR H H 2.357 1.209 6.936 1.00 . A A . 516 THR H 1 1 14 9162 1 1 19 THR HA H 2.836 3.911 7.757 1.00 . A A . 516 THR HA 1 1 14 9163 1 1 19 THR HB H 3.828 1.358 9.047 1.00 . A A . 516 THR HB 1 1 14 9164 1 1 19 THR HG1 H 1.342 1.974 8.639 1.00 . A A . 516 THR HG1 1 1 14 9165 1 1 19 THR HG21 H 3.276 4.110 10.172 1.00 . A A . 516 THR HG21 1 1 14 9166 1 1 19 THR HG22 H 3.815 2.709 11.098 1.00 . A A . 516 THR HG22 1 1 14 9167 1 1 19 THR HG23 H 4.872 3.415 9.877 1.00 . A A . 516 THR HG23 1 1 14 9168 1 1 19 THR N N 2.501 2.151 6.747 1.00 . A A . 516 THR N 1 1 14 9169 1 1 19 THR O O 5.387 2.026 6.992 1.00 . A A . 516 THR O 1 1 14 9170 1 1 19 THR OG1 O 1.889 1.955 9.433 1.00 . A A . 516 THR OG1 1 1 14 9171 1 1 20 GLY C C 6.218 5.468 5.144 1.00 . A A . 517 GLY C 1 1 14 9172 1 1 20 GLY CA C 6.390 4.449 6.238 1.00 . A A . 517 GLY CA 1 1 14 9173 1 1 20 GLY H H 4.667 5.010 7.334 1.00 . A A . 517 GLY H 1 1 14 9174 1 1 20 GLY HA2 H 7.148 4.791 6.929 1.00 . A A . 517 GLY HA2 1 1 14 9175 1 1 20 GLY HA3 H 6.703 3.513 5.801 1.00 . A A . 517 GLY HA3 1 1 14 9176 1 1 20 GLY N N 5.150 4.248 6.952 1.00 . A A . 517 GLY N 1 1 14 9177 1 1 20 GLY O O 6.908 6.488 5.123 1.00 . A A . 517 GLY O 1 1 14 9178 1 1 21 CYS C C 3.360 6.181 3.191 1.00 . A A . 518 CYS C 1 1 14 9179 1 1 21 CYS CA C 4.870 6.204 3.285 1.00 . A A . 518 CYS CA 1 1 14 9180 1 1 21 CYS CB C 5.487 5.970 1.903 1.00 . A A . 518 CYS CB 1 1 14 9181 1 1 21 CYS H H 4.860 4.314 4.226 1.00 . A A . 518 CYS H 1 1 14 9182 1 1 21 CYS HA H 5.183 7.159 3.674 1.00 . A A . 518 CYS HA 1 1 14 9183 1 1 21 CYS HB2 H 5.445 6.890 1.340 1.00 . A A . 518 CYS HB2 1 1 14 9184 1 1 21 CYS HB3 H 6.521 5.677 2.021 1.00 . A A . 518 CYS HB3 1 1 14 9185 1 1 21 CYS N N 5.289 5.199 4.236 1.00 . A A . 518 CYS N 1 1 14 9186 1 1 21 CYS O O 2.743 5.127 3.265 1.00 . A A . 518 CYS O 1 1 14 9187 1 1 21 CYS SG S 4.652 4.681 0.918 1.00 . A A . 518 CYS SG 1 1 14 9188 1 1 22 HIS C C 0.922 7.840 1.529 1.00 . A A . 519 HIS C 1 1 14 9189 1 1 22 HIS CA C 1.316 7.401 2.921 1.00 . A A . 519 HIS CA 1 1 14 9190 1 1 22 HIS CB C 0.740 8.343 3.983 1.00 . A A . 519 HIS CB 1 1 14 9191 1 1 22 HIS CD2 C 2.174 8.005 6.118 1.00 . A A . 519 HIS CD2 1 1 14 9192 1 1 22 HIS CE1 C 0.692 6.982 7.357 1.00 . A A . 519 HIS CE1 1 1 14 9193 1 1 22 HIS CG C 1.040 7.904 5.388 1.00 . A A . 519 HIS CG 1 1 14 9194 1 1 22 HIS H H 3.295 8.158 2.952 1.00 . A A . 519 HIS H 1 1 14 9195 1 1 22 HIS HA H 0.931 6.405 3.089 1.00 . A A . 519 HIS HA 1 1 14 9196 1 1 22 HIS HB2 H 1.159 9.329 3.844 1.00 . A A . 519 HIS HB2 1 1 14 9197 1 1 22 HIS HB3 H -0.332 8.392 3.869 1.00 . A A . 519 HIS HB3 1 1 14 9198 1 1 22 HIS HD1 H -0.808 7.028 5.957 1.00 . A A . 519 HIS HD1 1 1 14 9199 1 1 22 HIS HD2 H 3.098 8.467 5.800 1.00 . A A . 519 HIS HD2 1 1 14 9200 1 1 22 HIS HE1 H 0.215 6.477 8.186 1.00 . A A . 519 HIS HE1 1 1 14 9201 1 1 22 HIS HE2 H 2.636 7.143 7.976 1.00 . A A . 519 HIS HE2 1 1 14 9202 1 1 22 HIS N N 2.758 7.332 3.017 1.00 . A A . 519 HIS N 1 1 14 9203 1 1 22 HIS ND1 N 0.128 7.258 6.197 1.00 . A A . 519 HIS ND1 1 1 14 9204 1 1 22 HIS NE2 N 1.935 7.423 7.338 1.00 . A A . 519 HIS NE2 1 1 14 9205 1 1 22 HIS O O -0.051 8.566 1.343 1.00 . A A . 519 HIS O 1 1 14 9206 1 1 23 LYS C C 0.475 6.718 -1.455 1.00 . A A . 520 LYS C 1 1 14 9207 1 1 23 LYS CA C 1.445 7.725 -0.843 1.00 . A A . 520 LYS CA 1 1 14 9208 1 1 23 LYS CB C 2.772 7.725 -1.623 1.00 . A A . 520 LYS CB 1 1 14 9209 1 1 23 LYS CD C 4.836 6.394 -2.297 1.00 . A A . 520 LYS CD 1 1 14 9210 1 1 23 LYS CE C 5.862 7.099 -1.423 1.00 . A A . 520 LYS CE 1 1 14 9211 1 1 23 LYS CG C 3.457 6.361 -1.646 1.00 . A A . 520 LYS CG 1 1 14 9212 1 1 23 LYS H H 2.498 6.863 0.750 1.00 . A A . 520 LYS H 1 1 14 9213 1 1 23 LYS HA H 1.007 8.710 -0.885 1.00 . A A . 520 LYS HA 1 1 14 9214 1 1 23 LYS HB2 H 2.579 8.029 -2.641 1.00 . A A . 520 LYS HB2 1 1 14 9215 1 1 23 LYS HB3 H 3.446 8.434 -1.166 1.00 . A A . 520 LYS HB3 1 1 14 9216 1 1 23 LYS HD2 H 5.166 5.378 -2.467 1.00 . A A . 520 LYS HD2 1 1 14 9217 1 1 23 LYS HD3 H 4.765 6.911 -3.241 1.00 . A A . 520 LYS HD3 1 1 14 9218 1 1 23 LYS HE2 H 5.578 8.136 -1.319 1.00 . A A . 520 LYS HE2 1 1 14 9219 1 1 23 LYS HE3 H 5.871 6.631 -0.450 1.00 . A A . 520 LYS HE3 1 1 14 9220 1 1 23 LYS HG2 H 3.569 6.014 -0.631 1.00 . A A . 520 LYS HG2 1 1 14 9221 1 1 23 LYS HG3 H 2.834 5.672 -2.190 1.00 . A A . 520 LYS HG3 1 1 14 9222 1 1 23 LYS HZ1 H 7.245 7.498 -2.943 1.00 . A A . 520 LYS HZ1 1 1 14 9223 1 1 23 LYS HZ2 H 7.914 7.502 -1.389 1.00 . A A . 520 LYS HZ2 1 1 14 9224 1 1 23 LYS HZ3 H 7.519 6.035 -2.134 1.00 . A A . 520 LYS HZ3 1 1 14 9225 1 1 23 LYS N N 1.702 7.400 0.547 1.00 . A A . 520 LYS N 1 1 14 9226 1 1 23 LYS NZ N 7.230 7.026 -2.010 1.00 . A A . 520 LYS NZ 1 1 14 9227 1 1 23 LYS O O -0.238 7.031 -2.405 1.00 . A A . 520 LYS O 1 1 14 9228 1 1 24 VAL C C -1.266 3.836 -0.342 1.00 . A A . 521 VAL C 1 1 14 9229 1 1 24 VAL CA C -0.404 4.451 -1.431 1.00 . A A . 521 VAL CA 1 1 14 9230 1 1 24 VAL CB C 0.411 3.324 -2.100 1.00 . A A . 521 VAL CB 1 1 14 9231 1 1 24 VAL CG1 C 1.093 3.818 -3.366 1.00 . A A . 521 VAL CG1 1 1 14 9232 1 1 24 VAL CG2 C 1.429 2.753 -1.126 1.00 . A A . 521 VAL CG2 1 1 14 9233 1 1 24 VAL H H 0.995 5.335 -0.103 1.00 . A A . 521 VAL H 1 1 14 9234 1 1 24 VAL HA H -1.049 4.890 -2.178 1.00 . A A . 521 VAL HA 1 1 14 9235 1 1 24 VAL HB H -0.270 2.532 -2.375 1.00 . A A . 521 VAL HB 1 1 14 9236 1 1 24 VAL HG11 H 1.728 4.656 -3.130 1.00 . A A . 521 VAL HG11 1 1 14 9237 1 1 24 VAL HG12 H 1.688 3.022 -3.788 1.00 . A A . 521 VAL HG12 1 1 14 9238 1 1 24 VAL HG13 H 0.344 4.124 -4.082 1.00 . A A . 521 VAL HG13 1 1 14 9239 1 1 24 VAL HG21 H 0.924 2.408 -0.236 1.00 . A A . 521 VAL HG21 1 1 14 9240 1 1 24 VAL HG22 H 1.946 1.926 -1.590 1.00 . A A . 521 VAL HG22 1 1 14 9241 1 1 24 VAL HG23 H 2.143 3.519 -0.860 1.00 . A A . 521 VAL HG23 1 1 14 9242 1 1 24 VAL N N 0.447 5.511 -0.899 1.00 . A A . 521 VAL N 1 1 14 9243 1 1 24 VAL O O -0.996 3.991 0.850 1.00 . A A . 521 VAL O 1 1 14 9244 1 1 25 ASN C C -3.454 1.044 -0.200 1.00 . A A . 522 ASN C 1 1 14 9245 1 1 25 ASN CA C -3.235 2.507 0.153 1.00 . A A . 522 ASN CA 1 1 14 9246 1 1 25 ASN CB C -4.573 3.252 0.164 1.00 . A A . 522 ASN CB 1 1 14 9247 1 1 25 ASN CG C -4.781 4.114 -1.065 1.00 . A A . 522 ASN CG 1 1 14 9248 1 1 25 ASN H H -2.424 2.999 -1.735 1.00 . A A . 522 ASN H 1 1 14 9249 1 1 25 ASN HA H -2.802 2.565 1.140 1.00 . A A . 522 ASN HA 1 1 14 9250 1 1 25 ASN HB2 H -5.376 2.533 0.214 1.00 . A A . 522 ASN HB2 1 1 14 9251 1 1 25 ASN HB3 H -4.613 3.887 1.037 1.00 . A A . 522 ASN HB3 1 1 14 9252 1 1 25 ASN HD21 H -5.368 2.531 -2.116 1.00 . A A . 522 ASN HD21 1 1 14 9253 1 1 25 ASN HD22 H -5.357 4.047 -2.963 1.00 . A A . 522 ASN HD22 1 1 14 9254 1 1 25 ASN N N -2.298 3.126 -0.769 1.00 . A A . 522 ASN N 1 1 14 9255 1 1 25 ASN ND2 N -5.210 3.505 -2.155 1.00 . A A . 522 ASN ND2 1 1 14 9256 1 1 25 ASN O O -3.399 0.655 -1.371 1.00 . A A . 522 ASN O 1 1 14 9257 1 1 25 ASN OD1 O -4.528 5.318 -1.040 1.00 . A A . 522 ASN OD1 1 1 14 9258 1 1 26 TYR C C -5.243 -1.576 1.270 1.00 . A A . 523 TYR C 1 1 14 9259 1 1 26 TYR CA C -3.896 -1.185 0.679 1.00 . A A . 523 TYR CA 1 1 14 9260 1 1 26 TYR CB C -2.791 -1.958 1.404 1.00 . A A . 523 TYR CB 1 1 14 9261 1 1 26 TYR CD1 C -0.606 -0.696 1.382 1.00 . A A . 523 TYR CD1 1 1 14 9262 1 1 26 TYR CD2 C -0.872 -2.521 -0.125 1.00 . A A . 523 TYR CD2 1 1 14 9263 1 1 26 TYR CE1 C 0.674 -0.487 0.910 1.00 . A A . 523 TYR CE1 1 1 14 9264 1 1 26 TYR CE2 C 0.409 -2.322 -0.598 1.00 . A A . 523 TYR CE2 1 1 14 9265 1 1 26 TYR CG C -1.400 -1.715 0.871 1.00 . A A . 523 TYR CG 1 1 14 9266 1 1 26 TYR CZ C 1.177 -1.304 -0.078 1.00 . A A . 523 TYR CZ 1 1 14 9267 1 1 26 TYR H H -3.796 0.659 1.718 1.00 . A A . 523 TYR H 1 1 14 9268 1 1 26 TYR HA H -3.880 -1.422 -0.373 1.00 . A A . 523 TYR HA 1 1 14 9269 1 1 26 TYR HB2 H -2.795 -1.676 2.445 1.00 . A A . 523 TYR HB2 1 1 14 9270 1 1 26 TYR HB3 H -2.997 -3.016 1.326 1.00 . A A . 523 TYR HB3 1 1 14 9271 1 1 26 TYR HD1 H -1.477 -3.317 -0.534 1.00 . A A . 523 TYR HD1 1 1 14 9272 1 1 26 TYR HD2 H -1.003 -0.057 2.158 1.00 . A A . 523 TYR HD2 1 1 14 9273 1 1 26 TYR HE1 H 0.802 -2.960 -1.376 1.00 . A A . 523 TYR HE1 1 1 14 9274 1 1 26 TYR HE2 H 1.277 0.312 1.317 1.00 . A A . 523 TYR HE2 1 1 14 9275 1 1 26 TYR HH H 2.524 -1.396 -1.465 1.00 . A A . 523 TYR HH 1 1 14 9276 1 1 26 TYR N N -3.697 0.250 0.826 1.00 . A A . 523 TYR N 1 1 14 9277 1 1 26 TYR O O -6.006 -0.720 1.717 1.00 . A A . 523 TYR O 1 1 14 9278 1 1 26 TYR OH O 2.457 -1.107 -0.537 1.00 . A A . 523 TYR OH 1 1 14 9279 1 1 27 CYS C C -6.531 -4.339 2.979 1.00 . A A . 524 CYS C 1 1 14 9280 1 1 27 CYS CA C -6.788 -3.328 1.871 1.00 . A A . 524 CYS CA 1 1 14 9281 1 1 27 CYS CB C -7.722 -3.892 0.785 1.00 . A A . 524 CYS CB 1 1 14 9282 1 1 27 CYS H H -4.863 -3.522 1.010 1.00 . A A . 524 CYS H 1 1 14 9283 1 1 27 CYS HA H -7.265 -2.469 2.315 1.00 . A A . 524 CYS HA 1 1 14 9284 1 1 27 CYS HB2 H -8.735 -3.864 1.155 1.00 . A A . 524 CYS HB2 1 1 14 9285 1 1 27 CYS HB3 H -7.654 -3.256 -0.088 1.00 . A A . 524 CYS HB3 1 1 14 9286 1 1 27 CYS N N -5.529 -2.869 1.314 1.00 . A A . 524 CYS N 1 1 14 9287 1 1 27 CYS O O -7.461 -4.904 3.554 1.00 . A A . 524 CYS O 1 1 14 9288 1 1 27 CYS SG S -7.398 -5.601 0.245 1.00 . A A . 524 CYS SG 1 1 14 9289 1 1 28 SER C C -3.350 -5.223 4.604 1.00 . A A . 525 SER C 1 1 14 9290 1 1 28 SER CA C -4.842 -5.402 4.375 1.00 . A A . 525 SER CA 1 1 14 9291 1 1 28 SER CB C -5.151 -6.871 4.065 1.00 . A A . 525 SER CB 1 1 14 9292 1 1 28 SER H H -4.562 -4.090 2.756 1.00 . A A . 525 SER H 1 1 14 9293 1 1 28 SER HA H -5.376 -5.099 5.263 1.00 . A A . 525 SER HA 1 1 14 9294 1 1 28 SER HB2 H -4.999 -7.462 4.955 1.00 . A A . 525 SER HB2 1 1 14 9295 1 1 28 SER HB3 H -6.179 -6.960 3.747 1.00 . A A . 525 SER HB3 1 1 14 9296 1 1 28 SER HG H -4.603 -7.039 2.178 1.00 . A A . 525 SER HG 1 1 14 9297 1 1 28 SER N N -5.255 -4.540 3.283 1.00 . A A . 525 SER N 1 1 14 9298 1 1 28 SER O O -2.647 -4.701 3.734 1.00 . A A . 525 SER O 1 1 14 9299 1 1 28 SER OG O -4.309 -7.374 3.038 1.00 . A A . 525 SER OG 1 1 14 9300 1 1 29 THR C C -0.728 -6.650 5.162 1.00 . A A . 526 THR C 1 1 14 9301 1 1 29 THR CA C -1.435 -5.602 6.022 1.00 . A A . 526 THR CA 1 1 14 9302 1 1 29 THR CB C -1.126 -5.845 7.511 1.00 . A A . 526 THR CB 1 1 14 9303 1 1 29 THR CG2 C 0.337 -5.552 7.813 1.00 . A A . 526 THR CG2 1 1 14 9304 1 1 29 THR H H -3.479 -5.945 6.467 1.00 . A A . 526 THR H 1 1 14 9305 1 1 29 THR HA H -1.069 -4.621 5.752 1.00 . A A . 526 THR HA 1 1 14 9306 1 1 29 THR HB H -1.329 -6.881 7.746 1.00 . A A . 526 THR HB 1 1 14 9307 1 1 29 THR HG1 H -2.042 -4.140 7.899 1.00 . A A . 526 THR HG1 1 1 14 9308 1 1 29 THR HG21 H 0.550 -4.516 7.590 1.00 . A A . 526 THR HG21 1 1 14 9309 1 1 29 THR HG22 H 0.534 -5.744 8.857 1.00 . A A . 526 THR HG22 1 1 14 9310 1 1 29 THR HG23 H 0.966 -6.185 7.206 1.00 . A A . 526 THR HG23 1 1 14 9311 1 1 29 THR N N -2.863 -5.632 5.764 1.00 . A A . 526 THR N 1 1 14 9312 1 1 29 THR O O 0.456 -6.522 4.848 1.00 . A A . 526 THR O 1 1 14 9313 1 1 29 THR OG1 O -1.959 -5.003 8.321 1.00 . A A . 526 THR OG1 1 1 14 9314 1 1 30 PHE C C -0.568 -8.132 2.528 1.00 . A A . 527 PHE C 1 1 14 9315 1 1 30 PHE CA C -0.945 -8.716 3.885 1.00 . A A . 527 PHE CA 1 1 14 9316 1 1 30 PHE CB C -1.965 -9.846 3.705 1.00 . A A . 527 PHE CB 1 1 14 9317 1 1 30 PHE CD1 C -0.594 -11.722 2.756 1.00 . A A . 527 PHE CD1 1 1 14 9318 1 1 30 PHE CD2 C -2.300 -10.762 1.396 1.00 . A A . 527 PHE CD2 1 1 14 9319 1 1 30 PHE CE1 C -0.266 -12.592 1.732 1.00 . A A . 527 PHE CE1 1 1 14 9320 1 1 30 PHE CE2 C -1.977 -11.625 0.371 1.00 . A A . 527 PHE CE2 1 1 14 9321 1 1 30 PHE CG C -1.615 -10.799 2.599 1.00 . A A . 527 PHE CG 1 1 14 9322 1 1 30 PHE CZ C -0.959 -12.543 0.539 1.00 . A A . 527 PHE CZ 1 1 14 9323 1 1 30 PHE H H -2.397 -7.750 5.075 1.00 . A A . 527 PHE H 1 1 14 9324 1 1 30 PHE HA H -0.056 -9.119 4.346 1.00 . A A . 527 PHE HA 1 1 14 9325 1 1 30 PHE HB2 H -2.031 -10.413 4.622 1.00 . A A . 527 PHE HB2 1 1 14 9326 1 1 30 PHE HB3 H -2.932 -9.418 3.482 1.00 . A A . 527 PHE HB3 1 1 14 9327 1 1 30 PHE HD1 H -3.097 -10.047 1.262 1.00 . A A . 527 PHE HD1 1 1 14 9328 1 1 30 PHE HD2 H -0.051 -11.760 3.688 1.00 . A A . 527 PHE HD2 1 1 14 9329 1 1 30 PHE HE1 H -2.518 -11.584 -0.561 1.00 . A A . 527 PHE HE1 1 1 14 9330 1 1 30 PHE HE2 H 0.530 -13.309 1.867 1.00 . A A . 527 PHE HE2 1 1 14 9331 1 1 30 PHE HZ H -0.703 -13.219 -0.264 1.00 . A A . 527 PHE HZ 1 1 14 9332 1 1 30 PHE N N -1.473 -7.681 4.765 1.00 . A A . 527 PHE N 1 1 14 9333 1 1 30 PHE O O 0.533 -8.367 2.038 1.00 . A A . 527 PHE O 1 1 14 9334 1 1 31 CYS C C 0.022 -5.845 0.740 1.00 . A A . 528 CYS C 1 1 14 9335 1 1 31 CYS CA C -1.208 -6.731 0.642 1.00 . A A . 528 CYS CA 1 1 14 9336 1 1 31 CYS CB C -2.406 -5.913 0.173 1.00 . A A . 528 CYS CB 1 1 14 9337 1 1 31 CYS H H -2.344 -7.211 2.366 1.00 . A A . 528 CYS H 1 1 14 9338 1 1 31 CYS HA H -1.012 -7.529 -0.057 1.00 . A A . 528 CYS HA 1 1 14 9339 1 1 31 CYS HB2 H -2.542 -5.068 0.833 1.00 . A A . 528 CYS HB2 1 1 14 9340 1 1 31 CYS HB3 H -2.220 -5.555 -0.829 1.00 . A A . 528 CYS HB3 1 1 14 9341 1 1 31 CYS N N -1.475 -7.356 1.932 1.00 . A A . 528 CYS N 1 1 14 9342 1 1 31 CYS O O 0.816 -5.765 -0.189 1.00 . A A . 528 CYS O 1 1 14 9343 1 1 31 CYS SG S -3.960 -6.850 0.146 1.00 . A A . 528 CYS SG 1 1 14 9344 1 1 32 GLN C C 2.600 -5.164 2.110 1.00 . A A . 529 GLN C 1 1 14 9345 1 1 32 GLN CA C 1.315 -4.341 2.147 1.00 . A A . 529 GLN CA 1 1 14 9346 1 1 32 GLN CB C 1.117 -3.610 3.498 1.00 . A A . 529 GLN CB 1 1 14 9347 1 1 32 GLN CD C 3.569 -3.317 4.254 1.00 . A A . 529 GLN CD 1 1 14 9348 1 1 32 GLN CG C 2.178 -3.851 4.583 1.00 . A A . 529 GLN CG 1 1 14 9349 1 1 32 GLN H H -0.487 -5.338 2.603 1.00 . A A . 529 GLN H 1 1 14 9350 1 1 32 GLN HA H 1.355 -3.603 1.357 1.00 . A A . 529 GLN HA 1 1 14 9351 1 1 32 GLN HB2 H 1.068 -2.549 3.311 1.00 . A A . 529 GLN HB2 1 1 14 9352 1 1 32 GLN HB3 H 0.166 -3.925 3.900 1.00 . A A . 529 GLN HB3 1 1 14 9353 1 1 32 GLN HE21 H 2.810 -1.880 3.118 1.00 . A A . 529 GLN HE21 1 1 14 9354 1 1 32 GLN HE22 H 4.531 -1.926 3.228 1.00 . A A . 529 GLN HE22 1 1 14 9355 1 1 32 GLN HG2 H 1.846 -3.376 5.493 1.00 . A A . 529 GLN HG2 1 1 14 9356 1 1 32 GLN HG3 H 2.253 -4.916 4.751 1.00 . A A . 529 GLN HG3 1 1 14 9357 1 1 32 GLN N N 0.175 -5.204 1.894 1.00 . A A . 529 GLN N 1 1 14 9358 1 1 32 GLN NE2 N 3.642 -2.267 3.457 1.00 . A A . 529 GLN NE2 1 1 14 9359 1 1 32 GLN O O 3.566 -4.793 1.447 1.00 . A A . 529 GLN O 1 1 14 9360 1 1 32 GLN OE1 O 4.575 -3.857 4.718 1.00 . A A . 529 GLN OE1 1 1 14 9361 1 1 33 ARG C C 4.020 -7.853 1.542 1.00 . A A . 530 ARG C 1 1 14 9362 1 1 33 ARG CA C 3.786 -7.136 2.872 1.00 . A A . 530 ARG CA 1 1 14 9363 1 1 33 ARG CB C 3.671 -8.146 4.013 1.00 . A A . 530 ARG CB 1 1 14 9364 1 1 33 ARG CD C 5.295 -7.178 5.647 1.00 . A A . 530 ARG CD 1 1 14 9365 1 1 33 ARG CG C 3.843 -7.536 5.390 1.00 . A A . 530 ARG CG 1 1 14 9366 1 1 33 ARG CZ C 7.488 -8.322 5.654 1.00 . A A . 530 ARG CZ 1 1 14 9367 1 1 33 ARG H H 1.787 -6.547 3.302 1.00 . A A . 530 ARG H 1 1 14 9368 1 1 33 ARG HA H 4.618 -6.468 3.056 1.00 . A A . 530 ARG HA 1 1 14 9369 1 1 33 ARG HB2 H 2.698 -8.611 3.970 1.00 . A A . 530 ARG HB2 1 1 14 9370 1 1 33 ARG HB3 H 4.428 -8.904 3.883 1.00 . A A . 530 ARG HB3 1 1 14 9371 1 1 33 ARG HD2 H 5.614 -6.468 4.900 1.00 . A A . 530 ARG HD2 1 1 14 9372 1 1 33 ARG HD3 H 5.375 -6.734 6.628 1.00 . A A . 530 ARG HD3 1 1 14 9373 1 1 33 ARG HE H 5.716 -9.236 5.495 1.00 . A A . 530 ARG HE 1 1 14 9374 1 1 33 ARG HG2 H 3.242 -6.641 5.458 1.00 . A A . 530 ARG HG2 1 1 14 9375 1 1 33 ARG HG3 H 3.519 -8.249 6.132 1.00 . A A . 530 ARG HG3 1 1 14 9376 1 1 33 ARG HH11 H 7.620 -6.297 5.762 1.00 . A A . 530 ARG HH11 1 1 14 9377 1 1 33 ARG HH12 H 9.136 -7.153 5.819 1.00 . A A . 530 ARG HH12 1 1 14 9378 1 1 33 ARG HH21 H 7.692 -10.335 5.524 1.00 . A A . 530 ARG HH21 1 1 14 9379 1 1 33 ARG HH22 H 9.177 -9.442 5.676 1.00 . A A . 530 ARG HH22 1 1 14 9380 1 1 33 ARG N N 2.602 -6.286 2.814 1.00 . A A . 530 ARG N 1 1 14 9381 1 1 33 ARG NE N 6.159 -8.357 5.586 1.00 . A A . 530 ARG NE 1 1 14 9382 1 1 33 ARG NH1 N 8.133 -7.166 5.750 1.00 . A A . 530 ARG NH1 1 1 14 9383 1 1 33 ARG NH2 N 8.176 -9.456 5.612 1.00 . A A . 530 ARG NH2 1 1 14 9384 1 1 33 ARG O O 5.156 -8.160 1.176 1.00 . A A . 530 ARG O 1 1 14 9385 1 1 34 LYS C C 3.560 -7.800 -1.515 1.00 . A A . 531 LYS C 1 1 14 9386 1 1 34 LYS CA C 3.012 -8.774 -0.473 1.00 . A A . 531 LYS CA 1 1 14 9387 1 1 34 LYS CB C 1.620 -9.291 -0.872 1.00 . A A . 531 LYS CB 1 1 14 9388 1 1 34 LYS CD C 1.092 -8.933 -3.306 1.00 . A A . 531 LYS CD 1 1 14 9389 1 1 34 LYS CE C 1.016 -9.570 -4.684 1.00 . A A . 531 LYS CE 1 1 14 9390 1 1 34 LYS CG C 1.547 -9.931 -2.250 1.00 . A A . 531 LYS CG 1 1 14 9391 1 1 34 LYS H H 2.055 -7.925 1.218 1.00 . A A . 531 LYS H 1 1 14 9392 1 1 34 LYS HA H 3.688 -9.612 -0.392 1.00 . A A . 531 LYS HA 1 1 14 9393 1 1 34 LYS HB2 H 1.306 -10.026 -0.146 1.00 . A A . 531 LYS HB2 1 1 14 9394 1 1 34 LYS HB3 H 0.926 -8.463 -0.847 1.00 . A A . 531 LYS HB3 1 1 14 9395 1 1 34 LYS HD2 H 0.114 -8.562 -3.037 1.00 . A A . 531 LYS HD2 1 1 14 9396 1 1 34 LYS HD3 H 1.793 -8.111 -3.337 1.00 . A A . 531 LYS HD3 1 1 14 9397 1 1 34 LYS HE2 H 0.496 -10.513 -4.601 1.00 . A A . 531 LYS HE2 1 1 14 9398 1 1 34 LYS HE3 H 0.465 -8.912 -5.339 1.00 . A A . 531 LYS HE3 1 1 14 9399 1 1 34 LYS HG2 H 2.524 -10.304 -2.518 1.00 . A A . 531 LYS HG2 1 1 14 9400 1 1 34 LYS HG3 H 0.843 -10.752 -2.217 1.00 . A A . 531 LYS HG3 1 1 14 9401 1 1 34 LYS HZ1 H 2.964 -10.324 -4.589 1.00 . A A . 531 LYS HZ1 1 1 14 9402 1 1 34 LYS HZ2 H 2.277 -10.384 -6.137 1.00 . A A . 531 LYS HZ2 1 1 14 9403 1 1 34 LYS HZ3 H 2.818 -8.906 -5.503 1.00 . A A . 531 LYS HZ3 1 1 14 9404 1 1 34 LYS N N 2.937 -8.133 0.834 1.00 . A A . 531 LYS N 1 1 14 9405 1 1 34 LYS NZ N 2.361 -9.814 -5.266 1.00 . A A . 531 LYS NZ 1 1 14 9406 1 1 34 LYS O O 4.408 -8.162 -2.333 1.00 . A A . 531 LYS O 1 1 14 9407 1 1 35 ASP C C 4.930 -5.019 -1.998 1.00 . A A . 532 ASP C 1 1 14 9408 1 1 35 ASP CA C 3.532 -5.505 -2.371 1.00 . A A . 532 ASP CA 1 1 14 9409 1 1 35 ASP CB C 2.543 -4.336 -2.308 1.00 . A A . 532 ASP CB 1 1 14 9410 1 1 35 ASP CG C 2.809 -3.270 -3.354 1.00 . A A . 532 ASP CG 1 1 14 9411 1 1 35 ASP H H 2.395 -6.341 -0.797 1.00 . A A . 532 ASP H 1 1 14 9412 1 1 35 ASP HA H 3.539 -5.890 -3.379 1.00 . A A . 532 ASP HA 1 1 14 9413 1 1 35 ASP HB2 H 1.543 -4.714 -2.457 1.00 . A A . 532 ASP HB2 1 1 14 9414 1 1 35 ASP HB3 H 2.604 -3.879 -1.331 1.00 . A A . 532 ASP HB3 1 1 14 9415 1 1 35 ASP N N 3.089 -6.561 -1.460 1.00 . A A . 532 ASP N 1 1 14 9416 1 1 35 ASP O O 5.613 -4.386 -2.799 1.00 . A A . 532 ASP O 1 1 14 9417 1 1 35 ASP OD1 O 2.710 -3.586 -4.561 1.00 . A A . 532 ASP OD1 1 1 14 9418 1 1 35 ASP OD2 O 3.097 -2.118 -2.968 1.00 . A A . 532 ASP OD2 1 1 14 9419 1 1 36 TRP C C 7.831 -5.221 -1.107 1.00 . A A . 533 TRP C 1 1 14 9420 1 1 36 TRP CA C 6.626 -4.915 -0.224 1.00 . A A . 533 TRP CA 1 1 14 9421 1 1 36 TRP CB C 6.844 -5.514 1.171 1.00 . A A . 533 TRP CB 1 1 14 9422 1 1 36 TRP CD1 C 9.218 -5.605 2.125 1.00 . A A . 533 TRP CD1 1 1 14 9423 1 1 36 TRP CD2 C 8.209 -3.620 2.360 1.00 . A A . 533 TRP CD2 1 1 14 9424 1 1 36 TRP CE2 C 9.501 -3.535 2.912 1.00 . A A . 533 TRP CE2 1 1 14 9425 1 1 36 TRP CE3 C 7.386 -2.489 2.395 1.00 . A A . 533 TRP CE3 1 1 14 9426 1 1 36 TRP CG C 8.048 -4.956 1.864 1.00 . A A . 533 TRP CG 1 1 14 9427 1 1 36 TRP CH2 C 9.165 -1.274 3.502 1.00 . A A . 533 TRP CH2 1 1 14 9428 1 1 36 TRP CZ2 C 9.989 -2.365 3.484 1.00 . A A . 533 TRP CZ2 1 1 14 9429 1 1 36 TRP CZ3 C 7.873 -1.330 2.964 1.00 . A A . 533 TRP CZ3 1 1 14 9430 1 1 36 TRP H H 4.833 -6.032 -0.278 1.00 . A A . 533 TRP H 1 1 14 9431 1 1 36 TRP HA H 6.545 -3.844 -0.109 1.00 . A A . 533 TRP HA 1 1 14 9432 1 1 36 TRP HB2 H 5.980 -5.307 1.784 1.00 . A A . 533 TRP HB2 1 1 14 9433 1 1 36 TRP HB3 H 6.972 -6.583 1.082 1.00 . A A . 533 TRP HB3 1 1 14 9434 1 1 36 TRP HD1 H 9.412 -6.634 1.868 1.00 . A A . 533 TRP HD1 1 1 14 9435 1 1 36 TRP HE1 H 11.012 -4.997 3.043 1.00 . A A . 533 TRP HE1 1 1 14 9436 1 1 36 TRP HE3 H 6.386 -2.512 1.989 1.00 . A A . 533 TRP HE3 1 1 14 9437 1 1 36 TRP HH2 H 9.504 -0.346 3.937 1.00 . A A . 533 TRP HH2 1 1 14 9438 1 1 36 TRP HZ2 H 10.986 -2.304 3.897 1.00 . A A . 533 TRP HZ2 1 1 14 9439 1 1 36 TRP HZ3 H 7.253 -0.446 2.999 1.00 . A A . 533 TRP HZ3 1 1 14 9440 1 1 36 TRP N N 5.373 -5.404 -0.801 1.00 . A A . 533 TRP N 1 1 14 9441 1 1 36 TRP NE1 N 10.098 -4.759 2.754 1.00 . A A . 533 TRP NE1 1 1 14 9442 1 1 36 TRP O O 8.831 -4.519 -1.069 1.00 . A A . 533 TRP O 1 1 14 9443 1 1 37 LYS C C 9.132 -5.655 -3.846 1.00 . A A . 534 LYS C 1 1 14 9444 1 1 37 LYS CA C 8.855 -6.674 -2.744 1.00 . A A . 534 LYS CA 1 1 14 9445 1 1 37 LYS CB C 8.619 -8.075 -3.310 1.00 . A A . 534 LYS CB 1 1 14 9446 1 1 37 LYS CD C 8.335 -10.528 -2.778 1.00 . A A . 534 LYS CD 1 1 14 9447 1 1 37 LYS CE C 8.763 -11.645 -1.835 1.00 . A A . 534 LYS CE 1 1 14 9448 1 1 37 LYS CG C 8.779 -9.169 -2.264 1.00 . A A . 534 LYS CG 1 1 14 9449 1 1 37 LYS H H 6.886 -6.735 -1.967 1.00 . A A . 534 LYS H 1 1 14 9450 1 1 37 LYS HA H 9.737 -6.688 -2.126 1.00 . A A . 534 LYS HA 1 1 14 9451 1 1 37 LYS HB2 H 7.617 -8.129 -3.710 1.00 . A A . 534 LYS HB2 1 1 14 9452 1 1 37 LYS HB3 H 9.329 -8.256 -4.104 1.00 . A A . 534 LYS HB3 1 1 14 9453 1 1 37 LYS HD2 H 7.258 -10.536 -2.866 1.00 . A A . 534 LYS HD2 1 1 14 9454 1 1 37 LYS HD3 H 8.779 -10.698 -3.746 1.00 . A A . 534 LYS HD3 1 1 14 9455 1 1 37 LYS HE2 H 8.341 -12.575 -2.185 1.00 . A A . 534 LYS HE2 1 1 14 9456 1 1 37 LYS HE3 H 9.841 -11.715 -1.849 1.00 . A A . 534 LYS HE3 1 1 14 9457 1 1 37 LYS HG2 H 9.819 -9.230 -1.983 1.00 . A A . 534 LYS HG2 1 1 14 9458 1 1 37 LYS HG3 H 8.189 -8.912 -1.395 1.00 . A A . 534 LYS HG3 1 1 14 9459 1 1 37 LYS HZ1 H 7.272 -11.394 -0.386 1.00 . A A . 534 LYS HZ1 1 1 14 9460 1 1 37 LYS HZ2 H 8.663 -12.173 0.185 1.00 . A A . 534 LYS HZ2 1 1 14 9461 1 1 37 LYS HZ3 H 8.679 -10.500 -0.083 1.00 . A A . 534 LYS HZ3 1 1 14 9462 1 1 37 LYS N N 7.735 -6.259 -1.910 1.00 . A A . 534 LYS N 1 1 14 9463 1 1 37 LYS NZ N 8.313 -11.412 -0.436 1.00 . A A . 534 LYS NZ 1 1 14 9464 1 1 37 LYS O O 10.281 -5.480 -4.252 1.00 . A A . 534 LYS O 1 1 14 9465 1 1 38 ASP C C 8.348 -2.563 -4.398 1.00 . A A . 535 ASP C 1 1 14 9466 1 1 38 ASP CA C 8.319 -3.836 -5.213 1.00 . A A . 535 ASP CA 1 1 14 9467 1 1 38 ASP CB C 7.196 -3.717 -6.237 1.00 . A A . 535 ASP CB 1 1 14 9468 1 1 38 ASP CG C 7.636 -3.041 -7.524 1.00 . A A . 535 ASP CG 1 1 14 9469 1 1 38 ASP H H 7.191 -5.217 -4.054 1.00 . A A . 535 ASP H 1 1 14 9470 1 1 38 ASP HA H 9.265 -3.978 -5.711 1.00 . A A . 535 ASP HA 1 1 14 9471 1 1 38 ASP HB2 H 6.825 -4.691 -6.468 1.00 . A A . 535 ASP HB2 1 1 14 9472 1 1 38 ASP HB3 H 6.398 -3.130 -5.807 1.00 . A A . 535 ASP HB3 1 1 14 9473 1 1 38 ASP N N 8.105 -4.970 -4.318 1.00 . A A . 535 ASP N 1 1 14 9474 1 1 38 ASP O O 9.109 -1.642 -4.639 1.00 . A A . 535 ASP O 1 1 14 9475 1 1 38 ASP OD1 O 8.234 -1.948 -7.464 1.00 . A A . 535 ASP OD1 1 1 14 9476 1 1 38 ASP OD2 O 7.365 -3.598 -8.608 1.00 . A A . 535 ASP OD2 1 1 14 9477 1 1 39 HIS C C 8.452 -0.914 -1.860 1.00 . A A . 536 HIS C 1 1 14 9478 1 1 39 HIS CA C 7.236 -1.345 -2.659 1.00 . A A . 536 HIS CA 1 1 14 9479 1 1 39 HIS CB C 6.046 -1.577 -1.728 1.00 . A A . 536 HIS CB 1 1 14 9480 1 1 39 HIS CD2 C 5.433 0.028 0.208 1.00 . A A . 536 HIS CD2 1 1 14 9481 1 1 39 HIS CE1 C 4.474 1.597 -0.933 1.00 . A A . 536 HIS CE1 1 1 14 9482 1 1 39 HIS CG C 5.496 -0.337 -1.099 1.00 . A A . 536 HIS CG 1 1 14 9483 1 1 39 HIS H H 7.009 -3.350 -3.189 1.00 . A A . 536 HIS H 1 1 14 9484 1 1 39 HIS HA H 6.984 -0.565 -3.370 1.00 . A A . 536 HIS HA 1 1 14 9485 1 1 39 HIS HB2 H 5.248 -2.040 -2.289 1.00 . A A . 536 HIS HB2 1 1 14 9486 1 1 39 HIS HB3 H 6.350 -2.245 -0.934 1.00 . A A . 536 HIS HB3 1 1 14 9487 1 1 39 HIS HD1 H 4.746 0.690 -2.781 1.00 . A A . 536 HIS HD1 1 1 14 9488 1 1 39 HIS HD2 H 5.824 -0.530 1.046 1.00 . A A . 536 HIS HD2 1 1 14 9489 1 1 39 HIS HE1 H 3.961 2.507 -1.201 1.00 . A A . 536 HIS HE1 1 1 14 9490 1 1 39 HIS N N 7.497 -2.538 -3.409 1.00 . A A . 536 HIS N 1 1 14 9491 1 1 39 HIS ND1 N 4.884 0.672 -1.810 1.00 . A A . 536 HIS ND1 1 1 14 9492 1 1 39 HIS NE2 N 4.778 1.247 0.297 1.00 . A A . 536 HIS NE2 1 1 14 9493 1 1 39 HIS O O 8.678 0.263 -1.698 1.00 . A A . 536 HIS O 1 1 14 9494 1 1 40 GLN C C 11.360 -0.569 -1.148 1.00 . A A . 537 GLN C 1 1 14 9495 1 1 40 GLN CA C 10.364 -1.527 -0.490 1.00 . A A . 537 GLN CA 1 1 14 9496 1 1 40 GLN CB C 11.080 -2.789 -0.012 1.00 . A A . 537 GLN CB 1 1 14 9497 1 1 40 GLN CD C 12.282 -4.912 -0.630 1.00 . A A . 537 GLN CD 1 1 14 9498 1 1 40 GLN CG C 11.716 -3.600 -1.128 1.00 . A A . 537 GLN CG 1 1 14 9499 1 1 40 GLN H H 9.062 -2.809 -1.596 1.00 . A A . 537 GLN H 1 1 14 9500 1 1 40 GLN HA H 9.940 -1.015 0.360 1.00 . A A . 537 GLN HA 1 1 14 9501 1 1 40 GLN HB2 H 11.856 -2.509 0.685 1.00 . A A . 537 GLN HB2 1 1 14 9502 1 1 40 GLN HB3 H 10.367 -3.419 0.497 1.00 . A A . 537 GLN HB3 1 1 14 9503 1 1 40 GLN HE21 H 10.510 -5.772 -0.826 1.00 . A A . 537 GLN HE21 1 1 14 9504 1 1 40 GLN HE22 H 11.777 -6.791 -0.237 1.00 . A A . 537 GLN HE22 1 1 14 9505 1 1 40 GLN HG2 H 10.970 -3.806 -1.891 1.00 . A A . 537 GLN HG2 1 1 14 9506 1 1 40 GLN HG3 H 12.518 -3.020 -1.556 1.00 . A A . 537 GLN HG3 1 1 14 9507 1 1 40 GLN N N 9.243 -1.862 -1.374 1.00 . A A . 537 GLN N 1 1 14 9508 1 1 40 GLN NE2 N 11.440 -5.926 -0.560 1.00 . A A . 537 GLN NE2 1 1 14 9509 1 1 40 GLN O O 11.904 0.306 -0.478 1.00 . A A . 537 GLN O 1 1 14 9510 1 1 40 GLN OE1 O 13.456 -5.002 -0.278 1.00 . A A . 537 GLN OE1 1 1 14 9511 1 1 41 HIS C C 11.891 1.472 -3.527 1.00 . A A . 538 HIS C 1 1 14 9512 1 1 41 HIS CA C 12.547 0.154 -3.126 1.00 . A A . 538 HIS CA 1 1 14 9513 1 1 41 HIS CB C 13.195 -0.534 -4.342 1.00 . A A . 538 HIS CB 1 1 14 9514 1 1 41 HIS CD2 C 11.477 -1.662 -5.897 1.00 . A A . 538 HIS CD2 1 1 14 9515 1 1 41 HIS CE1 C 11.428 -0.134 -7.436 1.00 . A A . 538 HIS CE1 1 1 14 9516 1 1 41 HIS CG C 12.320 -0.667 -5.553 1.00 . A A . 538 HIS CG 1 1 14 9517 1 1 41 HIS H H 11.157 -1.444 -2.939 1.00 . A A . 538 HIS H 1 1 14 9518 1 1 41 HIS HA H 13.328 0.392 -2.420 1.00 . A A . 538 HIS HA 1 1 14 9519 1 1 41 HIS HB2 H 14.070 0.026 -4.634 1.00 . A A . 538 HIS HB2 1 1 14 9520 1 1 41 HIS HB3 H 13.498 -1.527 -4.051 1.00 . A A . 538 HIS HB3 1 1 14 9521 1 1 41 HIS HD2 H 11.253 -2.545 -5.316 1.00 . A A . 538 HIS HD2 1 1 14 9522 1 1 41 HIS HE1 H 11.152 0.416 -8.322 1.00 . A A . 538 HIS HE1 1 1 14 9523 1 1 41 HIS HE2 H 10.049 -1.677 -7.433 1.00 . A A . 538 HIS HE2 1 1 14 9524 1 1 41 HIS N N 11.600 -0.722 -2.447 1.00 . A A . 538 HIS N 1 1 14 9525 1 1 41 HIS ND1 N 12.291 0.297 -6.530 1.00 . A A . 538 HIS ND1 1 1 14 9526 1 1 41 HIS NE2 N 10.909 -1.321 -7.097 1.00 . A A . 538 HIS NE2 1 1 14 9527 1 1 41 HIS O O 12.581 2.461 -3.778 1.00 . A A . 538 HIS O 1 1 14 9528 1 1 42 ILE C C 9.490 3.503 -2.663 1.00 . A A . 539 ILE C 1 1 14 9529 1 1 42 ILE CA C 9.862 2.730 -3.937 1.00 . A A . 539 ILE CA 1 1 14 9530 1 1 42 ILE CB C 8.602 2.442 -4.812 1.00 . A A . 539 ILE CB 1 1 14 9531 1 1 42 ILE CD1 C 6.490 3.228 -3.623 1.00 . A A . 539 ILE CD1 1 1 14 9532 1 1 42 ILE CG1 C 7.369 2.050 -3.991 1.00 . A A . 539 ILE CG1 1 1 14 9533 1 1 42 ILE CG2 C 8.910 1.352 -5.821 1.00 . A A . 539 ILE CG2 1 1 14 9534 1 1 42 ILE H H 10.050 0.667 -3.461 1.00 . A A . 539 ILE H 1 1 14 9535 1 1 42 ILE HA H 10.536 3.341 -4.518 1.00 . A A . 539 ILE HA 1 1 14 9536 1 1 42 ILE HB H 8.373 3.330 -5.364 1.00 . A A . 539 ILE HB 1 1 14 9537 1 1 42 ILE HD11 H 6.137 3.707 -4.524 1.00 . A A . 539 ILE HD11 1 1 14 9538 1 1 42 ILE HD12 H 5.646 2.886 -3.042 1.00 . A A . 539 ILE HD12 1 1 14 9539 1 1 42 ILE HD13 H 7.066 3.935 -3.043 1.00 . A A . 539 ILE HD13 1 1 14 9540 1 1 42 ILE HG12 H 6.774 1.361 -4.559 1.00 . A A . 539 ILE HG12 1 1 14 9541 1 1 42 ILE HG13 H 7.686 1.573 -3.076 1.00 . A A . 539 ILE HG13 1 1 14 9542 1 1 42 ILE HG21 H 9.271 0.474 -5.302 1.00 . A A . 539 ILE HG21 1 1 14 9543 1 1 42 ILE HG22 H 8.016 1.105 -6.371 1.00 . A A . 539 ILE HG22 1 1 14 9544 1 1 42 ILE HG23 H 9.671 1.700 -6.505 1.00 . A A . 539 ILE HG23 1 1 14 9545 1 1 42 ILE N N 10.564 1.497 -3.602 1.00 . A A . 539 ILE N 1 1 14 9546 1 1 42 ILE O O 9.561 4.735 -2.620 1.00 . A A . 539 ILE O 1 1 14 9547 1 1 43 CYS C C 9.681 4.228 0.186 1.00 . A A . 540 CYS C 1 1 14 9548 1 1 43 CYS CA C 8.605 3.316 -0.405 1.00 . A A . 540 CYS CA 1 1 14 9549 1 1 43 CYS CB C 8.334 2.157 0.557 1.00 . A A . 540 CYS CB 1 1 14 9550 1 1 43 CYS H H 8.905 1.790 -1.830 1.00 . A A . 540 CYS H 1 1 14 9551 1 1 43 CYS HA H 7.691 3.871 -0.555 1.00 . A A . 540 CYS HA 1 1 14 9552 1 1 43 CYS HB2 H 7.731 1.418 0.052 1.00 . A A . 540 CYS HB2 1 1 14 9553 1 1 43 CYS HB3 H 9.277 1.711 0.834 1.00 . A A . 540 CYS HB3 1 1 14 9554 1 1 43 CYS N N 9.030 2.762 -1.675 1.00 . A A . 540 CYS N 1 1 14 9555 1 1 43 CYS O O 10.815 3.813 0.438 1.00 . A A . 540 CYS O 1 1 14 9556 1 1 43 CYS SG S 7.470 2.608 2.089 1.00 . A A . 540 CYS SG 1 1 14 9557 1 1 44 GLY C C 9.697 7.865 0.545 1.00 . A A . 541 GLY C 1 1 14 9558 1 1 44 GLY CA C 10.205 6.482 0.874 1.00 . A A . 541 GLY CA 1 1 14 9559 1 1 44 GLY H H 8.350 5.696 0.252 1.00 . A A . 541 GLY H 1 1 14 9560 1 1 44 GLY HA2 H 10.319 6.392 1.946 1.00 . A A . 541 GLY HA2 1 1 14 9561 1 1 44 GLY HA3 H 11.165 6.338 0.401 1.00 . A A . 541 GLY HA3 1 1 14 9562 1 1 44 GLY N N 9.288 5.467 0.406 1.00 . A A . 541 GLY N 1 1 14 9563 1 1 44 GLY O O 9.030 8.492 1.363 1.00 . A A . 541 GLY O 1 1 14 9564 1 1 45 GLN C C 9.099 9.548 -2.596 1.00 . A A . 542 GLN C 1 1 14 9565 1 1 45 GLN CA C 9.498 9.630 -1.127 1.00 . A A . 542 GLN CA 1 1 14 9566 1 1 45 GLN CB C 10.569 10.716 -0.922 1.00 . A A . 542 GLN CB 1 1 14 9567 1 1 45 GLN CD C 12.703 9.478 -1.609 1.00 . A A . 542 GLN CD 1 1 14 9568 1 1 45 GLN CG C 11.761 10.641 -1.875 1.00 . A A . 542 GLN CG 1 1 14 9569 1 1 45 GLN H H 10.512 7.778 -1.287 1.00 . A A . 542 GLN H 1 1 14 9570 1 1 45 GLN HA H 8.623 9.884 -0.545 1.00 . A A . 542 GLN HA 1 1 14 9571 1 1 45 GLN HB2 H 10.103 11.682 -1.049 1.00 . A A . 542 GLN HB2 1 1 14 9572 1 1 45 GLN HB3 H 10.942 10.643 0.089 1.00 . A A . 542 GLN HB3 1 1 14 9573 1 1 45 GLN HE21 H 12.268 9.505 0.331 1.00 . A A . 542 GLN HE21 1 1 14 9574 1 1 45 GLN HE22 H 13.401 8.297 -0.175 1.00 . A A . 542 GLN HE22 1 1 14 9575 1 1 45 GLN HG2 H 11.388 10.550 -2.883 1.00 . A A . 542 GLN HG2 1 1 14 9576 1 1 45 GLN HG3 H 12.323 11.561 -1.788 1.00 . A A . 542 GLN HG3 1 1 14 9577 1 1 45 GLN N N 9.970 8.328 -0.672 1.00 . A A . 542 GLN N 1 1 14 9578 1 1 45 GLN NE2 N 12.801 9.053 -0.360 1.00 . A A . 542 GLN NE2 1 1 14 9579 1 1 45 GLN O O 9.470 8.600 -3.285 1.00 . A A . 542 GLN O 1 1 14 9580 1 1 45 GLN OE1 O 13.346 8.969 -2.522 1.00 . A A . 542 GLN OE1 1 1 14 9581 1 1 46 SER C C 7.605 11.991 -4.871 1.00 . A A . 543 SER C 1 1 14 9582 1 1 46 SER CA C 7.873 10.552 -4.448 1.00 . A A . 543 SER CA 1 1 14 9583 1 1 46 SER CB C 6.594 9.721 -4.626 1.00 . A A . 543 SER CB 1 1 14 9584 1 1 46 SER H H 8.053 11.244 -2.464 1.00 . A A . 543 SER H 1 1 14 9585 1 1 46 SER HA H 8.656 10.140 -5.069 1.00 . A A . 543 SER HA 1 1 14 9586 1 1 46 SER HB2 H 5.810 10.142 -4.015 1.00 . A A . 543 SER HB2 1 1 14 9587 1 1 46 SER HB3 H 6.294 9.748 -5.664 1.00 . A A . 543 SER HB3 1 1 14 9588 1 1 46 SER HG H 6.818 7.811 -5.038 1.00 . A A . 543 SER HG 1 1 14 9589 1 1 46 SER N N 8.324 10.518 -3.062 1.00 . A A . 543 SER N 1 1 14 9590 1 1 46 SER O O 6.990 12.755 -4.125 1.00 . A A . 543 SER O 1 1 14 9591 1 1 46 SER OG O 6.792 8.371 -4.243 1.00 . A A . 543 SER OG 1 1 14 9592 1 1 47 ALA C C 7.506 13.626 -8.064 1.00 . A A . 544 ALA C 1 1 14 9593 1 1 47 ALA CA C 7.835 13.691 -6.581 1.00 . A A . 544 ALA CA 1 1 14 9594 1 1 47 ALA CB C 9.044 14.582 -6.338 1.00 . A A . 544 ALA CB 1 1 14 9595 1 1 47 ALA H H 8.573 11.711 -6.593 1.00 . A A . 544 ALA H 1 1 14 9596 1 1 47 ALA HA H 6.991 14.114 -6.054 1.00 . A A . 544 ALA HA 1 1 14 9597 1 1 47 ALA HB1 H 9.897 14.189 -6.872 1.00 . A A . 544 ALA HB1 1 1 14 9598 1 1 47 ALA HB2 H 8.830 15.581 -6.687 1.00 . A A . 544 ALA HB2 1 1 14 9599 1 1 47 ALA HB3 H 9.263 14.610 -5.280 1.00 . A A . 544 ALA HB3 1 1 14 9600 1 1 47 ALA N N 8.065 12.355 -6.055 1.00 . A A . 544 ALA N 1 1 14 9601 1 1 47 ALA O O 8.442 13.510 -8.879 1.00 . A A . 544 ALA O 1 1 14 9602 1 1 47 ALA OXT O 6.309 13.673 -8.410 1.00 . A A . 544 ALA OXT 1 1 14 9603 2 2 1 ZN ZN ZN -5.527 -5.708 -1.045 1.00 . B A . 601 ZN ZN 1 1 14 9604 3 2 1 ZN ZN ZN 5.222 2.596 1.682 1.00 . C A . 602 ZN ZN 1 1 15 9605 1 1 1 GLY C C -14.139 0.509 2.689 1.00 . A A . 498 GLY C 1 1 15 9606 1 1 1 GLY CA C -13.831 -0.963 2.858 1.00 . A A . 498 GLY CA 1 1 15 9607 1 1 1 GLY H1 H -15.735 -1.677 2.390 1.00 . A A . 498 GLY H1 1 1 15 9608 1 1 1 GLY H2 H -15.489 -1.394 4.045 1.00 . A A . 498 GLY H2 1 1 15 9609 1 1 1 GLY H3 H -14.805 -2.755 3.305 1.00 . A A . 498 GLY H3 1 1 15 9610 1 1 1 GLY HA2 H -13.123 -1.082 3.664 1.00 . A A . 498 GLY HA2 1 1 15 9611 1 1 1 GLY HA3 H -13.392 -1.339 1.945 1.00 . A A . 498 GLY HA3 1 1 15 9612 1 1 1 GLY N N -15.049 -1.752 3.170 1.00 . A A . 498 GLY N 1 1 15 9613 1 1 1 GLY O O -15.307 0.909 2.675 1.00 . A A . 498 GLY O 1 1 15 9614 1 1 2 ALA C C -13.425 3.110 0.937 1.00 . A A . 499 ALA C 1 1 15 9615 1 1 2 ALA CA C -13.264 2.751 2.404 1.00 . A A . 499 ALA CA 1 1 15 9616 1 1 2 ALA CB C -12.079 3.488 3.005 1.00 . A A . 499 ALA CB 1 1 15 9617 1 1 2 ALA H H -12.190 0.933 2.533 1.00 . A A . 499 ALA H 1 1 15 9618 1 1 2 ALA HA H -14.155 3.046 2.942 1.00 . A A . 499 ALA HA 1 1 15 9619 1 1 2 ALA HB1 H -11.174 3.186 2.500 1.00 . A A . 499 ALA HB1 1 1 15 9620 1 1 2 ALA HB2 H -12.221 4.553 2.887 1.00 . A A . 499 ALA HB2 1 1 15 9621 1 1 2 ALA HB3 H -12.003 3.251 4.055 1.00 . A A . 499 ALA HB3 1 1 15 9622 1 1 2 ALA N N -13.099 1.317 2.555 1.00 . A A . 499 ALA N 1 1 15 9623 1 1 2 ALA O O -12.617 2.714 0.101 1.00 . A A . 499 ALA O 1 1 15 9624 1 1 3 MET C C -13.935 5.442 -1.199 1.00 . A A . 500 MET C 1 1 15 9625 1 1 3 MET CA C -14.739 4.224 -0.764 1.00 . A A . 500 MET CA 1 1 15 9626 1 1 3 MET CB C -16.238 4.465 -0.962 1.00 . A A . 500 MET CB 1 1 15 9627 1 1 3 MET CE C -18.855 4.096 -2.743 1.00 . A A . 500 MET CE 1 1 15 9628 1 1 3 MET CG C -17.076 3.204 -0.809 1.00 . A A . 500 MET CG 1 1 15 9629 1 1 3 MET H H -15.024 4.243 1.339 1.00 . A A . 500 MET H 1 1 15 9630 1 1 3 MET HA H -14.441 3.382 -1.374 1.00 . A A . 500 MET HA 1 1 15 9631 1 1 3 MET HB2 H -16.573 5.188 -0.233 1.00 . A A . 500 MET HB2 1 1 15 9632 1 1 3 MET HB3 H -16.399 4.862 -1.953 1.00 . A A . 500 MET HB3 1 1 15 9633 1 1 3 MET HE1 H -18.425 3.354 -3.399 1.00 . A A . 500 MET HE1 1 1 15 9634 1 1 3 MET HE2 H -19.873 4.296 -3.045 1.00 . A A . 500 MET HE2 1 1 15 9635 1 1 3 MET HE3 H -18.278 5.007 -2.800 1.00 . A A . 500 MET HE3 1 1 15 9636 1 1 3 MET HG2 H -16.741 2.476 -1.532 1.00 . A A . 500 MET HG2 1 1 15 9637 1 1 3 MET HG3 H -16.928 2.811 0.187 1.00 . A A . 500 MET HG3 1 1 15 9638 1 1 3 MET N N -14.453 3.879 0.622 1.00 . A A . 500 MET N 1 1 15 9639 1 1 3 MET O O -14.170 6.001 -2.268 1.00 . A A . 500 MET O 1 1 15 9640 1 1 3 MET SD S -18.841 3.486 -1.059 1.00 . A A . 500 MET SD 1 1 15 9641 1 1 4 GLU C C -10.846 6.421 -1.420 1.00 . A A . 501 GLU C 1 1 15 9642 1 1 4 GLU CA C -12.084 6.940 -0.693 1.00 . A A . 501 GLU CA 1 1 15 9643 1 1 4 GLU CB C -11.650 7.670 0.583 1.00 . A A . 501 GLU CB 1 1 15 9644 1 1 4 GLU CD C -10.036 9.322 1.611 1.00 . A A . 501 GLU CD 1 1 15 9645 1 1 4 GLU CG C -10.631 8.775 0.335 1.00 . A A . 501 GLU CG 1 1 15 9646 1 1 4 GLU H H -12.887 5.387 0.494 1.00 . A A . 501 GLU H 1 1 15 9647 1 1 4 GLU HA H -12.612 7.628 -1.337 1.00 . A A . 501 GLU HA 1 1 15 9648 1 1 4 GLU HB2 H -12.521 8.110 1.047 1.00 . A A . 501 GLU HB2 1 1 15 9649 1 1 4 GLU HB3 H -11.214 6.954 1.262 1.00 . A A . 501 GLU HB3 1 1 15 9650 1 1 4 GLU HG2 H -9.833 8.380 -0.275 1.00 . A A . 501 GLU HG2 1 1 15 9651 1 1 4 GLU HG3 H -11.118 9.582 -0.192 1.00 . A A . 501 GLU HG3 1 1 15 9652 1 1 4 GLU N N -12.983 5.841 -0.367 1.00 . A A . 501 GLU N 1 1 15 9653 1 1 4 GLU O O -10.235 7.131 -2.219 1.00 . A A . 501 GLU O 1 1 15 9654 1 1 4 GLU OE1 O -9.176 8.641 2.208 1.00 . A A . 501 GLU OE1 1 1 15 9655 1 1 4 GLU OE2 O -10.425 10.432 2.024 1.00 . A A . 501 GLU OE2 1 1 15 9656 1 1 5 GLN C C -9.399 3.228 -2.202 1.00 . A A . 502 GLN C 1 1 15 9657 1 1 5 GLN CA C -9.229 4.623 -1.619 1.00 . A A . 502 GLN CA 1 1 15 9658 1 1 5 GLN CB C -8.231 4.606 -0.457 1.00 . A A . 502 GLN CB 1 1 15 9659 1 1 5 GLN CD C -7.788 4.046 1.965 1.00 . A A . 502 GLN CD 1 1 15 9660 1 1 5 GLN CG C -8.737 3.902 0.790 1.00 . A A . 502 GLN CG 1 1 15 9661 1 1 5 GLN H H -11.119 4.589 -0.672 1.00 . A A . 502 GLN H 1 1 15 9662 1 1 5 GLN HA H -8.838 5.271 -2.389 1.00 . A A . 502 GLN HA 1 1 15 9663 1 1 5 GLN HB2 H -7.328 4.109 -0.781 1.00 . A A . 502 GLN HB2 1 1 15 9664 1 1 5 GLN HB3 H -7.991 5.626 -0.193 1.00 . A A . 502 GLN HB3 1 1 15 9665 1 1 5 GLN HE21 H -7.216 5.840 1.325 1.00 . A A . 502 GLN HE21 1 1 15 9666 1 1 5 GLN HE22 H -6.469 5.287 2.781 1.00 . A A . 502 GLN HE22 1 1 15 9667 1 1 5 GLN HG2 H -9.691 4.325 1.063 1.00 . A A . 502 GLN HG2 1 1 15 9668 1 1 5 GLN HG3 H -8.859 2.851 0.569 1.00 . A A . 502 GLN HG3 1 1 15 9669 1 1 5 GLN N N -10.498 5.169 -1.162 1.00 . A A . 502 GLN N 1 1 15 9670 1 1 5 GLN NE2 N -7.087 5.171 2.030 1.00 . A A . 502 GLN NE2 1 1 15 9671 1 1 5 GLN O O -10.403 2.560 -1.953 1.00 . A A . 502 GLN O 1 1 15 9672 1 1 5 GLN OE1 O -7.690 3.162 2.811 1.00 . A A . 502 GLN OE1 1 1 15 9673 1 1 6 SER C C -7.139 0.757 -3.370 1.00 . A A . 503 SER C 1 1 15 9674 1 1 6 SER CA C -8.454 1.492 -3.618 1.00 . A A . 503 SER CA 1 1 15 9675 1 1 6 SER CB C -8.719 1.633 -5.121 1.00 . A A . 503 SER CB 1 1 15 9676 1 1 6 SER H H -7.667 3.396 -3.174 1.00 . A A . 503 SER H 1 1 15 9677 1 1 6 SER HA H -9.259 0.929 -3.169 1.00 . A A . 503 SER HA 1 1 15 9678 1 1 6 SER HB2 H -8.655 0.663 -5.589 1.00 . A A . 503 SER HB2 1 1 15 9679 1 1 6 SER HB3 H -9.709 2.040 -5.272 1.00 . A A . 503 SER HB3 1 1 15 9680 1 1 6 SER HG H -7.212 1.985 -6.328 1.00 . A A . 503 SER HG 1 1 15 9681 1 1 6 SER N N -8.428 2.807 -2.998 1.00 . A A . 503 SER N 1 1 15 9682 1 1 6 SER O O -6.065 1.312 -3.581 1.00 . A A . 503 SER O 1 1 15 9683 1 1 6 SER OG O -7.774 2.499 -5.736 1.00 . A A . 503 SER OG 1 1 15 9684 1 1 7 CYS C C -5.270 -1.446 -3.958 1.00 . A A . 504 CYS C 1 1 15 9685 1 1 7 CYS CA C -6.049 -1.293 -2.669 1.00 . A A . 504 CYS CA 1 1 15 9686 1 1 7 CYS CB C -6.428 -2.674 -2.128 1.00 . A A . 504 CYS CB 1 1 15 9687 1 1 7 CYS H H -8.124 -0.879 -2.764 1.00 . A A . 504 CYS H 1 1 15 9688 1 1 7 CYS HA H -5.434 -0.789 -1.936 1.00 . A A . 504 CYS HA 1 1 15 9689 1 1 7 CYS HB2 H -7.070 -2.555 -1.269 1.00 . A A . 504 CYS HB2 1 1 15 9690 1 1 7 CYS HB3 H -6.957 -3.216 -2.893 1.00 . A A . 504 CYS HB3 1 1 15 9691 1 1 7 CYS N N -7.229 -0.489 -2.920 1.00 . A A . 504 CYS N 1 1 15 9692 1 1 7 CYS O O -5.814 -1.868 -4.981 1.00 . A A . 504 CYS O 1 1 15 9693 1 1 7 CYS SG S -4.997 -3.692 -1.616 1.00 . A A . 504 CYS SG 1 1 15 9694 1 1 8 VAL C C -2.969 -2.619 -5.512 1.00 . A A . 505 VAL C 1 1 15 9695 1 1 8 VAL CA C -3.132 -1.164 -5.060 1.00 . A A . 505 VAL CA 1 1 15 9696 1 1 8 VAL CB C -1.756 -0.524 -4.754 1.00 . A A . 505 VAL CB 1 1 15 9697 1 1 8 VAL CG1 C -0.980 -1.340 -3.731 1.00 . A A . 505 VAL CG1 1 1 15 9698 1 1 8 VAL CG2 C -0.943 -0.327 -6.022 1.00 . A A . 505 VAL CG2 1 1 15 9699 1 1 8 VAL H H -3.650 -0.720 -3.061 1.00 . A A . 505 VAL H 1 1 15 9700 1 1 8 VAL HA H -3.594 -0.604 -5.859 1.00 . A A . 505 VAL HA 1 1 15 9701 1 1 8 VAL HB H -1.936 0.451 -4.325 1.00 . A A . 505 VAL HB 1 1 15 9702 1 1 8 VAL HG11 H -0.807 -2.334 -4.118 1.00 . A A . 505 VAL HG11 1 1 15 9703 1 1 8 VAL HG12 H -0.034 -0.860 -3.534 1.00 . A A . 505 VAL HG12 1 1 15 9704 1 1 8 VAL HG13 H -1.550 -1.405 -2.816 1.00 . A A . 505 VAL HG13 1 1 15 9705 1 1 8 VAL HG21 H -1.490 0.308 -6.704 1.00 . A A . 505 VAL HG21 1 1 15 9706 1 1 8 VAL HG22 H 0.000 0.138 -5.775 1.00 . A A . 505 VAL HG22 1 1 15 9707 1 1 8 VAL HG23 H -0.764 -1.284 -6.488 1.00 . A A . 505 VAL HG23 1 1 15 9708 1 1 8 VAL N N -4.004 -1.083 -3.902 1.00 . A A . 505 VAL N 1 1 15 9709 1 1 8 VAL O O -2.573 -2.890 -6.647 1.00 . A A . 505 VAL O 1 1 15 9710 1 1 9 ASN C C -4.576 -5.538 -5.341 1.00 . A A . 506 ASN C 1 1 15 9711 1 1 9 ASN CA C -3.213 -4.973 -4.949 1.00 . A A . 506 ASN CA 1 1 15 9712 1 1 9 ASN CB C -2.646 -5.743 -3.747 1.00 . A A . 506 ASN CB 1 1 15 9713 1 1 9 ASN CG C -2.485 -7.231 -4.008 1.00 . A A . 506 ASN CG 1 1 15 9714 1 1 9 ASN H H -3.586 -3.295 -3.721 1.00 . A A . 506 ASN H 1 1 15 9715 1 1 9 ASN HA H -2.539 -5.083 -5.783 1.00 . A A . 506 ASN HA 1 1 15 9716 1 1 9 ASN HB2 H -1.678 -5.337 -3.495 1.00 . A A . 506 ASN HB2 1 1 15 9717 1 1 9 ASN HB3 H -3.311 -5.616 -2.907 1.00 . A A . 506 ASN HB3 1 1 15 9718 1 1 9 ASN HD21 H -4.247 -7.609 -3.165 1.00 . A A . 506 ASN HD21 1 1 15 9719 1 1 9 ASN HD22 H -3.382 -8.980 -3.758 1.00 . A A . 506 ASN HD22 1 1 15 9720 1 1 9 ASN N N -3.299 -3.556 -4.627 1.00 . A A . 506 ASN N 1 1 15 9721 1 1 9 ASN ND2 N -3.469 -8.019 -3.606 1.00 . A A . 506 ASN ND2 1 1 15 9722 1 1 9 ASN O O -4.662 -6.485 -6.125 1.00 . A A . 506 ASN O 1 1 15 9723 1 1 9 ASN OD1 O -1.470 -7.670 -4.546 1.00 . A A . 506 ASN OD1 1 1 15 9724 1 1 10 CYS C C -7.924 -4.465 -5.663 1.00 . A A . 507 CYS C 1 1 15 9725 1 1 10 CYS CA C -6.980 -5.489 -5.025 1.00 . A A . 507 CYS CA 1 1 15 9726 1 1 10 CYS CB C -7.556 -5.982 -3.699 1.00 . A A . 507 CYS CB 1 1 15 9727 1 1 10 CYS H H -5.530 -4.136 -4.272 1.00 . A A . 507 CYS H 1 1 15 9728 1 1 10 CYS HA H -6.887 -6.329 -5.694 1.00 . A A . 507 CYS HA 1 1 15 9729 1 1 10 CYS HB2 H -7.845 -5.131 -3.099 1.00 . A A . 507 CYS HB2 1 1 15 9730 1 1 10 CYS HB3 H -8.427 -6.590 -3.897 1.00 . A A . 507 CYS HB3 1 1 15 9731 1 1 10 CYS N N -5.644 -4.949 -4.810 1.00 . A A . 507 CYS N 1 1 15 9732 1 1 10 CYS O O -8.121 -4.466 -6.882 1.00 . A A . 507 CYS O 1 1 15 9733 1 1 10 CYS SG S -6.390 -6.982 -2.718 1.00 . A A . 507 CYS SG 1 1 15 9734 1 1 11 GLY C C -10.079 -1.792 -4.232 1.00 . A A . 508 GLY C 1 1 15 9735 1 1 11 GLY CA C -9.459 -2.625 -5.342 1.00 . A A . 508 GLY CA 1 1 15 9736 1 1 11 GLY H H -8.284 -3.619 -3.890 1.00 . A A . 508 GLY H 1 1 15 9737 1 1 11 GLY HA2 H -8.955 -1.966 -6.035 1.00 . A A . 508 GLY HA2 1 1 15 9738 1 1 11 GLY HA3 H -10.245 -3.147 -5.867 1.00 . A A . 