NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
444116 | 2kgg | 16209 | cing | 4-filtered-FRED | STAR | entry | full | 617 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2kgg # This FRED archive file contains, for PDB entry <2kgg>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2kgg _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2kgg _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "free and other bound" _Assembly.Molecular_mass 5881.15 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 $Histone_demethylase_JARID1A 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_Histone_demethylase_JARID1A _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Histone demethylase JARID1A" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code SVCAAQNCQRPCKDKVDWVQCDGGCDEWFHQVCVGVSPEMAENEDYICINCA _Entity.Number_of_monomers 52 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 SER . 1 1 2 VAL . 1 1 3 CYS . 1 1 4 ALA . 1 1 5 ALA . 1 1 6 GLN . 1 1 7 ASN . 1 1 8 CYS . 1 1 9 GLN . 1 1 10 ARG . 1 1 11 PRO . 1 1 12 CYS . 1 1 13 LYS . 1 1 14 ASP . 1 1 15 LYS . 1 1 16 VAL . 1 1 17 ASP . 1 1 18 TRP . 1 1 19 VAL . 1 1 20 GLN . 1 1 21 CYS . 1 1 22 ASP . 1 1 23 GLY . 1 1 24 GLY . 1 1 25 CYS . 1 1 26 ASP . 1 1 27 GLU . 1 1 28 TRP . 1 1 29 PHE . 1 1 30 HIS . 1 1 31 GLN . 1 1 32 VAL . 1 1 33 CYS . 1 1 34 VAL . 1 1 35 GLY . 1 1 36 VAL . 1 1 37 SER . 1 1 38 PRO . 1 1 39 GLU . 1 1 40 MET . 1 1 41 ALA . 1 1 42 GLU . 1 1 43 ASN . 1 1 44 GLU . 1 1 45 ASP . 1 1 46 TYR . 1 1 47 ILE . 1 1 48 CYS . 1 1 49 ILE . 1 1 50 ASN . 1 1 51 CYS . 1 1 52 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 SER 1 1 1 1 VAL 2 2 1 1 CYS 3 3 1 1 ALA 4 4 1 1 ALA 5 5 1 1 GLN 6 6 1 1 ASN 7 7 1 1 CYS 8 8 1 1 GLN 9 9 1 1 ARG 10 10 1 1 PRO 11 11 1 1 CYS 12 12 1 1 LYS 13 13 1 1 ASP 14 14 1 1 LYS 15 15 1 1 VAL 16 16 1 1 ASP 17 17 1 1 TRP 18 18 1 1 VAL 19 19 1 1 GLN 20 20 1 1 CYS 21 21 1 1 ASP 22 22 1 1 GLY 23 23 1 1 GLY 24 24 1 1 CYS 25 25 1 1 ASP 26 26 1 1 GLU 27 27 1 1 TRP 28 28 1 1 PHE 29 29 1 1 HIS 30 30 1 1 GLN 31 31 1 1 VAL 32 32 1 1 CYS 33 33 1 1 VAL 34 34 1 1 GLY 35 35 1 1 VAL 36 36 1 1 SER 37 37 1 1 PRO 38 38 1 1 GLU 39 39 1 1 MET 40 40 1 1 ALA 41 41 1 1 GLU 42 42 1 1 ASN 43 43 1 1 GLU 44 44 1 1 ASP 45 45 1 1 TYR 46 46 1 1 ILE 47 47 1 1 CYS 48 48 1 1 ILE 49 49 1 1 ASN 50 50 1 1 CYS 51 51 1 1 ALA 52 52 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 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 VAL HA . 2 . HA 1 1 1 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 2 1 1 1 1 2 VAL HA . 2 . HA 1 1 2 1 2 1 1 3 CYS H . 3 . HN 1 1 3 1 1 1 1 2 VAL HB . 2 . HB 1 1 3 1 2 1 1 3 CYS H . 3 . HN 1 1 4 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 4 1 2 1 1 10 ARG HD2 . 10 . HD2 1 1 5 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 5 1 2 1 1 3 CYS H . 3 . HN 1 1 6 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 6 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 7 1 1 1 1 2 VAL MG1 . 2 . HG1# 1 1 7 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 8 1 1 1 1 2 VAL MG2 . 2 . HG2# 1 1 8 1 2 1 1 10 ARG HD2 . 10 . HD2 1 1 9 1 1 1 1 3 CYS HA . 3 . HA 1 1 9 1 2 1 1 18 TRP HH2 . 18 . HH2 1 1 10 1 1 1 1 3 CYS HA . 3 . HA 1 1 10 1 2 1 1 18 TRP HZ3 . 18 . HZ3 1 1 11 1 1 1 1 3 CYS HA . 3 . HA 1 1 11 1 2 1 1 4 ALA H . 4 . HN 1 1 12 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 12 1 2 1 1 30 HIS H . 30 . HN 1 1 13 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 13 1 2 1 1 4 ALA H . 4 . HN 1 1 14 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 14 1 2 1 1 30 HIS H . 30 . HN 1 1 15 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 15 1 2 1 1 4 ALA H . 4 . HN 1 1 16 1 1 1 1 3 CYS H . 3 . HN 1 1 16 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 17 1 1 1 1 3 CYS H . 3 . HN 1 1 17 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 18 1 1 1 1 3 CYS H . 3 . HN 1 1 18 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 19 1 1 1 1 4 ALA HA . 4 . HA 1 1 19 1 2 1 1 5 ALA H . 5 . HN 1 1 20 1 1 1 1 4 ALA MB . 4 . HB# 1 1 20 1 2 1 1 27 GLU HA . 27 . HA 1 1 21 1 1 1 1 4 ALA MB . 4 . HB# 1 1 21 1 2 1 1 27 GLU HB3 . 27 . HB1 1 1 22 1 1 1 1 4 ALA MB . 4 . HB# 1 1 22 1 2 1 1 27 GLU HB2 . 27 . HB2 1 1 23 1 1 1 1 4 ALA MB . 4 . HB# 1 1 23 1 2 1 1 27 GLU HG3 . 27 . HG1 1 1 24 1 1 1 1 4 ALA MB . 4 . HB# 1 1 24 1 2 1 1 28 TRP H . 28 . HN 1 1 25 1 1 1 1 4 ALA MB . 4 . HB# 1 1 25 1 2 1 1 29 PHE HZ . 29 . HZ 1 1 26 1 1 1 1 4 ALA MB . 4 . HB# 1 1 26 1 2 1 1 5 ALA H . 5 . HN 1 1 27 1 1 1 1 4 ALA H . 4 . HN 1 1 27 1 2 1 1 4 ALA MB . 4 . HB# 1 1 28 1 1 1 1 4 ALA H . 4 . HN 1 1 28 1 2 1 1 5 ALA H . 5 . HN 1 1 29 1 1 1 1 5 ALA HA . 5 . HA 1 1 29 1 2 1 1 29 PHE QD . 29 . HD# 1 1 30 1 1 1 1 5 ALA HA . 5 . HA 1 1 30 1 2 1 1 6 GLN H . 6 . HN 1 1 31 1 1 1 1 5 ALA MB . 5 . HB# 1 1 31 1 2 1 1 29 PHE HA . 29 . HA 1 1 32 1 1 1 1 5 ALA MB . 5 . HB# 1 1 32 1 2 1 1 29 PHE HB3 . 29 . HB1 1 1 33 1 1 1 1 5 ALA MB . 5 . HB# 1 1 33 1 2 1 1 29 PHE QD . 29 . HD# 1 1 34 1 1 1 1 5 ALA MB . 5 . HB# 1 1 34 1 2 1 1 33 CYS HA . 33 . HA 1 1 35 1 1 1 1 5 ALA MB . 5 . HB# 1 1 35 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 36 1 1 1 1 5 ALA MB . 5 . HB# 1 1 36 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 37 1 1 1 1 5 ALA MB . 5 . HB# 1 1 37 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 38 1 1 1 1 5 ALA MB . 5 . HB# 1 1 38 1 2 1 1 34 VAL H . 34 . HN 1 1 39 1 1 1 1 5 ALA MB . 5 . HB# 1 1 39 1 2 1 1 6 GLN H . 6 . HN 1 1 40 1 1 1 1 5 ALA MB . 5 . HB# 1 1 40 1 2 1 1 7 ASN H . 7 . HN 1 1 41 1 1 1 1 5 ALA MB . 5 . HB# 1 1 41 1 2 1 1 8 CYS HA . 8 . HA 1 1 42 1 1 1 1 5 ALA MB . 5 . HB# 1 1 42 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 43 1 1 1 1 5 ALA MB . 5 . HB# 1 1 43 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 44 1 1 1 1 5 ALA MB . 5 . HB# 1 1 44 1 2 1 1 8 CYS H . 8 . HN 1 1 45 1 1 1 1 5 ALA H . 5 . HN 1 1 45 1 2 1 1 29 PHE QD . 29 . HD# 1 1 46 1 1 1 1 5 ALA H . 5 . HN 1 1 46 1 2 1 1 5 ALA MB . 5 . HB# 1 1 47 1 1 1 1 6 GLN HA . 6 . HA 1 1 47 1 2 1 1 6 GLN HG2 . 6 . HG2 1 1 48 1 1 1 1 6 GLN HA . 6 . HA 1 1 48 1 2 1 1 7 ASN H . 7 . HN 1 1 49 1 1 1 1 6 GLN HB3 . 6 . HB1 1 1 49 1 2 1 1 7 ASN H . 7 . HN 1 1 50 1 1 1 1 6 GLN HB2 . 6 . HB2 1 1 50 1 2 1 1 49 ILE MD . 49 . HD1# 1 1 51 1 1 1 1 6 GLN HB2 . 6 . HB2 1 1 51 1 2 1 1 7 ASN H . 7 . HN 1 1 52 1 1 1 1 6 GLN HE22 . 6 . HE22 1 1 52 1 2 1 1 49 ILE MD . 49 . HD1# 1 1 53 1 1 1 1 6 GLN HG2 . 6 . HG2 1 1 53 1 2 1 1 49 ILE MD . 49 . HD1# 1 1 54 1 1 1 1 6 GLN HG2 . 6 . HG2 1 1 54 1 2 1 1 7 ASN H . 7 . HN 1 1 55 1 1 1 1 6 GLN H . 6 . HN 1 1 55 1 2 1 1 6 GLN HB3 . 6 . HB1 1 1 56 1 1 1 1 6 GLN H . 6 . HN 1 1 56 1 2 1 1 6 GLN HG2 . 6 . HG2 1 1 57 1 1 1 1 6 GLN H . 6 . HN 1 1 57 1 2 1 1 7 ASN H . 7 . HN 1 1 58 1 1 1 1 7 ASN H . 7 . HN 1 1 58 1 2 1 1 7 ASN HB2 . 7 . HB2 1 1 59 1 1 1 1 7 ASN H . 7 . HN 1 1 59 1 2 1 1 8 CYS H . 8 . HN 1 1 60 1 1 1 1 8 CYS HA . 8 . HA 1 1 60 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 61 1 1 1 1 8 CYS HA . 8 . HA 1 1 61 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 62 1 1 1 1 8 CYS HA . 8 . HA 1 1 62 1 2 1 1 9 GLN H . 9 . HN 1 1 63 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 63 1 2 1 1 9 GLN H . 9 . HN 1 1 64 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 64 1 2 1 1 9 GLN H . 9 . HN 1 1 65 1 1 1 1 8 CYS H . 8 . HN 1 1 65 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 66 1 1 1 1 8 CYS H . 8 . HN 1 1 66 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 67 1 1 1 1 9 GLN HA . 9 . HA 1 1 67 1 2 1 1 10 ARG H . 10 . HN 1 1 68 1 1 1 1 9 GLN HA . 9 . HA 1 1 68 1 2 1 1 9 GLN HG2 . 9 . HG2 1 1 69 1 1 1 1 9 GLN HB3 . 9 . HB1 1 1 69 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 70 1 1 1 1 9 GLN HB3 . 9 . HB1 1 1 70 1 2 1 1 9 GLN HE22 . 9 . HE22 1 1 71 1 1 1 1 9 GLN HB2 . 9 . HB2 1 1 71 1 2 1 1 11 PRO HD2 . 11 . HD2 1 1 72 1 1 1 1 9 GLN HB2 . 9 . HB2 1 1 72 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 73 1 1 1 1 9 GLN HE21 . 9 . HE21 1 1 73 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 74 1 1 1 1 9 GLN HE21 . 9 . HE21 1 1 74 1 2 1 1 32 VAL MG2 . 32 . HG2# 1 1 75 1 1 1 1 9 GLN HE21 . 9 . HE21 1 1 75 1 2 1 1 33 CYS HA . 33 . HA 1 1 76 1 1 1 1 9 GLN HE22 . 9 . HE22 1 1 76 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 77 1 1 1 1 9 GLN HE22 . 9 . HE22 1 1 77 1 2 1 1 33 CYS HA . 33 . HA 1 1 78 1 1 1 1 9 GLN HG3 . 9 . HG1 1 1 78 1 2 1 1 32 VAL MG2 . 32 . HG2# 1 1 79 1 1 1 1 9 GLN HE22 . 9 . HE22 1 1 79 1 2 1 1 9 GLN HG3 . 9 . HG1 1 1 80 1 1 1 1 9 GLN HG2 . 9 . HG2 1 1 80 1 2 1 1 33 CYS HA . 33 . HA 1 1 81 1 1 1 1 9 GLN HE22 . 9 . HE22 1 1 81 1 2 1 1 9 GLN HG2 . 9 . HG2 1 1 82 1 1 1 1 9 GLN H . 9 . HN 1 1 82 1 2 1 1 10 ARG H . 10 . HN 1 1 83 1 1 1 1 9 GLN H . 9 . HN 1 1 83 1 2 1 1 33 CYS HA . 33 . HA 1 1 84 1 1 1 1 9 GLN H . 9 . HN 1 1 84 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 85 1 1 1 1 9 GLN H . 9 . HN 1 1 85 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 86 1 1 1 1 9 GLN H . 9 . HN 1 1 86 1 2 1 1 9 GLN HB2 . 9 . HB2 1 1 87 1 1 1 1 9 GLN H . 9 . HN 1 1 87 1 2 1 1 9 GLN HG3 . 9 . HG1 1 1 88 1 1 1 1 9 GLN H . 9 . HN 1 1 88 1 2 1 1 9 GLN HG2 . 9 . HG2 1 1 89 1 1 1 1 10 ARG HA . 10 . HA 1 1 89 1 2 1 1 10 ARG HD2 . 10 . HD2 1 1 90 1 1 1 1 10 ARG HA . 10 . HA 1 1 90 1 2 1 1 11 PRO HD2 . 11 . HD2 1 1 91 1 1 1 1 10 ARG HB3 . 10 . HB1 1 1 91 1 2 1 1 10 ARG HD2 . 10 . HD2 1 1 92 1 1 1 1 10 ARG H . 10 . HN 1 1 92 1 2 1 1 10 ARG HG2 . 10 . HG2 1 1 93 1 1 1 1 10 ARG H . 10 . HN 1 1 93 1 2 1 1 11 PRO HD2 . 11 . HD2 1 1 94 1 1 1 1 11 PRO HB2 . 11 . HB2 1 1 94 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 95 1 1 1 1 11 PRO HB2 . 11 . HB2 1 1 95 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 96 1 1 1 1 11 PRO HA . 11 . HA 1 1 96 1 2 1 1 11 PRO HD2 . 11 . HD2 1 1 97 1 1 1 1 11 PRO HD2 . 11 . HD2 1 1 97 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 98 1 1 1 1 11 PRO HG2 . 11 . HG2 1 1 98 1 2 1 1 30 HIS HE1 . 30 . HE1 1 1 99 1 1 1 1 12 CYS HA . 12 . HA 1 1 99 1 2 1 1 13 LYS H . 13 . HN 1 1 100 1 1 1 1 13 LYS HA . 13 . HA 1 1 100 1 2 1 1 14 ASP H . 14 . HN 1 1 101 1 1 1 1 13 LYS HA . 13 . HA 1 1 101 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 102 1 1 1 1 13 LYS HB2 . 13 . HB2 1 1 102 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 103 1 1 1 1 13 LYS HE2 . 13 . HE2 1 1 103 1 2 1 1 13 LYS HG2 . 13 . HG2 1 1 104 1 1 1 1 13 LYS H . 13 . HN 1 1 104 1 2 1 1 13 LYS HG2 . 13 . HG2 1 1 105 1 1 1 1 14 ASP HA . 14 . HA 1 1 105 1 2 1 1 15 LYS H . 15 . HN 1 1 106 1 1 1 1 14 ASP HB3 . 14 . HB1 1 1 106 1 2 1 1 15 LYS H . 15 . HN 1 1 107 1 1 1 1 14 ASP HB2 . 14 . HB2 1 1 107 1 2 1 1 15 LYS H . 15 . HN 1 1 108 1 1 1 1 14 ASP H . 14 . HN 1 1 108 1 2 1 1 15 LYS H . 15 . HN 1 1 109 1 1 1 1 15 LYS HA . 15 . HA 1 1 109 1 2 1 1 16 VAL H . 16 . HN 1 1 110 1 1 1 1 15 LYS H . 15 . HN 1 1 110 1 2 1 1 15 LYS HG2 . 15 . HG2 1 1 111 1 1 1 1 16 VAL HA . 16 . HA 1 1 111 1 2 1 1 17 ASP H . 17 . HN 1 1 112 1 1 1 1 16 VAL HB . 16 . HB 1 1 112 1 2 1 1 17 ASP H . 17 . HN 1 1 113 1 1 1 1 16 VAL HB . 16 . HB 1 1 113 1 2 1 1 18 TRP HE1 . 18 . HE1 1 1 114 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 114 1 2 1 1 17 ASP H . 17 . HN 1 1 115 1 1 1 1 16 VAL MG1 . 16 . HG1# 1 1 115 1 2 1 1 18 TRP HZ2 . 18 . HZ2 1 1 116 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 116 1 2 1 1 17 ASP H . 17 . HN 1 1 117 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 117 1 2 1 1 18 TRP HD1 . 18 . HD1 1 1 118 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 118 1 2 1 1 18 TRP HE1 . 18 . HE1 1 1 119 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 119 1 2 1 1 31 GLN HE21 . 31 . HE21 1 1 120 1 1 1 1 16 VAL MG2 . 16 . HG2# 1 1 120 1 2 1 1 31 GLN HE22 . 31 . HE22 1 1 121 1 1 1 1 16 VAL H . 16 . HN 1 1 121 1 2 1 1 16 VAL MG1 . 16 . HG1# 1 1 122 1 1 1 1 17 ASP HA . 17 . HA 1 1 122 1 2 1 1 18 TRP HE1 . 18 . HE1 1 1 123 1 1 1 1 17 ASP HA . 17 . HA 1 1 123 1 2 1 1 18 TRP H . 18 . HN 1 1 124 1 1 1 1 17 ASP HB2 . 17 . HB2 1 1 124 1 2 1 1 18 TRP H . 18 . HN 1 1 125 1 1 1 1 17 ASP HB2 . 17 . HB2 1 1 125 1 2 1 1 31 GLN HE21 . 31 . HE21 1 1 126 1 1 1 1 17 ASP HB2 . 17 . HB2 1 1 126 1 2 1 1 31 GLN HE22 . 31 . HE22 1 1 127 1 1 1 1 18 TRP HA . 18 . HA 1 1 127 1 2 1 1 18 TRP HE3 . 18 . HE3 1 1 128 1 1 1 1 18 TRP HA . 18 . HA 1 1 128 1 2 1 1 19 VAL H . 19 . HN 1 1 129 1 1 1 1 18 TRP HA . 18 . HA 1 1 129 1 2 1 1 30 HIS HA . 30 . HA 1 1 130 1 1 1 1 18 TRP HA . 18 . HA 1 1 130 1 2 1 1 31 GLN HG3 . 31 . HG1 1 1 131 1 1 1 1 18 TRP HA . 18 . HA 1 1 131 1 2 1 1 31 GLN HG2 . 31 . HG2 1 1 132 1 1 1 1 18 TRP HA . 18 . HA 1 1 132 1 2 1 1 31 GLN H . 31 . HN 1 1 133 1 1 1 1 18 TRP HB3 . 18 . HB1 1 1 133 1 2 1 1 18 TRP HE1 . 18 . HE1 1 1 134 1 1 1 1 18 TRP HB3 . 18 . HB1 1 1 134 1 2 1 1 19 VAL H . 19 . HN 1 1 135 1 1 1 1 18 TRP HB3 . 18 . HB1 1 1 135 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 136 1 1 1 1 18 TRP HB3 . 18 . HB1 1 1 136 1 2 1 1 28 TRP HZ3 . 28 . HZ3 1 1 137 1 1 1 1 18 TRP HB2 . 18 . HB2 1 1 137 1 2 1 1 19 VAL H . 19 . HN 1 1 138 1 1 1 1 18 TRP HB2 . 18 . HB2 1 1 138 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 139 1 1 1 1 18 TRP HB2 . 18 . HB2 1 1 139 1 2 1 1 28 TRP HZ3 . 28 . HZ3 1 1 140 1 1 1 1 18 TRP HE3 . 18 . HE3 1 1 140 1 2 1 1 28 TRP HB3 . 28 . HB1 1 1 141 1 1 1 1 18 TRP HE3 . 18 . HE3 1 1 141 1 2 1 1 29 PHE H . 29 . HN 1 1 142 1 1 1 1 18 TRP HE3 . 18 . HE3 1 1 142 1 2 1 1 30 HIS H . 30 . HN 1 1 143 1 1 1 1 18 TRP H . 18 . HN 1 1 143 1 2 1 1 18 TRP HD1 . 18 . HD1 1 1 144 1 1 1 1 18 TRP HZ3 . 18 . HZ3 1 1 144 1 2 1 1 28 TRP HB3 . 28 . HB1 1 1 145 1 1 1 1 18 TRP HZ3 . 18 . HZ3 1 1 145 1 2 1 1 30 HIS H . 30 . HN 1 1 146 1 1 1 1 19 VAL HB . 19 . HB 1 1 146 1 2 1 1 41 ALA MB . 41 . HB# 1 1 147 1 1 1 1 19 VAL MG1 . 19 . HG1# 1 1 147 1 2 1 1 46 TYR HB2 . 