508 GLY HA3 1 1 15 9739 1 1 11 GLY N N -8.505 -3.598 -4.842 1.00 . A A . 508 GLY N 1 1 15 9740 1 1 11 GLY O O -9.500 -1.666 -3.155 1.00 . A A . 508 GLY O 1 1 15 9741 1 1 12 ARG C C -12.177 -0.926 -2.159 1.00 . A A . 509 ARG C 1 1 15 9742 1 1 12 ARG CA C -11.987 -0.345 -3.572 1.00 . A A . 509 ARG CA 1 1 15 9743 1 1 12 ARG CB C -13.351 -0.001 -4.186 1.00 . A A . 509 ARG CB 1 1 15 9744 1 1 12 ARG CD C -13.258 2.417 -3.474 1.00 . A A . 509 ARG CD 1 1 15 9745 1 1 12 ARG CG C -14.089 1.142 -3.500 1.00 . A A . 509 ARG CG 1 1 15 9746 1 1 12 ARG CZ C -12.451 3.972 -5.215 1.00 . A A . 509 ARG CZ 1 1 15 9747 1 1 12 ARG H H -11.660 -1.384 -5.389 1.00 . A A . 509 ARG H 1 1 15 9748 1 1 12 ARG HA H -11.412 0.565 -3.490 1.00 . A A . 509 ARG HA 1 1 15 9749 1 1 12 ARG HB2 H -13.203 0.271 -5.220 1.00 . A A . 509 ARG HB2 1 1 15 9750 1 1 12 ARG HB3 H -13.978 -0.880 -4.145 1.00 . A A . 509 ARG HB3 1 1 15 9751 1 1 12 ARG HD2 H -13.891 3.234 -3.164 1.00 . A A . 509 ARG HD2 1 1 15 9752 1 1 12 ARG HD3 H -12.456 2.293 -2.760 1.00 . A A . 509 ARG HD3 1 1 15 9753 1 1 12 ARG HE H -12.419 1.978 -5.356 1.00 . A A . 509 ARG HE 1 1 15 9754 1 1 12 ARG HG2 H -15.007 1.333 -4.033 1.00 . A A . 509 ARG HG2 1 1 15 9755 1 1 12 ARG HG3 H -14.315 0.851 -2.484 1.00 . A A . 509 ARG HG3 1 1 15 9756 1 1 12 ARG HH11 H -13.339 4.890 -3.642 1.00 . A A . 509 ARG HH11 1 1 15 9757 1 1 12 ARG HH12 H -12.672 5.956 -4.839 1.00 . A A . 509 ARG HH12 1 1 15 9758 1 1 12 ARG HH21 H -11.560 3.353 -6.927 1.00 . A A . 509 ARG HH21 1 1 15 9759 1 1 12 ARG HH22 H -11.648 5.083 -6.714 1.00 . A A . 509 ARG HH22 1 1 15 9760 1 1 12 ARG N N -11.266 -1.242 -4.496 1.00 . A A . 509 ARG N 1 1 15 9761 1 1 12 ARG NE N -12.682 2.736 -4.781 1.00 . A A . 509 ARG NE 1 1 15 9762 1 1 12 ARG NH1 N -12.852 5.019 -4.510 1.00 . A A . 509 ARG NH1 1 1 15 9763 1 1 12 ARG NH2 N -11.842 4.152 -6.378 1.00 . A A . 509 ARG NH2 1 1 15 9764 1 1 12 ARG O O -12.622 -0.225 -1.251 1.00 . A A . 509 ARG O 1 1 15 9765 1 1 13 GLU C C -10.872 -2.232 0.302 1.00 . A A . 510 GLU C 1 1 15 9766 1 1 13 GLU CA C -11.912 -2.830 -0.666 1.00 . A A . 510 GLU CA 1 1 15 9767 1 1 13 GLU CB C -11.697 -4.341 -0.811 1.00 . A A . 510 GLU CB 1 1 15 9768 1 1 13 GLU CD C -13.529 -4.982 0.800 1.00 . A A . 510 GLU CD 1 1 15 9769 1 1 13 GLU CG C -12.070 -5.139 0.429 1.00 . A A . 510 GLU CG 1 1 15 9770 1 1 13 GLU H H -11.558 -2.722 -2.751 1.00 . A A . 510 GLU H 1 1 15 9771 1 1 13 GLU HA H -12.894 -2.653 -0.268 1.00 . A A . 510 GLU HA 1 1 15 9772 1 1 13 GLU HB2 H -12.295 -4.700 -1.635 1.00 . A A . 510 GLU HB2 1 1 15 9773 1 1 13 GLU HB3 H -10.655 -4.524 -1.029 1.00 . A A . 510 GLU HB3 1 1 15 9774 1 1 13 GLU HG2 H -11.870 -6.184 0.244 1.00 . A A . 510 GLU HG2 1 1 15 9775 1 1 13 GLU HG3 H -11.464 -4.798 1.256 1.00 . A A . 510 GLU HG3 1 1 15 9776 1 1 13 GLU N N -11.848 -2.195 -1.978 1.00 . A A . 510 GLU N 1 1 15 9777 1 1 13 GLU O O -10.829 -2.601 1.479 1.00 . A A . 510 GLU O 1 1 15 9778 1 1 13 GLU OE1 O -14.366 -5.735 0.262 1.00 . A A . 510 GLU OE1 1 1 15 9779 1 1 13 GLU OE2 O -13.847 -4.105 1.626 1.00 . A A . 510 GLU OE2 1 1 15 9780 1 1 14 ALA C C -9.436 -0.188 1.937 1.00 . A A . 511 ALA C 1 1 15 9781 1 1 14 ALA CA C -8.970 -0.691 0.576 1.00 . A A . 511 ALA CA 1 1 15 9782 1 1 14 ALA CB C -8.342 0.458 -0.194 1.00 . A A . 511 ALA CB 1 1 15 9783 1 1 14 ALA H H -10.143 -1.069 -1.148 1.00 . A A . 511 ALA H 1 1 15 9784 1 1 14 ALA HA H -8.204 -1.435 0.731 1.00 . A A . 511 ALA HA 1 1 15 9785 1 1 14 ALA HB1 H -9.073 1.237 -0.346 1.00 . A A . 511 ALA HB1 1 1 15 9786 1 1 14 ALA HB2 H -7.505 0.854 0.368 1.00 . A A . 511 ALA HB2 1 1 15 9787 1 1 14 ALA HB3 H -7.993 0.100 -1.152 1.00 . A A . 511 ALA HB3 1 1 15 9788 1 1 14 ALA N N -10.041 -1.319 -0.208 1.00 . A A . 511 ALA N 1 1 15 9789 1 1 14 ALA O O -10.585 0.226 2.119 1.00 . A A . 511 ALA O 1 1 15 9790 1 1 15 MET C C -7.495 0.508 5.008 1.00 . A A . 512 MET C 1 1 15 9791 1 1 15 MET CA C -8.784 0.213 4.245 1.00 . A A . 512 MET CA 1 1 15 9792 1 1 15 MET CB C -9.591 -0.854 4.991 1.00 . A A . 512 MET CB 1 1 15 9793 1 1 15 MET CE C -12.393 -1.401 6.462 1.00 . A A . 512 MET CE 1 1 15 9794 1 1 15 MET CG C -9.769 -0.559 6.475 1.00 . A A . 512 MET CG 1 1 15 9795 1 1 15 MET H H -7.608 -0.503 2.640 1.00 . A A . 512 MET H 1 1 15 9796 1 1 15 MET HA H -9.369 1.118 4.188 1.00 . A A . 512 MET HA 1 1 15 9797 1 1 15 MET HB2 H -10.570 -0.928 4.541 1.00 . A A . 512 MET HB2 1 1 15 9798 1 1 15 MET HB3 H -9.085 -1.802 4.893 1.00 . A A . 512 MET HB3 1 1 15 9799 1 1 15 MET HE1 H -12.273 -1.571 5.402 1.00 . A A . 512 MET HE1 1 1 15 9800 1 1 15 MET HE2 H -13.162 -2.053 6.847 1.00 . A A . 512 MET HE2 1 1 15 9801 1 1 15 MET HE3 H -12.672 -0.373 6.635 1.00 . A A . 512 MET HE3 1 1 15 9802 1 1 15 MET HG2 H -8.801 -0.587 6.950 1.00 . A A . 512 MET HG2 1 1 15 9803 1 1 15 MET HG3 H -10.192 0.429 6.586 1.00 . A A . 512 MET HG3 1 1 15 9804 1 1 15 MET N N -8.510 -0.210 2.880 1.00 . A A . 512 MET N 1 1 15 9805 1 1 15 MET O O -7.484 1.350 5.908 1.00 . A A . 512 MET O 1 1 15 9806 1 1 15 MET SD S -10.847 -1.744 7.299 1.00 . A A . 512 MET SD 1 1 15 9807 1 1 16 SER C C -4.059 0.551 4.551 1.00 . A A . 513 SER C 1 1 15 9808 1 1 16 SER CA C -5.178 -0.032 5.409 1.00 . A A . 513 SER CA 1 1 15 9809 1 1 16 SER CB C -4.772 -1.384 6.005 1.00 . A A . 513 SER CB 1 1 15 9810 1 1 16 SER H H -6.407 -0.677 3.818 1.00 . A A . 513 SER H 1 1 15 9811 1 1 16 SER HA H -5.387 0.674 6.197 1.00 . A A . 513 SER HA 1 1 15 9812 1 1 16 SER HB2 H -4.557 -2.076 5.206 1.00 . A A . 513 SER HB2 1 1 15 9813 1 1 16 SER HB3 H -3.893 -1.254 6.619 1.00 . A A . 513 SER HB3 1 1 15 9814 1 1 16 SER HG H -6.217 -1.208 7.329 1.00 . A A . 513 SER HG 1 1 15 9815 1 1 16 SER N N -6.403 -0.156 4.643 1.00 . A A . 513 SER N 1 1 15 9816 1 1 16 SER O O -3.897 0.206 3.387 1.00 . A A . 513 SER O 1 1 15 9817 1 1 16 SER OG O -5.813 -1.922 6.809 1.00 . A A . 513 SER OG 1 1 15 9818 1 1 17 GLU C C -0.875 1.714 4.895 1.00 . A A . 514 GLU C 1 1 15 9819 1 1 17 GLU CA C -2.258 2.183 4.457 1.00 . A A . 514 GLU CA 1 1 15 9820 1 1 17 GLU CB C -2.428 3.675 4.749 1.00 . A A . 514 GLU CB 1 1 15 9821 1 1 17 GLU CD C -3.081 5.407 6.447 1.00 . A A . 514 GLU CD 1 1 15 9822 1 1 17 GLU CG C -2.545 4.010 6.222 1.00 . A A . 514 GLU CG 1 1 15 9823 1 1 17 GLU H H -3.447 1.622 6.108 1.00 . A A . 514 GLU H 1 1 15 9824 1 1 17 GLU HA H -2.385 2.048 3.392 1.00 . A A . 514 GLU HA 1 1 15 9825 1 1 17 GLU HB2 H -1.577 4.205 4.352 1.00 . A A . 514 GLU HB2 1 1 15 9826 1 1 17 GLU HB3 H -3.321 4.025 4.252 1.00 . A A . 514 GLU HB3 1 1 15 9827 1 1 17 GLU HG2 H -3.214 3.304 6.690 1.00 . A A . 514 GLU HG2 1 1 15 9828 1 1 17 GLU HG3 H -1.568 3.937 6.674 1.00 . A A . 514 GLU HG3 1 1 15 9829 1 1 17 GLU N N -3.304 1.449 5.151 1.00 . A A . 514 GLU N 1 1 15 9830 1 1 17 GLU O O -0.732 1.085 5.947 1.00 . A A . 514 GLU O 1 1 15 9831 1 1 17 GLU OE1 O -2.327 6.375 6.235 1.00 . A A . 514 GLU OE1 1 1 15 9832 1 1 17 GLU OE2 O -4.257 5.538 6.833 1.00 . A A . 514 GLU OE2 1 1 15 9833 1 1 18 CYS C C 1.997 2.691 5.536 1.00 . A A . 515 CYS C 1 1 15 9834 1 1 18 CYS CA C 1.516 1.740 4.451 1.00 . A A . 515 CYS CA 1 1 15 9835 1 1 18 CYS CB C 2.442 1.859 3.226 1.00 . A A . 515 CYS CB 1 1 15 9836 1 1 18 CYS H H -0.050 2.480 3.249 1.00 . A A . 515 CYS H 1 1 15 9837 1 1 18 CYS HA H 1.586 0.749 4.881 1.00 . A A . 515 CYS HA 1 1 15 9838 1 1 18 CYS HB2 H 2.521 0.894 2.748 1.00 . A A . 515 CYS HB2 1 1 15 9839 1 1 18 CYS HB3 H 2.015 2.566 2.531 1.00 . A A . 515 CYS HB3 1 1 15 9840 1 1 18 CYS N N 0.134 2.027 4.096 1.00 . A A . 515 CYS N 1 1 15 9841 1 1 18 CYS O O 1.822 3.909 5.448 1.00 . A A . 515 CYS O 1 1 15 9842 1 1 18 CYS SG S 4.138 2.424 3.624 1.00 . A A . 515 CYS SG 1 1 15 9843 1 1 19 THR C C 4.741 3.016 6.939 1.00 . A A . 516 THR C 1 1 15 9844 1 1 19 THR CA C 3.357 2.847 7.535 1.00 . A A . 516 THR CA 1 1 15 9845 1 1 19 THR CB C 3.463 2.123 8.883 1.00 . A A . 516 THR CB 1 1 15 9846 1 1 19 THR CG2 C 2.369 2.580 9.828 1.00 . A A . 516 THR CG2 1 1 15 9847 1 1 19 THR H H 2.380 1.174 6.787 1.00 . A A . 516 THR H 1 1 15 9848 1 1 19 THR HA H 2.912 3.818 7.692 1.00 . A A . 516 THR HA 1 1 15 9849 1 1 19 THR HB H 4.417 2.363 9.319 1.00 . A A . 516 THR HB 1 1 15 9850 1 1 19 THR HG1 H 4.030 0.448 8.003 1.00 . A A . 516 THR HG1 1 1 15 9851 1 1 19 THR HG21 H 1.403 2.353 9.401 1.00 . A A . 516 THR HG21 1 1 15 9852 1 1 19 THR HG22 H 2.475 2.069 10.773 1.00 . A A . 516 THR HG22 1 1 15 9853 1 1 19 THR HG23 H 2.454 3.645 9.981 1.00 . A A . 516 THR HG23 1 1 15 9854 1 1 19 THR N N 2.538 2.113 6.610 1.00 . A A . 516 THR N 1 1 15 9855 1 1 19 THR O O 5.430 2.033 6.657 1.00 . A A . 516 THR O 1 1 15 9856 1 1 19 THR OG1 O 3.397 0.702 8.685 1.00 . A A . 516 THR OG1 1 1 15 9857 1 1 20 GLY C C 6.117 5.614 5.022 1.00 . A A . 517 GLY C 1 1 15 9858 1 1 20 GLY CA C 6.359 4.538 6.050 1.00 . A A . 517 GLY CA 1 1 15 9859 1 1 20 GLY H H 4.629 4.977 7.173 1.00 . A A . 517 GLY H 1 1 15 9860 1 1 20 GLY HA2 H 7.112 4.871 6.749 1.00 . A A . 517 GLY HA2 1 1 15 9861 1 1 20 GLY HA3 H 6.698 3.643 5.555 1.00 . A A . 517 GLY HA3 1 1 15 9862 1 1 20 GLY N N 5.145 4.248 6.769 1.00 . A A . 517 GLY N 1 1 15 9863 1 1 20 GLY O O 6.742 6.675 5.058 1.00 . A A . 517 GLY O 1 1 15 9864 1 1 21 CYS C C 3.226 6.279 3.038 1.00 . A A . 518 CYS C 1 1 15 9865 1 1 21 CYS CA C 4.730 6.377 3.200 1.00 . A A . 518 CYS CA 1 1 15 9866 1 1 21 CYS CB C 5.433 6.248 1.848 1.00 . A A . 518 CYS CB 1 1 15 9867 1 1 21 CYS H H 4.756 4.465 4.096 1.00 . A A . 518 CYS H 1 1 15 9868 1 1 21 CYS HA H 4.963 7.328 3.644 1.00 . A A . 518 CYS HA 1 1 15 9869 1 1 21 CYS HB2 H 5.311 7.169 1.297 1.00 . A A . 518 CYS HB2 1 1 15 9870 1 1 21 CYS HB3 H 6.485 6.072 2.015 1.00 . A A . 518 CYS HB3 1 1 15 9871 1 1 21 CYS N N 5.176 5.358 4.123 1.00 . A A . 518 CYS N 1 1 15 9872 1 1 21 CYS O O 2.660 5.193 3.066 1.00 . A A . 518 CYS O 1 1 15 9873 1 1 21 CYS SG S 4.804 4.895 0.804 1.00 . A A . 518 CYS SG 1 1 15 9874 1 1 22 HIS C C 0.716 7.834 1.379 1.00 . A A . 519 HIS C 1 1 15 9875 1 1 22 HIS CA C 1.134 7.429 2.777 1.00 . A A . 519 HIS CA 1 1 15 9876 1 1 22 HIS CB C 0.540 8.379 3.822 1.00 . A A . 519 HIS CB 1 1 15 9877 1 1 22 HIS CD2 C 2.037 8.295 5.940 1.00 . A A . 519 HIS CD2 1 1 15 9878 1 1 22 HIS CE1 C 0.709 7.133 7.232 1.00 . A A . 519 HIS CE1 1 1 15 9879 1 1 22 HIS CG C 0.916 8.024 5.230 1.00 . A A . 519 HIS CG 1 1 15 9880 1 1 22 HIS H H 3.087 8.251 2.774 1.00 . A A . 519 HIS H 1 1 15 9881 1 1 22 HIS HA H 0.781 6.427 2.970 1.00 . A A . 519 HIS HA 1 1 15 9882 1 1 22 HIS HB2 H 0.892 9.383 3.630 1.00 . A A . 519 HIS HB2 1 1 15 9883 1 1 22 HIS HB3 H -0.538 8.360 3.749 1.00 . A A . 519 HIS HB3 1 1 15 9884 1 1 22 HIS HD1 H -0.800 6.949 5.856 1.00 . A A . 519 HIS HD1 1 1 15 9885 1 1 22 HIS HD2 H 2.893 8.857 5.594 1.00 . A A . 519 HIS HD2 1 1 15 9886 1 1 22 HIS HE1 H 0.310 6.602 8.084 1.00 . A A . 519 HIS HE1 1 1 15 9887 1 1 22 HIS HE2 H 2.466 7.888 7.954 1.00 . A A . 519 HIS HE2 1 1 15 9888 1 1 22 HIS N N 2.580 7.409 2.864 1.00 . A A . 519 HIS N 1 1 15 9889 1 1 22 HIS ND1 N 0.104 7.294 6.071 1.00 . A A . 519 HIS ND1 1 1 15 9890 1 1 22 HIS NE2 N 1.882 7.729 7.180 1.00 . A A . 519 HIS NE2 1 1 15 9891 1 1 22 HIS O O -0.311 8.486 1.183 1.00 . A A . 519 HIS O 1 1 15 9892 1 1 23 LYS C C 0.352 6.717 -1.610 1.00 . A A . 520 LYS C 1 1 15 9893 1 1 23 LYS CA C 1.241 7.784 -0.980 1.00 . A A . 520 LYS CA 1 1 15 9894 1 1 23 LYS CB C 2.536 7.953 -1.788 1.00 . A A . 520 LYS CB 1 1 15 9895 1 1 23 LYS CD C 4.513 6.874 -2.936 1.00 . A A . 520 LYS CD 1 1 15 9896 1 1 23 LYS CE C 4.333 7.802 -4.135 1.00 . A A . 520 LYS CE 1 1 15 9897 1 1 23 LYS CG C 3.209 6.644 -2.180 1.00 . A A . 520 LYS CG 1 1 15 9898 1 1 23 LYS H H 2.346 6.950 0.614 1.00 . A A . 520 LYS H 1 1 15 9899 1 1 23 LYS HA H 0.703 8.722 -0.983 1.00 . A A . 520 LYS HA 1 1 15 9900 1 1 23 LYS HB2 H 2.312 8.499 -2.692 1.00 . A A . 520 LYS HB2 1 1 15 9901 1 1 23 LYS HB3 H 3.238 8.528 -1.200 1.00 . A A . 520 LYS HB3 1 1 15 9902 1 1 23 LYS HD2 H 5.232 7.312 -2.263 1.00 . A A . 520 LYS HD2 1 1 15 9903 1 1 23 LYS HD3 H 4.884 5.918 -3.286 1.00 . A A . 520 LYS HD3 1 1 15 9904 1 1 23 LYS HE2 H 3.942 8.747 -3.787 1.00 . A A . 520 LYS HE2 1 1 15 9905 1 1 23 LYS HE3 H 5.300 7.963 -4.590 1.00 . A A . 520 LYS HE3 1 1 15 9906 1 1 23 LYS HG2 H 3.420 6.078 -1.285 1.00 . A A . 520 LYS HG2 1 1 15 9907 1 1 23 LYS HG3 H 2.534 6.084 -2.808 1.00 . A A . 520 LYS HG3 1 1 15 9908 1 1 23 LYS HZ1 H 2.455 7.106 -4.753 1.00 . A A . 520 LYS HZ1 1 1 15 9909 1 1 23 LYS HZ2 H 3.323 7.914 -5.962 1.00 . A A . 520 LYS HZ2 1 1 15 9910 1 1 23 LYS HZ3 H 3.756 6.337 -5.520 1.00 . A A . 520 LYS HZ3 1 1 15 9911 1 1 23 LYS N N 1.529 7.453 0.401 1.00 . A A . 520 LYS N 1 1 15 9912 1 1 23 LYS NZ N 3.405 7.249 -5.160 1.00 . A A . 520 LYS NZ 1 1 15 9913 1 1 23 LYS O O -0.381 6.995 -2.558 1.00 . A A . 520 LYS O 1 1 15 9914 1 1 24 VAL C C -1.285 3.790 -0.568 1.00 . A A . 521 VAL C 1 1 15 9915 1 1 24 VAL CA C -0.379 4.391 -1.633 1.00 . A A . 521 VAL CA 1 1 15 9916 1 1 24 VAL CB C 0.505 3.269 -2.221 1.00 . A A . 521 VAL CB 1 1 15 9917 1 1 24 VAL CG1 C 1.173 3.720 -3.511 1.00 . A A . 521 VAL CG1 1 1 15 9918 1 1 24 VAL CG2 C 1.548 2.824 -1.212 1.00 . A A . 521 VAL CG2 1 1 15 9919 1 1 24 VAL H H 0.961 5.321 -0.290 1.00 . A A . 521 VAL H 1 1 15 9920 1 1 24 VAL HA H -0.994 4.786 -2.428 1.00 . A A . 521 VAL HA 1 1 15 9921 1 1 24 VAL HB H -0.128 2.424 -2.448 1.00 . A A . 521 VAL HB 1 1 15 9922 1 1 24 VAL HG11 H 1.837 4.543 -3.300 1.00 . A A . 521 VAL HG11 1 1 15 9923 1 1 24 VAL HG12 H 1.736 2.901 -3.933 1.00 . A A . 521 VAL HG12 1 1 15 9924 1 1 24 VAL HG13 H 0.419 4.039 -4.215 1.00 . A A . 521 VAL HG13 1 1 15 9925 1 1 24 VAL HG21 H 1.057 2.409 -0.343 1.00 . A A . 521 VAL HG21 1 1 15 9926 1 1 24 VAL HG22 H 2.183 2.072 -1.659 1.00 . A A . 521 VAL HG22 1 1 15 9927 1 1 24 VAL HG23 H 2.147 3.671 -0.917 1.00 . A A . 521 VAL HG23 1 1 15 9928 1 1 24 VAL N N 0.407 5.492 -1.088 1.00 . A A . 521 VAL N 1 1 15 9929 1 1 24 VAL O O -1.056 3.961 0.630 1.00 . A A . 521 VAL O 1 1 15 9930 1 1 25 ASN C C -3.522 1.038 -0.448 1.00 . A A . 522 ASN C 1 1 15 9931 1 1 25 ASN CA C -3.287 2.503 -0.118 1.00 . A A . 522 ASN CA 1 1 15 9932 1 1 25 ASN CB C -4.612 3.285 -0.134 1.00 . A A . 522 ASN CB 1 1 15 9933 1 1 25 ASN CG C -4.884 4.007 -1.447 1.00 . A A . 522 ASN CG 1 1 15 9934 1 1 25 ASN H H -2.421 2.972 -1.985 1.00 . A A . 522 ASN H 1 1 15 9935 1 1 25 ASN HA H -2.871 2.550 0.879 1.00 . A A . 522 ASN HA 1 1 15 9936 1 1 25 ASN HB2 H -5.421 2.592 0.036 1.00 . A A . 522 ASN HB2 1 1 15 9937 1 1 25 ASN HB3 H -4.603 4.013 0.662 1.00 . A A . 522 ASN HB3 1 1 15 9938 1 1 25 ASN HD21 H -4.364 2.406 -2.496 1.00 . A A . 522 ASN HD21 1 1 15 9939 1 1 25 ASN HD22 H -4.816 3.797 -3.421 1.00 . A A . 522 ASN HD22 1 1 15 9940 1 1 25 ASN N N -2.314 3.098 -1.018 1.00 . A A . 522 ASN N 1 1 15 9941 1 1 25 ASN ND2 N -4.670 3.336 -2.563 1.00 . A A . 522 ASN ND2 1 1 15 9942 1 1 25 ASN O O -3.505 0.630 -1.610 1.00 . A A . 522 ASN O 1 1 15 9943 1 1 25 ASN OD1 O -5.331 5.152 -1.451 1.00 . A A . 522 ASN OD1 1 1 15 9944 1 1 26 TYR C C -5.270 -1.502 1.199 1.00 . A A . 523 TYR C 1 1 15 9945 1 1 26 TYR CA C -3.952 -1.168 0.511 1.00 . A A . 523 TYR CA 1 1 15 9946 1 1 26 TYR CB C -2.800 -1.920 1.199 1.00 . A A . 523 TYR CB 1 1 15 9947 1 1 26 TYR CD1 C -0.775 -0.424 0.912 1.00 . A A . 523 TYR CD1 1 1 15 9948 1 1 26 TYR CD2 C -0.755 -2.555 -0.154 1.00 . A A . 523 TYR CD2 1 1 15 9949 1 1 26 TYR CE1 C 0.486 -0.157 0.413 1.00 . A A . 523 TYR CE1 1 1 15 9950 1 1 26 TYR CE2 C 0.508 -2.294 -0.654 1.00 . A A . 523 TYR CE2 1 1 15 9951 1 1 26 TYR CG C -1.420 -1.625 0.638 1.00 . A A . 523 TYR CG 1 1 15 9952 1 1 26 TYR CZ C 1.123 -1.096 -0.369 1.00 . A A . 523 TYR CZ 1 1 15 9953 1 1 26 TYR H H -3.800 0.693 1.486 1.00 . A A . 523 TYR H 1 1 15 9954 1 1 26 TYR HA H -4.005 -1.446 -0.532 1.00 . A A . 523 TYR HA 1 1 15 9955 1 1 26 TYR HB2 H -2.789 -1.655 2.246 1.00 . A A . 523 TYR HB2 1 1 15 9956 1 1 26 TYR HB3 H -2.975 -2.982 1.107 1.00 . A A . 523 TYR HB3 1 1 15 9957 1 1 26 TYR HD1 H -1.238 -3.496 -0.376 1.00 . A A . 523 TYR HD1 1 1 15 9958 1 1 26 TYR HD2 H -1.275 0.312 1.525 1.00 . A A . 523 TYR HD2 1 1 15 9959 1 1 26 TYR HE1 H 1.011 -3.031 -1.265 1.00 . A A . 523 TYR HE1 1 1 15 9960 1 1 26 TYR HE2 H 0.970 0.781 0.639 1.00 . A A . 523 TYR HE2 1 1 15 9961 1 1 26 TYR HH H 2.479 -1.234 -1.742 1.00 . A A . 523 TYR HH 1 1 15 9962 1 1 26 TYR N N -3.745 0.267 0.602 1.00 . A A . 523 TYR N 1 1 15 9963 1 1 26 TYR O O -5.980 -0.600 1.649 1.00 . A A . 523 TYR O 1 1 15 9964 1 1 26 TYR OH O 2.380 -0.833 -0.863 1.00 . A A . 523 TYR OH 1 1 15 9965 1 1 27 CYS C C -6.586 -4.070 3.136 1.00 . A A . 524 CYS C 1 1 15 9966 1 1 27 CYS CA C -6.849 -3.161 1.943 1.00 . A A . 524 CYS CA 1 1 15 9967 1 1 27 CYS CB C -7.793 -3.831 0.930 1.00 . A A . 524 CYS CB 1 1 15 9968 1 1 27 CYS H H -4.967 -3.470 1.018 1.00 . A A . 524 CYS H 1 1 15 9969 1 1 27 CYS HA H -7.317 -2.256 2.305 1.00 . A A . 524 CYS HA 1 1 15 9970 1 1 27 CYS HB2 H -8.803 -3.782 1.309 1.00 . A A . 524 CYS HB2 1 1 15 9971 1 1 27 CYS HB3 H -7.745 -3.284 0.000 1.00 . A A . 524 CYS HB3 1 1 15 9972 1 1 27 CYS N N -5.595 -2.779 1.315 1.00 . A A . 524 CYS N 1 1 15 9973 1 1 27 CYS O O -7.481 -4.359 3.929 1.00 . A A . 524 CYS O 1 1 15 9974 1 1 27 CYS SG S -7.438 -5.576 0.558 1.00 . A A . 524 CYS SG 1 1 15 9975 1 1 28 SER C C -3.414 -5.305 4.492 1.00 . A A . 525 SER C 1 1 15 9976 1 1 28 SER CA C -4.928 -5.374 4.342 1.00 . A A . 525 SER CA 1 1 15 9977 1 1 28 SER CB C -5.363 -6.814 4.038 1.00 . A A . 525 SER CB 1 1 15 9978 1 1 28 SER H H -4.655 -4.204 2.631 1.00 . A A . 525 SER H 1 1 15 9979 1 1 28 SER HA H -5.395 -5.039 5.258 1.00 . A A . 525 SER HA 1 1 15 9980 1 1 28 SER HB2 H -6.436 -6.850 3.940 1.00 . A A . 525 SER HB2 1 1 15 9981 1 1 28 SER HB3 H -4.908 -7.134 3.112 1.00 . A A . 525 SER HB3 1 1 15 9982 1 1 28 SER HG H -5.755 -8.179 5.398 1.00 . A A . 525 SER HG 1 1 15 9983 1 1 28 SER N N -5.337 -4.493 3.269 1.00 . A A . 525 SER N 1 1 15 9984 1 1 28 SER O O -2.714 -4.845 3.584 1.00 . A A . 525 SER O 1 1 15 9985 1 1 28 SER OG O -4.969 -7.705 5.070 1.00 . A A . 525 SER OG 1 1 15 9986 1 1 29 THR C C -0.831 -6.848 4.953 1.00 . A A . 526 THR C 1 1 15 9987 1 1 29 THR CA C -1.478 -5.808 5.869 1.00 . A A . 526 THR CA 1 1 15 9988 1 1 29 THR CB C -1.182 -6.142 7.345 1.00 . A A . 526 THR CB 1 1 15 9989 1 1 29 THR CG2 C 0.315 -6.128 7.630 1.00 . A A . 526 THR CG2 1 1 15 9990 1 1 29 THR H H -3.523 -6.057 6.337 1.00 . A A . 526 THR H 1 1 15 9991 1 1 29 THR HA H -1.063 -4.835 5.646 1.00 . A A . 526 THR HA 1 1 15 9992 1 1 29 THR HB H -1.569 -7.126 7.560 1.00 . A A . 526 THR HB 1 1 15 9993 1 1 29 THR HG1 H -1.428 -4.311 8.061 1.00 . A A . 526 THR HG1 1 1 15 9994 1 1 29 THR HG21 H 0.709 -5.140 7.444 1.00 . A A . 526 THR HG21 1 1 15 9995 1 1 29 THR HG22 H 0.489 -6.395 8.662 1.00 . A A . 526 THR HG22 1 1 15 9996 1 1 29 THR HG23 H 0.811 -6.843 6.987 1.00 . A A . 526 THR HG23 1 1 15 9997 1 1 29 THR N N -2.912 -5.754 5.633 1.00 . A A . 526 THR N 1 1 15 9998 1 1 29 THR O O 0.353 -6.755 4.620 1.00 . A A . 526 THR O 1 1 15 9999 1 1 29 THR OG1 O -1.839 -5.184 8.189 1.00 . A A . 526 THR OG1 1 1 15 10000 1 1 30 PHE C C -0.715 -8.235 2.292 1.00 . A A . 527 PHE C 1 1 15 10001 1 1 30 PHE CA C -1.156 -8.855 3.616 1.00 . A A . 527 PHE CA 1 1 15 10002 1 1 30 PHE CB C -2.260 -9.893 3.373 1.00 . A A . 527 PHE CB 1 1 15 10003 1 1 30 PHE CD1 C -1.110 -11.947 2.506 1.00 . A A . 527 PHE CD1 1 1 15 10004 1 1 30 PHE CD2 C -2.462 -10.683 1.005 1.00 . A A . 527 PHE CD2 1 1 15 10005 1 1 30 PHE CE1 C -0.807 -12.834 1.491 1.00 . A A . 527 PHE CE1 1 1 15 10006 1 1 30 PHE CE2 C -2.162 -11.562 -0.013 1.00 . A A . 527 PHE CE2 1 1 15 10007 1 1 30 PHE CG C -1.940 -10.864 2.274 1.00 . A A . 527 PHE CG 1 1 15 10008 1 1 30 PHE CZ C -1.333 -12.640 0.228 1.00 . A A . 527 PHE CZ 1 1 15 10009 1 1 30 PHE H H -2.553 -7.867 4.859 1.00 . A A . 527 PHE H 1 1 15 10010 1 1 30 PHE HA H -0.308 -9.345 4.069 1.00 . A A . 527 PHE HA 1 1 15 10011 1 1 30 PHE HB2 H -2.417 -10.460 4.279 1.00 . A A . 527 PHE HB2 1 1 15 10012 1 1 30 PHE HB3 H -3.174 -9.383 3.110 1.00 . A A . 527 PHE HB3 1 1 15 10013 1 1 30 PHE HD1 H -3.111 -9.842 0.814 1.00 . A A . 527 PHE HD1 1 1 15 10014 1 1 30 PHE HD2 H -0.698 -12.099 3.494 1.00 . A A . 527 PHE HD2 1 1 15 10015 1 1 30 PHE HE1 H -2.576 -11.407 -0.998 1.00 . A A . 527 PHE HE1 1 1 15 10016 1 1 30 PHE HE2 H -0.159 -13.675 1.684 1.00 . A A . 527 PHE HE2 1 1 15 10017 1 1 30 PHE HZ H -1.097 -13.330 -0.569 1.00 . A A . 527 PHE HZ 1 1 15 10018 1 1 30 PHE N N -1.626 -7.830 4.533 1.00 . A A . 527 PHE N 1 1 15 10019 1 1 30 PHE O O 0.383 -8.506 1.808 1.00 . A A . 527 PHE O 1 1 15 10020 1 1 31 CYS C C -0.042 -5.824 0.606 1.00 . A A . 528 CYS C 1 1 15 10021 1 1 31 CYS CA C -1.255 -6.733 0.459 1.00 . A A . 528 CYS CA 1 1 15 10022 1 1 31 CYS CB C -2.463 -5.946 -0.028 1.00 . A A . 528 CYS CB 1 1 15 10023 1 1 31 CYS H H -2.413 -7.185 2.166 1.00 . A A . 528 CYS H 1 1 15 10024 1 1 31 CYS HA H -1.020 -7.519 -0.245 1.00 . A A . 528 CYS HA 1 1 15 10025 1 1 31 CYS HB2 H -2.551 -5.033 0.545 1.00 . A A . 528 CYS HB2 1 1 15 10026 1 1 31 CYS HB3 H -2.334 -5.704 -1.072 1.00 . A A . 528 CYS HB3 1 1 15 10027 1 1 31 CYS N N -1.560 -7.380 1.728 1.00 . A A . 528 CYS N 1 1 15 10028 1 1 31 CYS O O 0.773 -5.710 -0.308 1.00 . A A . 528 CYS O 1 1 15 10029 1 1 31 CYS SG S -4.018 -6.866 0.145 1.00 . A A . 528 CYS SG 1 1 15 10030 1 1 32 GLN C C 2.504 -5.154 2.009 1.00 . A A . 529 GLN C 1 1 15 10031 1 1 32 GLN CA C 1.211 -4.340 2.074 1.00 . A A . 529 GLN CA 1 1 15 10032 1 1 32 GLN CB C 1.046 -3.715 3.472 1.00 . A A . 529 GLN CB 1 1 15 10033 1 1 32 GLN CD C 2.824 -1.930 3.337 1.00 . A A . 529 GLN CD 1 1 15 10034 1 1 32 GLN CG C 2.334 -3.164 4.062 1.00 . A A . 529 GLN CG 1 1 15 10035 1 1 32 GLN H H -0.606 -5.345 2.463 1.00 . A A . 529 GLN H 1 1 15 10036 1 1 32 GLN HA H 1.246 -3.552 1.335 1.00 . A A . 529 GLN HA 1 1 15 10037 1 1 32 GLN HB2 H 0.341 -2.894 3.410 1.00 . A A . 529 GLN HB2 1 1 15 10038 1 1 32 GLN HB3 H 0.655 -4.463 4.146 1.00 . A A . 529 GLN HB3 1 1 15 10039 1 1 32 GLN HE21 H 4.710 -2.393 3.734 1.00 . A A . 529 GLN HE21 1 1 15 10040 1 1 32 GLN HE22 H 4.462 -0.931 2.849 1.00 . A A . 529 GLN HE22 1 1 15 10041 1 1 32 GLN HG2 H 2.161 -2.909 5.097 1.00 . A A . 529 GLN HG2 1 1 15 10042 1 1 32 GLN HG3 H 3.096 -3.926 4.002 1.00 . A A . 529 GLN HG3 1 1 15 10043 1 1 32 GLN N N 0.074 -5.198 1.773 1.00 . A A . 529 GLN N 1 1 15 10044 1 1 32 GLN NE2 N 4.131 -1.735 3.300 1.00 . A A . 529 GLN NE2 1 1 15 10045 1 1 32 GLN O O 3.482 -4.753 1.379 1.00 . A A . 529 GLN O 1 1 15 10046 1 1 32 GLN OE1 O 2.031 -1.162 2.808 1.00 . A A . 529 GLN OE1 1 1 15 10047 1 1 33 ARG C C 3.943 -7.844 1.388 1.00 . A A . 530 ARG C 1 1 15 10048 1 1 33 ARG CA C 3.661 -7.165 2.734 1.00 . A A . 530 ARG CA 1 1 15 10049 1 1 33 ARG CB C 3.476 -8.187 3.856 1.00 . A A . 530 ARG CB 1 1 15 10050 1 1 33 ARG CD C 4.353 -10.112 5.190 1.00 . A A . 530 ARG CD 1 1 15 10051 1 1 33 ARG CG C 4.633 -9.151 4.044 1.00 . A A . 530 ARG CG 1 1 15 10052 1 1 33 ARG CZ C 2.050 -10.889 5.684 1.00 . A A . 530 ARG CZ 1 1 15 10053 1 1 33 ARG H H 1.656 -6.590 3.104 1.00 . A A . 530 ARG H 1 1 15 10054 1 1 33 ARG HA H 4.490 -6.512 2.963 1.00 . A A . 530 ARG HA 1 1 15 10055 1 1 33 ARG HB2 H 3.334 -7.655 4.784 1.00 . A A . 530 ARG HB2 1 1 15 10056 1 1 33 ARG HB3 H 2.587 -8.766 3.650 1.00 . A A . 530 ARG HB3 1 1 15 10057 1 1 33 ARG HD2 H 5.207 -10.763 5.316 1.00 . A A . 530 ARG HD2 1 1 15 10058 1 1 33 ARG HD3 H 4.201 -9.540 6.093 1.00 . A A . 530 ARG HD3 1 1 15 10059 1 1 33 ARG HE H 3.198 -11.555 4.179 1.00 . A A . 530 ARG HE 1 1 15 10060 1 1 33 ARG HG2 H 4.774 -9.717 3.134 1.00 . A A . 530 ARG HG2 1 1 15 10061 1 1 33 ARG HG3 H 5.529 -8.590 4.264 1.00 . A A . 530 ARG HG3 1 1 15 10062 1 1 33 ARG HH11 H 2.742 -9.459 6.958 1.00 . A A . 530 ARG HH11 1 1 15 10063 1 1 33 ARG HH12 H 1.132 -10.039 7.289 1.00 . A A . 530 ARG HH12 1 1 15 10064 1 1 33 ARG HH21 H 1.089 -12.316 4.604 1.00 . A A . 530 ARG HH21 1 1 15 10065 1 1 33 ARG HH22 H 0.170 -11.638 5.924 1.00 . A A . 530 ARG HH22 1 1 15 10066 1 1 33 ARG N N 2.487 -6.306 2.662 1.00 . A A . 530 ARG N 1 1 15 10067 1 1 33 ARG NE N 3.164 -10.932 4.942 1.00 . A A . 530 ARG NE 1 1 15 10068 1 1 33 ARG NH1 N 1.966 -10.062 6.723 1.00 . A A . 530 ARG NH1 1 1 15 10069 1 1 33 ARG NH2 N 1.024 -11.680 5.384 1.00 . A A . 530 ARG NH2 1 1 15 10070 1 1 33 ARG O O 5.096 -8.110 1.044 1.00 . A A . 530 ARG O 1 1 15 10071 1 1 34 LYS C C 3.633 -7.732 -1.675 1.00 . A A . 531 LYS C 1 1 15 10072 1 1 34 LYS CA C 3.029 -8.735 -0.687 1.00 . A A . 531 LYS CA 1 1 15 10073 1 1 34 LYS CB C 1.657 -9.236 -1.176 1.00 . A A . 531 LYS CB 1 1 15 10074 1 1 34 LYS CD C 1.867 -9.335 -3.695 1.00 . A A . 531 LYS CD 1 1 15 10075 1 1 34 LYS CE C 1.906 -10.232 -4.923 1.00 . A A . 531 LYS CE 1 1 15 10076 1 1 34 LYS CG C 1.702 -10.133 -2.411 1.00 . A A . 531 LYS CG 1 1 15 10077 1 1 34 LYS H H 1.988 -7.950 0.991 1.00 . A A . 531 LYS H 1 1 15 10078 1 1 34 LYS HA H 3.698 -9.576 -0.595 1.00 . A A . 531 LYS HA 1 1 15 10079 1 1 34 LYS HB2 H 1.192 -9.795 -0.376 1.00 . A A . 531 LYS HB2 1 1 15 10080 1 1 34 LYS HB3 H 1.038 -8.380 -1.403 1.00 . A A . 531 LYS HB3 1 1 15 10081 1 1 34 LYS HD2 H 1.035 -8.654 -3.790 1.00 . A A . 531 LYS HD2 1 1 15 10082 1 1 34 LYS HD3 H 2.788 -8.773 -3.642 1.00 . A A . 531 LYS HD3 1 1 15 10083 1 1 34 LYS HE2 H 2.704 -10.950 -4.808 1.00 . A A . 531 LYS HE2 1 1 15 10084 1 1 34 LYS HE3 H 0.962 -10.750 -5.007 1.00 . A A . 531 LYS HE3 1 1 15 10085 1 1 34 LYS HG2 H 2.534 -10.814 -2.316 1.00 . A A . 531 LYS HG2 1 1 15 10086 1 1 34 LYS HG3 H 0.782 -10.696 -2.464 1.00 . A A . 531 LYS HG3 1 1 15 10087 1 1 34 LYS HZ1 H 3.059 -8.964 -6.114 1.00 . A A . 531 LYS HZ1 1 1 15 10088 1 1 34 LYS HZ2 H 2.125 -10.070 -6.998 1.00 . A A . 531 LYS HZ2 1 1 15 10089 1 1 34 LYS HZ3 H 1.392 -8.723 -6.272 1.00 . A A . 531 LYS HZ3 1 1 15 10090 1 1 34 LYS N N 2.888 -8.127 0.635 1.00 . A A . 531 LYS N 1 1 15 10091 1 1 34 LYS NZ N 2.136 -9.444 -6.162 1.00 . A A . 531 LYS NZ 1 1 15 10092 1 1 34 LYS O O 4.518 -8.071 -2.463 1.00 . A A . 531 LYS O 1 1 15 10093 1 1 35 ASP C C 5.049 -4.960 -2.049 1.00 . A A . 532 ASP C 1 1 15 10094 1 1 35 ASP CA C 3.661 -5.426 -2.480 1.00 . A A . 532 ASP CA 1 1 15 10095 1 1 35 ASP CB C 2.689 -4.247 -2.444 1.00 . A A . 532 ASP CB 1 1 15 10096 1 1 35 ASP CG C 2.984 -3.212 -3.512 1.00 . A A . 532 ASP CG 1 1 15 10097 1 1 35 ASP H H 2.451 -6.280 -0.966 1.00 . A A . 532 ASP H 1 1 15 10098 1 1 35 ASP HA H 3.707 -5.792 -3.494 1.00 . A A . 532 ASP HA 1 1 15 10099 1 1 35 ASP HB2 H 1.684 -4.615 -2.593 1.00 . A A . 532 ASP HB2 1 1 15 10100 1 1 35 ASP HB3 H 2.751 -3.769 -1.477 1.00 . A A . 532 ASP HB3 1 1 15 10101 1 1 35 ASP N N 3.168 -6.492 -1.609 1.00 . A A . 532 ASP N 1 1 15 10102 1 1 35 ASP O O 5.751 -4.278 -2.795 1.00 . A A . 532 ASP O 1 1 15 10103 1 1 35 ASP OD1 O 2.982 -3.577 -4.712 1.00 . A A . 532 ASP OD1 1 1 15 10104 1 1 35 ASP OD2 O 3.207 -2.034 -3.160 1.00 . A A . 532 ASP OD2 1 1 15 10105 1 1 36 TRP C C 7.930 -5.147 -1.064 1.00 . A A . 533 TRP C 1 1 15 10106 1 1 36 TRP CA C 6.676 -4.902 -0.227 1.00 . A A . 533 TRP CA 1 1 15 10107 1 1 36 TRP CB C 6.849 -5.538 1.149 1.00 . A A . 533 TRP CB 1 1 15 10108 1 1 36 TRP CD1 C 9.172 -5.585 2.227 1.00 . A A . 533 TRP CD1 1 1 15 10109 1 1 36 TRP CD2 C 8.121 -3.614 2.375 1.00 . A A . 533 TRP CD2 1 1 15 10110 1 1 36 TRP CE2 C 9.380 -3.498 2.991 1.00 . A A . 533 TRP CE2 1 1 15 10111 1 1 36 TRP CE3 C 7.277 -2.497 2.344 1.00 . A A . 533 TRP CE3 1 1 15 10112 1 1 36 TRP CG C 8.007 -4.958 1.897 1.00 . A A . 533 TRP CG 1 1 15 10113 1 1 36 TRP CH2 C 8.977 -1.233 3.522 1.00 . A A . 533 TRP CH2 1 1 15 10114 1 1 36 TRP CZ2 C 9.820 -2.311 3.567 1.00 . A A . 533 TRP CZ2 1 1 15 10115 1 1 36 TRP CZ3 C 7.716 -1.319 2.919 1.00 . A A . 533 TRP CZ3 1 1 15 10116 1 1 36 TRP H H 4.928 -6.077 -0.399 1.00 . A A . 533 TRP H 1 1 15 10117 1 1 36 TRP HA H 6.562 -3.838 -0.085 1.00 . A A . 533 TRP HA 1 1 15 10118 1 1 36 TRP HB2 H 5.955 -5.375 1.731 1.00 . A A . 533 TRP HB2 1 1 15 10119 1 1 36 TRP HB3 H 7.016 -6.599 1.036 1.00 . A A . 533 TRP HB3 1 1 15 10120 1 1 36 TRP HD1 H 9.395 -6.616 1.998 1.00 . A A . 533 TRP HD1 1 1 15 10121 1 1 36 TRP HE1 H 10.902 -4.930 3.229 1.00 . A A . 533 TRP HE1 1 1 15 10122 1 1 36 TRP HE3 H 6.296 -2.543 1.881 1.00 . A A . 533 TRP HE3 1 1 15 10123 1 1 36 TRP HH2 H 9.276 -0.291 3.960 1.00 . A A . 533 TRP HH2 1 1 15 10124 1 1 36 TRP HZ2 H 10.792 -2.229 4.029 1.00 . A A . 533 TRP HZ2 1 1 15 10125 1 1 36 TRP HZ3 H 7.081 -0.446 2.906 1.00 . A A . 533 TRP HZ3 1 1 15 10126 1 1 36 TRP N N 5.461 -5.399 -0.867 1.00 . A A . 533 TRP N 1 1 15 10127 1 1 36 TRP NE1 N 10.002 -4.715 2.887 1.00 . A A . 533 TRP NE1 1 1 15 10128 1 1 36 TRP O O 8.902 -4.410 -0.965 1.00 . A A . 533 TRP O 1 1 15 10129 1 1 37 LYS C C 9.387 -5.453 -3.721 1.00 . A A . 534 LYS C 1 1 15 10130 1 1 37 LYS CA C 9.082 -6.523 -2.678 1.00 . A A . 534 LYS CA 1 1 15 10131 1 1 37 LYS CB C 8.905 -7.894 -3.325 1.00 . A A . 534 LYS CB 1 1 15 10132 1 1 37 LYS CD C 8.482 -10.354 -3.003 1.00 . A A . 534 LYS CD 1 1 15 10133 1 1 37 LYS CE C 9.691 -10.726 -3.843 1.00 . A A . 534 LYS CE 1 1 15 10134 1 1 37 LYS CG C 8.670 -9.009 -2.318 1.00 . A A . 534 LYS CG 1 1 15 10135 1 1 37 LYS H H 7.076 -6.660 -2.017 1.00 . A A . 534 LYS H 1 1 15 10136 1 1 37 LYS HA H 9.938 -6.536 -2.023 1.00 . A A . 534 LYS HA 1 1 15 10137 1 1 37 LYS HB2 H 8.058 -7.858 -3.993 1.00 . A A . 534 LYS HB2 1 1 15 10138 1 1 37 LYS HB3 H 9.795 -8.130 -3.892 1.00 . A A . 534 LYS HB3 1 1 15 10139 1 1 37 LYS HD2 H 8.333 -11.112 -2.251 1.00 . A A . 534 LYS HD2 1 1 15 10140 1 1 37 LYS HD3 H 7.612 -10.302 -3.643 1.00 . A A . 534 LYS HD3 1 1 15 10141 1 1 37 LYS HE2 H 9.799 -10.001 -4.635 1.00 . A A . 534 LYS HE2 1 1 15 10142 1 1 37 LYS HE3 H 10.569 -10.704 -3.216 1.00 . A A . 534 LYS HE3 1 1 15 10143 1 1 37 LYS HG2 H 9.521 -9.072 -1.657 1.00 . A A . 534 LYS HG2 1 1 15 10144 1 1 37 LYS HG3 H 7.783 -8.782 -1.743 1.00 . A A . 534 LYS HG3 1 1 15 10145 1 1 37 LYS HZ1 H 8.671 -12.149 -4.987 1.00 . A A . 534 LYS HZ1 1 1 15 10146 1 1 37 LYS HZ2 H 10.362 -12.270 -5.072 1.00 . A A . 534 LYS HZ2 1 1 15 10147 1 1 37 LYS HZ3 H 9.544 -12.803 -3.685 1.00 . A A . 534 LYS HZ3 1 1 15 10148 1 1 37 LYS N N 7.905 -6.162 -1.897 1.00 . A A . 534 LYS N 1 1 15 10149 1 1 37 LYS NZ N 9.556 -12.080 -4.438 1.00 . A A . 534 LYS NZ 1 1 15 10150 1 1 37 LYS O O 10.549 -5.220 -4.057 1.00 . A A . 534 LYS O 1 1 15 10151 1 1 38 ASP C C 8.538 -2.363 -4.266 1.00 . A A . 535 ASP C 1 1 15 10152 1 1 38 ASP CA C 8.582 -3.639 -5.086 1.00 . A A . 535 ASP CA 1 1 15 10153 1 1 38 ASP CB C 7.542 -3.567 -6.201 1.00 . A A . 535 ASP CB 1 1 15 10154 1 1 38 ASP CG C 7.533 -4.806 -7.062 1.00 . A A . 535 ASP CG 1 1 15 10155 1 1 38 ASP H H 7.446 -5.080 -4.023 1.00 . A A . 535 ASP H 1 1 15 10156 1 1 38 ASP HA H 9.564 -3.743 -5.522 1.00 . A A . 535 ASP HA 1 1 15 10157 1 1 38 ASP HB2 H 6.562 -3.448 -5.765 1.00 . A A . 535 ASP HB2 1 1 15 10158 1 1 38 ASP HB3 H 7.757 -2.716 -6.830 1.00 . A A . 535 ASP HB3 1 1 15 10159 1 1 38 ASP N N 8.363 -4.793 -4.227 1.00 . A A . 535 ASP N 1 1 15 10160 1 1 38 ASP O O 9.252 -1.408 -4.524 1.00 . A A . 535 ASP O 1 1 15 10161 1 1 38 ASP OD1 O 8.510 -5.026 -7.808 1.00 . A A . 535 ASP OD1 1 1 15 10162 1 1 38 ASP OD2 O 6.545 -5.565 -7.001 1.00 . A A . 535 ASP OD2 1 1 15 10163 1 1 39 HIS C C 8.656 -0.808 -1.636 1.00 . A A . 536 HIS C 1 1 15 10164 1 1 39 HIS CA C 7.439 -1.185 -2.469 1.00 . A A . 536 HIS CA 1 1 15 10165 1 1 39 HIS CB C 6.239 -1.433 -1.559 1.00 . A A . 536 HIS CB 1 1 15 10166 1 1 39 HIS CD2 C 5.592 0.219 0.325 1.00 . A A . 536 HIS CD2 1 1 15 10167 1 1 39 HIS CE1 C 4.655 1.748 -0.884 1.00 . A A . 536 HIS CE1 1 1 15 10168 1 1 39 HIS CG C 5.668 -0.190 -0.969 1.00 . A A . 536 HIS CG 1 1 15 10169 1 1 39 HIS H H 7.185 -3.177 -3.079 1.00 . A A . 536 HIS H 1 1 15 10170 1 1 39 HIS HA H 7.213 -0.359 -3.137 1.00 . A A . 536 HIS HA 1 1 15 10171 1 1 39 HIS HB2 H 5.460 -1.919 -2.128 1.00 . A A . 536 HIS HB2 1 1 15 10172 1 1 39 HIS HB3 H 6.539 -2.080 -0.747 1.00 . A A . 536 HIS HB3 1 1 15 10173 1 1 39 HIS HD1 H 4.931 0.772 -2.700 1.00 . A A . 536 HIS HD1 1 1 15 10174 1 1 39 HIS HD2 H 5.972 -0.311 1.184 1.00 . A A . 536 HIS HD2 1 1 15 10175 1 1 39 HIS HE1 H 4.169 2.661 -1.193 1.00 . A A . 536 HIS HE1 1 1 15 10176 1 1 39 HIS N N 7.685 -2.362 -3.272 1.00 . A A . 536 HIS N 1 1 15 10177 1 1 39 HIS ND1 N 5.067 0.792 -1.720 1.00 . A A . 536 HIS ND1 1 1 15 10178 1 1 39 HIS NE2 N 4.943 1.441 0.360 1.00 . A A . 536 HIS NE2 1 1 15 10179 1 1 39 HIS O O 8.906 0.364 -1.432 1.00 . A A . 536 HIS O 1 1 15 10180 1 1 40 GLN C C 11.581 -0.588 -0.935 1.00 . A A . 537 GLN C 1 1 15 10181 1 1 40 GLN CA C 10.546 -1.502 -0.276 1.00 . A A . 537 GLN CA 1 1 15 10182 1 1 40 GLN CB C 11.213 -2.792 0.204 1.00 . A A . 537 GLN CB 1 1 15 10183 1 1 40 GLN CD C 12.458 -4.894 -0.402 1.00 . A A . 537 GLN CD 1 1 15 10184 1 1 40 GLN CG C 11.876 -3.591 -0.903 1.00 . A A . 537 GLN CG 1 1 15 10185 1 1 40 GLN H H 9.211 -2.727 -1.410 1.00 . A A . 537 GLN H 1 1 15 10186 1 1 40 GLN HA H 10.141 -0.977 0.576 1.00 . A A . 537 GLN HA 1 1 15 10187 1 1 40 GLN HB2 H 11.964 -2.546 0.941 1.00 . A A . 537 GLN HB2 1 1 15 10188 1 1 40 GLN HB3 H 10.463 -3.417 0.668 1.00 . A A . 537 GLN HB3 1 1 15 10189 1 1 40 GLN HE21 H 10.700 -5.775 -0.628 1.00 . A A . 537 GLN HE21 1 1 15 10190 1 1 40 GLN HE22 H 11.975 -6.785 -0.046 1.00 . A A . 537 GLN HE22 1 1 15 10191 1 1 40 GLN HG2 H 11.143 -3.809 -1.672 1.00 . A A . 537 GLN HG2 1 1 15 10192 1 1 40 GLN HG3 H 12.671 -2.996 -1.323 1.00 . A A . 537 GLN HG3 1 1 15 10193 1 1 40 GLN N N 9.419 -1.789 -1.169 1.00 . A A . 537 GLN N 1 1 15 10194 1 1 40 GLN NE2 N 11.629 -5.919 -0.350 1.00 . A A . 537 GLN NE2 1 1 15 10195 1 1 40 GLN O O 12.197 0.240 -0.264 1.00 . A A . 537 GLN O 1 1 15 10196 1 1 40 GLN OE1 O 13.633 -4.969 -0.041 1.00 . A A . 537 GLN OE1 1 1 15 10197 1 1 41 HIS C C 12.135 1.470 -3.283 1.00 . A A . 538 HIS C 1 1 15 10198 1 1 41 HIS CA C 12.739 0.110 -2.937 1.00 . A A . 538 HIS CA 1 1 15 10199 1 1 41 HIS CB C 13.318 -0.586 -4.189 1.00 . A A . 538 HIS CB 1 1 15 10200 1 1 41 HIS CD2 C 11.608 -1.544 -5.880 1.00 . A A . 538 HIS CD2 1 1 15 10201 1 1 41 HIS CE1 C 11.581 0.158 -7.236 1.00 . A A . 538 HIS CE1 1 1 15 10202 1 1 41 HIS CG C 12.441 -0.587 -5.410 1.00 . A A . 538 HIS CG 1 1 15 10203 1 1 41 HIS H H 11.302 -1.439 -2.722 1.00 . A A . 538 HIS H 1 1 15 10204 1 1 41 HIS HA H 13.552 0.300 -2.255 1.00 . A A . 538 HIS HA 1 1 15 10205 1 1 41 HIS HB2 H 14.239 -0.095 -4.458 1.00 . A A . 538 HIS HB2 1 1 15 10206 1 1 41 HIS HB3 H 13.534 -1.615 -3.939 1.00 . A A . 538 HIS HB3 1 1 15 10207 1 1 41 HIS HD2 H 11.363 -2.481 -5.405 1.00 . A A . 538 HIS HD2 1 1 15 10208 1 1 41 HIS HE1 H 11.315 0.809 -8.055 1.00 . A A . 538 HIS HE1 1 1 15 10209 1 1 41 HIS HE2 H 10.311 -1.454 -7.538 1.00 . A A . 538 HIS HE2 1 1 15 10210 1 1 41 HIS N N 11.779 -0.734 -2.239 1.00 . A A . 538 HIS N 1 1 15 10211 1 1 41 HIS ND1 N 12.418 0.483 -6.270 1.00 . A A . 538 HIS ND1 1 1 15 10212 1 1 41 HIS NE2 N 11.069 -1.062 -7.046 1.00 . A A . 538 HIS NE2 1 1 15 10213 1 1 41 HIS O O 12.867 2.438 -3.485 1.00 . A A . 538 HIS O 1 1 15 10214 1 1 42 ILE C C 9.877 3.605 -2.348 1.00 . A A . 539 ILE C 1 1 15 10215 1 1 42 ILE CA C 10.167 2.832 -3.642 1.00 . A A . 539 ILE CA 1 1 15 10216 1 1 42 ILE CB C 8.874 2.634 -4.498 1.00 . A A . 539 ILE CB 1 1 15 10217 1 1 42 ILE CD1 C 6.845 3.576 -3.265 1.00 . A A . 539 ILE CD1 1 1 15 10218 1 1 42 ILE CG1 C 7.626 2.337 -3.658 1.00 . A A . 539 ILE CG1 1 1 15 10219 1 1 42 ILE CG2 C 9.081 1.524 -5.509 1.00 . A A . 539 ILE CG2 1 1 15 10220 1 1 42 ILE H H 10.256 0.755 -3.212 1.00 . A A . 539 ILE H 1 1 15 10221 1 1 42 ILE HA H 10.862 3.413 -4.230 1.00 . A A . 539 ILE HA 1 1 15 10222 1 1 42 ILE HB H 8.707 3.534 -5.049 1.00 . A A . 539 ILE HB 1 1 15 10223 1 1 42 ILE HD11 H 6.474 4.064 -4.152 1.00 . A A . 539 ILE HD11 1 1 15 10224 1 1 42 ILE HD12 H 6.015 3.293 -2.634 1.00 . A A . 539 ILE HD12 1 1 15 10225 1 1 42 ILE HD13 H 7.496 4.251 -2.727 1.00 . A A . 539 ILE HD13 1 1 15 10226 1 1 42 ILE HG12 H 6.968 1.700 -4.220 1.00 . A A . 539 ILE HG12 1 1 15 10227 1 1 42 ILE HG13 H 7.921 1.830 -2.752 1.00 . A A . 539 ILE HG13 1 1 15 10228 1 1 42 ILE HG21 H 9.409 0.629 -4.998 1.00 . A A . 539 ILE HG21 1 1 15 10229 1 1 42 ILE HG22 H 8.151 1.325 -6.020 1.00 . A A . 539 ILE HG22 1 1 15 10230 1 1 42 ILE HG23 H 9.832 1.824 -6.227 1.00 . A A . 539 ILE HG23 1 1 15 10231 1 1 42 ILE N N 10.808 1.558 -3.346 1.00 . A A . 539 ILE N 1 1 15 10232 1 1 42 ILE O O 10.118 4.812 -2.264 1.00 . A A . 539 ILE O 1 1 15 10233 1 1 43 CYS C C 10.118 4.252 0.538 1.00 . A A . 540 CYS C 1 1 15 10234 1 1 43 CYS CA C 8.966 3.465 -0.091 1.00 . A A . 540 CYS CA 1 1 15 10235 1 1 43 CYS CB C 8.560 2.323 0.843 1.00 . A A . 540 CYS CB 1 1 15 10236 1 1 43 CYS H H 9.169 1.931 -1.517 1.00 . A A . 540 CYS H 1 1 15 10237 1 1 43 CYS HA H 8.111 4.112 -0.228 1.00 . A A . 540 CYS HA 1 1 15 10238 1 1 43 CYS HB2 H 7.977 1.605 0.286 1.00 . A A . 540 CYS HB2 1 1 15 10239 1 1 43 CYS HB3 H 9.452 1.840 1.215 1.00 . A A . 540 CYS HB3 1 1 15 10240 1 1 43 CYS N N 9.352 2.891 -1.363 1.00 . A A . 540 CYS N 1 1 15 10241 1 1 43 CYS O O 11.207 3.721 0.770 1.00 . A A . 540 CYS O 1 1 15 10242 1 1 43 CYS SG S 7.572 2.836 2.277 1.00 . A A . 540 CYS SG 1 1 15 10243 1 1 44 GLY C C 11.087 7.640 0.527 1.00 . A A . 541 GLY C 1 1 15 10244 1 1 44 GLY CA C 10.873 6.389 1.355 1.00 . A A . 541 GLY CA 1 1 15 10245 1 1 44 GLY H H 8.943 5.849 0.644 1.00 . A A . 541 GLY H 1 1 15 10246 1 1 44 GLY HA2 H 10.574 6.677 2.351 1.00 . A A . 541 GLY HA2 1 1 15 10247 1 1 44 GLY HA3 H 11.804 5.845 1.411 1.00 . A A . 541 GLY HA3 1 1 15 10248 1 1 44 GLY N N 9.856 5.519 0.794 1.00 . A A . 541 GLY N 1 1 15 10249 1 1 44 GLY O O 12.022 8.403 0.777 1.00 . A A . 541 GLY O 1 1 15 10250 1 1 45 GLN C C 11.566 9.026 -2.126 1.00 . A A . 542 GLN C 1 1 15 10251 1 1 45 GLN CA C 10.266 9.020 -1.322 1.00 . A A . 542 GLN CA 1 1 15 10252 1 1 45 GLN CB C 10.145 10.307 -0.491 1.00 . A A . 542 GLN CB 1 1 15 10253 1 1 45 GLN CD C 7.613 10.382 -0.491 1.00 . A A . 542 GLN CD 1 1 15 10254 1 1 45 GLN CG C 8.876 10.395 0.346 1.00 . A A . 542 GLN CG 1 1 15 10255 1 1 45 GLN H H 9.538 7.158 -0.632 1.00 . A A . 542 GLN H 1 1 15 10256 1 1 45 GLN HA H 9.434 8.964 -2.009 1.00 . A A . 542 GLN HA 1 1 15 10257 1 1 45 GLN HB2 H 10.989 10.364 0.179 1.00 . A A . 542 GLN HB2 1 1 15 10258 1 1 45 GLN HB3 H 10.169 11.155 -1.158 1.00 . A A . 542 GLN HB3 1 1 15 10259 1 1 45 GLN HE21 H 7.470 8.414 -0.305 1.00 . A A . 542 GLN HE21 1 1 15 10260 1 1 45 GLN HE22 H 6.235 9.172 -1.244 1.00 . A A . 542 GLN HE22 1 1 15 10261 1 1 45 GLN HG2 H 8.849 9.553 1.022 1.00 . A A . 542 GLN HG2 1 1 15 10262 1 1 45 GLN HG3 H 8.903 11.311 0.918 1.00 . A A . 542 GLN HG3 1 1 15 10263 1 1 45 GLN N N 10.215 7.840 -0.461 1.00 . A A . 542 GLN N 1 1 15 10264 1 1 45 GLN NE2 N 7.050 9.204 -0.700 1.00 . A A . 542 GLN NE2 1 1 15 10265 1 1 45 GLN O O 12.103 7.963 -2.447 1.00 . A A . 542 GLN O 1 1 15 10266 1 1 45 GLN OE1 O 7.132 11.428 -0.927 1.00 . A A . 542 GLN OE1 1 1 15 10267 1 1 46 SER C C 14.365 11.051 -2.367 1.00 . A A . 543 SER C 1 1 15 10268 1 1 46 SER CA C 13.315 10.310 -3.193 1.00 . A A . 543 SER CA 1 1 15 10269 1 1 46 SER CB C 13.080 11.034 -4.520 1.00 . A A . 543 SER CB 1 1 15 10270 1 1 46 SER H H 11.600 11.024 -2.187 1.00 . A A . 543 SER H 1 1 15 10271 1 1 46 SER HA H 13.669 9.311 -3.395 1.00 . A A . 543 SER HA 1 1 15 10272 1 1 46 SER HB2 H 12.855 12.072 -4.327 1.00 . A A . 543 SER HB2 1 1 15 10273 1 1 46 SER HB3 H 13.970 10.966 -5.130 1.00 . A A . 543 SER HB3 1 1 15 10274 1 1 46 SER HG H 12.048 9.494 -5.167 1.00 . A A . 543 SER HG 1 1 15 10275 1 1 46 SER N N 12.069 10.205 -2.454 1.00 . A A . 543 SER N 1 1 15 10276 1 1 46 SER O O 15.415 10.499 -2.030 1.00 . A A . 543 SER O 1 1 15 10277 1 1 46 SER OG O 11.995 10.455 -5.231 1.00 . A A . 543 SER OG 1 1 15 10278 1 1 47 ALA C C 14.212 14.169 -0.466 1.00 . A A . 544 ALA C 1 1 15 10279 1 1 47 ALA CA C 14.979 13.142 -1.288 1.00 . A A . 544 ALA CA 1 1 15 10280 1 1 47 ALA CB C 15.939 13.830 -2.248 1.00 . A A . 544 ALA CB 1 1 15 10281 1 1 47 ALA H H 13.165 12.646 -2.241 1.00 . A A . 544 ALA H 1 1 15 10282 1 1 47 ALA HA H 15.557 12.517 -0.621 1.00 . A A . 544 ALA HA 1 1 15 10283 1 1 47 ALA HB1 H 15.386 14.494 -2.896 1.00 . A A . 544 ALA HB1 1 1 15 10284 1 1 47 ALA HB2 H 16.665 14.398 -1.686 1.00 . A A . 544 ALA HB2 1 1 15 10285 1 1 47 ALA HB3 H 16.449 13.087 -2.844 1.00 . A A . 544 ALA HB3 1 1 15 10286 1 1 47 ALA N N 14.056 12.293 -2.019 1.00 . A A . 544 ALA N 1 1 15 10287 1 1 47 ALA O O 13.708 15.148 -1.056 1.00 . A A . 544 ALA O 1 1 15 10288 1 1 47 ALA OXT O 14.103 13.987 0.764 1.00 . A A . 544 ALA OXT 1 1 15 10289 2 2 1 ZN ZN ZN -5.703 -5.762 -0.906 1.00 . B A . 601 ZN ZN 1 1 15 10290 3 2 1 ZN ZN ZN 5.339 2.840 1.710 1.00 . C A . 602 ZN ZN 1 1 16 10291 1 1 1 GLY C C -15.394 3.957 2.450 1.00 . A A . 498 GLY C 1 1 16 10292 1 1 1 GLY CA C -15.934 5.292 2.918 1.00 . A A . 498 GLY CA 1 1 16 10293 1 1 1 GLY H1 H -17.702 6.401 2.924 1.00 . A A . 498 GLY H1 1 1 16 10294 1 1 1 GLY H2 H -17.937 4.727 3.072 1.00 . A A . 498 GLY H2 1 1 16 10295 1 1 1 GLY H3 H -17.521 5.395 1.571 1.00 . A A . 498 GLY H3 1 1 16 10296 1 1 1 GLY HA2 H -15.373 6.080 2.440 1.00 . A A . 498 GLY HA2 1 1 16 10297 1 1 1 GLY HA3 H -15.802 5.368 3.987 1.00 . A A . 498 GLY HA3 1 1 16 10298 1 1 1 GLY N N -17.371 5.466 2.599 1.00 . A A . 498 GLY N 1 1 16 10299 1 1 1 GLY O O -14.536 3.368 3.102 1.00 . A A . 498 GLY O 1 1 16 10300 1 1 2 ALA C C -15.084 2.325 -0.692 1.00 . A A . 499 ALA C 1 1 16 10301 1 1 2 ALA CA C -15.464 2.197 0.777 1.00 . A A . 499 ALA CA 1 1 16 10302 1 1 2 ALA CB C -16.559 1.158 0.955 1.00 . A A . 499 ALA CB 1 1 16 10303 1 1 2 ALA H H -16.572 3.997 0.826 1.00 . A A . 499 ALA H 1 1 16 10304 1 1 2 ALA HA H -14.597 1.873 1.338 1.00 . A A . 499 ALA HA 1 1 16 10305 1 1 2 ALA HB1 H -17.421 1.441 0.370 1.00 . A A . 499 ALA HB1 1 1 16 10306 1 1 2 ALA HB2 H -16.200 0.195 0.621 1.00 . A A . 499 ALA HB2 1 1 16 10307 1 1 2 ALA HB3 H -16.834 1.097 1.997 1.00 . A A . 499 ALA HB3 1 1 16 10308 1 1 2 ALA N N -15.892 3.478 1.315 1.00 . A A . 499 ALA N 1 1 16 10309 1 1 2 ALA O O -15.075 1.341 -1.430 1.00 . A A . 499 ALA O 1 1 16 10310 1 1 3 MET C C -13.406 4.990 -2.504 1.00 . A A . 500 MET C 1 1 16 10311 1 1 3 MET CA C -14.344 3.791 -2.483 1.00 . A A . 500 MET CA 1 1 16 10312 1 1 3 MET CB C -15.530 4.036 -3.425 1.00 . A A . 500 MET CB 1 1 16 10313 1 1 3 MET CE C -18.224 7.204 -3.730 1.00 . A A . 500 MET CE 1 1 16 10314 1 1 3 MET CG C -16.267 5.338 -3.159 1.00 . A A . 500 MET CG 1 1 16 10315 1 1 3 MET H H -14.930 4.308 -0.514 1.00 . A A . 500 MET H 1 1 16 10316 1 1 3 MET HA H -13.804 2.914 -2.810 1.00 . A A . 500 MET HA 1 1 16 10317 1 1 3 MET HB2 H -15.168 4.054 -4.443 1.00 . A A . 500 MET HB2 1 1 16 10318 1 1 3 MET HB3 H -16.232 3.222 -3.319 1.00 . A A . 500 MET HB3 1 1 16 10319 1 1 3 MET HE1 H -17.429 7.920 -3.877 1.00 . A A . 500 MET HE1 1 1 16 10320 1 1 3 MET HE2 H -19.085 7.499 -4.312 1.00 . A A . 500 MET HE2 1 1 16 10321 1 1 3 MET HE3 H -18.490 7.172 -2.684 1.00 . A A . 500 MET HE3 1 1 16 10322 1 1 3 MET HG2 H -16.624 5.332 -2.139 1.00 . A A . 500 MET HG2 1 1 16 10323 1 1 3 MET HG3 H -15.576 6.159 -3.291 1.00 . A A . 500 MET HG3 1 1 16 10324 1 1 3 MET N N -14.806 3.549 -1.121 1.00 . A A . 500 MET N 1 1 16 10325 1 1 3 MET O O -13.046 5.499 -3.568 1.00 . A A . 500 MET O 1 1 16 10326 1 1 3 MET SD S -17.673 5.585 -4.258 1.00 . A A . 500 MET SD 1 1 16 10327 1 1 4 GLU C C -10.747 6.325 -1.566 1.00 . A A . 501 GLU C 1 1 16 10328 1 1 4 GLU CA C -12.183 6.629 -1.173 1.00 . A A . 501 GLU CA 1 1 16 10329 1 1 4 GLU CB C -12.221 7.142 0.270 1.00 . A A . 501 GLU CB 1 1 16 10330 1 1 4 GLU CD C -14.734 7.497 0.175 1.00 . A A . 501 GLU CD 1 1 16 10331 1 1 4 GLU CG C -13.561 6.959 0.969 1.00 . A A . 501 GLU CG 1 1 16 10332 1 1 4 GLU H H -13.267 4.937 -0.512 1.00 . A A . 501 GLU H 1 1 16 10333 1 1 4 GLU HA H -12.578 7.388 -1.832 1.00 . A A . 501 GLU HA 1 1 16 10334 1 1 4 GLU HB2 H -11.469 6.617 0.842 1.00 . A A . 501 GLU HB2 1 1 16 10335 1 1 4 GLU HB3 H -11.983 8.196 0.267 1.00 . A A . 501 GLU HB3 1 1 16 10336 1 1 4 GLU HG2 H -13.722 5.905 1.141 1.00 . A A . 501 GLU HG2 1 1 16 10337 1 1 4 GLU HG3 H -13.527 7.472 1.920 1.00 . A A . 501 GLU HG3 1 1 16 10338 1 1 4 GLU N N -13.006 5.431 -1.314 1.00 . A A . 501 GLU N 1 1 16 10339 1 1 4 GLU O O -10.027 7.178 -2.090 1.00 . A A . 501 GLU O 1 1 16 10340 1 1 4 GLU OE1 O -14.752 8.700 -0.132 1.00 . A A . 501 GLU OE1 1 1 16 10341 1 1 4 GLU OE2 O -15.655 6.708 -0.131 1.00 . A A . 501 GLU OE2 1 1 16 10342 1 1 5 GLN C C -9.147 3.221 -2.262 1.00 . A A . 502 GLN C 1 1 16 10343 1 1 5 GLN CA C -9.026 4.619 -1.670 1.00 . A A . 502 GLN CA 1 1 16 10344 1 1 5 GLN CB C -8.089 4.625 -0.460 1.00 . A A . 502 GLN CB 1 1 16 10345 1 1 5 GLN CD C -7.762 4.054 1.973 1.00 . A A . 502 GLN CD 1 1 16 10346 1 1 5 GLN CG C -8.657 3.921 0.761 1.00 . A A . 502 GLN CG 1 1 16 10347 1 1 5 GLN H H -10.959 4.480 -0.859 1.00 . A A . 502 GLN H 1 1 16 10348 1 1 5 GLN HA H -8.640 5.287 -2.424 1.00 . A A . 502 GLN HA 1 1 16 10349 1 1 5 GLN HB2 H -7.167 4.136 -0.735 1.00 . A A . 502 GLN HB2 1 1 16 10350 1 1 5 GLN HB3 H -7.878 5.650 -0.192 1.00 . A A . 502 GLN HB3 1 1 16 10351 1 1 5 GLN HE21 H -8.635 5.774 2.431 1.00 . A A . 502 GLN HE21 1 1 16 10352 1 1 5 GLN HE22 H -7.379 5.254 3.504 1.00 . A A . 502 GLN HE22 1 1 16 10353 1 1 5 GLN HG2 H -9.619 4.351 0.994 1.00 . A A . 502 GLN HG2 1 1 16 10354 1 1 5 GLN HG3 H -8.776 2.871 0.533 1.00 . A A . 502 GLN HG3 1 1 16 10355 1 1 5 GLN N N -10.343 5.096 -1.303 1.00 . A A . 502 GLN N 1 1 16 10356 1 1 5 GLN NE2 N -7.944 5.133 2.711 1.00 . A A . 502 GLN NE2 1 1 16 10357 1 1 5 GLN O O -10.137 2.527 -2.030 1.00 . A A . 502 GLN O 1 1 16 10358 1 1 5 GLN OE1 O -6.900 3.212 2.232 1.00 . A A . 502 GLN OE1 1 1 16 10359 1 1 6 SER C C -6.927 0.732 -3.411 1.00 . A A . 503 SER C 1 1 16 10360 1 1 6 SER CA C -8.190 1.531 -3.704 1.00 . A A . 503 SER CA 1 1 16 10361 1 1 6 SER CB C -8.344 1.756 -5.210 1.00 . A A . 503 SER CB 1 1 16 10362 1 1 6 SER H H -7.371 3.393 -3.147 1.00 . A A . 503 SER H 1 1 16 10363 1 1 6 SER HA H -9.047 0.983 -3.340 1.00 . A A . 503 SER HA 1 1 16 10364 1 1 6 SER HB2 H -8.112 0.841 -5.733 1.00 . A A . 503 SER HB2 1 1 16 10365 1 1 6 SER HB3 H -9.361 2.049 -5.428 1.00 . A A . 503 SER HB3 1 1 16 10366 1 1 6 SER HG H -7.844 3.205 -6.443 1.00 . A A . 503 SER HG 1 1 16 10367 1 1 6 SER N N -8.154 2.816 -3.028 1.00 . A A . 503 SER N 1 1 16 10368 1 1 6 SER O O -5.820 1.224 -3.603 1.00 . A A . 503 SER O 1 1 16 10369 1 1 6 SER OG O -7.466 2.778 -5.661 1.00 . A A . 503 SER OG 1 1 16 10370 1 1 7 CYS C C -5.193 -1.564 -3.965 1.00 . A A . 504 CYS C 1 1 16 10371 1 1 7 CYS CA C -5.948 -1.350 -2.671 1.00 . A A . 504 CYS CA 1 1 16 10372 1 1 7 CYS CB C -6.370 -2.702 -2.080 1.00 . A A . 504 CYS CB 1 1 16 10373 1 1 7 CYS H H -8.001 -0.832 -2.760 1.00 . A A . 504 CYS H 1 1 16 10374 1 1 7 CYS HA H -5.303 -0.846 -1.966 1.00 . A A . 504 CYS HA 1 1 16 10375 1 1 7 CYS HB2 H -7.007 -2.534 -1.222 1.00 . A A . 504 CYS HB2 1 1 16 10376 1 1 7 CYS HB3 H -6.913 -3.260 -2.823 1.00 . A A . 504 CYS HB3 1 1 16 10377 1 1 7 CYS N N -7.089 -0.497 -2.933 1.00 . A A . 504 CYS N 1 1 16 10378 1 1 7 CYS O O -5.756 -2.027 -4.962 1.00 . A A . 504 CYS O 1 1 16 10379 1 1 7 CYS SG S -4.963 -3.732 -1.537 1.00 . A A . 504 CYS SG 1 1 16 10380 1 1 8 VAL C C -2.940 -2.758 -5.565 1.00 . A A . 505 VAL C 1 1 16 10381 1 1 8 VAL CA C -3.075 -1.302 -5.114 1.00 . A A . 505 VAL CA 1 1 16 10382 1 1 8 VAL CB C -1.688 -0.676 -4.830 1.00 . A A . 505 VAL CB 1 1 16 10383 1 1 8 VAL CG1 C -0.900 -1.505 -3.831 1.00 . A A . 505 VAL CG1 1 1 16 10384 1 1 8 VAL CG2 C -0.903 -0.469 -6.115 1.00 . A A . 505 VAL CG2 1 1 16 10385 1 1 8 VAL H H -3.551 -0.833 -3.111 1.00 . A A . 505 VAL H 1 1 16 10386 1 1 8 VAL HA H -3.544 -0.736 -5.905 1.00 . A A . 505 VAL HA 1 1 16 10387 1 1 8 VAL HB H -1.853 0.296 -4.387 1.00 . A A . 505 VAL HB 1 1 16 10388 1 1 8 VAL HG11 H -0.742 -2.496 -4.230 1.00 . A A . 505 VAL HG11 1 1 16 10389 1 1 8 VAL HG12 H 0.055 -1.034 -3.646 1.00 . A A . 505 VAL HG12 1 1 16 10390 1 1 8 VAL HG13 H -1.454 -1.570 -2.905 1.00 . A A . 505 VAL HG13 1 1 16 10391 1 1 8 VAL HG21 H -1.463 0.173 -6.777 1.00 . A A . 505 VAL HG21 1 1 16 10392 1 1 8 VAL HG22 H 0.045 -0.008 -5.883 1.00 . A A . 505 VAL HG22 1 1 16 10393 1 1 8 VAL HG23 H -0.734 -1.422 -6.592 1.00 . A A . 505 VAL HG23 1 1 16 10394 1 1 8 VAL N N -3.923 -1.204 -3.941 1.00 . A A . 505 VAL N 1 1 16 10395 1 1 8 VAL O O -2.533 -3.040 -6.692 1.00 . A A . 505 VAL O 1 1 16 10396 1 1 9 ASN C C -4.662 -5.629 -5.341 1.00 . A A . 506 ASN C 1 1 16 10397 1 1 9 ASN CA C -3.266 -5.099 -4.999 1.00 . A A . 506 ASN CA 1 1 16 10398 1 1 9 ASN CB C -2.673 -5.881 -3.819 1.00 . A A . 506 ASN CB 1 1 16 10399 1 1 9 ASN CG C -2.581 -7.376 -4.077 1.00 . A A . 506 ASN CG 1 1 16 10400 1 1 9 ASN H H -3.574 -3.410 -3.776 1.00 . A A . 506 ASN H 1 1 16 10401 1 1 9 ASN HA H -2.626 -5.227 -5.859 1.00 . A A . 506 ASN HA 1 1 16 10402 1 1 9 ASN HB2 H -1.679 -5.511 -3.616 1.00 . A A . 506 ASN HB2 1 1 16 10403 1 1 9 ASN HB3 H -3.292 -5.723 -2.947 1.00 . A A . 506 ASN HB3 1 1 16 10404 1 1 9 ASN HD21 H -4.299 -7.681 -3.126 1.00 . A A . 506 ASN HD21 1 1 16 10405 1 1 9 ASN HD22 H -3.528 -9.094 -3.766 1.00 . A A . 506 ASN HD22 1 1 16 10406 1 1 9 ASN N N -3.302 -3.682 -4.682 1.00 . A A . 506 ASN N 1 1 16 10407 1 1 9 ASN ND2 N -3.568 -8.123 -3.612 1.00 . A A . 506 ASN ND2 1 1 16 10408 1 1 9 ASN O O -4.795 -6.591 -6.099 1.00 . A A . 506 ASN O 1 1 16 10409 1 1 9 ASN OD1 O -1.615 -7.857 -4.667 1.00 . A A . 506 ASN OD1 1 1 16 10410 1 1 10 CYS C C -8.009 -4.503 -5.614 1.00 . A A . 507 CYS C 1 1 16 10411 1 1 10 CYS CA C -7.058 -5.513 -4.958 1.00 . A A . 507 CYS CA 1 1 16 10412 1 1 10 CYS CB C -7.600 -5.945 -3.597 1.00 . A A . 507 CYS CB 1 1 16 10413 1 1 10 CYS H H -5.558 -4.155 -4.318 1.00 . A A . 507 CYS H 1 1 16 10414 1 1 10 CYS HA H -6.998 -6.382 -5.593 1.00 . A A . 507 CYS HA 1 1 16 10415 1 1 10 CYS HB2 H -7.813 -5.067 -3.007 1.00 . A A . 507 CYS HB2 1 1 16 10416 1 1 10 CYS HB3 H -8.510 -6.510 -3.741 1.00 . A A . 507 CYS HB3 1 1 16 10417 1 1 10 CYS N N -5.703 -4.991 -4.807 1.00 . A A . 507 CYS N 1 1 16 10418 1 1 10 CYS O O -8.268 -4.586 -6.813 1.00 . A A . 507 CYS O 1 1 16 10419 1 1 10 CYS SG S -6.444 -6.985 -2.649 1.00 . A A . 507 CYS SG 1 1 16 10420 1 1 11 GLY C C -10.074 -1.709 -4.282 1.00 . A A . 508 GLY C 1 1 16 10421 1 1 11 GLY CA C -9.483 -2.599 -5.362 1.00 . A A . 508 GLY CA 1 1 16 10422 1 1 11 GLY H H -8.254 -3.506 -3.894 1.00 . A A . 508 GLY H 1 1 16 10423 1 1 11 GLY HA2 H -8.989 -1.980 -6.097 1.00 . A A . 508 GLY HA2 1 1 16 10424 1 1 11 GLY HA3 H -10.285 -3.141 -5.847 1.00 . A A . 508 GLY HA3 1 1 16 10425 1 1 11 GLY N N -8.525 -3.558 -4.832 1.00 . A A . 508 GLY N 1 1 16 10426 1 1 11 GLY O O -9.450 -1.511 -3.242 1.00 . A A . 508 GLY O 1 1 16 10427 1 1 12 ARG C C -12.047 -0.779 -2.145 1.00 . A A . 509 ARG C 1 1 16 10428 1 1 12 ARG CA C -11.983 -0.273 -3.593 1.00 . A A . 509 ARG CA 1 1 16 10429 1 1 12 ARG CB C -13.424 -0.071 -4.067 1.00 . A A . 509 ARG CB 1 1 16 10430 1 1 12 ARG CD C -15.757 -1.063 -4.075 1.00 . A A . 509 ARG CD 1 1 16 10431 1 1 12 ARG CG C -14.281 -1.308 -3.831 1.00 . A A . 509 ARG CG 1 1 16 10432 1 1 12 ARG CZ C -17.891 -2.249 -3.663 1.00 . A A . 509 ARG CZ 1 1 16 10433 1 1 12 ARG H H -11.706 -1.354 -5.394 1.00 . A A . 509 ARG H 1 1 16 10434 1 1 12 ARG HA H -11.471 0.674 -3.614 1.00 . A A . 509 ARG HA 1 1 16 10435 1 1 12 ARG HB2 H -13.859 0.761 -3.531 1.00 . A A . 509 ARG HB2 1 1 16 10436 1 1 12 ARG HB3 H -13.423 0.147 -5.124 1.00 . A A . 509 ARG HB3 1 1 16 10437 1 1 12 ARG HD2 H -16.057 -0.167 -3.550 1.00 . A A . 509 ARG HD2 1 1 16 10438 1 1 12 ARG HD3 H -15.921 -0.936 -5.134 1.00 . A A . 509 ARG HD3 1 1 16 10439 1 1 12 ARG HE H -16.076 -2.943 -3.192 1.00 . A A . 509 ARG HE 1 1 16 10440 1 1 12 ARG HG2 H -13.950 -2.090 -4.497 1.00 . A A . 509 ARG HG2 1 1 16 10441 1 1 12 ARG HG3 H -14.145 -1.631 -2.809 1.00 . A A . 509 ARG HG3 1 1 16 10442 1 1 12 ARG HH11 H -18.108 -0.454 -4.594 1.00 . A A . 509 ARG HH11 1 1 16 10443 1 1 12 ARG HH12 H -19.588 -1.309 -4.258 1.00 . A A . 509 ARG HH12 1 1 16 10444 1 1 12 ARG HH21 H -18.012 -4.061 -2.747 1.00 . A A . 509 ARG HH21 1 1 16 10445 1 1 12 ARG HH22 H -19.531 -3.353 -3.209 1.00 . A A . 509 ARG HH22 1 1 16 10446 1 1 12 ARG N N -11.289 -1.198 -4.518 1.00 . A A . 509 ARG N 1 1 16 10447 1 1 12 ARG NE N -16.561 -2.190 -3.598 1.00 . A A . 509 ARG NE 1 1 16 10448 1 1 12 ARG NH1 N -18.584 -1.260 -4.216 1.00 . A A . 509 ARG NH1 1 1 16 10449 1 1 12 ARG NH2 N -18.528 -3.305 -3.169 1.00 . A A . 509 ARG NH2 1 1 16 10450 1 1 12 ARG O O -12.372 -0.024 -1.232 1.00 . A A . 509 ARG O 1 1 16 10451 1 1 13 GLU C C -10.768 -2.139 0.320 1.00 . A A . 510 GLU C 1 1 16 10452 1 1 13 GLU CA C -11.836 -2.668 -0.638 1.00 . A A . 510 GLU CA 1 1 16 10453 1 1 13 GLU CB C -11.740 -4.180 -0.791 1.00 . A A . 510 GLU CB 1 1 16 10454 1 1 13 GLU CD C -14.206 -4.396 -0.361 1.00 . A A . 510 GLU CD 1 1 16 10455 1 1 13 GLU CG C -12.821 -4.914 -0.025 1.00 . A A . 510 GLU CG 1 1 16 10456 1 1 13 GLU H H -11.444 -2.586 -2.701 1.00 . A A . 510 GLU H 1 1 16 10457 1 1 13 GLU HA H -12.802 -2.423 -0.236 1.00 . A A . 510 GLU HA 1 1 16 10458 1 1 13 GLU HB2 H -11.836 -4.432 -1.837 1.00 . A A . 510 GLU HB2 1 1 16 10459 1 1 13 GLU HB3 H -10.780 -4.510 -0.435 1.00 . A A . 510 GLU HB3 1 1 16 10460 1 1 13 GLU HG2 H -12.772 -5.963 -0.273 1.00 . A A . 510 GLU HG2 1 1 16 10461 1 1 13 GLU HG3 H -12.648 -4.782 1.032 1.00 . A A . 510 GLU HG3 1 1 16 10462 1 1 13 GLU N N -11.742 -2.048 -1.944 1.00 . A A . 510 GLU N 1 1 16 10463 1 1 13 GLU O O -10.698 -2.556 1.478 1.00 . A A . 510 GLU O 1 1 16 10464 1 1 13 GLU OE1 O -14.714 -4.703 -1.462 1.00 . A A . 510 GLU OE1 1 1 16 10465 1 1 13 GLU OE2 O -14.791 -3.671 0.473 1.00 . A A . 510 GLU OE2 1 1 16 10466 1 1 14 ALA C C -9.366 -0.062 1.916 1.00 . A A . 511 ALA C 1 1 16 10467 1 1 14 ALA CA C -8.865 -0.616 0.590 1.00 . A A . 511 ALA CA 1 1 16 10468 1 1 14 ALA CB C -8.217 0.493 -0.208 1.00 . A A . 511 ALA CB 1 1 16 10469 1 1 14 ALA H H -10.023 -1.005 -1.131 1.00 . A A . 511 ALA H 1 1 16 10470 1 1 14 ALA HA H -8.111 -1.364 0.789 1.00 . A A . 511 ALA HA 1 1 16 10471 1 1 14 ALA HB1 H -8.938 1.276 -0.391 1.00 . A A . 511 ALA HB1 1 1 16 10472 1 1 14 ALA HB2 H -7.383 0.895 0.347 1.00 . A A . 511 ALA HB2 1 1 16 10473 1 1 14 ALA HB3 H -7.866 0.100 -1.151 1.00 . A A . 511 ALA HB3 1 1 16 10474 1 1 14 ALA N N -9.925 -1.248 -0.190 1.00 . A A . 511 ALA N 1 1 16 10475 1 1 14 ALA O O -10.440 0.536 2.000 1.00 . A A . 511 ALA O 1 1 16 10476 1 1 15 MET C C -7.632 0.531 5.084 1.00 . A A . 512 MET C 1 1 16 10477 1 1 15 MET CA C -8.888 0.158 4.299 1.00 . A A . 512 MET CA 1 1 16 10478 1 1 15 MET CB C -9.624 -0.960 5.050 1.00 . A A . 512 MET CB 1 1 16 10479 1 1 15 MET CE C -13.440 -2.602 4.718 1.00 . A A . 512 MET CE 1 1 16 10480 1 1 15 MET CG C -11.034 -1.236 4.560 1.00 . A A . 512 MET CG 1 1 16 10481 1 1 15 MET H H -7.684 -0.656 2.770 1.00 . A A . 512 MET H 1 1 16 10482 1 1 15 MET HA H -9.532 1.024 4.233 1.00 . A A . 512 MET HA 1 1 16 10483 1 1 15 MET HB2 H -9.052 -1.871 4.955 1.00 . A A . 512 MET HB2 1 1 16 10484 1 1 15 MET HB3 H -9.678 -0.692 6.095 1.00 . A A . 512 MET HB3 1 1 16 10485 1 1 15 MET HE1 H -13.350 -2.782 3.656 1.00 . A A . 512 MET HE1 1 1 16 10486 1 1 15 MET HE2 H -14.035 -3.384 5.167 1.00 . A A . 512 MET HE2 1 1 16 10487 1 1 15 MET HE3 H -13.917 -1.648 4.883 1.00 . A A . 512 MET HE3 1 1 16 10488 1 1 15 MET HG2 H -11.630 -0.345 4.691 1.00 . A A . 512 MET HG2 1 1 16 10489 1 1 15 MET HG3 H -10.996 -1.494 3.512 1.00 . A A . 512 MET HG3 1 1 16 10490 1 1 15 MET N N -8.552 -0.251 2.942 1.00 . A A . 512 MET N 1 1 16 10491 1 1 15 MET O O -7.683 1.357 5.997 1.00 . A A . 512 MET O 1 1 16 10492 1 1 15 MET SD S -11.811 -2.593 5.460 1.00 . A A . 512 MET SD 1 1 16 10493 1 1 16 SER C C -4.178 0.681 4.609 1.00 . A A . 513 SER C 1 1 16 10494 1 1 16 SER CA C -5.282 0.108 5.489 1.00 . A A . 513 SER CA 1 1 16 10495 1 1 16 SER CB C -4.862 -1.225 6.121 1.00 . A A . 513 SER CB 1 1 16 10496 1 1 16 SER H H -6.466 -0.572 3.889 1.00 . A A . 513 SER H 1 1 16 10497 1 1 16 SER HA H -5.504 0.828 6.260 1.00 . A A . 513 SER HA 1 1 16 10498 1 1 16 SER HB2 H -5.696 -1.635 6.671 1.00 . A A . 513 SER HB2 1 1 16 10499 1 1 16 SER HB3 H -4.577 -1.914 5.340 1.00 . A A . 513 SER HB3 1 1 16 10500 1 1 16 SER HG H -3.997 -1.460 7.870 1.00 . A A . 513 SER HG 1 1 16 10501 1 1 16 SER N N -6.499 -0.063 4.719 1.00 . A A . 513 SER N 1 1 16 10502 1 1 16 SER O O -4.194 0.528 3.389 1.00 . A A . 513 SER O 1 1 16 10503 1 1 16 SER OG O -3.766 -1.068 7.009 1.00 . A A . 513 SER OG 1 1 16 10504 1 1 17 GLU C C -0.814 1.618 4.941 1.00 . A A . 514 GLU C 1 1 16 10505 1 1 17 GLU CA C -2.203 2.083 4.527 1.00 . A A . 514 GLU CA 1 1 16 10506 1 1 17 GLU CB C -2.376 3.577 4.814 1.00 . A A . 514 GLU CB 1 1 16 10507 1 1 17 GLU CD C -3.205 5.209 6.530 1.00 . A A . 514 GLU CD 1 1 16 10508 1 1 17 GLU CG C -2.446 3.922 6.289 1.00 . A A . 514 GLU CG 1 1 16 10509 1 1 17 GLU H H -3.208 1.326 6.216 1.00 . A A . 514 GLU H 1 1 16 10510 1 1 17 GLU HA H -2.343 1.938 3.465 1.00 . A A . 514 GLU HA 1 1 16 10511 1 1 17 GLU HB2 H -1.543 4.111 4.383 1.00 . A A . 514 GLU HB2 1 1 16 10512 1 1 17 GLU HB3 H -3.289 3.914 4.345 1.00 . A A . 514 GLU HB3 1 1 16 10513 1 1 17 GLU HG2 H -2.945 3.121 6.815 1.00 . A A . 514 GLU HG2 1 1 16 10514 1 1 17 GLU HG3 H -1.441 4.035 6.670 1.00 . A A . 514 GLU HG3 1 1 16 10515 1 1 17 GLU N N -3.231 1.346 5.236 1.00 . A A . 514 GLU N 1 1 16 10516 1 1 17 GLU O O -0.657 0.944 5.961 1.00 . A A . 514 GLU O 1 1 16 10517 1 1 17 GLU OE1 O -2.606 6.296 6.401 1.00 . A A . 514 GLU OE1 1 1 16 10518 1 1 17 GLU OE2 O -4.413 5.137 6.840 1.00 . A A . 514 GLU OE2 1 1 16 10519 1 1 18 CYS C C 2.039 2.661 5.564 1.00 . A A . 515 CYS C 1 1 16 10520 1 1 18 CYS CA C 1.563 1.704 4.484 1.00 . A A . 515 CYS CA 1 1 16 10521 1 1 18 CYS CB C 2.476 1.827 3.254 1.00 . A A . 515 CYS CB 1 1 16 10522 1 1 18 CYS H H -0.020 2.437 3.305 1.00 . A A . 515 CYS H 1 1 16 10523 1 1 18 CYS HA H 1.645 0.715 4.911 1.00 . A A . 515 CYS HA 1 1 16 10524 1 1 18 CYS HB2 H 2.596 0.853 2.804 1.00 . A A . 515 CYS HB2 1 1 16 10525 1 1 18 CYS HB3 H 2.021 2.499 2.540 1.00 . A A . 515 CYS HB3 1 1 16 10526 1 1 18 CYS N N 0.180 1.970 4.141 1.00 . A A . 515 CYS N 1 1 16 10527 1 1 18 CYS O O 1.871 3.880 5.467 1.00 . A A . 515 CYS O 1 1 16 10528 1 1 18 CYS SG S 4.145 2.475 3.644 1.00 . A A . 515 CYS SG 1 1 16 10529 1 1 19 THR C C 4.752 3.057 7.013 1.00 . A A . 516 THR C 1 1 16 10530 1 1 19 THR CA C 3.360 2.827 7.592 1.00 . A A . 516 THR CA 1 1 16 10531 1 1 19 THR CB C 3.451 2.096 8.953 1.00 . A A . 516 THR CB 1 1 16 10532 1 1 19 THR CG2 C 3.796 0.623 8.776 1.00 . A A . 516 THR CG2 1 1 16 10533 1 1 19 THR H H 2.445 1.138 6.796 1.00 . A A . 516 THR H 1 1 16 10534 1 1 19 THR HA H 2.880 3.783 7.743 1.00 . A A . 516 THR HA 1 1 16 10535 1 1 19 THR HB H 2.486 2.164 9.438 1.00 . A A . 516 THR HB 1 1 16 10536 1 1 19 THR HG1 H 5.311 2.460 9.497 1.00 . A A . 516 THR HG1 1 1 16 10537 1 1 19 THR HG21 H 4.734 0.535 8.249 1.00 . A A . 516 THR HG21 1 1 16 10538 1 1 19 THR HG22 H 3.884 0.154 9.745 1.00 . A A . 516 THR HG22 1 1 16 10539 1 1 19 THR HG23 H 3.017 0.135 8.209 1.00 . A A . 516 THR HG23 1 1 16 10540 1 1 19 THR N N 2.578 2.084 6.638 1.00 . A A . 516 THR N 1 1 16 10541 1 1 19 THR O O 5.490 2.116 6.713 1.00 . A A . 516 THR O 1 1 16 10542 1 1 19 THR OG1 O 4.430 2.724 9.790 1.00 . A A . 516 THR OG1 1 1 16 10543 1 1 20 GLY C C 6.041 5.677 5.096 1.00 . A A . 517 GLY C 1 1 16 10544 1 1 20 GLY CA C 6.318 4.657 6.168 1.00 . A A . 517 GLY CA 1 1 16 10545 1 1 20 GLY H H 4.550 5.011 7.262 1.00 . A A . 517 GLY H 1 1 16 10546 1 1 20 GLY HA2 H 7.031 5.063 6.873 1.00 . A A . 517 GLY HA2 1 1 16 10547 1 1 20 GLY HA3 H 6.730 3.769 5.713 1.00 . A A . 517 GLY HA3 1 1 16 10548 1 1 20 GLY N N 5.106 4.311 6.867 1.00 . A A . 517 GLY N 1 1 16 10549 1 1 20 GLY O O 6.699 6.716 5.035 1.00 . A A . 517 GLY O 1 1 16 10550 1 1 21 CYS C C 3.101 6.228 3.086 1.00 . A A . 518 CYS C 1 1 16 10551 1 1 21 CYS CA C 4.598 6.388 3.307 1.00 . A A . 518 CYS CA 1 1 16 10552 1 1 21 CYS CB C 5.366 6.305 1.990 1.00 . A A . 518 CYS CB 1 1 16 10553 1 1 21 CYS H H 4.640 4.498 4.260 1.00 . A A . 518 CYS H 1 1 16 10554 1 1 21 CYS HA H 4.774 7.345 3.769 1.00 . A A . 518 CYS HA 1 1 16 10555 1 1 21 CYS HB2 H 5.260 7.240 1.463 1.00 . A A . 518 CYS HB2 1 1 16 10556 1 1 21 CYS HB3 H 6.414 6.139 2.202 1.00 . A A . 518 CYS HB3 1 1 16 10557 1 1 21 CYS N N 5.066 5.392 4.244 1.00 . A A . 518 CYS N 1 1 16 10558 1 1 21 CYS O O 2.582 5.121 3.079 1.00 . A A . 518 CYS O 1 1 16 10559 1 1 21 CYS SG S 4.813 4.980 0.872 1.00 . A A . 518 CYS SG 1 1 16 10560 1 1 22 HIS C C 0.578 7.695 1.337 1.00 . A A . 519 HIS C 1 1 16 10561 1 1 22 HIS CA C 0.964 7.295 2.747 1.00 . A A . 519 HIS CA 1 1 16 10562 1 1 22 HIS CB C 0.297 8.218 3.775 1.00 . A A . 519 HIS CB 1 1 16 10563 1 1 22 HIS CD2 C 1.774 8.211 5.907 1.00 . A A . 519 HIS CD2 1 1 16 10564 1 1 22 HIS CE1 C 0.456 7.065 7.219 1.00 . A A . 519 HIS CE1 1 1 16 10565 1 1 22 HIS CG C 0.665 7.901 5.195 1.00 . A A . 519 HIS CG 1 1 16 10566 1 1 22 HIS H H 2.885 8.192 2.804 1.00 . A A . 519 HIS H 1 1 16 10567 1 1 22 HIS HA H 0.641 6.280 2.923 1.00 . A A . 519 HIS HA 1 1 16 10568 1 1 22 HIS HB2 H 0.590 9.238 3.576 1.00 . A A . 519 HIS HB2 1 1 16 10569 1 1 22 HIS HB3 H -0.776 8.133 3.682 1.00 . A A . 519 HIS HB3 1 1 16 10570 1 1 22 HIS HD1 H -1.036 6.815 5.837 1.00 . A A . 519 HIS HD1 1 1 16 10571 1 1 22 HIS HD2 H 2.623 8.778 5.552 1.00 . A A . 519 HIS HD2 1 1 16 10572 1 1 22 HIS HE1 H 0.060 6.548 8.080 1.00 . A A . 519 HIS HE1 1 1 16 10573 1 1 22 HIS HE2 H 2.153 7.943 7.953 1.00 . A A . 519 HIS HE2 1 1 16 10574 1 1 22 HIS N N 2.411 7.331 2.885 1.00 . A A . 519 HIS N 1 1 16 10575 1 1 22 HIS ND1 N -0.142 7.183 6.049 1.00 . A A . 519 HIS ND1 1 1 16 10576 1 1 22 HIS NE2 N 1.619 7.680 7.161 1.00 . A A . 519 HIS NE2 1 1 16 10577 1 1 22 HIS O O -0.489 8.261 1.103 1.00 . A A . 519 HIS O 1 1 16 10578 1 1 23 LYS C C 0.456 6.628 -1.695 1.00 . A A . 520 LYS C 1 1 16 10579 1 1 23 LYS CA C 1.236 7.731 -0.999 1.00 . A A . 520 LYS CA 1 1 16 10580 1 1 23 LYS CB C 2.566 7.963 -1.723 1.00 . A A . 520 LYS CB 1 1 16 10581 1 1 23 LYS CD C 4.840 7.056 -2.347 1.00 . A A . 520 LYS CD 1 1 16 10582 1 1 23 LYS CE C 5.517 8.325 -1.833 1.00 . A A . 520 LYS CE 1 1 16 10583 1 1 23 LYS CG C 3.523 6.785 -1.629 1.00 . A A . 520 LYS CG 1 1 16 10584 1 1 23 LYS H H 2.303 6.952 0.644 1.00 . A A . 520 LYS H 1 1 16 10585 1 1 23 LYS HA H 0.656 8.640 -1.034 1.00 . A A . 520 LYS HA 1 1 16 10586 1 1 23 LYS HB2 H 2.366 8.154 -2.766 1.00 . A A . 520 LYS HB2 1 1 16 10587 1 1 23 LYS HB3 H 3.052 8.827 -1.293 1.00 . A A . 520 LYS HB3 1 1 16 10588 1 1 23 LYS HD2 H 5.504 6.214 -2.190 1.00 . A A . 520 LYS HD2 1 1 16 10589 1 1 23 LYS HD3 H 4.645 7.164 -3.404 1.00 . A A . 520 LYS HD3 1 1 16 10590 1 1 23 LYS HE2 H 6.502 8.396 -2.273 1.00 . A A . 520 LYS HE2 1 1 16 10591 1 1 23 LYS HE3 H 4.929 9.179 -2.137 1.00 . A A . 520 LYS HE3 1 1 16 10592 1 1 23 LYS HG2 H 3.729 6.589 -0.588 1.00 . A A . 520 LYS HG2 1 1 16 10593 1 1 23 LYS HG3 H 3.054 5.918 -2.072 1.00 . A A . 520 LYS HG3 1 1 16 10594 1 1 23 LYS HZ1 H 6.076 7.443 -0.020 1.00 . A A . 520 LYS HZ1 1 1 16 10595 1 1 23 LYS HZ2 H 6.252 9.131 -0.042 1.00 . A A . 520 LYS HZ2 1 1 16 10596 1 1 23 LYS HZ3 H 4.716 8.435 0.094 1.00 . A A . 520 LYS HZ3 1 1 16 10597 1 1 23 LYS N N 1.464 7.398 0.396 1.00 . A A . 520 LYS N 1 1 16 10598 1 1 23 LYS NZ N 5.651 8.332 -0.349 1.00 . A A . 520 LYS NZ 1 1 16 10599 1 1 23 LYS O O -0.160 6.859 -2.735 1.00 . A A . 520 LYS O 1 1 16 10600 1 1 24 VAL C C -1.161 3.693 -0.622 1.00 . A A . 521 VAL C 1 1 16 10601 1 1 24 VAL CA C -0.265 4.302 -1.691 1.00 . A A . 521 VAL CA 1 1 16 10602 1 1 24 VAL CB C 0.661 3.203 -2.259 1.00 . A A . 521 VAL CB 1 1 16 10603 1 1 24 VAL CG1 C 1.572 3.758 -3.343 1.00 . A A . 521 VAL CG1 1 1 16 10604 1 1 24 VAL CG2 C 1.475 2.563 -1.149 1.00 . A A . 521 VAL CG2 1 1 16 10605 1 1 24 VAL H H 0.992 5.276 -0.307 1.00 . A A . 521 VAL H 1 1 16 10606 1 1 24 VAL HA H -0.883 4.679 -2.494 1.00 . A A . 521 VAL HA 1 1 16 10607 1 1 24 VAL HB H 0.040 2.438 -2.703 1.00 . A A . 521 VAL HB 1 1 16 10608 1 1 24 VAL HG11 H 2.156 4.572 -2.940 1.00 . A A . 521 VAL HG11 1 1 16 10609 1 1 24 VAL HG12 H 2.234 2.977 -3.691 1.00 . A A . 521 VAL HG12 1 1 16 10610 1 1 24 VAL HG13 H 0.974 4.118 -4.168 1.00 . A A . 521 VAL HG13 1 1 16 10611 1 1 24 VAL HG21 H 0.810 2.122 -0.421 1.00 . A A . 521 VAL HG21 1 1 16 10612 1 1 24 VAL HG22 H 2.110 1.797 -1.567 1.00 . A A . 521 VAL HG22 1 1 16 10613 1 1 24 VAL HG23 H 2.085 3.314 -0.671 1.00 . A A . 521 VAL HG23 1 1 16 10614 1 1 24 VAL N N 0.481 5.421 -1.135 1.00 . A A . 521 VAL N 1 1 16 10615 1 1 24 VAL O O -0.923 3.865 0.575 1.00 . A A . 521 VAL O 1 1 16 10616 1 1 25 ASN C C -3.422 0.960 -0.429 1.00 . A A . 522 ASN C 1 1 16 10617 1 1 25 ASN CA C -3.157 2.424 -0.131 1.00 . A A . 522 ASN CA 1 1 16 10618 1 1 25 ASN CB C -4.471 3.216 -0.152 1.00 . A A . 522 ASN CB 1 1 16 10619 1 1 25 ASN CG C -4.631 4.055 -1.406 1.00 . A A . 522 ASN CG 1 1 16 10620 1 1 25 ASN H H -2.299 2.843 -2.026 1.00 . A A . 522 ASN H 1 1 16 10621 1 1 25 ASN HA H -2.732 2.481 0.861 1.00 . A A . 522 ASN HA 1 1 16 10622 1 1 25 ASN HB2 H -5.300 2.526 -0.093 1.00 . A A . 522 ASN HB2 1 1 16 10623 1 1 25 ASN HB3 H -4.498 3.874 0.706 1.00 . A A . 522 ASN HB3 1 1 16 10624 1 1 25 ASN HD21 H -5.211 2.453 -2.442 1.00 . A A . 522 ASN HD21 1 1 16 10625 1 1 25 ASN HD22 H -5.129 3.946 -3.324 1.00 . A A . 522 ASN HD22 1 1 16 10626 1 1 25 ASN N N -2.190 2.992 -1.058 1.00 . A A . 522 ASN N 1 1 16 10627 1 1 25 ASN ND2 N -5.035 3.427 -2.497 1.00 . A A . 522 ASN ND2 1 1 16 10628 1 1 25 ASN O O -3.389 0.520 -1.580 1.00 . A A . 522 ASN O 1 1 16 10629 1 1 25 ASN OD1 O -4.355 5.255 -1.405 1.00 . A A . 522 ASN OD1 1 1 16 10630 1 1 26 TYR C C -5.270 -1.517 1.216 1.00 . A A . 523 TYR C 1 1 16 10631 1 1 26 TYR CA C -3.932 -1.213 0.554 1.00 . A A . 523 TYR CA 1 1 16 10632 1 1 26 TYR CB C -2.829 -2.007 1.265 1.00 . A A . 523 TYR CB 1 1 16 10633 1 1 26 TYR CD1 C -0.878 -2.484 -0.269 1.00 . A A . 523 TYR CD1 1 1 16 10634 1 1 26 TYR CD2 C -0.627 -0.763 1.360 1.00 . A A . 523 TYR CD2 1 1 16 10635 1 1 26 TYR CE1 C 0.413 -2.259 -0.708 1.00 . A A . 523 TYR CE1 1 1 16 10636 1 1 26 TYR CE2 C 0.665 -0.536 0.928 1.00 . A A . 523 TYR CE2 1 1 16 10637 1 1 26 TYR CG C -1.421 -1.741 0.771 1.00 . A A . 523 TYR CG 1 1 16 10638 1 1 26 TYR CZ C 1.180 -1.285 -0.108 1.00 . A A . 523 TYR CZ 1 1 16 10639 1 1 26 TYR H H -3.723 0.653 1.517 1.00 . A A . 523 TYR H 1 1 16 10640 1 1 26 TYR HA H -3.973 -1.490 -0.489 1.00 . A A . 523 TYR HA 1 1 16 10641 1 1 26 TYR HB2 H -2.853 -1.769 2.317 1.00 . A A . 523 TYR HB2 1 1 16 10642 1 1 26 TYR HB3 H -3.027 -3.063 1.142 1.00 . A A . 523 TYR HB3 1 1 16 10643 1 1 26 TYR HD1 H -1.034 -0.175 2.170 1.00 . A A . 523 TYR HD1 1 1 16 10644 1 1 26 TYR HD2 H -1.480 -3.246 -0.739 1.00 . A A . 523 TYR HD2 1 1 16 10645 1 1 26 TYR HE1 H 1.267 0.228 1.399 1.00 . A A . 523 TYR HE1 1 1 16 10646 1 1 26 TYR HE2 H 0.817 -2.846 -1.520 1.00 . A A . 523 TYR HE2 1 1 16 10647 1 1 26 TYR HH H 2.541 -1.259 -1.488 1.00 . A A . 523 TYR HH 1 1 16 10648 1 1 26 TYR N N -3.673 0.215 0.638 1.00 . A A . 523 TYR N 1 1 16 10649 1 1 26 TYR O O -5.984 -0.606 1.636 1.00 . A A . 523 TYR O 1 1 16 10650 1 1 26 TYR OH O 2.471 -1.069 -0.535 1.00 . A A . 523 TYR OH 1 1 16 10651 1 1 27 CYS C C -6.586 -4.046 3.183 1.00 . A A . 524 CYS C 1 1 16 10652 1 1 27 CYS CA C -6.858 -3.166 1.972 1.00 . A A . 524 CYS CA 1 1 16 10653 1 1 27 CYS CB C -7.780 -3.879 0.979 1.00 . A A . 524 CYS CB 1 1 16 10654 1 1 27 CYS H H -4.983 -3.486 1.051 1.00 . A A . 524 CYS H 1 1 16 10655 1 1 27 CYS HA H -7.339 -2.264 2.307 1.00 . A A . 524 CYS HA 1 1 16 10656 1 1 27 CYS HB2 H -8.790 -3.847 1.356 1.00 . A A . 524 CYS HB2 1 1 16 10657 1 1 27 CYS HB3 H -7.743 -3.360 0.032 1.00 . A A . 524 CYS HB3 1 1 16 10658 1 1 27 CYS N N -5.605 -2.789 1.344 1.00 . A A . 524 CYS N 1 1 16 10659 1 1 27 CYS O O -7.455 -4.248 4.033 1.00 . A A . 524 CYS O 1 1 16 10660 1 1 27 CYS SG S -7.371 -5.623 0.671 1.00 . A A . 524 CYS SG 1 1 16 10661 1 1 28 SER C C -3.439 -5.370 4.471 1.00 . A A . 525 SER C 1 1 16 10662 1 1 28 SER CA C -4.952 -5.445 4.320 1.00 . A A . 525 SER CA 1 1 16 10663 1 1 28 SER CB C -5.384 -6.875 3.965 1.00 . A A . 525 SER CB 1 1 16 10664 1 1 28 SER H H -4.692 -4.287 2.603 1.00 . A A . 525 SER H 1 1 16 10665 1 1 28 SER HA H -5.422 -5.140 5.243 1.00 . A A . 525 SER HA 1 1 16 10666 1 1 28 SER HB2 H -6.460 -6.918 3.911 1.00 . A A . 525 SER HB2 1 1 16 10667 1 1 28 SER HB3 H -4.965 -7.145 3.006 1.00 . A A . 525 SER HB3 1 1 16 10668 1 1 28 SER HG H -5.288 -8.697 4.708 1.00 . A A . 525 SER HG 1 1 16 10669 1 1 28 SER N N -5.359 -4.540 3.266 1.00 . A A . 525 SER N 1 1 16 10670 1 1 28 SER O O -2.742 -4.913 3.560 1.00 . A A . 525 SER O 1 1 16 10671 1 1 28 SER OG O -4.941 -7.814 4.933 1.00 . A A . 525 SER OG 1 1 16 10672 1 1 29 THR C C -0.845 -6.903 4.944 1.00 . A A . 526 THR C 1 1 16 10673 1 1 29 THR CA C -1.498 -5.850 5.845 1.00 . A A . 526 THR CA 1 1 16 10674 1 1 29 THR CB C -1.185 -6.142 7.327 1.00 . A A . 526 THR CB 1 1 16 10675 1 1 29 THR CG2 C 0.315 -6.111 7.591 1.00 . A A . 526 THR CG2 1 1 16 10676 1 1 29 THR H H -3.539 -6.114 6.325 1.00 . A A . 526 THR H 1 1 16 10677 1 1 29 THR HA H -1.095 -4.881 5.595 1.00 . A A . 526 THR HA 1 1 16 10678 1 1 29 THR HB H -1.560 -7.127 7.571 1.00 . A A . 526 THR HB 1 1 16 10679 1 1 29 THR HG1 H -1.785 -4.298 7.741 1.00 . A A . 526 THR HG1 1 1 16 10680 1 1 29 THR HG21 H 0.710 -5.144 7.311 1.00 . A A . 526 THR HG21 1 1 16 10681 1 1 29 THR HG22 H 0.501 -6.287 8.641 1.00 . A A . 526 THR HG22 1 1 16 10682 1 1 29 THR HG23 H 0.798 -6.880 7.005 1.00 . A A . 526 THR HG23 1 1 16 10683 1 1 29 THR N N -2.932 -5.811 5.614 1.00 . A A . 526 THR N 1 1 16 10684 1 1 29 THR O O 0.345 -6.821 4.628 1.00 . A A . 526 THR O 1 1 16 10685 1 1 29 THR OG1 O -1.838 -5.173 8.162 1.00 . A A . 526 THR OG1 1 1 16 10686 1 1 30 PHE C C -0.696 -8.272 2.288 1.00 . A A . 527 PHE C 1 1 16 10687 1 1 30 PHE CA C -1.149 -8.903 3.599 1.00 . A A . 527 PHE CA 1 1 16 10688 1 1 30 PHE CB C -2.233 -9.951 3.330 1.00 . A A . 527 PHE CB 1 1 16 10689 1 1 30 PHE CD1 C -0.987 -11.929 2.416 1.00 . A A . 527 PHE CD1 1 1 16 10690 1 1 30 PHE CD2 C -2.448 -10.735 0.958 1.00 . A A . 527 PHE CD2 1 1 16 10691 1 1 30 PHE CE1 C -0.659 -12.789 1.386 1.00 . A A . 527 PHE CE1 1 1 16 10692 1 1 30 PHE CE2 C -2.126 -11.591 -0.074 1.00 . A A . 527 PHE CE2 1 1 16 10693 1 1 30 PHE CG C -1.885 -10.894 2.214 1.00 . A A . 527 PHE CG 1 1 16 10694 1 1 30 PHE CZ C -1.230 -12.620 0.139 1.00 . A A . 527 PHE CZ 1 1 16 10695 1 1 30 PHE H H -2.563 -7.926 4.834 1.00 . A A . 527 PHE H 1 1 16 10696 1 1 30 PHE HA H -0.301 -9.387 4.062 1.00 . A A . 527 PHE HA 1 1 16 10697 1 1 30 PHE HB2 H -2.390 -10.536 4.224 1.00 . A A . 527 PHE HB2 1 1 16 10698 1 1 30 PHE HB3 H -3.153 -9.448 3.068 1.00 . A A . 527 PHE HB3 1 1 16 10699 1 1 30 PHE HD1 H -0.544 -12.063 3.392 1.00 . A A . 527 PHE HD1 1 1 16 10700 1 1 30 PHE HD2 H -3.149 -9.932 0.790 1.00 . A A . 527 PHE HD2 1 1 16 10701 1 1 30 PHE HE1 H 0.043 -13.591 1.555 1.00 . A A . 527 PHE HE1 1 1 16 10702 1 1 30 PHE HE2 H -2.570 -11.452 -1.047 1.00 . A A . 527 PHE HE2 1 1 16 10703 1 1 30 PHE HZ H -0.974 -13.290 -0.667 1.00 . A A . 527 PHE HZ 1 1 16 10704 1 1 30 PHE N N -1.635 -7.885 4.516 1.00 . A A . 527 PHE N 1 1 16 10705 1 1 30 PHE O O 0.411 -8.532 1.819 1.00 . A A . 527 PHE O 1 1 16 10706 1 1 31 CYS C C -0.024 -5.827 0.654 1.00 . A A . 528 CYS C 1 1 16 10707 1 1 31 CYS CA C -1.223 -6.751 0.467 1.00 . A A . 528 CYS CA 1 1 16 10708 1 1 31 CYS CB C -2.439 -5.983 -0.028 1.00 . A A . 528 CYS CB 1 1 16 10709 1 1 31 CYS H H -2.404 -7.246 2.143 1.00 . A A . 528 CYS H 1 1 16 10710 1 1 31 CYS HA H -0.965 -7.524 -0.242 1.00 . A A . 528 CYS HA 1 1 16 10711 1 1 31 CYS HB2 H -2.553 -5.078 0.552 1.00 . A A . 528 CYS HB2 1 1 16 10712 1 1 31 CYS HB3 H -2.301 -5.729 -1.068 1.00 . A A . 528 CYS HB3 1 1 16 10713 1 1 31 CYS N N -1.540 -7.420 1.718 1.00 . A A . 528 CYS N 1 1 16 10714 1 1 31 CYS O O 0.805 -5.681 -0.245 1.00 . A A . 528 CYS O 1 1 16 10715 1 1 31 CYS SG S -3.977 -6.939 0.118 1.00 . A A . 528 CYS SG 1 1 16 10716 1 1 32 GLN C C 2.500 -5.101 2.068 1.00 . A A . 529 GLN C 1 1 16 10717 1 1 32 GLN CA C 1.177 -4.340 2.177 1.00 . A A . 529 GLN CA 1 1 16 10718 1 1 32 GLN CB C 0.993 -3.802 3.606 1.00 . A A . 529 GLN CB 1 1 16 10719 1 1 32 GLN CD C 2.726 -2.009 4.036 1.00 . A A . 529 GLN CD 1 1 16 10720 1 1 32 GLN CG C 2.291 -3.430 4.309 1.00 . A A . 529 GLN CG 1 1 16 10721 1 1 32 GLN H H -0.621 -5.396 2.514 1.00 . A A . 529 GLN H 1 1 16 10722 1 1 32 GLN HA H 1.175 -3.516 1.478 1.00 . A A . 529 GLN HA 1 1 16 10723 1 1 32 GLN HB2 H 0.374 -2.915 3.569 1.00 . A A . 529 GLN HB2 1 1 16 10724 1 1 32 GLN HB3 H 0.491 -4.555 4.197 1.00 . A A . 529 GLN HB3 1 1 16 10725 1 1 32 GLN HE21 H 3.706 -2.576 2.399 1.00 . A A . 529 GLN HE21 1 1 16 10726 1 1 32 GLN HE22 H 3.751 -0.886 2.765 1.00 . A A . 529 GLN HE22 1 1 16 10727 1 1 32 GLN HG2 H 2.152 -3.551 5.372 1.00 . A A . 529 GLN HG2 1 1 16 10728 1 1 32 GLN HG3 H 3.068 -4.099 3.968 1.00 . A A . 529 GLN HG3 1 1 16 10729 1 1 32 GLN N N 0.065 -5.220 1.837 1.00 . A A . 529 GLN N 1 1 16 10730 1 1 32 GLN NE2 N 3.474 -1.805 2.961 1.00 . A A . 529 GLN NE2 1 1 16 10731 1 1 32 GLN O O 3.458 -4.629 1.454 1.00 . A A . 529 GLN O 1 1 16 10732 1 1 32 GLN OE1 O 2.386 -1.101 4.785 1.00 . A A . 529 GLN OE1 1 1 16 10733 1 1 33 ARG C C 3.937 -7.743 1.275 1.00 . A A . 530 ARG C 1 1 16 10734 1 1 33 ARG CA C 3.733 -7.111 2.652 1.00 . A A . 530 ARG CA 1 1 16 10735 1 1 33 ARG CB C 3.671 -8.183 3.738 1.00 . A A . 530 ARG CB 1 1 16 10736 1 1 33 ARG CD C 3.699 -8.727 6.188 1.00 . A A . 530 ARG CD 1 1 16 10737 1 1 33 ARG CG C 3.730 -7.621 5.149 1.00 . A A . 530 ARG CG 1 1 16 10738 1 1 33 ARG CZ C 4.279 -8.899 8.579 1.00 . A A . 530 ARG CZ 1 1 16 10739 1 1 33 ARG H H 1.725 -6.605 3.128 1.00 . A A . 530 ARG H 1 1 16 10740 1 1 33 ARG HA H 4.564 -6.451 2.843 1.00 . A A . 530 ARG HA 1 1 16 10741 1 1 33 ARG HB2 H 2.744 -8.730 3.633 1.00 . A A . 530 ARG HB2 1 1 16 10742 1 1 33 ARG HB3 H 4.498 -8.864 3.608 1.00 . A A . 530 ARG HB3 1 1 16 10743 1 1 33 ARG HD2 H 2.766 -9.264 6.095 1.00 . A A . 530 ARG HD2 1 1 16 10744 1 1 33 ARG HD3 H 4.521 -9.402 6.001 1.00 . A A . 530 ARG HD3 1 1 16 10745 1 1 33 ARG HE H 3.526 -7.266 7.697 1.00 . A A . 530 ARG HE 1 1 16 10746 1 1 33 ARG HG2 H 4.644 -7.059 5.265 1.00 . A A . 530 ARG HG2 1 1 16 10747 1 1 33 ARG HG3 H 2.882 -6.969 5.305 1.00 . A A . 530 ARG HG3 1 1 16 10748 1 1 33 ARG HH11 H 4.637 -10.579 7.511 1.00 . A A . 530 ARG HH11 1 1 16 10749 1 1 33 ARG HH12 H 5.035 -10.681 9.194 1.00 . A A . 530 ARG HH12 1 1 16 10750 1 1 33 ARG HH21 H 4.052 -7.386 9.904 1.00 . A A . 530 ARG HH21 1 1 16 10751 1 1 33 ARG HH22 H 4.702 -8.861 10.566 1.00 . A A . 530 ARG HH22 1 1 16 10752 1 1 33 ARG N N 2.537 -6.280 2.677 1.00 . A A . 530 ARG N 1 1 16 10753 1 1 33 ARG NE N 3.813 -8.202 7.546 1.00 . A A . 530 ARG NE 1 1 16 10754 1 1 33 ARG NH1 N 4.681 -10.153 8.413 1.00 . A A . 530 ARG NH1 1 1 16 10755 1 1 33 ARG NH2 N 4.347 -8.337 9.776 1.00 . A A . 530 ARG NH2 1 1 16 10756 1 1 33 ARG O O 5.068 -7.978 0.850 1.00 . A A . 530 ARG O 1 1 16 10757 1 1 34 LYS C C 3.527 -7.639 -1.730 1.00 . A A . 531 LYS C 1 1 16 10758 1 1 34 LYS CA C 2.883 -8.610 -0.741 1.00 . A A . 531 LYS CA 1 1 16 10759 1 1 34 LYS CB C 1.453 -8.985 -1.171 1.00 . A A . 531 LYS CB 1 1 16 10760 1 1 34 LYS CD C 1.383 -8.903 -3.695 1.00 . A A . 531 LYS CD 1 1 16 10761 1 1 34 LYS CE C 1.053 -9.689 -4.954 1.00 . A A . 531 LYS CE 1 1 16 10762 1 1 34 LYS CG C 1.347 -9.789 -2.459 1.00 . A A . 531 LYS CG 1 1 16 10763 1 1 34 LYS H H 1.964 -7.793 0.981 1.00 . A A . 531 LYS H 1 1 16 10764 1 1 34 LYS HA H 3.484 -9.506 -0.683 1.00 . A A . 531 LYS HA 1 1 16 10765 1 1 34 LYS HB2 H 1.001 -9.564 -0.381 1.00 . A A . 531 LYS HB2 1 1 16 10766 1 1 34 LYS HB3 H 0.884 -8.076 -1.298 1.00 . A A . 531 LYS HB3 1 1 16 10767 1 1 34 LYS HD2 H 0.660 -8.109 -3.577 1.00 . A A . 531 LYS HD2 1 1 16 10768 1 1 34 LYS HD3 H 2.373 -8.479 -3.792 1.00 . A A . 531 LYS HD3 1 1 16 10769 1 1 34 LYS HE2 H 1.134 -9.033 -5.808 1.00 . A A . 531 LYS HE2 1 1 16 10770 1 1 34 LYS HE3 H 1.763 -10.497 -5.053 1.00 . A A . 531 LYS HE3 1 1 16 10771 1 1 34 LYS HG2 H 2.174 -10.480 -2.506 1.00 . A A . 531 LYS HG2 1 1 16 10772 1 1 34 LYS HG3 H 0.417 -10.340 -2.450 1.00 . A A . 531 LYS HG3 1 1 16 10773 1 1 34 LYS HZ1 H -1.014 -9.507 -4.700 1.00 . A A . 531 LYS HZ1 1 1 16 10774 1 1 34 LYS HZ2 H -0.563 -10.691 -5.829 1.00 . A A . 531 LYS HZ2 1 1 16 10775 1 1 34 LYS HZ3 H -0.387 -10.989 -4.171 1.00 . A A . 531 LYS HZ3 1 1 16 10776 1 1 34 LYS N N 2.839 -8.008 0.585 1.00 . A A . 531 LYS N 1 1 16 10777 1 1 34 LYS NZ N -0.322 -10.257 -4.910 1.00 . A A . 531 LYS NZ 1 1 16 10778 1 1 34 LYS O O 4.354 -8.029 -2.561 1.00 . A A . 531 LYS O 1 1 16 10779 1 1 35 ASP C C 5.084 -4.882 -2.004 1.00 . A A . 532 ASP C 1 1 16 10780 1 1 35 ASP CA C 3.697 -5.310 -2.460 1.00 . A A . 532 ASP CA 1 1 16 10781 1 1 35 ASP CB C 2.758 -4.102 -2.437 1.00 . A A . 532 ASP CB 1 1 16 10782 1 1 35 ASP CG C 3.157 -3.013 -3.424 1.00 . A A . 532 ASP CG 1 1 16 10783 1 1 35 ASP H H 2.477 -6.133 -0.940 1.00 . A A . 532 ASP H 1 1 16 10784 1 1 35 ASP HA H 3.752 -5.676 -3.475 1.00 . A A . 532 ASP HA 1 1 16 10785 1 1 35 ASP HB2 H 1.761 -4.433 -2.674 1.00 . A A . 532 ASP HB2 1 1 16 10786 1 1 35 ASP HB3 H 2.758 -3.677 -1.444 1.00 . A A . 532 ASP HB3 1 1 16 10787 1 1 35 ASP N N 3.159 -6.369 -1.610 1.00 . A A . 532 ASP N 1 1 16 10788 1 1 35 ASP O O 5.800 -4.202 -2.731 1.00 . A A . 532 ASP O 1 1 16 10789 1 1 35 ASP OD1 O 3.492 -3.347 -4.585 1.00 . A A . 532 ASP OD1 1 1 16 10790 1 1 35 ASP OD2 O 3.112 -1.819 -3.048 1.00 . A A . 532 ASP OD2 1 1 16 10791 1 1 36 TRP C C 7.945 -5.155 -1.076 1.00 . A A . 533 TRP C 1 1 16 10792 1 1 36 TRP CA C 6.727 -4.869 -0.197 1.00 . A A . 533 TRP CA 1 1 16 10793 1 1 36 TRP CB C 6.912 -5.512 1.178 1.00 . A A . 533 TRP CB 1 1 16 10794 1 1 36 TRP CD1 C 9.254 -5.631 2.213 1.00 . A A . 533 TRP CD1 1 1 16 10795 1 1 36 TRP CD2 C 8.246 -3.642 2.430 1.00 . A A . 533 TRP CD2 1 1 16 10796 1 1 36 TRP CE2 C 9.518 -3.568 3.023 1.00 . A A . 533 TRP CE2 1 1 16 10797 1 1 36 TRP CE3 C 7.428 -2.505 2.439 1.00 . A A . 533 TRP CE3 1 1 16 10798 1 1 36 TRP CG C 8.096 -4.971 1.916 1.00 . A A . 533 TRP CG 1 1 16 10799 1 1 36 TRP CH2 C 9.174 -1.310 3.618 1.00 . A A . 533 TRP CH2 1 1 16 10800 1 1 36 TRP CZ2 C 9.992 -2.408 3.623 1.00 . A A . 533 TRP CZ2 1 1 16 10801 1 1 36 TRP CZ3 C 7.901 -1.352 3.038 1.00 . A A . 533 TRP CZ3 1 1 16 10802 1 1 36 TRP H H 4.930 -5.979 -0.335 1.00 . A A . 533 TRP H 1 1 16 10803 1 1 36 TRP HA H 6.650 -3.801 -0.059 1.00 . A A . 533 TRP HA 1 1 16 10804 1 1 36 TRP HB2 H 6.032 -5.332 1.777 1.00 . A A . 533 TRP HB2 1 1 16 10805 1 1 36 TRP HB3 H 7.049 -6.577 1.058 1.00 . A A . 533 TRP HB3 1 1 16 10806 1 1 36 TRP HD1 H 9.451 -6.661 1.955 1.00 . A A . 533 TRP HD1 1 1 16 10807 1 1 36 TRP HE1 H 11.010 -5.039 3.198 1.00 . A A . 533 TRP HE1 1 1 16 10808 1 1 36 TRP HE3 H 6.440 -2.521 1.995 1.00 . A A . 533 TRP HE3 1 1 16 10809 1 1 36 TRP HH2 H 9.503 -0.388 4.074 1.00 . A A . 533 TRP HH2 1 1 16 10810 1 1 36 TRP HZ2 H 10.972 -2.357 4.071 1.00 . A A . 533 TRP HZ2 1 1 16 10811 1 1 36 TRP HZ3 H 7.286 -0.464 3.056 1.00 . A A . 533 TRP HZ3 1 1 16 10812 1 1 36 TRP N N 5.483 -5.327 -0.817 1.00 . A A . 533 TRP N 1 1 16 10813 1 1 36 TRP NE1 N 10.113 -4.795 2.878 1.00 . A A . 533 TRP NE1 1 1 16 10814 1 1 36 TRP O O 8.930 -4.432 -1.035 1.00 . A A . 533 TRP O 1 1 16 10815 1 1 37 LYS C C 9.245 -5.405 -3.743 1.00 . A A . 534 LYS C 1 1 16 10816 1 1 37 LYS CA C 8.936 -6.561 -2.802 1.00 . A A . 534 LYS CA 1 1 16 10817 1 1 37 LYS CB C 8.563 -7.802 -3.607 1.00 . A A . 534 LYS CB 1 1 16 10818 1 1 37 LYS CD C 7.761 -10.176 -3.611 1.00 . A A . 534 LYS CD 1 1 16 10819 1 1 37 LYS CE C 8.839 -10.625 -4.582 1.00 . A A . 534 LYS CE 1 1 16 10820 1 1 37 LYS CG C 8.230 -9.015 -2.752 1.00 . A A . 534 LYS CG 1 1 16 10821 1 1 37 LYS H H 7.061 -6.749 -1.843 1.00 . A A . 534 LYS H 1 1 16 10822 1 1 37 LYS HA H 9.859 -6.732 -2.272 1.00 . A A . 534 LYS HA 1 1 16 10823 1 1 37 LYS HB2 H 7.703 -7.573 -4.216 1.00 . A A . 534 LYS HB2 1 1 16 10824 1 1 37 LYS HB3 H 9.390 -8.061 -4.254 1.00 . A A . 534 LYS HB3 1 1 16 10825 1 1 37 LYS HD2 H 7.504 -11.005 -2.968 1.00 . A A . 534 LYS HD2 1 1 16 10826 1 1 37 LYS HD3 H 6.891 -9.868 -4.169 1.00 . A A . 534 LYS HD3 1 1 16 10827 1 1 37 LYS HE2 H 9.199 -9.765 -5.128 1.00 . A A . 534 LYS HE2 1 1 16 10828 1 1 37 LYS HE3 H 9.652 -11.060 -4.019 1.00 . A A . 534 LYS HE3 1 1 16 10829 1 1 37 LYS HG2 H 9.112 -9.314 -2.204 1.00 . A A . 534 LYS HG2 1 1 16 10830 1 1 37 LYS HG3 H 7.444 -8.748 -2.060 1.00 . A A . 534 LYS HG3 1 1 16 10831 1 1 37 LYS HZ1 H 7.879 -12.422 -5.040 1.00 . A A . 534 LYS HZ1 1 1 16 10832 1 1 37 LYS HZ2 H 7.621 -11.188 -6.177 1.00 . A A . 534 LYS HZ2 1 1 16 10833 1 1 37 LYS HZ3 H 9.107 -11.999 -6.129 1.00 . A A . 534 LYS HZ3 1 1 16 10834 1 1 37 LYS N N 7.867 -6.204 -1.871 1.00 . A A . 534 LYS N 1 1 16 10835 1 1 37 LYS NZ N 8.326 -11.628 -5.546 1.00 . A A . 534 LYS NZ 1 1 16 10836 1 1 37 LYS O O 10.415 -5.106 -3.980 1.00 . A A . 534 LYS O 1 1 16 10837 1 1 38 ASP C C 8.481 -2.327 -4.248 1.00 . A A . 535 ASP C 1 1 16 10838 1 1 38 ASP CA C 8.483 -3.573 -5.094 1.00 . A A . 535 ASP CA 1 1 16 10839 1 1 38 ASP CB C 7.419 -3.424 -6.164 1.00 . A A . 535 ASP CB 1 1 16 10840 1 1 38 ASP CG C 7.846 -2.491 -7.273 1.00 . A A . 535 ASP CG 1 1 16 10841 1 1 38 ASP H H 7.308 -5.023 -4.077 1.00 . A A . 535 ASP H 1 1 16 10842 1 1 38 ASP HA H 9.450 -3.696 -5.557 1.00 . A A . 535 ASP HA 1 1 16 10843 1 1 38 ASP HB2 H 7.200 -4.380 -6.578 1.00 . A A . 535 ASP HB2 1 1 16 10844 1 1 38 ASP HB3 H 6.525 -3.024 -5.712 1.00 . A A . 535 ASP HB3 1 1 16 10845 1 1 38 ASP N N 8.233 -4.737 -4.258 1.00 . A A . 535 ASP N 1 1 16 10846 1 1 38 ASP O O 9.245 -1.400 -4.455 1.00 . A A . 535 ASP O 1 1 16 10847 1 1 38 ASP OD1 O 8.944 -2.699 -7.837 1.00 . A A . 535 ASP OD1 1 1 16 10848 1 1 38 ASP OD2 O 7.093 -1.549 -7.589 1.00 . A A . 535 ASP OD2 1 1 16 10849 1 1 39 HIS C C 8.552 -0.767 -1.664 1.00 . A A . 536 HIS C 1 1 16 10850 1 1 39 HIS CA C 7.353 -1.149 -2.512 1.00 . A A . 536 HIS CA 1 1 16 10851 1 1 39 HIS CB C 6.130 -1.358 -1.620 1.00 . A A . 536 HIS CB 1 1 16 10852 1 1 39 HIS CD2 C 5.554 0.293 0.300 1.00 . A A . 536 HIS CD2 1 1 16 10853 1 1 39 HIS CE1 C 4.624 1.855 -0.877 1.00 . A A . 536 HIS CE1 1 1 16 10854 1 1 39 HIS CG C 5.604 -0.102 -1.003 1.00 . A A . 536 HIS CG 1 1 16 10855 1 1 39 HIS H H 7.120 -3.145 -3.090 1.00 . A A . 536 HIS H 1 1 16 10856 1 1 39 HIS HA H 7.150 -0.355 -3.221 1.00 . A A . 536 HIS HA 1 1 16 10857 1 1 39 HIS HB2 H 5.338 -1.794 -2.209 1.00 . A A . 536 HIS HB2 1 1 16 10858 1 1 39 HIS HB3 H 6.390 -2.039 -0.821 1.00 . A A . 536 HIS HB3 1 1 16 10859 1 1 39 HIS HD1 H 4.865 0.905 -2.710 1.00 . A A . 536 HIS HD1 1 1 16 10860 1 1 39 HIS HD2 H 5.937 -0.251 1.150 1.00 . A A . 536 HIS HD2 1 1 16 10861 1 1 39 HIS HE1 H 4.133 2.772 -1.164 1.00 . A A . 536 HIS HE1 1 1 16 10862 1 1 39 HIS N N 7.616 -2.329 -3.279 1.00 . A A . 536 HIS N 1 1 16 10863 1 1 39 HIS ND1 N 5.011 0.905 -1.733 1.00 . A A . 536 HIS ND1 1 1 16 10864 1 1 39 HIS NE2 N 4.925 1.527 0.358 1.00 . A A . 536 HIS NE2 1 1 16 10865 1 1 39 HIS O O 8.788 0.405 -1.447 1.00 . A A . 536 HIS O 1 1 16 10866 1 1 40 GLN C C 11.442 -0.509 -0.913 1.00 . A A . 537 GLN C 1 1 16 10867 1 1 40 GLN CA C 10.427 -1.464 -0.284 1.00 . A A . 537 GLN CA 1 1 16 10868 1 1 40 GLN CB C 11.127 -2.752 0.158 1.00 . A A . 537 GLN CB 1 1 16 10869 1 1 40 GLN CD C 12.349 -4.846 -0.567 1.00 . A A . 537 GLN CD 1 1 16 10870 1 1 40 GLN CG C 11.794 -3.503 -0.986 1.00 . A A . 537 GLN CG 1 1 16 10871 1 1 40 GLN H H 9.110 -2.688 -1.441 1.00 . A A . 537 GLN H 1 1 16 10872 1 1 40 GLN HA H 9.999 -0.967 0.574 1.00 . A A . 537 GLN HA 1 1 16 10873 1 1 40 GLN HB2 H 11.882 -2.505 0.889 1.00 . A A . 537 GLN HB2 1 1 16 10874 1 1 40 GLN HB3 H 10.399 -3.408 0.615 1.00 . A A . 537 GLN HB3 1 1 16 10875 1 1 40 GLN HE21 H 10.595 -5.699 -0.913 1.00 . A A . 537 GLN HE21 1 1 16 10876 1 1 40 GLN HE22 H 11.848 -6.757 -0.354 1.00 . A A . 537 GLN HE22 1 1 16 10877 1 1 40 GLN HG2 H 11.067 -3.659 -1.772 1.00 . A A . 