46 . HB2 1 1 148 1 1 1 1 19 VAL MG1 . 19 . HG1# 1 1 148 1 2 1 1 46 TYR QD . 46 . HD# 1 1 149 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 149 1 2 1 1 29 PHE HB3 . 29 . HB1 1 1 150 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 150 1 2 1 1 29 PHE HB2 . 29 . HB2 1 1 151 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 151 1 2 1 1 29 PHE H . 29 . HN 1 1 152 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 152 1 2 1 1 29 PHE QD . 29 . HD# 1 1 153 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 153 1 2 1 1 30 HIS H . 30 . HN 1 1 154 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 154 1 2 1 1 31 GLN HA . 31 . HA 1 1 155 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 155 1 2 1 1 31 GLN HG2 . 31 . HG2 1 1 156 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 156 1 2 1 1 31 GLN H . 31 . HN 1 1 157 1 1 1 1 19 VAL MG2 . 19 . HG2# 1 1 157 1 2 1 1 46 TYR QD . 46 . HD# 1 1 158 1 1 1 1 19 VAL H . 19 . HN 1 1 158 1 2 1 1 19 VAL MG2 . 19 . HG2# 1 1 159 1 1 1 1 19 VAL H . 19 . HN 1 1 159 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 160 1 1 1 1 19 VAL H . 19 . HN 1 1 160 1 2 1 1 29 PHE HB2 . 29 . HB2 1 1 161 1 1 1 1 19 VAL H . 19 . HN 1 1 161 1 2 1 1 29 PHE H . 29 . HN 1 1 162 1 1 1 1 19 VAL H . 19 . HN 1 1 162 1 2 1 1 29 PHE O . 29 . O 1 1 163 1 1 1 1 19 VAL H . 19 . HN 1 1 163 1 2 1 1 30 HIS HA . 30 . HA 1 1 164 1 1 1 1 19 VAL O . 19 . O 1 1 164 1 2 1 1 29 PHE H . 29 . HN 1 1 165 1 1 1 1 20 GLN HA . 20 . HA 1 1 165 1 2 1 1 21 CYS H . 21 . HN 1 1 166 1 1 1 1 20 GLN HA . 20 . HA 1 1 166 1 2 1 1 28 TRP HA . 28 . HA 1 1 167 1 1 1 1 20 GLN HA . 20 . HA 1 1 167 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 168 1 1 1 1 20 GLN HA . 20 . HA 1 1 168 1 2 1 1 29 PHE H . 29 . HN 1 1 169 1 1 1 1 20 GLN HE21 . 20 . HE21 1 1 169 1 2 1 1 26 ASP HA . 26 . HA 1 1 170 1 1 1 1 20 GLN HE21 . 20 . HE21 1 1 170 1 2 1 1 26 ASP HB2 . 26 . HB2 1 1 171 1 1 1 1 20 GLN HE21 . 20 . HE21 1 1 171 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 172 1 1 1 1 20 GLN HE22 . 20 . HE22 1 1 172 1 2 1 1 26 ASP HA . 26 . HA 1 1 173 1 1 1 1 20 GLN HE22 . 20 . HE22 1 1 173 1 2 1 1 26 ASP HB2 . 26 . HB2 1 1 174 1 1 1 1 20 GLN HE22 . 20 . HE22 1 1 174 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 175 1 1 1 1 20 GLN HG3 . 20 . HG1 1 1 175 1 2 1 1 21 CYS H . 21 . HN 1 1 176 1 1 1 1 20 GLN HG3 . 20 . HG1 1 1 176 1 2 1 1 26 ASP HA . 26 . HA 1 1 177 1 1 1 1 20 GLN HG2 . 20 . HG2 1 1 177 1 2 1 1 21 CYS H . 21 . HN 1 1 178 1 1 1 1 20 GLN HG2 . 20 . HG2 1 1 178 1 2 1 1 26 ASP HA . 26 . HA 1 1 179 1 1 1 1 20 GLN HG2 . 20 . HG2 1 1 179 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 180 1 1 1 1 21 CYS HA . 21 . HA 1 1 180 1 2 1 1 22 ASP H . 22 . HN 1 1 181 1 1 1 1 21 CYS HB3 . 21 . HB1 1 1 181 1 2 1 1 29 PHE QE . 29 . HE# 1 1 182 1 1 1 1 21 CYS HB3 . 21 . HB1 1 1 182 1 2 1 1 29 PHE HZ . 29 . HZ 1 1 183 1 1 1 1 21 CYS HB3 . 21 . HB1 1 1 183 1 2 1 1 46 TYR QD . 46 . HD# 1 1 184 1 1 1 1 21 CYS HB3 . 21 . HB1 1 1 184 1 2 1 1 48 CYS H . 48 . HN 1 1 185 1 1 1 1 21 CYS HB2 . 21 . HB2 1 1 185 1 2 1 1 27 GLU H . 27 . HN 1 1 186 1 1 1 1 21 CYS HB2 . 21 . HB2 1 1 186 1 2 1 1 29 PHE HZ . 29 . HZ 1 1 187 1 1 1 1 21 CYS HB2 . 21 . HB2 1 1 187 1 2 1 1 48 CYS H . 48 . HN 1 1 188 1 1 1 1 21 CYS H . 21 . HN 1 1 188 1 2 1 1 21 CYS HB3 . 21 . HB1 1 1 189 1 1 1 1 21 CYS H . 21 . HN 1 1 189 1 2 1 1 21 CYS HB2 . 21 . HB2 1 1 190 1 1 1 1 21 CYS H . 21 . HN 1 1 190 1 2 1 1 29 PHE QD . 29 . HD# 1 1 191 1 1 1 1 22 ASP HA . 22 . HA 1 1 191 1 2 1 1 23 GLY H . 23 . HN 1 1 192 1 1 1 1 22 ASP H . 22 . HN 1 1 192 1 2 1 1 23 GLY H . 23 . HN 1 1 193 1 1 1 1 22 ASP H . 22 . HN 1 1 193 1 2 1 1 46 TYR QD . 46 . HD# 1 1 194 1 1 1 1 22 ASP H . 22 . HN 1 1 194 1 2 1 1 47 ILE MD . 47 . HD1# 1 1 195 1 1 1 1 23 GLY HA3 . 23 . HA1 1 1 195 1 2 1 1 24 GLY H . 24 . HN 1 1 196 1 1 1 1 23 GLY HA3 . 23 . HA1 1 1 196 1 2 1 1 47 ILE MD . 47 . HD1# 1 1 197 1 1 1 1 23 GLY HA3 . 23 . HA1 1 1 197 1 2 1 1 47 ILE MG . 47 . HG2# 1 1 198 1 1 1 1 23 GLY HA3 . 23 . HA1 1 1 198 1 2 1 1 51 CYS HB3 . 51 . HB1 1 1 199 1 1 1 1 23 GLY HA3 . 23 . HA1 1 1 199 1 2 1 1 51 CYS HB2 . 51 . HB2 1 1 200 1 1 1 1 23 GLY H . 23 . HN 1 1 200 1 2 1 1 24 GLY H . 24 . HN 1 1 201 1 1 1 1 23 GLY H . 23 . HN 1 1 201 1 2 1 1 47 ILE HA . 47 . HA 1 1 202 1 1 1 1 23 GLY H . 23 . HN 1 1 202 1 2 1 1 47 ILE MD . 47 . HD1# 1 1 203 1 1 1 1 23 GLY H . 23 . HN 1 1 203 1 2 1 1 47 ILE MG . 47 . HG2# 1 1 204 1 1 1 1 24 GLY HA3 . 24 . HA1 1 1 204 1 2 1 1 25 CYS H . 25 . HN 1 1 205 1 1 1 1 24 GLY H . 24 . HN 1 1 205 1 2 1 1 25 CYS H . 25 . HN 1 1 206 1 1 1 1 25 CYS HA . 25 . HA 1 1 206 1 2 1 1 26 ASP H . 26 . HN 1 1 207 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 207 1 2 1 1 26 ASP H . 26 . HN 1 1 208 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 208 1 2 1 1 27 GLU HG2 . 27 . HG2 1 1 209 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 209 1 2 1 1 27 GLU H . 27 . HN 1 1 210 1 1 1 1 25 CYS H . 25 . HN 1 1 210 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1 211 1 1 1 1 25 CYS H . 25 . HN 1 1 211 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 212 1 1 1 1 25 CYS H . 25 . HN 1 1 212 1 2 1 1 26 ASP H . 26 . HN 1 1 213 1 1 1 1 25 CYS H . 25 . HN 1 1 213 1 2 1 1 27 GLU H . 27 . HN 1 1 214 1 1 1 1 26 ASP HA . 26 . HA 1 1 214 1 2 1 1 27 GLU H . 27 . HN 1 1 215 1 1 1 1 26 ASP HB2 . 26 . HB2 1 1 215 1 2 1 1 27 GLU H . 27 . HN 1 1 216 1 1 1 1 26 ASP H . 26 . HN 1 1 216 1 2 1 1 27 GLU H . 27 . HN 1 1 217 1 1 1 1 27 GLU HA . 27 . HA 1 1 217 1 2 1 1 27 GLU HG2 . 27 . HG2 1 1 218 1 1 1 1 27 GLU HA . 27 . HA 1 1 218 1 2 1 1 28 TRP HD1 . 28 . HD1 1 1 219 1 1 1 1 27 GLU HA . 27 . HA 1 1 219 1 2 1 1 28 TRP H . 28 . HN 1 1 220 1 1 1 1 27 GLU HB3 . 27 . HB1 1 1 220 1 2 1 1 28 TRP H . 28 . HN 1 1 221 1 1 1 1 27 GLU HB3 . 27 . HB1 1 1 221 1 2 1 1 29 PHE QE . 29 . HE# 1 1 222 1 1 1 1 27 GLU HB3 . 27 . HB1 1 1 222 1 2 1 1 29 PHE HZ . 29 . HZ 1 1 223 1 1 1 1 27 GLU HB2 . 27 . HB2 1 1 223 1 2 1 1 28 TRP H . 28 . HN 1 1 224 1 1 1 1 27 GLU HB2 . 27 . HB2 1 1 224 1 2 1 1 29 PHE QE . 29 . HE# 1 1 225 1 1 1 1 27 GLU HB2 . 27 . HB2 1 1 225 1 2 1 1 29 PHE HZ . 29 . HZ 1 1 226 1 1 1 1 27 GLU HG2 . 27 . HG2 1 1 226 1 2 1 1 28 TRP H . 28 . HN 1 1 227 1 1 1 1 27 GLU H . 27 . HN 1 1 227 1 2 1 1 27 GLU HB3 . 27 . HB1 1 1 228 1 1 1 1 27 GLU H . 27 . HN 1 1 228 1 2 1 1 27 GLU HG3 . 27 . HG1 1 1 229 1 1 1 1 27 GLU H . 27 . HN 1 1 229 1 2 1 1 27 GLU HG2 . 27 . HG2 1 1 230 1 1 1 1 27 GLU H . 27 . HN 1 1 230 1 2 1 1 29 PHE HZ . 29 . HZ 1 1 231 1 1 1 1 28 TRP HA . 28 . HA 1 1 231 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 232 1 1 1 1 28 TRP HA . 28 . HA 1 1 232 1 2 1 1 29 PHE H . 29 . HN 1 1 233 1 1 1 1 28 TRP HB3 . 28 . HB1 1 1 233 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 234 1 1 1 1 28 TRP HB3 . 28 . HB1 1 1 234 1 2 1 1 29 PHE H . 29 . HN 1 1 235 1 1 1 1 28 TRP HE3 . 28 . HE3 1 1 235 1 2 1 1 29 PHE H . 29 . HN 1 1 236 1 1 1 1 28 TRP H . 28 . HN 1 1 236 1 2 1 1 28 TRP HB2 . 28 . HB2 1 1 237 1 1 1 1 28 TRP H . 28 . HN 1 1 237 1 2 1 1 28 TRP HD1 . 28 . HD1 1 1 238 1 1 1 1 29 PHE HA . 29 . HA 1 1 238 1 2 1 1 30 HIS H . 30 . HN 1 1 239 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 239 1 2 1 1 30 HIS H . 30 . HN 1 1 240 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 240 1 2 1 1 34 VAL MG1 . 34 . HG1# 1 1 241 1 1 1 1 29 PHE HB3 . 29 . HB1 1 1 241 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 242 1 1 1 1 29 PHE HB2 . 29 . HB2 1 1 242 1 2 1 1 30 HIS H . 30 . HN 1 1 243 1 1 1 1 29 PHE HB2 . 29 . HB2 1 1 243 1 2 1 1 34 VAL MG1 . 34 . HG1# 1 1 244 1 1 1 1 29 PHE HB2 . 29 . HB2 1 1 244 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 245 1 1 1 1 29 PHE QD . 29 . HD# 1 1 245 1 2 1 1 30 HIS H . 30 . HN 1 1 246 1 1 1 1 29 PHE QD . 29 . HD# 1 1 246 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 247 1 1 1 1 29 PHE QE . 29 . HE# 1 1 247 1 2 1 1 48 CYS HB3 . 48 . HB1 1 1 248 1 1 1 1 29 PHE H . 29 . HN 1 1 248 1 2 1 1 29 PHE HB3 . 29 . HB1 1 1 249 1 1 1 1 29 PHE H . 29 . HN 1 1 249 1 2 1 1 29 PHE QD . 29 . HD# 1 1 250 1 1 1 1 29 PHE HZ . 29 . HZ 1 1 250 1 2 1 1 48 CYS HB3 . 48 . HB1 1 1 251 1 1 1 1 29 PHE HZ . 29 . HZ 1 1 251 1 2 1 1 48 CYS HB2 . 48 . HB2 1 1 252 1 1 1 1 30 HIS HA . 30 . HA 1 1 252 1 2 1 1 31 GLN H . 31 . HN 1 1 253 1 1 1 1 30 HIS HA . 30 . HA 1 1 253 1 2 1 1 32 VAL H . 32 . HN 1 1 254 1 1 1 1 30 HIS HB3 . 30 . HB1 1 1 254 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 255 1 1 1 1 30 HIS HB3 . 30 . HB1 1 1 255 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 256 1 1 1 1 30 HIS HB3 . 30 . HB1 1 1 256 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 257 1 1 1 1 30 HIS HB3 . 30 . HB1 1 1 257 1 2 1 1 33 CYS H . 33 . HN 1 1 258 1 1 1 1 30 HIS HB3 . 30 . HB1 1 1 258 1 2 1 1 34 VAL H . 34 . HN 1 1 259 1 1 1 1 30 HIS HB2 . 30 . HB2 1 1 259 1 2 1 1 31 GLN H . 31 . HN 1 1 260 1 1 1 1 30 HIS HB2 . 30 . HB2 1 1 260 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 261 1 1 1 1 30 HIS HB2 . 30 . HB2 1 1 261 1 2 1 1 32 VAL H . 32 . HN 1 1 262 1 1 1 1 30 HIS HB2 . 30 . HB2 1 1 262 1 2 1 1 33 CYS H . 33 . HN 1 1 263 1 1 1 1 30 HIS H . 30 . HN 1 1 263 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 264 1 1 1 1 30 HIS H . 30 . HN 1 1 264 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 265 1 1 1 1 30 HIS H . 30 . HN 1 1 265 1 2 1 1 33 CYS H . 33 . HN 1 1 266 1 1 1 1 30 HIS H . 30 . HN 1 1 266 1 2 1 1 34 VAL MG1 . 34 . HG1# 1 1 267 1 1 1 1 30 HIS H . 30 . HN 1 1 267 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 268 1 1 1 1 31 GLN HA . 31 . HA 1 1 268 1 2 1 1 31 GLN HG3 . 31 . HG1 1 1 269 1 1 1 1 31 GLN HA . 31 . HA 1 1 269 1 2 1 1 31 GLN HG2 . 31 . HG2 1 1 270 1 1 1 1 31 GLN HA . 31 . HA 1 1 270 1 2 1 1 32 VAL H . 32 . HN 1 1 271 1 1 1 1 31 GLN HA . 31 . HA 1 1 271 1 2 1 1 34 VAL MG1 . 34 . HG1# 1 1 272 1 1 1 1 31 GLN HA . 31 . HA 1 1 272 1 2 1 1 34 VAL H . 34 . HN 1 1 273 1 1 1 1 31 GLN HA . 31 . HA 1 1 273 1 2 1 1 36 VAL HB . 36 . HB 1 1 274 1 1 1 1 31 GLN HA . 31 . HA 1 1 274 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 275 1 1 1 1 31 GLN HA . 31 . HA 1 1 275 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 276 1 1 1 1 31 GLN HA . 31 . HA 1 1 276 1 2 1 1 36 VAL H . 36 . HN 1 1 277 1 1 1 1 31 GLN HB3 . 31 . HB1 1 1 277 1 2 1 1 32 VAL H . 32 . HN 1 1 278 1 1 1 1 31 GLN HB3 . 31 . HB1 1 1 278 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 279 1 1 1 1 31 GLN HB3 . 31 . HB1 1 1 279 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 280 1 1 1 1 31 GLN HB3 . 31 . HB1 1 1 280 1 2 1 1 36 VAL H . 36 . HN 1 1 281 1 1 1 1 31 GLN HB2 . 31 . HB2 1 1 281 1 2 1 1 32 VAL H . 32 . HN 1 1 282 1 1 1 1 31 GLN HE21 . 31 . HE21 1 1 282 1 2 1 1 38 PRO HA . 38 . HA 1 1 283 1 1 1 1 31 GLN HE21 . 31 . HE21 1 1 283 1 2 1 1 38 PRO HB3 . 38 . HB1 1 1 284 1 1 1 1 31 GLN HE21 . 31 . HE21 1 1 284 1 2 1 1 41 ALA MB . 41 . HB# 1 1 285 1 1 1 1 31 GLN HE22 . 31 . HE22 1 1 285 1 2 1 1 41 ALA MB . 41 . HB# 1 1 286 1 1 1 1 31 GLN HE22 . 31 . HE22 1 1 286 1 2 1 1 31 GLN HG3 . 31 . HG1 1 1 287 1 1 1 1 31 GLN HG3 . 31 . HG1 1 1 287 1 2 1 1 32 VAL H . 32 . HN 1 1 288 1 1 1 1 31 GLN HG3 . 31 . HG1 1 1 288 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 289 1 1 1 1 31 GLN HG3 . 31 . HG1 1 1 289 1 2 1 1 36 VAL H . 36 . HN 1 1 290 1 1 1 1 31 GLN HG2 . 31 . HG2 1 1 290 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 291 1 1 1 1 31 GLN HG2 . 31 . HG2 1 1 291 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 292 1 1 1 1 31 GLN HG2 . 31 . HG2 1 1 292 1 2 1 1 36 VAL H . 36 . HN 1 1 293 1 1 1 1 31 GLN H . 31 . HN 1 1 293 1 2 1 1 31 GLN HG3 . 31 . HG1 1 1 294 1 1 1 1 31 GLN H . 31 . HN 1 1 294 1 2 1 1 31 GLN HG2 . 31 . HG2 1 1 295 1 1 1 1 32 VAL HA . 32 . HA 1 1 295 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 296 1 1 1 1 32 VAL HA . 32 . HA 1 1 296 1 2 1 1 33 CYS H . 33 . HN 1 1 297 1 1 1 1 32 VAL HA . 32 . HA 1 1 297 1 2 1 1 35 GLY H . 35 . HN 1 1 298 1 1 1 1 32 VAL HA . 32 . HA 1 1 298 1 2 1 1 36 VAL H . 36 . HN 1 1 299 1 1 1 1 32 VAL HB . 32 . HB 1 1 299 1 2 1 1 33 CYS H . 33 . HN 1 1 300 1 1 1 1 32 VAL MG1 . 32 . HG1# 1 1 300 1 2 1 1 33 CYS H . 33 . HN 1 1 301 1 1 1 1 32 VAL MG1 . 32 . HG1# 1 1 301 1 2 1 1 35 GLY H . 35 . HN 1 1 302 1 1 1 1 32 VAL MG2 . 32 . HG2# 1 1 302 1 2 1 1 33 CYS H . 33 . HN 1 1 303 1 1 1 1 32 VAL H . 32 . HN 1 1 303 1 2 1 1 32 VAL HB . 32 . HB 1 1 304 1 1 1 1 32 VAL H . 32 . HN 1 1 304 1 2 1 1 32 VAL MG1 . 32 . HG1# 1 1 305 1 1 1 1 32 VAL H . 32 . HN 1 1 305 1 2 1 1 33 CYS H . 33 . HN 1 1 306 1 1 1 1 32 VAL H . 32 . HN 1 1 306 1 2 1 1 34 VAL H . 34 . HN 1 1 307 1 1 1 1 33 CYS HA . 33 . HA 1 1 307 1 2 1 1 34 VAL H . 34 . HN 1 1 308 1 1 1 1 33 CYS HB3 . 33 . HB1 1 1 308 1 2 1 1 34 VAL H . 34 . HN 1 1 309 1 1 1 1 33 CYS HB2 . 33 . HB2 1 1 309 1 2 1 1 34 VAL H . 34 . HN 1 1 310 1 1 1 1 33 CYS H . 33 . HN 1 1 310 1 2 1 1 33 CYS HB3 . 33 . HB1 1 1 311 1 1 1 1 33 CYS H . 33 . HN 1 1 311 1 2 1 1 33 CYS HB2 . 33 . HB2 1 1 312 1 1 1 1 33 CYS H . 33 . HN 1 1 312 1 2 1 1 34 VAL H . 34 . HN 1 1 313 1 1 1 1 34 VAL HA . 34 . HA 1 1 313 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 314 1 1 1 1 34 VAL HA . 34 . HA 1 1 314 1 2 1 1 35 GLY H . 35 . HN 1 1 315 1 1 1 1 34 VAL HB . 34 . HB 1 1 315 1 2 1 1 35 GLY H . 35 . HN 1 1 316 1 1 1 1 34 VAL HB . 34 . HB 1 1 316 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 317 1 1 1 1 34 VAL HB . 34 . HB 1 1 317 1 2 1 1 46 TYR QE . 46 . HE# 1 1 318 1 1 1 1 34 VAL MG1 . 34 . HG1# 1 1 318 1 2 1 1 35 GLY H . 35 . HN 1 1 319 1 1 1 1 34 VAL MG1 . 34 . HG1# 1 1 319 1 2 1 1 36 VAL HB . 36 . HB 1 1 320 1 1 1 1 34 VAL MG1 . 34 . HG1# 1 1 320 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 321 1 1 1 1 34 VAL MG1 . 34 . HG1# 1 1 321 1 2 1 1 36 VAL H . 36 . HN 1 1 322 1 1 1 1 34 VAL MG1 . 