537 GLN HG2 1 1 16 10878 1 1 40 GLN HG3 H 12.604 -2.900 -1.364 1.00 . A A . 537 GLN HG3 1 1 16 10879 1 1 40 GLN N N 9.313 -1.749 -1.192 1.00 . A A . 537 GLN N 1 1 16 10880 1 1 40 GLN NE2 N 11.514 -5.868 -0.615 1.00 . A A . 537 GLN NE2 1 1 16 10881 1 1 40 GLN O O 11.982 0.362 -0.229 1.00 . A A . 537 GLN O 1 1 16 10882 1 1 40 GLN OE1 O 13.516 -4.959 -0.195 1.00 . A A . 537 GLN OE1 1 1 16 10883 1 1 41 HIS C C 12.052 1.535 -3.249 1.00 . A A . 538 HIS C 1 1 16 10884 1 1 41 HIS CA C 12.666 0.189 -2.884 1.00 . A A . 538 HIS CA 1 1 16 10885 1 1 41 HIS CB C 13.267 -0.500 -4.126 1.00 . A A . 538 HIS CB 1 1 16 10886 1 1 41 HIS CD2 C 11.590 -1.541 -5.786 1.00 . A A . 538 HIS CD2 1 1 16 10887 1 1 41 HIS CE1 C 11.481 0.132 -7.171 1.00 . A A . 538 HIS CE1 1 1 16 10888 1 1 41 HIS CG C 12.386 -0.546 -5.340 1.00 . A A . 538 HIS CG 1 1 16 10889 1 1 41 HIS H H 11.264 -1.396 -2.696 1.00 . A A . 538 HIS H 1 1 16 10890 1 1 41 HIS HA H 13.468 0.391 -2.194 1.00 . A A . 538 HIS HA 1 1 16 10891 1 1 41 HIS HB2 H 14.173 0.016 -4.406 1.00 . A A . 538 HIS HB2 1 1 16 10892 1 1 41 HIS HB3 H 13.515 -1.519 -3.867 1.00 . A A . 538 HIS HB3 1 1 16 10893 1 1 41 HIS HD2 H 11.388 -2.477 -5.289 1.00 . A A . 538 HIS HD2 1 1 16 10894 1 1 41 HIS HE1 H 11.183 0.756 -8.000 1.00 . A A . 538 HIS HE1 1 1 16 10895 1 1 41 HIS HE2 H 10.224 -1.506 -7.387 1.00 . A A . 538 HIS HE2 1 1 16 10896 1 1 41 HIS N N 11.702 -0.669 -2.206 1.00 . A A . 538 HIS N 1 1 16 10897 1 1 41 HIS ND1 N 12.315 0.510 -6.215 1.00 . A A . 538 HIS ND1 1 1 16 10898 1 1 41 HIS NE2 N 11.019 -1.105 -6.955 1.00 . A A . 538 HIS NE2 1 1 16 10899 1 1 41 HIS O O 12.773 2.515 -3.438 1.00 . A A . 538 HIS O 1 1 16 10900 1 1 42 ILE C C 9.779 3.635 -2.375 1.00 . A A . 539 ILE C 1 1 16 10901 1 1 42 ILE CA C 10.078 2.865 -3.665 1.00 . A A . 539 ILE CA 1 1 16 10902 1 1 42 ILE CB C 8.787 2.659 -4.522 1.00 . A A . 539 ILE CB 1 1 16 10903 1 1 42 ILE CD1 C 6.792 3.799 -3.401 1.00 . A A . 539 ILE CD1 1 1 16 10904 1 1 42 ILE CG1 C 7.510 2.496 -3.684 1.00 . A A . 539 ILE CG1 1 1 16 10905 1 1 42 ILE CG2 C 8.954 1.460 -5.433 1.00 . A A . 539 ILE CG2 1 1 16 10906 1 1 42 ILE H H 10.184 0.788 -3.242 1.00 . A A . 539 ILE H 1 1 16 10907 1 1 42 ILE HA H 10.775 3.450 -4.250 1.00 . A A . 539 ILE HA 1 1 16 10908 1 1 42 ILE HB H 8.673 3.517 -5.151 1.00 . A A . 539 ILE HB 1 1 16 10909 1 1 42 ILE HD11 H 6.475 4.243 -4.332 1.00 . A A . 539 ILE HD11 1 1 16 10910 1 1 42 ILE HD12 H 5.931 3.609 -2.779 1.00 . A A . 539 ILE HD12 1 1 16 10911 1 1 42 ILE HD13 H 7.463 4.474 -2.892 1.00 . A A . 539 ILE HD13 1 1 16 10912 1 1 42 ILE HG12 H 6.825 1.860 -4.213 1.00 . A A . 539 ILE HG12 1 1 16 10913 1 1 42 ILE HG13 H 7.759 2.040 -2.738 1.00 . A A . 539 ILE HG13 1 1 16 10914 1 1 42 ILE HG21 H 9.202 0.590 -4.840 1.00 . A A . 539 ILE HG21 1 1 16 10915 1 1 42 ILE HG22 H 8.034 1.284 -5.970 1.00 . A A . 539 ILE HG22 1 1 16 10916 1 1 42 ILE HG23 H 9.751 1.652 -6.135 1.00 . A A . 539 ILE HG23 1 1 16 10917 1 1 42 ILE N N 10.727 1.600 -3.357 1.00 . A A . 539 ILE N 1 1 16 10918 1 1 42 ILE O O 9.967 4.850 -2.302 1.00 . A A . 539 ILE O 1 1 16 10919 1 1 43 CYS C C 10.119 4.245 0.485 1.00 . A A . 540 CYS C 1 1 16 10920 1 1 43 CYS CA C 8.929 3.490 -0.105 1.00 . A A . 540 CYS CA 1 1 16 10921 1 1 43 CYS CB C 8.517 2.361 0.843 1.00 . A A . 540 CYS CB 1 1 16 10922 1 1 43 CYS H H 9.080 1.954 -1.544 1.00 . A A . 540 CYS H 1 1 16 10923 1 1 43 CYS HA H 8.096 4.162 -0.237 1.00 . A A . 540 CYS HA 1 1 16 10924 1 1 43 CYS HB2 H 7.915 1.649 0.299 1.00 . A A . 540 CYS HB2 1 1 16 10925 1 1 43 CYS HB3 H 9.408 1.866 1.204 1.00 . A A . 540 CYS HB3 1 1 16 10926 1 1 43 CYS N N 9.277 2.913 -1.388 1.00 . A A . 540 CYS N 1 1 16 10927 1 1 43 CYS O O 11.193 3.681 0.714 1.00 . A A . 540 CYS O 1 1 16 10928 1 1 43 CYS SG S 7.559 2.899 2.287 1.00 . A A . 540 CYS SG 1 1 16 10929 1 1 44 GLY C C 11.227 7.559 0.329 1.00 . A A . 541 GLY C 1 1 16 10930 1 1 44 GLY CA C 10.969 6.368 1.222 1.00 . A A . 541 GLY CA 1 1 16 10931 1 1 44 GLY H H 9.005 5.890 0.582 1.00 . A A . 541 GLY H 1 1 16 10932 1 1 44 GLY HA2 H 10.701 6.720 2.208 1.00 . A A . 541 GLY HA2 1 1 16 10933 1 1 44 GLY HA3 H 11.875 5.783 1.293 1.00 . A A . 541 GLY HA3 1 1 16 10934 1 1 44 GLY N N 9.907 5.525 0.721 1.00 . A A . 541 GLY N 1 1 16 10935 1 1 44 GLY O O 12.025 8.432 0.667 1.00 . A A . 541 GLY O 1 1 16 10936 1 1 45 GLN C C 9.739 9.858 -1.219 1.00 . A A . 542 GLN C 1 1 16 10937 1 1 45 GLN CA C 10.642 8.742 -1.722 1.00 . A A . 542 GLN CA 1 1 16 10938 1 1 45 GLN CB C 10.239 8.334 -3.142 1.00 . A A . 542 GLN CB 1 1 16 10939 1 1 45 GLN CD C 10.653 6.749 -5.079 1.00 . A A . 542 GLN CD 1 1 16 10940 1 1 45 GLN CG C 11.179 7.318 -3.773 1.00 . A A . 542 GLN CG 1 1 16 10941 1 1 45 GLN H H 10.015 6.835 -1.087 1.00 . A A . 542 GLN H 1 1 16 10942 1 1 45 GLN HA H 11.663 9.093 -1.730 1.00 . A A . 542 GLN HA 1 1 16 10943 1 1 45 GLN HB2 H 9.247 7.907 -3.113 1.00 . A A . 542 GLN HB2 1 1 16 10944 1 1 45 GLN HB3 H 10.222 9.215 -3.768 1.00 . A A . 542 GLN HB3 1 1 16 10945 1 1 45 GLN HE21 H 8.779 6.966 -4.453 1.00 . A A . 542 GLN HE21 1 1 16 10946 1 1 45 GLN HE22 H 8.966 6.277 -6.033 1.00 . A A . 542 GLN HE22 1 1 16 10947 1 1 45 GLN HG2 H 12.128 7.795 -3.962 1.00 . A A . 542 GLN HG2 1 1 16 10948 1 1 45 GLN HG3 H 11.321 6.505 -3.077 1.00 . A A . 542 GLN HG3 1 1 16 10949 1 1 45 GLN N N 10.563 7.596 -0.825 1.00 . A A . 542 GLN N 1 1 16 10950 1 1 45 GLN NE2 N 9.337 6.658 -5.200 1.00 . A A . 542 GLN NE2 1 1 16 10951 1 1 45 GLN O O 8.721 9.593 -0.569 1.00 . A A . 542 GLN O 1 1 16 10952 1 1 45 GLN OE1 O 11.424 6.388 -5.972 1.00 . A A . 542 GLN OE1 1 1 16 10953 1 1 46 SER C C 9.393 12.350 0.472 1.00 . A A . 543 SER C 1 1 16 10954 1 1 46 SER CA C 9.400 12.277 -1.053 1.00 . A A . 543 SER CA 1 1 16 10955 1 1 46 SER CB C 7.973 12.284 -1.611 1.00 . A A . 543 SER CB 1 1 16 10956 1 1 46 SER H H 10.930 11.223 -2.066 1.00 . A A . 543 SER H 1 1 16 10957 1 1 46 SER HA H 9.923 13.144 -1.432 1.00 . A A . 543 SER HA 1 1 16 10958 1 1 46 SER HB2 H 7.472 11.371 -1.324 1.00 . A A . 543 SER HB2 1 1 16 10959 1 1 46 SER HB3 H 7.435 13.132 -1.212 1.00 . A A . 543 SER HB3 1 1 16 10960 1 1 46 SER HG H 8.503 13.154 -3.289 1.00 . A A . 543 SER HG 1 1 16 10961 1 1 46 SER N N 10.125 11.097 -1.511 1.00 . A A . 543 SER N 1 1 16 10962 1 1 46 SER O O 8.368 12.627 1.097 1.00 . A A . 543 SER O 1 1 16 10963 1 1 46 SER OG O 7.989 12.374 -3.029 1.00 . A A . 543 SER OG 1 1 16 10964 1 1 47 ALA C C 12.168 12.519 2.820 1.00 . A A . 544 ALA C 1 1 16 10965 1 1 47 ALA CA C 10.729 12.145 2.499 1.00 . A A . 544 ALA CA 1 1 16 10966 1 1 47 ALA CB C 10.360 10.817 3.146 1.00 . A A . 544 ALA CB 1 1 16 10967 1 1 47 ALA H H 11.323 11.826 0.501 1.00 . A A . 544 ALA H 1 1 16 10968 1 1 47 ALA HA H 10.071 12.909 2.887 1.00 . A A . 544 ALA HA 1 1 16 10969 1 1 47 ALA HB1 H 10.995 10.036 2.753 1.00 . A A . 544 ALA HB1 1 1 16 10970 1 1 47 ALA HB2 H 10.497 10.887 4.216 1.00 . A A . 544 ALA HB2 1 1 16 10971 1 1 47 ALA HB3 H 9.328 10.586 2.930 1.00 . A A . 544 ALA HB3 1 1 16 10972 1 1 47 ALA N N 10.553 12.080 1.059 1.00 . A A . 544 ALA N 1 1 16 10973 1 1 47 ALA O O 13.032 11.619 2.823 1.00 . A A . 544 ALA O 1 1 16 10974 1 1 47 ALA OXT O 12.438 13.719 3.031 1.00 . A A . 544 ALA OXT 1 1 16 10975 2 2 1 ZN ZN ZN -5.685 -5.801 -0.852 1.00 . B A . 601 ZN ZN 1 1 16 10976 3 2 1 ZN ZN ZN 5.331 2.904 1.736 1.00 . C A . 602 ZN ZN 1 1 17 10977 1 1 1 GLY C C -13.577 3.864 4.178 1.00 . A A . 498 GLY C 1 1 17 10978 1 1 1 GLY CA C -14.054 5.180 4.758 1.00 . A A . 498 GLY CA 1 1 17 10979 1 1 1 GLY H1 H -15.654 6.511 4.618 1.00 . A A . 498 GLY H1 1 1 17 10980 1 1 1 GLY H2 H -16.070 4.895 4.312 1.00 . A A . 498 GLY H2 1 1 17 10981 1 1 1 GLY H3 H -15.225 5.788 3.143 1.00 . A A . 498 GLY H3 1 1 17 10982 1 1 1 GLY HA2 H -13.303 5.934 4.573 1.00 . A A . 498 GLY HA2 1 1 17 10983 1 1 1 GLY HA3 H -14.178 5.065 5.825 1.00 . A A . 498 GLY HA3 1 1 17 10984 1 1 1 GLY N N -15.339 5.624 4.170 1.00 . A A . 498 GLY N 1 1 17 10985 1 1 1 GLY O O -12.911 3.085 4.859 1.00 . A A . 498 GLY O 1 1 17 10986 1 1 2 ALA C C -13.312 2.576 0.773 1.00 . A A . 499 ALA C 1 1 17 10987 1 1 2 ALA CA C -13.517 2.371 2.269 1.00 . A A . 499 ALA CA 1 1 17 10988 1 1 2 ALA CB C -14.563 1.295 2.525 1.00 . A A . 499 ALA CB 1 1 17 10989 1 1 2 ALA H H -14.395 4.297 2.399 1.00 . A A . 499 ALA H 1 1 17 10990 1 1 2 ALA HA H -12.586 2.045 2.707 1.00 . A A . 499 ALA HA 1 1 17 10991 1 1 2 ALA HB1 H -15.499 1.583 2.070 1.00 . A A . 499 ALA HB1 1 1 17 10992 1 1 2 ALA HB2 H -14.228 0.360 2.100 1.00 . A A . 499 ALA HB2 1 1 17 10993 1 1 2 ALA HB3 H -14.705 1.176 3.590 1.00 . A A . 499 ALA HB3 1 1 17 10994 1 1 2 ALA N N -13.902 3.616 2.917 1.00 . A A . 499 ALA N 1 1 17 10995 1 1 2 ALA O O -12.182 2.632 0.296 1.00 . A A . 499 ALA O 1 1 17 10996 1 1 3 MET C C -13.882 4.221 -1.881 1.00 . A A . 500 MET C 1 1 17 10997 1 1 3 MET CA C -14.348 2.838 -1.422 1.00 . A A . 500 MET CA 1 1 17 10998 1 1 3 MET CB C -15.705 2.504 -2.048 1.00 . A A . 500 MET CB 1 1 17 10999 1 1 3 MET CE C -18.741 1.524 -1.862 1.00 . A A . 500 MET CE 1 1 17 11000 1 1 3 MET CG C -16.799 3.509 -1.727 1.00 . A A . 500 MET CG 1 1 17 11001 1 1 3 MET H H -15.278 2.811 0.487 1.00 . A A . 500 MET H 1 1 17 11002 1 1 3 MET HA H -13.626 2.108 -1.759 1.00 . A A . 500 MET HA 1 1 17 11003 1 1 3 MET HB2 H -15.592 2.460 -3.120 1.00 . A A . 500 MET HB2 1 1 17 11004 1 1 3 MET HB3 H -16.021 1.536 -1.688 1.00 . A A . 500 MET HB3 1 1 17 11005 1 1 3 MET HE1 H -18.861 1.619 -0.793 1.00 . A A . 500 MET HE1 1 1 17 11006 1 1 3 MET HE2 H -19.658 1.153 -2.296 1.00 . A A . 500 MET HE2 1 1 17 11007 1 1 3 MET HE3 H -17.938 0.833 -2.073 1.00 . A A . 500 MET HE3 1 1 17 11008 1 1 3 MET HG2 H -16.969 3.506 -0.662 1.00 . A A . 500 MET HG2 1 1 17 11009 1 1 3 MET HG3 H -16.471 4.493 -2.035 1.00 . A A . 500 MET HG3 1 1 17 11010 1 1 3 MET N N -14.410 2.747 0.039 1.00 . A A . 500 MET N 1 1 17 11011 1 1 3 MET O O -13.961 4.556 -3.064 1.00 . A A . 500 MET O 1 1 17 11012 1 1 3 MET SD S -18.351 3.127 -2.564 1.00 . A A . 500 MET SD 1 1 17 11013 1 1 4 GLU C C -11.364 6.131 -1.666 1.00 . A A . 501 GLU C 1 1 17 11014 1 1 4 GLU CA C -12.821 6.316 -1.250 1.00 . A A . 501 GLU CA 1 1 17 11015 1 1 4 GLU CB C -12.908 7.254 -0.041 1.00 . A A . 501 GLU CB 1 1 17 11016 1 1 4 GLU CD C -15.241 6.572 0.711 1.00 . A A . 501 GLU CD 1 1 17 11017 1 1 4 GLU CG C -14.323 7.710 0.307 1.00 . A A . 501 GLU CG 1 1 17 11018 1 1 4 GLU H H -13.455 4.734 -0.002 1.00 . A A . 501 GLU H 1 1 17 11019 1 1 4 GLU HA H -13.374 6.745 -2.074 1.00 . A A . 501 GLU HA 1 1 17 11020 1 1 4 GLU HB2 H -12.498 6.744 0.817 1.00 . A A . 501 GLU HB2 1 1 17 11021 1 1 4 GLU HB3 H -12.310 8.131 -0.244 1.00 . A A . 501 GLU HB3 1 1 17 11022 1 1 4 GLU HG2 H -14.267 8.408 1.127 1.00 . A A . 501 GLU HG2 1 1 17 11023 1 1 4 GLU HG3 H -14.747 8.205 -0.554 1.00 . A A . 501 GLU HG3 1 1 17 11024 1 1 4 GLU N N -13.406 5.021 -0.938 1.00 . A A . 501 GLU N 1 1 17 11025 1 1 4 GLU O O -10.731 7.036 -2.210 1.00 . A A . 501 GLU O 1 1 17 11026 1 1 4 GLU OE1 O -14.861 5.778 1.600 1.00 . A A . 501 GLU OE1 1 1 17 11027 1 1 4 GLU OE2 O -16.345 6.462 0.142 1.00 . A A . 501 GLU OE2 1 1 17 11028 1 1 5 GLN C C -9.466 3.211 -2.437 1.00 . A A . 502 GLN C 1 1 17 11029 1 1 5 GLN CA C -9.485 4.580 -1.761 1.00 . A A . 502 GLN CA 1 1 17 11030 1 1 5 GLN CB C -8.604 4.591 -0.508 1.00 . A A . 502 GLN CB 1 1 17 11031 1 1 5 GLN CD C -8.393 3.997 1.928 1.00 . A A . 502 GLN CD 1 1 17 11032 1 1 5 GLN CG C -9.166 3.782 0.646 1.00 . A A . 502 GLN CG 1 1 17 11033 1 1 5 GLN H H -11.429 4.244 -1.019 1.00 . A A . 502 GLN H 1 1 17 11034 1 1 5 GLN HA H -9.119 5.320 -2.456 1.00 . A A . 502 GLN HA 1 1 17 11035 1 1 5 GLN HB2 H -7.634 4.190 -0.759 1.00 . A A . 502 GLN HB2 1 1 17 11036 1 1 5 GLN HB3 H -8.483 5.613 -0.175 1.00 . A A . 502 GLN HB3 1 1 17 11037 1 1 5 GLN HE21 H -9.549 5.551 2.364 1.00 . A A . 502 GLN HE21 1 1 17 11038 1 1 5 GLN HE22 H -8.320 5.172 3.522 1.00 . A A . 502 GLN HE22 1 1 17 11039 1 1 5 GLN HG2 H -10.193 4.074 0.809 1.00 . A A . 502 GLN HG2 1 1 17 11040 1 1 5 GLN HG3 H -9.124 2.736 0.389 1.00 . A A . 502 GLN HG3 1 1 17 11041 1 1 5 GLN N N -10.854 4.932 -1.423 1.00 . A A . 502 GLN N 1 1 17 11042 1 1 5 GLN NE2 N -8.791 5.008 2.680 1.00 . A A . 502 GLN NE2 1 1 17 11043 1 1 5 GLN O O -10.458 2.487 -2.399 1.00 . A A . 502 GLN O 1 1 17 11044 1 1 5 GLN OE1 O -7.442 3.277 2.230 1.00 . A A . 502 GLN OE1 1 1 17 11045 1 1 6 SER C C -7.021 0.826 -3.384 1.00 . A A . 503 SER C 1 1 17 11046 1 1 6 SER CA C -8.273 1.598 -3.784 1.00 . A A . 503 SER CA 1 1 17 11047 1 1 6 SER CB C -8.281 1.843 -5.298 1.00 . A A . 503 SER CB 1 1 17 11048 1 1 6 SER H H -7.593 3.475 -3.080 1.00 . A A . 503 SER H 1 1 17 11049 1 1 6 SER HA H -9.139 1.011 -3.521 1.00 . A A . 503 SER HA 1 1 17 11050 1 1 6 SER HB2 H -8.134 0.906 -5.811 1.00 . A A . 503 SER HB2 1 1 17 11051 1 1 6 SER HB3 H -9.233 2.263 -5.586 1.00 . A A . 503 SER HB3 1 1 17 11052 1 1 6 SER HG H -7.412 3.611 -5.287 1.00 . A A . 503 SER HG 1 1 17 11053 1 1 6 SER N N -8.362 2.867 -3.077 1.00 . A A . 503 SER N 1 1 17 11054 1 1 6 SER O O -5.911 1.336 -3.500 1.00 . A A . 503 SER O 1 1 17 11055 1 1 6 SER OG O -7.250 2.741 -5.685 1.00 . A A . 503 SER OG 1 1 17 11056 1 1 7 CYS C C -5.270 -1.448 -3.896 1.00 . A A . 504 CYS C 1 1 17 11057 1 1 7 CYS CA C -6.050 -1.245 -2.619 1.00 . A A . 504 CYS CA 1 1 17 11058 1 1 7 CYS CB C -6.467 -2.605 -2.053 1.00 . A A . 504 CYS CB 1 1 17 11059 1 1 7 CYS H H -8.109 -0.751 -2.771 1.00 . A A . 504 CYS H 1 1 17 11060 1 1 7 CYS HA H -5.427 -0.742 -1.893 1.00 . A A . 504 CYS HA 1 1 17 11061 1 1 7 CYS HB2 H -7.060 -2.455 -1.162 1.00 . A A . 504 CYS HB2 1 1 17 11062 1 1 7 CYS HB3 H -7.053 -3.132 -2.788 1.00 . A A . 504 CYS HB3 1 1 17 11063 1 1 7 CYS N N -7.193 -0.402 -2.913 1.00 . A A . 504 CYS N 1 1 17 11064 1 1 7 CYS O O -5.815 -1.920 -4.896 1.00 . A A . 504 CYS O 1 1 17 11065 1 1 7 CYS SG S -5.047 -3.665 -1.609 1.00 . A A . 504 CYS SG 1 1 17 11066 1 1 8 VAL C C -2.965 -2.619 -5.457 1.00 . A A . 505 VAL C 1 1 17 11067 1 1 8 VAL CA C -3.152 -1.162 -5.030 1.00 . A A . 505 VAL CA 1 1 17 11068 1 1 8 VAL CB C -1.785 -0.485 -4.768 1.00 . A A . 505 VAL CB 1 1 17 11069 1 1 8 VAL CG1 C -0.941 -1.297 -3.801 1.00 . A A . 505 VAL CG1 1 1 17 11070 1 1 8 VAL CG2 C -1.044 -0.227 -6.071 1.00 . A A . 505 VAL CG2 1 1 17 11071 1 1 8 VAL H H -3.638 -0.708 -3.026 1.00 . A A . 505 VAL H 1 1 17 11072 1 1 8 VAL HA H -3.643 -0.627 -5.831 1.00 . A A . 505 VAL HA 1 1 17 11073 1 1 8 VAL HB H -1.977 0.472 -4.307 1.00 . A A . 505 VAL HB 1 1 17 11074 1 1 8 VAL HG11 H -0.768 -2.283 -4.209 1.00 . A A . 505 VAL HG11 1 1 17 11075 1 1 8 VAL HG12 H 0.007 -0.801 -3.647 1.00 . A A . 505 VAL HG12 1 1 17 11076 1 1 8 VAL HG13 H -1.460 -1.383 -2.859 1.00 . A A . 505 VAL HG13 1 1 17 11077 1 1 8 VAL HG21 H -1.643 0.412 -6.702 1.00 . A A . 505 VAL HG21 1 1 17 11078 1 1 8 VAL HG22 H -0.102 0.258 -5.859 1.00 . A A . 505 VAL HG22 1 1 17 11079 1 1 8 VAL HG23 H -0.861 -1.165 -6.576 1.00 . A A . 505 VAL HG23 1 1 17 11080 1 1 8 VAL N N -4.004 -1.075 -3.860 1.00 . A A . 505 VAL N 1 1 17 11081 1 1 8 VAL O O -2.544 -2.901 -6.579 1.00 . A A . 505 VAL O 1 1 17 11082 1 1 9 ASN C C -4.526 -5.541 -5.307 1.00 . A A . 506 ASN C 1 1 17 11083 1 1 9 ASN CA C -3.187 -4.964 -4.861 1.00 . A A . 506 ASN CA 1 1 17 11084 1 1 9 ASN CB C -2.673 -5.720 -3.631 1.00 . A A . 506 ASN CB 1 1 17 11085 1 1 9 ASN CG C -2.513 -7.214 -3.871 1.00 . A A . 506 ASN CG 1 1 17 11086 1 1 9 ASN H H -3.599 -3.279 -3.663 1.00 . A A . 506 ASN H 1 1 17 11087 1 1 9 ASN HA H -2.475 -5.079 -5.663 1.00 . A A . 506 ASN HA 1 1 17 11088 1 1 9 ASN HB2 H -1.712 -5.317 -3.348 1.00 . A A . 506 ASN HB2 1 1 17 11089 1 1 9 ASN HB3 H -3.367 -5.577 -2.817 1.00 . A A . 506 ASN HB3 1 1 17 11090 1 1 9 ASN HD21 H -4.331 -7.569 -3.137 1.00 . A A . 506 ASN HD21 1 1 17 11091 1 1 9 ASN HD22 H -3.439 -8.957 -3.663 1.00 . A A . 506 ASN HD22 1 1 17 11092 1 1 9 ASN N N -3.298 -3.546 -4.562 1.00 . A A . 506 ASN N 1 1 17 11093 1 1 9 ASN ND2 N -3.528 -7.992 -3.525 1.00 . A A . 506 ASN ND2 1 1 17 11094 1 1 9 ASN O O -4.575 -6.428 -6.161 1.00 . A A . 506 ASN O 1 1 17 11095 1 1 9 ASN OD1 O -1.474 -7.667 -4.349 1.00 . A A . 506 ASN OD1 1 1 17 11096 1 1 10 CYS C C -7.889 -4.577 -5.618 1.00 . A A . 507 CYS C 1 1 17 11097 1 1 10 CYS CA C -6.924 -5.600 -5.009 1.00 . A A . 507 CYS CA 1 1 17 11098 1 1 10 CYS CB C -7.486 -6.180 -3.714 1.00 . A A . 507 CYS CB 1 1 17 11099 1 1 10 CYS H H -5.536 -4.238 -4.168 1.00 . A A . 507 CYS H 1 1 17 11100 1 1 10 CYS HA H -6.791 -6.406 -5.716 1.00 . A A . 507 CYS HA 1 1 17 11101 1 1 10 CYS HB2 H -7.904 -5.380 -3.120 1.00 . A A . 507 CYS HB2 1 1 17 11102 1 1 10 CYS HB3 H -8.264 -6.889 -3.951 1.00 . A A . 507 CYS HB3 1 1 17 11103 1 1 10 CYS N N -5.615 -5.022 -4.754 1.00 . A A . 507 CYS N 1 1 17 11104 1 1 10 CYS O O -8.068 -4.545 -6.836 1.00 . A A . 507 CYS O 1 1 17 11105 1 1 10 CYS SG S -6.240 -7.036 -2.692 1.00 . A A . 507 CYS SG 1 1 17 11106 1 1 11 GLY C C -9.981 -1.809 -4.244 1.00 . A A . 508 GLY C 1 1 17 11107 1 1 11 GLY CA C -9.474 -2.784 -5.297 1.00 . A A . 508 GLY CA 1 1 17 11108 1 1 11 GLY H H -8.299 -3.772 -3.824 1.00 . A A . 508 GLY H 1 1 17 11109 1 1 11 GLY HA2 H -9.014 -2.220 -6.097 1.00 . A A . 508 GLY HA2 1 1 17 11110 1 1 11 GLY HA3 H -10.315 -3.330 -5.697 1.00 . A A . 508 GLY HA3 1 1 17 11111 1 1 11 GLY N N -8.503 -3.740 -4.785 1.00 . A A . 508 GLY N 1 1 17 11112 1 1 11 GLY O O -9.409 -1.704 -3.165 1.00 . A A . 508 GLY O 1 1 17 11113 1 1 12 ARG C C -12.030 -0.556 -2.302 1.00 . A A . 509 ARG C 1 1 17 11114 1 1 12 ARG CA C -11.651 -0.058 -3.700 1.00 . A A . 509 ARG CA 1 1 17 11115 1 1 12 ARG CB C -12.881 0.563 -4.366 1.00 . A A . 509 ARG CB 1 1 17 11116 1 1 12 ARG CD C -11.751 1.349 -6.484 1.00 . A A . 509 ARG CD 1 1 17 11117 1 1 12 ARG CG C -12.562 1.749 -5.264 1.00 . A A . 509 ARG CG 1 1 17 11118 1 1 12 ARG CZ C -10.826 2.421 -8.509 1.00 . A A . 509 ARG CZ 1 1 17 11119 1 1 12 ARG H H -11.467 -1.235 -5.455 1.00 . A A . 509 ARG H 1 1 17 11120 1 1 12 ARG HA H -10.909 0.717 -3.585 1.00 . A A . 509 ARG HA 1 1 17 11121 1 1 12 ARG HB2 H -13.369 -0.190 -4.964 1.00 . A A . 509 ARG HB2 1 1 17 11122 1 1 12 ARG HB3 H -13.559 0.896 -3.595 1.00 . A A . 509 ARG HB3 1 1 17 11123 1 1 12 ARG HD2 H -10.832 0.888 -6.152 1.00 . A A . 509 ARG HD2 1 1 17 11124 1 1 12 ARG HD3 H -12.320 0.637 -7.064 1.00 . A A . 509 ARG HD3 1 1 17 11125 1 1 12 ARG HE H -11.689 3.396 -6.981 1.00 . A A . 509 ARG HE 1 1 17 11126 1 1 12 ARG HG2 H -13.488 2.194 -5.594 1.00 . A A . 509 ARG HG2 1 1 17 11127 1 1 12 ARG HG3 H -11.999 2.473 -4.693 1.00 . A A . 509 ARG HG3 1 1 17 11128 1 1 12 ARG HH11 H -10.635 0.398 -8.474 1.00 . A A . 509 ARG HH11 1 1 17 11129 1 1 12 ARG HH12 H -10.001 1.186 -9.894 1.00 . A A . 509 ARG HH12 1 1 17 11130 1 1 12 ARG HH21 H -10.861 4.418 -8.841 1.00 . A A . 509 ARG HH21 1 1 17 11131 1 1 12 ARG HH22 H -10.131 3.472 -10.103 1.00 . A A . 509 ARG HH22 1 1 17 11132 1 1 12 ARG N N -11.061 -1.094 -4.573 1.00 . A A . 509 ARG N 1 1 17 11133 1 1 12 ARG NE N -11.431 2.502 -7.324 1.00 . A A . 509 ARG NE 1 1 17 11134 1 1 12 ARG NH1 N -10.459 1.243 -8.998 1.00 . A A . 509 ARG NH1 1 1 17 11135 1 1 12 ARG NH2 N -10.586 3.525 -9.205 1.00 . A A . 509 ARG NH2 1 1 17 11136 1 1 12 ARG O O -12.421 0.232 -1.448 1.00 . A A . 509 ARG O 1 1 17 11137 1 1 13 GLU C C -11.128 -2.041 0.247 1.00 . A A . 510 GLU C 1 1 17 11138 1 1 13 GLU CA C -12.215 -2.434 -0.768 1.00 . A A . 510 GLU CA 1 1 17 11139 1 1 13 GLU CB C -12.354 -3.952 -0.859 1.00 . A A . 510 GLU CB 1 1 17 11140 1 1 13 GLU CD C -13.275 -6.058 0.183 1.00 . A A . 510 GLU CD 1 1 17 11141 1 1 13 GLU CG C -13.116 -4.562 0.307 1.00 . A A . 510 GLU CG 1 1 17 11142 1 1 13 GLU H H -11.716 -2.444 -2.829 1.00 . A A . 510 GLU H 1 1 17 11143 1 1 13 GLU HA H -13.148 -2.022 -0.430 1.00 . A A . 510 GLU HA 1 1 17 11144 1 1 13 GLU HB2 H -12.875 -4.200 -1.773 1.00 . A A . 510 GLU HB2 1 1 17 11145 1 1 13 GLU HB3 H -11.369 -4.393 -0.886 1.00 . A A . 510 GLU HB3 1 1 17 11146 1 1 13 GLU HG2 H -12.584 -4.345 1.221 1.00 . A A . 510 GLU HG2 1 1 17 11147 1 1 13 GLU HG3 H -14.099 -4.114 0.351 1.00 . A A . 510 GLU HG3 1 1 17 11148 1 1 13 GLU N N -11.951 -1.856 -2.084 1.00 . A A . 510 GLU N 1 1 17 11149 1 1 13 GLU O O -11.149 -2.486 1.397 1.00 . A A . 510 GLU O 1 1 17 11150 1 1 13 GLU OE1 O -13.993 -6.509 -0.732 1.00 . A A . 510 GLU OE1 1 1 17 11151 1 1 13 GLU OE2 O -12.677 -6.789 1.000 1.00 . A A . 510 GLU OE2 1 1 17 11152 1 1 14 ALA C C -9.514 -0.198 1.949 1.00 . A A . 511 ALA C 1 1 17 11153 1 1 14 ALA CA C -9.054 -0.759 0.606 1.00 . A A . 511 ALA CA 1 1 17 11154 1 1 14 ALA CB C -8.288 0.312 -0.145 1.00 . A A . 511 ALA CB 1 1 17 11155 1 1 14 ALA H H -10.197 -0.978 -1.156 1.00 . A A . 511 ALA H 1 1 17 11156 1 1 14 ALA HA H -8.379 -1.582 0.785 1.00 . A A . 511 ALA HA 1 1 17 11157 1 1 14 ALA HB1 H -8.951 1.130 -0.380 1.00 . A A . 511 ALA HB1 1 1 17 11158 1 1 14 ALA HB2 H -7.474 0.671 0.469 1.00 . A A . 511 ALA HB2 1 1 17 11159 1 1 14 ALA HB3 H -7.892 -0.102 -1.060 1.00 . A A . 511 ALA HB3 1 1 17 11160 1 1 14 ALA N N -10.158 -1.252 -0.218 1.00 . A A . 511 ALA N 1 1 17 11161 1 1 14 ALA O O -10.647 0.265 2.105 1.00 . A A . 511 ALA O 1 1 17 11162 1 1 15 MET C C -7.638 0.592 5.038 1.00 . A A . 512 MET C 1 1 17 11163 1 1 15 MET CA C -8.903 0.220 4.261 1.00 . A A . 512 MET CA 1 1 17 11164 1 1 15 MET CB C -9.668 -0.876 5.012 1.00 . A A . 512 MET CB 1 1 17 11165 1 1 15 MET CE C -11.076 -1.051 8.930 1.00 . A A . 512 MET CE 1 1 17 11166 1 1 15 MET CG C -10.009 -0.504 6.445 1.00 . A A . 512 MET CG 1 1 17 11167 1 1 15 MET H H -7.700 -0.524 2.687 1.00 . A A . 512 MET H 1 1 17 11168 1 1 15 MET HA H -9.533 1.094 4.190 1.00 . A A . 512 MET HA 1 1 17 11169 1 1 15 MET HB2 H -10.589 -1.081 4.487 1.00 . A A . 512 MET HB2 1 1 17 11170 1 1 15 MET HB3 H -9.065 -1.773 5.029 1.00 . A A . 512 MET HB3 1 1 17 11171 1 1 15 MET HE1 H -11.590 -0.105 8.859 1.00 . A A . 512 MET HE1 1 1 17 11172 1 1 15 MET HE2 H -11.630 -1.716 9.580 1.00 . A A . 512 MET HE2 1 1 17 11173 1 1 15 MET HE3 H -10.087 -0.896 9.334 1.00 . A A . 512 MET HE3 1 1 17 11174 1 1 15 MET HG2 H -9.089 -0.331 6.983 1.00 . A A . 512 MET HG2 1 1 17 11175 1 1 15 MET HG3 H -10.593 0.405 6.434 1.00 . A A . 512 MET HG3 1 1 17 11176 1 1 15 MET N N -8.602 -0.220 2.906 1.00 . A A . 512 MET N 1 1 17 11177 1 1 15 MET O O -7.692 1.394 5.970 1.00 . A A . 512 MET O 1 1 17 11178 1 1 15 MET SD S -10.945 -1.783 7.299 1.00 . A A . 512 MET SD 1 1 17 11179 1 1 16 SER C C -4.189 0.876 4.574 1.00 . A A . 513 SER C 1 1 17 11180 1 1 16 SER CA C -5.281 0.243 5.429 1.00 . A A . 513 SER CA 1 1 17 11181 1 1 16 SER CB C -4.805 -1.073 6.055 1.00 . A A . 513 SER CB 1 1 17 11182 1 1 16 SER H H -6.453 -0.465 3.818 1.00 . A A . 513 SER H 1 1 17 11183 1 1 16 SER HA H -5.535 0.947 6.206 1.00 . A A . 513 SER HA 1 1 17 11184 1 1 16 SER HB2 H -5.612 -1.512 6.621 1.00 . A A . 513 SER HB2 1 1 17 11185 1 1 16 SER HB3 H -4.507 -1.753 5.270 1.00 . A A . 513 SER HB3 1 1 17 11186 1 1 16 SER HG H -3.321 -1.725 7.173 1.00 . A A . 513 SER HG 1 1 17 11187 1 1 16 SER N N -6.494 0.037 4.654 1.00 . A A . 513 SER N 1 1 17 11188 1 1 16 SER O O -4.184 0.753 3.351 1.00 . A A . 513 SER O 1 1 17 11189 1 1 16 SER OG O -3.702 -0.867 6.921 1.00 . A A . 513 SER OG 1 1 17 11190 1 1 17 GLU C C -0.856 1.876 5.027 1.00 . A A . 514 GLU C 1 1 17 11191 1 1 17 GLU CA C -2.240 2.332 4.573 1.00 . A A . 514 GLU CA 1 1 17 11192 1 1 17 GLU CB C -2.449 3.818 4.885 1.00 . A A . 514 GLU CB 1 1 17 11193 1 1 17 GLU CD C -3.349 5.467 6.564 1.00 . A A . 514 GLU CD 1 1 17 11194 1 1 17 GLU CG C -2.700 4.113 6.354 1.00 . A A . 514 GLU CG 1 1 17 11195 1 1 17 GLU H H -3.286 1.535 6.216 1.00 . A A . 514 GLU H 1 1 17 11196 1 1 17 GLU HA H -2.344 2.199 3.505 1.00 . A A . 514 GLU HA 1 1 17 11197 1 1 17 GLU HB2 H -1.571 4.367 4.577 1.00 . A A . 514 GLU HB2 1 1 17 11198 1 1 17 GLU HB3 H -3.298 4.175 4.321 1.00 . A A . 514 GLU HB3 1 1 17 11199 1 1 17 GLU HG2 H -3.351 3.351 6.756 1.00 . A A . 514 GLU HG2 1 1 17 11200 1 1 17 GLU HG3 H -1.756 4.095 6.880 1.00 . A A . 514 GLU HG3 1 1 17 11201 1 1 17 GLU N N -3.277 1.562 5.236 1.00 . A A . 514 GLU N 1 1 17 11202 1 1 17 GLU O O -0.712 1.278 6.097 1.00 . A A . 514 GLU O 1 1 17 11203 1 1 17 GLU OE1 O -2.624 6.471 6.697 1.00 . A A . 514 GLU OE1 1 1 17 11204 1 1 17 GLU OE2 O -4.596 5.531 6.599 1.00 . A A . 514 GLU OE2 1 1 17 11205 1 1 18 CYS C C 2.097 2.766 5.588 1.00 . A A . 515 CYS C 1 1 17 11206 1 1 18 CYS CA C 1.529 1.811 4.542 1.00 . A A . 515 CYS CA 1 1 17 11207 1 1 18 CYS CB C 2.412 1.830 3.281 1.00 . A A . 515 CYS CB 1 1 17 11208 1 1 18 CYS H H -0.029 2.634 3.381 1.00 . A A . 515 CYS H 1 1 17 11209 1 1 18 CYS HA H 1.556 0.827 4.998 1.00 . A A . 515 CYS HA 1 1 17 11210 1 1 18 CYS HB2 H 2.357 0.866 2.798 1.00 . A A . 515 CYS HB2 1 1 17 11211 1 1 18 CYS HB3 H 2.043 2.588 2.604 1.00 . A A . 515 CYS HB3 1 1 17 11212 1 1 18 CYS N N 0.152 2.158 4.216 1.00 . A A . 515 CYS N 1 1 17 11213 1 1 18 CYS O O 1.974 3.987 5.475 1.00 . A A . 515 CYS O 1 1 17 11214 1 1 18 CYS SG S 4.175 2.186 3.611 1.00 . A A . 515 CYS SG 1 1 17 11215 1 1 19 THR C C 4.887 3.053 6.933 1.00 . A A . 516 THR C 1 1 17 11216 1 1 19 THR CA C 3.506 2.922 7.566 1.00 . A A . 516 THR CA 1 1 17 11217 1 1 19 THR CB C 3.624 2.205 8.925 1.00 . A A . 516 THR CB 1 1 17 11218 1 1 19 THR CG2 C 4.325 3.087 9.946 1.00 . A A . 516 THR CG2 1 1 17 11219 1 1 19 THR H H 2.480 1.252 6.843 1.00 . A A . 516 THR H 1 1 17 11220 1 1 19 THR HA H 3.083 3.904 7.720 1.00 . A A . 516 THR HA 1 1 17 11221 1 1 19 THR HB H 4.203 1.302 8.792 1.00 . A A . 516 THR HB 1 1 17 11222 1 1 19 THR HG1 H 1.645 2.269 8.839 1.00 . A A . 516 THR HG1 1 1 17 11223 1 1 19 THR HG21 H 3.772 4.006 10.066 1.00 . A A . 516 THR HG21 1 1 17 11224 1 1 19 THR HG22 H 4.377 2.571 10.891 1.00 . A A . 516 THR HG22 1 1 17 11225 1 1 19 THR HG23 H 5.325 3.311 9.602 1.00 . A A . 516 THR HG23 1 1 17 11226 1 1 19 THR N N 2.652 2.190 6.658 1.00 . A A . 516 THR N 1 1 17 11227 1 1 19 THR O O 5.550 2.054 6.646 1.00 . A A . 516 THR O 1 1 17 11228 1 1 19 THR OG1 O 2.317 1.860 9.408 1.00 . A A . 516 THR OG1 1 1 17 11229 1 1 20 GLY C C 6.244 5.529 4.894 1.00 . A A . 517 GLY C 1 1 17 11230 1 1 20 GLY CA C 6.519 4.516 5.965 1.00 . A A . 517 GLY CA 1 1 17 11231 1 1 20 GLY H H 4.830 5.028 7.128 1.00 . A A . 517 GLY H 1 1 17 11232 1 1 20 GLY HA2 H 7.295 4.888 6.621 1.00 . A A . 517 GLY HA2 1 1 17 11233 1 1 20 GLY HA3 H 6.844 3.595 5.508 1.00 . A A . 517 GLY HA3 1 1 17 11234 1 1 20 GLY N N 5.320 4.274 6.731 1.00 . A A . 517 GLY N 1 1 17 11235 1 1 20 GLY O O 6.940 6.540 4.790 1.00 . A A . 517 GLY O 1 1 17 11236 1 1 21 CYS C C 3.191 6.133 3.128 1.00 . A A . 518 CYS C 1 1 17 11237 1 1 21 CYS CA C 4.697 6.273 3.212 1.00 . A A . 518 CYS CA 1 1 17 11238 1 1 21 CYS CB C 5.315 6.137 1.821 1.00 . A A . 518 CYS CB 1 1 17 11239 1 1 21 CYS H H 4.769 4.390 4.155 1.00 . A A . 518 CYS H 1 1 17 11240 1 1 21 CYS HA H 4.940 7.232 3.638 1.00 . A A . 518 CYS HA 1 1 17 11241 1 1 21 CYS HB2 H 5.158 7.056 1.273 1.00 . A A . 518 CYS HB2 1 1 17 11242 1 1 21 CYS HB3 H 6.377 5.960 1.920 1.00 . A A . 518 CYS HB3 1 1 17 11243 1 1 21 CYS N N 5.210 5.272 4.110 1.00 . A A . 518 CYS N 1 1 17 11244 1 1 21 CYS O O 2.662 5.030 3.142 1.00 . A A . 518 CYS O 1 1 17 11245 1 1 21 CYS SG S 4.612 4.773 0.837 1.00 . A A . 518 CYS SG 1 1 17 11246 1 1 22 HIS C C 0.640 7.586 1.519 1.00 . A A . 519 HIS C 1 1 17 11247 1 1 22 HIS CA C 1.057 7.201 2.925 1.00 . A A . 519 HIS CA 1 1 17 11248 1 1 22 HIS CB C 0.416 8.125 3.971 1.00 . A A . 519 HIS CB 1 1 17 11249 1 1 22 HIS CD2 C 1.925 7.793 6.058 1.00 . A A . 519 HIS CD2 1 1 17 11250 1 1 22 HIS CE1 C 0.415 7.048 7.447 1.00 . A A . 519 HIS CE1 1 1 17 11251 1 1 22 HIS CG C 0.748 7.752 5.388 1.00 . A A . 519 HIS CG 1 1 17 11252 1 1 22 HIS H H 2.969 8.098 2.980 1.00 . A A . 519 HIS H 1 1 17 11253 1 1 22 HIS HA H 0.742 6.184 3.113 1.00 . A A . 519 HIS HA 1 1 17 11254 1 1 22 HIS HB2 H 0.756 9.135 3.805 1.00 . A A . 519 HIS HB2 1 1 17 11255 1 1 22 HIS HB3 H -0.659 8.090 3.861 1.00 . A A . 519 HIS HB3 1 1 17 11256 1 1 22 HIS HD1 H -1.142 7.124 6.118 1.00 . A A . 519 HIS HD1 1 1 17 11257 1 1 22 HIS HD2 H 2.879 8.110 5.658 1.00 . A A . 519 HIS HD2 1 1 17 11258 1 1 22 HIS HE1 H -0.064 6.664 8.338 1.00 . A A . 519 HIS HE1 1 1 17 11259 1 1 22 HIS HE2 H 2.325 7.414 8.084 1.00 . A A . 519 HIS HE2 1 1 17 11260 1 1 22 HIS N N 2.500 7.239 3.015 1.00 . A A . 519 HIS N 1 1 17 11261 1 1 22 HIS ND1 N -0.179 7.280 6.293 1.00 . A A . 519 HIS ND1 1 1 17 11262 1 1 22 HIS NE2 N 1.689 7.350 7.331 1.00 . A A . 519 HIS NE2 1 1 17 11263 1 1 22 HIS O O -0.431 8.148 1.300 1.00 . A A . 519 HIS O 1 1 17 11264 1 1 23 LYS C C 0.414 6.577 -1.520 1.00 . A A . 520 LYS C 1 1 17 11265 1 1 23 LYS CA C 1.277 7.629 -0.828 1.00 . A A . 520 LYS CA 1 1 17 11266 1 1 23 LYS CB C 2.623 7.790 -1.558 1.00 . A A . 520 LYS CB 1 1 17 11267 1 1 23 LYS CD C 4.704 6.645 -2.450 1.00 . A A . 520 LYS CD 1 1 17 11268 1 1 23 LYS CE C 4.865 7.729 -3.510 1.00 . A A . 520 LYS CE 1 1 17 11269 1 1 23 LYS CG C 3.255 6.475 -1.999 1.00 . A A . 520 LYS CG 1 1 17 11270 1 1 23 LYS H H 2.316 6.756 0.785 1.00 . A A . 520 LYS H 1 1 17 11271 1 1 23 LYS HA H 0.752 8.574 -0.841 1.00 . A A . 520 LYS HA 1 1 17 11272 1 1 23 LYS HB2 H 2.471 8.401 -2.436 1.00 . A A . 520 LYS HB2 1 1 17 11273 1 1 23 LYS HB3 H 3.317 8.294 -0.901 1.00 . A A . 520 LYS HB3 1 1 17 11274 1 1 23 LYS HD2 H 5.306 6.909 -1.595 1.00 . A A . 520 LYS HD2 1 1 17 11275 1 1 23 LYS HD3 H 5.055 5.703 -2.858 1.00 . A A . 520 LYS HD3 1 1 17 11276 1 1 23 LYS HE2 H 4.560 8.672 -3.084 1.00 . A A . 520 LYS HE2 1 1 17 11277 1 1 23 LYS HE3 H 5.907 7.785 -3.790 1.00 . A A . 520 LYS HE3 1 1 17 11278 1 1 23 LYS HG2 H 3.227 5.784 -1.171 1.00 . A A . 520 LYS HG2 1 1 17 11279 1 1 23 LYS HG3 H 2.679 6.076 -2.821 1.00 . A A . 520 LYS HG3 1 1 17 11280 1 1 23 LYS HZ1 H 4.182 6.488 -5.053 1.00 . A A . 520 LYS HZ1 1 1 17 11281 1 1 23 LYS HZ2 H 3.042 7.631 -4.527 1.00 . A A . 520 LYS HZ2 1 1 17 11282 1 1 23 LYS HZ3 H 4.344 8.115 -5.489 1.00 . A A . 520 LYS HZ3 1 1 17 11283 1 1 23 LYS N N 1.501 7.258 0.559 1.00 . A A . 520 LYS N 1 1 17 11284 1 1 23 LYS NZ N 4.052 7.470 -4.726 1.00 . A A . 520 LYS NZ 1 1 17 11285 1 1 23 LYS O O -0.272 6.873 -2.495 1.00 . A A . 520 LYS O 1 1 17 11286 1 1 24 VAL C C -1.254 3.672 -0.469 1.00 . A A . 521 VAL C 1 1 17 11287 1 1 24 VAL CA C -0.371 4.273 -1.552 1.00 . A A . 521 VAL CA 1 1 17 11288 1 1 24 VAL CB C 0.492 3.153 -2.175 1.00 . A A . 521 VAL CB 1 1 17 11289 1 1 24 VAL CG1 C 1.250 3.656 -3.395 1.00 . A A . 521 VAL CG1 1 1 17 11290 1 1 24 VAL CG2 C 1.451 2.583 -1.144 1.00 . A A . 521 VAL CG2 1 1 17 11291 1 1 24 VAL H H 0.988 5.168 -0.207 1.00 . A A . 521 VAL H 1 1 17 11292 1 1 24 VAL HA H -0.999 4.692 -2.325 1.00 . A A . 521 VAL HA 1 1 17 11293 1 1 24 VAL HB H -0.167 2.359 -2.495 1.00 . A A . 521 VAL HB 1 1 17 11294 1 1 24 VAL HG11 H 1.923 4.446 -3.098 1.00 . A A . 521 VAL HG11 1 1 17 11295 1 1 24 VAL HG12 H 1.817 2.844 -3.825 1.00 . A A . 521 VAL HG12 1 1 17 11296 1 1 24 VAL HG13 H 0.551 4.034 -4.125 1.00 . A A . 521 VAL HG13 1 1 17 11297 1 1 24 VAL HG21 H 0.890 2.185 -0.312 1.00 . A A . 521 VAL HG21 1 1 17 11298 1 1 24 VAL HG22 H 2.036 1.794 -1.594 1.00 . A A . 521 VAL HG22 1 1 17 11299 1 1 24 VAL HG23 H 2.109 3.365 -0.796 1.00 . A A . 521 VAL HG23 1 1 17 11300 1 1 24 VAL N N 0.436 5.352 -0.999 1.00 . A A . 521 VAL N 1 1 17 11301 1 1 24 VAL O O -0.990 3.835 0.724 1.00 . A A . 521 VAL O 1 1 17 11302 1 1 25 ASN C C -3.478 0.924 -0.297 1.00 . A A . 522 ASN C 1 1 17 11303 1 1 25 ASN CA C -3.246 2.388 0.036 1.00 . A A . 522 ASN CA 1 1 17 11304 1 1 25 ASN CB C -4.579 3.145 0.036 1.00 . A A . 522 ASN CB 1 1 17 11305 1 1 25 ASN CG C -4.745 4.056 -1.165 1.00 . A A . 522 ASN CG 1 1 17 11306 1 1 25 ASN H H -2.435 2.864 -1.857 1.00 . A A . 522 ASN H 1 1 17 11307 1 1 25 ASN HA H -2.816 2.438 1.026 1.00 . A A . 522 ASN HA 1 1 17 11308 1 1 25 ASN HB2 H -5.388 2.429 0.031 1.00 . A A . 522 ASN HB2 1 1 17 11309 1 1 25 ASN HB3 H -4.642 3.743 0.932 1.00 . A A . 522 ASN HB3 1 1 17 11310 1 1 25 ASN HD21 H -5.256 2.504 -2.299 1.00 . A A . 522 ASN HD21 1 1 17 11311 1 1 25 ASN HD22 H -5.216 4.050 -3.089 1.00 . A A . 522 ASN HD22 1 1 17 11312 1 1 25 ASN N N -2.299 2.986 -0.892 1.00 . A A . 522 ASN N 1 1 17 11313 1 1 25 ASN ND2 N -5.111 3.484 -2.296 1.00 . A A . 522 ASN ND2 1 1 17 11314 1 1 25 ASN O O -3.415 0.514 -1.457 1.00 . A A . 522 ASN O 1 1 17 11315 1 1 25 ASN OD1 O -4.512 5.262 -1.084 1.00 . A A . 522 ASN OD1 1 1 17 11316 1 1 26 TYR C C -5.303 -1.611 1.301 1.00 . A A . 523 TYR C 1 1 17 11317 1 1 26 TYR CA C -3.980 -1.277 0.620 1.00 . A A . 523 TYR CA 1 1 17 11318 1 1 26 TYR CB C -2.851 -2.077 1.283 1.00 . A A . 523 TYR CB 1 1 17 11319 1 1 26 TYR CD1 C -0.947 -2.488 -0.325 1.00 . A A . 523 TYR CD1 1 1 17 11320 1 1 26 TYR CD2 C -0.657 -0.823 1.353 1.00 . A A . 523 TYR CD2 1 1 17 11321 1 1 26 TYR CE1 C 0.328 -2.239 -0.796 1.00 . A A . 523 TYR CE1 1 1 17 11322 1 1 26 TYR CE2 C 0.620 -0.571 0.890 1.00 . A A . 523 TYR CE2 1 1 17 11323 1 1 26 TYR CG C -1.463 -1.783 0.753 1.00 . A A . 523 TYR CG 1 1 17 11324 1 1 26 TYR CZ C 1.108 -1.283 -0.183 1.00 . A A . 523 TYR CZ 1 1 17 11325 1 1 26 TYR H H -3.816 0.571 1.631 1.00 . A A . 523 TYR H 1 1 17 11326 1 1 26 TYR HA H -4.039 -1.520 -0.431 1.00 . A A . 523 TYR HA 1 1 17 11327 1 1 26 TYR HB2 H -2.846 -1.863 2.341 1.00 . A A . 523 TYR HB2 1 1 17 11328 1 1 26 TYR HB3 H -3.040 -3.131 1.140 1.00 . A A . 523 TYR HB3 1 1 17 11329 1 1 26 TYR HD1 H -1.042 -0.266 2.193 1.00 . A A . 523 TYR HD1 1 1 17 11330 1 1 26 TYR HD2 H -1.561 -3.235 -0.804 1.00 . A A . 523 TYR HD2 1 1 17 11331 1 1 26 TYR HE1 H 1.232 0.179 1.369 1.00 . A A . 523 TYR HE1 1 1 17 11332 1 1 26 TYR HE2 H 0.711 -2.796 -1.637 1.00 . A A . 523 TYR HE2 1 1 17 11333 1 1 26 TYR HH H 2.436 -1.216 -1.590 1.00 . A A . 523 TYR HH 1 1 17 11334 1 1 26 TYR N N -3.738 0.150 0.743 1.00 . A A . 523 TYR N 1 1 17 11335 1 1 26 TYR O O -6.008 -0.712 1.764 1.00 . A A . 523 TYR O 1 1 17 11336 1 1 26 TYR OH O 2.385 -1.040 -0.638 1.00 . A A . 523 TYR OH 1 1 17 11337 1 1 27 CYS C C -6.650 -4.295 3.123 1.00 . A A . 524 CYS C 1 1 17 11338 1 1 27 CYS CA C -6.896 -3.281 2.013 1.00 . A A . 524 CYS CA 1 1 17 11339 1 1 27 CYS CB C -7.875 -3.832 0.963 1.00 . A A . 524 CYS CB 1 1 17 11340 1 1 27 CYS H H -5.003 -3.581 1.109 1.00 . A A . 524 CYS H 1 1 17 11341 1 1 27 CYS HA H -7.328 -2.395 2.458 1.00 . A A . 524 CYS HA 1 1 17 11342 1 1 27 CYS HB2 H -8.876 -3.782 1.364 1.00 . A A . 524 CYS HB2 1 1 17 11343 1 1 27 CYS HB3 H -7.821 -3.213 0.080 1.00 . A A . 524 CYS HB3 1 1 17 11344 1 1 27 CYS N N -5.634 -2.891 1.402 1.00 . A A . 524 CYS N 1 1 17 11345 1 1 27 CYS O O -7.580 -4.753 3.787 1.00 . A A . 524 CYS O 1 1 17 11346 1 1 27 CYS SG S -7.593 -5.555 0.441 1.00 . A A . 524 CYS SG 1 1 17 11347 1 1 28 SER C C -3.477 -5.471 4.560 1.00 . A A . 525 SER C 1 1 17 11348 1 1 28 SER CA C -4.983 -5.564 4.356 1.00 . A A . 525 SER CA 1 1 17 11349 1 1 28 SER CB C -5.377 -6.987 3.938 1.00 . A A . 525 SER CB 1 1 17 11350 1 1 28 SER H H -4.681 -4.200 2.797 1.00 . A A . 525 SER H 1 1 17 11351 1 1 28 SER HA H -5.486 -5.306 5.276 1.00 . A A . 525 SER HA 1 1 17 11352 1 1 28 SER HB2 H -6.443 -7.025 3.770 1.00 . A A . 525 SER HB2 1 1 17 11353 1 1 28 SER HB3 H -4.860 -7.247 3.027 1.00 . A A . 525 SER HB3 1 1 17 11354 1 1 28 SER HG H -5.830 -8.128 5.476 1.00 . A A . 525 SER HG 1 1 17 11355 1 1 28 SER N N -5.381 -4.614 3.337 1.00 . A A . 525 SER N 1 1 17 11356 1 1 28 SER O O -2.769 -4.941 3.701 1.00 . A A . 525 SER O 1 1 17 11357 1 1 28 SER OG O -5.044 -7.935 4.939 1.00 . A A . 525 SER OG 1 1 17 11358 1 1 29 THR C C -0.877 -6.944 4.953 1.00 . A A . 526 THR C 1 1 17 11359 1 1 29 THR CA C -1.561 -6.007 5.945 1.00 . A A . 526 THR CA 1 1 17 11360 1 1 29 THR CB C -1.261 -6.484 7.379 1.00 . A A . 526 THR CB 1 1 17 11361 1 1 29 THR CG2 C 0.211 -6.300 7.715 1.00 . A A . 526 THR CG2 1 1 17 11362 1 1 29 THR H H -3.611 -6.303 6.373 1.00 . A A . 526 THR H 1 1 17 11363 1 1 29 THR HA H -1.164 -5.009 5.822 1.00 . A A . 526 THR HA 1 1 17 11364 1 1 29 THR HB H -1.500 -7.536 7.448 1.00 . A A . 526 THR HB 1 1 17 11365 1 1 29 THR HG1 H -2.299 -4.895 7.947 1.00 . A A . 526 THR HG1 1 1 17 11366 1 1 29 THR HG21 H 0.477 -5.258 7.610 1.00 . A A . 526 THR HG21 1 1 17 11367 1 1 29 THR HG22 H 0.388 -6.618 8.730 1.00 . A A . 526 THR HG22 1 1 17 11368 1 1 29 THR HG23 H 0.811 -6.893 7.040 1.00 . A A . 526 THR HG23 1 1 17 11369 1 1 29 THR N N -2.991 -5.966 5.690 1.00 . A A . 526 THR N 1 1 17 11370 1 1 29 THR O O 0.290 -6.757 4.602 1.00 . A A . 526 THR O 1 1 17 11371 1 1 29 THR OG1 O -2.063 -5.758 8.320 1.00 . A A . 526 THR OG1 1 1 17 11372 1 1 30 PHE C C -0.690 -8.210 2.241 1.00 . A A . 527 PHE C 1 1 17 11373 1 1 30 PHE CA C -1.100 -8.904 3.536 1.00 . A A . 527 PHE CA 1 1 17 11374 1 1 30 PHE CB C -2.141 -9.990 3.246 1.00 . A A . 527 PHE CB 1 1 17 11375 1 1 30 PHE CD1 C -0.912 -11.984 2.339 1.00 . A A . 527 PHE CD1 1 1 17 11376 1 1 30 PHE CD2 C -2.224 -10.675 0.840 1.00 . A A . 527 PHE CD2 1 1 17 11377 1 1 30 PHE CE1 C -0.552 -12.818 1.299 1.00 . A A . 527 PHE CE1 1 1 17 11378 1 1 30 PHE CE2 C -1.867 -11.502 -0.202 1.00 . A A . 527 PHE CE2 1 1 17 11379 1 1 30 PHE CG C -1.752 -10.903 2.120 1.00 . A A . 527 PHE CG 1 1 17 11380 1 1 30 PHE CZ C -1.032 -12.578 0.026 1.00 . A A . 527 PHE CZ 1 1 17 11381 1 1 30 PHE H H -2.545 -8.037 4.809 1.00 . A A . 527 PHE H 1 1 17 11382 1 1 30 PHE HA H -0.228 -9.364 3.974 1.00 . A A . 527 PHE HA 1 1 17 11383 1 1 30 PHE HB2 H -2.279 -10.593 4.132 1.00 . A A . 527 PHE HB2 1 1 17 11384 1 1 30 PHE HB3 H -3.079 -9.520 2.986 1.00 . A A . 527 PHE HB3 1 1 17 11385 1 1 30 PHE HD1 H -2.878 -9.834 0.659 1.00 . A A . 527 PHE HD1 1 1 17 11386 1 1 30 PHE HD2 H -0.537 -12.171 3.335 1.00 . A A . 527 PHE HD2 1 1 17 11387 1 1 30 PHE HE1 H -2.244 -11.308 -1.195 1.00 . A A . 527 PHE HE1 1 1 17 11388 1 1 30 PHE HE2 H 0.103 -13.657 1.480 1.00 . A A . 527 PHE HE2 1 1 17 11389 1 1 30 PHE HZ H -0.752 -13.229 -0.790 1.00 . A A . 527 PHE HZ 1 1 17 11390 1 1 30 PHE N N -1.621 -7.943 4.492 1.00 . A A . 527 PHE N 1 1 17 11391 1 1 30 PHE O O 0.415 -8.419 1.747 1.00 . A A . 527 PHE O 1 1 17 11392 1 1 31 CYS C C -0.070 -5.761 0.625 1.00 . A A . 528 CYS C 1 1 17 11393 1 1 31 CYS CA C -1.281 -6.676 0.456 1.00 . A A . 528 CYS CA 1 1 17 11394 1 1 31 CYS CB C -2.496 -5.875 0.003 1.00 . A A . 528 CYS CB 1 1 17 11395 1 1 31 CYS H H -2.431 -7.216 2.143 1.00 . A A . 528 CYS H 1 1 17 11396 1 1 31 CYS HA H -1.046 -7.444 -0.264 1.00 . A A . 528 CYS HA 1 1 17 11397 1 1 31 CYS HB2 H -2.506 -4.923 0.516 1.00 . A A . 528 CYS HB2 1 1 17 11398 1 1 31 CYS HB3 H -2.430 -5.706 -1.061 1.00 . A A . 528 CYS HB3 1 1 17 11399 1 1 31 CYS N N -1.568 -7.365 1.705 1.00 . A A . 528 CYS N 1 1 17 11400 1 1 31 CYS O O 0.747 -5.624 -0.287 1.00 . A A . 528 CYS O 1 1 17 11401 1 1 31 CYS SG S -4.080 -6.708 0.339 1.00 . A A . 528 CYS SG 1 1 17 11402 1 1 32 GLN C C 2.481 -5.074 2.009 1.00 . A A . 529 GLN C 1 1 17 11403 1 1 32 GLN CA C 1.170 -4.296 2.141 1.00 . A A . 529 GLN CA 1 1 17 11404 1 1 32 GLN CB C 1.022 -3.751 3.576 1.00 . A A . 529 GLN CB 1 1 17 11405 1 1 32 GLN CD C 2.718 -1.923 3.994 1.00 . A A . 529 GLN CD 1 1 17 11406 1 1 32 GLN CG C 2.337 -3.368 4.234 1.00 . A A . 529 GLN CG 1 1 17 11407 1 1 32 GLN H H -0.647 -5.321 2.488 1.00 . A A . 529 GLN H 1 1 17 11408 1 1 32 GLN HA H 1.169 -3.474 1.444 1.00 . A A . 529 GLN HA 1 1 17 11409 1 1 32 GLN HB2 H 0.399 -2.863 3.553 1.00 . A A . 529 GLN HB2 1 1 17 11410 1 1 32 GLN HB3 H 0.543 -4.502 4.188 1.00 . A A . 529 GLN HB3 1 1 17 11411 1 1 32 GLN HE21 H 3.673 -2.400 2.317 1.00 . A A . 529 GLN HE21 1 1 17 11412 1 1 32 GLN HE22 H 3.682 -0.723 2.744 1.00 . A A . 529 GLN HE22 1 1 17 11413 1 1 32 GLN HG2 H 2.252 -3.531 5.298 1.00 . A A . 529 GLN HG2 1 1 17 11414 1 1 32 GLN HG3 H 3.116 -4.001 3.838 1.00 . A A . 529 GLN HG3 1 1 17 11415 1 1 32 GLN N N 0.039 -5.157 1.809 1.00 . A A . 529 GLN N 1 1 17 11416 1 1 32 GLN NE2 N 3.429 -1.656 2.910 1.00 . A A . 529 GLN NE2 1 1 17 11417 1 1 32 GLN O O 3.439 -4.604 1.394 1.00 . A A . 529 GLN O 1 1 17 11418 1 1 32 GLN OE1 O 2.375 -1.052 4.785 1.00 . A A . 529 GLN OE1 1 1 17 11419 1 1 33 ARG C C 3.938 -7.711 1.210 1.00 . A A . 530 ARG C 1 1 17 11420 1 1 33 ARG CA C 3.707 -7.094 2.588 1.00 . A A . 530 ARG CA 1 1 17 11421 1 1 33 ARG CB C 3.624 -8.180 3.648 1.00 . A A . 530 ARG CB 1 1 17 11422 1 1 33 ARG CD C 3.579 -8.771 6.074 1.00 . A A . 530 ARG CD 1 1 17 11423 1 1 33 ARG CG C 3.682 -7.647 5.065 1.00 . A A . 530 ARG CG 1 1 17 11424 1 1 33 ARG CZ C 4.885 -10.764 6.720 1.00 . A A . 530 ARG CZ 1 1 17 11425 1 1 33 ARG H H 1.690 -6.599 3.031 1.00 . A A . 530 ARG H 1 1 17 11426 1 1 33 ARG HA H 4.532 -6.435 2.808 1.00 . A A . 530 ARG HA 1 1 17 11427 1 1 33 ARG HB2 H 2.692 -8.712 3.523 1.00 . A A . 530 ARG HB2 1 1 17 11428 1 1 33 ARG HB3 H 4.444 -8.869 3.510 1.00 . A A . 530 ARG HB3 1 1 17 11429 1 1 33 ARG HD2 H 3.706 -8.359 7.063 1.00 . A A . 530 ARG HD2 1 1 17 11430 1 1 33 ARG HD3 H 2.600 -9.217 5.992 1.00 . A A . 530 ARG HD3 1 1 17 11431 1 1 33 ARG HE H 5.080 -9.776 4.989 1.00 . A A . 530 ARG HE 1 1 17 11432 1 1 33 ARG HG2 H 4.619 -7.128 5.209 1.00 . A A . 530 ARG HG2 1 1 17 11433 1 1 33 ARG HG3 H 2.862 -6.962 5.217 1.00 . A A . 530 ARG HG3 1 1 17 11434 1 1 33 ARG HH11 H 3.521 -10.176 8.109 1.00 . A A . 530 ARG HH11 1 1 17 11435 1 1 33 ARG HH12 H 4.475 -11.564 8.537 1.00 . A A . 530 ARG HH12 1 1 17 11436 1 1 33 ARG HH21 H 6.303 -11.606 5.541 1.00 . A A . 530 ARG HH21 1 1 17 11437 1 1 33 ARG HH22 H 6.040 -12.395 7.069 1.00 . A A . 530 ARG HH22 1 1 17 11438 1 1 33 ARG N N 2.511 -6.264 2.603 1.00 . A A . 530 ARG N 1 1 17 11439 1 1 33 ARG NE N 4.592 -9.802 5.849 1.00 . A A . 530 ARG NE 1 1 17 11440 1 1 33 ARG NH1 N 4.242 -10.845 7.880 1.00 . A A . 530 ARG NH1 1 1 17 11441 1 1 33 ARG NH2 N 5.818 -11.658 6.419 1.00 . A A . 530 ARG NH2 1 1 17 11442 1 1 33 ARG O O 5.077 -7.902 0.785 1.00 . A A . 530 ARG O 1 1 17 11443 1 1 34 LYS C C 3.584 -7.649 -1.773 1.00 . A A . 531 LYS C 1 1 17 11444 1 1 34 LYS CA C 2.907 -8.617 -0.807 1.00 . A A . 531 LYS CA 1 1 17 11445 1 1 34 LYS CB C 1.476 -8.964 -1.270 1.00 . A A . 531 LYS CB 1 1 17 11446 1 1 34 LYS CD C 1.554 -8.867 -3.797 1.00 . A A . 531 LYS CD 1 1 17 11447 1 1 34 LYS CE C 1.208 -9.610 -5.075 1.00 . A A . 531 LYS CE 1 1 17 11448 1 1 34 LYS CG C 1.378 -9.752 -2.573 1.00 . A A . 531 LYS CG 1 1 17 11449 1 1 34 LYS H H 1.965 -7.864 0.933 1.00 . A A . 531 LYS H 1 1 17 11450 1 1 34 LYS HA H 3.491 -9.523 -0.748 1.00 . A A . 531 LYS HA 1 1 17 11451 1 1 34 LYS HB2 H 0.998 -9.547 -0.498 1.00 . A A . 531 LYS HB2 1 1 17 11452 1 1 34 LYS HB3 H 0.924 -8.044 -1.397 1.00 . A A . 531 LYS HB3 1 1 17 11453 1 1 34 LYS HD2 H 0.905 -8.009 -3.704 1.00 . A A . 531 LYS HD2 1 1 17 11454 1 1 34 LYS HD3 H 2.582 -8.539 -3.848 1.00 . A A . 531 LYS HD3 1 1 17 11455 1 1 34 LYS HE2 H 1.458 -8.984 -5.917 1.00 . A A . 531 LYS HE2 1 1 17 11456 1 1 34 LYS HE3 H 1.788 -10.520 -5.117 1.00 . A A . 531 LYS HE3 1 1 17 11457 1 1 34 LYS HG2 H 2.148 -10.510 -2.580 1.00 . A A . 531 LYS HG2 1 1 17 11458 1 1 34 LYS HG3 H 0.409 -10.226 -2.619 1.00 . A A . 531 LYS HG3 1 1 17 11459 1 1 34 LYS HZ1 H -0.812 -9.086 -5.100 1.00 . A A . 531 LYS HZ1 1 1 17 11460 1 1 34 LYS HZ2 H -0.443 -10.456 -6.029 1.00 . A A . 531 LYS HZ2 1 1 17 11461 1 1 34 LYS HZ3 H -0.501 -10.566 -4.339 1.00 . A A . 531 LYS HZ3 1 1 17 11462 1 1 34 LYS N N 2.845 -8.026 0.525 1.00 . A A . 531 LYS N 1 1 17 11463 1 1 34 LYS NZ N -0.235 -9.953 -5.139 1.00 . A A . 531 LYS NZ 1 1 17 11464 1 1 34 LYS O O 4.430 -8.041 -2.582 1.00 . A A . 531 LYS O 1 1 17 11465 1 1 35 ASP C C 5.168 -4.920 -2.068 1.00 . A A . 532 ASP C 1 1 17 11466 1 1 35 ASP CA C 3.769 -5.333 -2.514 1.00 . A A . 532 ASP CA 1 1 17 11467 1 1 35 ASP CB C 2.835 -4.125 -2.482 1.00 . A A . 532 ASP CB 1 1 17 11468 1 1 35 ASP CG C 3.174 -3.076 -3.527 1.00 . A A . 532 ASP CG 1 1 17 11469 1 1 35 ASP H H 2.545 -6.134 -0.989 1.00 . A A . 532 ASP H 1 1 17 11470 1 1 35 ASP HA H 3.814 -5.704 -3.526 1.00 . A A . 532 ASP HA 1 1 17 11471 1 1 35 ASP HB2 H 1.825 -4.460 -2.652 1.00 . A A . 532 ASP HB2 1 1 17 11472 1 1 35 ASP HB3 H 2.893 -3.663 -1.506 1.00 . A A . 532 ASP HB3 1 1 17 11473 1 1 35 ASP N N 3.225 -6.381 -1.657 1.00 . A A . 532 ASP N 1 1 17 11474 1 1 35 ASP O O 5.897 -4.275 -2.817 1.00 . A A . 532 ASP O 1 1 17 11475 1 1 35 ASP OD1 O 3.319 -3.436 -4.719 1.00 . A A . 532 ASP OD1 1 1 17 11476 1 1 35 ASP OD2 O 3.282 -1.884 -3.169 1.00 . A A . 532 ASP OD2 1 1 17 11477 1 1 36 TRP C C 8.045 -5.166 -1.035 1.00 . A A . 533 TRP C 1 1 17 11478 1 1 36 TRP CA C 6.782 -4.886 -0.221 1.00 . A A . 533 TRP CA 1 1 17 11479 1 1 36 TRP CB C 6.932 -5.509 1.171 1.00 . A A . 533 TRP CB 1 1 17 11480 1 1 36 TRP CD1 C 9.249 -5.582 2.273 1.00 . A A . 533 TRP CD1 1 1 17 11481 1 1 36 TRP CD2 C 8.211 -3.604 2.433 1.00 . A A . 533 TRP CD2 1 1 17 11482 1 1 36 TRP CE2 C 9.467 -3.508 3.063 1.00 . A A . 533 TRP CE2 1 1 17 11483 1 1 36 TRP CE3 C 7.382 -2.477 2.406 1.00 . A A . 533 TRP CE3 1 1 17 11484 1 1 36 TRP CG C 8.090 -4.941 1.935 1.00 . A A . 533 TRP CG 1 1 17 11485 1 1 36 TRP CH2 C 9.083 -1.245 3.617 1.00 . A A . 533 TRP CH2 1 1 17 11486 1 1 36 TRP CZ2 C 9.913 -2.333 3.660 1.00 . A A . 533 TRP CZ2 1 1 17 11487 1 1 36 TRP CZ3 C 7.826 -1.310 3.001 1.00 . A A . 533 TRP CZ3 1 1 17 11488 1 1 36 TRP H H 5.017 -6.035 -0.413 1.00 . A A . 533 TRP H 1 1 17 11489 1 1 36 TRP HA H 6.689 -3.817 -0.088 1.00 . A A . 533 TRP HA 1 1 17 11490 1 1 36 TRP HB2 H 6.030 -5.332 1.739 1.00 . A A . 533 TRP HB2 1 1 17 11491 1 1 36 TRP HB3 H 7.085 -6.574 1.068 1.00 . A A . 533 TRP HB3 1 1 17 11492 1 1 36 TRP HD1 H 9.466 -6.611 2.033 1.00 . A A . 533 TRP HD1 1 1 17 11493 1 1 36 TRP HE1 H 10.968 -4.953 3.303 1.00 . A A . 533 TRP HE1 1 1 17 11494 1 1 36 TRP HE3 H 6.407 -2.509 1.937 1.00 . A A . 533 TRP HE3 1 1 17 11495 1 1 36 TRP HH2 H 9.390 -0.313 4.067 1.00 . A A . 533 TRP HH2 1 1 17 11496 1 1 36 TRP HZ2 H 10.883 -2.266 4.128 1.00 . A A . 533 TRP HZ2 1 1 17 11497 1 1 36 TRP HZ3 H 7.201 -0.428 2.990 1.00 . A A . 533 TRP HZ3 1 1 17 11498 1 1 36 TRP N N 5.560 -5.362 -0.874 1.00 . A A . 533 TRP N 1 1 17 11499 1 1 36 TRP NE1 N 10.080 -4.727 2.953 1.00 . A A . 533 TRP NE1 1 1 17 11500 1 1 36 TRP O O 9.030 -4.452 -0.920 1.00 . A A . 533 TRP O 1 1 17 11501 1 1 37 LYS C C 9.532 -5.513 -3.672 1.00 . A A . 534 LYS C 1 1 17 11502 1 1 37 LYS CA C 9.204 -6.573 -2.627 1.00 . A A . 534 LYS CA 1 1 17 11503 1 1 37 LYS CB C 9.038 -7.949 -3.271 1.00 . A A . 534 LYS CB 1 1 17 11504 1 1 37 LYS CD C 8.689 -10.413 -2.956 1.00 . A A . 534 LYS CD 1 1 17 11505 1 1 37 LYS CE C 8.369 -11.523 -1.969 1.00 . A A . 534 LYS CE 1 1 17 11506 1 1 37 LYS CG C 8.782 -9.062 -2.269 1.00 . A A . 534 LYS CG 1 1 17 11507 1 1 37 LYS H H 7.180 -6.675 -1.994 1.00 . A A . 534 LYS H 1 1 17 11508 1 1 37 LYS HA H 10.051 -6.581 -1.960 1.00 . A A . 534 LYS HA 1 1 17 11509 1 1 37 LYS HB2 H 8.208 -7.914 -3.959 1.00 . A A . 534 LYS HB2 1 1 17 11510 1 1 37 LYS HB3 H 9.938 -8.188 -3.819 1.00 . A A . 534 LYS HB3 1 1 17 11511 1 1 37 LYS HD2 H 7.911 -10.375 -3.705 1.00 . A A . 534 LYS HD2 1 1 17 11512 1 1 37 LYS HD3 H 9.636 -10.628 -3.430 1.00 . A A . 534 LYS HD3 1 1 17 11513 1 1 37 LYS HE2 H 8.380 -12.466 -2.491 1.00 . A A . 534 LYS HE2 1 1 17 11514 1 1 37 LYS HE3 H 9.128 -11.527 -1.203 1.00 . A A . 534 LYS HE3 1 1 17 11515 1 1 37 LYS HG2 H 9.593 -9.087 -1.557 1.00 . A A . 534 LYS HG2 1 1 17 11516 1 1 37 LYS HG3 H 7.853 -8.866 -1.755 1.00 . A A . 534 LYS HG3 1 1 17 11517 1 1 37 LYS HZ1 H 6.310 -11.150 -2.045 1.00 . A A . 534 LYS HZ1 1 1 17 11518 1 1 37 LYS HZ2 H 6.772 -12.211 -0.806 1.00 . A A . 534 LYS HZ2 1 1 17 11519 1 1 37 LYS HZ3 H 7.070 -10.550 -0.652 1.00 . A A . 534 LYS HZ3 1 1 17 11520 1 1 37 LYS N N 8.017 -6.191 -1.864 1.00 . A A . 534 LYS N 1 1 17 11521 1 1 37 LYS NZ N 7.038 -11.345 -1.324 1.00 . A A . 534 LYS NZ 1 1 17 11522 1 1 37 LYS O O 10.703 -5.283 -3.976 1.00 . A A . 534 LYS O 1 1 17 11523 1 1 38 ASP C C 8.730 -2.428 -4.209 1.00 . A A . 535 ASP C 1 1 17 11524 1 1 38 ASP CA C 8.763 -3.682 -5.046 1.00 . A A . 535 ASP CA 1 1 17 11525 1 1 38 ASP CB C 7.702 -3.560 -6.127 1.00 . A A . 535 ASP CB 1 1 17 11526 1 1 38 ASP CG C 8.008 -2.460 -7.123 1.00 . A A . 535 ASP CG 1 1 17 11527 1 1 38 ASP H H 7.602 -5.137 -4.021 1.00 . A A . 535 ASP H 1 1 17 11528 1 1 38 ASP HA H 9.737 -3.795 -5.499 1.00 . A A . 535 ASP HA 1 1 17 11529 1 1 38 ASP HB2 H 7.626 -4.484 -6.647 1.00 . A A . 535 ASP HB2 1 1 17 11530 1 1 38 ASP HB3 H 6.753 -3.338 -5.661 1.00 . A A . 535 ASP HB3 1 1 17 11531 1 1 38 ASP N N 8.521 -4.846 -4.199 1.00 . A A . 535 ASP N 1 1 17 11532 1 1 38 ASP O O 9.502 -1.497 -4.387 1.00 . A A . 535 ASP O 1 1 17 11533 1 1 38 ASP OD1 O 9.088 -2.507 -7.755 1.00 . A A . 535 ASP OD1 1 1 17 11534 1 1 38 ASP OD2 O 7.155 -1.565 -7.301 1.00 . A A . 535 ASP OD2 1 1 17 11535 1 1 39 HIS C C 8.686 -0.821 -1.666 1.00 . A A . 536 HIS C 1 1 17 11536 1 1 39 HIS CA C 7.513 -1.249 -2.525 1.00 . A A . 536 HIS CA 1 1 17 11537 1 1 39 HIS CB C 6.279 -1.495 -1.657 1.00 . A A . 536 HIS CB 1 1 17 11538 1 1 39 HIS CD2 C 5.611 0.131 0.245 1.00 . A A . 536 HIS CD2 1 1 17 11539 1 1 39 HIS CE1 C 4.641 1.654 -0.946 1.00 . A A . 536 HIS CE1 1 1 17 11540 1 1 39 HIS CG C 5.700 -0.261 -1.053 1.00 . A A . 536 HIS CG 1 1 17 11541 1 1 39 HIS H H 7.340 -3.255 -3.084 1.00 . A A . 536 HIS H 1 1 17 11542 1 1 39 HIS HA H 7.296 -0.471 -3.250 1.00 . A A . 536 HIS HA 1 1 17 11543 1 1 39 HIS HB2 H 5.512 -1.954 -2.263 1.00 . A A . 536 HIS HB2 1 1 17 11544 1 1 39 HIS HB3 H 6.543 -2.168 -0.853 1.00 . A A . 536 HIS HB3 1 1 17 11545 1 1 39 HIS HD1 H 4.957 0.718 -2.775 1.00 . A A . 536 HIS HD1 1 1 17 11546 1 1 39 HIS HD2 H 5.999 -0.402 1.101 1.00 . A A . 536 HIS HD2 1 1 17 11547 1 1 39 HIS HE1 H 4.113 2.548 -1.243 1.00 . A A . 536 HIS HE1 1 1 17 11548 1 1 39 HIS N N 7.826 -2.432 -3.269 1.00 . A A . 536 HIS N 1 1 17 11549 1 1 39 HIS ND1 N 5.079 0.719 -1.793 1.00 . A A . 536 HIS ND1 1 1 17 11550 1 1 39 HIS NE2 N 4.932 1.338 0.295 1.00 . A A . 536 HIS NE2 1 1 17 11551 1 1 39 HIS O O 8.909 0.358 -1.485 1.00 . A A . 536 HIS O 1 1 17 11552 1 1 40 GLN C C 11.572 -0.533 -0.887 1.00 . A A . 537 GLN C 1 1 17 11553 1 1 40 GLN CA C 10.544 -1.470 -0.250 1.00 . A A . 537 GLN CA 1 1 17 11554 1 1 40 GLN CB C 11.233 -2.745 0.238 1.00 . A A . 537 GLN CB 1 1 17 11555 1 1 40 GLN CD C 12.560 -4.799 -0.374 1.00 . A A . 537 GLN CD 1 1 17 11556 1 1 40 GLN CG C 11.923 -3.520 -0.865 1.00 . A A . 537 GLN CG 1 1 17 11557 1 1 40 GLN H H 9.259 -2.723 -1.397 1.00 . A A . 537 GLN H 1 1 17 11558 1 1 40 GLN HA H 10.108 -0.956 0.594 1.00 . A A . 537 GLN HA 1 1 17 11559 1 1 40 GLN HB2 H 11.972 -2.484 0.981 1.00 . A A . 537 GLN HB2 1 1 17 11560 1 1 40 GLN HB3 H 10.493 -3.390 0.692 1.00 . A A . 537 GLN HB3 1 1 17 11561 1 1 40 GLN HE21 H 10.842 -5.754 -0.599 1.00 . A A . 537 GLN HE21 1 1 17 11562 1 1 40 GLN HE22 H 12.163 -6.712 -0.026 1.00 . A A . 537 GLN HE22 1 1 17 11563 1 1 40 GLN HG2 H 11.199 -3.764 -1.631 1.00 . A A . 537 GLN HG2 1 1 17 11564 1 1 40 GLN HG3 H 12.694 -2.894 -1.285 1.00 . A A . 537 GLN HG3 1 1 17 11565 1 1 40 GLN N N 9.448 -1.780 -1.163 1.00 . A A . 537 GLN N 1 1 17 11566 1 1 40 GLN NE2 N 11.776 -5.860 -0.324 1.00 . A A . 537 GLN NE2 1 1 17 11567 1 1 40 GLN O O 12.164 0.293 -0.196 1.00 . A A . 537 GLN O 1 1 17 11568 1 1 40 GLN OE1 O 13.739 -4.825 -0.026 1.00 . A A . 537 GLN OE1 1 1 17 11569 1 1 41 HIS C C 12.132 1.548 -3.239 1.00 . A A . 538 HIS C 1 1 17 11570 1 1 41 HIS CA C 12.767 0.214 -2.853 1.00 . A A . 538 HIS CA 1 1 17 11571 1 1 41 HIS CB C 13.434 -0.471 -4.067 1.00 . A A . 538 HIS CB 1 1 17 11572 1 1 41 HIS CD2 C 11.814 -1.542 -5.773 1.00 . A A . 538 HIS CD2 1 1 17 11573 1 1 41 HIS CE1 C 11.784 0.096 -7.198 1.00 . A A . 538 HIS CE1 1 1 17 11574 1 1 41 HIS CG C 12.605 -0.545 -5.319 1.00 . A A . 538 HIS CG 1 1 17 11575 1 1 41 HIS H H 11.350 -1.368 -2.697 1.00 . A A . 538 HIS H 1 1 17 11576 1 1 41 HIS HA H 13.537 0.435 -2.131 1.00 . A A . 538 HIS HA 1 1 17 11577 1 1 41 HIS HB2 H 14.335 0.066 -4.311 1.00 . A A . 538 HIS HB2 1 1 17 11578 1 1 41 HIS HB3 H 13.697 -1.481 -3.788 1.00 . A A . 538 HIS HB3 1 1 17 11579 1 1 41 HIS HD2 H 11.586 -2.470 -5.267 1.00 . A A . 538 HIS HD2 1 1 17 11580 1 1 41 HIS HE1 H 11.530 0.701 -8.054 1.00 . A A . 538 HIS HE1 1 1 17 11581 1 1 41 HIS HE2 H 10.481 -1.506 -7.399 1.00 . A A . 538 HIS HE2 1 1 17 11582 1 1 41 HIS N N 11.804 -0.660 -2.192 1.00 . A A . 538 HIS N 1 1 17 11583 1 1 41 HIS ND1 N 12.585 0.488 -6.223 1.00 . A A . 538 HIS ND1 1 1 17 11584 1 1 41 HIS NE2 N 11.294 -1.129 -6.973 1.00 . A A . 538 HIS NE2 1 1 17 11585 1 1 41 HIS O O 12.832 2.560 -3.341 1.00 . A A . 538 HIS O 1 1 17 11586 1 1 42 ILE C C 9.770 3.606 -2.532 1.00 . A A . 539 ILE C 1 1 17 11587 1 1 42 ILE CA C 10.135 2.811 -3.790 1.00 . A A . 539 ILE CA 1 1 17 11588 1 1 42 ILE CB C 8.877 2.537 -4.674 1.00 . A A . 539 ILE CB 1 1 17 11589 1 1 42 ILE CD1 C 6.791 3.470 -3.527 1.00 . A A . 539 ILE CD1 1 1 17 11590 1 1 42 ILE CG1 C 7.604 2.239 -3.867 1.00 . A A . 539 ILE CG1 1 1 17 11591 1 1 42 ILE CG2 C 9.154 1.391 -5.627 1.00 . A A . 539 ILE CG2 1 1 17 11592 1 1 42 ILE H H 10.291 0.746 -3.334 1.00 . A A . 539 ILE H 1 1 17 11593 1 1 42 ILE HA H 10.826 3.400 -4.373 1.00 . A A . 539 ILE HA 1 1 17 11594 1 1 42 ILE HB H 8.702 3.408 -5.272 1.00 . A A . 539 ILE HB 1 1 17 11595 1 1 42 ILE HD11 H 6.477 3.956 -4.439 1.00 . A A . 539 ILE HD11 1 1 17 11596 1 1 42 ILE HD12 H 5.925 3.181 -2.953 1.00 . A A . 539 ILE HD12 1 1 17 11597 1 1 42 ILE HD13 H 7.399 4.151 -2.948 1.00 . A A . 539 ILE HD13 1 1 17 11598 1 1 42 ILE HG12 H 6.973 1.587 -4.437 1.00 . A A . 539 ILE HG12 1 1 17 11599 1 1 42 ILE HG13 H 7.874 1.754 -2.942 1.00 . A A . 539 ILE HG13 1 1 17 11600 1 1 42 ILE HG21 H 9.496 0.532 -5.064 1.00 . A A . 539 ILE HG21 1 1 17 11601 1 1 42 ILE HG22 H 8.250 1.137 -6.160 1.00 . A A . 539 ILE HG22 1 1 17 11602 1 1 42 ILE HG23 H 9.920 1.683 -6.331 1.00 . A A . 539 ILE HG23 1 1 17 11603 1 1 42 ILE N N 10.814 1.572 -3.431 1.00 . A A . 539 ILE N 1 1 17 11604 1 1 42 ILE O O 9.933 4.825 -2.481 1.00 . A A . 539 ILE O 1 1 17 11605 1 1 43 CYS C C 9.952 4.313 0.320 1.00 . A A . 540 CYS C 1 1 17 11606 1 1 43 CYS CA C 8.834 3.473 -0.290 1.00 . A A . 540 CYS CA 1 1 17 11607 1 1 43 CYS CB C 8.478 2.338 0.670 1.00 . A A . 540 CYS CB 1 1 17 11608 1 1 43 CYS H H 9.082 1.928 -1.701 1.00 . A A . 540 CYS H 1 1 17 11609 1 1 43 CYS HA H 7.959 4.080 -0.450 1.00 . A A . 540 CYS HA 1 1 17 11610 1 1 43 CYS HB2 H 7.883 1.607 0.144 1.00 . A A . 540 CYS HB2 1 1 17 11611 1 1 43 CYS HB3 H 9.392 1.871 1.008 1.00 . A A . 540 CYS HB3 1 1 17 11612 1 1 43 CYS N N 9.253 2.893 -1.550 1.00 . A A . 540 CYS N 1 1 17 11613 1 1 43 CYS O O 11.068 3.836 0.533 1.00 . A A . 540 CYS O 1 1 17 11614 1 1 43 CYS SG S 7.540 2.848 2.139 1.00 . A A . 540 CYS SG 1 1 17 11615 1 1 44 GLY C C 10.962 7.640 0.283 1.00 . A A . 541 GLY C 1 1 17 11616 1 1 44 GLY CA C 10.618 6.455 1.159 1.00 . A A . 541 GLY CA 1 1 17 11617 1 1 44 GLY H H 8.727 5.876 0.394 1.00 . A A . 541 GLY H 1 1 17 11618 1 1 44 GLY HA2 H 10.228 6.819 2.098 1.00 . A A . 541 GLY HA2 1 1 17 11619 1 1 44 GLY HA3 H 11.521 5.893 1.353 1.00 . A A . 541 GLY HA3 1 1 17 11620 1 1 44 GLY N N 9.644 5.570 0.564 1.00 . A A . 541 GLY N 1 1 17 11621 1 1 44 GLY O O 11.599 8.586 0.743 1.00 . A A . 541 GLY O 1 1 17 11622 1 1 45 GLN C C 9.975 9.928 -1.614 1.00 . A A . 542 GLN C 1 1 17 11623 1 1 45 GLN CA C 10.835 8.705 -1.905 1.00 . A A . 542 GLN CA 1 1 17 11624 1 1 45 GLN CB C 10.633 8.252 -3.356 1.00 . A A . 542 GLN CB 1 1 17 11625 1 1 45 GLN CD C 13.047 7.586 -3.705 1.00 . A A . 542 GLN CD 1 1 17 11626 1 1 45 GLN CG C 11.595 7.161 -3.804 1.00 . A A . 542 GLN CG 1 1 17 11627 1 1 45 GLN H H 9.992 6.867 -1.292 1.00 . A A . 542 GLN H 1 1 17 11628 1 1 45 GLN HA H 11.873 8.972 -1.764 1.00 . A A . 542 GLN HA 1 1 17 11629 1 1 45 GLN HB2 H 9.626 7.881 -3.470 1.00 . A A . 542 GLN HB2 1 1 17 11630 1 1 45 GLN HB3 H 10.766 9.103 -4.007 1.00 . A A . 542 GLN HB3 1 1 17 11631 1 1 45 GLN HE21 H 13.194 6.769 -1.896 1.00 . A A . 542 GLN HE21 1 1 17 11632 1 1 45 GLN HE22 H 14.623 7.556 -2.487 1.00 . A A . 542 GLN HE22 1 1 17 11633 1 1 45 GLN HG2 H 11.448 6.290 -3.183 1.00 . A A . 542 GLN HG2 1 1 17 11634 1 1 45 GLN HG3 H 11.381 6.908 -4.832 1.00 . A A . 542 GLN HG3 1 1 17 11635 1 1 45 GLN N N 10.527 7.620 -0.977 1.00 . A A . 542 GLN N 1 1 17 11636 1 1 45 GLN NE2 N 13.686 7.268 -2.588 1.00 . A A . 542 GLN NE2 1 1 17 11637 1 1 45 GLN O O 10.276 11.033 -2.064 1.00 . A A . 542 GLN O 1 1 17 11638 1 1 45 GLN OE1 O 13.602 8.160 -4.642 1.00 . A A . 542 GLN OE1 1 1 17 11639 1 1 46 SER C C 8.058 11.030 1.020 1.00 . A A . 543 SER C 1 1 17 11640 1 1 46 SER CA C 8.018 10.818 -0.492 1.00 . A A . 543 SER CA 1 1 17 11641 1 1 46 SER CB C 6.591 10.529 -0.955 1.00 . A A . 543 SER CB 1 1 17 11642 1 1 46 SER H H 8.685 8.819 -0.577 1.00 . A A . 543 SER H 1 1 17 11643 1 1 46 SER HA H 8.373 11.712 -0.980 1.00 . A A . 543 SER HA 1 1 17 11644 1 1 46 SER HB2 H 6.208 9.670 -0.424 1.00 . A A . 543 SER HB2 1 1 17 11645 1 1 46 SER HB3 H 5.968 11.388 -0.753 1.00 . A A . 543 SER HB3 1 1 17 11646 1 1 46 SER HG H 7.166 10.856 -2.808 1.00 . A A . 543 SER HG 1 1 17 11647 1 1 46 SER N N 8.897 9.725 -0.872 1.00 . A A . 543 SER N 1 1 17 11648 1 1 46 SER O O 7.116 11.558 1.614 1.00 . A A . 543 SER O 1 1 17 11649 1 1 46 SER OG O 6.557 10.258 -2.348 1.00 . A A . 543 SER OG 1 1 17 11650 1 1 47 ALA C C 10.801 10.964 3.398 1.00 . A A . 544 ALA C 1 1 17 11651 1 1 47 ALA CA C 9.331 10.748 3.070 1.00 . A A . 544 ALA CA 1 1 17 11652 1 1 47 ALA CB C 8.787 9.526 3.798 1.00 . A A . 544 ALA CB 1 1 17 11653 1 1 47 ALA H H 9.868 10.189 1.109 1.00 . A A . 544 ALA H 1 1 17 11654 1 1 47 ALA HA H 8.767 11.612 3.393 1.00 . A A . 544 ALA HA 1 1 17 11655 1 1 47 ALA HB1 H 9.333 8.648 3.485 1.00 . A A . 544 ALA HB1 1 1 17 11656 1 1 47 ALA HB2 H 8.900 9.660 4.863 1.00 . A A . 544 ALA HB2 1 1 17 11657 1 1 47 ALA HB3 H 7.741 9.403 3.561 1.00 . A A . 544 ALA HB3 1 1 17 11658 1 1 47 ALA N N 9.154 10.604 1.636 1.00 . A A . 544 ALA N 1 1 17 11659 1 1 47 ALA O O 11.245 12.131 3.391 1.00 . A A . 544 ALA O 1 1 17 11660 1 1 47 ALA OXT O 11.513 9.970 3.638 1.00 . A A . 544 ALA OXT 1 1 17 11661 2 2 1 ZN ZN ZN -5.742 -5.727 -0.886 1.00 . B A . 601 ZN ZN 1 1 17 11662 3 2 1 ZN ZN ZN 5.292 2.728 1.670 1.00 . C A . 602 ZN ZN 1 1 18 11663 1 1 1 GLY C C -15.572 1.939 1.783 1.00 . A A . 498 GLY C 1 1 18 11664 1 1 1 GLY CA C -15.004 2.654 2.990 1.00 . A A . 498 GLY CA 1 1 18 11665 1 1 1 GLY H1 H -16.803 2.966 3.990 1.00 . A A . 498 GLY H1 1 1 18 11666 1 1 1 GLY H2 H -15.445 2.979 5.004 1.00 . A A . 498 GLY H2 1 1 18 11667 1 1 1 GLY H3 H -16.036 1.511 4.390 1.00 . A A . 498 GLY H3 1 1 18 11668 1 1 1 GLY HA2 H -14.891 3.703 2.754 1.00 . A A . 498 GLY HA2 1 1 18 11669 1 1 1 GLY HA3 H -14.034 2.239 3.220 1.00 . A A . 498 GLY HA3 1 1 18 11670 1 1 1 GLY N N -15.879 2.518 4.176 1.00 . A A . 498 GLY N 1 1 18 11671 1 1 1 GLY O O -16.622 2.322 1.265 1.00 . A A . 498 GLY O 1 1 18 11672 1 1 2 ALA C C -15.553 0.886 -1.047 1.00 . A A . 499 ALA C 1 1 18 11673 1 1 2 ALA CA C -15.286 0.067 0.211 1.00 . A A . 499 ALA CA 1 1 18 11674 1 1 2 ALA CB C -16.518 -0.742 0.571 1.00 . A A . 499 ALA CB 1 1 18 11675 1 1 2 ALA H H -14.029 0.665 1.808 1.00 . A A . 499 ALA H 1 1 18 11676 1 1 2 ALA HA H -14.486 -0.627 0.002 1.00 . A A . 499 ALA HA 1 1 18 11677 1 1 2 ALA HB1 H -17.346 -0.073 0.746 1.00 . A A . 499 ALA HB1 1 1 18 11678 1 1 2 ALA HB2 H -16.759 -1.406 -0.246 1.00 . A A . 499 ALA HB2 1 1 18 11679 1 1 2 ALA HB3 H -16.325 -1.320 1.463 1.00 . A A . 499 ALA HB3 1 1 18 11680 1 1 2 ALA N N -14.867 0.898 1.342 1.00 . A A . 499 ALA N 1 1 18 11681 1 1 2 ALA O O -16.343 0.476 -1.898 1.00 . A A . 499 ALA O 1 1 18 11682 1 1 3 MET C C -14.125 4.074 -2.326 1.00 . A A . 500 MET C 1 1 18 11683 1 1 3 MET CA C -15.092 2.891 -2.332 1.00 . A A . 500 MET CA 1 1 18 11684 1 1 3 MET CB C -16.536 3.408 -2.373 1.00 . A A . 500 MET CB 1 1 18 11685 1 1 3 MET CE C -17.266 4.090 -6.421 1.00 . A A . 500 MET CE 1 1 18 11686 1 1 3 MET CG C -16.897 4.096 -3.679 1.00 . A A . 500 MET CG 1 1 18 11687 1 1 3 MET H H -14.229 2.282 -0.491 1.00 . A A . 500 MET H 1 1 18 11688 1 1 3 MET HA H -14.912 2.296 -3.214 1.00 . A A . 500 MET HA 1 1 18 11689 1 1 3 MET HB2 H -17.209 2.576 -2.233 1.00 . A A . 500 MET HB2 1 1 18 11690 1 1 3 MET HB3 H -16.677 4.113 -1.568 1.00 . A A . 500 MET HB3 1 1 18 11691 1 1 3 MET HE1 H -16.582 4.925 -6.470 1.00 . A A . 500 MET HE1 1 1 18 11692 1 1 3 MET HE2 H -17.253 3.555 -7.359 1.00 . A A . 500 MET HE2 1 1 18 11693 1 1 3 MET HE3 H -18.264 4.453 -6.227 1.00 . A A . 500 MET HE3 1 1 18 11694 1 1 3 MET HG2 H -17.914 4.455 -3.613 1.00 . A A . 500 MET HG2 1 1 18 11695 1 1 3 MET HG3 H -16.230 4.932 -3.826 1.00 . A A . 500 MET HG3 1 1 18 11696 1 1 3 MET N N -14.887 2.028 -1.176 1.00 . A A . 500 MET N 1 1 18 11697 1 1 3 MET O O -13.618 4.473 -3.371 1.00 . A A . 500 MET O 1 1 18 11698 1 1 3 MET SD S -16.765 2.991 -5.100 1.00 . A A . 500 MET SD 1 1 18 11699 1 1 4 GLU C C -11.625 5.606 -1.524 1.00 . A A . 501 GLU C 1 1 18 11700 1 1 4 GLU CA C -13.041 5.819 -0.991 1.00 . A A . 501 GLU CA 1 1 18 11701 1 1 4 GLU CB C -12.972 6.224 0.481 1.00 . A A . 501 GLU CB 1 1 18 11702 1 1 4 GLU CD C -11.896 7.689 2.226 1.00 . A A . 501 GLU CD 1 1 18 11703 1 1 4 GLU CG C -12.071 7.418 0.748 1.00 . A A . 501 GLU CG 1 1 18 11704 1 1 4 GLU H H -14.251 4.208 -0.339 1.00 . A A . 501 GLU H 1 1 18 11705 1 1 4 GLU HA H -13.507 6.616 -1.552 1.00 . A A . 501 GLU HA 1 1 18 11706 1 1 4 GLU HB2 H -13.967 6.469 0.823 1.00 . A A . 501 GLU HB2 1 1 18 11707 1 1 4 GLU HB3 H -12.599 5.387 1.054 1.00 . A A . 501 GLU HB3 1 1 18 11708 1 1 4 GLU HG2 H -11.101 7.227 0.314 1.00 . A A . 501 GLU HG2 1 1 18 11709 1 1 4 GLU HG3 H -12.508 8.292 0.284 1.00 . A A . 501 GLU HG3 1 1 18 11710 1 1 4 GLU N N -13.870 4.620 -1.139 1.00 . A A . 501 GLU N 1 1 18 11711 1 1 4 GLU O O -11.052 6.487 -2.168 1.00 . A A . 501 GLU O 1 1 18 11712 1 1 4 GLU OE1 O -11.171 6.919 2.892 1.00 . A A . 501 GLU OE1 1 1 18 11713 1 1 4 GLU OE2 O -12.485 8.669 2.729 1.00 . A A . 501 GLU OE2 1 1 18 11714 1 1 5 GLN C C -9.557 2.795 -2.263 1.00 . A A . 502 GLN C 1 1 18 11715 1 1 5 GLN CA C -9.695 4.156 -1.603 1.00 . A A . 502 GLN CA 1 1 18 11716 1 1 5 GLN CB C -8.830 4.240 -0.343 1.00 . A A . 502 GLN CB 1 1 18 11717 1 1 5 GLN CD C -8.642 3.821 2.134 1.00 . A A . 502 GLN CD 1 1 18 11718 1 1 5 GLN CG C -9.434 3.557 0.871 1.00 . A A . 502 GLN CG 1 1 18 11719 1 1 5 GLN H H -11.632 3.719 -0.881 1.00 . A A . 502 GLN H 1 1 18 11720 1 1 5 GLN HA H -9.350 4.914 -2.290 1.00 . A A . 502 GLN HA 1 1 18 11721 1 1 5 GLN HB2 H -7.875 3.778 -0.547 1.00 . A A . 502 GLN HB2 1 1 18 11722 1 1 5 GLN HB3 H -8.670 5.281 -0.101 1.00 . A A . 502 GLN HB3 1 1 18 11723 1 1 5 GLN HE21 H -9.710 5.463 2.484 1.00 . A A . 502 GLN HE21 1 1 18 11724 1 1 5 GLN HE22 H -8.484 5.093 3.647 1.00 . A A . 502 GLN HE22 1 1 18 11725 1 1 5 GLN HG2 H -10.440 3.922 1.011 1.00 . A A . 502 GLN HG2 1 1 18 11726 1 1 5 GLN HG3 H -9.458 2.492 0.694 1.00 . A A . 502 GLN HG3 1 1 18 11727 1 1 5 GLN N N -11.080 4.433 -1.275 1.00 . A A . 502 GLN N 1 1 18 11728 1 1 5 GLN NE2 N -8.977 4.900 2.824 1.00 . A A . 502 GLN NE2 1 1 18 11729 1 1 5 GLN O O -10.370 1.899 -2.032 1.00 . A A . 502 GLN O 1 1 18 11730 1 1 5 GLN OE1 O -7.735 3.068 2.481 1.00 . A A . 502 GLN OE1 1 1 18 11731 1 1 6 SER C C -7.004 0.745 -3.392 1.00 . A A . 503 SER C 1 1 18 11732 1 1 6 SER CA C -8.320 1.399 -3.799 1.00 . A A . 503 SER CA 1 1 18 11733 1 1 6 SER CB C -8.338 1.651 -5.308 1.00 . A A . 503 SER CB 1 1 18 11734 1 1 6 SER H H -7.914 3.393 -3.227 1.00 . A A . 503 SER H 1 1 18 11735 1 1 6 SER HA H -9.129 0.732 -3.547 1.00 . A A . 503 SER HA 1 1 18 11736 1 1 6 SER HB2 H -7.559 2.355 -5.564 1.00 . A A . 503 SER HB2 1 1 18 11737 1 1 6 SER HB3 H -8.169 0.721 -5.831 1.00 . A A . 503 SER HB3 1 1 18 11738 1 1 6 SER HG H -9.674 3.092 -5.378 1.00 . A A . 503 SER HG 1 1 18 11739 1 1 6 SER N N -8.538 2.643 -3.087 1.00 . A A . 503 SER N 1 1 18 11740 1 1 6 SER O O -5.940 1.351 -3.497 1.00 . A A . 503 SER O 1 1 18 11741 1 1 6 SER OG O -9.585 2.186 -5.716 1.00 . A A . 503 SER OG 1 1 18 11742 1 1 7 CYS C C -5.081 -1.422 -3.852 1.00 . A A . 504 CYS C 1 1 18 11743 1 1 7 CYS CA C -5.913 -1.275 -2.596 1.00 . A A . 504 CYS CA 1 1 18 11744 1 1 7 CYS CB C -6.308 -2.663 -2.060 1.00 . A A . 504 CYS CB 1 1 18 11745 1 1 7 CYS H H -7.984 -0.895 -2.790 1.00 . A A . 504 CYS H 1 1 18 11746 1 1 7 CYS HA H -5.342 -0.754 -1.841 1.00 . A A . 504 CYS HA 1 1 18 11747 1 1 7 CYS HB2 H -6.969 -2.539 -1.214 1.00 . A A . 504 CYS HB2 1 1 18 11748 1 1 7 CYS HB3 H -6.826 -3.204 -2.836 1.00 . A A . 504 CYS HB3 1 1 18 11749 1 1 7 CYS N N -7.091 -0.496 -2.920 1.00 . A A . 504 CYS N 1 1 18 11750 1 1 7 CYS O O -5.580 -1.860 -4.889 1.00 . A A . 504 CYS O 1 1 18 11751 1 1 7 CYS SG S -4.899 -3.692 -1.513 1.00 . A A . 504 CYS SG 1 1 18 11752 1 1 8 VAL C C -2.724 -2.506 -5.396 1.00 . A A . 505 VAL C 1 1 18 11753 1 1 8 VAL CA C -2.941 -1.065 -4.915 1.00 . A A . 505 VAL CA 1 1 18 11754 1 1 8 VAL CB C -1.598 -0.372 -4.591 1.00 . A A . 505 VAL CB 1 1 18 11755 1 1 8 VAL CG1 C -0.748 -1.215 -3.649 1.00 . A A . 505 VAL CG1 1 1 18 11756 1 1 8 VAL CG2 C -0.842 -0.023 -5.865 1.00 . A A . 505 VAL CG2 1 1 18 11757 1 1 8 VAL H H -3.495 -0.658 -2.917 1.00 . A A . 505 VAL H 1 1 18 11758 1 1 8 VAL HA H -3.418 -0.511 -5.710 1.00 . A A . 505 VAL HA 1 1 18 11759 1 1 8 VAL HB H -1.825 0.555 -4.082 1.00 . A A . 505 VAL HB 1 1 18 11760 1 1 8 VAL HG11 H -0.569 -2.183 -4.094 1.00 . A A . 505 VAL HG11 1 1 18 11761 1 1 8 VAL HG12 H 0.195 -0.719 -3.472 1.00 . A A . 505 VAL HG12 1 1 18 11762 1 1 8 VAL HG13 H -1.268 -1.340 -2.710 1.00 . A A . 505 VAL HG13 1 1 18 11763 1 1 8 VAL HG21 H -1.442 0.642 -6.468 1.00 . A A . 505 VAL HG21 1 1 18 11764 1 1 8 VAL HG22 H 0.087 0.465 -5.608 1.00 . A A . 505 VAL HG22 1 1 18 11765 1 1 8 VAL HG23 H -0.634 -0.925 -6.419 1.00 . A A . 505 VAL HG23 1 1 18 11766 1 1 8 VAL N N -3.825 -1.026 -3.767 1.00 . A A . 505 VAL N 1 1 18 11767 1 1 8 VAL O O -2.216 -2.739 -6.495 1.00 . A A . 505 VAL O 1 1 18 11768 1 1 9 ASN C C -4.457 -5.412 -5.342 1.00 . A A . 506 ASN C 1 1 18 11769 1 1 9 ASN CA C -3.071 -4.877 -4.964 1.00 . A A . 506 ASN CA 1 1 18 11770 1 1 9 ASN CB C -2.474 -5.710 -3.823 1.00 . A A . 506 ASN CB 1 1 18 11771 1 1 9 ASN CG C -2.400 -7.191 -4.149 1.00 . A A . 506 ASN CG 1 1 18 11772 1 1 9 ASN H H -3.477 -3.243 -3.686 1.00 . A A . 506 ASN H 1 1 18 11773 1 1 9 ASN HA H -2.426 -4.952 -5.826 1.00 . A A . 506 ASN HA 1 1 18 11774 1 1 9 ASN HB2 H -1.474 -5.359 -3.616 1.00 . A A . 506 ASN HB2 1 1 18 11775 1 1 9 ASN HB3 H -3.084 -5.584 -2.939 1.00 . A A . 506 ASN HB3 1 1 18 11776 1 1 9 ASN HD21 H -4.104 -7.523 -3.182 1.00 . A A . 506 ASN HD21 1 1 18 11777 1 1 9 ASN HD22 H -3.359 -8.909 -3.896 1.00 . A A . 506 ASN HD22 1 1 18 11778 1 1 9 ASN N N -3.137 -3.473 -4.579 1.00 . A A . 506 ASN N 1 1 18 11779 1 1 9 ASN ND2 N -3.385 -7.950 -3.698 1.00 . A A . 506 ASN ND2 1 1 18 11780 1 1 9 ASN O O -4.576 -6.361 -6.118 1.00 . A A . 506 ASN O 1 1 18 11781 1 1 9 ASN OD1 O -1.452 -7.651 -4.783 1.00 . A A . 506 ASN OD1 1 1 18 11782 1 1 10 CYS C C -7.753 -4.243 -5.729 1.00 . A A . 507 CYS C 1 1 18 11783 1 1 10 CYS CA C -6.860 -5.285 -5.048 1.00 . A A . 507 CYS CA 1 1 18 11784 1 1 10 CYS CB C -7.476 -5.718 -3.722 1.00 . A A . 507 CYS CB 1 1 18 11785 1 1 10 CYS H H -5.376 -3.973 -4.297 1.00 . A A . 507 CYS H 1 1 18 11786 1 1 10 CYS HA H -6.787 -6.149 -5.693 1.00 . A A . 507 CYS HA 1 1 18 11787 1 1 10 CYS HB2 H -7.638 -4.845 -3.107 1.00 . A A . 507 CYS HB2 1 1 18 11788 1 1 10 CYS HB3 H -8.423 -6.200 -3.913 1.00 . A A . 507 CYS HB3 1 1 18 11789 1 1 10 CYS N N -5.508 -4.784 -4.829 1.00 . A A . 507 CYS N 1 1 18 11790 1 1 10 CYS O O -7.886 -4.240 -6.952 1.00 . A A . 507 CYS O 1 1 18 11791 1 1 10 CYS SG S -6.442 -6.877 -2.773 1.00 . A A . 507 CYS SG 1 1 18 11792 1 1 11 GLY C C -9.965 -1.587 -4.390 1.00 . A A . 508 GLY C 1 1 18 11793 1 1 11 GLY CA C -9.270 -2.378 -5.480 1.00 . A A . 508 GLY CA 1 1 18 11794 1 1 11 GLY H H -8.151 -3.364 -3.979 1.00 . A A . 508 GLY H 1 1 18 11795 1 1 11 GLY HA2 H -8.725 -1.695 -6.115 1.00 . A A . 508 GLY HA2 1 1 18 11796 1 1 11 GLY HA3 H -10.015 -2.890 -6.071 1.00 . A A . 508 GLY HA3 1 1 18 11797 1 1 11 GLY N N -8.346 -3.357 -4.937 1.00 . A A . 508 GLY N 1 1 18 11798 1 1 11 GLY O O -9.442 -1.475 -3.282 1.00 . A A . 508 GLY O 1 1 18 11799 1 1 12 ARG C C -12.128 -0.766 -2.378 1.00 . A A . 509 ARG C 1 1 18 11800 1 1 12 ARG CA C -11.922 -0.197 -3.790 1.00 . A A . 509 ARG CA 1 1 18 11801 1 1 12 ARG CB C -13.284 0.107 -4.415 1.00 . A A . 509 ARG CB 1 1 18 11802 1 1 12 ARG CD C -15.364 -0.783 -5.510 1.00 . A A . 509 ARG CD 1 1 18 11803 1 1 12 ARG CG C -14.007 -1.131 -4.924 1.00 . A A . 509 ARG CG 1 1 18 11804 1 1 12 ARG CZ C -17.678 -0.610 -4.666 1.00 . A A . 509 ARG CZ 1 1 18 11805 1 1 12 ARG H H -11.517 -1.225 -5.597 1.00 . A A . 509 ARG H 1 1 18 11806 1 1 12 ARG HA H -11.378 0.731 -3.706 1.00 . A A . 509 ARG HA 1 1 18 11807 1 1 12 ARG HB2 H -13.908 0.585 -3.674 1.00 . A A . 509 ARG HB2 1 1 18 11808 1 1 12 ARG HB3 H -13.143 0.784 -5.245 1.00 . A A . 509 ARG HB3 1 1 18 11809 1 1 12 ARG HD2 H -15.255 0.101 -6.123 1.00 . A A . 509 ARG HD2 1 1 18 11810 1 1 12 ARG HD3 H -15.699 -1.606 -6.123 1.00 . A A . 509 ARG HD3 1 1 18 11811 1 1 12 ARG HE H -16.030 -0.280 -3.576 1.00 . A A . 509 ARG HE 1 1 18 11812 1 1 12 ARG HG2 H -13.405 -1.599 -5.688 1.00 . A A . 509 ARG HG2 1 1 18 11813 1 1 12 ARG HG3 H -14.145 -1.819 -4.103 1.00 . A A . 509 ARG HG3 1 1 18 11814 1 1 12 ARG HH11 H -17.533 -0.999 -6.656 1.00 . A A . 509 ARG HH11 1 1 18 11815 1 1 12 ARG HH12 H -19.155 -0.931 -6.025 1.00 . A A . 509 ARG HH12 1 1 18 11816 1 1 12 ARG HH21 H -18.147 -0.181 -2.741 1.00 . A A . 509 ARG HH21 1 1 18 11817 1 1 12 ARG HH22 H -19.506 -0.496 -3.781 1.00 . A A . 509 ARG HH22 1 1 18 11818 1 1 12 ARG N N -11.156 -1.074 -4.695 1.00 . A A . 509 ARG N 1 1 18 11819 1 1 12 ARG NE N -16.362 -0.520 -4.473 1.00 . A A . 509 ARG NE 1 1 18 11820 1 1 12 ARG NH1 N -18.160 -0.870 -5.877 1.00 . A A . 509 ARG NH1 1 1 18 11821 1 1 12 ARG NH2 N -18.510 -0.406 -3.650 1.00 . A A . 509 ARG NH2 1 1 18 11822 1 1 12 ARG O O -12.595 -0.057 -1.490 1.00 . A A . 509 ARG O 1 1 18 11823 1 1 13 GLU C C -10.926 -2.093 0.159 1.00 . A A . 510 GLU C 1 1 18 11824 1 1 13 GLU CA C -11.932 -2.655 -0.862 1.00 . A A . 510 GLU CA 1 1 18 11825 1 1 13 GLU CB C -11.757 -4.172 -0.985 1.00 . A A . 510 GLU CB 1 1 18 11826 1 1 13 GLU CD C -13.896 -4.878 0.150 1.00 . A A . 510 GLU CD 1 1 18 11827 1 1 13 GLU CG C -12.383 -4.952 0.158 1.00 . A A . 510 GLU CG 1 1 18 11828 1 1 13 GLU H H -11.431 -2.547 -2.918 1.00 . A A . 510 GLU H 1 1 18 11829 1 1 13 GLU HA H -12.926 -2.445 -0.514 1.00 . A A . 510 GLU HA 1 1 18 11830 1 1 13 GLU HB2 H -12.209 -4.502 -1.910 1.00 . A A . 510 GLU HB2 1 1 18 11831 1 1 13 GLU HB3 H -10.701 -4.397 -1.011 1.00 . A A . 510 GLU HB3 1 1 18 11832 1 1 13 GLU HG2 H -12.088 -5.987 0.076 1.00 . A A . 510 GLU HG2 1 1 18 11833 1 1 13 GLU HG3 H -12.022 -4.547 1.092 1.00 . A A . 510 GLU HG3 1 1 18 11834 1 1 13 GLU N N -11.785 -2.026 -2.170 1.00 . A A . 510 GLU N 1 1 18 11835 1 1 13 GLU O O -10.957 -2.460 1.332 1.00 . A A . 510 GLU O 1 1 18 11836 1 1 13 GLU OE1 O -14.459 -3.876 0.632 1.00 . A A . 510 GLU OE1 1 1 18 11837 1 1 13 GLU OE2 O -14.534 -5.829 -0.344 1.00 . A A . 510 GLU OE2 1 1 18 11838 1 1 14 ALA C C -9.499 -0.035 1.843 1.00 . A A . 511 ALA C 1 1 18 11839 1 1 14 ALA CA C -8.980 -0.648 0.545 1.00 . A A . 511 ALA CA 1 1 18 11840 1 1 14 ALA CB C -8.193 0.391 -0.223 1.00 . A A . 511 ALA CB 1 1 18 11841 1 1 14 ALA H H -10.091 -0.934 -1.238 1.00 . A A . 511 ALA H 1 1 18 11842 1 1 14 ALA HA H -8.301 -1.451 0.794 1.00 . A A . 511 ALA HA 1 1 18 11843 1 1 14 ALA HB1 H -8.834 1.225 -0.463 1.00 . A A . 511 ALA HB1 1 1 18 11844 1 1 14 ALA HB2 H -7.364 0.734 0.378 1.00 . A A . 511 ALA HB2 1 1 18 11845 1 1 14 ALA HB3 H -7.818 -0.048 -1.137 1.00 . A A . 511 ALA HB3 1 1 18 11846 1 1 14 ALA N N -10.038 -1.210 -0.299 1.00 . A A . 511 ALA N 1 1 18 11847 1 1 14 ALA O O -10.586 0.550 1.896 1.00 . A A . 511 ALA O 1 1 18 11848 1 1 15 MET C C -7.754 0.859 4.929 1.00 . A A . 512 MET C 1 1 18 11849 1 1 15 MET CA C -9.001 0.347 4.209 1.00 . A A . 512 MET CA 1 1 18 11850 1 1 15 MET CB C -9.642 -0.758 5.056 1.00 . A A . 512 MET CB 1 1 18 11851 1 1 15 MET CE C -10.521 -0.838 9.133 1.00 . A A . 512 MET CE 1 1 18 11852 1 1 15 MET CG C -9.903 -0.326 6.494 1.00 . A A . 512 MET CG 1 1 18 11853 1 1 15 MET H H -7.820 -0.599 2.731 1.00 . A A . 512 MET H 1 1 18 11854 1 1 15 MET HA H -9.705 1.161 4.125 1.00 . A A . 512 MET HA 1 1 18 11855 1 1 15 MET HB2 H -10.583 -1.043 4.608 1.00 . A A . 512 MET HB2 1 1 18 11856 1 1 15 MET HB3 H -8.984 -1.614 5.073 1.00 . A A . 512 MET HB3 1 1 18 11857 1 1 15 MET HE1 H -11.205 -0.003 9.108 1.00 . A A . 512 MET HE1 1 1 18 11858 1 1 15 MET HE2 H -10.834 -1.536 9.895 1.00 . A A . 512 MET HE2 1 1 18 11859 1 1 15 MET HE3 H -9.525 -0.484 9.356 1.00 . A A . 512 MET HE3 1 1 18 11860 1 1 15 MET HG2 H -8.978 0.035 6.914 1.00 . A A . 512 MET HG2 1 1 18 11861 1 1 15 MET HG3 H -10.629 0.474 6.486 1.00 . A A . 512 MET HG3 1 1 18 11862 1 1 15 MET N N -8.680 -0.154 2.875 1.00 . A A . 512 MET N 1 1 18 11863 1 1 15 MET O O -7.832 1.773 5.749 1.00 . A A . 512 MET O 1 1 18 11864 1 1 15 MET SD S -10.521 -1.658 7.538 1.00 . A A . 512 MET SD 1 1 18 11865 1 1 16 SER C C -4.295 1.118 4.562 1.00 . A A . 513 SER C 1 1 18 11866 1 1 16 SER CA C -5.410 0.519 5.406 1.00 . A A . 513 SER CA 1 1 18 11867 1 1 16 SER CB C -4.973 -0.798 6.054 1.00 . A A . 513 SER CB 1 1 18 11868 1 1 16 SER H H -6.525 -0.200 3.767 1.00 . A A . 513 SER H 1 1 18 11869 1 1 16 SER HA H -5.674 1.232 6.172 1.00 . A A . 513 SER HA 1 1 18 11870 1 1 16 SER HB2 H -5.812 -1.231 6.578 1.00 . A A . 513 SER HB2 1 1 18 11871 1 1 16 SER HB3 H -4.640 -1.480 5.285 1.00 . A A . 513 SER HB3 1 1 18 11872 1 1 16 SER HG H -3.576 -1.467 7.256 1.00 . A A . 513 SER HG 1 1 18 11873 1 1 16 SER N N -6.599 0.300 4.602 1.00 . A A . 513 SER N 1 1 18 11874 1 1 16 SER O O -4.278 0.977 3.342 1.00 . A A . 513 SER O 1 1 18 11875 1 1 16 SER OG O -3.914 -0.603 6.975 1.00 . A A . 513 SER OG 1 1 18 11876 1 1 17 GLU C C -0.943 1.921 4.951 1.00 . A A . 514 GLU C 1 1 18 11877 1 1 17 GLU CA C -2.294 2.486 4.527 1.00 . A A . 514 GLU CA 1 1 18 11878 1 1 17 GLU CB C -2.365 3.987 4.818 1.00 . A A . 514 GLU CB 1 1 18 11879 1 1 17 GLU CD C -2.749 5.769 6.547 1.00 . A A . 514 GLU CD 1 1 18 11880 1 1 17 GLU CG C -2.337 4.337 6.295 1.00 . A A . 514 GLU CG 1 1 18 11881 1 1 17 GLU H H -3.416 1.842 6.198 1.00 . A A . 514 GLU H 1 1 18 11882 1 1 17 GLU HA H -2.429 2.341 3.464 1.00 . A A . 514 GLU HA 1 1 18 11883 1 1 17 GLU HB2 H -1.525 4.471 4.342 1.00 . A A . 514 GLU HB2 1 1 18 11884 1 1 17 GLU HB3 H -3.278 4.381 4.396 1.00 . A A . 514 GLU HB3 1 1 18 11885 1 1 17 GLU HG2 H -3.016 3.684 6.820 1.00 . A A . 514 GLU HG2 1 1 18 11886 1 1 17 GLU HG3 H -1.334 4.194 6.668 1.00 . A A . 514 GLU HG3 1 1 18 11887 1 1 17 GLU N N -3.378 1.806 5.217 1.00 . A A . 514 GLU N 1 1 18 11888 1 1 17 GLU O O -0.838 1.231 5.969 1.00 . A A . 514 GLU O 1 1 18 11889 1 1 17 GLU OE1 O -1.914 6.678 6.356 1.00 . A A . 514 GLU OE1 1 1 18 11890 1 1 17 GLU OE2 O -3.921 5.992 6.924 1.00 . A A . 514 GLU OE2 1 1 18 11891 1 1 18 CYS C C 2.069 2.745 5.473 1.00 . A A . 515 CYS C 1 1 18 11892 1 1 18 CYS CA C 1.437 1.799 4.464 1.00 . A A . 515 CYS CA 1 1 18 11893 1 1 18 CYS CB C 2.298 1.767 3.189 1.00 . A A . 515 CYS CB 1 1 18 11894 1 1 18 CYS H H -0.079 2.740 3.354 1.00 . A A . 515 CYS H 1 1 18 11895 1 1 18 CYS HA H 1.436 0.826 4.939 1.00 . A A . 515 CYS HA 1 1 18 11896 1 1 18 CYS HB2 H 2.182 0.807 2.705 1.00 . A A . 515 CYS HB2 1 1 18 11897 1 1 18 CYS HB3 H 1.968 2.546 2.518 1.00 . A A . 515 CYS HB3 1 1 18 11898 1 1 18 CYS N N 0.079 2.210 4.160 1.00 . A A . 515 CYS N 1 1 18 11899 1 1 18 CYS O O 2.012 3.965 5.331 1.00 . A A . 515 CYS O 1 1 18 11900 1 1 18 CYS SG S 4.079 2.017 3.502 1.00 . A A . 515 CYS SG 1 1 18 11901 1 1 19 THR C C 4.905 2.859 6.772 1.00 . A A . 516 THR C 1 1 18 11902 1 1 19 THR CA C 3.521 2.873 7.417 1.00 . A A . 516 THR CA 1 1 18 11903 1 1 19 THR CB C 3.587 2.212 8.805 1.00 . A A . 516 THR CB 1 1 18 11904 1 1 19 THR CG2 C 4.212 3.152 9.822 1.00 . A A . 516 THR CG2 1 1 18 11905 1 1 19 THR H H 2.374 1.252 6.772 1.00 . A A . 516 THR H 1 1 18 11906 1 1 19 THR HA H 3.184 3.894 7.524 1.00 . A A . 516 THR HA 1 1 18 11907 1 1 19 THR HB H 4.193 1.322 8.737 1.00 . A A . 516 THR HB 1 1 18 11908 1 1 19 THR HG1 H 1.845 1.302 8.562 1.00 . A A . 516 THR HG1 1 1 18 11909 1 1 19 THR HG21 H 3.630 4.059 9.880 1.00 . A A . 516 THR HG21 1 1 18 11910 1 1 19 THR HG22 H 4.228 2.674 10.791 1.00 . A A . 516 THR HG22 1 1 18 11911 1 1 19 THR HG23 H 5.222 3.388 9.523 1.00 . A A . 516 THR HG23 1 1 18 11912 1 1 19 THR N N 2.603 2.172 6.550 1.00 . A A . 516 THR N 1 1 18 11913 1 1 19 THR O O 5.476 1.793 6.530 1.00 . A A . 516 THR O 1 1 18 11914 1 1 19 THR OG1 O 2.267 1.849 9.240 1.00 . A A . 516 THR OG1 1 1 18 11915 1 1 20 GLY C C 6.480 5.189 4.662 1.00 . A A . 517 GLY C 1 1 18 11916 1 1 20 GLY CA C 6.648 4.132 5.719 1.00 . A A . 517 GLY CA 1 1 18 11917 1 1 20 GLY H H 5.040 4.836 6.902 1.00 . A A . 517 GLY H 1 1 18 11918 1 1 20 GLY HA2 H 7.477 4.395 6.359 1.00 . A A . 517 GLY HA2 1 1 18 11919 1 1 20 GLY HA3 H 6.846 3.184 5.243 1.00 . A A . 517 GLY HA3 1 1 18 11920 1 1 20 GLY N N 5.443 4.029 6.515 1.00 . A A . 517 GLY N 1 1 18 11921 1 1 20 GLY O O 7.327 6.063 4.496 1.00 . A A . 517 GLY O 1 1 18 11922 1 1 21 CYS C C 3.429 6.238 3.117 1.00 . A A . 518 CYS C 1 1 18 11923 1 1 21 CYS CA C 4.941 6.181 3.090 1.00 . A A . 518 CYS CA 1 1 18 11924 1 1 21 CYS CB C 5.421 5.973 1.657 1.00 . A A . 518 CYS CB 1 1 18 11925 1 1 21 CYS H H 4.812 4.295 4.016 1.00 . A A . 518 CYS H 1 1 18 11926 1 1 21 CYS HA H 5.335 7.104 3.489 1.00 . A A . 518 CYS HA 1 1 18 11927 1 1 21 CYS HB2 H 5.281 6.888 1.100 1.00 . A A . 518 CYS HB2 1 1 18 11928 1 1 21 CYS HB3 H 6.469 5.714 1.666 1.00 . A A . 518 CYS HB3 1 1 18 11929 1 1 21 CYS N N 5.370 5.105 3.950 1.00 . A A . 518 CYS N 1 1 18 11930 1 1 21 CYS O O 2.765 5.210 3.164 1.00 . A A . 518 CYS O 1 1 18 11931 1 1 21 CYS SG S 4.528 4.649 0.782 1.00 . A A . 518 CYS SG 1 1 18 11932 1 1 22 HIS C C 0.947 7.981 1.714 1.00 . A A . 519 HIS C 1 1 18 11933 1 1 22 HIS CA C 1.437 7.560 3.084 1.00 . A A . 519 HIS CA 1 1 18 11934 1 1 22 HIS CB C 1.006 8.557 4.164 1.00 . A A . 519 HIS CB 1 1 18 11935 1 1 22 HIS CD2 C 2.577 8.322 6.222 1.00 . A A . 519 HIS CD2 1 1 18 11936 1 1 22 HIS CE1 C 1.220 7.220 7.544 1.00 . A A . 519 HIS CE1 1 1 18 11937 1 1 22 HIS CG C 1.412 8.143 5.552 1.00 . A A . 519 HIS CG 1 1 18 11938 1 1 22 HIS H H 3.445 8.222 2.990 1.00 . A A . 519 HIS H 1 1 18 11939 1 1 22 HIS HA H 1.020 6.590 3.315 1.00 . A A . 519 HIS HA 1 1 18 11940 1 1 22 HIS HB2 H 1.458 9.517 3.959 1.00 . A A . 519 HIS HB2 1 1 18 11941 1 1 22 HIS HB3 H -0.068 8.657 4.147 1.00 . A A . 519 HIS HB3 1 1 18 11942 1 1 22 HIS HD1 H -0.345 7.158 6.217 1.00 . A A . 519 HIS HD1 1 1 18 11943 1 1 22 HIS HD2 H 3.456 8.835 5.856 1.00 . A A . 519 HIS HD2 1 1 18 11944 1 1 22 HIS HE1 H 0.815 6.705 8.404 1.00 . A A . 519 HIS HE1 1 1 18 11945 1 1 22 HIS HE2 H 3.104 7.731 8.175 1.00 . A A . 519 HIS HE2 1 1 18 11946 1 1 22 HIS N N 2.878 7.423 3.060 1.00 . A A . 519 HIS N 1 1 18 11947 1 1 22 HIS ND1 N 0.585 7.449 6.410 1.00 . A A . 519 HIS ND1 1 1 18 11948 1 1 22 HIS NE2 N 2.429 7.737 7.456 1.00 . A A . 519 HIS NE2 1 1 18 11949 1 1 22 HIS O O 0.025 8.782 1.584 1.00 . A A . 519 HIS O 1 1 18 11950 1 1 23 LYS C C 0.344 6.725 -1.310 1.00 . A A . 520 LYS C 1 1 18 11951 1 1 23 LYS CA C 1.255 7.782 -0.688 1.00 . A A . 520 LYS CA 1 1 18 11952 1 1 23 LYS CB C 2.533 7.948 -1.530 1.00 . A A . 520 LYS CB 1 1 18 11953 1 1 23 LYS CD C 4.476 6.834 -2.711 1.00 . A A . 520 LYS CD 1 1 18 11954 1 1 23 LYS CE C 4.351 7.825 -3.861 1.00 . A A . 520 LYS CE 1 1 18 11955 1 1 23 LYS CG C 3.155 6.633 -1.979 1.00 . A A . 520 LYS CG 1 1 18 11956 1 1 23 LYS H H 2.311 6.788 0.849 1.00 . A A . 520 LYS H 1 1 18 11957 1 1 23 LYS HA H 0.726 8.723 -0.668 1.00 . A A . 520 LYS HA 1 1 18 11958 1 1 23 LYS HB2 H 2.295 8.525 -2.411 1.00 . A A . 520 LYS HB2 1 1 18 11959 1 1 23 LYS HB3 H 3.265 8.487 -0.946 1.00 . A A . 520 LYS HB3 1 1 18 11960 1 1 23 LYS HD2 H 5.208 7.206 -2.012 1.00 . A A . 520 LYS HD2 1 1 18 11961 1 1 23 LYS HD3 H 4.805 5.878 -3.105 1.00 . A A . 520 LYS HD3 1 1 18 11962 1 1 23 LYS HE2 H 4.045 8.780 -3.460 1.00 . A A . 520 LYS HE2 1 1 18 11963 1 1 23 LYS HE3 H 5.317 7.929 -4.333 1.00 . A A . 520 LYS HE3 1 1 18 11964 1 1 23 LYS HG2 H 3.330 6.015 -1.111 1.00 . A A . 520 LYS HG2 1 1 18 11965 1 1 23 LYS HG3 H 2.463 6.136 -2.640 1.00 . A A . 520 LYS HG3 1 1 18 11966 1 1 23 LYS HZ1 H 3.561 6.419 -5.201 1.00 . A A . 520 LYS HZ1 1 1 18 11967 1 1 23 LYS HZ2 H 2.391 7.423 -4.490 1.00 . A A . 520 LYS HZ2 1 1 18 11968 1 1 23 LYS HZ3 H 3.396 8.023 -5.711 1.00 . A A . 520 LYS HZ3 1 1 18 11969 1 1 23 LYS N N 1.588 7.434 0.684 1.00 . A A . 520 LYS N 1 1 18 11970 1 1 23 LYS NZ N 3.356 7.392 -4.883 1.00 . A A . 520 LYS NZ 1 1 18 11971 1 1 23 LYS O O -0.401 7.014 -2.243 1.00 . A A . 520 LYS O 1 1 18 11972 1 1 24 VAL C C -1.314 3.822 -0.265 1.00 . A A . 521 VAL C 1 1 18 11973 1 1 24 VAL CA C -0.411 4.410 -1.337 1.00 . A A . 521 VAL CA 1 1 18 11974 1 1 24 VAL CB C 0.449 3.270 -1.928 1.00 . A A . 521 VAL CB 1 1 18 11975 1 1 24 VAL CG1 C 1.175 3.726 -3.183 1.00 . A A . 521 VAL CG1 1 1 18 11976 1 1 24 VAL CG2 C 1.441 2.758 -0.894 1.00 . A A . 521 VAL CG2 1 1 18 11977 1 1 24 VAL H H 0.967 5.316 -0.014 1.00 . A A . 521 VAL H 1 1 18 11978 1 1 24 VAL HA H -1.028 4.817 -2.127 1.00 . A A . 521 VAL HA 1 1 18 11979 1 1 24 VAL HB H -0.208 2.456 -2.197 1.00 . A A . 521 VAL HB 1 1 18 11980 1 1 24 VAL HG11 H 0.464 4.141 -3.882 1.00 . A A . 521 VAL HG11 1 1 18 11981 1 1 24 VAL HG12 H 1.903 4.477 -2.923 1.00 . A A . 521 VAL HG12 1 1 18 11982 1 1 24 VAL HG13 H 1.677 2.883 -3.636 1.00 . A A . 521 VAL HG13 1 1 18 11983 1 1 24 VAL HG21 H 0.906 2.379 -0.037 1.00 . A A . 521 VAL HG21 1 1 18 11984 1 1 24 VAL HG22 H 2.037 1.967 -1.326 1.00 . A A . 521 VAL HG22 1 1 18 11985 1 1 24 VAL HG23 H 2.086 3.567 -0.586 1.00 . A A . 521 VAL HG23 1 1 18 11986 1 1 24 VAL N N 0.397 5.498 -0.795 1.00 . A A . 521 VAL N 1 1 18 11987 1 1 24 VAL O O -1.095 4.028 0.932 1.00 . A A . 521 VAL O 1 1 18 11988 1 1 25 ASN C C -3.461 0.999 -0.141 1.00 . A A . 522 ASN C 1 1 18 11989 1 1 25 ASN CA C -3.251 2.459 0.223 1.00 . A A . 522 ASN CA 1 1 18 11990 1 1 25 ASN CB C -4.601 3.184 0.287 1.00 . A A . 522 ASN CB 1 1 18 11991 1 1 25 ASN CG C -4.870 4.065 -0.912 1.00 . A A . 522 ASN CG 1 1 18 11992 1 1 25 ASN H H -2.462 2.984 -1.670 1.00 . A A . 522 ASN H 1 1 18 11993 1 1 25 ASN HA H -2.796 2.510 1.202 1.00 . A A . 522 ASN HA 1 1 18 11994 1 1 25 ASN HB2 H -5.391 2.449 0.345 1.00 . A A . 522 ASN HB2 1 1 18 11995 1 1 25 ASN HB3 H -4.627 3.799 1.174 1.00 . A A . 522 ASN HB3 1 1 18 11996 1 1 25 ASN HD21 H -5.593 2.515 -1.919 1.00 . A A . 522 ASN HD21 1 1 18 11997 1 1 25 ASN HD22 H -5.602 4.037 -2.755 1.00 . A A . 522 ASN HD22 1 1 18 11998 1 1 25 ASN N N -2.333 3.103 -0.701 1.00 . A A . 522 ASN N 1 1 18 11999 1 1 25 ASN ND2 N -5.405 3.482 -1.966 1.00 . A A . 522 ASN ND2 1 1 18 12000 1 1 25 ASN O O -3.382 0.609 -1.309 1.00 . A A . 522 ASN O 1 1 18 12001 1 1 25 ASN OD1 O -4.582 5.261 -0.892 1.00 . A A . 522 ASN OD1 1 1 18 12002 1 1 26 TYR C C -5.300 -1.547 1.366 1.00 . A A . 523 TYR C 1 1 18 12003 1 1 26 TYR CA C -3.958 -1.211 0.733 1.00 . A A . 523 TYR CA 1 1 18 12004 1 1 26 TYR CB C -2.851 -2.020 1.416 1.00 . A A . 523 TYR CB 1 1 18 12005 1 1 26 TYR CD1 C -0.670 -0.748 1.374 1.00 . A A . 523 TYR CD1 1 1 18 12006 1 1 26 TYR CD2 C -0.928 -2.584 -0.121 1.00 . A A . 523 TYR CD2 1 1 18 12007 1 1 26 TYR CE1 C 0.607 -0.533 0.896 1.00 . A A . 523 TYR CE1 1 1 18 12008 1 1 26 TYR CE2 C 0.353 -2.376 -0.602 1.00 . A A . 523 TYR CE2 1 1 18 12009 1 1 26 TYR CG C -1.459 -1.776 0.874 1.00 . A A . 523 TYR CG 1 1 18 12010 1 1 26 TYR CZ C 1.114 -1.349 -0.092 1.00 . A A . 523 TYR CZ 1 1 18 12011 1 1 26 TYR H H -3.820 0.621 1.769 1.00 . A A . 523 TYR H 1 1 18 12012 1 1 26 TYR HA H -3.988 -1.442 -0.322 1.00 . A A . 523 TYR HA 1 1 18 12013 1 1 26 TYR HB2 H -2.838 -1.775 2.465 1.00 . A A . 523 TYR HB2 1 1 18 12014 1 1 26 TYR HB3 H -3.068 -3.073 1.303 1.00 . A A . 523 TYR HB3 1 1 18 12015 1 1 26 TYR HD1 H -1.528 -3.387 -0.522 1.00 . A A . 523 TYR HD1 1 1 18 12016 1 1 26 TYR HD2 H -1.069 -0.109 2.147 1.00 . A A . 