34 . HG1# 1 1 322 1 2 1 1 46 TYR QD . 46 . HD# 1 1 323 1 1 1 1 34 VAL MG1 . 34 . HG1# 1 1 323 1 2 1 1 46 TYR QE . 46 . HE# 1 1 324 1 1 1 1 34 VAL MG1 . 34 . HG1# 1 1 324 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 325 1 1 1 1 34 VAL MG2 . 34 . HG2# 1 1 325 1 2 1 1 35 GLY H . 35 . HN 1 1 326 1 1 1 1 34 VAL H . 34 . HN 1 1 326 1 2 1 1 34 VAL MG1 . 34 . HG1# 1 1 327 1 1 1 1 34 VAL H . 34 . HN 1 1 327 1 2 1 1 34 VAL MG2 . 34 . HG2# 1 1 328 1 1 1 1 34 VAL H . 34 . HN 1 1 328 1 2 1 1 35 GLY H . 35 . HN 1 1 329 1 1 1 1 35 GLY HA3 . 35 . HA1 1 1 329 1 2 1 1 36 VAL H . 36 . HN 1 1 330 1 1 1 1 35 GLY H . 35 . HN 1 1 330 1 2 1 1 36 VAL HB . 36 . HB 1 1 331 1 1 1 1 35 GLY H . 35 . HN 1 1 331 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 332 1 1 1 1 36 VAL HA . 36 . HA 1 1 332 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 333 1 1 1 1 36 VAL HA . 36 . HA 1 1 333 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 334 1 1 1 1 36 VAL HA . 36 . HA 1 1 334 1 2 1 1 37 SER H . 37 . HN 1 1 335 1 1 1 1 36 VAL HA . 36 . HA 1 1 335 1 2 1 1 40 MET ME . 40 . HE# 1 1 336 1 1 1 1 36 VAL HB . 36 . HB 1 1 336 1 2 1 1 37 SER H . 37 . HN 1 1 337 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 337 1 2 1 1 37 SER H . 37 . HN 1 1 338 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 338 1 2 1 1 40 MET HB3 . 40 . HB1 1 1 339 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 339 1 2 1 1 40 MET HB2 . 40 . HB2 1 1 340 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 340 1 2 1 1 40 MET H . 40 . HN 1 1 341 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 341 1 2 1 1 41 ALA HA . 41 . HA 1 1 342 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 342 1 2 1 1 41 ALA MB . 41 . HB# 1 1 343 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 343 1 2 1 1 41 ALA H . 41 . HN 1 1 344 1 1 1 1 36 VAL MG1 . 36 . HG1# 1 1 344 1 2 1 1 46 TYR QD . 46 . HD# 1 1 345 1 1 1 1 36 VAL MG2 . 36 . HG2# 1 1 345 1 2 1 1 37 SER H . 37 . HN 1 1 346 1 1 1 1 36 VAL MG2 . 36 . HG2# 1 1 346 1 2 1 1 40 MET ME . 40 . HE# 1 1 347 1 1 1 1 36 VAL MG2 . 36 . HG2# 1 1 347 1 2 1 1 46 TYR HB2 . 46 . HB2 1 1 348 1 1 1 1 36 VAL MG2 . 36 . HG2# 1 1 348 1 2 1 1 46 TYR QD . 46 . HD# 1 1 349 1 1 1 1 36 VAL MG2 . 36 . HG2# 1 1 349 1 2 1 1 46 TYR QE . 46 . HE# 1 1 350 1 1 1 1 36 VAL H . 36 . HN 1 1 350 1 2 1 1 36 VAL HB . 36 . HB 1 1 351 1 1 1 1 36 VAL H . 36 . HN 1 1 351 1 2 1 1 36 VAL MG1 . 36 . HG1# 1 1 352 1 1 1 1 36 VAL H . 36 . HN 1 1 352 1 2 1 1 36 VAL MG2 . 36 . HG2# 1 1 353 1 1 1 1 37 SER HA . 37 . HA 1 1 353 1 2 1 1 38 PRO HD3 . 38 . HD1 1 1 354 1 1 1 1 37 SER HA . 37 . HA 1 1 354 1 2 1 1 38 PRO HD2 . 38 . HD2 1 1 355 1 1 1 1 37 SER HA . 37 . HA 1 1 355 1 2 1 1 38 PRO HG2 . 38 . HG2 1 1 356 1 1 1 1 37 SER HA . 37 . HA 1 1 356 1 2 1 1 39 GLU H . 39 . HN 1 1 357 1 1 1 1 37 SER HA . 37 . HA 1 1 357 1 2 1 1 40 MET H . 40 . HN 1 1 358 1 1 1 1 37 SER HB3 . 37 . HB1 1 1 358 1 2 1 1 39 GLU H . 39 . HN 1 1 359 1 1 1 1 37 SER HB3 . 37 . HB1 1 1 359 1 2 1 1 40 MET HB2 . 40 . HB2 1 1 360 1 1 1 1 37 SER HB3 . 37 . HB1 1 1 360 1 2 1 1 40 MET H . 40 . HN 1 1 361 1 1 1 1 37 SER HB2 . 37 . HB2 1 1 361 1 2 1 1 38 PRO HD3 . 38 . HD1 1 1 362 1 1 1 1 37 SER HB2 . 37 . HB2 1 1 362 1 2 1 1 38 PRO HD2 . 38 . HD2 1 1 363 1 1 1 1 37 SER HB2 . 37 . HB2 1 1 363 1 2 1 1 38 PRO HG2 . 38 . HG2 1 1 364 1 1 1 1 37 SER HB2 . 37 . HB2 1 1 364 1 2 1 1 39 GLU H . 39 . HN 1 1 365 1 1 1 1 37 SER HB2 . 37 . HB2 1 1 365 1 2 1 1 40 MET H . 40 . HN 1 1 366 1 1 1 1 37 SER H . 37 . HN 1 1 366 1 2 1 1 37 SER HB3 . 37 . HB1 1 1 367 1 1 1 1 37 SER H . 37 . HN 1 1 367 1 2 1 1 40 MET HB3 . 40 . HB1 1 1 368 1 1 1 1 37 SER H . 37 . HN 1 1 368 1 2 1 1 40 MET HB2 . 40 . HB2 1 1 369 1 1 1 1 37 SER H . 37 . HN 1 1 369 1 2 1 1 40 MET HG2 . 40 . HG2 1 1 370 1 1 1 1 38 PRO HA . 38 . HA 1 1 370 1 2 1 1 39 GLU H . 39 . HN 1 1 371 1 1 1 1 38 PRO HA . 38 . HA 1 1 371 1 2 1 1 40 MET H . 40 . HN 1 1 372 1 1 1 1 38 PRO HA . 38 . HA 1 1 372 1 2 1 1 41 ALA MB . 41 . HB# 1 1 373 1 1 1 1 38 PRO HA . 38 . HA 1 1 373 1 2 1 1 41 ALA H . 41 . HN 1 1 374 1 1 1 1 38 PRO HA . 38 . HA 1 1 374 1 2 1 1 42 GLU H . 42 . HN 1 1 375 1 1 1 1 38 PRO HB3 . 38 . HB1 1 1 375 1 2 1 1 39 GLU H . 39 . HN 1 1 376 1 1 1 1 38 PRO HB2 . 38 . HB2 1 1 376 1 2 1 1 38 PRO HD2 . 38 . HD2 1 1 377 1 1 1 1 38 PRO HB2 . 38 . HB2 1 1 377 1 2 1 1 39 GLU H . 39 . HN 1 1 378 1 1 1 1 38 PRO HD3 . 38 . HD1 1 1 378 1 2 1 1 39 GLU H . 39 . HN 1 1 379 1 1 1 1 38 PRO HD2 . 38 . HD2 1 1 379 1 2 1 1 39 GLU H . 39 . HN 1 1 380 1 1 1 1 38 PRO HA . 38 . HA 1 1 380 1 2 1 1 38 PRO HG2 . 38 . HG2 1 1 381 1 1 1 1 38 PRO HG2 . 38 . HG2 1 1 381 1 2 1 1 39 GLU H . 39 . HN 1 1 382 1 1 1 1 39 GLU HA . 39 . HA 1 1 382 1 2 1 1 39 GLU HG3 . 39 . HG1 1 1 383 1 1 1 1 39 GLU HA . 39 . HA 1 1 383 1 2 1 1 39 GLU HG2 . 39 . HG2 1 1 384 1 1 1 1 39 GLU HA . 39 . HA 1 1 384 1 2 1 1 40 MET H . 40 . HN 1 1 385 1 1 1 1 39 GLU HA . 39 . HA 1 1 385 1 2 1 1 42 GLU HB2 . 42 . HB2 1 1 386 1 1 1 1 39 GLU HA . 39 . HA 1 1 386 1 2 1 1 42 GLU H . 42 . HN 1 1 387 1 1 1 1 39 GLU HA . 39 . HA 1 1 387 1 2 1 1 43 ASN HD21 . 43 . HD21 1 1 388 1 1 1 1 39 GLU HA . 39 . HA 1 1 388 1 2 1 1 43 ASN HD22 . 43 . HD22 1 1 389 1 1 1 1 39 GLU HB3 . 39 . HB1 1 1 389 1 2 1 1 40 MET H . 40 . HN 1 1 390 1 1 1 1 39 GLU HB2 . 39 . HB2 1 1 390 1 2 1 1 40 MET H . 40 . HN 1 1 391 1 1 1 1 39 GLU HG2 . 39 . HG2 1 1 391 1 2 1 1 43 ASN HD21 . 43 . HD21 1 1 392 1 1 1 1 39 GLU H . 39 . HN 1 1 392 1 2 1 1 39 GLU HB3 . 39 . HB1 1 1 393 1 1 1 1 39 GLU H . 39 . HN 1 1 393 1 2 1 1 39 GLU HB2 . 39 . HB2 1 1 394 1 1 1 1 39 GLU H . 39 . HN 1 1 394 1 2 1 1 39 GLU HG3 . 39 . HG1 1 1 395 1 1 1 1 39 GLU H . 39 . HN 1 1 395 1 2 1 1 39 GLU HG2 . 39 . HG2 1 1 396 1 1 1 1 39 GLU H . 39 . HN 1 1 396 1 2 1 1 40 MET H . 40 . HN 1 1 397 1 1 1 1 40 MET HA . 40 . HA 1 1 397 1 2 1 1 40 MET HG2 . 40 . HG2 1 1 398 1 1 1 1 40 MET HA . 40 . HA 1 1 398 1 2 1 1 41 ALA H . 41 . HN 1 1 399 1 1 1 1 40 MET HA . 40 . HA 1 1 399 1 2 1 1 43 ASN HB3 . 43 . HB1 1 1 400 1 1 1 1 40 MET HA . 40 . HA 1 1 400 1 2 1 1 43 ASN HB2 . 43 . HB2 1 1 401 1 1 1 1 40 MET HA . 40 . HA 1 1 401 1 2 1 1 43 ASN H . 43 . HN 1 1 402 1 1 1 1 40 MET HA . 40 . HA 1 1 402 1 2 1 1 44 GLU H . 44 . HN 1 1 403 1 1 1 1 40 MET HB3 . 40 . HB1 1 1 403 1 2 1 1 41 ALA H . 41 . HN 1 1 404 1 1 1 1 40 MET HB2 . 40 . HB2 1 1 404 1 2 1 1 41 ALA H . 41 . HN 1 1 405 1 1 1 1 40 MET ME . 40 . HE# 1 1 405 1 2 1 1 40 MET HG2 . 40 . HG2 1 1 406 1 1 1 1 40 MET HG2 . 40 . HG2 1 1 406 1 2 1 1 41 ALA H . 41 . HN 1 1 407 1 1 1 1 40 MET HG2 . 40 . HG2 1 1 407 1 2 1 1 46 TYR H . 46 . HN 1 1 408 1 1 1 1 40 MET H . 40 . HN 1 1 408 1 2 1 1 40 MET HB3 . 40 . HB1 1 1 409 1 1 1 1 40 MET H . 40 . HN 1 1 409 1 2 1 1 40 MET HB2 . 40 . HB2 1 1 410 1 1 1 1 40 MET H . 40 . HN 1 1 410 1 2 1 1 40 MET HG2 . 40 . HG2 1 1 411 1 1 1 1 40 MET H . 40 . HN 1 1 411 1 2 1 1 41 ALA MB . 41 . HB# 1 1 412 1 1 1 1 40 MET H . 40 . HN 1 1 412 1 2 1 1 41 ALA H . 41 . HN 1 1 413 1 1 1 1 41 ALA HA . 41 . HA 1 1 413 1 2 1 1 42 GLU H . 42 . HN 1 1 414 1 1 1 1 41 ALA MB . 41 . HB# 1 1 414 1 2 1 1 42 GLU H . 42 . HN 1 1 415 1 1 1 1 41 ALA H . 41 . HN 1 1 415 1 2 1 1 41 ALA MB . 41 . HB# 1 1 416 1 1 1 1 41 ALA H . 41 . HN 1 1 416 1 2 1 1 42 GLU H . 42 . HN 1 1 417 1 1 1 1 42 GLU HB2 . 42 . HB2 1 1 417 1 2 1 1 43 ASN HD21 . 43 . HD21 1 1 418 1 1 1 1 42 GLU HB2 . 42 . HB2 1 1 418 1 2 1 1 43 ASN HD22 . 43 . HD22 1 1 419 1 1 1 1 42 GLU H . 42 . HN 1 1 419 1 2 1 1 42 GLU HB2 . 42 . HB2 1 1 420 1 1 1 1 42 GLU H . 42 . HN 1 1 420 1 2 1 1 42 GLU HG2 . 42 . HG2 1 1 421 1 1 1 1 43 ASN HA . 43 . HA 1 1 421 1 2 1 1 43 ASN HD22 . 43 . HD22 1 1 422 1 1 1 1 43 ASN HB3 . 43 . HB1 1 1 422 1 2 1 1 43 ASN HD22 . 43 . HD22 1 1 423 1 1 1 1 43 ASN HB3 . 43 . HB1 1 1 423 1 2 1 1 44 GLU H . 44 . HN 1 1 424 1 1 1 1 43 ASN HB2 . 43 . HB2 1 1 424 1 2 1 1 44 GLU H . 44 . HN 1 1 425 1 1 1 1 43 ASN H . 43 . HN 1 1 425 1 2 1 1 43 ASN HB3 . 43 . HB1 1 1 426 1 1 1 1 43 ASN H . 43 . HN 1 1 426 1 2 1 1 43 ASN HB2 . 43 . HB2 1 1 427 1 1 1 1 43 ASN H . 43 . HN 1 1 427 1 2 1 1 44 GLU H . 44 . HN 1 1 428 1 1 1 1 44 GLU H . 44 . HN 1 1 428 1 2 1 1 44 GLU HG2 . 44 . HG2 1 1 429 1 1 1 1 45 ASP HB3 . 45 . HB1 1 1 429 1 2 1 1 46 TYR H . 46 . HN 1 1 430 1 1 1 1 45 ASP HB2 . 45 . HB2 1 1 430 1 2 1 1 46 TYR H . 46 . HN 1 1 431 1 1 1 1 45 ASP H . 45 . HN 1 1 431 1 2 1 1 46 TYR H . 46 . HN 1 1 432 1 1 1 1 46 TYR HA . 46 . HA 1 1 432 1 2 1 1 46 TYR QD . 46 . HD# 1 1 433 1 1 1 1 46 TYR HA . 46 . HA 1 1 433 1 2 1 1 47 ILE H . 47 . HN 1 1 434 1 1 1 1 46 TYR HB2 . 46 . HB2 1 1 434 1 2 1 1 47 ILE H . 47 . HN 1 1 435 1 1 1 1 46 TYR QD . 46 . HD# 1 1 435 1 2 1 1 47 ILE H . 47 . HN 1 1 436 1 1 1 1 46 TYR QE . 46 . HE# 1 1 436 1 2 1 1 48 CYS HA . 48 . HA 1 1 437 1 1 1 1 46 TYR QE . 46 . HE# 1 1 437 1 2 1 1 48 CYS HB3 . 48 . HB1 1 1 438 1 1 1 1 46 TYR QE . 46 . HE# 1 1 438 1 2 1 1 48 CYS HB2 . 48 . HB2 1 1 439 1 1 1 1 46 TYR H . 46 . HN 1 1 439 1 2 1 1 46 TYR QD . 46 . HD# 1 1 440 1 1 1 1 46 TYR H . 46 . HN 1 1 440 1 2 1 1 47 ILE H . 47 . HN 1 1 441 1 1 1 1 47 ILE HA . 47 . HA 1 1 441 1 2 1 1 47 ILE MD . 47 . HD1# 1 1 442 1 1 1 1 47 ILE HA . 47 . HA 1 1 442 1 2 1 1 47 ILE HG12 . 47 . HG12 1 1 443 1 1 1 1 47 ILE HA . 47 . HA 1 1 443 1 2 1 1 47 ILE MG . 47 . HG2# 1 1 444 1 1 1 1 47 ILE HA . 47 . HA 1 1 444 1 2 1 1 48 CYS H . 48 . HN 1 1 445 1 1 1 1 47 ILE HG13 . 47 . HG11 1 1 445 1 2 1 1 47 ILE MG . 47 . HG2# 1 1 446 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 446 1 2 1 1 48 CYS HA . 48 . HA 1 1 447 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 447 1 2 1 1 48 CYS H . 48 . HN 1 1 448 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 448 1 2 1 1 51 CYS HA . 51 . HA 1 1 449 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 449 1 2 1 1 51 CYS HB3 . 51 . HB1 1 1 450 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 450 1 2 1 1 51 CYS HB2 . 51 . HB2 1 1 451 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 451 1 2 1 1 51 CYS H . 51 . HN 1 1 452 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 452 1 2 1 1 52 ALA HA . 52 . HA 1 1 453 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 453 1 2 1 1 52 ALA MB . 52 . HB# 1 1 454 1 1 1 1 47 ILE MG . 47 . HG2# 1 1 454 1 2 1 1 52 ALA H . 52 . HN 1 1 455 1 1 1 1 47 ILE H . 47 . HN 1 1 455 1 2 1 1 47 ILE HB . 47 . HB 1 1 456 1 1 1 1 47 ILE H . 47 . HN 1 1 456 1 2 1 1 47 ILE MD . 47 . HD1# 1 1 457 1 1 1 1 47 ILE H . 47 . HN 1 1 457 1 2 1 1 47 ILE HG13 . 47 . HG11 1 1 458 1 1 1 1 47 ILE H . 47 . HN 1 1 458 1 2 1 1 47 ILE HG12 . 47 . HG12 1 1 459 1 1 1 1 47 ILE H . 47 . HN 1 1 459 1 2 1 1 47 ILE MG . 47 . HG2# 1 1 460 1 1 1 1 47 ILE H . 47 . HN 1 1 460 1 2 1 1 48 CYS H . 48 . HN 1 1 461 1 1 1 1 48 CYS HA . 48 . HA 1 1 461 1 2 1 1 49 ILE H . 49 . HN 1 1 462 1 1 1 1 48 CYS HA . 48 . HA 1 1 462 1 2 1 1 50 ASN H . 50 . HN 1 1 463 1 1 1 1 48 CYS HB3 . 48 . HB1 1 1 463 1 2 1 1 49 ILE H . 49 . HN 1 1 464 1 1 1 1 48 CYS HB3 . 48 . HB1 1 1 464 1 2 1 1 50 ASN H . 50 . HN 1 1 465 1 1 1 1 48 CYS HB3 . 48 . HB1 1 1 465 1 2 1 1 51 CYS H . 51 . HN 1 1 466 1 1 1 1 48 CYS HB2 . 48 . HB2 1 1 466 1 2 1 1 49 ILE H . 49 . HN 1 1 467 1 1 1 1 48 CYS H . 48 . HN 1 1 467 1 2 1 1 48 CYS HB2 . 48 . HB2 1 1 468 1 1 1 1 48 CYS H . 48 . HN 1 1 468 1 2 1 1 49 ILE H . 49 . HN 1 1 469 1 1 1 1 48 CYS H . 48 . HN 1 1 469 1 2 1 1 51 CYS HB3 . 51 . HB1 1 1 470 1 1 1 1 48 CYS H . 48 . HN 1 1 470 1 2 1 1 51 CYS HB2 . 51 . HB2 1 1 471 1 1 1 1 48 CYS H . 48 . HN 1 1 471 1 2 1 1 51 CYS H . 51 . HN 1 1 472 1 1 1 1 49 ILE HA . 49 . HA 1 1 472 1 2 1 1 49 ILE HB . 49 . HB 1 1 473 1 1 1 1 49 ILE HA . 49 . HA 1 1 473 1 2 1 1 49 ILE MD . 49 . HD1# 1 1 474 1 1 1 1 49 ILE HA . 49 . HA 1 1 474 1 2 1 1 49 ILE HG13 . 49 . HG11 1 1 475 1 1 1 1 49 ILE HA . 49 . HA 1 1 475 1 2 1 1 49 ILE HG12 . 49 . HG12 1 1 476 1 1 1 1 49 ILE HA . 49 . HA 1 1 476 1 2 1 1 50 ASN H . 50 . HN 1 1 477 1 1 1 1 49 ILE HA . 49 . HA 1 1 477 1 2 1 1 51 CYS H . 51 . HN 1 1 478 1 1 1 1 49 ILE HA . 49 . HA 1 1 478 1 2 1 1 52 ALA MB . 52 . HB# 1 1 479 1 1 1 1 49 ILE HA . 49 . HA 1 1 479 1 2 1 1 52 ALA H . 52 . HN 1 1 480 1 1 1 1 49 ILE HB . 49 . HB 1 1 480 1 2 1 1 49 ILE MD . 49 . HD1# 1 1 481 1 1 1 1 49 ILE HB . 49 . HB 1 1 481 1 2 1 1 50 ASN H . 50 . HN 1 1 482 1 1 1 1 49 ILE HG13 . 49 . HG11 1 1 482 1 2 1 1 50 ASN H . 50 . HN 1 1 483 1 1 1 1 49 ILE HG12 . 49 . HG12 1 1 483 1 2 1 1 50 ASN HD21 . 50 . HD21 1 1 484 1 1 1 1 49 ILE HG12 . 49 . HG12 1 1 484 1 2 1 1 50 ASN H . 50 . HN 1 1 485 1 1 1 1 49 ILE MG . 49 . HG2# 1 1 485 1 2 1 1 50 ASN HD21 . 50 . HD21 1 1 486 1 1 1 1 49 ILE MG . 49 . HG2# 1 1 486 1 2 1 1 50 ASN HD22 . 50 . HD22 1 1 487 1 1 1 1 49 ILE MG . 49 . HG2# 1 1 487 1 2 1 1 50 ASN H . 50 . HN 1 1 488 1 1 1 1 49 ILE MG . 49 . HG2# 1 1 488 1 2 1 1 51 CYS H . 51 . HN 1 1 489 1 1 1 1 49 ILE H . 49 . HN 1 1 489 1 2 1 1 49 ILE HB . 49 . HB 1 1 490 1 1 1 1 49 ILE H . 49 . HN 1 1 490 1 2 1 1 49 ILE MD . 49 . HD1# 1 1 491 1 1 1 1 49 ILE H . 49 . HN 1 1 491 1 2 1 1 49 ILE HG13 . 49 . HG11 1 1 492 1 1 1 1 49 ILE H . 49 . HN 1 1 492 1 2 1 1 49 ILE HG12 . 49 . HG12 1 1 493 1 1 1 1 49 ILE H . 49 . HN 1 1 493 1 2 1 1 49 ILE MG . 49 . HG2# 1 1 494 1 1 1 1 49 ILE H . 49 . HN 1 1 494 1 2 1 1 50 ASN H . 50 . HN 1 1 495 1 1 1 1 50 ASN HA . 50 . HA 1 1 495 1 2 1 1 51 CYS H . 51 . HN 1 1 496 1 1 1 1 50 ASN HB3 . 50 . HB1 1 1 496 1 2 1 1 50 ASN HD22 . 50 . HD22 1 1 497 1 1 1 1 50 ASN HB2 . 50 . HB2 1 1 497 1 2 1 1 50 ASN HD22 . 50 . HD22 1 1 498 1 1 1 1 50 ASN H . 50 . HN 1 1 498 1 2 1 1 50 ASN HB3 . 50 . HB1 1 1 499 1 1 1 1 50 ASN H . 50 . HN 1 1 499 1 2 1 1 50 ASN HB2 . 50 . HB2 1 1 500 1 1 1 1 50 ASN H . 50 . HN 1 1 500 1 2 1 1 50 ASN HD21 . 50 . HD21 1 1 501 1 1 1 1 50 ASN H . 50 . HN 1 1 501 1 2 1 1 50 ASN HD22 . 50 . HD22 1 1 502 1 1 1 1 50 ASN H . 50 . HN 1 1 502 1 2 1 1 51 CYS H . 51 . HN 1 1 503 1 1 1 1 50 ASN H . 50 . HN 1 1 503 1 2 1 1 52 ALA H . 52 . HN 1 1 504 1 1 1 1 51 CYS HA . 51 . HA 1 1 504 1 2 1 1 52 ALA H . 52 . HN 1 1 505 1 1 1 1 51 CYS HB3 . 51 . HB1 1 1 505 1 2 1 1 52 ALA H . 52 . HN 1 1 506 1 1 1 1 51 CYS HB2 . 51 . HB2 1 1 506 1 2 1 1 52 ALA H . 52 . HN 1 1 507 1 1 1 1 51 CYS H . 51 . HN 1 1 507 1 2 1 1 51 CYS HB3 . 51 . HB1 1 1 508 1 1 1 1 51 CYS H . 51 . HN 1 1 508 1 2 1 1 51 CYS HB2 . 51 . HB2 1 1 509 1 1 1 1 51 CYS H . 51 . HN 1 1 509 1 2 1 1 52 ALA H . 52 . HN 1 1 510 1 1 1 1 52 ALA H . 52 . HN 1 1 510 1 2 1 1 52 ALA MB . 52 . HB# 1 1 511 1 1 1 1 21 CYS HB2 . 21 . HB2 1 1 511 1 1 1 1 24 GLY HA3 . 24 . HA1 1 1 511 1 2 1 1 26 ASP H . 26 . 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 . . . . . 0.0 0.0 4.92 1 1 2 1 . . . . . 0.0 0.0 3.95 1 1 3 1 . . . . . 0.0 0.0 5.03 1 1 4 1 . . . . . 0.0 0.0 4.88 1 1 5 1 . . . . . 0.0 0.0 4.44 1 1 6 1 . . . . . 0.0 0.0 5.09 1 1 7 1 . . . . . 0.0 0.0 4.44 1 1 8 1 . . . . . 0.0 0.0 4.76 1 1 9 1 . . . . . 0.0 0.0 5.5 1 1 10 1 . . . . . 0.0 0.0 5.5 1 1 11 1 . . . . . 0.0 0.0 4.32 1 1 12 1 . . . . . 0.0 0.0 5.05 1 1 13 1 . . . . . 0.0 0.0 5.15 1 1 14 1 . . . . . 0.0 0.0 4.6 1 1 15 1 . . . . . 0.0 0.0 5.5 1 1 16 1 . . . . . 0.0 0.0 5.5 1 1 17 1 . . . . . 0.0 0.0 5.46 1 1 18 1 . . . . . 0.0 0.0 5.5 1 1 19 1 . . . . . 0.0 0.0 5.22 1 1 20 1 . . . . . 0.0 0.0 5.24 1 1 21 1 . . . . . 0.0 0.0 4.12 1 1 22 1 . . . . . 0.0 0.0 3.66 1 1 23 1 . . . . . 0.0 0.0 5.21 1 1 24 1 . . . . . 0.0 0.0 5.07 1 1 25 1 . . . . . 0.0 0.0 4.05 1 1 26 1 . . . . . 0.0 0.0 4.78 1 1 27 1 . . . . . 0.0 0.0 3.56 1 1 28 1 . . . . . 0.0 0.0 4.95 1 1 29 1 . . . . . 0.0 0.0 3.81 1 1 30 1 . . . . . 0.0 0.0 3.62 1 1 31 1 . . . . . 0.0 0.0 4.5 1 1 32 1 . . . . . 0.0 0.0 4.19 1 1 33 1 . . . . . 0.0 0.0 4.76 1 1 34 1 . . . . . 0.0 0.0 5.22 1 1 35 1 . . . . . 0.0 0.0 5.04 1 1 36 1 . . . . . 0.0 0.0 4.54 1 1 37 1 . . . . . 0.0 0.0 3.59 1 1 38 1 . . . . . 0.0 0.0 5.31 1 1 39 1 . . . . . 0.0 0.0 4.43 1 1 40 1 . . . . . 0.0 0.0 4.42 1 1 41 1 . . . . . 0.0 0.0 3.84 1 1 42 1 . . . . . 0.0 0.0 4.81 1 1 43 1 . . . . . 0.0 0.0 4.53 1 1 44 1 . . . . . 0.0 0.0 4.69 1 1 45 1 . . . . . 0.0 0.0 5.2 1 1 46 1 . . . . . 0.0 0.0 3.45 1 1 47 1 . . . . . 0.0 0.0 4.5 1 1 48 1 . . . . . 0.0 0.0 4.38 1 1 49 1 . . . . . 0.0 0.0 5.31 1 1 50 1 . . . . . 0.0 0.0 5.48 1 1 51 1 . . . . . 0.0 0.0 4.36 1 1 52 1 . . . . . 0.0 0.0 5.5 1 1 53 1 . . . . . 0.0 0.0 5.18 1 1 54 1 . . . . . 0.0 0.0 5.5 1 1 55 1 . . . . . 0.0 0.0 4.08 1 1 56 1 . . . . . 0.0 0.0 4.71 1 1 57 1 . . . . . 0.0 0.0 4.78 1 1 58 1 . . . . . 0.0 0.0 4.23 1 1 59 1 . . . . . 0.0 0.0 4.89 1 1 60 1 . . . . . 0.0 0.0 4.78 1 1 61 1 . . . . . 0.0 0.0 4.14 1 1 62 1 . . . . . 0.0 0.0 3.29 1 1 63 1 . . . . . 0.0 0.0 5.5 1 1 64 1 . . . . . 0.0 0.0 5.1 1 1 65 1 . . . . . 0.0 0.0 4.38 1 1 66 1 . . . . . 0.0 0.0 4.06 1 1 67 1 . . . . . 0.0 0.0 5.5 1 1 68 1 . . . . . 0.0 0.0 3.94 1 1 69 1 . . . . . 0.0 0.0 5.2 1 1 70 1 . . . . . 0.0 0.0 5.5 1 1 71 1 . . . . . 0.0 0.0 4.89 1 1 72 1 . . . . . 0.0 0.0 4.83 1 1 73 1 . . . . . 0.0 0.0 4.56 1 1 74 1 . . . . . 0.0 0.0 5.28 1 1 75 1 . . . . . 0.0 0.0 5.1 1 1 76 1 . . . . . 0.0 0.0 5.5 1 1 77 1 . . . . . 0.0 0.0 4.36 1 1 78 1 . . . . . 0.0 0.0 4.97 1 1 79 1 . . . . . 0.0 0.0 4.21 1 1 80 1 . . . . . 0.0 0.0 4.23 1 1 81 1 . . . . . 0.0 0.0 4.15 1 1 82 1 . . . . . 0.0 0.0 4.37 1 1 83 1 . . . . . 0.0 0.0 5.46 1 1 84 1 . . . . . 0.0 0.0 5.5 1 1 85 1 . . . . . 0.0 0.0 5.36 1 1 86 1 . . . . . 0.0 0.0 4.29 1 1 87 1 . . . . . 0.0 0.0 4.42 1 1 88 1 . . . . . 0.0 0.0 4.28 1 1 89 1 . . . . . 0.0 0.0 5.42 1 1 90 1 . . . . . 0.0 0.0 4.11 1 1 91 1 . . . . . 0.0 0.0 4.1 1 1 92 1 . . . . . 0.0 0.0 5.24 1 1 93 1 . . . . . 0.0 0.0 4.46 1 1 94 1 . . . . . 0.0 0.0 4.72 1 1 95 1 . . . . . 0.0 0.0 5.5 1 1 96 1 . . . . . 0.0 0.0 4.78 1 1 97 1 . . . . . 0.0 0.0 5.11 1 1 98 1 . . . . . 0.0 0.0 5.5 1 1 99 1 . . . . . 0.0 0.0 5.5 1 1 100 1 . . . . . 0.0 0.0 5.04 1 1 101 1 . . . . . 0.0 0.0 4.85 1 1 102 1 . . . . . 0.0 0.0 5.31 1 1 103 1 . . . . . 0.0 0.0 4.1 1 1 104 1 . . . . . 0.0 0.0 4.19 1 1 105 1 . . . . . 0.0 0.0 4.53 1 1 106 1 . . . . . 0.0 0.0 5.19 1 1 107 1 . . . . . 0.0 0.0 4.92 1 1 108 1 . . . . . 0.0 0.0 5.5 1 1 109 1 . . . . . 0.0 0.0 3.97 1 1 110 1 . . . . . 0.0 0.0 5.5 1 1 111 1 . . . . . 0.0 0.0 3.67 1 1 112 1 . . . . . 0.0 0.0 5.05 1 1 113 1 . . . . . 0.0 0.0 5.46 1 1 114 1 . . . . . 0.0 0.0 4.77 1 1 115 1 . . . . . 0.0 0.0 5.2 1 1 116 1 . . . . . 0.0 0.0 5.16 1 1 117 1 . . . . . 0.0 0.0 5.36 1 1 118 1 . . . . . 0.0 0.0 4.53 1 1 119 1 . . . . . 0.0 0.0 5.5 1 1 120 1 . . . . . 0.0 0.0 5.5 1 1 121 1 . . . . . 0.0 0.0 4.43 1 1 122 1 . . . . . 0.0 0.0 5.5 1 1 123 1 . . . . . 0.0 0.0 4.2 1 1 124 1 . . . . . 0.0 0.0 5.07 1 1 125 1 . . . . . 0.0 0.0 4.53 1 1 126 1 . . . . . 0.0 0.0 5.37 1 1 127 1 . . . . . 0.0 0.0 5.0 1 1 128 1 . . . . . 0.0 0.0 3.54 1 1 129 1 . . . . . 0.0 0.0 4.01 1 1 130 1 . . . . . 0.0 0.0 4.61 1 1 131 1 . . . . . 0.0 0.0 5.5 1 1 132 1 . . . . . 0.0 0.0 4.57 1 1 133 1 . . . . . 0.0 0.0 5.5 1 1 134 1 . . . . . 0.0 0.0 4.67 1 1 135 1 . . . . . 0.0 0.0 4.13 1 1 136 1 . . . . . 0.0 0.0 5.24 1 1 137 1 . . . . . 0.0 0.0 5.14 1 1 138 1 . . . . . 0.0 0.0 4.36 1 1 139 1 . . . . . 0.0 0.0 5.14 1 1 140 1 . . . . . 0.0 0.0 4.11 1 1 141 1 . . . . . 0.0 0.0 5.5 1 1 142 1 . . . . . 0.0 0.0 5.44 1 1 143 1 . . . . . 0.0 0.0 5.5 1 1 144 1 . . . . . 0.0 0.0 5.35 1 1 145 1 . . . . . 0.0 0.0 5.5 1 1 146 1 . . . . . 0.0 0.0 5.33 1 1 147 1 . . . . . 0.0 0.0 4.61 1 1 148 1 . . . . . 0.0 0.0 5.32 1 1 149 1 . . . . . 0.0 0.0 4.25 1 1 150 1 . . . . . 0.0 0.0 3.97 1 1 151 1 . . . . . 0.0 0.0 5.5 1 1 152 1 . . . . . 0.0 0.0 5.2 1 1 153 1 . . . . . 0.0 0.0 5.22 1 1 154 1 . . . . . 0.0 0.0 3.88 1 1 155 1 . . . . . 0.0 0.0 4.28 1 1 156 1 . . . . . 0.0 0.0 5.05 1 1 157 1 . . . . . 0.0 0.0 4.79 1 1 158 1 . . . . . 0.0 0.0 3.89 1 1 159 1 . . . . . 0.0 0.0 5.18 1 1 160 1 . . . . . 0.0 0.0 5.5 1 1 161 1 . . . . . 0.0 0.0 4.97 1 1 162 1 . . . . . 0.0 0.0 2.3 1 1 163 1 . . . . . 0.0 0.0 5.5 1 1 164 1 . . . . . 0.0 0.0 2.3 1 1 165 1 . . . . . 0.0 0.0 4.17 1 1 166 1 . . . . . 0.0 0.0 4.03 1 1 167 1 . . . . . 0.0 0.0 5.5 1 1 168 1 . . . . . 0.0 0.0 5.41 1 1 169 1 . . . . . 0.0 0.0 5.46 1 1 170 1 . . . . . 0.0 0.0 4.71 1 1 171 1 . . . . . 0.0 0.0 5.33 1 1 172 1 . . . . . 0.0 0.0 4.76 1 1 173 1 . . . . . 0.0 0.0 4.59 1 1 174 1 . . . . . 0.0 0.0 5.13 1 1 175 1 . . . . . 0.0 0.0 5.49 1 1 176 1 . . . . . 0.0 0.0 4.72 1 1 177 1 . . . . . 0.0 0.0 5.47 1 1 178 1 . . . . . 0.0 0.0 5.18 1 1 179 1 . . . . . 0.0 0.0 5.5 1 1 180 1 . . . . . 0.0 0.0 3.93 1 1 181 1 . . . . . 0.0 0.0 5.45 1 1 182 1 . . . . . 0.0 0.0 3.72 1 1 183 1 . . . . . 0.0 0.0 4.9 1 1 184 1 . . . . . 0.0 0.0 5.07 1 1 185 1 . . . . . 0.0 0.0 5.33 1 1 186 1 . . . . . 0.0 0.0 4.23 1 1 187 1 . . . . . 0.0 0.0 5.5 1 1 188 1 . . . . . 0.0 0.0 4.2 1 1 189 1 . . . . . 0.0 0.0 4.15 1 1 190 1 . . . . . 0.0 0.0 5.44 1 1 191 1 . . . . . 0.0 0.0 5.39 1 1 192 1 . . . . . 0.0 0.0 4.68 1 1 193 1 . . . . . 0.0 0.0 5.49 1 1 194 1 . . . . . 0.0 0.0 5.41 1 1 195 1 . . . . . 0.0 0.0 3.94 1 1 196 1 . . . . . 0.0 0.0 4.11 1 1 197 1 . . . . . 0.0 0.0 3.91 1 1 198 1 . . . . . 0.0 0.0 3.76 1 1 199 1 . . . . . 0.0 0.0 4.34 1 1 200 1 . . . . . 0.0 0.0 4.61 1 1 201 1 . . . . . 0.0 0.0 5.42 1 1 202 1 . . . . . 0.0 0.0 4.7 1 1 203 1 . . . . . 0.0 0.0 5.5 1 1 204 1 . . . . . 0.0 0.0 4.34 1 1 205 1 . . . . . 0.0 0.0 3.76 1 1 206 1 . . . . . 0.0 0.0 4.66 1 1 207 1 . . . . . 0.0 0.0 5.5 1 1 208 1 . . . . . 0.0 0.0 4.71 1 1 209 1 . . . . . 0.0 0.0 5.18 1 1 210 1 . . . . . 0.0 0.0 3.74 1 1 211 1 . . . . . 0.0 0.0 4.38 1 1 212 1 . . . . . 0.0 0.0 3.74 1 1 213 1 . . . . . 0.0 0.0 5.5 1 1 214 1 . . . . . 0.0 0.0 4.82 1 1 215 1 . . . . . 0.0 0.0 5.5 1 1 216 1 . . . . . 0.0 0.0 4.49 1 1 217 1 . . . . . 0.0 0.0 3.76 1 1 218 1 . . . . . 0.0 0.0 4.65 1 1 219 1 . . . . . 0.0 0.0 3.31 1 1 220 1 . . . . . 0.0 0.0 5.02 1 1 221 1 . . . . . 0.0 0.0 5.14 1 1 222 1 . . . . . 0.0 0.0 4.48 1 1 223 1 . . . . . 0.0 0.0 4.17 1 1 224 1 . . . . . 0.0 0.0 5.23 1 1 225 1 . . . . . 0.0 0.0 4.89 1 1 226 1 . . . . . 0.0 0.0 5.5 1 1 227 1 . . . . . 0.0 0.0 4.04 1 1 228 1 . . . . . 0.0 0.0 4.82 1 1 229 1 . . . . . 0.0 0.0 4.43 1 1 230 1 . . . . . 0.0 0.0 5.43 1 1 231 1 . . . . . 0.0 0.0 5.5 1 1 232 1 . . . . . 0.0 0.0 4.18 1 1 233 1 . . . . . 0.0 0.0 4.28 1 1 234 1 . . . . . 0.0 0.0 5.15 1 1 235 1 . . . . . 0.0 0.0 5.5 1 1 236 1 . . . . . 0.0 0.0 4.34 1 1 237 1 . . . . . 0.0 0.0 5.08 1 1 238 1 . . . . . 0.0 0.0 3.76 1 1 239 1 . . . . . 0.0 0.0 4.11 1 1 240 1 . . . . . 0.0 0.0 3.99 1 1 241 1 . . . . . 0.0 0.0 3.78 1 1 242 1 . . . . . 0.0 0.0 5.06 1 1 243 1 . . . . . 0.0 0.0 4.21 1 1 244 1 . . . . . 0.0 0.0 4.45 1 1 245 1 . . . . . 0.0 0.0 5.33 1 1 246 1 . . . . . 0.0 0.0 3.81 1 1 247 1 . . . . . 0.0 0.0 4.36 1 1 248 1 . . . . . 0.0 0.0 4.23 1 1 249 1 . . . . . 0.0 0.0 4.63 1 1 250 1 . . . . . 0.0 0.0 4.69 1 1 251 1 . . . . . 0.0 0.0 4.8 1 1 252 1 . . . . . 0.0 0.0 4.53 1 1 253 1 . . . . . 0.0 0.0 5.28 1 1 254 1 . . . . . 0.0 0.0 5.03 1 1 255 1 . . . . . 0.0 0.0 4.48 1 1 256 1 . . . . . 0.0 0.0 4.51 1 1 257 1 . . . . . 0.0 0.0 4.28 1 1 258 1 . . . . . 0.0 0.0 5.5 1 1 259 1 . . . . . 0.0 0.0 5.5 1 1 260 1 . . . . . 0.0 0.0 4.74 1 1 261 1 . . . . . 0.0 0.0 5.01 1 1 262 1 . . . . . 0.0 0.0 5.31 1 1 263 1 . . . . . 0.0 0.0 4.85 1 1 264 1 . . . . . 0.0 0.0 5.32 1 1 265 1 . . . . . 0.0 0.0 5.5 1 1 266 1 . . . . . 0.0 0.0 5.5 1 1 267 1 . . . . . 0.0 0.0 5.5 1 1 268 1 . . . . . 0.0 0.0 3.96 1 1 269 1 . . . . . 0.0 0.0 3.7 1 1 270 1 . . . . . 0.0 0.0 5.03 1 1 271 1 . . . . . 0.0 0.0 3.63 1 1 272 1 . . . . . 0.0 0.0 4.92 1 1 273 1 . . . . . 0.0 0.0 3.73 1 1 274 1 . . . . . 0.0 0.0 4.58 1 1 275 1 . . . . . 0.0 0.0 4.21 1 1 276 1 . . . . . 0.0 0.0 4.77 1 1 277 1 . . . . . 0.0 0.0 4.85 1 1 278 1 . . . . . 0.0 0.0 4.83 1 1 279 1 . . . . . 0.0 0.0 4.88 1 1 280 1 . . . . . 0.0 0.0 5.04 1 1 281 1 . . . . . 0.0 0.0 4.31 1 1 282 1 . . . . . 0.0 0.0 4.27 1 1 283 1 . . . . . 0.0 0.0 5.36 1 1 284 1 . . . . . 0.0 0.0 4.41 1 1 285 1 . . . . . 0.0 0.0 3.91 1 1 286 1 . . . . . 0.0 0.0 4.05 1 1 287 1 . . . . . 0.0 0.0 5.5 1 1 288 1 . . . . . 0.0 0.0 4.33 1 1 289 1 . . . . . 0.0 0.0 5.5 1 1 290 1 . . . . . 0.0 0.0 3.9 1 1 291 1 . . . . . 0.0 0.0 4.9 1 1 292 1 . . . . . 0.0 0.0 5.5 1 1 293 1 . . . . . 0.0 0.0 4.31 1 1 294 1 . . . . . 0.0 0.0 4.88 1 1 295 1 . . . . . 0.0 0.0 3.7 1 1 296 1 . . . . . 0.0 0.0 5.15 1 1 297 1 . . . . . 0.0 0.0 4.65 1 1 298 1 . . . . . 0.0 0.0 5.04 1 1 299 1 . . . . . 0.0 0.0 5.2 1 1 300 1 . . . . . 0.0 0.0 3.93 1 1 301 1 . . . . . 0.0 0.0 5.6 1 1 302 1 . . . . . 0.0 0.0 4.03 1 1 303 1 . . . . . 0.0 0.0 3.97 1 1 304 1 . . . . . 0.0 0.0 3.59 1 1 305 1 . . . . . 0.0 0.0 4.4 1 1 306 1 . . . . . 0.0 0.0 5.5 1 1 307 1 . . . . . 0.0 0.0 4.56 1 1 308 1 . . . . . 0.0 0.0 4.31 1 1 309 1 . . . . . 0.0 0.0 4.79 1 1 310 1 . . . . . 0.0 0.0 3.91 1 1 311 1 . . . . . 0.0 0.0 4.34 1 1 312 1 . . . . . 0.0 0.0 3.89 1 1 313 1 . . . . . 0.0 0.0 3.22 1 1 314 1 . . . . . 0.0 0.0 4.28 1 1 315 1 . . . . . 0.0 0.0 5.21 1 1 316 1 . . . . . 0.0 0.0 4.76 1 1 317 1 . . . . . 0.0 0.0 4.92 1 1 318 1 . . . . . 0.0 0.0 4.36 1 1 319 1 . . . . . 0.0 0.0 3.89 1 1 320 1 . . . . . 0.0 0.0 3.22 1 1 321 1 . . . . . 0.0 0.0 4.02 1 1 322 1 . . . . . 0.0 0.0 5.5 1 1 323 1 . . . . . 0.0 0.0 5.11 1 1 324 1 . . . . . 0.0 0.0 3.04 1 1 325 1 . . . . . 0.0 0.0 5.5 1 1 326 1 . . . . . 0.0 0.0 3.52 1 1 327 1 . . . . . 0.0 0.0 4.23 1 1 328 1 . . . . . 0.0 0.0 3.48 1 1 329 1 . . . . . 0.0 0.0 4.27 1 1 330 1 . . . . . 0.0 0.0 5.5 1 1 331 1 . . . . . 0.0 0.0 5.09 1 1 332 1 . . . . . 0.0 0.0 3.5 1 1 333 1 . . . . . 0.0 0.0 3.46 1 1 334 1 . . . . . 0.0 0.0 3.09 1 1 335 1 . . . . . 0.0 0.0 3.76 1 1 336 1 . . . . . 0.0 0.0 4.67 1 1 337 1 . . . . . 0.0 0.0 4.07 1 1 338 1 . . . . . 0.0 0.0 4.23 1 1 339 1 . . . . . 0.0 0.0 3.56 1 1 340 1 . . . . . 0.0 0.0 5.04 1 1 341 1 . . . . . 0.0 0.0 4.16 1 1 342 1 . . . . . 0.0 0.0 3.8 1 1 343 1 . . . . . 0.0 0.0 4.08 1 1 344 1 . . . . . 0.0 0.0 5.15 1 1 345 1 . . . . . 0.0 0.0 4.97 1 1 346 1 . . . . . 0.0 0.0 3.73 1 1 347 1 . . . . . 0.0 0.0 4.62 1 1 348 1 . . . . . 0.0 0.0 4.0 1 1 349 1 . . . . . 0.0 0.0 4.59 1 1 350 1 . . . . . 0.0 0.0 3.56 1 1 351 1 . . . . . 0.0 0.0 4.41 1 1 352 1 . . . . . 0.0 0.0 3.75 1 1 353 1 . . . . . 0.0 0.0 3.26 1 1 354 1 . . . . . 0.0 0.0 3.4 1 1 355 1 . . . . . 0.0 0.0 4.66 1 1 356 1 . . . . . 0.0 0.0 4.43 1 1 357 1 . . . . . 0.0 0.0 4.84 1 1 358 1 . . . . . 0.0 0.0 5.03 1 1 359 1 . . . . . 0.0 0.0 4.79 1 1 360 1 . . . . . 0.0 0.0 5.12 1 1 361 1 . . . . . 0.0 0.0 3.82 1 1 362 1 . . . . . 0.0 0.0 3.45 1 1 363 1 . . . . . 0.0 0.0 4.81 1 1 364 1 . . . . . 0.0 0.0 4.08 1 1 365 1 . . . . . 0.0 0.0 4.7 1 1 366 1 . . . . . 0.0 0.0 3.92 1 1 367 1 . . . . . 0.0 0.0 4.43 1 1 368 1 . . . . . 0.0 0.0 3.78 1 1 369 1 . . . . . 0.0 0.0 4.91 1 1 370 1 . . . . . 0.0 0.0 4.84 1 1 371 1 . . . . . 0.0 0.0 5.4 1 1 372 1 . . . . . 0.0 0.0 3.71 1 1 373 1 . . . . . 0.0 0.0 4.31 1 1 374 1 . . . . . 0.0 0.0 5.43 1 1 375 1 . . . . . 0.0 0.0 4.57 1 1 376 1 . . . . . 0.0 0.0 4.15 1 1 377 1 . . . . . 0.0 0.0 4.19 1 1 378 1 . . . . . 0.0 0.0 4.95 1 1 379 1 . . . . . 0.0 0.0 4.04 1 1 380 1 . . . . . 0.0 0.0 3.78 1 1 381 1 . . . . . 0.0 0.0 4.78 1 1 382 1 . . . . . 0.0 0.0 4.27 1 1 383 1 . . . . . 0.0 0.0 3.77 1 1 384 1 . . . . . 0.0 0.0 3.64 1 1 385 1 . . . . . 0.0 0.0 4.73 1 1 386 1 . . . . . 0.0 0.0 4.27 1 1 387 1 . . . . . 0.0 0.0 5.5 1 1 388 1 . . . . . 0.0 0.0 5.03 1 1 389 1 . . . . . 0.0 0.0 3.81 1 1 390 1 . . . . . 0.0 0.0 4.43 1 1 391 1 . . . . . 0.0 0.0 5.5 1 1 392 1 . . . . . 0.0 0.0 3.29 1 1 393 1 . . . . . 0.0 0.0 3.93 1 1 394 1 . . . . . 0.0 0.0 4.87 1 1 395 1 . . . . . 0.0 0.0 4.38 1 1 396 1 . . . . . 0.0 0.0 3.58 1 1 397 1 . . . . . 0.0 0.0 3.67 1 1 398 1 . . . . . 