523 TYR HD2 1 1 18 12017 1 1 26 TYR HE1 H 0.748 -3.017 -1.378 1.00 . A A . 523 TYR HE1 1 1 18 12018 1 1 26 TYR HE2 H 1.204 0.273 1.297 1.00 . A A . 523 TYR HE2 1 1 18 12019 1 1 26 TYR HH H 2.446 -1.388 -1.499 1.00 . A A . 523 TYR HH 1 1 18 12020 1 1 26 TYR N N -3.722 0.211 0.880 1.00 . A A . 523 TYR N 1 1 18 12021 1 1 26 TYR O O -6.017 -0.654 1.825 1.00 . A A . 523 TYR O 1 1 18 12022 1 1 26 TYR OH O 2.391 -1.139 -0.562 1.00 . A A . 523 TYR OH 1 1 18 12023 1 1 27 CYS C C -6.647 -4.068 3.243 1.00 . A A . 524 CYS C 1 1 18 12024 1 1 27 CYS CA C -6.901 -3.220 2.007 1.00 . A A . 524 CYS CA 1 1 18 12025 1 1 27 CYS CB C -7.749 -3.985 0.985 1.00 . A A . 524 CYS CB 1 1 18 12026 1 1 27 CYS H H -4.994 -3.504 1.140 1.00 . A A . 524 CYS H 1 1 18 12027 1 1 27 CYS HA H -7.425 -2.324 2.302 1.00 . A A . 524 CYS HA 1 1 18 12028 1 1 27 CYS HB2 H -8.772 -4.012 1.331 1.00 . A A . 524 CYS HB2 1 1 18 12029 1 1 27 CYS HB3 H -7.713 -3.465 0.039 1.00 . A A . 524 CYS HB3 1 1 18 12030 1 1 27 CYS N N -5.631 -2.820 1.432 1.00 . A A . 524 CYS N 1 1 18 12031 1 1 27 CYS O O -7.398 -4.021 4.218 1.00 . A A . 524 CYS O 1 1 18 12032 1 1 27 CYS SG S -7.226 -5.705 0.692 1.00 . A A . 524 CYS SG 1 1 18 12033 1 1 28 SER C C -3.668 -5.610 4.495 1.00 . A A . 525 SER C 1 1 18 12034 1 1 28 SER CA C -5.176 -5.694 4.289 1.00 . A A . 525 SER CA 1 1 18 12035 1 1 28 SER CB C -5.585 -7.128 3.959 1.00 . A A . 525 SER CB 1 1 18 12036 1 1 28 SER H H -4.981 -4.796 2.412 1.00 . A A . 525 SER H 1 1 18 12037 1 1 28 SER HA H -5.682 -5.368 5.186 1.00 . A A . 525 SER HA 1 1 18 12038 1 1 28 SER HB2 H -4.958 -7.505 3.164 1.00 . A A . 525 SER HB2 1 1 18 12039 1 1 28 SER HB3 H -5.465 -7.746 4.836 1.00 . A A . 525 SER HB3 1 1 18 12040 1 1 28 SER HG H -7.037 -6.698 2.703 1.00 . A A . 525 SER HG 1 1 18 12041 1 1 28 SER N N -5.558 -4.820 3.201 1.00 . A A . 525 SER N 1 1 18 12042 1 1 28 SER O O -2.955 -5.102 3.626 1.00 . A A . 525 SER O 1 1 18 12043 1 1 28 SER OG O -6.939 -7.185 3.538 1.00 . A A . 525 SER OG 1 1 18 12044 1 1 29 THR C C -0.995 -7.015 4.981 1.00 . A A . 526 THR C 1 1 18 12045 1 1 29 THR CA C -1.752 -6.064 5.909 1.00 . A A . 526 THR CA 1 1 18 12046 1 1 29 THR CB C -1.477 -6.426 7.383 1.00 . A A . 526 THR CB 1 1 18 12047 1 1 29 THR CG2 C -0.037 -6.111 7.774 1.00 . A A . 526 THR CG2 1 1 18 12048 1 1 29 THR H H -3.792 -6.498 6.289 1.00 . A A . 526 THR H 1 1 18 12049 1 1 29 THR HA H -1.405 -5.055 5.735 1.00 . A A . 526 THR HA 1 1 18 12050 1 1 29 THR HB H -1.653 -7.483 7.521 1.00 . A A . 526 THR HB 1 1 18 12051 1 1 29 THR HG1 H -3.171 -6.215 8.379 1.00 . A A . 526 THR HG1 1 1 18 12052 1 1 29 THR HG21 H 0.147 -5.054 7.649 1.00 . A A . 526 THR HG21 1 1 18 12053 1 1 29 THR HG22 H 0.126 -6.386 8.807 1.00 . A A . 526 THR HG22 1 1 18 12054 1 1 29 THR HG23 H 0.638 -6.671 7.144 1.00 . A A . 526 THR HG23 1 1 18 12055 1 1 29 THR N N -3.179 -6.102 5.624 1.00 . A A . 526 THR N 1 1 18 12056 1 1 29 THR O O 0.184 -6.811 4.685 1.00 . A A . 526 THR O 1 1 18 12057 1 1 29 THR OG1 O -2.371 -5.687 8.226 1.00 . A A . 526 THR OG1 1 1 18 12058 1 1 30 PHE C C -0.650 -8.320 2.291 1.00 . A A . 527 PHE C 1 1 18 12059 1 1 30 PHE CA C -1.122 -9.001 3.573 1.00 . A A . 527 PHE CA 1 1 18 12060 1 1 30 PHE CB C -2.153 -10.089 3.247 1.00 . A A . 527 PHE CB 1 1 18 12061 1 1 30 PHE CD1 C -0.799 -11.897 2.143 1.00 . A A . 527 PHE CD1 1 1 18 12062 1 1 30 PHE CD2 C -2.454 -10.770 0.851 1.00 . A A . 527 PHE CD2 1 1 18 12063 1 1 30 PHE CE1 C -0.465 -12.670 1.047 1.00 . A A . 527 PHE CE1 1 1 18 12064 1 1 30 PHE CE2 C -2.124 -11.536 -0.249 1.00 . A A . 527 PHE CE2 1 1 18 12065 1 1 30 PHE CG C -1.794 -10.939 2.057 1.00 . A A . 527 PHE CG 1 1 18 12066 1 1 30 PHE CZ C -1.130 -12.490 -0.150 1.00 . A A . 527 PHE CZ 1 1 18 12067 1 1 30 PHE H H -2.622 -8.157 4.791 1.00 . A A . 527 PHE H 1 1 18 12068 1 1 30 PHE HA H -0.272 -9.459 4.056 1.00 . A A . 527 PHE HA 1 1 18 12069 1 1 30 PHE HB2 H -2.255 -10.742 4.100 1.00 . A A . 527 PHE HB2 1 1 18 12070 1 1 30 PHE HB3 H -3.105 -9.621 3.043 1.00 . A A . 527 PHE HB3 1 1 18 12071 1 1 30 PHE HD1 H -3.231 -10.025 0.775 1.00 . A A . 527 PHE HD1 1 1 18 12072 1 1 30 PHE HD2 H -0.279 -12.039 3.080 1.00 . A A . 527 PHE HD2 1 1 18 12073 1 1 30 PHE HE1 H -2.645 -11.393 -1.183 1.00 . A A . 527 PHE HE1 1 1 18 12074 1 1 30 PHE HE2 H 0.313 -13.413 1.129 1.00 . A A . 527 PHE HE2 1 1 18 12075 1 1 30 PHE HZ H -0.869 -13.089 -1.009 1.00 . A A . 527 PHE HZ 1 1 18 12076 1 1 30 PHE N N -1.697 -8.035 4.499 1.00 . A A . 527 PHE N 1 1 18 12077 1 1 30 PHE O O 0.478 -8.543 1.842 1.00 . A A . 527 PHE O 1 1 18 12078 1 1 31 CYS C C 0.018 -5.859 0.701 1.00 . A A . 528 CYS C 1 1 18 12079 1 1 31 CYS CA C -1.166 -6.788 0.481 1.00 . A A . 528 CYS CA 1 1 18 12080 1 1 31 CYS CB C -2.372 -6.016 -0.040 1.00 . A A . 528 CYS CB 1 1 18 12081 1 1 31 CYS H H -2.373 -7.317 2.129 1.00 . A A . 528 CYS H 1 1 18 12082 1 1 31 CYS HA H -0.884 -7.552 -0.227 1.00 . A A . 528 CYS HA 1 1 18 12083 1 1 31 CYS HB2 H -2.559 -5.170 0.605 1.00 . A A . 528 CYS HB2 1 1 18 12084 1 1 31 CYS HB3 H -2.169 -5.669 -1.041 1.00 . A A . 528 CYS HB3 1 1 18 12085 1 1 31 CYS N N -1.500 -7.475 1.717 1.00 . A A . 528 CYS N 1 1 18 12086 1 1 31 CYS O O 0.869 -5.710 -0.173 1.00 . A A . 528 CYS O 1 1 18 12087 1 1 31 CYS SG S -3.882 -7.020 -0.093 1.00 . A A . 528 CYS SG 1 1 18 12088 1 1 32 GLN C C 2.495 -5.137 2.176 1.00 . A A . 529 GLN C 1 1 18 12089 1 1 32 GLN CA C 1.173 -4.373 2.237 1.00 . A A . 529 GLN CA 1 1 18 12090 1 1 32 GLN CB C 0.960 -3.796 3.648 1.00 . A A . 529 GLN CB 1 1 18 12091 1 1 32 GLN CD C 2.601 -1.926 4.031 1.00 . A A . 529 GLN CD 1 1 18 12092 1 1 32 GLN CG C 2.239 -3.356 4.337 1.00 . A A . 529 GLN CG 1 1 18 12093 1 1 32 GLN H H -0.625 -5.440 2.550 1.00 . A A . 529 GLN H 1 1 18 12094 1 1 32 GLN HA H 1.186 -3.568 1.517 1.00 . A A . 529 GLN HA 1 1 18 12095 1 1 32 GLN HB2 H 0.313 -2.929 3.579 1.00 . A A . 529 GLN HB2 1 1 18 12096 1 1 32 GLN HB3 H 0.482 -4.545 4.264 1.00 . A A . 529 GLN HB3 1 1 18 12097 1 1 32 GLN HE21 H 3.617 -2.486 2.418 1.00 . A A . 529 GLN HE21 1 1 18 12098 1 1 32 GLN HE22 H 3.587 -0.785 2.742 1.00 . A A . 529 GLN HE22 1 1 18 12099 1 1 32 GLN HG2 H 2.113 -3.459 5.404 1.00 . A A . 529 GLN HG2 1 1 18 12100 1 1 32 GLN HG3 H 3.046 -3.995 4.008 1.00 . A A . 529 GLN HG3 1 1 18 12101 1 1 32 GLN N N 0.074 -5.257 1.885 1.00 . A A . 529 GLN N 1 1 18 12102 1 1 32 GLN NE2 N 3.342 -1.711 2.958 1.00 . A A . 529 GLN NE2 1 1 18 12103 1 1 32 GLN O O 3.473 -4.670 1.590 1.00 . A A . 529 GLN O 1 1 18 12104 1 1 32 GLN OE1 O 2.209 -1.019 4.757 1.00 . A A . 529 GLN OE1 1 1 18 12105 1 1 33 ARG C C 4.109 -7.763 1.573 1.00 . A A . 530 ARG C 1 1 18 12106 1 1 33 ARG CA C 3.723 -7.113 2.904 1.00 . A A . 530 ARG CA 1 1 18 12107 1 1 33 ARG CB C 3.575 -8.161 4.003 1.00 . A A . 530 ARG CB 1 1 18 12108 1 1 33 ARG CD C 2.978 -8.577 6.413 1.00 . A A . 530 ARG CD 1 1 18 12109 1 1 33 ARG CG C 3.457 -7.558 5.393 1.00 . A A . 530 ARG CG 1 1 18 12110 1 1 33 ARG CZ C 3.864 -10.562 7.588 1.00 . A A . 530 ARG CZ 1 1 18 12111 1 1 33 ARG H H 1.675 -6.656 3.191 1.00 . A A . 530 ARG H 1 1 18 12112 1 1 33 ARG HA H 4.502 -6.419 3.173 1.00 . A A . 530 ARG HA 1 1 18 12113 1 1 33 ARG HB2 H 2.685 -8.744 3.810 1.00 . A A . 530 ARG HB2 1 1 18 12114 1 1 33 ARG HB3 H 4.435 -8.814 3.987 1.00 . A A . 530 ARG HB3 1 1 18 12115 1 1 33 ARG HD2 H 2.867 -8.085 7.366 1.00 . A A . 530 ARG HD2 1 1 18 12116 1 1 33 ARG HD3 H 2.020 -8.958 6.093 1.00 . A A . 530 ARG HD3 1 1 18 12117 1 1 33 ARG HE H 4.605 -9.812 5.875 1.00 . A A . 530 ARG HE 1 1 18 12118 1 1 33 ARG HG2 H 4.425 -7.187 5.696 1.00 . A A . 530 ARG HG2 1 1 18 12119 1 1 33 ARG HG3 H 2.752 -6.740 5.356 1.00 . A A . 530 ARG HG3 1 1 18 12120 1 1 33 ARG HH11 H 2.244 -9.727 8.481 1.00 . A A . 530 ARG HH11 1 1 18 12121 1 1 33 ARG HH12 H 2.918 -11.107 9.291 1.00 . A A . 530 ARG HH12 1 1 18 12122 1 1 33 ARG HH21 H 5.466 -11.643 6.971 1.00 . A A . 530 ARG HH21 1 1 18 12123 1 1 33 ARG HH22 H 4.704 -12.191 8.436 1.00 . A A . 530 ARG HH22 1 1 18 12124 1 1 33 ARG N N 2.509 -6.314 2.798 1.00 . A A . 530 ARG N 1 1 18 12125 1 1 33 ARG NE N 3.906 -9.699 6.568 1.00 . A A . 530 ARG NE 1 1 18 12126 1 1 33 ARG NH1 N 2.932 -10.456 8.525 1.00 . A A . 530 ARG NH1 1 1 18 12127 1 1 33 ARG NH2 N 4.749 -11.540 7.671 1.00 . A A . 530 ARG NH2 1 1 18 12128 1 1 33 ARG O O 5.291 -7.912 1.277 1.00 . A A . 530 ARG O 1 1 18 12129 1 1 34 LYS C C 3.926 -7.789 -1.522 1.00 . A A . 531 LYS C 1 1 18 12130 1 1 34 LYS CA C 3.415 -8.806 -0.505 1.00 . A A . 531 LYS CA 1 1 18 12131 1 1 34 LYS CB C 2.192 -9.578 -1.041 1.00 . A A . 531 LYS CB 1 1 18 12132 1 1 34 LYS CD C 1.001 -8.090 -2.725 1.00 . A A . 531 LYS CD 1 1 18 12133 1 1 34 LYS CE C 1.177 -9.114 -3.838 1.00 . A A . 531 LYS CE 1 1 18 12134 1 1 34 LYS CG C 0.949 -8.745 -1.347 1.00 . A A . 531 LYS CG 1 1 18 12135 1 1 34 LYS H H 2.189 -8.060 1.072 1.00 . A A . 531 LYS H 1 1 18 12136 1 1 34 LYS HA H 4.211 -9.517 -0.324 1.00 . A A . 531 LYS HA 1 1 18 12137 1 1 34 LYS HB2 H 2.480 -10.081 -1.948 1.00 . A A . 531 LYS HB2 1 1 18 12138 1 1 34 LYS HB3 H 1.917 -10.319 -0.307 1.00 . A A . 531 LYS HB3 1 1 18 12139 1 1 34 LYS HD2 H 0.079 -7.553 -2.890 1.00 . A A . 531 LYS HD2 1 1 18 12140 1 1 34 LYS HD3 H 1.832 -7.397 -2.750 1.00 . A A . 531 LYS HD3 1 1 18 12141 1 1 34 LYS HE2 H 2.127 -9.608 -3.706 1.00 . A A . 531 LYS HE2 1 1 18 12142 1 1 34 LYS HE3 H 0.382 -9.844 -3.768 1.00 . A A . 531 LYS HE3 1 1 18 12143 1 1 34 LYS HG2 H 0.083 -9.389 -1.306 1.00 . A A . 531 LYS HG2 1 1 18 12144 1 1 34 LYS HG3 H 0.856 -7.973 -0.597 1.00 . A A . 531 LYS HG3 1 1 18 12145 1 1 34 LYS HZ1 H 1.868 -7.749 -5.263 1.00 . A A . 531 LYS HZ1 1 1 18 12146 1 1 34 LYS HZ2 H 1.316 -9.205 -5.924 1.00 . A A . 531 LYS HZ2 1 1 18 12147 1 1 34 LYS HZ3 H 0.206 -8.054 -5.359 1.00 . A A . 531 LYS HZ3 1 1 18 12148 1 1 34 LYS N N 3.122 -8.167 0.777 1.00 . A A . 531 LYS N 1 1 18 12149 1 1 34 LYS NZ N 1.142 -8.486 -5.188 1.00 . A A . 531 LYS NZ 1 1 18 12150 1 1 34 LYS O O 4.815 -8.085 -2.318 1.00 . A A . 531 LYS O 1 1 18 12151 1 1 35 ASP C C 5.165 -4.996 -1.977 1.00 . A A . 532 ASP C 1 1 18 12152 1 1 35 ASP CA C 3.781 -5.507 -2.369 1.00 . A A . 532 ASP CA 1 1 18 12153 1 1 35 ASP CB C 2.755 -4.373 -2.304 1.00 . A A . 532 ASP CB 1 1 18 12154 1 1 35 ASP CG C 2.978 -3.299 -3.352 1.00 . A A . 532 ASP CG 1 1 18 12155 1 1 35 ASP H H 2.613 -6.437 -0.865 1.00 . A A . 532 ASP H 1 1 18 12156 1 1 35 ASP HA H 3.818 -5.884 -3.381 1.00 . A A . 532 ASP HA 1 1 18 12157 1 1 35 ASP HB2 H 1.766 -4.783 -2.448 1.00 . A A . 532 ASP HB2 1 1 18 12158 1 1 35 ASP HB3 H 2.806 -3.912 -1.328 1.00 . A A . 532 ASP HB3 1 1 18 12159 1 1 35 ASP N N 3.363 -6.594 -1.484 1.00 . A A . 532 ASP N 1 1 18 12160 1 1 35 ASP O O 5.849 -4.356 -2.770 1.00 . A A . 532 ASP O 1 1 18 12161 1 1 35 ASP OD1 O 2.780 -3.580 -4.556 1.00 . A A . 532 ASP OD1 1 1 18 12162 1 1 35 ASP OD2 O 3.311 -2.160 -2.973 1.00 . A A . 532 ASP OD2 1 1 18 12163 1 1 36 TRP C C 8.063 -5.181 -1.051 1.00 . A A . 533 TRP C 1 1 18 12164 1 1 36 TRP CA C 6.840 -4.877 -0.184 1.00 . A A . 533 TRP CA 1 1 18 12165 1 1 36 TRP CB C 7.046 -5.473 1.211 1.00 . A A . 533 TRP CB 1 1 18 12166 1 1 36 TRP CD1 C 9.334 -5.400 2.367 1.00 . A A . 533 TRP CD1 1 1 18 12167 1 1 36 TRP CD2 C 8.241 -3.446 2.357 1.00 . A A . 533 TRP CD2 1 1 18 12168 1 1 36 TRP CE2 C 9.477 -3.263 3.001 1.00 . A A . 533 TRP CE2 1 1 18 12169 1 1 36 TRP CE3 C 7.381 -2.351 2.229 1.00 . A A . 533 TRP CE3 1 1 18 12170 1 1 36 TRP CG C 8.169 -4.820 1.956 1.00 . A A . 533 TRP CG 1 1 18 12171 1 1 36 TRP CH2 C 9.015 -0.979 3.378 1.00 . A A . 533 TRP CH2 1 1 18 12172 1 1 36 TRP CZ2 C 9.875 -2.034 3.517 1.00 . A A . 533 TRP CZ2 1 1 18 12173 1 1 36 TRP CZ3 C 7.776 -1.130 2.744 1.00 . A A . 533 TRP CZ3 1 1 18 12174 1 1 36 TRP H H 5.052 -6.005 -0.260 1.00 . A A . 533 TRP H 1 1 18 12175 1 1 36 TRP HA H 6.752 -3.805 -0.065 1.00 . A A . 533 TRP HA 1 1 18 12176 1 1 36 TRP HB2 H 6.141 -5.350 1.789 1.00 . A A . 533 TRP HB2 1 1 18 12177 1 1 36 TRP HB3 H 7.271 -6.525 1.117 1.00 . A A . 533 TRP HB3 1 1 18 12178 1 1 36 TRP HD1 H 9.585 -6.440 2.214 1.00 . A A . 533 TRP HD1 1 1 18 12179 1 1 36 TRP HE1 H 11.015 -4.641 3.385 1.00 . A A . 533 TRP HE1 1 1 18 12180 1 1 36 TRP HE3 H 6.421 -2.447 1.744 1.00 . A A . 533 TRP HE3 1 1 18 12181 1 1 36 TRP HH2 H 9.283 -0.006 3.766 1.00 . A A . 533 TRP HH2 1 1 18 12182 1 1 36 TRP HZ2 H 10.832 -1.901 4.000 1.00 . A A . 533 TRP HZ2 1 1 18 12183 1 1 36 TRP HZ3 H 7.126 -0.273 2.655 1.00 . A A . 533 TRP HZ3 1 1 18 12184 1 1 36 TRP N N 5.597 -5.375 -0.775 1.00 . A A . 533 TRP N 1 1 18 12185 1 1 36 TRP NE1 N 10.127 -4.470 2.997 1.00 . A A . 533 TRP NE1 1 1 18 12186 1 1 36 TRP O O 9.057 -4.468 -1.002 1.00 . A A . 533 TRP O 1 1 18 12187 1 1 37 LYS C C 9.441 -5.607 -3.737 1.00 . A A . 534 LYS C 1 1 18 12188 1 1 37 LYS CA C 9.123 -6.646 -2.667 1.00 . A A . 534 LYS CA 1 1 18 12189 1 1 37 LYS CB C 8.881 -8.020 -3.290 1.00 . A A . 534 LYS CB 1 1 18 12190 1 1 37 LYS CD C 8.561 -10.483 -2.940 1.00 . A A . 534 LYS CD 1 1 18 12191 1 1 37 LYS CE C 8.624 -11.622 -1.938 1.00 . A A . 534 LYS CE 1 1 18 12192 1 1 37 LYS CG C 8.787 -9.140 -2.269 1.00 . A A . 534 LYS CG 1 1 18 12193 1 1 37 LYS H H 7.145 -6.718 -1.911 1.00 . A A . 534 LYS H 1 1 18 12194 1 1 37 LYS HA H 9.999 -6.683 -2.041 1.00 . A A . 534 LYS HA 1 1 18 12195 1 1 37 LYS HB2 H 7.956 -7.993 -3.848 1.00 . A A . 534 LYS HB2 1 1 18 12196 1 1 37 LYS HB3 H 9.694 -8.244 -3.966 1.00 . A A . 534 LYS HB3 1 1 18 12197 1 1 37 LYS HD2 H 7.587 -10.482 -3.410 1.00 . A A . 534 LYS HD2 1 1 18 12198 1 1 37 LYS HD3 H 9.323 -10.633 -3.691 1.00 . A A . 534 LYS HD3 1 1 18 12199 1 1 37 LYS HE2 H 9.588 -11.604 -1.454 1.00 . A A . 534 LYS HE2 1 1 18 12200 1 1 37 LYS HE3 H 7.848 -11.476 -1.201 1.00 . A A . 534 LYS HE3 1 1 18 12201 1 1 37 LYS HG2 H 9.709 -9.180 -1.707 1.00 . A A . 534 LYS HG2 1 1 18 12202 1 1 37 LYS HG3 H 7.963 -8.936 -1.599 1.00 . A A . 534 LYS HG3 1 1 18 12203 1 1 37 LYS HZ1 H 9.084 -13.052 -3.391 1.00 . A A . 534 LYS HZ1 1 1 18 12204 1 1 37 LYS HZ2 H 8.626 -13.706 -1.899 1.00 . A A . 534 LYS HZ2 1 1 18 12205 1 1 37 LYS HZ3 H 7.453 -13.043 -2.926 1.00 . A A . 534 LYS HZ3 1 1 18 12206 1 1 37 LYS N N 7.987 -6.230 -1.849 1.00 . A A . 534 LYS N 1 1 18 12207 1 1 37 LYS NZ N 8.434 -12.947 -2.584 1.00 . A A . 534 LYS NZ 1 1 18 12208 1 1 37 LYS O O 10.607 -5.412 -4.081 1.00 . A A . 534 LYS O 1 1 18 12209 1 1 38 ASP C C 8.647 -2.528 -4.312 1.00 . A A . 535 ASP C 1 1 18 12210 1 1 38 ASP CA C 8.677 -3.795 -5.127 1.00 . A A . 535 ASP CA 1 1 18 12211 1 1 38 ASP CB C 7.626 -3.676 -6.218 1.00 . A A . 535 ASP CB 1 1 18 12212 1 1 38 ASP CG C 8.040 -2.703 -7.301 1.00 . A A . 535 ASP CG 1 1 18 12213 1 1 38 ASP H H 7.508 -5.209 -4.054 1.00 . A A . 535 ASP H 1 1 18 12214 1 1 38 ASP HA H 9.652 -3.919 -5.574 1.00 . A A . 535 ASP HA 1 1 18 12215 1 1 38 ASP HB2 H 7.459 -4.632 -6.655 1.00 . A A . 535 ASP HB2 1 1 18 12216 1 1 38 ASP HB3 H 6.706 -3.321 -5.778 1.00 . A A . 535 ASP HB3 1 1 18 12217 1 1 38 ASP N N 8.430 -4.939 -4.258 1.00 . A A . 535 ASP N 1 1 18 12218 1 1 38 ASP O O 9.409 -1.598 -4.513 1.00 . A A . 535 ASP O 1 1 18 12219 1 1 38 ASP OD1 O 9.113 -2.910 -7.910 1.00 . A A . 535 ASP OD1 1 1 18 12220 1 1 38 ASP OD2 O 7.290 -1.740 -7.567 1.00 . A A . 535 ASP OD2 1 1 18 12221 1 1 39 HIS C C 8.597 -0.861 -1.802 1.00 . A A . 536 HIS C 1 1 18 12222 1 1 39 HIS CA C 7.426 -1.328 -2.644 1.00 . A A . 536 HIS CA 1 1 18 12223 1 1 39 HIS CB C 6.205 -1.579 -1.762 1.00 . A A . 536 HIS CB 1 1 18 12224 1 1 39 HIS CD2 C 5.510 0.029 0.135 1.00 . A A . 536 HIS CD2 1 1 18 12225 1 1 39 HIS CE1 C 4.564 1.570 -1.054 1.00 . A A . 536 HIS CE1 1 1 18 12226 1 1 39 HIS CG C 5.617 -0.350 -1.164 1.00 . A A . 536 HIS CG 1 1 18 12227 1 1 39 HIS H H 7.269 -3.342 -3.173 1.00 . A A . 536 HIS H 1 1 18 12228 1 1 39 HIS HA H 7.189 -0.567 -3.380 1.00 . A A . 536 HIS HA 1 1 18 12229 1 1 39 HIS HB2 H 5.438 -2.054 -2.352 1.00 . A A . 536 HIS HB2 1 1 18 12230 1 1 39 HIS HB3 H 6.487 -2.237 -0.954 1.00 . A A . 536 HIS HB3 1 1 18 12231 1 1 39 HIS HD1 H 4.892 0.640 -2.886 1.00 . A A . 536 HIS HD1 1 1 18 12232 1 1 39 HIS HD2 H 5.882 -0.514 0.992 1.00 . A A . 536 HIS HD2 1 1 18 12233 1 1 39 HIS HE1 H 4.055 2.477 -1.349 1.00 . A A . 536 HIS HE1 1 1 18 12234 1 1 39 HIS N N 7.750 -2.521 -3.369 1.00 . A A . 536 HIS N 1 1 18 12235 1 1 39 HIS ND1 N 5.010 0.639 -1.905 1.00 . A A . 536 HIS ND1 1 1 18 12236 1 1 39 HIS NE2 N 4.839 1.237 0.186 1.00 . A A . 536 HIS NE2 1 1 18 12237 1 1 39 HIS O O 8.782 0.326 -1.634 1.00 . A A . 536 HIS O 1 1 18 12238 1 1 40 GLN C C 11.472 -0.453 -1.048 1.00 . A A . 537 GLN C 1 1 18 12239 1 1 40 GLN CA C 10.489 -1.422 -0.390 1.00 . A A . 537 GLN CA 1 1 18 12240 1 1 40 GLN CB C 11.229 -2.660 0.117 1.00 . A A . 537 GLN CB 1 1 18 12241 1 1 40 GLN CD C 12.530 -4.738 -0.474 1.00 . A A . 537 GLN CD 1 1 18 12242 1 1 40 GLN CG C 11.960 -3.428 -0.971 1.00 . A A . 537 GLN CG 1 1 18 12243 1 1 40 GLN H H 9.236 -2.742 -1.504 1.00 . A A . 537 GLN H 1 1 18 12244 1 1 40 GLN HA H 10.040 -0.912 0.449 1.00 . A A . 537 GLN HA 1 1 18 12245 1 1 40 GLN HB2 H 11.952 -2.355 0.859 1.00 . A A . 537 GLN HB2 1 1 18 12246 1 1 40 GLN HB3 H 10.514 -3.325 0.578 1.00 . A A . 537 GLN HB3 1 1 18 12247 1 1 40 GLN HE21 H 10.814 -5.647 -0.863 1.00 . A A . 537 GLN HE21 1 1 18 12248 1 1 40 GLN HE22 H 12.064 -6.652 -0.220 1.00 . A A . 537 GLN HE22 1 1 18 12249 1 1 40 GLN HG2 H 11.273 -3.630 -1.783 1.00 . A A . 537 GLN HG2 1 1 18 12250 1 1 40 GLN HG3 H 12.772 -2.816 -1.330 1.00 . A A . 537 GLN HG3 1 1 18 12251 1 1 40 GLN N N 9.396 -1.789 -1.290 1.00 . A A . 537 GLN N 1 1 18 12252 1 1 40 GLN NE2 N 11.722 -5.782 -0.520 1.00 . A A . 537 GLN NE2 1 1 18 12253 1 1 40 GLN O O 11.981 0.449 -0.386 1.00 . A A . 537 GLN O 1 1 18 12254 1 1 40 GLN OE1 O 13.677 -4.807 -0.036 1.00 . A A . 537 GLN OE1 1 1 18 12255 1 1 41 HIS C C 12.020 1.577 -3.396 1.00 . A A . 538 HIS C 1 1 18 12256 1 1 41 HIS CA C 12.679 0.257 -3.023 1.00 . A A . 538 HIS CA 1 1 18 12257 1 1 41 HIS CB C 13.320 -0.411 -4.260 1.00 . A A . 538 HIS CB 1 1 18 12258 1 1 41 HIS CD2 C 11.702 -1.594 -5.890 1.00 . A A . 538 HIS CD2 1 1 18 12259 1 1 41 HIS CE1 C 11.516 0.020 -7.333 1.00 . A A . 538 HIS CE1 1 1 18 12260 1 1 41 HIS CG C 12.442 -0.542 -5.474 1.00 . A A . 538 HIS CG 1 1 18 12261 1 1 41 HIS H H 11.304 -1.353 -2.833 1.00 . A A . 538 HIS H 1 1 18 12262 1 1 41 HIS HA H 13.465 0.478 -2.316 1.00 . A A . 538 HIS HA 1 1 18 12263 1 1 41 HIS HB2 H 14.187 0.162 -4.552 1.00 . A A . 538 HIS HB2 1 1 18 12264 1 1 41 HIS HB3 H 13.642 -1.404 -3.981 1.00 . A A . 538 HIS HB3 1 1 18 12265 1 1 41 HIS HD2 H 11.540 -2.520 -5.359 1.00 . A A . 538 HIS HD2 1 1 18 12266 1 1 41 HIS HE1 H 11.189 0.599 -8.184 1.00 . A A . 538 HIS HE1 1 1 18 12267 1 1 41 HIS HE2 H 10.355 -1.697 -7.504 1.00 . A A . 538 HIS HE2 1 1 18 12268 1 1 41 HIS N N 11.735 -0.623 -2.343 1.00 . A A . 538 HIS N 1 1 18 12269 1 1 41 HIS ND1 N 12.322 0.477 -6.390 1.00 . A A . 538 HIS ND1 1 1 18 12270 1 1 41 HIS NE2 N 11.118 -1.232 -7.075 1.00 . A A . 538 HIS NE2 1 1 18 12271 1 1 41 HIS O O 12.705 2.590 -3.560 1.00 . A A . 538 HIS O 1 1 18 12272 1 1 42 ILE C C 9.633 3.580 -2.595 1.00 . A A . 539 ILE C 1 1 18 12273 1 1 42 ILE CA C 9.986 2.805 -3.869 1.00 . A A . 539 ILE CA 1 1 18 12274 1 1 42 ILE CB C 8.716 2.503 -4.736 1.00 . A A . 539 ILE CB 1 1 18 12275 1 1 42 ILE CD1 C 6.675 3.603 -3.649 1.00 . A A . 539 ILE CD1 1 1 18 12276 1 1 42 ILE CG1 C 7.429 2.314 -3.920 1.00 . A A . 539 ILE CG1 1 1 18 12277 1 1 42 ILE CG2 C 8.952 1.270 -5.584 1.00 . A A . 539 ILE CG2 1 1 18 12278 1 1 42 ILE H H 10.189 0.741 -3.414 1.00 . A A . 539 ILE H 1 1 18 12279 1 1 42 ILE HA H 10.656 3.412 -4.460 1.00 . A A . 539 ILE HA 1 1 18 12280 1 1 42 ILE HB H 8.578 3.324 -5.408 1.00 . A A . 539 ILE HB 1 1 18 12281 1 1 42 ILE HD11 H 6.395 4.060 -4.587 1.00 . A A . 539 ILE HD11 1 1 18 12282 1 1 42 ILE HD12 H 5.787 3.387 -3.074 1.00 . A A . 539 ILE HD12 1 1 18 12283 1 1 42 ILE HD13 H 7.308 4.279 -3.094 1.00 . A A . 539 ILE HD13 1 1 18 12284 1 1 42 ILE HG12 H 6.769 1.660 -4.461 1.00 . A A . 539 ILE HG12 1 1 18 12285 1 1 42 ILE HG13 H 7.674 1.867 -2.969 1.00 . A A . 539 ILE HG13 1 1 18 12286 1 1 42 ILE HG21 H 9.172 0.429 -4.942 1.00 . A A . 539 ILE HG21 1 1 18 12287 1 1 42 ILE HG22 H 8.069 1.058 -6.168 1.00 . A A . 539 ILE HG22 1 1 18 12288 1 1 42 ILE HG23 H 9.789 1.444 -6.245 1.00 . A A . 539 ILE HG23 1 1 18 12289 1 1 42 ILE N N 10.696 1.580 -3.528 1.00 . A A . 539 ILE N 1 1 18 12290 1 1 42 ILE O O 9.787 4.802 -2.530 1.00 . A A . 539 ILE O 1 1 18 12291 1 1 43 CYS C C 9.789 4.294 0.269 1.00 . A A . 540 CYS C 1 1 18 12292 1 1 43 CYS CA C 8.704 3.410 -0.346 1.00 . A A . 540 CYS CA 1 1 18 12293 1 1 43 CYS CB C 8.386 2.253 0.601 1.00 . A A . 540 CYS CB 1 1 18 12294 1 1 43 CYS H H 8.995 1.879 -1.769 1.00 . A A . 540 CYS H 1 1 18 12295 1 1 43 CYS HA H 7.809 3.989 -0.505 1.00 . A A . 540 CYS HA 1 1 18 12296 1 1 43 CYS HB2 H 7.817 1.509 0.064 1.00 . A A . 540 CYS HB2 1 1 18 12297 1 1 43 CYS HB3 H 9.314 1.812 0.936 1.00 . A A . 540 CYS HB3 1 1 18 12298 1 1 43 CYS N N 9.139 2.847 -1.613 1.00 . A A . 540 CYS N 1 1 18 12299 1 1 43 CYS O O 10.924 3.866 0.498 1.00 . A A . 540 CYS O 1 1 18 12300 1 1 43 CYS SG S 7.430 2.709 2.072 1.00 . A A . 540 CYS SG 1 1 18 12301 1 1 44 GLY C C 9.974 7.903 0.536 1.00 . A A . 541 GLY C 1 1 18 12302 1 1 44 GLY CA C 10.327 6.522 1.033 1.00 . A A . 541 GLY CA 1 1 18 12303 1 1 44 GLY H H 8.478 5.785 0.321 1.00 . A A . 541 GLY H 1 1 18 12304 1 1 44 GLY HA2 H 10.276 6.508 2.112 1.00 . A A . 541 GLY HA2 1 1 18 12305 1 1 44 GLY HA3 H 11.330 6.278 0.719 1.00 . A A . 541 GLY HA3 1 1 18 12306 1 1 44 GLY N N 9.410 5.536 0.502 1.00 . A A . 541 GLY N 1 1 18 12307 1 1 44 GLY O O 10.217 8.903 1.208 1.00 . A A . 541 GLY O 1 1 18 12308 1 1 45 GLN C C 7.534 9.555 -0.762 1.00 . A A . 542 GLN C 1 1 18 12309 1 1 45 GLN CA C 8.938 9.204 -1.242 1.00 . A A . 542 GLN CA 1 1 18 12310 1 1 45 GLN CB C 8.941 9.101 -2.768 1.00 . A A . 542 GLN CB 1 1 18 12311 1 1 45 GLN CD C 10.226 8.600 -4.872 1.00 . A A . 542 GLN CD 1 1 18 12312 1 1 45 GLN CG C 10.283 8.723 -3.363 1.00 . A A . 542 GLN CG 1 1 18 12313 1 1 45 GLN H H 9.233 7.120 -1.143 1.00 . A A . 542 GLN H 1 1 18 12314 1 1 45 GLN HA H 9.624 9.981 -0.937 1.00 . A A . 542 GLN HA 1 1 18 12315 1 1 45 GLN HB2 H 8.219 8.356 -3.068 1.00 . A A . 542 GLN HB2 1 1 18 12316 1 1 45 GLN HB3 H 8.647 10.055 -3.181 1.00 . A A . 542 GLN HB3 1 1 18 12317 1 1 45 GLN HE21 H 8.796 9.984 -4.955 1.00 . A A . 542 GLN HE21 1 1 18 12318 1 1 45 GLN HE22 H 9.299 9.321 -6.475 1.00 . A A . 542 GLN HE22 1 1 18 12319 1 1 45 GLN HG2 H 11.006 9.483 -3.104 1.00 . A A . 542 GLN HG2 1 1 18 12320 1 1 45 GLN HG3 H 10.593 7.775 -2.950 1.00 . A A . 542 GLN HG3 1 1 18 12321 1 1 45 GLN N N 9.377 7.950 -0.650 1.00 . A A . 542 GLN N 1 1 18 12322 1 1 45 GLN NE2 N 9.354 9.377 -5.497 1.00 . A A . 542 GLN NE2 1 1 18 12323 1 1 45 GLN O O 6.544 9.205 -1.406 1.00 . A A . 542 GLN O 1 1 18 12324 1 1 45 GLN OE1 O 10.956 7.809 -5.471 1.00 . A A . 542 GLN OE1 1 1 18 12325 1 1 46 SER C C 5.998 12.167 0.532 1.00 . A A . 543 SER C 1 1 18 12326 1 1 46 SER CA C 6.165 10.693 0.872 1.00 . A A . 543 SER CA 1 1 18 12327 1 1 46 SER CB C 6.063 10.477 2.382 1.00 . A A . 543 SER CB 1 1 18 12328 1 1 46 SER H H 8.263 10.408 0.895 1.00 . A A . 543 SER H 1 1 18 12329 1 1 46 SER HA H 5.387 10.129 0.379 1.00 . A A . 543 SER HA 1 1 18 12330 1 1 46 SER HB2 H 6.832 11.051 2.879 1.00 . A A . 543 SER HB2 1 1 18 12331 1 1 46 SER HB3 H 5.092 10.803 2.727 1.00 . A A . 543 SER HB3 1 1 18 12332 1 1 46 SER HG H 6.883 8.721 2.114 1.00 . A A . 543 SER HG 1 1 18 12333 1 1 46 SER N N 7.444 10.219 0.378 1.00 . A A . 543 SER N 1 1 18 12334 1 1 46 SER O O 5.031 12.556 -0.125 1.00 . A A . 543 SER O 1 1 18 12335 1 1 46 SER OG O 6.231 9.109 2.707 1.00 . A A . 543 SER OG 1 1 18 12336 1 1 47 ALA C C 8.282 15.026 1.100 1.00 . A A . 544 ALA C 1 1 18 12337 1 1 47 ALA CA C 6.944 14.406 0.712 1.00 . A A . 544 ALA CA 1 1 18 12338 1 1 47 ALA CB C 5.810 15.061 1.490 1.00 . A A . 544 ALA CB 1 1 18 12339 1 1 47 ALA H H 7.730 12.585 1.442 1.00 . A A . 544 ALA H 1 1 18 12340 1 1 47 ALA HA H 6.774 14.567 -0.342 1.00 . A A . 544 ALA HA 1 1 18 12341 1 1 47 ALA HB1 H 5.979 14.934 2.550 1.00 . A A . 544 ALA HB1 1 1 18 12342 1 1 47 ALA HB2 H 5.777 16.116 1.257 1.00 . A A . 544 ALA HB2 1 1 18 12343 1 1 47 ALA HB3 H 4.872 14.602 1.218 1.00 . A A . 544 ALA HB3 1 1 18 12344 1 1 47 ALA N N 6.967 12.972 0.954 1.00 . A A . 544 ALA N 1 1 18 12345 1 1 47 ALA O O 9.248 14.898 0.323 1.00 . A A . 544 ALA O 1 1 18 12346 1 1 47 ALA OXT O 8.366 15.626 2.194 1.00 . A A . 544 ALA OXT 1 1 18 12347 2 2 1 ZN ZN ZN -5.616 -5.806 -0.929 1.00 . B A . 601 ZN ZN 1 1 18 12348 3 2 1 ZN ZN ZN 5.196 2.599 1.578 1.00 . C A . 602 ZN ZN 1 1 19 12349 1 1 1 GLY C C -16.116 4.536 4.836 1.00 . A A . 498 GLY C 1 1 19 12350 1 1 1 GLY CA C -16.664 3.946 6.115 1.00 . A A . 498 GLY CA 1 1 19 12351 1 1 1 GLY H1 H -18.224 4.233 7.463 1.00 . A A . 498 GLY H1 1 1 19 12352 1 1 1 GLY H2 H -18.575 4.745 5.884 1.00 . A A . 498 GLY H2 1 1 19 12353 1 1 1 GLY H3 H -17.552 5.671 6.866 1.00 . A A . 498 GLY H3 1 1 19 12354 1 1 1 GLY HA2 H -15.889 3.960 6.867 1.00 . A A . 498 GLY HA2 1 1 19 12355 1 1 1 GLY HA3 H -16.956 2.924 5.931 1.00 . A A . 498 GLY HA3 1 1 19 12356 1 1 1 GLY N N -17.834 4.699 6.617 1.00 . A A . 498 GLY N 1 1 19 12357 1 1 1 GLY O O -16.840 4.669 3.849 1.00 . A A . 498 GLY O 1 1 19 12358 1 1 2 ALA C C -13.756 4.321 2.736 1.00 . A A . 499 ALA C 1 1 19 12359 1 1 2 ALA CA C -14.195 5.445 3.667 1.00 . A A . 499 ALA CA 1 1 19 12360 1 1 2 ALA CB C -13.011 6.313 4.064 1.00 . A A . 499 ALA CB 1 1 19 12361 1 1 2 ALA H H -14.317 4.787 5.672 1.00 . A A . 499 ALA H 1 1 19 12362 1 1 2 ALA HA H -14.912 6.068 3.152 1.00 . A A . 499 ALA HA 1 1 19 12363 1 1 2 ALA HB1 H -12.276 5.709 4.574 1.00 . A A . 499 ALA HB1 1 1 19 12364 1 1 2 ALA HB2 H -12.570 6.744 3.177 1.00 . A A . 499 ALA HB2 1 1 19 12365 1 1 2 ALA HB3 H -13.346 7.104 4.719 1.00 . A A . 499 ALA HB3 1 1 19 12366 1 1 2 ALA N N -14.840 4.897 4.849 1.00 . A A . 499 ALA N 1 1 19 12367 1 1 2 ALA O O -13.055 3.399 3.151 1.00 . A A . 499 ALA O 1 1 19 12368 1 1 3 MET C C -13.392 3.995 -0.796 1.00 . A A . 500 MET C 1 1 19 12369 1 1 3 MET CA C -13.875 3.365 0.503 1.00 . A A . 500 MET CA 1 1 19 12370 1 1 3 MET CB C -15.105 2.495 0.222 1.00 . A A . 500 MET CB 1 1 19 12371 1 1 3 MET CE C -17.243 -0.169 2.606 1.00 . A A . 500 MET CE 1 1 19 12372 1 1 3 MET CG C -15.552 1.660 1.408 1.00 . A A . 500 MET CG 1 1 19 12373 1 1 3 MET H H -14.750 5.161 1.220 1.00 . A A . 500 MET H 1 1 19 12374 1 1 3 MET HA H -13.090 2.744 0.906 1.00 . A A . 500 MET HA 1 1 19 12375 1 1 3 MET HB2 H -15.924 3.135 -0.067 1.00 . A A . 500 MET HB2 1 1 19 12376 1 1 3 MET HB3 H -14.878 1.826 -0.596 1.00 . A A . 500 MET HB3 1 1 19 12377 1 1 3 MET HE1 H -17.325 0.520 3.434 1.00 . A A . 500 MET HE1 1 1 19 12378 1 1 3 MET HE2 H -18.130 -0.781 2.561 1.00 . A A . 500 MET HE2 1 1 19 12379 1 1 3 MET HE3 H -16.376 -0.798 2.745 1.00 . A A . 500 MET HE3 1 1 19 12380 1 1 3 MET HG2 H -14.773 0.953 1.650 1.00 . A A . 500 MET HG2 1 1 19 12381 1 1 3 MET HG3 H -15.718 2.315 2.251 1.00 . A A . 500 MET HG3 1 1 19 12382 1 1 3 MET N N -14.192 4.392 1.488 1.00 . A A . 500 MET N 1 1 19 12383 1 1 3 MET O O -13.359 3.342 -1.839 1.00 . A A . 500 MET O 1 1 19 12384 1 1 3 MET SD S -17.073 0.747 1.076 1.00 . A A . 500 MET SD 1 1 19 12385 1 1 4 GLU C C -11.196 5.466 -2.354 1.00 . A A . 501 GLU C 1 1 19 12386 1 1 4 GLU CA C -12.573 5.972 -1.929 1.00 . A A . 501 GLU CA 1 1 19 12387 1 1 4 GLU CB C -12.533 7.485 -1.682 1.00 . A A . 501 GLU CB 1 1 19 12388 1 1 4 GLU CD C -11.635 9.368 -0.253 1.00 . A A . 501 GLU CD 1 1 19 12389 1 1 4 GLU CG C -11.843 7.875 -0.383 1.00 . A A . 501 GLU CG 1 1 19 12390 1 1 4 GLU H H -13.087 5.750 0.115 1.00 . A A . 501 GLU H 1 1 19 12391 1 1 4 GLU HA H -13.276 5.766 -2.722 1.00 . A A . 501 GLU HA 1 1 19 12392 1 1 4 GLU HB2 H -12.006 7.959 -2.499 1.00 . A A . 501 GLU HB2 1 1 19 12393 1 1 4 GLU HB3 H -13.545 7.862 -1.653 1.00 . A A . 501 GLU HB3 1 1 19 12394 1 1 4 GLU HG2 H -12.452 7.540 0.444 1.00 . A A . 501 GLU HG2 1 1 19 12395 1 1 4 GLU HG3 H -10.880 7.386 -0.341 1.00 . A A . 501 GLU HG3 1 1 19 12396 1 1 4 GLU N N -13.034 5.273 -0.739 1.00 . A A . 501 GLU N 1 1 19 12397 1 1 4 GLU O O -10.970 5.174 -3.530 1.00 . A A . 501 GLU O 1 1 19 12398 1 1 4 GLU OE1 O -12.615 10.085 0.036 1.00 . A A . 501 GLU OE1 1 1 19 12399 1 1 4 GLU OE2 O -10.487 9.828 -0.419 1.00 . A A . 501 GLU OE2 1 1 19 12400 1 1 5 GLN C C -9.139 3.318 -2.091 1.00 . A A . 502 GLN C 1 1 19 12401 1 1 5 GLN CA C -8.978 4.770 -1.661 1.00 . A A . 502 GLN CA 1 1 19 12402 1 1 5 GLN CB C -8.043 4.858 -0.446 1.00 . A A . 502 GLN CB 1 1 19 12403 1 1 5 GLN CD C -9.462 5.492 1.556 1.00 . A A . 502 GLN CD 1 1 19 12404 1 1 5 GLN CG C -8.669 4.395 0.866 1.00 . A A . 502 GLN CG 1 1 19 12405 1 1 5 GLN H H -10.469 5.749 -0.513 1.00 . A A . 502 GLN H 1 1 19 12406 1 1 5 GLN HA H -8.555 5.325 -2.485 1.00 . A A . 502 GLN HA 1 1 19 12407 1 1 5 GLN HB2 H -7.173 4.248 -0.636 1.00 . A A . 502 GLN HB2 1 1 19 12408 1 1 5 GLN HB3 H -7.728 5.879 -0.325 1.00 . A A . 502 GLN HB3 1 1 19 12409 1 1 5 GLN HE21 H -8.216 6.869 0.857 1.00 . A A . 502 GLN HE21 1 1 19 12410 1 1 5 GLN HE22 H -9.507 7.458 1.843 1.00 . A A . 502 GLN HE22 1 1 19 12411 1 1 5 GLN HG2 H -9.332 3.569 0.661 1.00 . A A . 502 GLN HG2 1 1 19 12412 1 1 5 GLN HG3 H -7.882 4.067 1.530 1.00 . A A . 502 GLN HG3 1 1 19 12413 1 1 5 GLN N N -10.279 5.367 -1.396 1.00 . A A . 502 GLN N 1 1 19 12414 1 1 5 GLN NE2 N -9.020 6.729 1.401 1.00 . A A . 502 GLN NE2 1 1 19 12415 1 1 5 GLN O O -10.096 2.645 -1.711 1.00 . A A . 502 GLN O 1 1 19 12416 1 1 5 GLN OE1 O -10.456 5.227 2.230 1.00 . A A . 502 GLN OE1 1 1 19 12417 1 1 6 SER C C -6.991 0.750 -3.234 1.00 . A A . 503 SER C 1 1 19 12418 1 1 6 SER CA C -8.296 1.508 -3.450 1.00 . A A . 503 SER CA 1 1 19 12419 1 1 6 SER CB C -8.618 1.601 -4.935 1.00 . A A . 503 SER CB 1 1 19 12420 1 1 6 SER H H -7.449 3.414 -3.141 1.00 . A A . 503 SER H 1 1 19 12421 1 1 6 SER HA H -9.095 0.986 -2.947 1.00 . A A . 503 SER HA 1 1 19 12422 1 1 6 SER HB2 H -7.775 2.027 -5.459 1.00 . A A . 503 SER HB2 1 1 19 12423 1 1 6 SER HB3 H -8.826 0.616 -5.322 1.00 . A A . 503 SER HB3 1 1 19 12424 1 1 6 SER HG H -10.059 2.764 -4.294 1.00 . A A . 503 SER HG 1 1 19 12425 1 1 6 SER N N -8.212 2.847 -2.903 1.00 . A A . 503 SER N 1 1 19 12426 1 1 6 SER O O -5.909 1.299 -3.423 1.00 . A A . 503 SER O 1 1 19 12427 1 1 6 SER OG O -9.752 2.426 -5.144 1.00 . A A . 503 SER OG 1 1 19 12428 1 1 7 CYS C C -5.190 -1.479 -3.945 1.00 . A A . 504 CYS C 1 1 19 12429 1 1 7 CYS CA C -5.934 -1.344 -2.632 1.00 . A A . 504 CYS CA 1 1 19 12430 1 1 7 CYS CB C -6.319 -2.733 -2.103 1.00 . A A . 504 CYS CB 1 1 19 12431 1 1 7 CYS H H -7.999 -0.887 -2.686 1.00 . A A . 504 CYS H 1 1 19 12432 1 1 7 CYS HA H -5.290 -0.862 -1.911 1.00 . A A . 504 CYS HA 1 1 19 12433 1 1 7 CYS HB2 H -6.903 -2.619 -1.202 1.00 . A A . 504 CYS HB2 1 1 19 12434 1 1 7 CYS HB3 H -6.908 -3.246 -2.845 1.00 . A A . 504 CYS HB3 1 1 19 12435 1 1 7 CYS N N -7.100 -0.509 -2.832 1.00 . A A . 504 CYS N 1 1 19 12436 1 1 7 CYS O O -5.759 -1.902 -4.955 1.00 . A A . 504 CYS O 1 1 19 12437 1 1 7 CYS SG S -4.882 -3.789 -1.706 1.00 . A A . 504 CYS SG 1 1 19 12438 1 1 8 VAL C C -2.939 -2.589 -5.620 1.00 . A A . 505 VAL C 1 1 19 12439 1 1 8 VAL CA C -3.079 -1.150 -5.101 1.00 . A A . 505 VAL CA 1 1 19 12440 1 1 8 VAL CB C -1.691 -0.533 -4.797 1.00 . A A . 505 VAL CB 1 1 19 12441 1 1 8 VAL CG1 C -0.904 -1.398 -3.831 1.00 . A A . 505 VAL CG1 1 1 19 12442 1 1 8 VAL CG2 C -0.903 -0.287 -6.071 1.00 . A A . 505 VAL CG2 1 1 19 12443 1 1 8 VAL H H -3.548 -0.751 -3.081 1.00 . A A . 505 VAL H 1 1 19 12444 1 1 8 VAL HA H -3.552 -0.551 -5.866 1.00 . A A . 505 VAL HA 1 1 19 12445 1 1 8 VAL HB H -1.852 0.425 -4.320 1.00 . A A . 505 VAL HB 1 1 19 12446 1 1 8 VAL HG11 H -0.799 -2.390 -4.242 1.00 . A A . 505 VAL HG11 1 1 19 12447 1 1 8 VAL HG12 H 0.074 -0.966 -3.676 1.00 . A A . 505 VAL HG12 1 1 19 12448 1 1 8 VAL HG13 H -1.428 -1.450 -2.890 1.00 . A A . 505 VAL HG13 1 1 19 12449 1 1 8 VAL HG21 H -1.460 0.379 -6.713 1.00 . A A . 505 VAL HG21 1 1 19 12450 1 1 8 VAL HG22 H 0.046 0.165 -5.821 1.00 . A A . 505 VAL HG22 1 1 19 12451 1 1 8 VAL HG23 H -0.735 -1.224 -6.577 1.00 . A A . 505 VAL HG23 1 1 19 12452 1 1 8 VAL N N -3.922 -1.103 -3.920 1.00 . A A . 505 VAL N 1 1 19 12453 1 1 8 VAL O O -2.545 -2.815 -6.764 1.00 . A A . 505 VAL O 1 1 19 12454 1 1 9 ASN C C -4.627 -5.521 -5.501 1.00 . A A . 506 ASN C 1 1 19 12455 1 1 9 ASN CA C -3.240 -4.964 -5.163 1.00 . A A . 506 ASN CA 1 1 19 12456 1 1 9 ASN CB C -2.588 -5.783 -4.037 1.00 . A A . 506 ASN CB 1 1 19 12457 1 1 9 ASN CG C -2.548 -7.273 -4.330 1.00 . A A . 506 ASN CG 1 1 19 12458 1 1 9 ASN H H -3.613 -3.323 -3.879 1.00 . A A . 506 ASN H 1 1 19 12459 1 1 9 ASN HA H -2.619 -5.034 -6.044 1.00 . A A . 506 ASN HA 1 1 19 12460 1 1 9 ASN HB2 H -1.575 -5.440 -3.895 1.00 . A A . 506 ASN HB2 1 1 19 12461 1 1 9 ASN HB3 H -3.145 -5.630 -3.123 1.00 . A A . 506 ASN HB3 1 1 19 12462 1 1 9 ASN HD21 H -4.092 -7.592 -3.122 1.00 . A A . 506 ASN HD21 1 1 19 12463 1 1 9 ASN HD22 H -3.448 -8.988 -3.903 1.00 . A A . 506 ASN HD22 1 1 19 12464 1 1 9 ASN N N -3.304 -3.559 -4.781 1.00 . A A . 506 ASN N 1 1 19 12465 1 1 9 ASN ND2 N -3.451 -8.027 -3.724 1.00 . A A . 506 ASN ND2 1 1 19 12466 1 1 9 ASN O O -4.747 -6.463 -6.283 1.00 . A A . 506 ASN O 1 1 19 12467 1 1 9 ASN OD1 O -1.682 -7.750 -5.064 1.00 . A A . 506 ASN OD1 1 1 19 12468 1 1 10 CYS C C -8.001 -4.470 -5.741 1.00 . A A . 507 CYS C 1 1 19 12469 1 1 10 CYS CA C -7.028 -5.470 -5.110 1.00 . A A . 507 CYS CA 1 1 19 12470 1 1 10 CYS CB C -7.564 -5.935 -3.760 1.00 . A A . 507 CYS CB 1 1 19 12471 1 1 10 CYS H H -5.551 -4.099 -4.430 1.00 . A A . 507 CYS H 1 1 19 12472 1 1 10 CYS HA H -6.953 -6.330 -5.761 1.00 . A A . 507 CYS HA 1 1 19 12473 1 1 10 CYS HB2 H -7.760 -5.072 -3.137 1.00 . A A . 507 CYS HB2 1 1 19 12474 1 1 10 CYS HB3 H -8.484 -6.479 -3.913 1.00 . A A . 507 CYS HB3 1 1 19 12475 1 1 10 CYS N N -5.680 -4.922 -4.947 1.00 . A A . 507 CYS N 1 1 19 12476 1 1 10 CYS O O -8.341 -4.587 -6.917 1.00 . A A . 507 CYS O 1 1 19 12477 1 1 10 CYS SG S -6.415 -7.022 -2.866 1.00 . A A . 507 CYS SG 1 1 19 12478 1 1 11 GLY C C -10.025 -1.720 -4.308 1.00 . A A . 508 GLY C 1 1 19 12479 1 1 11 GLY CA C -9.418 -2.528 -5.438 1.00 . A A . 508 GLY CA 1 1 19 12480 1 1 11 GLY H H -8.141 -3.452 -4.032 1.00 . A A . 508 GLY H 1 1 19 12481 1 1 11 GLY HA2 H -8.920 -1.858 -6.123 1.00 . A A . 508 GLY HA2 1 1 19 12482 1 1 11 GLY HA3 H -10.208 -3.045 -5.963 1.00 . A A . 508 GLY HA3 1 1 19 12483 1 1 11 GLY N N -8.457 -3.503 -4.952 1.00 . A A . 508 GLY N 1 1 19 12484 1 1 11 GLY O O -9.408 -1.574 -3.257 1.00 . A A . 508 GLY O 1 1 19 12485 1 1 12 ARG C C -12.021 -0.974 -2.124 1.00 . A A . 509 ARG C 1 1 19 12486 1 1 12 ARG CA C -11.945 -0.368 -3.540 1.00 . A A . 509 ARG CA 1 1 19 12487 1 1 12 ARG CB C -13.360 -0.097 -4.062 1.00 . A A . 509 ARG CB 1 1 19 12488 1 1 12 ARG CD C -15.700 0.635 -3.549 1.00 . A A . 509 ARG CD 1 1 19 12489 1 1 12 ARG CG C -14.271 0.583 -3.057 1.00 . A A . 509 ARG CG 1 1 19 12490 1 1 12 ARG CZ C -17.902 1.273 -2.629 1.00 . A A . 509 ARG CZ 1 1 19 12491 1 1 12 ARG H H -11.662 -1.346 -5.394 1.00 . A A . 509 ARG H 1 1 19 12492 1 1 12 ARG HA H -11.417 0.569 -3.483 1.00 . A A . 509 ARG HA 1 1 19 12493 1 1 12 ARG HB2 H -13.292 0.534 -4.936 1.00 . A A . 509 ARG HB2 1 1 19 12494 1 1 12 ARG HB3 H -13.811 -1.037 -4.343 1.00 . A A . 509 ARG HB3 1 1 19 12495 1 1 12 ARG HD2 H -15.788 1.427 -4.277 1.00 . A A . 509 ARG HD2 1 1 19 12496 1 1 12 ARG HD3 H -15.940 -0.310 -4.014 1.00 . A A . 509 ARG HD3 1 1 19 12497 1 1 12 ARG HE H -16.317 0.720 -1.543 1.00 . A A . 509 ARG HE 1 1 19 12498 1 1 12 ARG HG2 H -14.238 0.034 -2.126 1.00 . A A . 509 ARG HG2 1 1 19 12499 1 1 12 ARG HG3 H -13.918 1.591 -2.893 1.00 . A A . 509 ARG HG3 1 1 19 12500 1 1 12 ARG HH11 H -17.757 1.464 -4.648 1.00 . A A . 509 ARG HH11 1 1 19 12501 1 1 12 ARG HH12 H -19.318 1.830 -3.976 1.00 . A A . 509 ARG HH12 1 1 19 12502 1 1 12 ARG HH21 H -18.357 1.220 -0.652 1.00 . A A . 509 ARG HH21 1 1 19 12503 1 1 12 ARG HH22 H -19.660 1.698 -1.703 1.00 . A A . 509 ARG HH22 1 1 19 12504 1 1 12 ARG N N -11.242 -1.217 -4.517 1.00 . A A . 509 ARG N 1 1 19 12505 1 1 12 ARG NE N -16.642 0.882 -2.456 1.00 . A A . 509 ARG NE 1 1 19 12506 1 1 12 ARG NH1 N -18.361 1.546 -3.846 1.00 . A A . 509 ARG NH1 1 1 19 12507 1 1 12 ARG NH2 N -18.702 1.408 -1.577 1.00 . A A . 509 ARG NH2 1 1 19 12508 1 1 12 ARG O O -12.345 -0.277 -1.164 1.00 . A A . 509 ARG O 1 1 19 12509 1 1 13 GLU C C -10.710 -2.347 0.296 1.00 . A A . 510 GLU C 1 1 19 12510 1 1 13 GLU CA C -11.732 -2.931 -0.696 1.00 . A A . 510 GLU CA 1 1 19 12511 1 1 13 GLU CB C -11.470 -4.425 -0.889 1.00 . A A . 510 GLU CB 1 1 19 12512 1 1 13 GLU CD C -13.759 -5.170 -0.145 1.00 . A A . 510 GLU CD 1 1 19 12513 1 1 13 GLU CG C -12.263 -5.307 0.057 1.00 . A A . 510 GLU CG 1 1 19 12514 1 1 13 GLU H H -11.402 -2.754 -2.775 1.00 . A A . 510 GLU H 1 1 19 12515 1 1 13 GLU HA H -12.719 -2.799 -0.290 1.00 . A A . 510 GLU HA 1 1 19 12516 1 1 13 GLU HB2 H -11.729 -4.697 -1.902 1.00 . A A . 510 GLU HB2 1 1 19 12517 1 1 13 GLU HB3 H -10.418 -4.615 -0.731 1.00 . A A . 510 GLU HB3 1 1 19 12518 1 1 13 GLU HG2 H -11.984 -6.337 -0.109 1.00 . A A . 510 GLU HG2 1 1 19 12519 1 1 13 GLU HG3 H -12.025 -5.030 1.073 1.00 . A A . 510 GLU HG3 1 1 19 12520 1 1 13 GLU N N -11.688 -2.249 -1.988 1.00 . A A . 510 GLU N 1 1 19 12521 1 1 13 GLU O O -10.622 -2.794 1.442 1.00 . A A . 510 GLU O 1 1 19 12522 1 1 13 GLU OE1 O -14.294 -5.768 -1.105 1.00 . A A . 510 GLU OE1 1 1 19 12523 1 1 13 GLU OE2 O -14.413 -4.467 0.654 1.00 . A A . 510 GLU OE2 1 1 19 12524 1 1 14 ALA C C -9.440 -0.262 2.009 1.00 . A A . 511 ALA C 1 1 19 12525 1 1 14 ALA CA C -8.901 -0.719 0.655 1.00 . A A . 511 ALA CA 1 1 19 12526 1 1 14 ALA CB C -8.310 0.473 -0.077 1.00 . A A . 511 ALA CB 1 1 19 12527 1 1 14 ALA H H -10.003 -1.120 -1.110 1.00 . A A . 511 ALA H 1 1 19 12528 1 1 14 ALA HA H -8.104 -1.426 0.823 1.00 . A A . 511 ALA HA 1 1 19 12529 1 1 14 ALA HB1 H -7.935 0.155 -1.039 1.00 . A A . 511 ALA HB1 1 1 19 12530 1 1 14 ALA HB2 H -9.070 1.228 -0.216 1.00 . A A . 511 ALA HB2 1 1 19 12531 1 1 14 ALA HB3 H -7.498 0.886 0.504 1.00 . A A . 511 ALA HB3 1 1 19 12532 1 1 14 ALA N N -9.913 -1.382 -0.172 1.00 . A A . 511 ALA N 1 1 19 12533 1 1 14 ALA O O -10.568 0.223 2.120 1.00 . A A . 511 ALA O 1 1 19 12534 1 1 15 MET C C -7.733 0.483 5.160 1.00 . A A . 512 MET C 1 1 19 12535 1 1 15 MET CA C -8.963 -0.010 4.386 1.00 . A A . 512 MET CA 1 1 19 12536 1 1 15 MET CB C -9.612 -1.188 5.123 1.00 . A A . 512 MET CB 1 1 19 12537 1 1 15 MET CE C -11.672 0.551 8.309 1.00 . A A . 512 MET CE 1 1 19 12538 1 1 15 MET CG C -10.084 -0.857 6.530 1.00 . A A . 512 MET CG 1 1 19 12539 1 1 15 MET H H -7.732 -0.809 2.861 1.00 . A A . 512 MET H 1 1 19 12540 1 1 15 MET HA H -9.675 0.797 4.309 1.00 . A A . 512 MET HA 1 1 19 12541 1 1 15 MET HB2 H -10.464 -1.525 4.555 1.00 . A A . 512 MET HB2 1 1 19 12542 1 1 15 MET HB3 H -8.896 -1.992 5.191 1.00 . A A . 512 MET HB3 1 1 19 12543 1 1 15 MET HE1 H -10.760 0.849 8.805 1.00 . A A . 512 MET HE1 1 1 19 12544 1 1 15 MET HE2 H -12.434 1.296 8.483 1.00 . A A . 512 MET HE2 1 1 19 12545 1 1 15 MET HE3 H -12.001 -0.400 8.699 1.00 . A A . 512 MET HE3 1 1 19 12546 1 1 15 MET HG2 H -10.472 -1.757 6.986 1.00 . A A . 512 MET HG2 1 1 19 12547 1 1 15 MET HG3 H -9.243 -0.499 7.104 1.00 . A A . 512 MET HG3 1 1 19 12548 1 1 15 MET N N -8.607 -0.412 3.029 1.00 . A A . 512 MET N 1 1 19 12549 1 1 15 MET O O -7.854 1.251 6.117 1.00 . A A . 512 MET O 1 1 19 12550 1 1 15 MET SD S -11.376 0.401 6.549 1.00 . A A . 512 MET SD 1 1 19 12551 1 1 16 SER C C -4.311 1.051 4.538 1.00 . A A . 513 SER C 1 1 19 12552 1 1 16 SER CA C -5.326 0.375 5.457 1.00 . A A . 513 SER CA 1 1 19 12553 1 1 16 SER CB C -4.732 -0.880 6.094 1.00 . A A . 513 SER CB 1 1 19 12554 1 1 16 SER H H -6.485 -0.444 3.902 1.00 . A A . 513 SER H 1 1 19 12555 1 1 16 SER HA H -5.595 1.079 6.231 1.00 . A A . 513 SER HA 1 1 19 12556 1 1 16 SER HB2 H -4.430 -1.568 5.317 1.00 . A A . 513 SER HB2 1 1 19 12557 1 1 16 SER HB3 H -3.873 -0.606 6.687 1.00 . A A . 513 SER HB3 1 1 19 12558 1 1 16 SER HG H -5.970 -0.901 7.615 1.00 . A A . 513 SER HG 1 1 19 12559 1 1 16 SER N N -6.547 0.047 4.740 1.00 . A A . 513 SER N 1 1 19 12560 1 1 16 SER O O -4.333 0.869 3.322 1.00 . A A . 513 SER O 1 1 19 12561 1 1 16 SER OG O -5.682 -1.520 6.929 1.00 . A A . 513 SER OG 1 1 19 12562 1 1 17 GLU C C -1.008 2.009 4.821 1.00 . A A . 514 GLU C 1 1 19 12563 1 1 17 GLU CA C -2.381 2.532 4.407 1.00 . A A . 514 GLU CA 1 1 19 12564 1 1 17 GLU CB C -2.485 4.036 4.682 1.00 . A A . 514 GLU CB 1 1 19 12565 1 1 17 GLU CD C -3.175 5.777 6.345 1.00 . A A . 514 GLU CD 1 1 19 12566 1 1 17 GLU CG C -2.561 4.409 6.149 1.00 . A A . 514 GLU CG 1 1 19 12567 1 1 17 GLU H H -3.489 1.957 6.105 1.00 . A A . 514 GLU H 1 1 19 12568 1 1 17 GLU HA H -2.539 2.391 3.346 1.00 . A A . 514 GLU HA 1 1 19 12569 1 1 17 GLU HB2 H -1.619 4.523 4.260 1.00 . A A . 514 GLU HB2 1 1 19 12570 1 1 17 GLU HB3 H -3.371 4.417 4.192 1.00 . A A . 514 GLU HB3 1 1 19 12571 1 1 17 GLU HG2 H -3.163 3.678 6.667 1.00 . A A . 514 GLU HG2 1 1 19 12572 1 1 17 GLU HG3 H -1.562 4.415 6.560 1.00 . A A . 514 GLU HG3 1 1 19 12573 1 1 17 GLU N N -3.432 1.836 5.134 1.00 . A A . 514 GLU N 1 1 19 12574 1 1 17 GLU O O -0.872 1.363 5.862 1.00 . A A . 514 GLU O 1 1 19 12575 1 1 17 GLU OE1 O -2.479 6.788 6.121 1.00 . A A . 514 GLU OE1 1 1 19 12576 1 1 17 GLU OE2 O -4.368 5.849 6.704 1.00 . A A . 514 GLU OE2 1 1 19 12577 1 1 18 CYS C C 1.910 2.873 5.410 1.00 . A A . 515 CYS C 1 1 19 12578 1 1 18 CYS CA C 1.370 1.935 4.345 1.00 . A A . 515 CYS CA 1 1 19 12579 1 1 18 CYS CB C 2.288 1.984 3.110 1.00 . A A . 515 CYS CB 1 1 19 12580 1 1 18 CYS H H -0.169 2.773 3.179 1.00 . A A . 515 CYS H 1 1 19 12581 1 1 18 CYS HA H 1.390 0.945 4.784 1.00 . A A . 515 CYS HA 1 1 19 12582 1 1 18 CYS HB2 H 2.268 1.024 2.615 1.00 . A A . 515 CYS HB2 1 1 19 12583 1 1 18 CYS HB3 H 1.932 2.745 2.431 1.00 . A A . 515 CYS HB3 1 1 19 12584 1 1 18 CYS N N 0.002 2.292 4.011 1.00 . A A . 