0.0 0.0 4.16 1 1 399 1 . . . . . 0.0 0.0 4.97 1 1 400 1 . . . . . 0.0 0.0 4.57 1 1 401 1 . . . . . 0.0 0.0 4.44 1 1 402 1 . . . . . 0.0 0.0 5.11 1 1 403 1 . . . . . 0.0 0.0 4.48 1 1 404 1 . . . . . 0.0 0.0 3.71 1 1 405 1 . . . . . 0.0 0.0 3.85 1 1 406 1 . . . . . 0.0 0.0 5.06 1 1 407 1 . . . . . 0.0 0.0 5.06 1 1 408 1 . . . . . 0.0 0.0 4.1 1 1 409 1 . . . . . 0.0 0.0 3.32 1 1 410 1 . . . . . 0.0 0.0 4.46 1 1 411 1 . . . . . 0.0 0.0 5.13 1 1 412 1 . . . . . 0.0 0.0 3.48 1 1 413 1 . . . . . 0.0 0.0 3.98 1 1 414 1 . . . . . 0.0 0.0 3.84 1 1 415 1 . . . . . 0.0 0.0 3.21 1 1 416 1 . . . . . 0.0 0.0 3.9 1 1 417 1 . . . . . 0.0 0.0 5.3 1 1 418 1 . . . . . 0.0 0.0 5.19 1 1 419 1 . . . . . 0.0 0.0 3.46 1 1 420 1 . . . . . 0.0 0.0 4.53 1 1 421 1 . . . . . 0.0 0.0 5.5 1 1 422 1 . . . . . 0.0 0.0 3.85 1 1 423 1 . . . . . 0.0 0.0 4.85 1 1 424 1 . . . . . 0.0 0.0 4.89 1 1 425 1 . . . . . 0.0 0.0 3.59 1 1 426 1 . . . . . 0.0 0.0 3.57 1 1 427 1 . . . . . 0.0 0.0 3.51 1 1 428 1 . . . . . 0.0 0.0 5.25 1 1 429 1 . . . . . 0.0 0.0 4.47 1 1 430 1 . . . . . 0.0 0.0 5.5 1 1 431 1 . . . . . 0.0 0.0 5.5 1 1 432 1 . . . . . 0.0 0.0 3.63 1 1 433 1 . . . . . 0.0 0.0 3.13 1 1 434 1 . . . . . 0.0 0.0 4.9 1 1 435 1 . . . . . 0.0 0.0 5.5 1 1 436 1 . . . . . 0.0 0.0 4.62 1 1 437 1 . . . . . 0.0 0.0 5.0 1 1 438 1 . . . . . 0.0 0.0 4.89 1 1 439 1 . . . . . 0.0 0.0 5.5 1 1 440 1 . . . . . 0.0 0.0 5.5 1 1 441 1 . . . . . 0.0 0.0 3.79 1 1 442 1 . . . . . 0.0 0.0 4.41 1 1 443 1 . . . . . 0.0 0.0 3.56 1 1 444 1 . . . . . 0.0 0.0 3.43 1 1 445 1 . . . . . 0.0 0.0 3.3 1 1 446 1 . . . . . 0.0 0.0 5.1 1 1 447 1 . . . . . 0.0 0.0 4.09 1 1 448 1 . . . . . 0.0 0.0 4.87 1 1 449 1 . . . . . 0.0 0.0 3.79 1 1 450 1 . . . . . 0.0 0.0 3.61 1 1 451 1 . . . . . 0.0 0.0 4.62 1 1 452 1 . . . . . 0.0 0.0 3.38 1 1 453 1 . . . . . 0.0 0.0 3.33 1 1 454 1 . . . . . 0.0 0.0 4.07 1 1 455 1 . . . . . 0.0 0.0 3.81 1 1 456 1 . . . . . 0.0 0.0 4.75 1 1 457 1 . . . . . 0.0 0.0 4.81 1 1 458 1 . . . . . 0.0 0.0 4.25 1 1 459 1 . . . . . 0.0 0.0 4.6 1 1 460 1 . . . . . 0.0 0.0 5.32 1 1 461 1 . . . . . 0.0 0.0 3.27 1 1 462 1 . . . . . 0.0 0.0 5.11 1 1 463 1 . . . . . 0.0 0.0 3.63 1 1 464 1 . . . . . 0.0 0.0 4.87 1 1 465 1 . . . . . 0.0 0.0 5.49 1 1 466 1 . . . . . 0.0 0.0 4.4 1 1 467 1 . . . . . 0.0 0.0 3.87 1 1 468 1 . . . . . 0.0 0.0 5.5 1 1 469 1 . . . . . 0.0 0.0 5.5 1 1 470 1 . . . . . 0.0 0.0 4.85 1 1 471 1 . . . . . 0.0 0.0 5.44 1 1 472 1 . . . . . 0.0 0.0 3.13 1 1 473 1 . . . . . 0.0 0.0 4.33 1 1 474 1 . . . . . 0.0 0.0 3.63 1 1 475 1 . . . . . 0.0 0.0 3.85 1 1 476 1 . . . . . 0.0 0.0 4.63 1 1 477 1 . . . . . 0.0 0.0 5.15 1 1 478 1 . . . . . 0.0 0.0 3.87 1 1 479 1 . . . . . 0.0 0.0 4.55 1 1 480 1 . . . . . 0.0 0.0 3.63 1 1 481 1 . . . . . 0.0 0.0 5.22 1 1 482 1 . . . . . 0.0 0.0 5.04 1 1 483 1 . . . . . 0.0 0.0 5.5 1 1 484 1 . . . . . 0.0 0.0 4.68 1 1 485 1 . . . . . 0.0 0.0 5.4 1 1 486 1 . . . . . 0.0 0.0 5.5 1 1 487 1 . . . . . 0.0 0.0 4.08 1 1 488 1 . . . . . 0.0 0.0 5.48 1 1 489 1 . . . . . 0.0 0.0 3.58 1 1 490 1 . . . . . 0.0 0.0 5.38 1 1 491 1 . . . . . 0.0 0.0 4.37 1 1 492 1 . . . . . 0.0 0.0 4.36 1 1 493 1 . . . . . 0.0 0.0 3.33 1 1 494 1 . . . . . 0.0 0.0 4.1 1 1 495 1 . . . . . 0.0 0.0 5.1 1 1 496 1 . . . . . 0.0 0.0 4.02 1 1 497 1 . . . . . 0.0 0.0 4.04 1 1 498 1 . . . . . 0.0 0.0 3.68 1 1 499 1 . . . . . 0.0 0.0 4.25 1 1 500 1 . . . . . 0.0 0.0 5.5 1 1 501 1 . . . . . 0.0 0.0 4.99 1 1 502 1 . . . . . 0.0 0.0 3.31 1 1 503 1 . . . . . 0.0 0.0 4.69 1 1 504 1 . . . . . 0.0 0.0 4.52 1 1 505 1 . . . . . 0.0 0.0 4.84 1 1 506 1 . . . . . 0.0 0.0 4.42 1 1 507 1 . . . . . 0.0 0.0 3.84 1 1 508 1 . . . . . 0.0 0.0 3.51 1 1 509 1 . . . . . 0.0 0.0 3.48 1 1 510 1 . . . . . 0.0 0.0 3.17 1 1 511 1 . . . . . 0.0 0.0 5.35 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 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 19 VAL N . 19 . N 1 2 1 1 2 1 1 29 PHE O . 29 . O 1 2 2 1 1 1 1 19 VAL O . 19 . O 1 2 2 1 2 1 1 29 PHE N . 29 . N 1 2 3 1 1 1 1 21 CYS H . 21 . HN 1 2 3 1 2 1 1 27 GLU O . 27 . O 1 2 4 1 1 1 1 21 CYS N . 21 . N 1 2 4 1 2 1 1 27 GLU O . 27 . O 1 2 5 1 1 1 1 30 HIS O . 30 . O 1 2 5 1 2 1 1 34 VAL H . 34 . HN 1 2 6 1 1 1 1 30 HIS O . 30 . O 1 2 6 1 2 1 1 34 VAL N . 34 . N 1 2 7 1 1 1 1 37 SER O . 37 . O 1 2 7 1 2 1 1 41 ALA H . 41 . HN 1 2 8 1 1 1 1 37 SER O . 37 . O 1 2 8 1 2 1 1 41 ALA N . 41 . N 1 2 9 1 1 1 1 39 GLU O . 39 . O 1 2 9 1 2 1 1 43 ASN H . 43 . HN 1 2 10 1 1 1 1 39 GLU O . 39 . O 1 2 10 1 2 1 1 43 ASN N . 43 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 0.0 0.0 3.3 1 2 2 1 . . . . . 0.0 0.0 3.3 1 2 3 1 . . . . . 0.0 0.0 2.3 1 2 4 1 . . . . . 0.0 0.0 3.3 1 2 5 1 . . . . . 0.0 0.0 2.3 1 2 6 1 . . . . . 0.0 0.0 3.3 1 2 7 1 . . . . . 0.0 0.0 2.3 1 2 8 1 . . . . . 0.0 0.0 3.3 1 2 9 1 . . . . . 0.0 0.0 2.3 1 2 10 1 . . . . . 0.0 0.0 3.3 1 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 SER C 1 1 2 VAL N 1 1 2 VAL CA 1 1 2 VAL C -130.8 -99.74 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 VAL N 1 1 2 VAL CA 1 1 2 VAL C 1 1 3 CYS N 116.7 139.47 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 3 . 1 1 2 VAL C 1 1 3 CYS N 1 1 3 CYS CA 1 1 3 CYS C -143.5 -79.59999 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 4 . 1 1 3 CYS N 1 1 3 CYS CA 1 1 3 CYS C 1 1 4 ALA N 112.44 187.11 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1 5 . 1 1 3 CYS C 1 1 4 ALA N 1 1 4 ALA CA 1 1 4 ALA C -148.4 -39.91 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 6 . 1 1 4 ALA N 1 1 4 ALA CA 1 1 4 ALA C 1 1 5 ALA N 120.53 170.65 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 7 . 1 1 5 ALA C 1 1 6 GLN N 1 1 6 GLN CA 1 1 6 GLN C -85.42 -49.75 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 8 . 1 1 6 GLN N 1 1 6 GLN CA 1 1 6 GLN C 1 1 7 ASN N -42.4 -17.2 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 9 . 1 1 11 PRO N 1 1 11 PRO CA 1 1 11 PRO C 1 1 12 CYS N 132.78 158.1 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 10 . 1 1 17 ASP C 1 1 18 TRP N 1 1 18 TRP CA 1 1 18 TRP C -160.1 -96.3 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 11 . 1 1 18 TRP N 1 1 18 TRP CA 1 1 18 TRP C 1 1 19 VAL N 121.479996 158.53 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 12 . 1 1 18 TRP C 1 1 19 VAL N 1 1 19 VAL CA 1 1 19 VAL C -147.19998 -117.6 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 13 . 1 1 19 VAL N 1 1 19 VAL CA 1 1 19 VAL C 1 1 20 GLN N 106.91 144.05 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 14 . 1 1 19 VAL C 1 1 20 GLN N 1 1 20 GLN CA 1 1 20 GLN C -132.9 -77.36 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 15 . 1 1 20 GLN N 1 1 20 GLN CA 1 1 20 GLN C 1 1 21 CYS N 110.62 137.98 . 20 . N . 20 . CA . 20 . C . 21 . N 1 1 16 . 1 1 21 CYS C 1 1 22 ASP N 1 1 22 ASP CA 1 1 22 ASP C -135.1 -51.89 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 17 . 1 1 27 GLU C 1 1 28 TRP N 1 1 28 TRP CA 1 1 28 TRP C -136.7 -74.08999 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 18 . 1 1 28 TRP N 1 1 28 TRP CA 1 1 28 TRP C 1 1 29 PHE N 105.85 188.57 . 28 . N . 28 . CA . 28 . C . 29 . N 1 1 19 . 1 1 28 TRP C 1 1 29 PHE N 1 1 29 PHE CA 1 1 29 PHE C -158.4 -86.22 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1 20 . 1 1 29 PHE N 1 1 29 PHE CA 1 1 29 PHE C 1 1 30 HIS N 108.45 160.8 . 29 . N . 29 . CA . 29 . C . 30 . N 1 1 21 . 1 1 29 PHE C 1 1 30 HIS N 1 1 30 HIS CA 1 1 30 HIS C -100.9 -49.66 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 22 . 1 1 30 HIS N 1 1 30 HIS CA 1 1 30 HIS C 1 1 31 GLN N 95.464 169.17 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 23 . 1 1 30 HIS C 1 1 31 GLN N 1 1 31 GLN CA 1 1 31 GLN C -75.42 -46.23 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 24 . 1 1 31 GLN N 1 1 31 GLN CA 1 1 31 GLN C 1 1 32 VAL N -56.89 -24.67 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 25 . 1 1 31 GLN C 1 1 32 VAL N 1 1 32 VAL CA 1 1 32 VAL C -76.09 -48.81 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 26 . 1 1 32 VAL N 1 1 32 VAL CA 1 1 32 VAL C 1 1 33 CYS N -49.55 -19.879997 . 32 . N . 32 . CA . 32 . C . 33 . N 1 1 27 . 1 1 32 VAL C 1 1 33 CYS N 1 1 33 CYS CA 1 1 33 CYS C -83.19 -51.5 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 28 . 1 1 33 CYS N 1 1 33 CYS CA 1 1 33 CYS C 1 1 34 VAL N -52.87 -16.7 . 33 . N . 33 . CA . 33 . C . 34 . N 1 1 29 . 1 1 33 CYS C 1 1 34 VAL N 1 1 34 VAL CA 1 1 34 VAL C -127.69999 -74.83 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 30 . 1 1 34 VAL N 1 1 34 VAL CA 1 1 34 VAL C 1 1 35 GLY N -28.16 28.445 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 31 . 1 1 35 GLY C 1 1 36 VAL N 1 1 36 VAL CA 1 1 36 VAL C -142.2 -64.02 . 35 . C . 36 . N . 36 . CA . 36 . C 1 1 32 . 1 1 36 VAL N 1 1 36 VAL CA 1 1 36 VAL C 1 1 37 SER N 119.07001 148.76 . 36 . N . 36 . CA . 36 . C . 37 . N 1 1 33 . 1 1 36 VAL C 1 1 37 SER N 1 1 37 SER CA 1 1 37 SER C -110.7 -56.9 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 34 . 1 1 37 SER N 1 1 37 SER CA 1 1 37 SER C 1 1 38 PRO N 100.91 171.78 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 35 . 1 1 38 PRO N 1 1 38 PRO CA 1 1 38 PRO C 1 1 39 GLU N -46.17 -12.12 . 38 . N . 38 . CA . 38 . C . 39 . N 1 1 36 . 1 1 38 PRO C 1 1 39 GLU N 1 1 39 GLU CA 1 1 39 GLU C -72.71 -58.579998 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 37 . 1 1 39 GLU N 1 1 39 GLU CA 1 1 39 GLU C 1 1 40 MET N -50.52 -26.46 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 38 . 1 1 39 GLU C 1 1 40 MET N 1 1 40 MET CA 1 1 40 MET C -73.3 -55.11 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 39 . 1 1 40 MET N 1 1 40 MET CA 1 1 40 MET C 1 1 41 ALA N -49.15 -32.14 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 40 . 1 1 40 MET C 1 1 41 ALA N 1 1 41 ALA CA 1 1 41 ALA C -80.35 -57.76 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 41 . 1 1 41 ALA N 1 1 41 ALA CA 1 1 41 ALA C 1 1 42 GLU N -47.91 -11.4 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 42 . 1 1 41 ALA C 1 1 42 GLU N 1 1 42 GLU CA 1 1 42 GLU C -106.0 -53.25 . 41 . C . 42 . N . 42 . CA . 42 . C 1 1 43 . 1 1 42 GLU N 1 1 42 GLU CA 1 1 42 GLU C 1 1 43 ASN N -46.51 -14.72 . 42 . N . 42 . CA . 42 . C . 43 . N 1 1 44 . 1 1 43 ASN C 1 1 44 GLU N 1 1 44 GLU CA 1 1 44 GLU C -155.7 -76.41 . 43 . C . 44 . N . 44 . CA . 44 . C 1 1 45 . 1 1 44 GLU N 1 1 44 GLU CA 1 1 44 GLU C 1 1 45 ASP N 84.3445 190.3495 . 44 . N . 44 . CA . 44 . C . 45 . N 1 1 46 . 1 1 44 GLU C 1 1 45 ASP N 1 1 45 ASP CA 1 1 45 ASP C -129.5 -54.9 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1 47 . 1 1 45 ASP N 1 1 45 ASP CA 1 1 45 ASP C 1 1 46 TYR N 116.2 144.19 . 45 . N . 45 . CA . 45 . C . 46 . N 1 1 48 . 1 1 45 ASP C 1 1 46 TYR N 1 1 46 TYR CA 1 1 46 TYR C -136.3 -67.48 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1 49 . 1 1 46 TYR N 1 1 46 TYR CA 1 1 46 TYR C 1 1 47 ILE N 104.19999 147.64 . 46 . N . 46 . CA . 46 . C . 47 . N 1 1 50 . 1 1 46 TYR C 1 1 47 ILE N 1 1 47 ILE CA 1 1 47 ILE C -126.7 -87.97 . 46 . C . 47 . N . 47 . CA . 47 . C 1 1 51 . 1 1 47 ILE N 1 1 47 ILE CA 1 1 47 ILE C 1 1 48 CYS N 103.37 154.16 . 47 . N . 47 . CA . 47 . C . 48 . N 1 1 52 . 1 1 50 ASN C 1 1 51 CYS N 1 1 51 CYS CA 1 1 51 CYS C -77.88999 -47.53 . 50 . C . 51 . N . 51 . CA . 51 . C 1 1 53 . 1 1 51 CYS N 1 1 51 CYS CA 1 1 51 CYS C 1 1 52 ALA N -60.200005 -25.22 . 51 . N . 51 . CA . 51 . C . 52 . N 1 1 stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _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 3 CYS N 1 1 3 CYS H -0.22 . . . . 3 . N . 3 . HN 1 1 2 1 1 4 ALA N 1 1 4 ALA H -5.89 . . . . 4 . N . 4 . HN 1 1 3 1 1 5 ALA N 1 1 5 ALA H -2.67 . . . . 5 . N . 5 . HN 1 1 4 1 1 6 GLN N 1 1 6 GLN H 11.22 . . . . 6 . N . 6 . HN 1 1 5 1 1 7 ASN N 1 1 7 ASN H 5.06 . . . . 7 . N . 7 . HN 1 1 6 1 1 8 CYS N 1 1 8 CYS H -8.29 . . . . 8 . N . 8 . HN 1 1 7 1 1 9 GLN N 1 1 9 GLN H 6.049 . . . . 9 . N . 9 . HN 1 1 8 1 1 10 ARG N 1 1 10 ARG H 4.33 . . . . 10 . N . 10 . HN 1 1 9 1 1 15 LYS N 1 1 15 LYS H 1.87 . . . . 15 . N . 15 . HN 1 1 10 1 1 17 ASP N 1 1 17 ASP H -8.02 . . . . 17 . N . 17 . HN 1 1 11 1 1 19 VAL N 1 1 19 VAL H -4.76 . . . . 19 . N . 19 . HN 1 1 12 1 1 20 GLN N 1 1 20 GLN H -6.13 . . . . 20 . N . 20 . HN 1 1 13 1 1 21 CYS N 1 1 21 CYS H 2.38 . . . . 21 . N . 21 . HN 1 1 14 1 1 22 ASP N 1 1 22 ASP H -5.53 . . . . 22 . N . 22 . HN 1 1 15 1 1 23 GLY N 1 1 23 GLY H 13.0 . . . . 23 . N . 23 . HN 1 1 16 1 1 24 GLY N 1 1 24 GLY H -2.74 . . . . 24 . N . 24 . HN 1 1 17 1 1 25 CYS N 1 1 25 CYS H -4.75 . . . . 25 . N . 25 . HN 1 1 18 1 1 26 ASP N 1 1 26 ASP H 7.68 . . . . 26 . N . 26 . HN 1 1 19 1 1 27 GLU N 1 1 27 GLU H 3.17 . . . . 27 . N . 27 . HN 1 1 20 1 1 28 TRP N 1 1 28 TRP H -1.36 . . . . 28 . N . 28 . HN 1 1 21 1 1 29 PHE N 1 1 29 PHE H 1.78 . . . . 29 . N . 29 . HN 1 1 22 1 1 30 HIS N 1 1 30 HIS H -8.38 . . . . 30 . N . 30 . HN 1 1 23 1 1 31 GLN N 1 1 31 GLN H -1.9 . . . . 31 . N . 31 . HN 1 1 24 1 1 32 VAL N 1 1 32 VAL H 3.079 . . . . 32 . N . 32 . HN 1 1 25 1 1 33 CYS N 1 1 33 CYS H -2.98 . . . . 33 . N . 33 . HN 1 1 26 1 1 34 VAL N 1 1 34 VAL H -6.81 . . . . 34 . N . 34 . HN 1 1 27 1 1 35 GLY N 1 1 35 GLY H 16.06 . . . . 35 . N . 35 . HN 1 1 28 1 1 36 VAL N 1 1 36 VAL H 6.239 . . . . 36 . N . 36 . HN 1 1 29 1 1 37 SER N 1 1 37 SER H 13.35 . . . . 37 . N . 37 . HN 1 1 30 1 1 39 GLU N 1 1 39 GLU H 0.989 . . . . 39 . N . 39 . HN 1 1 31 1 1 40 MET N 1 1 40 MET H 8.44 . . . . 40 . N . 40 . HN 1 1 32 1 1 41 ALA N 1 1 41 ALA H 6.079 . . . . 41 . N . 41 . HN 1 1 33 1 1 42 GLU N 1 1 42 GLU H 4.609 . . . . 42 . N . 42 . HN 1 1 34 1 1 43 ASN N 1 1 43 ASN H 1.979 . . . . 43 . N . 43 . HN 1 1 35 1 1 44 GLU N 1 1 44 GLU H 12.28 . . . . 44 . N . 44 . HN 1 1 36 1 1 45 ASP N 1 1 45 ASP H 9.239 . . . . 45 . N . 45 . HN 1 1 37 1 1 46 TYR N 1 1 46 TYR H -1.85 . . . . 46 . N . 46 . HN 1 1 38 1 1 47 ILE N 1 1 47 ILE H -4.73 . . . . 47 . N . 47 . HN 1 1 39 1 1 48 CYS N 1 1 48 CYS H -3.21 . . . . 48 . N . 48 . HN 1 1 40 1 1 49 ILE N 1 1 49 ILE H 5.259 . . . . 49 . N . 49 . HN 1 1 41 1 1 50 ASN N 1 1 50 ASN H -0.21 . . . . 50 . N . 50 . HN 1 1 42 1 1 51 CYS N 1 1 51 CYS H 0.009 . . . . 51 . N . 51 . HN 1 1 43 1 1 52 ALA N 1 1 52 ALA H 13.43 . . . . 52 . N . 52 . HN 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 SER C C -11.387 5.676 2.213 1.00 . A A . 1 SER C 1 1 1 2 1 1 1 SER CA C -12.346 5.815 3.413 1.00 . A A . 1 SER CA 1 1 1 3 1 1 1 SER CB C -12.200 4.617 4.377 1.00 . A A . 1 SER CB 1 1 1 4 1 1 1 SER HA H -12.080 6.721 3.936 1.00 . A A . 1 SER HA 1 1 1 5 1 1 1 SER HB2 H -12.556 3.719 3.894 1.00 . A A . 1 SER HB2 1 1 1 6 1 1 1 SER HB3 H -11.160 4.493 4.646 1.00 . A A . 1 SER HB3 1 1 1 7 1 1 1 SER HG H -12.481 4.422 6.296 1.00 . A A . 1 SER HG 1 1 1 8 1 1 1 SER N N -13.765 5.969 2.978 1.00 . A A . 1 SER N 1 1 1 9 1 1 1 SER O O -11.436 4.698 1.444 1.00 . A A . 1 SER O 1 1 1 10 1 1 1 SER OG O -12.970 4.815 5.567 1.00 . A A . 1 SER OG 1 1 1 11 1 1 2 VAL C C -8.187 6.429 1.618 1.00 . A A . 2 VAL C 1 1 1 12 1 1 2 VAL CA C -9.554 6.681 0.994 1.00 . A A . 2 VAL CA 1 1 1 13 1 1 2 VAL CB C -9.544 8.063 0.289 1.00 . A A . 2 VAL CB 1 1 1 14 1 1 2 VAL CG1 C -8.571 8.073 -0.884 1.00 . A A . 2 VAL CG1 1 1 1 15 1 1 2 VAL CG2 C -10.949 8.445 -0.171 1.00 . A A . 2 VAL CG2 1 1 1 16 1 1 2 VAL H H -10.536 7.407 2.696 1.00 . A A . 2 VAL H 1 1 1 17 1 1 2 VAL HA H -9.784 5.906 0.277 1.00 . A A . 2 VAL HA 1 1 1 18 1 1 2 VAL HB H -9.208 8.807 0.998 1.00 . A A . 2 VAL HB 1 1 1 19 1 1 2 VAL HG11 H -8.848 7.303 -1.587 1.00 . A A . 2 VAL HG11 1 1 1 20 1 1 2 VAL HG12 H -7.569 7.885 -0.529 1.00 . A A . 2 VAL HG12 1 1 1 21 1 1 2 VAL HG13 H -8.608 9.038 -1.367 1.00 . A A . 2 VAL HG13 1 1 1 22 1 1 2 VAL HG21 H -11.614 8.496 0.680 1.00 . A A . 2 VAL HG21 1 1 1 23 1 1 2 VAL HG22 H -11.323 7.718 -0.879 1.00 . A A . 2 VAL HG22 1 1 1 24 1 1 2 VAL HG23 H -10.908 9.406 -0.661 1.00 . A A . 2 VAL HG23 1 1 1 25 1 1 2 VAL N N -10.532 6.662 2.057 1.00 . A A . 2 VAL N 1 1 1 26 1 1 2 VAL O O -7.885 6.990 2.666 1.00 . A A . 2 VAL O 1 1 1 27 1 1 3 CYS C C -5.040 6.309 1.020 1.00 . A A . 3 CYS C 1 1 1 28 1 1 3 CYS CA C -6.060 5.276 1.555 1.00 . A A . 3 CYS CA 1 1 1 29 1 1 3 CYS CB C -5.623 3.837 1.159 1.00 . A A . 3 CYS CB 1 1 1 30 1 1 3 CYS H H -7.622 5.098 0.193 1.00 . A A . 3 CYS H 1 1 1 31 1 1 3 CYS HA H -6.109 5.353 2.632 1.00 . A A . 3 CYS HA 1 1 1 32 1 1 3 CYS HB2 H -5.158 3.357 2.004 1.00 . A A . 3 CYS HB2 1 1 1 33 1 1 3 CYS HB3 H -6.498 3.266 0.890 1.00 . A A . 3 CYS HB3 1 1 1 34 1 1 3 CYS N N -7.374 5.572 1.008 1.00 . A A . 3 CYS N 1 1 1 35 1 1 3 CYS O O -5.421 7.234 0.288 1.00 . A A . 3 CYS O 1 1 1 36 1 1 3 CYS SG S -4.447 3.742 -0.220 1.00 . A A . 3 CYS SG 1 1 1 37 1 1 4 ALA C C -2.166 6.462 -0.431 1.00 . A A . 4 ALA C 1 1 1 38 1 1 4 ALA CA C -2.738 7.003 0.883 1.00 . A A . 4 ALA CA 1 1 1 39 1 1 4 ALA CB C -1.625 7.123 1.923 1.00 . A A . 4 ALA CB 1 1 1 40 1 1 4 ALA H H -3.520 5.355 1.907 1.00 . A A . 4 ALA H 1 1 1 41 1 1 4 ALA HA H -3.156 7.982 0.714 1.00 . A A . 4 ALA HA 1 1 1 42 1 1 4 ALA HB1 H -0.846 7.787 1.575 1.00 . A A . 4 ALA HB1 1 1 1 43 1 1 4 ALA HB2 H -1.185 6.151 2.101 1.00 . A A . 4 ALA HB2 1 1 1 44 1 1 4 ALA HB3 H -2.037 7.507 2.843 1.00 . A A . 4 ALA HB3 1 1 1 45 1 1 4 ALA N N -3.770 6.132 1.357 1.00 . A A . 4 ALA N 1 1 1 46 1 1 4 ALA O O -1.737 5.336 -0.486 1.00 . A A . 4 ALA O 1 1 1 47 1 1 5 ALA C C -2.069 8.130 -3.723 1.00 . A A . 5 ALA C 1 1 1 48 1 1 5 ALA CA C -1.657 7.009 -2.795 1.00 . A A . 5 ALA CA 1 1 1 49 1 1 5 ALA CB C -2.085 5.648 -3.401 1.00 . A A . 5 ALA CB 1 1 1 50 1 1 5 ALA H H -2.876 8.018 -1.417 1.00 . A A . 5 ALA H 1 1 1 51 1 1 5 ALA HA H -0.587 7.020 -2.652 1.00 . A A . 5 ALA HA 1 1 1 52 1 1 5 ALA HB1 H -1.796 4.853 -2.731 1.00 . A A . 5 ALA HB1 1 1 1 53 1 1 5 ALA HB2 H -1.618 5.464 -4.359 1.00 . A A . 5 ALA HB2 1 1 1 54 1 1 5 ALA HB3 H -3.160 5.643 -3.511 1.00 . A A . 5 ALA HB3 1 1 1 55 1 1 5 ALA N N -2.276 7.253 -1.489 1.00 . A A . 5 ALA N 1 1 1 56 1 1 5 ALA O O -3.238 8.504 -3.723 1.00 . A A . 5 ALA O 1 1 1 57 1 1 6 GLN C C -2.553 9.354 -6.403 1.00 . A A . 6 GLN C 1 1 1 58 1 1 6 GLN CA C -1.395 9.756 -5.485 1.00 . A A . 6 GLN CA 1 1 1 59 1 1 6 GLN CB C -0.145 10.057 -6.329 1.00 . A A . 6 GLN CB 1 1 1 60 1 1 6 GLN CD C 2.203 10.936 -6.448 1.00 . A A . 6 GLN CD 1 1 1 61 1 1 6 GLN CG C 1.006 10.664 -5.556 1.00 . A A . 6 GLN CG 1 1 1 62 1 1 6 GLN H H -0.167 8.470 -4.339 1.00 . A A . 6 GLN H 1 1 1 63 1 1 6 GLN HA H -1.676 10.651 -4.951 1.00 . A A . 6 GLN HA 1 1 1 64 1 1 6 GLN HB2 H 0.229 9.140 -6.764 1.00 . A A . 6 GLN HB2 1 1 1 65 1 1 6 GLN HB3 H -0.409 10.735 -7.127 1.00 . A A . 6 GLN HB3 1 1 1 66 1 1 6 GLN HE21 H 2.721 12.498 -5.351 1.00 . A A . 6 GLN HE21 1 1 1 67 1 1 6 GLN HE22 H 3.734 12.141 -6.705 1.00 . A A . 6 GLN HE22 1 1 1 68 1 1 6 GLN HG2 H 0.677 11.589 -5.110 1.00 . A A . 6 GLN HG2 1 1 1 69 1 1 6 GLN HG3 H 1.308 9.981 -4.772 1.00 . A A . 6 GLN HG3 1 1 1 70 1 1 6 GLN N N -1.105 8.698 -4.481 1.00 . A A . 6 GLN N 1 1 1 71 1 1 6 GLN NE2 N 2.960 11.960 -6.133 1.00 . A A . 6 GLN NE2 1 1 1 72 1 1 6 GLN O O -3.324 10.195 -6.853 1.00 . A A . 6 GLN O 1 1 1 73 1 1 6 GLN OE1 O 2.436 10.234 -7.427 1.00 . A A . 6 GLN OE1 1 1 1 74 1 1 7 ASN C C -4.291 6.326 -6.768 1.00 . A A . 7 ASN C 1 1 1 75 1 1 7 ASN CA C -3.753 7.556 -7.439 1.00 . A A . 7 ASN CA 1 1 1 76 1 1 7 ASN CB C -3.353 7.246 -8.890 1.00 . A A . 7 ASN CB 1 1 1 77 1 1 7 ASN CG C -4.532 6.777 -9.741 1.00 . A A . 7 ASN CG 1 1 1 78 1 1 7 ASN H H -1.897 7.554 -6.344 1.00 . A A . 7 ASN H 1 1 1 79 1 1 7 ASN HA H -4.530 8.312 -7.447 1.00 . A A . 7 ASN HA 1 1 1 80 1 1 7 ASN HB2 H -2.924 8.126 -9.338 1.00 . A A . 7 ASN HB2 1 1 1 81 1 1 7 ASN HB3 H -2.609 6.462 -8.892 1.00 . A A . 7 ASN HB3 1 1 1 82 1 1 7 ASN HD21 H -4.146 4.898 -9.294 1.00 . A A . 7 ASN HD21 1 1 1 83 1 1 7 ASN HD22 H -5.495 5.173 -10.345 1.00 . A A . 7 ASN HD22 1 1 1 84 1 1 7 ASN N N -2.646 8.084 -6.683 1.00 . A A . 7 ASN N 1 1 1 85 1 1 7 ASN ND2 N -4.746 5.486 -9.798 1.00 . A A . 7 ASN ND2 1 1 1 86 1 1 7 ASN O O -3.780 5.219 -6.988 1.00 . A A . 7 ASN O 1 1 1 87 1 1 7 ASN OD1 O -5.230 7.578 -10.341 1.00 . A A . 7 ASN OD1 1 1 1 88 1 1 8 CYS C C -7.066 4.877 -6.018 1.00 . A A . 8 CYS C 1 1 1 89 1 1 8 CYS CA C -5.833 5.356 -5.282 1.00 . A A . 8 CYS CA 1 1 1 90 1 1 8 CYS CB C -6.113 5.544 -3.782 1.00 . A A . 8 CYS CB 1 1 1 91 1 1 8 CYS H H -5.638 7.382 -5.712 1.00 . A A . 8 CYS H 1 1 1 92 1 1 8 CYS HA H -5.064 4.609 -5.395 1.00 . A A . 8 CYS HA 1 1 1 93 1 1 8 CYS HB2 H -5.197 5.765 -3.253 1.00 . A A . 8 CYS HB2 1 1 1 94 1 1 8 CYS HB3 H -6.804 6.364 -3.659 1.00 . A A . 8 CYS HB3 1 1 1 95 1 1 8 CYS N N -5.273 6.491 -5.911 1.00 . A A . 8 CYS N 1 1 1 96 1 1 8 CYS O O -8.062 5.589 -6.137 1.00 . A A . 8 CYS O 1 1 1 97 1 1 8 CYS SG S -6.874 4.074 -3.002 1.00 . A A . 8 CYS SG 1 1 1 98 1 1 9 GLN C C -9.218 2.670 -6.237 1.00 . A A . 9 GLN C 1 1 1 99 1 1 9 GLN CA C -8.063 2.979 -7.196 1.00 . A A . 9 GLN CA 1 1 1 100 1 1 9 GLN CB C -7.524 1.671 -7.761 1.00 . A A . 9 GLN CB 1 1 1 101 1 1 9 GLN CD C -5.797 0.491 -9.162 1.00 . A A . 9 GLN CD 1 1 1 102 1 1 9 GLN CG C -6.333 1.823 -8.697 1.00 . A A . 9 GLN CG 1 1 1 103 1 1 9 GLN H H -6.125 3.198 -6.374 1.00 . A A . 9 GLN H 1 1 1 104 1 1 9 GLN HA H -8.415 3.595 -8.011 1.00 . A A . 9 GLN HA 1 1 1 105 1 1 9 GLN HB2 H -7.224 1.033 -6.944 1.00 . A A . 9 GLN HB2 1 1 1 106 1 1 9 GLN HB3 H -8.307 1.167 -8.303 1.00 . A A . 9 GLN HB3 1 1 1 107 1 1 9 GLN HE21 H -3.967 1.234 -9.311 1.00 . A A . 9 GLN HE21 1 1 1 108 1 1 9 GLN HE22 H -4.161 -0.419 -9.747 1.00 . A A . 9 GLN HE22 1 1 1 109 1 1 9 GLN HG2 H -6.584 2.415 -9.560 1.00 . A A . 9 GLN HG2 1 1 1 110 1 1 9 GLN HG3 H -5.551 2.325 -8.148 1.00 . A A . 9 GLN HG3 1 1 1 111 1 1 9 GLN N N -6.983 3.651 -6.489 1.00 . A A . 9 GLN N 1 1 1 112 1 1 9 GLN NE2 N -4.521 0.435 -9.428 1.00 . A A . 9 GLN NE2 1 1 1 113 1 1 9 GLN O O -10.300 2.285 -6.658 1.00 . A A . 9 GLN O 1 1 1 114 1 1 9 GLN OE1 O -6.520 -0.471 -9.272 1.00 . A A . 9 GLN OE1 1 1 1 115 1 1 10 ARG C C -10.553 1.159 -3.918 1.00 . A A . 10 ARG C 1 1 1 116 1 1 10 ARG CA C -9.893 2.559 -3.847 1.00 . A A . 10 ARG CA 1 1 1 117 1 1 10 ARG CB C -10.915 3.684 -3.754 1.00 . A A . 10 ARG CB 1 1 1 118 1 1 10 ARG CD C -11.233 6.134 -3.373 1.00 . A A . 10 ARG CD 1 1 1 119 1 1 10 ARG CG C -10.327 4.956 -3.166 1.00 . A A . 10 ARG CG 1 1 1 120 1 1 10 ARG CZ C -12.307 7.137 -5.371 1.00 . A A . 10 ARG CZ 1 1 1 121 1 1 10 ARG H H -8.099 3.284 -4.722 1.00 . A A . 10 ARG H 1 1 1 122 1 1 10 ARG HA H -9.303 2.582 -2.941 1.00 . A A . 10 ARG HA 1 1 1 123 1 1 10 ARG HB2 H -11.278 3.909 -4.747 1.00 . A A . 10 ARG HB2 1 1 1 124 1 1 10 ARG HB3 H -11.733 3.362 -3.127 1.00 . A A . 10 ARG HB3 1 1 1 125 1 1 10 ARG HD2 H -12.225 5.857 -3.048 1.00 . A A . 10 ARG HD2 1 1 1 126 1 1 10 ARG HD3 H -10.873 6.962 -2.780 1.00 . A A . 10 ARG HD3 1 1 1 127 1 1 10 ARG HE H -10.431 6.388 -5.280 1.00 . A A . 10 ARG HE 1 1 1 128 1 1 10 ARG HG2 H -10.184 4.826 -2.104 1.00 . A A . 10 ARG HG2 1 1 1 129 1 1 10 ARG HG3 H -9.376 5.170 -3.629 1.00 . A A . 10 ARG HG3 1 1 1 130 1 1 10 ARG HH11 H -13.597 6.939 -3.783 1.00 . A A . 10 ARG HH11 1 1 1 131 1 1 10 ARG HH12 H -14.265 7.699 -5.118 1.00 . A A . 10 ARG HH12 1 1 1 132 1 1 10 ARG HH21 H -11.368 7.465 -7.166 1.00 . A A . 10 ARG HH21 1 1 1 133 1 1 10 ARG HH22 H -12.976 8.026 -7.078 1.00 . A A . 10 ARG HH22 1 1 1 134 1 1 10 ARG N N -8.947 2.853 -4.936 1.00 . A A . 10 ARG N 1 1 1 135 1 1 10 ARG NE N -11.271 6.538 -4.786 1.00 . A A . 10 ARG NE 1 1 1 136 1 1 10 ARG NH1 N -13.453 7.262 -4.718 1.00 . A A . 10 ARG NH1 1 1 1 137 1 1 10 ARG NH2 N -12.211 7.561 -6.623 1.00 . A A . 10 ARG NH2 1 1 1 138 1 1 10 ARG O O -11.739 1.039 -3.681 1.00 . A A . 10 ARG O 1 1 1 139 1 1 11 PRO C C -10.589 -1.826 -2.836 1.00 . A A . 11 PRO C 1 1 1 140 1 1 11 PRO CA C -10.339 -1.272 -4.240 1.00 . A A . 11 PRO CA 1 1 1 141 1 1 11 PRO CB C -9.234 -2.097 -4.946 1.00 . A A . 11 PRO CB 1 1 1 142 1 1 11 PRO CD C -8.334 0.023 -4.397 1.00 . A A . 11 PRO CD 1 1 1 143 1 1 11 PRO CG C -8.203 -1.105 -5.359 1.00 . A A . 11 PRO CG 1 1 1 144 1 1 11 PRO HA H -11.245 -1.293 -4.824 1.00 . A A . 11 PRO HA 1 1 1 145 1 1 11 PRO HB2 H -8.824 -2.786 -4.223 1.00 . A A . 11 PRO HB2 1 1 1 146 1 1 11 PRO HB3 H -9.635 -2.637 -5.789 1.00 . A A . 11 PRO HB3 1 1 1 147 1 1 11 PRO HD2 H -7.800 -0.213 -3.491 1.00 . A A . 11 PRO HD2 1 1 1 148 1 1 11 PRO HD3 H -7.975 0.950 -4.819 1.00 . A A . 11 PRO HD3 1 1 1 149 1 1 11 PRO HG2 H -7.216 -1.540 -5.312 1.00 . A A . 11 PRO HG2 1 1 1 150 1 1 11 PRO HG3 H -8.416 -0.762 -6.363 1.00 . A A . 11 PRO HG3 1 1 1 151 1 1 11 PRO N N -9.773 0.062 -4.173 1.00 . A A . 11 PRO N 1 1 1 152 1 1 11 PRO O O -9.685 -1.772 -1.951 1.00 . A A . 11 PRO O 1 1 1 153 1 1 12 CYS C C -12.356 -4.412 -1.541 1.00 . A A . 12 CYS C 1 1 1 154 1 1 12 CYS CA C -12.107 -2.927 -1.361 1.00 . A A . 12 CYS CA 1 1 1 155 1 1 12 CYS CB C -13.339 -2.217 -0.775 1.00 . A A . 12 CYS CB 1 1 1 156 1 1 12 CYS H H -12.438 -2.374 -3.338 1.00 . A A . 12 CYS H 1 1 1 157 1 1 12 CYS HA H -11.265 -2.788 -0.699 1.00 . A A . 12 CYS HA 1 1 1 158 1 1 12 CYS HB2 H -13.158 -1.155 -0.741 1.00 . A A . 12 CYS HB2 1 1 1 159 1 1 12 CYS HB3 H -14.178 -2.398 -1.428 1.00 . A A . 12 CYS HB3 1 1 1 160 1 1 12 CYS HG H -14.958 -3.427 0.765 1.00 . A A . 12 CYS HG 1 1 1 161 1 1 12 CYS N N -11.763 -2.359 -2.626 1.00 . A A . 12 CYS N 1 1 1 162 1 1 12 CYS O O -13.301 -4.814 -2.198 1.00 . A A . 12 CYS O 1 1 1 163 1 1 12 CYS SG S -13.816 -2.765 0.884 1.00 . A A . 12 CYS SG 1 1 1 164 1 1 13 LYS C C -11.183 -7.193 0.289 1.00 . A A . 13 LYS C 1 1 1 165 1 1 13 LYS CA C -11.562 -6.659 -1.071 1.00 . A A . 13 LYS CA 1 1 1 166 1 1 13 LYS CB C -10.604 -7.245 -2.149 1.00 . A A . 13 LYS CB 1 1 1 167 1 1 13 LYS CD C -9.891 -7.412 -4.564 1.00 . A A . 13 LYS CD 1 1 1 168 1 1 13 LYS CE C -10.161 -6.956 -6.001 1.00 . A A . 13 LYS CE 1 1 1 169 1 1 13 LYS CG C -10.874 -6.778 -3.583 1.00 . A A . 13 LYS CG 1 1 1 170 1 1 13 LYS H H -10.717 -4.847 -0.484 1.00 . A A . 13 LYS H 1 1 1 171 1 1 13 LYS HA H -12.580 -6.944 -1.293 1.00 . A A . 13 LYS HA 1 1 1 172 1 1 13 LYS HB2 H -9.587 -6.963 -1.906 1.00 . A A . 13 LYS HB2 1 1 1 173 1 1 13 LYS HB3 H -10.687 -8.324 -2.119 1.00 . A A . 13 LYS HB3 1 1 1 174 1 1 13 LYS HD2 H -8.885 -7.117 -4.300 1.00 . A A . 13 LYS HD2 1 1 1 175 1 1 13 LYS HD3 H -9.987 -8.487 -4.513 1.00 . A A . 13 LYS HD3 1 1 1 176 1 1 13 LYS HE2 H -11.170 -7.249 -6.263 1.00 . A A . 13 LYS HE2 1 1 1 177 1 1 13 LYS HE3 H -10.103 -5.876 -6.052 1.00 . A A . 13 LYS HE3 1 1 1 178 1 1 13 LYS HG2 H -11.875 -7.070 -3.857 1.00 . A A . 13 LYS HG2 1 1 1 179 1 1 13 LYS HG3 H -10.775 -5.704 -3.627 1.00 . A A . 13 LYS HG3 1 1 1 180 1 1 13 LYS HZ1 H -9.434 -7.277 -7.953 1.00 . A A . 13 LYS HZ1 1 1 1 181 1 1 13 LYS HZ2 H -9.249 -8.598 -6.954 1.00 . A A . 13 LYS HZ2 1 1 1 182 1 1 13 LYS HZ3 H -8.210 -7.321 -6.791 1.00 . A A . 13 LYS HZ3 1 1 1 183 1 1 13 LYS N N -11.471 -5.214 -0.998 1.00 . A A . 13 LYS N 1 1 1 184 1 1 13 LYS NZ N -9.204 -7.558 -6.979 1.00 . A A . 13 LYS NZ 1 1 1 185 1 1 13 LYS O O -10.472 -6.524 1.035 1.00 . A A . 13 LYS O 1 1 1 186 1 1 14 ASP C C -10.097 -9.816 1.855 1.00 . A A . 14 ASP C 1 1 1 187 1 1 14 ASP CA C -11.358 -8.973 1.917 1.00 . A A . 14 ASP CA 1 1 1 188 1 1 14 ASP CB C -12.542 -9.847 2.339 1.00 . A A . 14 ASP CB 1 1 1 189 1 1 14 ASP CG C -12.737 -11.035 1.420 1.00 . A A . 14 ASP CG 1 1 1 190 1 1 14 ASP H H -12.185 -8.901 -0.005 1.00 . A A . 14 ASP H 1 1 1 191 1 1 14 ASP HA H -11.232 -8.182 2.645 1.00 . A A . 14 ASP HA 1 1 1 192 1 1 14 ASP HB2 H -12.388 -10.217 3.341 1.00 . A A . 14 ASP HB2 1 1 1 193 1 1 14 ASP HB3 H -13.443 -9.248 2.311 1.00 . A A . 14 ASP HB3 1 1 1 194 1 1 14 ASP N N -11.633 -8.369 0.611 1.00 . A A . 