515 CYS N 1 1 19 12585 1 1 18 CYS O O 1.836 4.099 5.288 1.00 . A A . 515 CYS O 1 1 19 12586 1 1 18 CYS SG S 4.028 2.368 3.522 1.00 . A A . 515 CYS SG 1 1 19 12587 1 1 19 THR C C 4.630 3.027 6.886 1.00 . A A . 516 THR C 1 1 19 12588 1 1 19 THR CA C 3.215 2.999 7.442 1.00 . A A . 516 THR CA 1 1 19 12589 1 1 19 THR CB C 3.201 2.339 8.830 1.00 . A A . 516 THR CB 1 1 19 12590 1 1 19 THR CG2 C 3.897 3.220 9.855 1.00 . A A . 516 THR CG2 1 1 19 12591 1 1 19 THR H H 2.186 1.352 6.681 1.00 . A A . 516 THR H 1 1 19 12592 1 1 19 THR HA H 2.845 4.012 7.528 1.00 . A A . 516 THR HA 1 1 19 12593 1 1 19 THR HB H 3.721 1.393 8.772 1.00 . A A . 516 THR HB 1 1 19 12594 1 1 19 THR HG1 H 1.283 2.066 8.451 1.00 . A A . 516 THR HG1 1 1 19 12595 1 1 19 THR HG21 H 3.389 4.172 9.915 1.00 . A A . 516 THR HG21 1 1 19 12596 1 1 19 THR HG22 H 3.875 2.738 10.820 1.00 . A A . 516 THR HG22 1 1 19 12597 1 1 19 THR HG23 H 4.923 3.380 9.554 1.00 . A A . 516 THR HG23 1 1 19 12598 1 1 19 THR N N 2.382 2.287 6.508 1.00 . A A . 516 THR N 1 1 19 12599 1 1 19 THR O O 5.253 1.977 6.694 1.00 . A A . 516 THR O 1 1 19 12600 1 1 19 THR OG1 O 1.844 2.112 9.235 1.00 . A A . 516 THR OG1 1 1 19 12601 1 1 20 GLY C C 6.178 5.433 4.854 1.00 . A A . 517 GLY C 1 1 19 12602 1 1 20 GLY CA C 6.362 4.378 5.909 1.00 . A A . 517 GLY CA 1 1 19 12603 1 1 20 GLY H H 4.689 5.001 7.050 1.00 . A A . 517 GLY H 1 1 19 12604 1 1 20 GLY HA2 H 7.157 4.672 6.579 1.00 . A A . 517 GLY HA2 1 1 19 12605 1 1 20 GLY HA3 H 6.618 3.444 5.435 1.00 . A A . 517 GLY HA3 1 1 19 12606 1 1 20 GLY N N 5.137 4.217 6.662 1.00 . A A . 517 GLY N 1 1 19 12607 1 1 20 GLY O O 6.905 6.427 4.814 1.00 . A A . 517 GLY O 1 1 19 12608 1 1 21 CYS C C 3.233 6.261 3.006 1.00 . A A . 518 CYS C 1 1 19 12609 1 1 21 CYS CA C 4.744 6.296 3.128 1.00 . A A . 518 CYS CA 1 1 19 12610 1 1 21 CYS CB C 5.408 6.174 1.754 1.00 . A A . 518 CYS CB 1 1 19 12611 1 1 21 CYS H H 4.705 4.373 3.995 1.00 . A A . 518 CYS H 1 1 19 12612 1 1 21 CYS HA H 5.027 7.228 3.587 1.00 . A A . 518 CYS HA 1 1 19 12613 1 1 21 CYS HB2 H 5.245 7.091 1.207 1.00 . A A . 518 CYS HB2 1 1 19 12614 1 1 21 CYS HB3 H 6.468 6.029 1.884 1.00 . A A . 518 CYS HB3 1 1 19 12615 1 1 21 CYS N N 5.175 5.241 4.011 1.00 . A A . 518 CYS N 1 1 19 12616 1 1 21 CYS O O 2.631 5.199 2.934 1.00 . A A . 518 CYS O 1 1 19 12617 1 1 21 CYS SG S 4.793 4.809 0.714 1.00 . A A . 518 CYS SG 1 1 19 12618 1 1 22 HIS C C 0.713 7.843 1.498 1.00 . A A . 519 HIS C 1 1 19 12619 1 1 22 HIS CA C 1.171 7.497 2.901 1.00 . A A . 519 HIS CA 1 1 19 12620 1 1 22 HIS CB C 0.647 8.524 3.917 1.00 . A A . 519 HIS CB 1 1 19 12621 1 1 22 HIS CD2 C 2.026 8.289 6.104 1.00 . A A . 519 HIS CD2 1 1 19 12622 1 1 22 HIS CE1 C 0.499 7.347 7.356 1.00 . A A . 519 HIS CE1 1 1 19 12623 1 1 22 HIS CG C 0.914 8.150 5.347 1.00 . A A . 519 HIS CG 1 1 19 12624 1 1 22 HIS H H 3.150 8.246 2.908 1.00 . A A . 519 HIS H 1 1 19 12625 1 1 22 HIS HA H 0.786 6.522 3.158 1.00 . A A . 519 HIS HA 1 1 19 12626 1 1 22 HIS HB2 H 1.121 9.477 3.730 1.00 . A A . 519 HIS HB2 1 1 19 12627 1 1 22 HIS HB3 H -0.420 8.629 3.793 1.00 . A A . 519 HIS HB3 1 1 19 12628 1 1 22 HIS HD1 H -0.955 7.319 5.909 1.00 . A A . 519 HIS HD1 1 1 19 12629 1 1 22 HIS HD2 H 2.967 8.717 5.785 1.00 . A A . 519 HIS HD2 1 1 19 12630 1 1 22 HIS HE1 H -0.004 6.890 8.195 1.00 . A A . 519 HIS HE1 1 1 19 12631 1 1 22 HIS HE2 H 2.410 7.575 8.039 1.00 . A A . 519 HIS HE2 1 1 19 12632 1 1 22 HIS N N 2.621 7.422 2.940 1.00 . A A . 519 HIS N 1 1 19 12633 1 1 22 HIS ND1 N -0.025 7.556 6.165 1.00 . A A . 519 HIS ND1 1 1 19 12634 1 1 22 HIS NE2 N 1.743 7.780 7.347 1.00 . A A . 519 HIS NE2 1 1 19 12635 1 1 22 HIS O O -0.316 8.488 1.305 1.00 . A A . 519 HIS O 1 1 19 12636 1 1 23 LYS C C 0.295 6.646 -1.486 1.00 . A A . 520 LYS C 1 1 19 12637 1 1 23 LYS CA C 1.203 7.704 -0.877 1.00 . A A . 520 LYS CA 1 1 19 12638 1 1 23 LYS CB C 2.500 7.799 -1.682 1.00 . A A . 520 LYS CB 1 1 19 12639 1 1 23 LYS CD C 4.512 6.603 -2.599 1.00 . A A . 520 LYS CD 1 1 19 12640 1 1 23 LYS CE C 5.485 7.684 -2.176 1.00 . A A . 520 LYS CE 1 1 19 12641 1 1 23 LYS CG C 3.325 6.523 -1.659 1.00 . A A . 520 LYS CG 1 1 19 12642 1 1 23 LYS H H 2.293 6.884 0.731 1.00 . A A . 520 LYS H 1 1 19 12643 1 1 23 LYS HA H 0.698 8.657 -0.915 1.00 . A A . 520 LYS HA 1 1 19 12644 1 1 23 LYS HB2 H 2.257 8.029 -2.710 1.00 . A A . 520 LYS HB2 1 1 19 12645 1 1 23 LYS HB3 H 3.102 8.599 -1.277 1.00 . A A . 520 LYS HB3 1 1 19 12646 1 1 23 LYS HD2 H 5.027 5.652 -2.587 1.00 . A A . 520 LYS HD2 1 1 19 12647 1 1 23 LYS HD3 H 4.159 6.814 -3.598 1.00 . A A . 520 LYS HD3 1 1 19 12648 1 1 23 LYS HE2 H 6.113 7.936 -3.017 1.00 . A A . 520 LYS HE2 1 1 19 12649 1 1 23 LYS HE3 H 4.927 8.556 -1.869 1.00 . A A . 520 LYS HE3 1 1 19 12650 1 1 23 LYS HG2 H 3.686 6.360 -0.655 1.00 . A A . 520 LYS HG2 1 1 19 12651 1 1 23 LYS HG3 H 2.697 5.696 -1.954 1.00 . A A . 520 LYS HG3 1 1 19 12652 1 1 23 LYS HZ1 H 5.833 6.530 -0.475 1.00 . A A . 520 LYS HZ1 1 1 19 12653 1 1 23 LYS HZ2 H 7.214 6.806 -1.418 1.00 . A A . 520 LYS HZ2 1 1 19 12654 1 1 23 LYS HZ3 H 6.592 8.047 -0.442 1.00 . A A . 520 LYS HZ3 1 1 19 12655 1 1 23 LYS N N 1.494 7.410 0.516 1.00 . A A . 520 LYS N 1 1 19 12656 1 1 23 LYS NZ N 6.342 7.237 -1.049 1.00 . A A . 520 LYS NZ 1 1 19 12657 1 1 23 LYS O O -0.486 6.938 -2.394 1.00 . A A . 520 LYS O 1 1 19 12658 1 1 24 VAL C C -1.240 3.675 -0.473 1.00 . A A . 521 VAL C 1 1 19 12659 1 1 24 VAL CA C -0.386 4.316 -1.554 1.00 . A A . 521 VAL CA 1 1 19 12660 1 1 24 VAL CB C 0.509 3.233 -2.194 1.00 . A A . 521 VAL CB 1 1 19 12661 1 1 24 VAL CG1 C 1.254 3.782 -3.403 1.00 . A A . 521 VAL CG1 1 1 19 12662 1 1 24 VAL CG2 C 1.481 2.674 -1.169 1.00 . A A . 521 VAL CG2 1 1 19 12663 1 1 24 VAL H H 0.941 5.233 -0.206 1.00 . A A . 521 VAL H 1 1 19 12664 1 1 24 VAL HA H -1.036 4.718 -2.320 1.00 . A A . 521 VAL HA 1 1 19 12665 1 1 24 VAL HB H -0.127 2.427 -2.530 1.00 . A A . 521 VAL HB 1 1 19 12666 1 1 24 VAL HG11 H 1.871 4.613 -3.100 1.00 . A A . 521 VAL HG11 1 1 19 12667 1 1 24 VAL HG12 H 1.878 3.006 -3.824 1.00 . A A . 521 VAL HG12 1 1 19 12668 1 1 24 VAL HG13 H 0.543 4.115 -4.145 1.00 . A A . 521 VAL HG13 1 1 19 12669 1 1 24 VAL HG21 H 0.927 2.235 -0.350 1.00 . A A . 521 VAL HG21 1 1 19 12670 1 1 24 VAL HG22 H 2.099 1.920 -1.631 1.00 . A A . 521 VAL HG22 1 1 19 12671 1 1 24 VAL HG23 H 2.105 3.470 -0.793 1.00 . A A . 521 VAL HG23 1 1 19 12672 1 1 24 VAL N N 0.386 5.414 -0.997 1.00 . A A . 521 VAL N 1 1 19 12673 1 1 24 VAL O O -0.968 3.819 0.722 1.00 . A A . 521 VAL O 1 1 19 12674 1 1 25 ASN C C -3.473 0.931 -0.307 1.00 . A A . 522 ASN C 1 1 19 12675 1 1 25 ASN CA C -3.216 2.388 0.028 1.00 . A A . 522 ASN CA 1 1 19 12676 1 1 25 ASN CB C -4.535 3.162 0.048 1.00 . A A . 522 ASN CB 1 1 19 12677 1 1 25 ASN CG C -4.701 4.059 -1.162 1.00 . A A . 522 ASN CG 1 1 19 12678 1 1 25 ASN H H -2.409 2.870 -1.879 1.00 . A A . 522 ASN H 1 1 19 12679 1 1 25 ASN HA H -2.779 2.424 1.012 1.00 . A A . 522 ASN HA 1 1 19 12680 1 1 25 ASN HB2 H -5.357 2.461 0.066 1.00 . A A . 522 ASN HB2 1 1 19 12681 1 1 25 ASN HB3 H -4.572 3.774 0.937 1.00 . A A . 522 ASN HB3 1 1 19 12682 1 1 25 ASN HD21 H -5.277 2.503 -2.263 1.00 . A A . 522 ASN HD21 1 1 19 12683 1 1 25 ASN HD22 H -5.207 4.036 -3.077 1.00 . A A . 522 ASN HD22 1 1 19 12684 1 1 25 ASN N N -2.276 2.988 -0.901 1.00 . A A . 522 ASN N 1 1 19 12685 1 1 25 ASN ND2 N -5.106 3.480 -2.276 1.00 . A A . 522 ASN ND2 1 1 19 12686 1 1 25 ASN O O -3.437 0.522 -1.470 1.00 . A A . 522 ASN O 1 1 19 12687 1 1 25 ASN OD1 O -4.441 5.260 -1.103 1.00 . A A . 522 ASN OD1 1 1 19 12688 1 1 26 TYR C C -5.311 -1.607 1.265 1.00 . A A . 523 TYR C 1 1 19 12689 1 1 26 TYR CA C -3.975 -1.264 0.619 1.00 . A A . 523 TYR CA 1 1 19 12690 1 1 26 TYR CB C -2.859 -2.054 1.316 1.00 . A A . 523 TYR CB 1 1 19 12691 1 1 26 TYR CD1 C -0.940 -2.498 -0.266 1.00 . A A . 523 TYR CD1 1 1 19 12692 1 1 26 TYR CD2 C -0.648 -0.821 1.402 1.00 . A A . 523 TYR CD2 1 1 19 12693 1 1 26 TYR CE1 C 0.345 -2.275 -0.719 1.00 . A A . 523 TYR CE1 1 1 19 12694 1 1 26 TYR CE2 C 0.638 -0.589 0.947 1.00 . A A . 523 TYR CE2 1 1 19 12695 1 1 26 TYR CG C -1.460 -1.778 0.801 1.00 . A A . 523 TYR CG 1 1 19 12696 1 1 26 TYR CZ C 1.129 -1.321 -0.111 1.00 . A A . 523 TYR CZ 1 1 19 12697 1 1 26 TYR H H -3.807 0.581 1.626 1.00 . A A . 523 TYR H 1 1 19 12698 1 1 26 TYR HA H -4.007 -1.518 -0.431 1.00 . A A . 523 TYR HA 1 1 19 12699 1 1 26 TYR HB2 H -2.871 -1.813 2.367 1.00 . A A . 523 TYR HB2 1 1 19 12700 1 1 26 TYR HB3 H -3.053 -3.111 1.197 1.00 . A A . 523 TYR HB3 1 1 19 12701 1 1 26 TYR HD1 H -1.556 -3.245 -0.745 1.00 . A A . 523 TYR HD1 1 1 19 12702 1 1 26 TYR HD2 H -1.038 -0.246 2.230 1.00 . A A . 523 TYR HD2 1 1 19 12703 1 1 26 TYR HE1 H 0.731 -2.845 -1.551 1.00 . A A . 523 TYR HE1 1 1 19 12704 1 1 26 TYR HE2 H 1.254 0.158 1.426 1.00 . A A . 523 TYR HE2 1 1 19 12705 1 1 26 TYR HH H 2.464 -1.276 -1.510 1.00 . A A . 523 TYR HH 1 1 19 12706 1 1 26 TYR N N -3.738 0.161 0.737 1.00 . A A . 523 TYR N 1 1 19 12707 1 1 26 TYR O O -6.025 -0.726 1.742 1.00 . A A . 523 TYR O 1 1 19 12708 1 1 26 TYR OH O 2.414 -1.103 -0.557 1.00 . A A . 523 TYR OH 1 1 19 12709 1 1 27 CYS C C -6.672 -4.134 3.140 1.00 . A A . 524 CYS C 1 1 19 12710 1 1 27 CYS CA C -6.905 -3.317 1.877 1.00 . A A . 524 CYS CA 1 1 19 12711 1 1 27 CYS CB C -7.692 -4.133 0.845 1.00 . A A . 524 CYS CB 1 1 19 12712 1 1 27 CYS H H -4.987 -3.559 1.031 1.00 . A A . 524 CYS H 1 1 19 12713 1 1 27 CYS HA H -7.470 -2.435 2.135 1.00 . A A . 524 CYS HA 1 1 19 12714 1 1 27 CYS HB2 H -8.721 -4.201 1.162 1.00 . A A . 524 CYS HB2 1 1 19 12715 1 1 27 CYS HB3 H -7.650 -3.625 -0.108 1.00 . A A . 524 CYS HB3 1 1 19 12716 1 1 27 CYS N N -5.633 -2.888 1.323 1.00 . A A . 524 CYS N 1 1 19 12717 1 1 27 CYS O O -7.570 -4.299 3.970 1.00 . A A . 524 CYS O 1 1 19 12718 1 1 27 CYS SG S -7.083 -5.830 0.592 1.00 . A A . 524 CYS SG 1 1 19 12719 1 1 28 SER C C -3.552 -5.434 4.546 1.00 . A A . 525 SER C 1 1 19 12720 1 1 28 SER CA C -5.069 -5.467 4.399 1.00 . A A . 525 SER CA 1 1 19 12721 1 1 28 SER CB C -5.558 -6.901 4.162 1.00 . A A . 525 SER CB 1 1 19 12722 1 1 28 SER H H -4.770 -4.422 2.608 1.00 . A A . 525 SER H 1 1 19 12723 1 1 28 SER HA H -5.525 -5.070 5.295 1.00 . A A . 525 SER HA 1 1 19 12724 1 1 28 SER HB2 H -6.636 -6.905 4.103 1.00 . A A . 525 SER HB2 1 1 19 12725 1 1 28 SER HB3 H -5.150 -7.261 3.228 1.00 . A A . 525 SER HB3 1 1 19 12726 1 1 28 SER HG H -5.278 -8.699 4.898 1.00 . A A . 525 SER HG 1 1 19 12727 1 1 28 SER N N -5.450 -4.628 3.282 1.00 . A A . 525 SER N 1 1 19 12728 1 1 28 SER O O -2.847 -5.026 3.619 1.00 . A A . 525 SER O 1 1 19 12729 1 1 28 SER OG O -5.158 -7.782 5.200 1.00 . A A . 525 SER OG 1 1 19 12730 1 1 29 THR C C -0.905 -6.854 5.028 1.00 . A A . 526 THR C 1 1 19 12731 1 1 29 THR CA C -1.622 -5.869 5.956 1.00 . A A . 526 THR CA 1 1 19 12732 1 1 29 THR CB C -1.343 -6.245 7.420 1.00 . A A . 526 THR CB 1 1 19 12733 1 1 29 THR CG2 C 0.045 -5.791 7.843 1.00 . A A . 526 THR CG2 1 1 19 12734 1 1 29 THR H H -3.663 -6.168 6.401 1.00 . A A . 526 THR H 1 1 19 12735 1 1 29 THR HA H -1.239 -4.873 5.778 1.00 . A A . 526 THR HA 1 1 19 12736 1 1 29 THR HB H -1.407 -7.319 7.523 1.00 . A A . 526 THR HB 1 1 19 12737 1 1 29 THR HG1 H -1.946 -4.847 8.689 1.00 . A A . 526 THR HG1 1 1 19 12738 1 1 29 THR HG21 H 0.111 -4.715 7.765 1.00 . A A . 526 THR HG21 1 1 19 12739 1 1 29 THR HG22 H 0.224 -6.089 8.866 1.00 . A A . 526 THR HG22 1 1 19 12740 1 1 29 THR HG23 H 0.784 -6.245 7.201 1.00 . A A . 526 THR HG23 1 1 19 12741 1 1 29 THR N N -3.053 -5.858 5.698 1.00 . A A . 526 THR N 1 1 19 12742 1 1 29 THR O O 0.285 -6.705 4.743 1.00 . A A . 526 THR O 1 1 19 12743 1 1 29 THR OG1 O -2.326 -5.630 8.265 1.00 . A A . 526 THR OG1 1 1 19 12744 1 1 30 PHE C C -0.624 -8.193 2.340 1.00 . A A . 527 PHE C 1 1 19 12745 1 1 30 PHE CA C -1.093 -8.849 3.637 1.00 . A A . 527 PHE CA 1 1 19 12746 1 1 30 PHE CB C -2.147 -9.917 3.336 1.00 . A A . 527 PHE CB 1 1 19 12747 1 1 30 PHE CD1 C -1.029 -12.046 2.602 1.00 . A A . 527 PHE CD1 1 1 19 12748 1 1 30 PHE CD2 C -2.079 -10.685 0.948 1.00 . A A . 527 PHE CD2 1 1 19 12749 1 1 30 PHE CE1 C -0.661 -12.951 1.626 1.00 . A A . 527 PHE CE1 1 1 19 12750 1 1 30 PHE CE2 C -1.714 -11.585 -0.029 1.00 . A A . 527 PHE CE2 1 1 19 12751 1 1 30 PHE CG C -1.740 -10.903 2.275 1.00 . A A . 527 PHE CG 1 1 19 12752 1 1 30 PHE CZ C -1.004 -12.721 0.309 1.00 . A A . 527 PHE CZ 1 1 19 12753 1 1 30 PHE H H -2.577 -7.933 4.831 1.00 . A A . 527 PHE H 1 1 19 12754 1 1 30 PHE HA H -0.246 -9.316 4.120 1.00 . A A . 527 PHE HA 1 1 19 12755 1 1 30 PHE HB2 H -2.354 -10.472 4.240 1.00 . A A . 527 PHE HB2 1 1 19 12756 1 1 30 PHE HB3 H -3.053 -9.430 3.008 1.00 . A A . 527 PHE HB3 1 1 19 12757 1 1 30 PHE HD1 H -0.760 -12.226 3.632 1.00 . A A . 527 PHE HD1 1 1 19 12758 1 1 30 PHE HD2 H -2.631 -9.797 0.683 1.00 . A A . 527 PHE HD2 1 1 19 12759 1 1 30 PHE HE1 H -0.106 -13.837 1.894 1.00 . A A . 527 PHE HE1 1 1 19 12760 1 1 30 PHE HE2 H -1.982 -11.402 -1.056 1.00 . A A . 527 PHE HE2 1 1 19 12761 1 1 30 PHE HZ H -0.719 -13.427 -0.455 1.00 . A A . 527 PHE HZ 1 1 19 12762 1 1 30 PHE N N -1.641 -7.856 4.552 1.00 . A A . 527 PHE N 1 1 19 12763 1 1 30 PHE O O 0.501 -8.415 1.896 1.00 . A A . 527 PHE O 1 1 19 12764 1 1 31 CYS C C 0.020 -5.720 0.731 1.00 . A A . 528 CYS C 1 1 19 12765 1 1 31 CYS CA C -1.145 -6.678 0.512 1.00 . A A . 528 CYS CA 1 1 19 12766 1 1 31 CYS CB C -2.364 -5.956 -0.036 1.00 . A A . 528 CYS CB 1 1 19 12767 1 1 31 CYS H H -2.361 -7.225 2.149 1.00 . A A . 528 CYS H 1 1 19 12768 1 1 31 CYS HA H -0.836 -7.440 -0.190 1.00 . A A . 528 CYS HA 1 1 19 12769 1 1 31 CYS HB2 H -2.678 -5.196 0.666 1.00 . A A . 528 CYS HB2 1 1 19 12770 1 1 31 CYS HB3 H -2.112 -5.494 -0.978 1.00 . A A . 528 CYS HB3 1 1 19 12771 1 1 31 CYS N N -1.480 -7.367 1.749 1.00 . A A . 528 CYS N 1 1 19 12772 1 1 31 CYS O O 0.855 -5.534 -0.153 1.00 . A A . 528 CYS O 1 1 19 12773 1 1 31 CYS SG S -3.765 -7.074 -0.318 1.00 . A A . 528 CYS SG 1 1 19 12774 1 1 32 GLN C C 2.493 -5.015 2.191 1.00 . A A . 529 GLN C 1 1 19 12775 1 1 32 GLN CA C 1.172 -4.251 2.289 1.00 . A A . 529 GLN CA 1 1 19 12776 1 1 32 GLN CB C 0.965 -3.721 3.720 1.00 . A A . 529 GLN CB 1 1 19 12777 1 1 32 GLN CD C 2.669 -1.884 4.069 1.00 . A A . 529 GLN CD 1 1 19 12778 1 1 32 GLN CG C 2.242 -3.291 4.425 1.00 . A A . 529 GLN CG 1 1 19 12779 1 1 32 GLN H H -0.631 -5.315 2.573 1.00 . A A . 529 GLN H 1 1 19 12780 1 1 32 GLN HA H 1.184 -3.422 1.597 1.00 . A A . 529 GLN HA 1 1 19 12781 1 1 32 GLN HB2 H 0.310 -2.859 3.681 1.00 . A A . 529 GLN HB2 1 1 19 12782 1 1 32 GLN HB3 H 0.495 -4.493 4.311 1.00 . A A . 529 GLN HB3 1 1 19 12783 1 1 32 GLN HE21 H 3.736 -2.550 2.528 1.00 . A A . 529 GLN HE21 1 1 19 12784 1 1 32 GLN HE22 H 3.749 -0.837 2.782 1.00 . A A . 529 GLN HE22 1 1 19 12785 1 1 32 GLN HG2 H 2.080 -3.340 5.491 1.00 . A A . 529 GLN HG2 1 1 19 12786 1 1 32 GLN HG3 H 3.034 -3.973 4.153 1.00 . A A . 529 GLN HG3 1 1 19 12787 1 1 32 GLN N N 0.070 -5.128 1.917 1.00 . A A . 529 GLN N 1 1 19 12788 1 1 32 GLN NE2 N 3.464 -1.744 3.021 1.00 . A A . 529 GLN NE2 1 1 19 12789 1 1 32 GLN O O 3.475 -4.523 1.628 1.00 . A A . 529 GLN O 1 1 19 12790 1 1 32 GLN OE1 O 2.283 -0.929 4.733 1.00 . A A . 529 GLN OE1 1 1 19 12791 1 1 33 ARG C C 4.028 -7.640 1.414 1.00 . A A . 530 ARG C 1 1 19 12792 1 1 33 ARG CA C 3.706 -7.041 2.781 1.00 . A A . 530 ARG CA 1 1 19 12793 1 1 33 ARG CB C 3.594 -8.145 3.825 1.00 . A A . 530 ARG CB 1 1 19 12794 1 1 33 ARG CD C 3.358 -8.776 6.229 1.00 . A A . 530 ARG CD 1 1 19 12795 1 1 33 ARG CG C 3.472 -7.630 5.244 1.00 . A A . 530 ARG CG 1 1 19 12796 1 1 33 ARG CZ C 2.115 -8.817 8.354 1.00 . A A . 530 ARG CZ 1 1 19 12797 1 1 33 ARG H H 1.670 -6.569 3.145 1.00 . A A . 530 ARG H 1 1 19 12798 1 1 33 ARG HA H 4.511 -6.376 3.046 1.00 . A A . 530 ARG HA 1 1 19 12799 1 1 33 ARG HB2 H 2.718 -8.738 3.606 1.00 . A A . 530 ARG HB2 1 1 19 12800 1 1 33 ARG HB3 H 4.468 -8.775 3.767 1.00 . A A . 530 ARG HB3 1 1 19 12801 1 1 33 ARG HD2 H 2.556 -9.429 5.911 1.00 . A A . 530 ARG HD2 1 1 19 12802 1 1 33 ARG HD3 H 4.288 -9.324 6.227 1.00 . A A . 530 ARG HD3 1 1 19 12803 1 1 33 ARG HE H 3.648 -7.589 7.944 1.00 . A A . 530 ARG HE 1 1 19 12804 1 1 33 ARG HG2 H 4.350 -7.047 5.484 1.00 . A A . 530 ARG HG2 1 1 19 12805 1 1 33 ARG HG3 H 2.591 -7.010 5.317 1.00 . A A . 530 ARG HG3 1 1 19 12806 1 1 33 ARG HH11 H 1.460 -10.141 6.958 1.00 . A A . 530 ARG HH11 1 1 19 12807 1 1 33 ARG HH12 H 0.623 -10.176 8.480 1.00 . A A . 530 ARG HH12 1 1 19 12808 1 1 33 ARG HH21 H 2.510 -7.615 9.934 1.00 . A A . 530 ARG HH21 1 1 19 12809 1 1 33 ARG HH22 H 1.187 -8.722 10.157 1.00 . A A . 530 ARG HH22 1 1 19 12810 1 1 33 ARG N N 2.503 -6.220 2.754 1.00 . A A . 530 ARG N 1 1 19 12811 1 1 33 ARG NE N 3.080 -8.315 7.587 1.00 . A A . 530 ARG NE 1 1 19 12812 1 1 33 ARG NH1 N 1.333 -9.785 7.893 1.00 . A A . 530 ARG NH1 1 1 19 12813 1 1 33 ARG NH2 N 1.928 -8.347 9.578 1.00 . A A . 530 ARG NH2 1 1 19 12814 1 1 33 ARG O O 5.195 -7.767 1.055 1.00 . A A . 530 ARG O 1 1 19 12815 1 1 34 LYS C C 3.794 -7.659 -1.641 1.00 . A A . 531 LYS C 1 1 19 12816 1 1 34 LYS CA C 3.244 -8.662 -0.636 1.00 . A A . 531 LYS CA 1 1 19 12817 1 1 34 LYS CB C 1.975 -9.361 -1.165 1.00 . A A . 531 LYS CB 1 1 19 12818 1 1 34 LYS CD C 0.860 -7.744 -2.790 1.00 . A A . 531 LYS CD 1 1 19 12819 1 1 34 LYS CE C 1.049 -8.714 -3.945 1.00 . A A . 531 LYS CE 1 1 19 12820 1 1 34 LYS CG C 0.768 -8.464 -1.446 1.00 . A A . 531 LYS CG 1 1 19 12821 1 1 34 LYS H H 2.086 -7.914 0.988 1.00 . A A . 531 LYS H 1 1 19 12822 1 1 34 LYS HA H 4.002 -9.416 -0.477 1.00 . A A . 531 LYS HA 1 1 19 12823 1 1 34 LYS HB2 H 2.225 -9.866 -2.082 1.00 . A A . 531 LYS HB2 1 1 19 12824 1 1 34 LYS HB3 H 1.674 -10.098 -0.438 1.00 . A A . 531 LYS HB3 1 1 19 12825 1 1 34 LYS HD2 H -0.052 -7.188 -2.949 1.00 . A A . 531 LYS HD2 1 1 19 12826 1 1 34 LYS HD3 H 1.697 -7.061 -2.763 1.00 . A A . 531 LYS HD3 1 1 19 12827 1 1 34 LYS HE2 H 1.956 -9.278 -3.783 1.00 . A A . 531 LYS HE2 1 1 19 12828 1 1 34 LYS HE3 H 0.207 -9.391 -3.973 1.00 . A A . 531 LYS HE3 1 1 19 12829 1 1 34 LYS HG2 H -0.122 -9.073 -1.443 1.00 . A A . 531 LYS HG2 1 1 19 12830 1 1 34 LYS HG3 H 0.699 -7.726 -0.660 1.00 . A A . 531 LYS HG3 1 1 19 12831 1 1 34 LYS HZ1 H 1.936 -7.326 -5.233 1.00 . A A . 531 LYS HZ1 1 1 19 12832 1 1 34 LYS HZ2 H 1.311 -8.693 -6.017 1.00 . A A . 531 LYS HZ2 1 1 19 12833 1 1 34 LYS HZ3 H 0.261 -7.492 -5.449 1.00 . A A . 531 LYS HZ3 1 1 19 12834 1 1 34 LYS N N 3.008 -8.031 0.659 1.00 . A A . 531 LYS N 1 1 19 12835 1 1 34 LYS NZ N 1.146 -8.009 -5.250 1.00 . A A . 531 LYS NZ 1 1 19 12836 1 1 34 LYS O O 4.647 -7.992 -2.463 1.00 . A A . 531 LYS O 1 1 19 12837 1 1 35 ASP C C 5.181 -4.918 -2.058 1.00 . A A . 532 ASP C 1 1 19 12838 1 1 35 ASP CA C 3.772 -5.357 -2.437 1.00 . A A . 532 ASP CA 1 1 19 12839 1 1 35 ASP CB C 2.810 -4.162 -2.367 1.00 . A A . 532 ASP CB 1 1 19 12840 1 1 35 ASP CG C 3.095 -3.112 -3.425 1.00 . A A . 532 ASP CG 1 1 19 12841 1 1 35 ASP H H 2.581 -6.245 -0.925 1.00 . A A . 532 ASP H 1 1 19 12842 1 1 35 ASP HA H 3.783 -5.728 -3.451 1.00 . A A . 532 ASP HA 1 1 19 12843 1 1 35 ASP HB2 H 1.799 -4.515 -2.503 1.00 . A A . 532 ASP HB2 1 1 19 12844 1 1 35 ASP HB3 H 2.894 -3.698 -1.394 1.00 . A A . 532 ASP HB3 1 1 19 12845 1 1 35 ASP N N 3.306 -6.431 -1.562 1.00 . A A . 532 ASP N 1 1 19 12846 1 1 35 ASP O O 5.869 -4.272 -2.839 1.00 . A A . 532 ASP O 1 1 19 12847 1 1 35 ASP OD1 O 3.137 -3.470 -4.624 1.00 . A A . 532 ASP OD1 1 1 19 12848 1 1 35 ASP OD2 O 3.274 -1.927 -3.068 1.00 . A A . 532 ASP OD2 1 1 19 12849 1 1 36 TRP C C 8.079 -5.233 -1.222 1.00 . A A . 533 TRP C 1 1 19 12850 1 1 36 TRP CA C 6.893 -4.913 -0.308 1.00 . A A . 533 TRP CA 1 1 19 12851 1 1 36 TRP CB C 7.109 -5.545 1.069 1.00 . A A . 533 TRP CB 1 1 19 12852 1 1 36 TRP CD1 C 9.455 -5.524 2.100 1.00 . A A . 533 TRP CD1 1 1 19 12853 1 1 36 TRP CD2 C 8.317 -3.609 2.342 1.00 . A A . 533 TRP CD2 1 1 19 12854 1 1 36 TRP CE2 C 9.583 -3.459 2.938 1.00 . A A . 533 TRP CE2 1 1 19 12855 1 1 36 TRP CE3 C 7.426 -2.529 2.370 1.00 . A A . 533 TRP CE3 1 1 19 12856 1 1 36 TRP CG C 8.256 -4.938 1.812 1.00 . A A . 533 TRP CG 1 1 19 12857 1 1 36 TRP CH2 C 9.093 -1.237 3.565 1.00 . A A . 533 TRP CH2 1 1 19 12858 1 1 36 TRP CZ2 C 9.982 -2.277 3.551 1.00 . A A . 533 TRP CZ2 1 1 19 12859 1 1 36 TRP CZ3 C 7.823 -1.355 2.983 1.00 . A A . 533 TRP CZ3 1 1 19 12860 1 1 36 TRP H H 5.060 -5.976 -0.373 1.00 . A A . 533 TRP H 1 1 19 12861 1 1 36 TRP HA H 6.844 -3.843 -0.170 1.00 . A A . 533 TRP HA 1 1 19 12862 1 1 36 TRP HB2 H 6.216 -5.412 1.663 1.00 . A A . 533 TRP HB2 1 1 19 12863 1 1 36 TRP HB3 H 7.305 -6.601 0.948 1.00 . A A . 533 TRP HB3 1 1 19 12864 1 1 36 TRP HD1 H 9.719 -6.535 1.828 1.00 . A A . 533 TRP HD1 1 1 19 12865 1 1 36 TRP HE1 H 11.172 -4.824 3.093 1.00 . A A . 533 TRP HE1 1 1 19 12866 1 1 36 TRP HE3 H 6.442 -2.601 1.925 1.00 . A A . 533 TRP HE3 1 1 19 12867 1 1 36 TRP HH2 H 9.363 -0.302 4.033 1.00 . A A . 533 TRP HH2 1 1 19 12868 1 1 36 TRP HZ2 H 10.960 -2.169 3.997 1.00 . A A . 533 TRP HZ2 1 1 19 12869 1 1 36 TRP HZ3 H 7.152 -0.510 3.014 1.00 . A A . 533 TRP HZ3 1 1 19 12870 1 1 36 TRP N N 5.620 -5.351 -0.878 1.00 . A A . 533 TRP N 1 1 19 12871 1 1 36 TRP NE1 N 10.259 -4.640 2.776 1.00 . A A . 533 TRP NE1 1 1 19 12872 1 1 36 TRP O O 9.089 -4.548 -1.194 1.00 . A A . 533 TRP O 1 1 19 12873 1 1 37 LYS C C 9.319 -5.504 -3.945 1.00 . A A . 534 LYS C 1 1 19 12874 1 1 37 LYS CA C 9.007 -6.640 -2.980 1.00 . A A . 534 LYS CA 1 1 19 12875 1 1 37 LYS CB C 8.638 -7.910 -3.746 1.00 . A A . 534 LYS CB 1 1 19 12876 1 1 37 LYS CD C 10.239 -9.501 -2.639 1.00 . A A . 534 LYS CD 1 1 19 12877 1 1 37 LYS CE C 10.998 -9.819 -3.919 1.00 . A A . 534 LYS CE 1 1 19 12878 1 1 37 LYS CG C 8.778 -9.178 -2.922 1.00 . A A . 534 LYS CG 1 1 19 12879 1 1 37 LYS H H 7.123 -6.780 -2.019 1.00 . A A . 534 LYS H 1 1 19 12880 1 1 37 LYS HA H 9.921 -6.810 -2.432 1.00 . A A . 534 LYS HA 1 1 19 12881 1 1 37 LYS HB2 H 7.612 -7.832 -4.075 1.00 . A A . 534 LYS HB2 1 1 19 12882 1 1 37 LYS HB3 H 9.279 -7.995 -4.611 1.00 . A A . 534 LYS HB3 1 1 19 12883 1 1 37 LYS HD2 H 10.701 -8.650 -2.160 1.00 . A A . 534 LYS HD2 1 1 19 12884 1 1 37 LYS HD3 H 10.286 -10.357 -1.981 1.00 . A A . 534 LYS HD3 1 1 19 12885 1 1 37 LYS HE2 H 10.548 -10.683 -4.383 1.00 . A A . 534 LYS HE2 1 1 19 12886 1 1 37 LYS HE3 H 10.920 -8.972 -4.583 1.00 . A A . 534 LYS HE3 1 1 19 12887 1 1 37 LYS HG2 H 8.262 -9.041 -1.984 1.00 . A A . 534 LYS HG2 1 1 19 12888 1 1 37 LYS HG3 H 8.336 -10.000 -3.464 1.00 . A A . 534 LYS HG3 1 1 19 12889 1 1 37 LYS HZ1 H 12.540 -10.884 -2.983 1.00 . A A . 534 LYS HZ1 1 1 19 12890 1 1 37 LYS HZ2 H 12.907 -10.375 -4.559 1.00 . A A . 534 LYS HZ2 1 1 19 12891 1 1 37 LYS HZ3 H 12.911 -9.256 -3.283 1.00 . A A . 534 LYS HZ3 1 1 19 12892 1 1 37 LYS N N 7.949 -6.265 -2.041 1.00 . A A . 534 LYS N 1 1 19 12893 1 1 37 LYS NZ N 12.436 -10.103 -3.667 1.00 . A A . 534 LYS NZ 1 1 19 12894 1 1 37 LYS O O 10.484 -5.272 -4.267 1.00 . A A . 534 LYS O 1 1 19 12895 1 1 38 ASP C C 8.568 -2.394 -4.317 1.00 . A A . 535 ASP C 1 1 19 12896 1 1 38 ASP CA C 8.541 -3.611 -5.212 1.00 . A A . 535 ASP CA 1 1 19 12897 1 1 38 ASP CB C 7.434 -3.434 -6.248 1.00 . A A . 535 ASP CB 1 1 19 12898 1 1 38 ASP CG C 7.866 -2.631 -7.463 1.00 . A A . 535 ASP CG 1 1 19 12899 1 1 38 ASP H H 7.386 -5.060 -4.178 1.00 . A A . 535 ASP H 1 1 19 12900 1 1 38 ASP HA H 9.498 -3.730 -5.696 1.00 . A A . 535 ASP HA 1 1 19 12901 1 1 38 ASP HB2 H 7.105 -4.396 -6.573 1.00 . A A . 535 ASP HB2 1 1 19 12902 1 1 38 ASP HB3 H 6.605 -2.922 -5.782 1.00 . A A . 535 ASP HB3 1 1 19 12903 1 1 38 ASP N N 8.305 -4.796 -4.399 1.00 . A A . 535 ASP N 1 1 19 12904 1 1 38 ASP O O 9.359 -1.480 -4.476 1.00 . A A . 535 ASP O 1 1 19 12905 1 1 38 ASP OD1 O 8.055 -1.406 -7.344 1.00 . A A . 535 ASP OD1 1 1 19 12906 1 1 38 ASP OD2 O 7.992 -3.224 -8.553 1.00 . A A . 535 ASP OD2 1 1 19 12907 1 1 39 HIS C C 8.666 -0.895 -1.709 1.00 . A A . 536 HIS C 1 1 19 12908 1 1 39 HIS CA C 7.442 -1.263 -2.532 1.00 . A A . 536 HIS CA 1 1 19 12909 1 1 39 HIS CB C 6.248 -1.523 -1.616 1.00 . A A . 536 HIS CB 1 1 19 12910 1 1 39 HIS CD2 C 5.573 0.123 0.268 1.00 . A A . 536 HIS CD2 1 1 19 12911 1 1 39 HIS CE1 C 4.607 1.634 -0.942 1.00 . A A . 536 HIS CE1 1 1 19 12912 1 1 39 HIS CG C 5.658 -0.287 -1.027 1.00 . A A . 536 HIS CG 1 1 19 12913 1 1 39 HIS H H 7.189 -3.236 -3.184 1.00 . A A . 536 HIS H 1 1 19 12914 1 1 39 HIS HA H 7.207 -0.445 -3.203 1.00 . A A . 536 HIS HA 1 1 19 12915 1 1 39 HIS HB2 H 5.473 -2.020 -2.180 1.00 . A A . 536 HIS HB2 1 1 19 12916 1 1 39 HIS HB3 H 6.560 -2.164 -0.805 1.00 . A A . 536 HIS HB3 1 1 19 12917 1 1 39 HIS HD1 H 4.903 0.669 -2.756 1.00 . A A . 536 HIS HD1 1 1 19 12918 1 1 39 HIS HD2 H 5.959 -0.399 1.129 1.00 . A A . 536 HIS HD2 1 1 19 12919 1 1 39 HIS HE1 H 4.102 2.534 -1.250 1.00 . A A . 536 HIS HE1 1 1 19 12920 1 1 39 HIS N N 7.692 -2.414 -3.351 1.00 . A A . 536 HIS N 1 1 19 12921 1 1 39 HIS ND1 N 5.037 0.687 -1.778 1.00 . A A . 536 HIS ND1 1 1 19 12922 1 1 39 HIS NE2 N 4.899 1.334 0.301 1.00 . A A . 536 HIS NE2 1 1 19 12923 1 1 39 HIS O O 8.905 0.269 -1.459 1.00 . A A . 536 HIS O 1 1 19 12924 1 1 40 GLN C C 11.645 -0.737 -1.098 1.00 . A A . 537 GLN C 1 1 19 12925 1 1 40 GLN CA C 10.594 -1.621 -0.427 1.00 . A A . 537 GLN CA 1 1 19 12926 1 1 40 GLN CB C 11.238 -2.922 0.049 1.00 . A A . 537 GLN CB 1 1 19 12927 1 1 40 GLN CD C 12.431 -5.051 -0.565 1.00 . A A . 537 GLN CD 1 1 19 12928 1 1 40 GLN CG C 11.967 -3.689 -1.040 1.00 . A A . 537 GLN CG 1 1 19 12929 1 1 40 GLN H H 9.254 -2.811 -1.585 1.00 . A A . 537 GLN H 1 1 19 12930 1 1 40 GLN HA H 10.212 -1.083 0.426 1.00 . A A . 537 GLN HA 1 1 19 12931 1 1 40 GLN HB2 H 11.946 -2.692 0.829 1.00 . A A . 537 GLN HB2 1 1 19 12932 1 1 40 GLN HB3 H 10.468 -3.562 0.454 1.00 . A A . 537 GLN HB3 1 1 19 12933 1 1 40 GLN HE21 H 10.706 -5.849 -1.117 1.00 . A A . 537 GLN HE21 1 1 19 12934 1 1 40 GLN HE22 H 11.851 -6.950 -0.421 1.00 . A A . 537 GLN HE22 1 1 19 12935 1 1 40 GLN HG2 H 11.305 -3.820 -1.893 1.00 . A A . 537 GLN HG2 1 1 19 12936 1 1 40 GLN HG3 H 12.830 -3.116 -1.339 1.00 . A A . 537 GLN HG3 1 1 19 12937 1 1 40 GLN N N 9.453 -1.883 -1.305 1.00 . A A . 537 GLN N 1 1 19 12938 1 1 40 GLN NE2 N 11.578 -6.048 -0.716 1.00 . A A . 537 GLN NE2 1 1 19 12939 1 1 40 GLN O O 12.344 0.017 -0.420 1.00 . A A . 537 GLN O 1 1 19 12940 1 1 40 GLN OE1 O 13.540 -5.199 -0.050 1.00 . A A . 537 GLN OE1 1 1 19 12941 1 1 41 HIS C C 12.143 1.385 -3.411 1.00 . A A . 538 HIS C 1 1 19 12942 1 1 41 HIS CA C 12.737 0.010 -3.117 1.00 . A A . 538 HIS CA 1 1 19 12943 1 1 41 HIS CB C 13.276 -0.657 -4.404 1.00 . A A . 538 HIS CB 1 1 19 12944 1 1 41 HIS CD2 C 11.516 -1.535 -6.083 1.00 . A A . 538 HIS CD2 1 1 19 12945 1 1 41 HIS CE1 C 11.481 0.197 -7.393 1.00 . A A . 538 HIS CE1 1 1 19 12946 1 1 41 HIS CG C 12.377 -0.606 -5.608 1.00 . A A . 538 HIS CG 1 1 19 12947 1 1 41 HIS H H 11.268 -1.517 -2.902 1.00 . A A . 538 HIS H 1 1 19 12948 1 1 41 HIS HA H 13.571 0.166 -2.449 1.00 . A A . 538 HIS HA 1 1 19 12949 1 1 41 HIS HB2 H 14.202 -0.179 -4.677 1.00 . A A . 538 HIS HB2 1 1 19 12950 1 1 41 HIS HB3 H 13.476 -1.698 -4.189 1.00 . A A . 538 HIS HB3 1 1 19 12951 1 1 41 HIS HD2 H 11.281 -2.484 -5.628 1.00 . A A . 538 HIS HD2 1 1 19 12952 1 1 41 HIS HE1 H 11.220 0.866 -8.198 1.00 . A A . 538 HIS HE1 1 1 19 12953 1 1 41 HIS HE2 H 10.092 -1.322 -7.610 1.00 . A A . 538 HIS HE2 1 1 19 12954 1 1 41 HIS N N 11.779 -0.836 -2.416 1.00 . A A . 538 HIS N 1 1 19 12955 1 1 41 HIS ND1 N 12.351 0.487 -6.440 1.00 . A A . 538 HIS ND1 1 1 19 12956 1 1 41 HIS NE2 N 10.948 -1.019 -7.222 1.00 . A A . 538 HIS NE2 1 1 19 12957 1 1 41 HIS O O 12.884 2.347 -3.629 1.00 . A A . 538 HIS O 1 1 19 12958 1 1 42 ILE C C 9.873 3.510 -2.335 1.00 . A A . 539 ILE C 1 1 19 12959 1 1 42 ILE CA C 10.161 2.770 -3.652 1.00 . A A . 539 ILE CA 1 1 19 12960 1 1 42 ILE CB C 8.860 2.593 -4.504 1.00 . A A . 539 ILE CB 1 1 19 12961 1 1 42 ILE CD1 C 6.832 3.404 -3.183 1.00 . A A . 539 ILE CD1 1 1 19 12962 1 1 42 ILE CG1 C 7.628 2.211 -3.675 1.00 . A A . 539 ILE CG1 1 1 19 12963 1 1 42 ILE CG2 C 9.080 1.554 -5.585 1.00 . A A . 539 ILE CG2 1 1 19 12964 1 1 42 ILE H H 10.264 0.681 -3.284 1.00 . A A . 539 ILE H 1 1 19 12965 1 1 42 ILE HA H 10.845 3.376 -4.228 1.00 . A A . 539 ILE HA 1 1 19 12966 1 1 42 ILE HB H 8.662 3.523 -4.997 1.00 . A A . 539 ILE HB 1 1 19 12967 1 1 42 ILE HD11 H 6.448 3.953 -4.029 1.00 . A A . 539 ILE HD11 1 1 19 12968 1 1 42 ILE HD12 H 6.013 3.061 -2.570 1.00 . A A . 539 ILE HD12 1 1 19 12969 1 1 42 ILE HD13 H 7.478 4.046 -2.600 1.00 . A A . 539 ILE HD13 1 1 19 12970 1 1 42 ILE HG12 H 6.973 1.607 -4.277 1.00 . A A . 539 ILE HG12 1 1 19 12971 1 1 42 ILE HG13 H 7.944 1.642 -2.813 1.00 . A A . 539 ILE HG13 1 1 19 12972 1 1 42 ILE HG21 H 9.365 0.616 -5.130 1.00 . A A . 539 ILE HG21 1 1 19 12973 1 1 42 ILE HG22 H 8.169 1.419 -6.149 1.00 . A A . 539 ILE HG22 1 1 19 12974 1 1 42 ILE HG23 H 9.868 1.885 -6.246 1.00 . A A . 539 ILE HG23 1 1 19 12975 1 1 42 ILE N N 10.816 1.488 -3.408 1.00 . A A . 539 ILE N 1 1 19 12976 1 1 42 ILE O O 10.127 4.710 -2.220 1.00 . A A . 539 ILE O 1 1 19 12977 1 1 43 CYS C C 10.001 4.170 0.563 1.00 . A A . 540 CYS C 1 1 19 12978 1 1 43 CYS CA C 8.900 3.345 -0.103 1.00 . A A . 540 CYS CA 1 1 19 12979 1 1 43 CYS CB C 8.498 2.202 0.828 1.00 . A A . 540 CYS CB 1 1 19 12980 1 1 43 CYS H H 9.154 1.823 -1.538 1.00 . A A . 540 CYS H 1 1 19 12981 1 1 43 CYS HA H 8.034 3.966 -0.262 1.00 . A A . 540 CYS HA 1 1 19 12982 1 1 43 CYS HB2 H 7.924 1.479 0.268 1.00 . A A . 540 CYS HB2 1 1 19 12983 1 1 43 CYS HB3 H 9.390 1.728 1.210 1.00 . A A . 540 CYS HB3 1 1 19 12984 1 1 43 CYS N N 9.331 2.782 -1.371 1.00 . A A . 540 CYS N 1 1 19 12985 1 1 43 CYS O O 11.118 3.700 0.799 1.00 . A A . 540 CYS O 1 1 19 12986 1 1 43 CYS SG S 7.493 2.720 2.249 1.00 . A A . 540 CYS SG 1 1 19 12987 1 1 44 GLY C C 10.307 7.765 1.206 1.00 . A A . 541 GLY C 1 1 19 12988 1 1 44 GLY CA C 10.609 6.310 1.469 1.00 . A A . 541 GLY CA 1 1 19 12989 1 1 44 GLY H H 8.753 5.715 0.647 1.00 . A A . 541 GLY H 1 1 19 12990 1 1 44 GLY HA2 H 10.590 6.138 2.535 1.00 . A A . 541 GLY HA2 1 1 19 12991 1 1 44 GLY HA3 H 11.598 6.087 1.099 1.00 . A A . 541 GLY HA3 1 1 19 12992 1 1 44 GLY N N 9.667 5.419 0.835 1.00 . A A . 541 GLY N 1 1 19 12993 1 1 44 GLY O O 9.658 8.427 2.010 1.00 . A A . 541 GLY O 1 1 19 12994 1 1 45 GLN C C 9.342 10.019 -0.940 1.00 . A A . 542 GLN C 1 1 19 12995 1 1 45 GLN CA C 10.659 9.667 -0.259 1.00 . A A . 542 GLN CA 1 1 19 12996 1 1 45 GLN CB C 11.860 10.083 -1.113 1.00 . A A . 542 GLN CB 1 1 19 12997 1 1 45 GLN CD C 13.523 9.372 -2.869 1.00 . A A . 542 GLN CD 1 1 19 12998 1 1 45 GLN CG C 12.144 9.158 -2.288 1.00 . A A . 542 GLN CG 1 1 19 12999 1 1 45 GLN H H 11.103 7.635 -0.611 1.00 . A A . 542 GLN H 1 1 19 13000 1 1 45 GLN HA H 10.707 10.204 0.678 1.00 . A A . 542 GLN HA 1 1 19 13001 1 1 45 GLN HB2 H 11.683 11.074 -1.502 1.00 . A A . 542 GLN HB2 1 1 19 13002 1 1 45 GLN HB3 H 12.739 10.108 -0.484 1.00 . A A . 542 GLN HB3 1 1 19 13003 1 1 45 GLN HE21 H 14.283 8.073 -1.576 1.00 . A A . 542 GLN HE21 1 1 19 13004 1 1 45 GLN HE22 H 15.411 8.797 -2.666 1.00 . A A . 542 GLN HE22 1 1 19 13005 1 1 45 GLN HG2 H 12.068 8.135 -1.957 1.00 . A A . 542 GLN HG2 1 1 19 13006 1 1 45 GLN HG3 H 11.411 9.344 -3.060 1.00 . A A . 542 GLN HG3 1 1 19 13007 1 1 45 GLN N N 10.738 8.249 0.055 1.00 . A A . 542 GLN N 1 1 19 13008 1 1 45 GLN NE2 N 14.503 8.676 -2.318 1.00 . A A . 542 GLN NE2 1 1 19 13009 1 1 45 GLN O O 9.240 10.050 -2.165 1.00 . A A . 542 GLN O 1 1 19 13010 1 1 45 GLN OE1 O 13.709 10.160 -3.794 1.00 . A A . 542 GLN OE1 1 1 19 13011 1 1 46 SER C C 7.040 12.169 -0.935 1.00 . A A . 543 SER C 1 1 19 13012 1 1 46 SER CA C 7.032 10.678 -0.627 1.00 . A A . 543 SER CA 1 1 19 13013 1 1 46 SER CB C 5.957 10.365 0.410 1.00 . A A . 543 SER CB 1 1 19 13014 1 1 46 SER H H 8.472 10.182 0.846 1.00 . A A . 543 SER H 1 1 19 13015 1 1 46 SER HA H 6.827 10.127 -1.531 1.00 . A A . 543 SER HA 1 1 19 13016 1 1 46 SER HB2 H 5.996 11.099 1.200 1.00 . A A . 543 SER HB2 1 1 19 13017 1 1 46 SER HB3 H 4.985 10.390 -0.060 1.00 . A A . 543 SER HB3 1 1 19 13018 1 1 46 SER HG H 6.612 9.170 1.820 1.00 . A A . 543 SER HG 1 1 19 13019 1 1 46 SER N N 8.334 10.270 -0.127 1.00 . A A . 543 SER N 1 1 19 13020 1 1 46 SER O O 6.832 12.583 -2.075 1.00 . A A . 543 SER O 1 1 19 13021 1 1 46 SER OG O 6.166 9.077 0.966 1.00 . A A . 543 SER OG 1 1 19 13022 1 1 47 ALA C C 8.119 14.981 1.167 1.00 . A A . 544 ALA C 1 1 19 13023 1 1 47 ALA CA C 7.379 14.408 -0.030 1.00 . A A . 544 ALA CA 1 1 19 13024 1 1 47 ALA CB C 5.990 15.020 -0.147 1.00 . A A . 544 ALA CB 1 1 19 13025 1 1 47 ALA H H 7.437 12.559 0.980 1.00 . A A . 544 ALA H 1 1 19 13026 1 1 47 ALA HA H 7.932 14.637 -0.932 1.00 . A A . 544 ALA HA 1 1 19 13027 1 1 47 ALA HB1 H 5.431 14.816 0.753 1.00 . A A . 544 ALA HB1 1 1 19 13028 1 1 47 ALA HB2 H 6.079 16.088 -0.283 1.00 . A A . 544 ALA HB2 1 1 19 13029 1 1 47 ALA HB3 H 5.478 14.592 -0.994 1.00 . A A . 544 ALA HB3 1 1 19 13030 1 1 47 ALA N N 7.298 12.962 0.095 1.00 . A A . 544 ALA N 1 1 19 13031 1 1 47 ALA O O 7.532 15.015 2.268 1.00 . A A . 544 ALA O 1 1 19 13032 1 1 47 ALA OXT O 9.292 15.371 1.015 1.00 . A A . 544 ALA OXT 1 1 19 13033 2 2 1 ZN ZN ZN -5.547 -5.900 -1.088 1.00 . B A . 601 ZN ZN 1 1 19 13034 3 2 1 ZN ZN ZN 5.281 2.744 1.645 1.00 . C A . 602 ZN ZN 1 1 20 13035 1 1 1 GLY C C -16.539 -0.153 2.011 1.00 . A A . 498 GLY C 1 1 20 13036 1 1 1 GLY CA C -16.988 -1.515 2.487 1.00 . A A . 498 GLY CA 1 1 20 13037 1 1 1 GLY H1 H -17.238 -2.569 4.268 1.00 . A A . 498 GLY H1 1 1 20 13038 1 1 1 GLY H2 H -17.552 -0.909 4.402 1.00 . A A . 498 GLY H2 1 1 20 13039 1 1 1 GLY H3 H -15.954 -1.464 4.295 1.00 . A A . 498 GLY H3 1 1 20 13040 1 1 1 GLY HA2 H -16.346 -2.268 2.053 1.00 . A A . 498 GLY HA2 1 1 20 13041 1 1 1 GLY HA3 H -18.003 -1.686 2.159 1.00 . A A . 498 GLY HA3 1 1 20 13042 1 1 1 GLY N N -16.930 -1.624 3.964 1.00 . A A . 498 GLY N 1 1 20 13043 1 1 1 GLY O O -17.258 0.836 2.171 1.00 . A A . 498 GLY O 1 1 20 13044 1 1 2 ALA C C -14.831 1.319 -0.511 1.00 . A A . 499 ALA C 1 1 20 13045 1 1 2 ALA CA C -14.791 1.180 1.006 1.00 . A A . 499 ALA CA 1 1 20 13046 1 1 2 ALA CB C -13.365 1.320 1.512 1.00 . A A . 499 ALA CB 1 1 20 13047 1 1 2 ALA H H -14.845 -0.919 1.274 1.00 . A A . 499 ALA H 1 1 20 13048 1 1 2 ALA HA H -15.382 1.970 1.446 1.00 . A A . 499 ALA HA 1 1 20 13049 1 1 2 ALA HB1 H -12.752 0.543 1.082 1.00 . A A . 499 ALA HB1 1 1 20 13050 1 1 2 ALA HB2 H -12.974 2.287 1.224 1.00 . A A . 499 ALA HB2 1 1 20 13051 1 1 2 ALA HB3 H -13.354 1.233 2.589 1.00 . A A . 499 ALA HB3 1 1 20 13052 1 1 2 ALA N N -15.352 -0.090 1.431 1.00 . A A . 499 ALA N 1 1 20 13053 1 1 2 ALA O O -14.982 0.330 -1.232 1.00 . A A . 499 ALA O 1 1 20 13054 1 1 3 MET C C -14.020 4.198 -2.651 1.00 . A A . 500 MET C 1 1 20 13055 1 1 3 MET CA C -14.653 2.829 -2.413 1.00 . A A . 500 MET CA 1 1 20 13056 1 1 3 MET CB C -16.046 2.763 -3.053 1.00 . A A . 500 MET CB 1 1 20 13057 1 1 3 MET CE C -19.108 1.923 -2.580 1.00 . A A . 500 MET CE 1 1 20 13058 1 1 3 MET CG C -17.034 3.762 -2.478 1.00 . A A . 500 MET CG 1 1 20 13059 1 1 3 MET H H -14.730 3.310 -0.357 1.00 . A A . 500 MET H 1 1 20 13060 1 1 3 MET HA H -14.024 2.075 -2.860 1.00 . A A . 500 MET HA 1 1 20 13061 1 1 3 MET HB2 H -15.952 2.954 -4.111 1.00 . A A . 500 MET HB2 1 1 20 13062 1 1 3 MET HB3 H -16.447 1.771 -2.911 1.00 . A A . 500 MET HB3 1 1 20 13063 1 1 3 MET HE1 H -19.068 1.899 -1.500 1.00 . A A . 500 MET HE1 1 1 20 13064 1 1 3 MET HE2 H -20.102 1.664 -2.909 1.00 . A A . 500 MET HE2 1 1 20 13065 1 1 3 MET HE3 H -18.398 1.212 -2.980 1.00 . A A . 500 MET HE3 1 1 20 13066 1 1 3 MET HG2 H -17.077 3.628 -1.408 1.00 . A A . 500 MET HG2 1 1 20 13067 1 1 3 MET HG3 H -16.684 4.760 -2.699 1.00 . A A . 500 MET HG3 1 1 20 13068 1 1 3 MET N N -14.731 2.556 -0.985 1.00 . A A . 500 MET N 1 1 20 13069 1 1 3 MET O O -14.179 4.792 -3.718 1.00 . A A . 500 MET O 1 1 20 13070 1 1 3 MET SD S -18.694 3.570 -3.153 1.00 . A A . 500 MET SD 1 1 20 13071 1 1 4 GLU C C -11.236 5.878 -2.218 1.00 . A A . 501 GLU C 1 1 20 13072 1 1 4 GLU CA C -12.669 6.006 -1.719 1.00 . A A . 501 GLU CA 1 1 20 13073 1 1 4 GLU CB C -12.644 6.658 -0.331 1.00 . A A . 501 GLU CB 1 1 20 13074 1 1 4 GLU CD C -15.155 6.525 -0.007 1.00 . A A . 501 GLU CD 1 1 20 13075 1 1 4 GLU CG C -13.792 6.247 0.584 1.00 . A A . 501 GLU CG 1 1 20 13076 1 1 4 GLU H H -13.164 4.141 -0.848 1.00 . A A . 501 GLU H 1 1 20 13077 1 1 4 GLU HA H -13.237 6.622 -2.401 1.00 . A A . 501 GLU HA 1 1 20 13078 1 1 4 GLU HB2 H -11.717 6.391 0.158 1.00 . A A . 501 GLU HB2 1 1 20 13079 1 1 4 GLU HB3 H -12.678 7.731 -0.451 1.00 . A A . 501 GLU HB3 1 1 20 13080 1 1 4 GLU HG2 H -13.714 5.187 0.781 1.00 . A A . 501 GLU HG2 1 1 20 13081 1 1 4 GLU HG3 H -13.703 6.789 1.514 1.00 . A A . 501 GLU HG3 1 1 20 13082 1 1 4 GLU N N -13.290 4.684 -1.653 1.00 . A A . 501 GLU N 1 1 20 13083 1 1 4 GLU O O -10.667 6.796 -2.810 1.00 . A A . 501 GLU O 1 1 20 13084 1 1 4 GLU OE1 O -15.505 7.710 -0.184 1.00 . A A . 501 GLU OE1 1 1 20 13085 1 1 4 GLU OE2 O -15.890 5.558 -0.287 1.00 . A A . 501 GLU OE2 1 1 20 13086 1 1 5 GLN C C -9.135 2.982 -2.622 1.00 . A A . 502 GLN C 1 1 20 13087 1 1 5 GLN CA C -9.278 4.432 -2.206 1.00 . A A . 502 GLN CA 1 1 20 13088 1 1 5 GLN CB C -8.471 4.721 -0.933 1.00 . A A . 502 GLN CB 1 1 20 13089 1 1 5 GLN CD C -8.466 4.656 1.594 1.00 . A A . 502 GLN CD 1 1 20 13090 1 1 5 GLN CG C -9.011 4.043 0.318 1.00 . A A . 502 GLN CG 1 1 20 13091 1 1 5 GLN H H -11.230 4.002 -1.587 1.00 . A A . 502 GLN H 1 1 20 13092 1 1 5 GLN HA H -8.897 5.066 -2.994 1.00 . A A . 502 GLN HA 1 1 20 13093 1 1 5 GLN HB2 H -7.455 4.388 -1.084 1.00 . A A . 502 GLN HB2 1 1 20 13094 1 1 5 GLN HB3 H -8.466 5.787 -0.761 1.00 . A A . 502 GLN HB3 1 1 20 13095 1 1 5 GLN HE21 H -6.810 5.222 0.659 1.00 . A A . 502 GLN HE21 1 1 20 13096 1 1 5 GLN HE22 H -6.903 5.624 2.338 1.00 . A A . 502 GLN HE22 1 1 20 13097 1 1 5 GLN HG2 H -10.086 4.133 0.326 1.00 . A A . 502 GLN HG2 1 1 20 13098 1 1 5 GLN HG3 H -8.736 2.998 0.295 1.00 . A A . 502 GLN HG3 1 1 20 13099 1 1 5 GLN N N -10.675 4.717 -1.958 1.00 . A A . 502 GLN N 1 1 20 13100 1 1 5 GLN NE2 N -7.274 5.223 1.522 1.00 . A A . 502 GLN NE2 1 1 20 13101 1 1 5 GLN O O -9.888 2.130 -2.161 1.00 . A A . 502 GLN O 1 1 20 13102 1 1 5 GLN OE1 O -9.123 4.637 2.634 1.00 . A A . 502 GLN OE1 1 1 20 13103 1 1 6 SER C C -6.742 0.715 -3.557 1.00 . A A . 503 SER C 1 1 20 13104 1 1 6 SER CA C -8.042 1.356 -4.025 1.00 . A A . 503 SER CA 1 1 20 13105 1 1 6 SER CB C -8.096 1.380 -5.549 1.00 . A A . 503 SER CB 1 1 20 13106 1 1 6 SER H H -7.596 3.417 -3.819 1.00 . A A . 503 SER H 1 1 20 13107 1 1 6 SER HA H -8.868 0.767 -3.658 1.00 . A A . 503 SER HA 1 1 20 13108 1 1 6 SER HB2 H -7.311 2.016 -5.926 1.00 . A A . 503 SER HB2 1 1 20 13109 1 1 6 SER HB3 H -7.961 0.378 -5.928 1.00 . A A . 503 SER HB3 1 1 20 13110 1 1 6 SER HG H -9.215 2.750 -6.393 1.00 . A A . 503 SER HG 1 1 20 13111 1 1 6 SER N N -8.197 2.702 -3.505 1.00 . A A . 503 SER N 1 1 20 13112 1 1 6 SER O O -5.665 1.295 -3.688 1.00 . A A . 503 SER O 1 1 20 13113 1 1 6 SER OG O -9.342 1.875 -5.999 1.00 . A A . 503 SER OG 1 1 20 13114 1 1 7 CYS C C -4.834 -1.495 -3.846 1.00 . A A . 504 CYS C 1 1 20 13115 1 1 7 CYS CA C -5.709 -1.278 -2.629 1.00 . A A . 504 CYS CA 1 1 20 13116 1 1 7 CYS CB C -6.165 -2.632 -2.063 1.00 . A A . 504 CYS CB 1 1 20 13117 1 1 7 CYS H H -7.762 -0.874 -2.902 1.00 . A A . 504 CYS H 1 1 20 13118 1 1 7 CYS HA H -5.155 -0.745 -1.869 1.00 . A A . 504 CYS HA 1 1 20 13119 1 1 7 CYS HB2 H -6.790 -2.460 -1.200 1.00 . A A . 504 CYS HB2 1 1 20 13120 1 1 7 CYS HB3 H -6.734 -3.151 -2.814 1.00 . A A . 504 CYS HB3 1 1 20 13121 1 1 7 CYS N N -6.859 -0.494 -3.025 1.00 . A A . 504 CYS N 1 1 20 13122 1 1 7 CYS O O -5.317 -1.910 -4.903 1.00 . A A . 504 CYS O 1 1 20 13123 1 1 7 CYS SG S -4.799 -3.728 -1.546 1.00 . A A . 504 CYS SG 1 1 20 13124 1 1 8 VAL C C -2.595 -2.749 -5.279 1.00 . A A . 505 VAL C 1 1 20 13125 1 1 8 VAL CA C -2.586 -1.324 -4.778 1.00 . A A . 505 VAL CA 1 1 20 13126 1 1 8 VAL CB C -1.142 -0.999 -4.340 1.00 . A A . 505 VAL CB 1 1 20 13127 1 1 8 VAL CG1 C -0.386 -0.293 -5.451 1.00 . A A . 505 VAL CG1 1 1 20 13128 1 1 8 VAL CG2 C -1.118 -0.187 -3.064 1.00 . A A . 505 VAL CG2 1 1 20 13129 1 1 8 VAL H H -3.262 -0.794 -2.842 1.00 . A A . 505 VAL H 1 1 20 13130 1 1 8 VAL HA H -2.862 -0.658 -5.584 1.00 . A A . 505 VAL HA 1 1 20 13131 1 1 8 VAL HB H -0.639 -1.935 -4.146 1.00 . A A . 505 VAL HB 1 1 20 13132 1 1 8 VAL HG11 H -0.878 0.639 -5.687 1.00 . A A . 505 VAL HG11 1 1 20 13133 1 1 8 VAL HG12 H 0.625 -0.097 -5.129 1.00 . A A . 505 VAL HG12 1 1 20 13134 1 1 8 VAL HG13 H -0.369 -0.924 -6.329 1.00 . A A . 505 VAL HG13 1 1 20 13135 1 1 8 VAL HG21 H -1.727 0.695 -3.186 1.00 . A A . 505 VAL HG21 1 1 20 13136 1 1 8 VAL HG22 H -1.506 -0.789 -2.255 1.00 . A A . 505 VAL HG22 1 1 20 13137 1 1 8 VAL HG23 H -0.103 0.100 -2.842 1.00 . A A . 505 VAL HG23 1 1 20 13138 1 1 8 VAL N N -3.555 -1.170 -3.698 1.00 . A A . 505 VAL N 1 1 20 13139 1 1 8 VAL O O -2.273 -3.015 -6.435 1.00 . A A . 505 VAL O 1 1 20 13140 1 1 9 ASN C C -4.294 -5.530 -5.268 1.00 . A A . 506 ASN C 1 1 20 13141 1 1 9 ASN CA C -2.950 -5.065 -4.722 1.00 . A A . 506 ASN CA 1 1 20 13142 1 1 9 ASN CB C -2.607 -5.889 -3.487 1.00 . A A . 506 ASN CB 1 1 20 13143 1 1 9 ASN CG C -2.465 -7.360 -3.807 1.00 . A A . 506 ASN CG 1 1 20 13144 1 1 9 ASN H H -3.260 -3.388 -3.498 1.00 . A A . 506 ASN H 1 1 20 13145 1 1 9 ASN HA H -2.187 -5.212 -5.464 1.00 . A A . 506 ASN HA 1 1 20 13146 1 1 9 ASN HB2 H -1.674 -5.538 -3.072 1.00 . A A . 506 ASN HB2 1 1 20 13147 1 1 9 ASN HB3 H -3.390 -5.772 -2.754 1.00 . A A . 506 ASN HB3 1 1 20 13148 1 1 9 ASN HD21 H -3.637 -7.825 -2.280 1.00 . A A . 506 ASN HD21 1 1 20 13149 1 1 9 ASN HD22 H -3.032 -9.162 -3.196 1.00 . A A . 506 ASN HD22 1 1 20 13150 1 1 9 ASN N N -2.970 -3.663 -4.398 1.00 . A A . 506 ASN N 1 1 20 13151 1 1 9 ASN ND2 N -3.106 -8.199 -3.015 1.00 . A A . 506 ASN ND2 1 1 20 13152 1 1 9 ASN O O -4.349 -6.385 -6.150 1.00 . A A . 506 ASN O 1 1 20 13153 1 1 9 ASN OD1 O -1.826 -7.735 -4.788 1.00 . A A . 