14 ASP N 1 1 1 195 1 1 14 ASP O O -9.612 -10.303 2.868 1.00 . A A . 14 ASP O 1 1 1 196 1 1 14 ASP OD1 O -12.939 -10.820 0.181 1.00 . A A . 14 ASP OD1 1 1 1 197 1 1 14 ASP OD2 O -12.733 -12.193 1.914 1.00 . A A . 14 ASP OD2 1 1 1 198 1 1 15 LYS C C -7.213 -9.885 0.004 1.00 . A A . 15 LYS C 1 1 1 199 1 1 15 LYS CA C -8.370 -10.769 0.456 1.00 . A A . 15 LYS CA 1 1 1 200 1 1 15 LYS CB C -8.630 -11.889 -0.563 1.00 . A A . 15 LYS CB 1 1 1 201 1 1 15 LYS CD C -9.919 -13.953 -1.190 1.00 . A A . 15 LYS CD 1 1 1 202 1 1 15 LYS CE C -11.056 -14.903 -0.811 1.00 . A A . 15 LYS CE 1 1 1 203 1 1 15 LYS CG C -9.748 -12.854 -0.161 1.00 . A A . 15 LYS CG 1 1 1 204 1 1 15 LYS H H -9.986 -9.521 -0.095 1.00 . A A . 15 LYS H 1 1 1 205 1 1 15 LYS HA H -8.097 -11.210 1.401 1.00 . A A . 15 LYS HA 1 1 1 206 1 1 15 LYS HB2 H -8.894 -11.442 -1.507 1.00 . A A . 15 LYS HB2 1 1 1 207 1 1 15 LYS HB3 H -7.730 -12.469 -0.703 1.00 . A A . 15 LYS HB3 1 1 1 208 1 1 15 LYS HD2 H -10.106 -13.509 -2.159 1.00 . A A . 15 LYS HD2 1 1 1 209 1 1 15 LYS HD3 H -8.991 -14.504 -1.231 1.00 . A A . 15 LYS HD3 1 1 1 210 1 1 15 LYS HE2 H -10.853 -15.344 0.153 1.00 . A A . 15 LYS HE2 1 1 1 211 1 1 15 LYS HE3 H -11.974 -14.338 -0.746 1.00 . A A . 15 LYS HE3 1 1 1 212 1 1 15 LYS HG2 H -9.495 -13.303 0.788 1.00 . A A . 15 LYS HG2 1 1 1 213 1 1 15 LYS HG3 H -10.679 -12.314 -0.066 1.00 . A A . 15 LYS HG3 1 1 1 214 1 1 15 LYS HZ1 H -11.946 -16.664 -1.477 1.00 . A A . 15 LYS HZ1 1 1 1 215 1 1 15 LYS HZ2 H -10.334 -16.508 -1.910 1.00 . A A . 15 LYS HZ2 1 1 1 216 1 1 15 LYS HZ3 H -11.504 -15.605 -2.733 1.00 . A A . 15 LYS HZ3 1 1 1 217 1 1 15 LYS N N -9.563 -9.972 0.661 1.00 . A A . 15 LYS N 1 1 1 218 1 1 15 LYS NZ N -11.228 -15.985 -1.809 1.00 . A A . 15 LYS NZ 1 1 1 219 1 1 15 LYS O O -6.205 -10.377 -0.482 1.00 . A A . 15 LYS O 1 1 1 220 1 1 16 VAL C C -5.597 -7.114 1.069 1.00 . A A . 16 VAL C 1 1 1 221 1 1 16 VAL CA C -6.291 -7.679 -0.176 1.00 . A A . 16 VAL CA 1 1 1 222 1 1 16 VAL CB C -6.751 -6.518 -1.138 1.00 . A A . 16 VAL CB 1 1 1 223 1 1 16 VAL CG1 C -7.839 -5.685 -0.491 1.00 . A A . 16 VAL CG1 1 1 1 224 1 1 16 VAL CG2 C -5.566 -5.613 -1.500 1.00 . A A . 16 VAL CG2 1 1 1 225 1 1 16 VAL H H -8.165 -8.234 0.605 1.00 . A A . 16 VAL H 1 1 1 226 1 1 16 VAL HA H -5.559 -8.285 -0.695 1.00 . A A . 16 VAL HA 1 1 1 227 1 1 16 VAL HB H -7.142 -6.948 -2.051 1.00 . A A . 16 VAL HB 1 1 1 228 1 1 16 VAL HG11 H -8.157 -4.893 -1.154 1.00 . A A . 16 VAL HG11 1 1 1 229 1 1 16 VAL HG12 H -7.387 -5.290 0.409 1.00 . A A . 16 VAL HG12 1 1 1 230 1 1 16 VAL HG13 H -8.668 -6.321 -0.213 1.00 . A A . 16 VAL HG13 1 1 1 231 1 1 16 VAL HG21 H -5.911 -4.828 -2.159 1.00 . A A . 16 VAL HG21 1 1 1 232 1 1 16 VAL HG22 H -4.772 -6.180 -1.966 1.00 . A A . 16 VAL HG22 1 1 1 233 1 1 16 VAL HG23 H -5.202 -5.178 -0.578 1.00 . A A . 16 VAL HG23 1 1 1 234 1 1 16 VAL N N -7.352 -8.584 0.188 1.00 . A A . 16 VAL N 1 1 1 235 1 1 16 VAL O O -6.160 -6.324 1.822 1.00 . A A . 16 VAL O 1 1 1 236 1 1 17 ASP C C -2.993 -5.692 1.987 1.00 . A A . 17 ASP C 1 1 1 237 1 1 17 ASP CA C -3.547 -7.068 2.370 1.00 . A A . 17 ASP CA 1 1 1 238 1 1 17 ASP CB C -2.420 -8.058 2.746 1.00 . A A . 17 ASP CB 1 1 1 239 1 1 17 ASP CG C -2.972 -9.325 3.404 1.00 . A A . 17 ASP CG 1 1 1 240 1 1 17 ASP H H -4.187 -8.397 0.790 1.00 . A A . 17 ASP H 1 1 1 241 1 1 17 ASP HA H -4.212 -6.939 3.214 1.00 . A A . 17 ASP HA 1 1 1 242 1 1 17 ASP HB2 H -1.904 -8.321 1.833 1.00 . A A . 17 ASP HB2 1 1 1 243 1 1 17 ASP HB3 H -1.722 -7.565 3.413 1.00 . A A . 17 ASP HB3 1 1 1 244 1 1 17 ASP N N -4.419 -7.600 1.308 1.00 . A A . 17 ASP N 1 1 1 245 1 1 17 ASP O O -2.730 -5.411 0.805 1.00 . A A . 17 ASP O 1 1 1 246 1 1 17 ASP OD1 O -3.499 -10.182 2.710 1.00 . A A . 17 ASP OD1 1 1 1 247 1 1 17 ASP OD2 O -2.908 -9.431 4.624 1.00 . A A . 17 ASP OD2 1 1 1 248 1 1 18 TRP C C -0.986 -3.251 3.325 1.00 . A A . 18 TRP C 1 1 1 249 1 1 18 TRP CA C -2.417 -3.444 2.834 1.00 . A A . 18 TRP CA 1 1 1 250 1 1 18 TRP CB C -3.355 -2.540 3.659 1.00 . A A . 18 TRP CB 1 1 1 251 1 1 18 TRP CD1 C -5.578 -3.692 3.091 1.00 . A A . 18 TRP CD1 1 1 1 252 1 1 18 TRP CD2 C -5.667 -1.474 3.021 1.00 . A A . 18 TRP CD2 1 1 1 253 1 1 18 TRP CE2 C -6.936 -1.992 2.686 1.00 . A A . 18 TRP CE2 1 1 1 254 1 1 18 TRP CE3 C -5.489 -0.088 3.055 1.00 . A A . 18 TRP CE3 1 1 1 255 1 1 18 TRP CG C -4.808 -2.584 3.251 1.00 . A A . 18 TRP CG 1 1 1 256 1 1 18 TRP CH2 C -7.816 0.182 2.435 1.00 . A A . 18 TRP CH2 1 1 1 257 1 1 18 TRP CZ2 C -8.018 -1.175 2.389 1.00 . A A . 18 TRP CZ2 1 1 1 258 1 1 18 TRP CZ3 C -6.569 0.722 2.764 1.00 . A A . 18 TRP CZ3 1 1 1 259 1 1 18 TRP H H -2.971 -5.187 3.893 1.00 . A A . 18 TRP H 1 1 1 260 1 1 18 TRP HA H -2.490 -3.170 1.789 1.00 . A A . 18 TRP HA 1 1 1 261 1 1 18 TRP HB2 H -3.302 -2.854 4.692 1.00 . A A . 18 TRP HB2 1 1 1 262 1 1 18 TRP HB3 H -3.009 -1.518 3.586 1.00 . A A . 18 TRP HB3 1 1 1 263 1 1 18 TRP HD1 H -5.213 -4.703 3.203 1.00 . A A . 18 TRP HD1 1 1 1 264 1 1 18 TRP HE1 H -7.538 -4.019 2.532 1.00 . A A . 18 TRP HE1 1 1 1 265 1 1 18 TRP HE3 H -4.532 0.344 3.306 1.00 . A A . 18 TRP HE3 1 1 1 266 1 1 18 TRP HH2 H -8.636 0.849 2.216 1.00 . A A . 18 TRP HH2 1 1 1 267 1 1 18 TRP HZ2 H -8.988 -1.579 2.133 1.00 . A A . 18 TRP HZ2 1 1 1 268 1 1 18 TRP HZ3 H -6.449 1.795 2.787 1.00 . A A . 18 TRP HZ3 1 1 1 269 1 1 18 TRP N N -2.823 -4.852 2.986 1.00 . A A . 18 TRP N 1 1 1 270 1 1 18 TRP NE1 N -6.840 -3.352 2.719 1.00 . A A . 18 TRP NE1 1 1 1 271 1 1 18 TRP O O -0.475 -4.082 4.082 1.00 . A A . 18 TRP O 1 1 1 272 1 1 19 VAL C C 1.130 -0.497 3.963 1.00 . A A . 19 VAL C 1 1 1 273 1 1 19 VAL CA C 1.026 -1.880 3.314 1.00 . A A . 19 VAL CA 1 1 1 274 1 1 19 VAL CB C 2.043 -1.965 2.137 1.00 . A A . 19 VAL CB 1 1 1 275 1 1 19 VAL CG1 C 2.200 -3.387 1.649 1.00 . A A . 19 VAL CG1 1 1 1 276 1 1 19 VAL CG2 C 1.630 -1.047 0.983 1.00 . A A . 19 VAL CG2 1 1 1 277 1 1 19 VAL H H -0.721 -1.437 2.360 1.00 . A A . 19 VAL H 1 1 1 278 1 1 19 VAL HA H 1.292 -2.613 4.060 1.00 . A A . 19 VAL HA 1 1 1 279 1 1 19 VAL HB H 3.009 -1.643 2.494 1.00 . A A . 19 VAL HB 1 1 1 280 1 1 19 VAL HG11 H 1.246 -3.783 1.332 1.00 . A A . 19 VAL HG11 1 1 1 281 1 1 19 VAL HG12 H 2.605 -3.986 2.451 1.00 . A A . 19 VAL HG12 1 1 1 282 1 1 19 VAL HG13 H 2.892 -3.391 0.821 1.00 . A A . 19 VAL HG13 1 1 1 283 1 1 19 VAL HG21 H 0.655 -1.329 0.609 1.00 . A A . 19 VAL HG21 1 1 1 284 1 1 19 VAL HG22 H 2.351 -1.130 0.186 1.00 . A A . 19 VAL HG22 1 1 1 285 1 1 19 VAL HG23 H 1.617 -0.024 1.331 1.00 . A A . 19 VAL HG23 1 1 1 286 1 1 19 VAL N N -0.343 -2.166 2.906 1.00 . A A . 19 VAL N 1 1 1 287 1 1 19 VAL O O 0.507 0.449 3.513 1.00 . A A . 19 VAL O 1 1 1 288 1 1 20 GLN C C 3.582 1.284 5.416 1.00 . A A . 20 GLN C 1 1 1 289 1 1 20 GLN CA C 2.166 0.841 5.724 1.00 . A A . 20 GLN CA 1 1 1 290 1 1 20 GLN CB C 2.012 0.661 7.243 1.00 . A A . 20 GLN CB 1 1 1 291 1 1 20 GLN CD C 2.153 1.750 9.538 1.00 . A A . 20 GLN CD 1 1 1 292 1 1 20 GLN CG C 2.237 1.945 8.036 1.00 . A A . 20 GLN CG 1 1 1 293 1 1 20 GLN H H 2.320 -1.233 5.354 1.00 . A A . 20 GLN H 1 1 1 294 1 1 20 GLN HA H 1.461 1.580 5.379 1.00 . A A . 20 GLN HA 1 1 1 295 1 1 20 GLN HB2 H 1.010 0.304 7.445 1.00 . A A . 20 GLN HB2 1 1 1 296 1 1 20 GLN HB3 H 2.732 -0.077 7.570 1.00 . A A . 20 GLN HB3 1 1 1 297 1 1 20 GLN HE21 H 3.445 3.211 9.822 1.00 . A A . 20 GLN HE21 1 1 1 298 1 1 20 GLN HE22 H 2.864 2.472 11.246 1.00 . A A . 20 GLN HE22 1 1 1 299 1 1 20 GLN HG2 H 3.222 2.326 7.803 1.00 . A A . 20 GLN HG2 1 1 1 300 1 1 20 GLN HG3 H 1.496 2.678 7.748 1.00 . A A . 20 GLN HG3 1 1 1 301 1 1 20 GLN N N 1.905 -0.413 5.020 1.00 . A A . 20 GLN N 1 1 1 302 1 1 20 GLN NE2 N 2.887 2.546 10.272 1.00 . A A . 20 GLN NE2 1 1 1 303 1 1 20 GLN O O 4.479 0.456 5.320 1.00 . A A . 20 GLN O 1 1 1 304 1 1 20 GLN OE1 O 1.443 0.884 10.032 1.00 . A A . 20 GLN OE1 1 1 1 305 1 1 21 CYS C C 5.727 3.450 6.358 1.00 . A A . 21 CYS C 1 1 1 306 1 1 21 CYS CA C 5.126 3.037 5.012 1.00 . A A . 21 CYS CA 1 1 1 307 1 1 21 CYS CB C 5.231 4.164 3.955 1.00 . A A . 21 CYS CB 1 1 1 308 1 1 21 CYS H H 3.005 3.162 5.193 1.00 . A A . 21 CYS H 1 1 1 309 1 1 21 CYS HA H 5.695 2.181 4.677 1.00 . A A . 21 CYS HA 1 1 1 310 1 1 21 CYS HB2 H 6.254 4.430 3.755 1.00 . A A . 21 CYS HB2 1 1 1 311 1 1 21 CYS HB3 H 4.786 3.810 3.040 1.00 . A A . 21 CYS HB3 1 1 1 312 1 1 21 CYS N N 3.783 2.565 5.205 1.00 . A A . 21 CYS N 1 1 1 313 1 1 21 CYS O O 5.455 4.554 6.891 1.00 . A A . 21 CYS O 1 1 1 314 1 1 21 CYS SG S 4.422 5.710 4.367 1.00 . A A . 21 CYS SG 1 1 1 315 1 1 22 ASP C C 8.415 3.663 8.149 1.00 . A A . 22 ASP C 1 1 1 316 1 1 22 ASP CA C 7.171 2.769 8.223 1.00 . A A . 22 ASP CA 1 1 1 317 1 1 22 ASP CB C 7.486 1.406 8.894 1.00 . A A . 22 ASP CB 1 1 1 318 1 1 22 ASP CG C 6.237 0.652 9.395 1.00 . A A . 22 ASP CG 1 1 1 319 1 1 22 ASP H H 6.798 1.806 6.340 1.00 . A A . 22 ASP H 1 1 1 320 1 1 22 ASP HA H 6.441 3.296 8.818 1.00 . A A . 22 ASP HA 1 1 1 321 1 1 22 ASP HB2 H 7.991 0.771 8.178 1.00 . A A . 22 ASP HB2 1 1 1 322 1 1 22 ASP HB3 H 8.148 1.577 9.729 1.00 . A A . 22 ASP HB3 1 1 1 323 1 1 22 ASP N N 6.557 2.588 6.890 1.00 . A A . 22 ASP N 1 1 1 324 1 1 22 ASP O O 9.269 3.657 9.033 1.00 . A A . 22 ASP O 1 1 1 325 1 1 22 ASP OD1 O 5.449 0.152 8.562 1.00 . A A . 22 ASP OD1 1 1 1 326 1 1 22 ASP OD2 O 6.040 0.571 10.633 1.00 . A A . 22 ASP OD2 1 1 1 327 1 1 23 GLY C C 9.265 6.791 7.511 1.00 . A A . 23 GLY C 1 1 1 328 1 1 23 GLY CA C 9.542 5.403 6.923 1.00 . A A . 23 GLY CA 1 1 1 329 1 1 23 GLY H H 7.663 4.494 6.543 1.00 . A A . 23 GLY H 1 1 1 330 1 1 23 GLY HA2 H 10.432 4.983 7.369 1.00 . A A . 23 GLY HA2 1 1 1 331 1 1 23 GLY HA3 H 9.700 5.507 5.859 1.00 . A A . 23 GLY HA3 1 1 1 332 1 1 23 GLY N N 8.447 4.502 7.122 1.00 . A A . 23 GLY N 1 1 1 333 1 1 23 GLY O O 10.128 7.667 7.480 1.00 . A A . 23 GLY O 1 1 1 334 1 1 24 GLY C C 6.326 8.833 8.445 1.00 . A A . 24 GLY C 1 1 1 335 1 1 24 GLY CA C 7.763 8.313 8.623 1.00 . A A . 24 GLY CA 1 1 1 336 1 1 24 GLY H H 7.375 6.302 8.050 1.00 . A A . 24 GLY H 1 1 1 337 1 1 24 GLY HA2 H 7.954 8.252 9.683 1.00 . A A . 24 GLY HA2 1 1 1 338 1 1 24 GLY HA3 H 8.440 9.040 8.198 1.00 . A A . 24 GLY HA3 1 1 1 339 1 1 24 GLY N N 8.051 7.011 8.032 1.00 . A A . 24 GLY N 1 1 1 340 1 1 24 GLY O O 5.909 9.725 9.187 1.00 . A A . 24 GLY O 1 1 1 341 1 1 25 CYS C C 3.214 7.996 8.102 1.00 . A A . 25 CYS C 1 1 1 342 1 1 25 CYS CA C 4.189 8.834 7.277 1.00 . A A . 25 CYS CA 1 1 1 343 1 1 25 CYS CB C 3.730 8.761 5.810 1.00 . A A . 25 CYS CB 1 1 1 344 1 1 25 CYS H H 5.914 7.616 6.878 1.00 . A A . 25 CYS H 1 1 1 345 1 1 25 CYS HA H 4.152 9.858 7.620 1.00 . A A . 25 CYS HA 1 1 1 346 1 1 25 CYS HB2 H 3.500 7.735 5.565 1.00 . A A . 25 CYS HB2 1 1 1 347 1 1 25 CYS HB3 H 2.834 9.351 5.691 1.00 . A A . 25 CYS HB3 1 1 1 348 1 1 25 CYS N N 5.567 8.317 7.461 1.00 . A A . 25 CYS N 1 1 1 349 1 1 25 CYS O O 2.218 8.506 8.623 1.00 . A A . 25 CYS O 1 1 1 350 1 1 25 CYS SG S 4.924 9.338 4.592 1.00 . A A . 25 CYS SG 1 1 1 351 1 1 26 ASP C C 1.326 5.530 8.227 1.00 . A A . 26 ASP C 1 1 1 352 1 1 26 ASP CA C 2.690 5.678 8.900 1.00 . A A . 26 ASP CA 1 1 1 353 1 1 26 ASP CB C 2.530 5.987 10.413 1.00 . A A . 26 ASP CB 1 1 1 354 1 1 26 ASP CG C 3.818 5.851 11.209 1.00 . A A . 26 ASP CG 1 1 1 355 1 1 26 ASP H H 4.408 6.426 7.849 1.00 . A A . 26 ASP H 1 1 1 356 1 1 26 ASP HA H 3.195 4.730 8.783 1.00 . A A . 26 ASP HA 1 1 1 357 1 1 26 ASP HB2 H 2.172 6.995 10.534 1.00 . A A . 26 ASP HB2 1 1 1 358 1 1 26 ASP HB3 H 1.805 5.298 10.816 1.00 . A A . 26 ASP HB3 1 1 1 359 1 1 26 ASP N N 3.534 6.686 8.205 1.00 . A A . 26 ASP N 1 1 1 360 1 1 26 ASP O O 0.372 5.022 8.821 1.00 . A A . 26 ASP O 1 1 1 361 1 1 26 ASP OD1 O 4.738 6.663 11.005 1.00 . A A . 26 ASP OD1 1 1 1 362 1 1 26 ASP OD2 O 3.905 4.928 12.072 1.00 . A A . 26 ASP OD2 1 1 1 363 1 1 27 GLU C C -0.091 4.503 5.528 1.00 . A A . 27 GLU C 1 1 1 364 1 1 27 GLU CA C 0.032 5.866 6.213 1.00 . A A . 27 GLU CA 1 1 1 365 1 1 27 GLU CB C -0.048 7.029 5.207 1.00 . A A . 27 GLU CB 1 1 1 366 1 1 27 GLU CD C -0.164 9.570 4.914 1.00 . A A . 27 GLU CD 1 1 1 367 1 1 27 GLU CG C -0.074 8.403 5.885 1.00 . A A . 27 GLU CG 1 1 1 368 1 1 27 GLU H H 2.056 6.278 6.527 1.00 . A A . 27 GLU H 1 1 1 369 1 1 27 GLU HA H -0.783 5.960 6.918 1.00 . A A . 27 GLU HA 1 1 1 370 1 1 27 GLU HB2 H 0.791 6.984 4.525 1.00 . A A . 27 GLU HB2 1 1 1 371 1 1 27 GLU HB3 H -0.957 6.928 4.635 1.00 . A A . 27 GLU HB3 1 1 1 372 1 1 27 GLU HG2 H -0.931 8.441 6.545 1.00 . A A . 27 GLU HG2 1 1 1 373 1 1 27 GLU HG3 H 0.822 8.519 6.476 1.00 . A A . 27 GLU HG3 1 1 1 374 1 1 27 GLU N N 1.255 5.935 6.970 1.00 . A A . 27 GLU N 1 1 1 375 1 1 27 GLU O O 0.906 3.795 5.349 1.00 . A A . 27 GLU O 1 1 1 376 1 1 27 GLU OE1 O 0.888 10.023 4.429 1.00 . A A . 27 GLU OE1 1 1 1 377 1 1 27 GLU OE2 O -1.291 10.048 4.645 1.00 . A A . 27 GLU OE2 1 1 1 378 1 1 28 TRP C C -1.923 2.945 3.100 1.00 . A A . 28 TRP C 1 1 1 379 1 1 28 TRP CA C -1.584 2.839 4.577 1.00 . A A . 28 TRP CA 1 1 1 380 1 1 28 TRP CB C -2.703 2.122 5.336 1.00 . A A . 28 TRP CB 1 1 1 381 1 1 28 TRP CD1 C -2.310 2.546 7.844 1.00 . A A . 28 TRP CD1 1 1 1 382 1 1 28 TRP CD2 C -1.921 0.443 7.180 1.00 . A A . 28 TRP CD2 1 1 1 383 1 1 28 TRP CE2 C -1.676 0.529 8.556 1.00 . A A . 28 TRP CE2 1 1 1 384 1 1 28 TRP CE3 C -1.747 -0.783 6.539 1.00 . A A . 28 TRP CE3 1 1 1 385 1 1 28 TRP CG C -2.329 1.738 6.737 1.00 . A A . 28 TRP CG 1 1 1 386 1 1 28 TRP CH2 C -1.097 -1.756 8.648 1.00 . A A . 28 TRP CH2 1 1 1 387 1 1 28 TRP CZ2 C -1.252 -0.567 9.303 1.00 . A A . 28 TRP CZ2 1 1 1 388 1 1 28 TRP CZ3 C -1.331 -1.869 7.280 1.00 . A A . 28 TRP CZ3 1 1 1 389 1 1 28 TRP H H -1.983 4.835 5.294 1.00 . A A . 28 TRP H 1 1 1 390 1 1 28 TRP HA H -0.681 2.252 4.662 1.00 . A A . 28 TRP HA 1 1 1 391 1 1 28 TRP HB2 H -3.569 2.767 5.392 1.00 . A A . 28 TRP HB2 1 1 1 392 1 1 28 TRP HB3 H -2.969 1.220 4.803 1.00 . A A . 28 TRP HB3 1 1 1 393 1 1 28 TRP HD1 H -2.567 3.594 7.846 1.00 . A A . 