506 ASN OD1 1 1 20 13154 1 1 10 CYS C C -7.606 -4.434 -5.712 1.00 . A A . 507 CYS C 1 1 20 13155 1 1 10 CYS CA C -6.699 -5.478 -5.056 1.00 . A A . 507 CYS CA 1 1 20 13156 1 1 10 CYS CB C -7.346 -5.989 -3.774 1.00 . A A . 507 CYS CB 1 1 20 13157 1 1 10 CYS H H -5.283 -4.172 -4.181 1.00 . A A . 507 CYS H 1 1 20 13158 1 1 10 CYS HA H -6.573 -6.312 -5.729 1.00 . A A . 507 CYS HA 1 1 20 13159 1 1 10 CYS HB2 H -7.661 -5.145 -3.178 1.00 . A A . 507 CYS HB2 1 1 20 13160 1 1 10 CYS HB3 H -8.207 -6.591 -4.026 1.00 . A A . 507 CYS HB3 1 1 20 13161 1 1 10 CYS N N -5.376 -4.957 -4.759 1.00 . A A . 507 CYS N 1 1 20 13162 1 1 10 CYS O O -7.766 -4.423 -6.933 1.00 . A A . 507 CYS O 1 1 20 13163 1 1 10 CYS SG S -6.232 -7.003 -2.761 1.00 . A A . 507 CYS SG 1 1 20 13164 1 1 11 GLY C C -9.731 -1.703 -4.331 1.00 . A A . 508 GLY C 1 1 20 13165 1 1 11 GLY CA C -9.159 -2.600 -5.415 1.00 . A A . 508 GLY CA 1 1 20 13166 1 1 11 GLY H H -7.966 -3.561 -3.948 1.00 . A A . 508 GLY H 1 1 20 13167 1 1 11 GLY HA2 H -8.674 -1.983 -6.157 1.00 . A A . 508 GLY HA2 1 1 20 13168 1 1 11 GLY HA3 H -9.969 -3.138 -5.885 1.00 . A A . 508 GLY HA3 1 1 20 13169 1 1 11 GLY N N -8.194 -3.560 -4.901 1.00 . A A . 508 GLY N 1 1 20 13170 1 1 11 GLY O O -9.157 -1.595 -3.252 1.00 . A A . 508 GLY O 1 1 20 13171 1 1 12 ARG C C -11.707 -0.488 -2.297 1.00 . A A . 509 ARG C 1 1 20 13172 1 1 12 ARG CA C -11.514 -0.065 -3.758 1.00 . A A . 509 ARG CA 1 1 20 13173 1 1 12 ARG CB C -12.886 0.279 -4.329 1.00 . A A . 509 ARG CB 1 1 20 13174 1 1 12 ARG CD C -15.267 -0.475 -4.631 1.00 . A A . 509 ARG CD 1 1 20 13175 1 1 12 ARG CG C -13.859 -0.888 -4.257 1.00 . A A . 509 ARG CG 1 1 20 13176 1 1 12 ARG CZ C -16.589 -0.269 -6.693 1.00 . A A . 509 ARG CZ 1 1 20 13177 1 1 12 ARG H H -11.291 -1.246 -5.501 1.00 . A A . 509 ARG H 1 1 20 13178 1 1 12 ARG HA H -10.903 0.822 -3.786 1.00 . A A . 509 ARG HA 1 1 20 13179 1 1 12 ARG HB2 H -13.301 1.109 -3.771 1.00 . A A . 509 ARG HB2 1 1 20 13180 1 1 12 ARG HB3 H -12.775 0.568 -5.363 1.00 . A A . 509 ARG HB3 1 1 20 13181 1 1 12 ARG HD2 H -15.947 -1.260 -4.339 1.00 . A A . 509 ARG HD2 1 1 20 13182 1 1 12 ARG HD3 H -15.510 0.429 -4.092 1.00 . A A . 509 ARG HD3 1 1 20 13183 1 1 12 ARG HE H -14.604 -0.007 -6.577 1.00 . A A . 509 ARG HE 1 1 20 13184 1 1 12 ARG HG2 H -13.529 -1.660 -4.937 1.00 . A A . 509 ARG HG2 1 1 20 13185 1 1 12 ARG HG3 H -13.863 -1.274 -3.248 1.00 . A A . 509 ARG HG3 1 1 20 13186 1 1 12 ARG HH11 H -17.648 -0.761 -5.036 1.00 . A A . 509 ARG HH11 1 1 20 13187 1 1 12 ARG HH12 H -18.582 -0.595 -6.489 1.00 . A A . 509 ARG HH12 1 1 20 13188 1 1 12 ARG HH21 H -15.823 0.183 -8.521 1.00 . A A . 509 ARG HH21 1 1 20 13189 1 1 12 ARG HH22 H -17.543 -0.065 -8.468 1.00 . A A . 509 ARG HH22 1 1 20 13190 1 1 12 ARG N N -10.879 -1.082 -4.620 1.00 . A A . 509 ARG N 1 1 20 13191 1 1 12 ARG NE N -15.420 -0.225 -6.062 1.00 . A A . 509 ARG NE 1 1 20 13192 1 1 12 ARG NH1 N -17.693 -0.567 -6.021 1.00 . A A . 509 ARG NH1 1 1 20 13193 1 1 12 ARG NH2 N -16.656 -0.033 -7.996 1.00 . A A . 509 ARG NH2 1 1 20 13194 1 1 12 ARG O O -12.040 0.340 -1.454 1.00 . A A . 509 ARG O 1 1 20 13195 1 1 13 GLU C C -10.619 -1.719 0.317 1.00 . A A . 510 GLU C 1 1 20 13196 1 1 13 GLU CA C -11.676 -2.280 -0.653 1.00 . A A . 510 GLU CA 1 1 20 13197 1 1 13 GLU CB C -11.633 -3.810 -0.663 1.00 . A A . 510 GLU CB 1 1 20 13198 1 1 13 GLU CD C -13.737 -4.100 0.698 1.00 . A A . 510 GLU CD 1 1 20 13199 1 1 13 GLU CG C -12.264 -4.439 0.567 1.00 . A A . 510 GLU CG 1 1 20 13200 1 1 13 GLU H H -11.260 -2.367 -2.730 1.00 . A A . 510 GLU H 1 1 20 13201 1 1 13 GLU HA H -12.646 -1.967 -0.310 1.00 . A A . 510 GLU HA 1 1 20 13202 1 1 13 GLU HB2 H -12.159 -4.169 -1.535 1.00 . A A . 510 GLU HB2 1 1 20 13203 1 1 13 GLU HB3 H -10.601 -4.130 -0.717 1.00 . A A . 510 GLU HB3 1 1 20 13204 1 1 13 GLU HG2 H -12.162 -5.512 0.499 1.00 . A A . 510 GLU HG2 1 1 20 13205 1 1 13 GLU HG3 H -11.746 -4.082 1.445 1.00 . A A . 510 GLU HG3 1 1 20 13206 1 1 13 GLU N N -11.508 -1.760 -2.005 1.00 . A A . 510 GLU N 1 1 20 13207 1 1 13 GLU O O -10.621 -2.049 1.506 1.00 . A A . 510 GLU O 1 1 20 13208 1 1 13 GLU OE1 O -14.064 -3.000 1.195 1.00 . A A . 510 GLU OE1 1 1 20 13209 1 1 13 GLU OE2 O -14.579 -4.939 0.313 1.00 . A A . 510 GLU OE2 1 1 20 13210 1 1 14 ALA C C -9.149 0.364 1.852 1.00 . A A . 511 ALA C 1 1 20 13211 1 1 14 ALA CA C -8.632 -0.317 0.588 1.00 . A A . 511 ALA CA 1 1 20 13212 1 1 14 ALA CB C -7.828 0.665 -0.241 1.00 . A A . 511 ALA CB 1 1 20 13213 1 1 14 ALA H H -9.787 -0.653 -1.149 1.00 . A A . 511 ALA H 1 1 20 13214 1 1 14 ALA HA H -7.972 -1.121 0.877 1.00 . A A . 511 ALA HA 1 1 20 13215 1 1 14 ALA HB1 H -8.479 1.447 -0.604 1.00 . A A . 511 ALA HB1 1 1 20 13216 1 1 14 ALA HB2 H -7.049 1.098 0.370 1.00 . A A . 511 ALA HB2 1 1 20 13217 1 1 14 ALA HB3 H -7.385 0.149 -1.081 1.00 . A A . 511 ALA HB3 1 1 20 13218 1 1 14 ALA N N -9.713 -0.895 -0.206 1.00 . A A . 511 ALA N 1 1 20 13219 1 1 14 ALA O O -9.971 1.281 1.804 1.00 . A A . 511 ALA O 1 1 20 13220 1 1 15 MET C C -7.816 0.597 5.189 1.00 . A A . 512 MET C 1 1 20 13221 1 1 15 MET CA C -9.032 0.395 4.292 1.00 . A A . 512 MET CA 1 1 20 13222 1 1 15 MET CB C -10.020 -0.572 4.955 1.00 . A A . 512 MET CB 1 1 20 13223 1 1 15 MET CE C -9.744 -4.558 6.140 1.00 . A A . 512 MET CE 1 1 20 13224 1 1 15 MET CG C -9.470 -1.964 5.212 1.00 . A A . 512 MET CG 1 1 20 13225 1 1 15 MET H H -7.978 -0.816 2.924 1.00 . A A . 512 MET H 1 1 20 13226 1 1 15 MET HA H -9.517 1.356 4.202 1.00 . A A . 512 MET HA 1 1 20 13227 1 1 15 MET HB2 H -10.329 -0.156 5.900 1.00 . A A . 512 MET HB2 1 1 20 13228 1 1 15 MET HB3 H -10.885 -0.668 4.318 1.00 . A A . 512 MET HB3 1 1 20 13229 1 1 15 MET HE1 H -8.844 -4.387 6.712 1.00 . A A . 512 MET HE1 1 1 20 13230 1 1 15 MET HE2 H -10.344 -5.311 6.629 1.00 . A A . 512 MET HE2 1 1 20 13231 1 1 15 MET HE3 H -9.482 -4.892 5.147 1.00 . A A . 512 MET HE3 1 1 20 13232 1 1 15 MET HG2 H -9.192 -2.409 4.268 1.00 . A A . 512 MET HG2 1 1 20 13233 1 1 15 MET HG3 H -8.598 -1.882 5.842 1.00 . A A . 512 MET HG3 1 1 20 13234 1 1 15 MET N N -8.640 -0.101 2.978 1.00 . A A . 512 MET N 1 1 20 13235 1 1 15 MET O O -7.926 1.189 6.260 1.00 . A A . 512 MET O 1 1 20 13236 1 1 15 MET SD S -10.675 -3.035 6.023 1.00 . A A . 512 MET SD 1 1 20 13237 1 1 16 SER C C -4.365 0.953 4.685 1.00 . A A . 513 SER C 1 1 20 13238 1 1 16 SER CA C -5.446 0.305 5.547 1.00 . A A . 513 SER CA 1 1 20 13239 1 1 16 SER CB C -4.964 -1.008 6.164 1.00 . A A . 513 SER CB 1 1 20 13240 1 1 16 SER H H -6.617 -0.398 3.932 1.00 . A A . 513 SER H 1 1 20 13241 1 1 16 SER HA H -5.702 1.006 6.326 1.00 . A A . 513 SER HA 1 1 20 13242 1 1 16 SER HB2 H -5.772 -1.462 6.717 1.00 . A A . 513 SER HB2 1 1 20 13243 1 1 16 SER HB3 H -4.650 -1.677 5.375 1.00 . A A . 513 SER HB3 1 1 20 13244 1 1 16 SER HG H -3.586 -1.655 7.400 1.00 . A A . 513 SER HG 1 1 20 13245 1 1 16 SER N N -6.661 0.100 4.774 1.00 . A A . 513 SER N 1 1 20 13246 1 1 16 SER O O -4.398 0.869 3.462 1.00 . A A . 513 SER O 1 1 20 13247 1 1 16 SER OG O -3.873 -0.800 7.043 1.00 . A A . 513 SER OG 1 1 20 13248 1 1 17 GLU C C -0.997 1.846 5.067 1.00 . A A . 514 GLU C 1 1 20 13249 1 1 17 GLU CA C -2.372 2.337 4.627 1.00 . A A . 514 GLU CA 1 1 20 13250 1 1 17 GLU CB C -2.513 3.841 4.886 1.00 . A A . 514 GLU CB 1 1 20 13251 1 1 17 GLU CD C -2.982 5.678 6.534 1.00 . A A . 514 GLU CD 1 1 20 13252 1 1 17 GLU CG C -2.550 4.239 6.351 1.00 . A A . 514 GLU CG 1 1 20 13253 1 1 17 GLU H H -3.422 1.614 6.306 1.00 . A A . 514 GLU H 1 1 20 13254 1 1 17 GLU HA H -2.500 2.181 3.565 1.00 . A A . 514 GLU HA 1 1 20 13255 1 1 17 GLU HB2 H -1.678 4.348 4.424 1.00 . A A . 514 GLU HB2 1 1 20 13256 1 1 17 GLU HB3 H -3.426 4.184 4.420 1.00 . A A . 514 GLU HB3 1 1 20 13257 1 1 17 GLU HG2 H -3.246 3.599 6.869 1.00 . A A . 514 GLU HG2 1 1 20 13258 1 1 17 GLU HG3 H -1.562 4.119 6.770 1.00 . A A . 514 GLU HG3 1 1 20 13259 1 1 17 GLU N N -3.425 1.621 5.328 1.00 . A A . 514 GLU N 1 1 20 13260 1 1 17 GLU O O -0.843 1.298 6.161 1.00 . A A . 514 GLU O 1 1 20 13261 1 1 17 GLU OE1 O -2.177 6.590 6.248 1.00 . A A . 514 GLU OE1 1 1 20 13262 1 1 17 GLU OE2 O -4.136 5.904 6.955 1.00 . A A . 514 GLU OE2 1 1 20 13263 1 1 18 CYS C C 1.912 2.675 5.563 1.00 . A A . 515 CYS C 1 1 20 13264 1 1 18 CYS CA C 1.368 1.704 4.534 1.00 . A A . 515 CYS CA 1 1 20 13265 1 1 18 CYS CB C 2.252 1.727 3.276 1.00 . A A . 515 CYS CB 1 1 20 13266 1 1 18 CYS H H -0.196 2.466 3.354 1.00 . A A . 515 CYS H 1 1 20 13267 1 1 18 CYS HA H 1.404 0.727 5.000 1.00 . A A . 515 CYS HA 1 1 20 13268 1 1 18 CYS HB2 H 2.130 0.797 2.743 1.00 . A A . 515 CYS HB2 1 1 20 13269 1 1 18 CYS HB3 H 1.939 2.543 2.641 1.00 . A A . 515 CYS HB3 1 1 20 13270 1 1 18 CYS N N -0.006 2.045 4.212 1.00 . A A . 515 CYS N 1 1 20 13271 1 1 18 CYS O O 1.821 3.891 5.406 1.00 . A A . 515 CYS O 1 1 20 13272 1 1 18 CYS SG S 4.038 1.938 3.607 1.00 . A A . 515 CYS SG 1 1 20 13273 1 1 19 THR C C 4.603 3.048 7.046 1.00 . A A . 516 THR C 1 1 20 13274 1 1 19 THR CA C 3.192 2.892 7.603 1.00 . A A . 516 THR CA 1 1 20 13275 1 1 19 THR CB C 3.227 2.197 8.975 1.00 . A A . 516 THR CB 1 1 20 13276 1 1 19 THR CG2 C 3.866 3.088 10.029 1.00 . A A . 516 THR CG2 1 1 20 13277 1 1 19 THR H H 2.265 1.184 6.849 1.00 . A A . 516 THR H 1 1 20 13278 1 1 19 THR HA H 2.738 3.868 7.713 1.00 . A A . 516 THR HA 1 1 20 13279 1 1 19 THR HB H 3.804 1.287 8.890 1.00 . A A . 516 THR HB 1 1 20 13280 1 1 19 THR HG1 H 1.288 2.052 8.644 1.00 . A A . 516 THR HG1 1 1 20 13281 1 1 19 THR HG21 H 3.300 4.004 10.117 1.00 . A A . 516 THR HG21 1 1 20 13282 1 1 19 THR HG22 H 3.871 2.575 10.980 1.00 . A A . 516 THR HG22 1 1 20 13283 1 1 19 THR HG23 H 4.881 3.318 9.738 1.00 . A A . 516 THR HG23 1 1 20 13284 1 1 19 THR N N 2.413 2.128 6.664 1.00 . A A . 516 THR N 1 1 20 13285 1 1 19 THR O O 5.299 2.061 6.791 1.00 . A A . 516 THR O 1 1 20 13286 1 1 19 THR OG1 O 1.889 1.871 9.375 1.00 . A A . 516 THR OG1 1 1 20 13287 1 1 20 GLY C C 6.034 5.569 5.077 1.00 . A A . 517 GLY C 1 1 20 13288 1 1 20 GLY CA C 6.250 4.544 6.159 1.00 . A A . 517 GLY CA 1 1 20 13289 1 1 20 GLY H H 4.494 5.021 7.243 1.00 . A A . 517 GLY H 1 1 20 13290 1 1 20 GLY HA2 H 6.986 4.915 6.859 1.00 . A A . 517 GLY HA2 1 1 20 13291 1 1 20 GLY HA3 H 6.612 3.629 5.712 1.00 . A A . 517 GLY HA3 1 1 20 13292 1 1 20 GLY N N 5.017 4.277 6.861 1.00 . A A . 517 GLY N 1 1 20 13293 1 1 20 GLY O O 6.749 6.569 5.004 1.00 . A A . 517 GLY O 1 1 20 13294 1 1 21 CYS C C 3.094 6.360 3.231 1.00 . A A . 518 CYS C 1 1 20 13295 1 1 21 CYS CA C 4.614 6.336 3.287 1.00 . A A . 518 CYS CA 1 1 20 13296 1 1 21 CYS CB C 5.196 6.045 1.899 1.00 . A A . 518 CYS CB 1 1 20 13297 1 1 21 CYS H H 4.552 4.476 4.279 1.00 . A A . 518 CYS H 1 1 20 13298 1 1 21 CYS HA H 4.972 7.285 3.656 1.00 . A A . 518 CYS HA 1 1 20 13299 1 1 21 CYS HB2 H 5.117 6.935 1.290 1.00 . A A . 518 CYS HB2 1 1 20 13300 1 1 21 CYS HB3 H 6.239 5.779 2.001 1.00 . A A . 518 CYS HB3 1 1 20 13301 1 1 21 CYS N N 5.031 5.333 4.240 1.00 . A A . 518 CYS N 1 1 20 13302 1 1 21 CYS O O 2.447 5.324 3.319 1.00 . A A . 518 CYS O 1 1 20 13303 1 1 21 CYS SG S 4.362 4.688 1.005 1.00 . A A . 518 CYS SG 1 1 20 13304 1 1 22 HIS C C 0.621 7.920 1.594 1.00 . A A . 519 HIS C 1 1 20 13305 1 1 22 HIS CA C 1.072 7.644 3.015 1.00 . A A . 519 HIS CA 1 1 20 13306 1 1 22 HIS CB C 0.576 8.747 3.955 1.00 . A A . 519 HIS CB 1 1 20 13307 1 1 22 HIS CD2 C 2.042 8.889 6.091 1.00 . A A . 519 HIS CD2 1 1 20 13308 1 1 22 HIS CE1 C 0.708 7.835 7.471 1.00 . A A . 519 HIS CE1 1 1 20 13309 1 1 22 HIS CG C 0.940 8.524 5.392 1.00 . A A . 519 HIS CG 1 1 20 13310 1 1 22 HIS H H 3.077 8.343 2.985 1.00 . A A . 519 HIS H 1 1 20 13311 1 1 22 HIS HA H 0.657 6.698 3.332 1.00 . A A . 519 HIS HA 1 1 20 13312 1 1 22 HIS HB2 H 1.000 9.690 3.647 1.00 . A A . 519 HIS HB2 1 1 20 13313 1 1 22 HIS HB3 H -0.501 8.805 3.889 1.00 . A A . 519 HIS HB3 1 1 20 13314 1 1 22 HIS HD1 H -0.758 7.458 6.086 1.00 . A A . 519 HIS HD1 1 1 20 13315 1 1 22 HIS HD2 H 2.896 9.428 5.704 1.00 . A A . 519 HIS HD2 1 1 20 13316 1 1 22 HIS HE1 H 0.299 7.392 8.368 1.00 . A A . 519 HIS HE1 1 1 20 13317 1 1 22 HIS HE2 H 2.452 8.678 8.144 1.00 . A A . 519 HIS HE2 1 1 20 13318 1 1 22 HIS N N 2.518 7.533 3.066 1.00 . A A . 519 HIS N 1 1 20 13319 1 1 22 HIS ND1 N 0.126 7.864 6.289 1.00 . A A . 519 HIS ND1 1 1 20 13320 1 1 22 HIS NE2 N 1.871 8.448 7.379 1.00 . A A . 519 HIS NE2 1 1 20 13321 1 1 22 HIS O O -0.451 8.484 1.368 1.00 . A A . 519 HIS O 1 1 20 13322 1 1 23 LYS C C 0.248 6.688 -1.357 1.00 . A A . 520 LYS C 1 1 20 13323 1 1 23 LYS CA C 1.145 7.766 -0.770 1.00 . A A . 520 LYS CA 1 1 20 13324 1 1 23 LYS CB C 2.436 7.852 -1.591 1.00 . A A . 520 LYS CB 1 1 20 13325 1 1 23 LYS CD C 4.343 6.510 -2.588 1.00 . A A . 520 LYS CD 1 1 20 13326 1 1 23 LYS CE C 5.243 7.732 -2.721 1.00 . A A . 520 LYS CE 1 1 20 13327 1 1 23 LYS CG C 3.337 6.636 -1.448 1.00 . A A . 520 LYS CG 1 1 20 13328 1 1 23 LYS H H 2.262 7.030 0.865 1.00 . A A . 520 LYS H 1 1 20 13329 1 1 23 LYS HA H 0.632 8.714 -0.830 1.00 . A A . 520 LYS HA 1 1 20 13330 1 1 23 LYS HB2 H 2.178 7.958 -2.635 1.00 . A A . 520 LYS HB2 1 1 20 13331 1 1 23 LYS HB3 H 2.991 8.722 -1.277 1.00 . A A . 520 LYS HB3 1 1 20 13332 1 1 23 LYS HD2 H 4.963 5.644 -2.407 1.00 . A A . 520 LYS HD2 1 1 20 13333 1 1 23 LYS HD3 H 3.802 6.373 -3.513 1.00 . A A . 520 LYS HD3 1 1 20 13334 1 1 23 LYS HE2 H 5.465 8.106 -1.732 1.00 . A A . 520 LYS HE2 1 1 20 13335 1 1 23 LYS HE3 H 6.162 7.433 -3.204 1.00 . A A . 520 LYS HE3 1 1 20 13336 1 1 23 LYS HG2 H 3.879 6.716 -0.519 1.00 . A A . 520 LYS HG2 1 1 20 13337 1 1 23 LYS HG3 H 2.720 5.749 -1.428 1.00 . A A . 520 LYS HG3 1 1 20 13338 1 1 23 LYS HZ1 H 4.206 8.439 -4.391 1.00 . A A . 520 LYS HZ1 1 1 20 13339 1 1 23 LYS HZ2 H 3.854 9.283 -2.966 1.00 . A A . 520 LYS HZ2 1 1 20 13340 1 1 23 LYS HZ3 H 5.324 9.542 -3.765 1.00 . A A . 520 LYS HZ3 1 1 20 13341 1 1 23 LYS N N 1.436 7.509 0.632 1.00 . A A . 520 LYS N 1 1 20 13342 1 1 23 LYS NZ N 4.612 8.822 -3.514 1.00 . A A . 520 LYS NZ 1 1 20 13343 1 1 23 LYS O O -0.509 6.949 -2.290 1.00 . A A . 520 LYS O 1 1 20 13344 1 1 24 VAL C C -1.368 3.819 -0.254 1.00 . A A . 521 VAL C 1 1 20 13345 1 1 24 VAL CA C -0.466 4.373 -1.345 1.00 . A A . 521 VAL CA 1 1 20 13346 1 1 24 VAL CB C 0.420 3.231 -1.893 1.00 . A A . 521 VAL CB 1 1 20 13347 1 1 24 VAL CG1 C 1.269 3.713 -3.062 1.00 . A A . 521 VAL CG1 1 1 20 13348 1 1 24 VAL CG2 C 1.292 2.653 -0.789 1.00 . A A . 521 VAL CG2 1 1 20 13349 1 1 24 VAL H H 0.891 5.314 -0.042 1.00 . A A . 521 VAL H 1 1 20 13350 1 1 24 VAL HA H -1.079 4.749 -2.152 1.00 . A A . 521 VAL HA 1 1 20 13351 1 1 24 VAL HB H -0.229 2.446 -2.255 1.00 . A A . 521 VAL HB 1 1 20 13352 1 1 24 VAL HG11 H 1.871 4.553 -2.747 1.00 . A A . 521 VAL HG11 1 1 20 13353 1 1 24 VAL HG12 H 1.913 2.911 -3.394 1.00 . A A . 521 VAL HG12 1 1 20 13354 1 1 24 VAL HG13 H 0.624 4.017 -3.873 1.00 . A A . 521 VAL HG13 1 1 20 13355 1 1 24 VAL HG21 H 0.662 2.270 0.003 1.00 . A A . 521 VAL HG21 1 1 20 13356 1 1 24 VAL HG22 H 1.897 1.852 -1.186 1.00 . A A . 521 VAL HG22 1 1 20 13357 1 1 24 VAL HG23 H 1.932 3.428 -0.393 1.00 . A A . 521 VAL HG23 1 1 20 13358 1 1 24 VAL N N 0.324 5.477 -0.827 1.00 . A A . 521 VAL N 1 1 20 13359 1 1 24 VAL O O -1.147 4.066 0.934 1.00 . A A . 521 VAL O 1 1 20 13360 1 1 25 ASN C C -3.504 1.000 -0.063 1.00 . A A . 522 ASN C 1 1 20 13361 1 1 25 ASN CA C -3.299 2.467 0.280 1.00 . A A . 522 ASN CA 1 1 20 13362 1 1 25 ASN CB C -4.649 3.190 0.336 1.00 . A A . 522 ASN CB 1 1 20 13363 1 1 25 ASN CG C -4.943 4.003 -0.908 1.00 . A A . 522 ASN CG 1 1 20 13364 1 1 25 ASN H H -2.551 2.987 -1.625 1.00 . A A . 522 ASN H 1 1 20 13365 1 1 25 ASN HA H -2.837 2.526 1.253 1.00 . A A . 522 ASN HA 1 1 20 13366 1 1 25 ASN HB2 H -5.433 2.458 0.454 1.00 . A A . 522 ASN HB2 1 1 20 13367 1 1 25 ASN HB3 H -4.657 3.853 1.189 1.00 . A A . 522 ASN HB3 1 1 20 13368 1 1 25 ASN HD21 H -5.612 2.391 -1.848 1.00 . A A . 522 ASN HD21 1 1 20 13369 1 1 25 ASN HD22 H -5.664 3.871 -2.751 1.00 . A A . 522 ASN HD22 1 1 20 13370 1 1 25 ASN N N -2.394 3.100 -0.664 1.00 . A A . 522 ASN N 1 1 20 13371 1 1 25 ASN ND2 N -5.455 3.356 -1.935 1.00 . A A . 522 ASN ND2 1 1 20 13372 1 1 25 ASN O O -3.464 0.606 -1.229 1.00 . A A . 522 ASN O 1 1 20 13373 1 1 25 ASN OD1 O -4.695 5.205 -0.947 1.00 . A A . 522 ASN OD1 1 1 20 13374 1 1 26 TYR C C -5.248 -1.604 1.455 1.00 . A A . 523 TYR C 1 1 20 13375 1 1 26 TYR CA C -3.920 -1.221 0.831 1.00 . A A . 523 TYR CA 1 1 20 13376 1 1 26 TYR CB C -2.785 -1.980 1.530 1.00 . A A . 523 TYR CB 1 1 20 13377 1 1 26 TYR CD1 C -0.941 -2.558 -0.091 1.00 . A A . 523 TYR CD1 1 1 20 13378 1 1 26 TYR CD2 C -0.592 -0.737 1.405 1.00 . A A . 523 TYR CD2 1 1 20 13379 1 1 26 TYR CE1 C 0.315 -2.362 -0.631 1.00 . A A . 523 TYR CE1 1 1 20 13380 1 1 26 TYR CE2 C 0.666 -0.536 0.872 1.00 . A A . 523 TYR CE2 1 1 20 13381 1 1 26 TYR CG C -1.415 -1.750 0.934 1.00 . A A . 523 TYR CG 1 1 20 13382 1 1 26 TYR CZ C 1.115 -1.350 -0.147 1.00 . A A . 523 TYR CZ 1 1 20 13383 1 1 26 TYR H H -3.847 0.625 1.854 1.00 . A A . 523 TYR H 1 1 20 13384 1 1 26 TYR HA H -3.932 -1.467 -0.220 1.00 . A A . 523 TYR HA 1 1 20 13385 1 1 26 TYR HB2 H -2.747 -1.677 2.565 1.00 . A A . 523 TYR HB2 1 1 20 13386 1 1 26 TYR HB3 H -2.993 -3.041 1.484 1.00 . A A . 523 TYR HB3 1 1 20 13387 1 1 26 TYR HD1 H -0.946 -0.100 2.203 1.00 . A A . 523 TYR HD1 1 1 20 13388 1 1 26 TYR HD2 H -1.570 -3.352 -0.467 1.00 . A A . 523 TYR HD2 1 1 20 13389 1 1 26 TYR HE1 H 1.294 0.255 1.253 1.00 . A A . 523 TYR HE1 1 1 20 13390 1 1 26 TYR HE2 H 0.664 -2.999 -1.431 1.00 . A A . 523 TYR HE2 1 1 20 13391 1 1 26 TYR HH H 2.387 -1.429 -1.606 1.00 . A A . 523 TYR HH 1 1 20 13392 1 1 26 TYR N N -3.738 0.211 0.966 1.00 . A A . 523 TYR N 1 1 20 13393 1 1 26 TYR O O -5.980 -0.745 1.945 1.00 . A A . 523 TYR O 1 1 20 13394 1 1 26 TYR OH O 2.372 -1.158 -0.672 1.00 . A A . 523 TYR OH 1 1 20 13395 1 1 27 CYS C C -6.575 -4.310 3.161 1.00 . A A . 524 CYS C 1 1 20 13396 1 1 27 CYS CA C -6.820 -3.318 2.028 1.00 . A A . 524 CYS CA 1 1 20 13397 1 1 27 CYS CB C -7.715 -3.919 0.933 1.00 . A A . 524 CYS CB 1 1 20 13398 1 1 27 CYS H H -4.900 -3.548 1.183 1.00 . A A . 524 CYS H 1 1 20 13399 1 1 27 CYS HA H -7.310 -2.448 2.440 1.00 . A A . 524 CYS HA 1 1 20 13400 1 1 27 CYS HB2 H -8.742 -3.873 1.261 1.00 . A A . 524 CYS HB2 1 1 20 13401 1 1 27 CYS HB3 H -7.608 -3.327 0.036 1.00 . A A . 524 CYS HB3 1 1 20 13402 1 1 27 CYS N N -5.555 -2.883 1.478 1.00 . A A . 524 CYS N 1 1 20 13403 1 1 27 CYS O O -7.512 -4.784 3.804 1.00 . A A . 524 CYS O 1 1 20 13404 1 1 27 CYS SG S -7.363 -5.651 0.497 1.00 . A A . 524 CYS SG 1 1 20 13405 1 1 28 SER C C -3.364 -5.502 4.567 1.00 . A A . 525 SER C 1 1 20 13406 1 1 28 SER CA C -4.887 -5.509 4.464 1.00 . A A . 525 SER CA 1 1 20 13407 1 1 28 SER CB C -5.388 -6.929 4.170 1.00 . A A . 525 SER CB 1 1 20 13408 1 1 28 SER H H -4.600 -4.186 2.860 1.00 . A A . 525 SER H 1 1 20 13409 1 1 28 SER HA H -5.308 -5.162 5.397 1.00 . A A . 525 SER HA 1 1 20 13410 1 1 28 SER HB2 H -6.461 -6.912 4.055 1.00 . A A . 525 SER HB2 1 1 20 13411 1 1 28 SER HB3 H -4.935 -7.281 3.254 1.00 . A A . 525 SER HB3 1 1 20 13412 1 1 28 SER HG H -5.595 -7.627 6.000 1.00 . A A . 525 SER HG 1 1 20 13413 1 1 28 SER N N -5.298 -4.598 3.407 1.00 . A A . 525 SER N 1 1 20 13414 1 1 28 SER O O -2.677 -5.083 3.629 1.00 . A A . 525 SER O 1 1 20 13415 1 1 28 SER OG O -5.056 -7.829 5.216 1.00 . A A . 525 SER OG 1 1 20 13416 1 1 29 THR C C -0.787 -7.086 4.983 1.00 . A A . 526 THR C 1 1 20 13417 1 1 29 THR CA C -1.406 -6.044 5.911 1.00 . A A . 526 THR CA 1 1 20 13418 1 1 29 THR CB C -1.082 -6.386 7.381 1.00 . A A . 526 THR CB 1 1 20 13419 1 1 29 THR CG2 C 0.417 -6.330 7.652 1.00 . A A . 526 THR CG2 1 1 20 13420 1 1 29 THR H H -3.446 -6.252 6.417 1.00 . A A . 526 THR H 1 1 20 13421 1 1 29 THR HA H -0.982 -5.076 5.684 1.00 . A A . 526 THR HA 1 1 20 13422 1 1 29 THR HB H -1.436 -7.384 7.589 1.00 . A A . 526 THR HB 1 1 20 13423 1 1 29 THR HG1 H -2.113 -5.943 9.012 1.00 . A A . 526 THR HG1 1 1 20 13424 1 1 29 THR HG21 H 0.785 -5.335 7.450 1.00 . A A . 526 THR HG21 1 1 20 13425 1 1 29 THR HG22 H 0.605 -6.580 8.685 1.00 . A A . 526 THR HG22 1 1 20 13426 1 1 29 THR HG23 H 0.925 -7.040 7.013 1.00 . A A . 526 THR HG23 1 1 20 13427 1 1 29 THR N N -2.844 -5.963 5.700 1.00 . A A . 526 THR N 1 1 20 13428 1 1 29 THR O O 0.397 -7.011 4.642 1.00 . A A . 526 THR O 1 1 20 13429 1 1 29 THR OG1 O -1.756 -5.463 8.245 1.00 . A A . 526 THR OG1 1 1 20 13430 1 1 30 PHE C C -0.707 -8.396 2.306 1.00 . A A . 527 PHE C 1 1 20 13431 1 1 30 PHE CA C -1.165 -9.053 3.599 1.00 . A A . 527 PHE CA 1 1 20 13432 1 1 30 PHE CB C -2.304 -10.044 3.320 1.00 . A A . 527 PHE CB 1 1 20 13433 1 1 30 PHE CD1 C -1.184 -11.649 1.724 1.00 . A A . 527 PHE CD1 1 1 20 13434 1 1 30 PHE CD2 C -3.148 -10.507 0.999 1.00 . A A . 527 PHE CD2 1 1 20 13435 1 1 30 PHE CE1 C -1.103 -12.288 0.501 1.00 . A A . 527 PHE CE1 1 1 20 13436 1 1 30 PHE CE2 C -3.069 -11.143 -0.226 1.00 . A A . 527 PHE CE2 1 1 20 13437 1 1 30 PHE CG C -2.208 -10.751 1.990 1.00 . A A . 527 PHE CG 1 1 20 13438 1 1 30 PHE CZ C -2.046 -12.035 -0.475 1.00 . A A . 527 PHE CZ 1 1 20 13439 1 1 30 PHE H H -2.517 -8.088 4.904 1.00 . A A . 527 PHE H 1 1 20 13440 1 1 30 PHE HA H -0.333 -9.586 4.036 1.00 . A A . 527 PHE HA 1 1 20 13441 1 1 30 PHE HB2 H -2.307 -10.799 4.093 1.00 . A A . 527 PHE HB2 1 1 20 13442 1 1 30 PHE HB3 H -3.243 -9.510 3.347 1.00 . A A . 527 PHE HB3 1 1 20 13443 1 1 30 PHE HD1 H -3.949 -9.810 1.190 1.00 . A A . 527 PHE HD1 1 1 20 13444 1 1 30 PHE HD2 H -0.444 -11.846 2.482 1.00 . A A . 527 PHE HD2 1 1 20 13445 1 1 30 PHE HE1 H -3.809 -10.945 -0.988 1.00 . A A . 527 PHE HE1 1 1 20 13446 1 1 30 PHE HE2 H -0.299 -12.985 0.310 1.00 . A A . 527 PHE HE2 1 1 20 13447 1 1 30 PHE HZ H -1.982 -12.533 -1.432 1.00 . A A . 527 PHE HZ 1 1 20 13448 1 1 30 PHE N N -1.604 -8.045 4.552 1.00 . A A . 527 PHE N 1 1 20 13449 1 1 30 PHE O O 0.375 -8.695 1.799 1.00 . A A . 527 PHE O 1 1 20 13450 1 1 31 CYS C C 0.015 -5.918 0.731 1.00 . A A . 528 CYS C 1 1 20 13451 1 1 31 CYS CA C -1.199 -6.814 0.543 1.00 . A A . 528 CYS CA 1 1 20 13452 1 1 31 CYS CB C -2.402 -6.018 0.061 1.00 . A A . 528 CYS CB 1 1 20 13453 1 1 31 CYS H H -2.362 -7.273 2.240 1.00 . A A . 528 CYS H 1 1 20 13454 1 1 31 CYS HA H -0.954 -7.587 -0.167 1.00 . A A . 528 CYS HA 1 1 20 13455 1 1 31 CYS HB2 H -2.519 -5.141 0.680 1.00 . A A . 528 CYS HB2 1 1 20 13456 1 1 31 CYS HB3 H -2.243 -5.716 -0.961 1.00 . A A . 528 CYS HB3 1 1 20 13457 1 1 31 CYS N N -1.525 -7.492 1.783 1.00 . A A . 528 CYS N 1 1 20 13458 1 1 31 CYS O O 0.850 -5.798 -0.161 1.00 . A A . 528 CYS O 1 1 20 13459 1 1 31 CYS SG S -3.952 -6.962 0.129 1.00 . A A . 528 CYS SG 1 1 20 13460 1 1 32 GLN C C 2.543 -5.210 2.136 1.00 . A A . 529 GLN C 1 1 20 13461 1 1 32 GLN CA C 1.230 -4.434 2.233 1.00 . A A . 529 GLN CA 1 1 20 13462 1 1 32 GLN CB C 1.052 -3.865 3.652 1.00 . A A . 529 GLN CB 1 1 20 13463 1 1 32 GLN CD C 2.709 -2.004 4.066 1.00 . A A . 529 GLN CD 1 1 20 13464 1 1 32 GLN CG C 2.350 -3.448 4.328 1.00 . A A . 529 GLN CG 1 1 20 13465 1 1 32 GLN H H -0.583 -5.464 2.586 1.00 . A A . 529 GLN H 1 1 20 13466 1 1 32 GLN HA H 1.234 -3.625 1.517 1.00 . A A . 529 GLN HA 1 1 20 13467 1 1 32 GLN HB2 H 0.414 -2.990 3.600 1.00 . A A . 529 GLN HB2 1 1 20 13468 1 1 32 GLN HB3 H 0.573 -4.611 4.269 1.00 . A A . 529 GLN HB3 1 1 20 13469 1 1 32 GLN HE21 H 3.703 -2.503 2.419 1.00 . A A . 529 GLN HE21 1 1 20 13470 1 1 32 GLN HE22 H 3.669 -0.814 2.805 1.00 . A A . 529 GLN HE22 1 1 20 13471 1 1 32 GLN HG2 H 2.243 -3.587 5.392 1.00 . A A . 529 GLN HG2 1 1 20 13472 1 1 32 GLN HG3 H 3.149 -4.076 3.962 1.00 . A A . 529 GLN HG3 1 1 20 13473 1 1 32 GLN N N 0.108 -5.302 1.907 1.00 . A A . 529 GLN N 1 1 20 13474 1 1 32 GLN NE2 N 3.434 -1.750 2.990 1.00 . A A . 529 GLN NE2 1 1 20 13475 1 1 32 GLN O O 3.509 -4.755 1.522 1.00 . A A . 529 GLN O 1 1 20 13476 1 1 32 GLN OE1 O 2.334 -1.123 4.833 1.00 . A A . 529 GLN OE1 1 1 20 13477 1 1 33 ARG C C 4.006 -7.875 1.426 1.00 . A A . 530 ARG C 1 1 20 13478 1 1 33 ARG CA C 3.752 -7.220 2.790 1.00 . A A . 530 ARG CA 1 1 20 13479 1 1 33 ARG CB C 3.617 -8.269 3.895 1.00 . A A . 530 ARG CB 1 1 20 13480 1 1 33 ARG CD C 4.580 -10.201 5.153 1.00 . A A . 530 ARG CD 1 1 20 13481 1 1 33 ARG CG C 4.824 -9.172 4.064 1.00 . A A . 530 ARG CG 1 1 20 13482 1 1 33 ARG CZ C 2.766 -11.779 5.742 1.00 . A A . 530 ARG CZ 1 1 20 13483 1 1 33 ARG H H 1.738 -6.697 3.196 1.00 . A A . 530 ARG H 1 1 20 13484 1 1 33 ARG HA H 4.577 -6.558 3.008 1.00 . A A . 530 ARG HA 1 1 20 13485 1 1 33 ARG HB2 H 3.447 -7.761 4.833 1.00 . A A . 530 ARG HB2 1 1 20 13486 1 1 33 ARG HB3 H 2.760 -8.890 3.677 1.00 . A A . 530 ARG HB3 1 1 20 13487 1 1 33 ARG HD2 H 5.470 -10.801 5.273 1.00 . A A . 530 ARG HD2 1 1 20 13488 1 1 33 ARG HD3 H 4.369 -9.683 6.078 1.00 . A A . 530 ARG HD3 1 1 20 13489 1 1 33 ARG HE H 3.200 -11.164 3.881 1.00 . A A . 530 ARG HE 1 1 20 13490 1 1 33 ARG HG2 H 5.016 -9.684 3.131 1.00 . A A . 530 ARG HG2 1 1 20 13491 1 1 33 ARG HG3 H 5.681 -8.570 4.331 1.00 . A A . 530 ARG HG3 1 1 20 13492 1 1 33 ARG HH11 H 3.788 -11.047 7.336 1.00 . A A . 530 ARG HH11 1 1 20 13493 1 1 33 ARG HH12 H 2.538 -12.196 7.720 1.00 . A A . 530 ARG HH12 1 1 20 13494 1 1 33 ARG HH21 H 1.554 -12.661 4.378 1.00 . A A . 530 ARG HH21 1 1 20 13495 1 1 33 ARG HH22 H 1.244 -13.099 6.033 1.00 . A A . 530 ARG HH22 1 1 20 13496 1 1 33 ARG N N 2.561 -6.383 2.758 1.00 . A A . 530 ARG N 1 1 20 13497 1 1 33 ARG NE N 3.452 -11.081 4.836 1.00 . A A . 530 ARG NE 1 1 20 13498 1 1 33 ARG NH1 N 3.053 -11.662 7.033 1.00 . A A . 530 ARG NH1 1 1 20 13499 1 1 33 ARG NH2 N 1.778 -12.578 5.352 1.00 . A A . 530 ARG NH2 1 1 20 13500 1 1 33 ARG O O 5.151 -8.124 1.046 1.00 . A A . 530 ARG O 1 1 20 13501 1 1 34 LYS C C 3.630 -7.808 -1.636 1.00 . A A . 531 LYS C 1 1 20 13502 1 1 34 LYS CA C 3.035 -8.779 -0.617 1.00 . A A . 531 LYS CA 1 1 20 13503 1 1 34 LYS CB C 1.648 -9.220 -1.092 1.00 . A A . 531 LYS CB 1 1 20 13504 1 1 34 LYS CD C 0.434 -9.691 -3.235 1.00 . A A . 531 LYS CD 1 1 20 13505 1 1 34 LYS CE C 0.486 -10.405 -4.579 1.00 . A A . 531 LYS CE 1 1 20 13506 1 1 34 LYS CG C 1.664 -9.993 -2.397 1.00 . A A . 531 LYS CG 1 1 20 13507 1 1 34 LYS H H 2.044 -7.946 1.066 1.00 . A A . 531 LYS H 1 1 20 13508 1 1 34 LYS HA H 3.676 -9.642 -0.532 1.00 . A A . 531 LYS HA 1 1 20 13509 1 1 34 LYS HB2 H 1.202 -9.847 -0.333 1.00 . A A . 531 LYS HB2 1 1 20 13510 1 1 34 LYS HB3 H 1.033 -8.342 -1.227 1.00 . A A . 531 LYS HB3 1 1 20 13511 1 1 34 LYS HD2 H -0.446 -10.012 -2.698 1.00 . A A . 531 LYS HD2 1 1 20 13512 1 1 34 LYS HD3 H 0.386 -8.622 -3.407 1.00 . A A . 531 LYS HD3 1 1 20 13513 1 1 34 LYS HE2 H 1.378 -10.092 -5.099 1.00 . A A . 531 LYS HE2 1 1 20 13514 1 1 34 LYS HE3 H 0.528 -11.472 -4.404 1.00 . A A . 531 LYS HE3 1 1 20 13515 1 1 34 LYS HG2 H 2.547 -9.723 -2.958 1.00 . A A . 531 LYS HG2 1 1 20 13516 1 1 34 LYS HG3 H 1.684 -11.050 -2.172 1.00 . A A . 531 LYS HG3 1 1 20 13517 1 1 34 LYS HZ1 H -0.827 -9.069 -5.502 1.00 . A A . 531 LYS HZ1 1 1 20 13518 1 1 34 LYS HZ2 H -0.572 -10.495 -6.381 1.00 . A A . 531 LYS HZ2 1 1 20 13519 1 1 34 LYS HZ3 H -1.559 -10.510 -5.001 1.00 . A A . 531 LYS HZ3 1 1 20 13520 1 1 34 LYS N N 2.932 -8.152 0.699 1.00 . A A . 531 LYS N 1 1 20 13521 1 1 34 LYS NZ N -0.700 -10.099 -5.424 1.00 . A A . 531 LYS NZ 1 1 20 13522 1 1 34 LYS O O 4.510 -8.167 -2.418 1.00 . A A . 531 LYS O 1 1 20 13523 1 1 35 ASP C C 4.988 -5.009 -2.120 1.00 . A A . 532 ASP C 1 1 20 13524 1 1 35 ASP CA C 3.605 -5.524 -2.509 1.00 . A A . 532 ASP CA 1 1 20 13525 1 1 35 ASP CB C 2.586 -4.383 -2.483 1.00 . A A . 532 ASP CB 1 1 20 13526 1 1 35 ASP CG C 2.859 -3.306 -3.518 1.00 . A A . 532 ASP CG 1 1 20 13527 1 1 35 ASP H H 2.452 -6.350 -0.946 1.00 . A A . 532 ASP H 1 1 20 13528 1 1 35 ASP HA H 3.639 -5.915 -3.516 1.00 . A A . 532 ASP HA 1 1 20 13529 1 1 35 ASP HB2 H 1.606 -4.791 -2.674 1.00 . A A . 532 ASP HB2 1 1 20 13530 1 1 35 ASP HB3 H 2.593 -3.933 -1.505 1.00 . A A . 532 ASP HB3 1 1 20 13531 1 1 35 ASP N N 3.157 -6.571 -1.597 1.00 . A A . 532 ASP N 1 1 20 13532 1 1 35 ASP O O 5.648 -4.321 -2.895 1.00 . A A . 532 ASP O 1 1 20 13533 1 1 35 ASP OD1 O 2.843 -3.623 -4.729 1.00 . A A . 532 ASP OD1 1 1 20 13534 1 1 35 ASP OD2 O 3.069 -2.136 -3.126 1.00 . A A . 532 ASP OD2 1 1 20 13535 1 1 36 TRP C C 7.888 -5.233 -1.314 1.00 . A A . 533 TRP C 1 1 20 13536 1 1 36 TRP CA C 6.711 -4.930 -0.381 1.00 . A A . 533 TRP CA 1 1 20 13537 1 1 36 TRP CB C 6.957 -5.550 0.999 1.00 . A A . 533 TRP CB 1 1 20 13538 1 1 36 TRP CD1 C 9.333 -5.572 1.955 1.00 . A A . 533 TRP CD1 1 1 20 13539 1 1 36 TRP CD2 C 8.243 -3.634 2.233 1.00 . A A . 533 TRP CD2 1 1 20 13540 1 1 36 TRP CE2 C 9.529 -3.509 2.789 1.00 . A A . 533 TRP CE2 1 1 20 13541 1 1 36 TRP CE3 C 7.373 -2.539 2.291 1.00 . A A . 533 TRP CE3 1 1 20 13542 1 1 36 TRP CG C 8.139 -4.961 1.702 1.00 . A A . 533 TRP CG 1 1 20 13543 1 1 36 TRP CH2 C 9.098 -1.278 3.434 1.00 . A A . 533 TRP CH2 1 1 20 13544 1 1 36 TRP CZ2 C 9.969 -2.334 3.392 1.00 . A A . 533 TRP CZ2 1 1 20 13545 1 1 36 TRP CZ3 C 7.810 -1.372 2.891 1.00 . A A . 533 TRP CZ3 1 1 20 13546 1 1 36 TRP H H 4.900 -6.037 -0.415 1.00 . A A . 533 TRP H 1 1 20 13547 1 1 36 TRP HA H 6.633 -3.858 -0.262 1.00 . A A . 533 TRP HA 1 1 20 13548 1 1 36 TRP HB2 H 6.088 -5.389 1.618 1.00 . A A . 533 TRP HB2 1 1 20 13549 1 1 36 TRP HB3 H 7.127 -6.611 0.888 1.00 . A A . 533 TRP HB3 1 1 20 13550 1 1 36 TRP HD1 H 9.567 -6.590 1.677 1.00 . A A . 533 TRP HD1 1 1 20 13551 1 1 36 TRP HE1 H 11.101 -4.907 2.889 1.00 . A A . 533 TRP HE1 1 1 20 13552 1 1 36 TRP HE3 H 6.376 -2.594 1.879 1.00 . A A . 533 TRP HE3 1 1 20 13553 1 1 36 TRP HH2 H 9.397 -0.348 3.895 1.00 . A A . 533 TRP HH2 1 1 20 13554 1 1 36 TRP HZ2 H 10.960 -2.244 3.813 1.00 . A A . 533 TRP HZ2 1 1 20 13555 1 1 36 TRP HZ3 H 7.152 -0.516 2.947 1.00 . A A . 533 TRP HZ3 1 1 20 13556 1 1 36 TRP N N 5.444 -5.410 -0.936 1.00 . A A . 533 TRP N 1 1 20 13557 1 1 36 TRP NE1 N 10.177 -4.704 2.604 1.00 . A A . 533 TRP NE1 1 1 20 13558 1 1 36 TRP O O 8.887 -4.527 -1.318 1.00 . A A . 533 TRP O 1 1 20 13559 1 1 37 LYS C C 9.092 -5.521 -4.043 1.00 . A A . 534 LYS C 1 1 20 13560 1 1 37 LYS CA C 8.772 -6.663 -3.080 1.00 . A A . 534 LYS CA 1 1 20 13561 1 1 37 LYS CB C 8.335 -7.911 -3.846 1.00 . A A . 534 LYS CB 1 1 20 13562 1 1 37 LYS CD C 7.544 -10.288 -3.740 1.00 . A A . 534 LYS CD 1 1 20 13563 1 1 37 LYS CE C 7.199 -11.455 -2.832 1.00 . A A . 534 LYS CE 1 1 20 13564 1 1 37 LYS CG C 8.041 -9.098 -2.944 1.00 . A A . 534 LYS CG 1 1 20 13565 1 1 37 LYS H H 6.934 -6.801 -2.046 1.00 . A A . 534 LYS H 1 1 20 13566 1 1 37 LYS HA H 9.705 -6.862 -2.574 1.00 . A A . 534 LYS HA 1 1 20 13567 1 1 37 LYS HB2 H 7.440 -7.680 -4.405 1.00 . A A . 534 LYS HB2 1 1 20 13568 1 1 37 LYS HB3 H 9.119 -8.192 -4.535 1.00 . A A . 534 LYS HB3 1 1 20 13569 1 1 37 LYS HD2 H 6.659 -9.998 -4.286 1.00 . A A . 534 LYS HD2 1 1 20 13570 1 1 37 LYS HD3 H 8.314 -10.596 -4.433 1.00 . A A . 534 LYS HD3 1 1 20 13571 1 1 37 LYS HE2 H 8.081 -11.745 -2.283 1.00 . A A . 534 LYS HE2 1 1 20 13572 1 1 37 LYS HE3 H 6.431 -11.142 -2.141 1.00 . A A . 534 LYS HE3 1 1 20 13573 1 1 37 LYS HG2 H 8.944 -9.378 -2.423 1.00 . A A . 534 LYS HG2 1 1 20 13574 1 1 37 LYS HG3 H 7.283 -8.817 -2.229 1.00 . A A . 534 LYS HG3 1 1 20 13575 1 1 37 LYS HZ1 H 7.459 -12.993 -4.220 1.00 . A A . 534 LYS HZ1 1 1 20 13576 1 1 37 LYS HZ2 H 6.398 -13.378 -2.955 1.00 . A A . 534 LYS HZ2 1 1 20 13577 1 1 37 LYS HZ3 H 5.894 -12.338 -4.198 1.00 . A A . 534 LYS HZ3 1 1 20 13578 1 1 37 LYS N N 7.751 -6.275 -2.110 1.00 . A A . 534 LYS N 1 1 20 13579 1 1 37 LYS NZ N 6.704 -12.621 -3.605 1.00 . A A . 534 LYS NZ 1 1 20 13580 1 1 37 LYS O O 10.264 -5.286 -4.340 1.00 . A A . 534 LYS O 1 1 20 13581 1 1 38 ASP C C 8.390 -2.401 -4.428 1.00 . A A . 535 ASP C 1 1 20 13582 1 1 38 ASP CA C 8.366 -3.612 -5.323 1.00 . A A . 535 ASP CA 1 1 20 13583 1 1 38 ASP CB C 7.304 -3.390 -6.395 1.00 . A A . 535 ASP CB 1 1 20 13584 1 1 38 ASP CG C 7.681 -2.287 -7.370 1.00 . A A . 535 ASP CG 1 1 20 13585 1 1 38 ASP H H 7.163 -5.067 -4.334 1.00 . A A . 535 ASP H 1 1 20 13586 1 1 38 ASP HA H 9.332 -3.739 -5.785 1.00 . A A . 535 ASP HA 1 1 20 13587 1 1 38 ASP HB2 H 7.159 -4.295 -6.935 1.00 . A A . 535 ASP HB2 1 1 20 13588 1 1 38 ASP HB3 H 6.378 -3.114 -5.915 1.00 . A A . 535 ASP HB3 1 1 20 13589 1 1 38 ASP N N 8.091 -4.805 -4.522 1.00 . A A . 535 ASP N 1 1 20 13590 1 1 38 ASP O O 9.180 -1.484 -4.591 1.00 . A A . 535 ASP O 1 1 20 13591 1 1 38 ASP OD1 O 8.517 -2.536 -8.265 1.00 . A A . 535 ASP OD1 1 1 20 13592 1 1 38 ASP OD2 O 7.143 -1.169 -7.253 1.00 . A A . 535 ASP OD2 1 1 20 13593 1 1 39 HIS C C 8.476 -0.872 -1.845 1.00 . A A . 536 HIS C 1 1 20 13594 1 1 39 HIS CA C 7.260 -1.263 -2.670 1.00 . A A . 536 HIS CA 1 1 20 13595 1 1 39 HIS CB C 6.058 -1.512 -1.764 1.00 . A A . 536 HIS CB 1 1 20 13596 1 1 39 HIS CD2 C 5.440 0.085 0.172 1.00 . A A . 536 HIS CD2 1 1 20 13597 1 1 39 HIS CE1 C 4.487 1.658 -0.972 1.00 . A A . 536 HIS CE1 1 1 20 13598 1 1 39 HIS CG C 5.504 -0.279 -1.134 1.00 . A A . 536 HIS CG 1 1 20 13599 1 1 39 HIS H H 7.039 -3.247 -3.274 1.00 . A A . 536 HIS H 1 1 20 13600 1 1 39 HIS HA H 7.028 -0.462 -3.362 1.00 . A A . 536 HIS HA 1 1 20 13601 1 1 39 HIS HB2 H 5.269 -1.970 -2.342 1.00 . A A . 536 HIS HB2 1 1 20 13602 1 1 39 HIS HB3 H 6.350 -2.185 -0.971 1.00 . A A . 536 HIS HB3 1 1 20 13603 1 1 39 HIS HD1 H 4.757 0.751 -2.825 1.00 . A A . 536 HIS HD1 1 1 20 13604 1 1 39 HIS HD2 H 5.829 -0.472 1.012 1.00 . A A . 536 HIS HD2 1 1 20 13605 1 1 39 HIS HE1 H 3.982 2.575 -1.238 1.00 . A A . 536 HIS HE1 1 1 20 13606 1 1 39 HIS N N 7.521 -2.422 -3.462 1.00 . A A . 536 HIS N 1 1 20 13607 1 1 39 HIS ND1 N 4.896 0.733 -1.847 1.00 . A A . 536 HIS ND1 1 1 20 13608 1 1 39 HIS NE2 N 4.787 1.304 0.254 1.00 . A A . 536 HIS NE2 1 1 20 13609 1 1 39 HIS O O 8.694 0.299 -1.605 1.00 . A A . 536 HIS O 1 1 20 13610 1 1 40 GLN C C 11.409 -0.600 -1.216 1.00 . A A . 537 GLN C 1 1 20 13611 1 1 40 GLN CA C 10.410 -1.545 -0.546 1.00 . A A . 537 GLN CA 1 1 20 13612 1 1 40 GLN CB C 11.114 -2.823 -0.091 1.00 . A A . 537 GLN CB 1 1 20 13613 1 1 40 GLN CD C 12.236 -4.975 -0.815 1.00 . A A . 537 GLN CD 1 1 20 13614 1 1 40 GLN CG C 11.774 -3.592 -1.227 1.00 . A A . 537 GLN CG 1 1 20 13615 1 1 40 GLN H H 9.083 -2.782 -1.677 1.00 . A A . 537 GLN H 1 1 20 13616 1 1 40 GLN HA H 10.002 -1.024 0.305 1.00 . A A . 537 GLN HA 1 1 20 13617 1 1 40 GLN HB2 H 11.875 -2.562 0.629 1.00 . A A . 537 GLN HB2 1 1 20 13618 1 1 40 GLN HB3 H 10.390 -3.471 0.382 1.00 . A A . 537 GLN HB3 1 1 20 13619 1 1 40 GLN HE21 H 10.445 -5.707 -1.235 1.00 . A A . 537 GLN HE21 1 1 20 13620 1 1 40 GLN HE22 H 11.610 -6.852 -0.665 1.00 . A A . 537 GLN HE22 1 1 20 13621 1 1 40 GLN HG2 H 11.065 -3.693 -2.040 1.00 . A A . 537 GLN HG2 1 1 20 13622 1 1 40 GLN HG3 H 12.631 -3.030 -1.566 1.00 . A A . 537 GLN HG3 1 1 20 13623 1 1 40 GLN N N 9.273 -1.844 -1.419 1.00 . A A . 537 GLN N 1 1 20 13624 1 1 40 GLN NE2 N 11.342 -5.941 -0.913 1.00 . A A . 537 GLN NE2 1 1 20 13625 1 1 40 GLN O O 11.982 0.262 -0.552 1.00 . A A . 537 GLN O 1 1 20 13626 1 1 40 GLN OE1 O 13.378 -5.170 -0.403 1.00 . A A . 537 GLN OE1 1 1 20 13627 1 1 41 HIS C C 11.931 1.471 -3.535 1.00 . A A . 538 HIS C 1 1 20 13628 1 1 41 HIS CA C 12.567 0.121 -3.213 1.00 . A A . 538 HIS CA 1 1 20 13629 1 1 41 HIS CB C 13.147 -0.541 -4.483 1.00 . A A . 538 HIS CB 1 1 20 13630 1 1 41 HIS CD2 C 11.425 -1.620 -6.086 1.00 . A A . 538 HIS CD2 1 1 20 13631 1 1 41 HIS CE1 C 11.273 0.031 -7.490 1.00 . A A . 538 HIS CE1 1 1 20 13632 1 1 41 HIS CG C 12.227 -0.612 -5.672 1.00 . A A . 538 HIS CG 1 1 20 13633 1 1 41 HIS H H 11.181 -1.477 -3.002 1.00 . A A . 538 HIS H 1 1 20 13634 1 1 41 HIS HA H 13.386 0.321 -2.537 1.00 . A A . 538 HIS HA 1 1 20 13635 1 1 41 HIS HB2 H 14.023 0.008 -4.787 1.00 . A A . 538 HIS HB2 1 1 20 13636 1 1 41 HIS HB3 H 13.440 -1.550 -4.235 1.00 . A A . 538 HIS HB3 1 1 20 13637 1 1 41 HIS HD2 H 11.238 -2.549 -5.572 1.00 . A A . 538 HIS HD2 1 1 20 13638 1 1 41 HIS HE1 H 10.956 0.636 -8.325 1.00 . A A . 538 HIS HE1 1 1 20 13639 1 1 41 HIS HE2 H 10.030 -1.626 -7.663 1.00 . A A . 538 HIS HE2 1 1 20 13640 1 1 41 HIS N N 11.628 -0.752 -2.519 1.00 . A A . 538 HIS N 1 1 20 13641 1 1 41 HIS ND1 N 12.126 0.429 -6.563 1.00 . A A . 538 HIS ND1 1 1 20 13642 1 1 41 HIS NE2 N 10.825 -1.205 -7.246 1.00 . A A . 538 HIS NE2 1 1 20 13643 1 1 41 HIS O O 12.642 2.451 -3.770 1.00 . A A . 538 HIS O 1 1 20 13644 1 1 42 ILE C C 9.605 3.551 -2.514 1.00 . A A . 539 ILE C 1 1 20 13645 1 1 42 ILE CA C 9.919 2.794 -3.816 1.00 . A A . 539 ILE CA 1 1 20 13646 1 1 42 ILE CB C 8.632 2.561 -4.671 1.00 . A A . 539 ILE CB 1 1 20 13647 1 1 42 ILE CD1 C 6.575 3.457 -3.462 1.00 . A A . 539 ILE CD1 1 1 20 13648 1 1 42 ILE CG1 C 7.393 2.236 -3.831 1.00 . A A . 539 ILE CG1 1 1 20 13649 1 1 42 ILE CG2 C 8.865 1.451 -5.678 1.00 . A A . 539 ILE CG2 1 1 20 13650 1 1 42 ILE H H 10.071 0.717 -3.400 1.00 . A A . 539 ILE H 1 1 20 13651 1 1 42 ILE HA H 10.593 3.403 -4.400 1.00 . A A . 539 ILE HA 1 1 20 13652 1 1 42 ILE HB H 8.444 3.453 -5.227 1.00 . A A . 539 ILE HB 1 1 20 13653 1 1 42 ILE HD11 H 6.193 3.918 -4.361 1.00 . A A . 539 ILE HD11 1 1 20 13654 1 1 42 ILE HD12 H 5.752 3.164 -2.830 1.00 . A A . 539 ILE HD12 1 1 20 13655 1 1 42 ILE HD13 H 7.203 4.163 -2.936 1.00 . A A . 539 ILE HD13 1 1 20 13656 1 1 42 ILE HG12 H 6.757 1.571 -4.389 1.00 . A A . 539 ILE HG12 1 1 20 13657 1 1 42 ILE HG13 H 7.701 1.751 -2.917 1.00 . A A . 539 ILE HG13 1 1 20 13658 1 1 42 ILE HG21 H 9.159 0.550 -5.159 1.00 . A A . 539 ILE HG21 1 1 20 13659 1 1 42 ILE HG22 H 7.955 1.267 -6.228 1.00 . A A . 539 ILE HG22 1 1 20 13660 1 1 42 ILE HG23 H 9.648 1.745 -6.362 1.00 . A A . 539 ILE HG23 1 1 20 13661 1 1 42 ILE N N 10.602 1.534 -3.542 1.00 . A A . 539 ILE N 1 1 20 13662 1 1 42 ILE O O 9.804 4.763 -2.426 1.00 . A A . 539 ILE O 1 1 20 13663 1 1 43 CYS C C 9.753 4.286 0.353 1.00 . A A . 540 CYS C 1 1 20 13664 1 1 43 CYS CA C 8.668 3.404 -0.267 1.00 . A A . 540 CYS CA 1 1 20 13665 1 1 43 CYS CB C 8.323 2.265 0.696 1.00 . A A . 540 CYS CB 1 1 20 13666 1 1 43 CYS H H 8.954 1.856 -1.681 1.00 . A A . 540 CYS H 1 1 20 13667 1 1 43 CYS HA H 7.779 3.993 -0.434 1.00 . A A . 540 CYS HA 1 1 20 13668 1 1 43 CYS HB2 H 7.744 1.522 0.168 1.00 . A A . 540 CYS HB2 1 1 20 13669 1 1 43 CYS HB3 H 9.239 1.813 1.046 1.00 . A A . 540 CYS HB3 1 1 20 13670 1 1 43 CYS N N 9.102 2.826 -1.531 1.00 . A A . 540 CYS N 1 1 20 13671 1 1 43 CYS O O 10.891 3.860 0.568 1.00 . A A . 540 CYS O 1 1 20 13672 1 1 43 CYS SG S 7.366 2.770 2.159 1.00 . A A . 540 CYS SG 1 1 20 13673 1 1 44 GLY C C 10.655 7.628 0.277 1.00 . A A . 541 GLY C 1 1 20 13674 1 1 44 GLY CA C 10.306 6.476 1.194 1.00 . A A . 541 GLY CA 1 1 20 13675 1 1 44 GLY H H 8.458 5.794 0.410 1.00 . A A . 541 GLY H 1 1 20 13676 1 1 44 GLY HA2 H 9.863 6.872 2.095 1.00 . A A . 541 GLY HA2 1 1 20 13677 1 1 44 GLY HA3 H 11.213 5.951 1.455 1.00 . A A . 541 GLY HA3 1 1 20 13678 1 1 44 GLY N N 9.384 5.533 0.596 1.00 . A A . 541 GLY N 1 1 20 13679 1 1 44 GLY O O 11.430 8.508 0.649 1.00 . A A . 541 GLY O 1 1 20 13680 1 1 45 GLN C C 9.726 10.019 -1.412 1.00 . A A . 542 GLN C 1 1 20 13681 1 1 45 GLN CA C 10.351 8.711 -1.878 1.00 . A A . 542 GLN CA 1 1 20 13682 1 1 45 GLN CB C 9.821 8.357 -3.269 1.00 . A A . 542 GLN CB 1 1 20 13683 1 1 45 GLN CD C 12.063 7.385 -3.914 1.00 . A A . 542 GLN CD 1 1 20 13684 1 1 45 GLN CG C 10.559 7.209 -3.941 1.00 . A A . 542 GLN CG 1 1 20 13685 1 1 45 GLN H H 9.514 6.889 -1.191 1.00 . A A . 542 GLN H 1 1 20 13686 1 1 45 GLN HA H 11.421 8.841 -1.938 1.00 . A A . 542 GLN HA 1 1 20 13687 1 1 45 GLN HB2 H 8.779 8.082 -3.186 1.00 . A A . 542 GLN HB2 1 1 20 13688 1 1 45 GLN HB3 H 9.902 9.226 -3.905 1.00 . A A . 542 GLN HB3 1 1 20 13689 1 1 45 GLN HE21 H 12.180 6.294 -2.263 1.00 . A A . 542 GLN HE21 1 1 20 13690 1 1 45 GLN HE22 H 13.680 6.903 -2.867 1.00 . A A . 542 GLN HE22 1 1 20 13691 1 1 45 GLN HG2 H 10.313 6.290 -3.429 1.00 . A A . 542 GLN HG2 1 1 20 13692 1 1 45 GLN HG3 H 10.237 7.143 -4.969 1.00 . A A . 542 GLN HG3 1 1 20 13693 1 1 45 GLN N N 10.095 7.633 -0.927 1.00 . A A . 542 GLN N 1 1 20 13694 1 1 45 GLN NE2 N 12.705 6.804 -2.916 1.00 . A A . 542 GLN NE2 1 1 20 13695 1 1 45 GLN O O 10.175 11.100 -1.790 1.00 . A A . 542 GLN O 1 1 20 13696 1 1 45 GLN OE1 O 12.644 8.015 -4.797 1.00 . A A . 542 GLN OE1 1 1 20 13697 1 1 46 SER C C 8.197 11.282 1.386 1.00 . A A . 543 SER C 1 1 20 13698 1 1 46 SER CA C 7.993 11.094 -0.114 1.00 . A A . 543 SER CA 1 1 20 13699 1 1 46 SER CB C 6.505 10.959 -0.435 1.00 . A A . 543 SER CB 1 1 20 13700 1 1 46 SER H H 8.421 9.037 -0.275 1.00 . A A . 543 SER H 1 1 20 13701 1 1 46 SER HA H 8.389 11.954 -0.633 1.00 . A A . 543 SER HA 1 1 20 13702 1 1 46 SER HB2 H 6.078 10.161 0.158 1.00 . A A . 543 SER HB2 1 1 20 13703 1 1 46 SER HB3 H 6.003 11.887 -0.204 1.00 . A A . 543 SER HB3 1 1 20 13704 1 1 46 SER HG H 6.890 11.233 -2.344 1.00 . A A . 543 SER HG 1 1 20 13705 1 1 46 SER N N 8.703 9.920 -0.585 1.00 . A A . 543 SER N 1 1 20 13706 1 1 46 SER O O 7.944 10.370 2.175 1.00 . A A . 543 SER O 1 1 20 13707 1 1 46 SER OG O 6.312 10.663 -1.811 1.00 . A A . 543 SER OG 1 1 20 13708 1 1 47 ALA C C 8.275 14.158 3.470 1.00 . A A . 544 ALA C 1 1 20 13709 1 1 47 ALA CA C 8.863 12.783 3.170 1.00 . A A . 544 ALA CA 1 1 20 13710 1 1 47 ALA CB C 10.343 12.735 3.527 1.00 . A A . 544 ALA CB 1 1 20 13711 1 1 47 ALA H H 8.916 13.124 1.087 1.00 . A A . 544 ALA H 1 1 20 13712 1 1 47 ALA HA H 8.345 12.041 3.761 1.00 . A A . 544 ALA HA 1 1 20 13713 1 1 47 ALA HB1 H 10.878 13.471 2.945 1.00 . A A . 544 ALA HB1 1 1 20 13714 1 1 47 ALA HB2 H 10.466 12.950 4.579 1.00 . A A . 544 ALA HB2 1 1 20 13715 1 1 47 ALA HB3 H 10.733 11.752 3.313 1.00 . A A . 544 ALA HB3 1 1 20 13716 1 1 47 ALA N N 8.676 12.455 1.768 1.00 . A A . 544 ALA N 1 1 20 13717 1 1 47 ALA O O 9.051 15.093 3.758 1.00 . A A . 544 ALA O 1 1 20 13718 1 1 47 ALA OXT O 7.040 14.308 3.367 1.00 . A A . 544 ALA OXT 1 1 20 13719 2 2 1 ZN ZN ZN -5.590 -5.805 -0.933 1.00 . B A . 601 ZN ZN 1 1 20 13720 3 2 1 ZN ZN ZN 5.123 2.627 1.697 1.00 . C A . 602 ZN ZN 1 1 stop_ save_
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