28 TRP HD1 1 1 1 394 1 1 28 TRP HE1 H -1.817 2.182 9.850 1.00 . A A . 28 TRP HE1 1 1 1 395 1 1 28 TRP HE3 H -1.927 -0.885 5.480 1.00 . A A . 28 TRP HE3 1 1 1 396 1 1 28 TRP HH2 H -0.767 -2.638 9.182 1.00 . A A . 28 TRP HH2 1 1 1 397 1 1 28 TRP HZ2 H -1.070 -0.489 10.364 1.00 . A A . 28 TRP HZ2 1 1 1 398 1 1 28 TRP HZ3 H -1.195 -2.827 6.803 1.00 . A A . 28 TRP HZ3 1 1 1 399 1 1 28 TRP N N -1.296 4.148 5.168 1.00 . A A . 28 TRP N 1 1 1 400 1 1 28 TRP NE1 N -1.914 1.827 8.940 1.00 . A A . 28 TRP NE1 1 1 1 401 1 1 28 TRP O O -2.763 3.754 2.691 1.00 . A A . 28 TRP O 1 1 1 402 1 1 29 PHE C C -1.920 0.743 0.418 1.00 . A A . 29 PHE C 1 1 1 403 1 1 29 PHE CA C -1.392 2.110 0.877 1.00 . A A . 29 PHE CA 1 1 1 404 1 1 29 PHE CB C 0.013 2.304 0.242 1.00 . A A . 29 PHE CB 1 1 1 405 1 1 29 PHE CD1 C 1.402 3.416 2.007 1.00 . A A . 29 PHE CD1 1 1 1 406 1 1 29 PHE CD2 C 0.915 4.653 0.052 1.00 . A A . 29 PHE CD2 1 1 1 407 1 1 29 PHE CE1 C 2.101 4.472 2.508 1.00 . A A . 29 PHE CE1 1 1 1 408 1 1 29 PHE CE2 C 1.622 5.721 0.548 1.00 . A A . 29 PHE CE2 1 1 1 409 1 1 29 PHE CG C 0.794 3.485 0.775 1.00 . A A . 29 PHE CG 1 1 1 410 1 1 29 PHE CZ C 2.217 5.625 1.783 1.00 . A A . 29 PHE CZ 1 1 1 411 1 1 29 PHE H H -0.626 1.508 2.744 1.00 . A A . 29 PHE H 1 1 1 412 1 1 29 PHE HA H -2.037 2.912 0.547 1.00 . A A . 29 PHE HA 1 1 1 413 1 1 29 PHE HB2 H 0.609 1.424 0.424 1.00 . A A . 29 PHE HB2 1 1 1 414 1 1 29 PHE HB3 H -0.102 2.434 -0.825 1.00 . A A . 29 PHE HB3 1 1 1 415 1 1 29 PHE HD1 H 1.314 2.505 2.576 1.00 . A A . 29 PHE HD1 1 1 1 416 1 1 29 PHE HD2 H 0.445 4.735 -0.919 1.00 . A A . 29 PHE HD2 1 1 1 417 1 1 29 PHE HE1 H 2.572 4.400 3.479 1.00 . A A . 29 PHE HE1 1 1 1 418 1 1 29 PHE HE2 H 1.712 6.633 -0.023 1.00 . A A . 29 PHE HE2 1 1 1 419 1 1 29 PHE HZ H 2.773 6.451 2.200 1.00 . A A . 29 PHE HZ 1 1 1 420 1 1 29 PHE N N -1.264 2.128 2.323 1.00 . A A . 29 PHE N 1 1 1 421 1 1 29 PHE O O -1.793 -0.269 1.128 1.00 . A A . 29 PHE O 1 1 1 422 1 1 30 HIS C C -1.814 -1.032 -2.254 1.00 . A A . 30 HIS C 1 1 1 423 1 1 30 HIS CA C -2.928 -0.557 -1.381 1.00 . A A . 30 HIS CA 1 1 1 424 1 1 30 HIS CB C -4.157 -0.394 -2.275 1.00 . A A . 30 HIS CB 1 1 1 425 1 1 30 HIS CD2 C -6.322 -1.186 -1.157 1.00 . A A . 30 HIS CD2 1 1 1 426 1 1 30 HIS CE1 C -7.306 0.751 -1.001 1.00 . A A . 30 HIS CE1 1 1 1 427 1 1 30 HIS CG C -5.464 -0.251 -1.623 1.00 . A A . 30 HIS CG 1 1 1 428 1 1 30 HIS H H -2.635 1.565 -1.215 1.00 . A A . 30 HIS H 1 1 1 429 1 1 30 HIS HA H -3.129 -1.287 -0.611 1.00 . A A . 30 HIS HA 1 1 1 430 1 1 30 HIS HB2 H -3.977 0.580 -2.707 1.00 . A A . 30 HIS HB2 1 1 1 431 1 1 30 HIS HB3 H -4.222 -1.061 -3.122 1.00 . A A . 30 HIS HB3 1 1 1 432 1 1 30 HIS HD2 H -6.141 -2.249 -1.104 1.00 . A A . 30 HIS HD2 1 1 1 433 1 1 30 HIS HE1 H -8.061 1.494 -0.805 1.00 . A A . 30 HIS HE1 1 1 1 434 1 1 30 HIS HE2 H -8.324 -1.006 -0.791 1.00 . A A . 30 HIS HE2 1 1 1 435 1 1 30 HIS N N -2.513 0.707 -0.757 1.00 . A A . 30 HIS N 1 1 1 436 1 1 30 HIS ND1 N -6.101 0.958 -1.517 1.00 . A A . 30 HIS ND1 1 1 1 437 1 1 30 HIS NE2 N -7.454 -0.543 -0.790 1.00 . A A . 30 HIS NE2 1 1 1 438 1 1 30 HIS O O -1.200 -0.227 -2.960 1.00 . A A . 30 HIS O 1 1 1 439 1 1 31 GLN C C -0.747 -2.647 -4.574 1.00 . A A . 31 GLN C 1 1 1 440 1 1 31 GLN CA C -0.515 -2.871 -3.061 1.00 . A A . 31 GLN CA 1 1 1 441 1 1 31 GLN CB C -0.233 -4.329 -2.693 1.00 . A A . 31 GLN CB 1 1 1 442 1 1 31 GLN CD C 0.584 -5.961 -0.917 1.00 . A A . 31 GLN CD 1 1 1 443 1 1 31 GLN CG C 0.341 -4.511 -1.287 1.00 . A A . 31 GLN CG 1 1 1 444 1 1 31 GLN H H -2.125 -2.887 -1.679 1.00 . A A . 31 GLN H 1 1 1 445 1 1 31 GLN HA H 0.355 -2.279 -2.820 1.00 . A A . 31 GLN HA 1 1 1 446 1 1 31 GLN HB2 H -1.154 -4.888 -2.755 1.00 . A A . 31 GLN HB2 1 1 1 447 1 1 31 GLN HB3 H 0.485 -4.722 -3.400 1.00 . A A . 31 GLN HB3 1 1 1 448 1 1 31 GLN HE21 H -1.172 -6.070 -0.022 1.00 . A A . 31 GLN HE21 1 1 1 449 1 1 31 GLN HE22 H -0.231 -7.515 -0.021 1.00 . A A . 31 GLN HE22 1 1 1 450 1 1 31 GLN HG2 H 1.289 -3.999 -1.240 1.00 . A A . 31 GLN HG2 1 1 1 451 1 1 31 GLN HG3 H -0.334 -4.071 -0.573 1.00 . A A . 31 GLN HG3 1 1 1 452 1 1 31 GLN N N -1.576 -2.310 -2.252 1.00 . A A . 31 GLN N 1 1 1 453 1 1 31 GLN NE2 N -0.362 -6.575 -0.259 1.00 . A A . 31 GLN NE2 1 1 1 454 1 1 31 GLN O O 0.170 -2.369 -5.297 1.00 . A A . 31 GLN O 1 1 1 455 1 1 31 GLN OE1 O 1.637 -6.506 -1.179 1.00 . A A . 31 GLN OE1 1 1 1 456 1 1 32 VAL C C -2.188 -0.891 -6.748 1.00 . A A . 32 VAL C 1 1 1 457 1 1 32 VAL CA C -2.245 -2.428 -6.442 1.00 . A A . 32 VAL CA 1 1 1 458 1 1 32 VAL CB C -3.619 -2.997 -6.886 1.00 . A A . 32 VAL CB 1 1 1 459 1 1 32 VAL CG1 C -4.716 -2.379 -6.065 1.00 . A A . 32 VAL CG1 1 1 1 460 1 1 32 VAL CG2 C -3.854 -2.718 -8.348 1.00 . A A . 32 VAL CG2 1 1 1 461 1 1 32 VAL H H -2.702 -2.992 -4.433 1.00 . A A . 32 VAL H 1 1 1 462 1 1 32 VAL HA H -1.471 -2.913 -7.019 1.00 . A A . 32 VAL HA 1 1 1 463 1 1 32 VAL HB H -3.641 -4.065 -6.730 1.00 . A A . 32 VAL HB 1 1 1 464 1 1 32 VAL HG11 H -5.687 -2.757 -6.346 1.00 . A A . 32 VAL HG11 1 1 1 465 1 1 32 VAL HG12 H -4.636 -1.317 -6.263 1.00 . A A . 32 VAL HG12 1 1 1 466 1 1 32 VAL HG13 H -4.493 -2.559 -5.025 1.00 . A A . 32 VAL HG13 1 1 1 467 1 1 32 VAL HG21 H -3.060 -3.155 -8.933 1.00 . A A . 32 VAL HG21 1 1 1 468 1 1 32 VAL HG22 H -3.822 -1.642 -8.448 1.00 . A A . 32 VAL HG22 1 1 1 469 1 1 32 VAL HG23 H -4.819 -3.100 -8.645 1.00 . A A . 32 VAL HG23 1 1 1 470 1 1 32 VAL N N -1.977 -2.714 -5.029 1.00 . A A . 32 VAL N 1 1 1 471 1 1 32 VAL O O -1.644 -0.466 -7.764 1.00 . A A . 32 VAL O 1 1 1 472 1 1 33 CYS C C -1.525 2.073 -5.996 1.00 . A A . 33 CYS C 1 1 1 473 1 1 33 CYS CA C -2.875 1.360 -6.067 1.00 . A A . 33 CYS CA 1 1 1 474 1 1 33 CYS CB C -3.953 2.014 -5.134 1.00 . A A . 33 CYS CB 1 1 1 475 1 1 33 CYS H H -3.026 -0.581 -5.046 1.00 . A A . 33 CYS H 1 1 1 476 1 1 33 CYS HA H -3.188 1.509 -7.090 1.00 . A A . 33 CYS HA 1 1 1 477 1 1 33 CYS HB2 H -4.317 2.927 -5.552 1.00 . A A . 33 CYS HB2 1 1 1 478 1 1 33 CYS HB3 H -4.785 1.328 -5.079 1.00 . A A . 33 CYS HB3 1 1 1 479 1 1 33 CYS N N -2.740 -0.082 -5.833 1.00 . A A . 33 CYS N 1 1 1 480 1 1 33 CYS O O -1.291 3.025 -6.723 1.00 . A A . 33 CYS O 1 1 1 481 1 1 33 CYS SG S -3.460 2.371 -3.448 1.00 . A A . 33 CYS SG 1 1 1 482 1 1 34 VAL C C 1.761 1.361 -5.723 1.00 . A A . 34 VAL C 1 1 1 483 1 1 34 VAL CA C 0.662 2.205 -5.016 1.00 . A A . 34 VAL CA 1 1 1 484 1 1 34 VAL CB C 1.012 2.381 -3.528 1.00 . A A . 34 VAL CB 1 1 1 485 1 1 34 VAL CG1 C 1.703 1.181 -2.937 1.00 . A A . 34 VAL CG1 1 1 1 486 1 1 34 VAL CG2 C 1.712 3.674 -3.304 1.00 . A A . 34 VAL CG2 1 1 1 487 1 1 34 VAL H H -0.785 0.836 -4.543 1.00 . A A . 34 VAL H 1 1 1 488 1 1 34 VAL HA H 0.607 3.180 -5.477 1.00 . A A . 34 VAL HA 1 1 1 489 1 1 34 VAL HB H 0.121 2.374 -2.922 1.00 . A A . 34 VAL HB 1 1 1 490 1 1 34 VAL HG11 H 2.632 1.049 -3.471 1.00 . A A . 34 VAL HG11 1 1 1 491 1 1 34 VAL HG12 H 1.086 0.299 -3.068 1.00 . A A . 34 VAL HG12 1 1 1 492 1 1 34 VAL HG13 H 1.901 1.346 -1.891 1.00 . A A . 34 VAL HG13 1 1 1 493 1 1 34 VAL HG21 H 1.015 4.446 -3.604 1.00 . A A . 34 VAL HG21 1 1 1 494 1 1 34 VAL HG22 H 2.597 3.713 -3.920 1.00 . A A . 34 VAL HG22 1 1 1 495 1 1 34 VAL HG23 H 1.958 3.761 -2.259 1.00 . A A . 34 VAL HG23 1 1 1 496 1 1 34 VAL N N -0.620 1.585 -5.147 1.00 . A A . 34 VAL N 1 1 1 497 1 1 34 VAL O O 2.945 1.730 -5.734 1.00 . A A . 34 VAL O 1 1 1 498 1 1 35 GLY C C 3.290 -1.369 -6.069 1.00 . A A . 35 GLY C 1 1 1 499 1 1 35 GLY CA C 2.293 -0.636 -7.014 1.00 . A A . 35 GLY CA 1 1 1 500 1 1 35 GLY H H 0.361 0.224 -6.473 1.00 . A A . 35 GLY H 1 1 1 501 1 1 35 GLY HA2 H 1.726 -1.383 -7.552 1.00 . A A . 35 GLY HA2 1 1 1 502 1 1 35 GLY HA3 H 2.857 -0.056 -7.730 1.00 . A A . 35 GLY HA3 1 1 1 503 1 1 35 GLY N N 1.339 0.283 -6.365 1.00 . A A . 35 GLY N 1 1 1 504 1 1 35 GLY O O 4.486 -1.064 -6.049 1.00 . A A . 35 GLY O 1 1 1 505 1 1 36 VAL C C 3.115 -4.626 -4.784 1.00 . A A . 36 VAL C 1 1 1 506 1 1 36 VAL CA C 3.557 -3.208 -4.460 1.00 . A A . 36 VAL CA 1 1 1 507 1 1 36 VAL CB C 3.251 -2.937 -2.947 1.00 . A A . 36 VAL CB 1 1 1 508 1 1 36 VAL CG1 C 3.904 -3.973 -2.025 1.00 . A A . 36 VAL CG1 1 1 1 509 1 1 36 VAL CG2 C 3.646 -1.538 -2.547 1.00 . A A . 36 VAL CG2 1 1 1 510 1 1 36 VAL H H 1.835 -2.562 -5.287 1.00 . A A . 36 VAL H 1 1 1 511 1 1 36 VAL HA H 4.612 -3.091 -4.658 1.00 . A A . 36 VAL HA 1 1 1 512 1 1 36 VAL HB H 2.184 -3.037 -2.831 1.00 . A A . 36 VAL HB 1 1 1 513 1 1 36 VAL HG11 H 4.959 -4.096 -2.226 1.00 . A A . 36 VAL HG11 1 1 1 514 1 1 36 VAL HG12 H 3.394 -4.918 -2.140 1.00 . A A . 36 VAL HG12 1 1 1 515 1 1 36 VAL HG13 H 3.769 -3.676 -0.999 1.00 . A A . 36 VAL HG13 1 1 1 516 1 1 36 VAL HG21 H 4.686 -1.349 -2.775 1.00 . A A . 36 VAL HG21 1 1 1 517 1 1 36 VAL HG22 H 3.478 -1.404 -1.490 1.00 . A A . 36 VAL HG22 1 1 1 518 1 1 36 VAL HG23 H 2.992 -0.842 -3.057 1.00 . A A . 36 VAL HG23 1 1 1 519 1 1 36 VAL N N 2.789 -2.326 -5.325 1.00 . A A . 36 VAL N 1 1 1 520 1 1 36 VAL O O 1.954 -4.848 -5.109 1.00 . A A . 36 VAL O 1 1 1 521 1 1 37 SER C C 3.468 -7.608 -3.585 1.00 . A A . 37 SER C 1 1 1 522 1 1 37 SER CA C 3.659 -6.941 -4.948 1.00 . A A . 37 SER CA 1 1 1 523 1 1 37 SER CB C 4.775 -7.632 -5.744 1.00 . A A . 37 SER CB 1 1 1 524 1 1 37 SER H H 4.965 -5.493 -4.496 1.00 . A A . 37 SER H 1 1 1 525 1 1 37 SER HA H 2.742 -6.963 -5.511 1.00 . A A . 37 SER HA 1 1 1 526 1 1 37 SER HB2 H 4.540 -8.681 -5.847 1.00 . A A . 37 SER HB2 1 1 1 527 1 1 37 SER HB3 H 4.837 -7.166 -6.716 1.00 . A A . 37 SER HB3 1 1 1 528 1 1 37 SER HG H 6.699 -7.972 -5.577 1.00 . A A . 37 SER HG 1 1 1 529 1 1 37 SER N N 4.018 -5.577 -4.724 1.00 . A A . 37 SER N 1 1 1 530 1 1 37 SER O O 4.121 -7.202 -2.614 1.00 . A A . 37 SER O 1 1 1 531 1 1 37 SER OG O 6.022 -7.497 -5.080 1.00 . A A . 37 SER OG 1 1 1 532 1 1 38 PRO C C 3.614 -9.925 -1.581 1.00 . A A . 38 PRO C 1 1 1 533 1 1 38 PRO CA C 2.327 -9.335 -2.186 1.00 . A A . 38 PRO CA 1 1 1 534 1 1 38 PRO CB C 1.339 -10.460 -2.582 1.00 . A A . 38 PRO CB 1 1 1 535 1 1 38 PRO CD C 1.795 -9.227 -4.565 1.00 . A A . 38 PRO CD 1 1 1 536 1 1 38 PRO CG C 1.505 -10.602 -4.056 1.00 . A A . 38 PRO CG 1 1 1 537 1 1 38 PRO HA H 1.873 -8.669 -1.470 1.00 . A A . 38 PRO HA 1 1 1 538 1 1 38 PRO HB2 H 1.595 -11.368 -2.058 1.00 . A A . 38 PRO HB2 1 1 1 539 1 1 38 PRO HB3 H 0.331 -10.174 -2.329 1.00 . A A . 38 PRO HB3 1 1 1 540 1 1 38 PRO HD2 H 2.369 -9.276 -5.479 1.00 . A A . 38 PRO HD2 1 1 1 541 1 1 38 PRO HD3 H 0.881 -8.670 -4.706 1.00 . A A . 38 PRO HD3 1 1 1 542 1 1 38 PRO HG2 H 2.352 -11.245 -4.242 1.00 . A A . 38 PRO HG2 1 1 1 543 1 1 38 PRO HG3 H 0.613 -11.011 -4.504 1.00 . A A . 38 PRO HG3 1 1 1 544 1 1 38 PRO N N 2.596 -8.645 -3.475 1.00 . A A . 38 PRO N 1 1 1 545 1 1 38 PRO O O 3.723 -10.132 -0.378 1.00 . A A . 38 PRO O 1 1 1 546 1 1 39 GLU C C 6.686 -9.636 -1.296 1.00 . A A . 39 GLU C 1 1 1 547 1 1 39 GLU CA C 5.863 -10.691 -2.067 1.00 . A A . 39 GLU CA 1 1 1 548 1 1 39 GLU CB C 6.594 -11.119 -3.334 1.00 . A A . 39 GLU CB 1 1 1 549 1 1 39 GLU CD C 8.581 -12.128 -4.441 1.00 . A A . 39 GLU CD 1 1 1 550 1 1 39 GLU CG C 7.936 -11.792 -3.125 1.00 . A A . 39 GLU CG 1 1 1 551 1 1 39 GLU H H 4.458 -9.842 -3.365 1.00 . A A . 39 GLU H 1 1 1 552 1 1 39 GLU HA H 5.696 -11.553 -1.443 1.00 . A A . 39 GLU HA 1 1 1 553 1 1 39 GLU HB2 H 5.958 -11.792 -3.889 1.00 . A A . 39 GLU HB2 1 1 1 554 1 1 39 GLU HB3 H 6.748 -10.229 -3.922 1.00 . A A . 39 GLU HB3 1 1 1 555 1 1 39 GLU HG2 H 8.581 -11.115 -2.582 1.00 . A A . 39 GLU HG2 1 1 1 556 1 1 39 GLU HG3 H 7.804 -12.700 -2.554 1.00 . A A . 39 GLU HG3 1 1 1 557 1 1 39 GLU N N 4.594 -10.134 -2.441 1.00 . A A . 39 GLU N 1 1 1 558 1 1 39 GLU O O 7.398 -9.961 -0.339 1.00 . A A . 39 GLU O 1 1 1 559 1 1 39 GLU OE1 O 8.209 -13.147 -5.058 1.00 . A A . 39 GLU OE1 1 1 1 560 1 1 39 GLU OE2 O 9.413 -11.353 -4.912 1.00 . A A . 39 GLU OE2 1 1 1 561 1 1 40 MET C C 6.801 -7.008 0.296 1.00 . A A . 40 MET C 1 1 1 562 1 1 40 MET CA C 7.314 -7.284 -1.091 1.00 . A A . 40 MET CA 1 1 1 563 1 1 40 MET CB C 7.277 -5.985 -1.926 1.00 . A A . 40 MET CB 1 1 1 564 1 1 40 MET CE C 7.024 -2.888 -2.930 1.00 . A A . 40 MET CE 1 1 1 565 1 1 40 MET CG C 8.231 -4.909 -1.384 1.00 . A A . 40 MET CG 1 1 1 566 1 1 40 MET H H 5.870 -8.136 -2.382 1.00 . A A . 40 MET H 1 1 1 567 1 1 40 MET HA H 8.335 -7.624 -1.021 1.00 . A A . 40 MET HA 1 1 1 568 1 1 40 MET HB2 H 7.335 -6.114 -2.993 1.00 . A A . 40 MET HB2 1 1 1 569 1 1 40 MET HB3 H 6.284 -5.588 -1.767 1.00 . A A . 40 MET HB3 1 1 1 570 1 1 40 MET HE1 H 6.551 -2.555 -2.018 1.00 . A A . 40 MET HE1 1 1 1 571 1 1 40 MET HE2 H 6.415 -3.653 -3.387 1.00 . A A . 40 MET HE2 1 1 1 572 1 1 40 MET HE3 H 7.124 -2.053 -3.607 1.00 . A A . 40 MET HE3 1 1 1 573 1 1 40 MET HG2 H 7.738 -4.469 -0.530 1.00 . A A . 40 MET HG2 1 1 1 574 1 1 40 MET HG3 H 9.152 -5.373 -1.062 1.00 . A A . 40 MET HG3 1 1 1 575 1 1 40 MET N N 6.539 -8.351 -1.697 1.00 . A A . 40 MET N 1 1 1 576 1 1 40 MET O O 7.570 -6.790 1.213 1.00 . A A . 40 MET O 1 1 1 577 1 1 40 MET SD S 8.622 -3.567 -2.556 1.00 . A A . 40 MET SD 1 1 1 578 1 1 41 ALA C C 5.286 -7.703 2.823 1.00 . A A . 41 ALA C 1 1 1 579 1 1 41 ALA CA C 4.801 -6.794 1.676 1.00 . A A . 41 ALA CA 1 1 1 580 1 1 41 ALA CB C 3.288 -6.913 1.473 1.00 . A A . 41 ALA CB 1 1 1 581 1 1 41 ALA H H 4.958 -7.275 -0.367 1.00 . A A . 41 ALA H 1 1 1 582 1 1 41 ALA HA H 5.025 -5.771 1.926 1.00 . A A . 41 ALA HA 1 1 1 583 1 1 41 ALA HB1 H 2.748 -6.633 2.370 1.00 . A A . 41 ALA HB1 1 1 1 584 1 1 41 ALA HB2 H 3.033 -7.927 1.211 1.00 . A A . 41 ALA HB2 1 1 1 585 1 1 41 ALA HB3 H 2.987 -6.268 0.656 1.00 . A A . 41 ALA HB3 1 1 1 586 1 1 41 ALA N N 5.490 -7.066 0.422 1.00 . A A . 41 ALA N 1 1 1 587 1 1 41 ALA O O 5.547 -7.233 3.915 1.00 . A A . 41 ALA O 1 1 1 588 1 1 42 GLU C C 7.390 -10.008 3.757 1.00 . A A . 42 GLU C 1 1 1 589 1 1 42 GLU CA C 5.849 -9.936 3.595 1.00 . A A . 42 GLU CA 1 1 1 590 1 1 42 GLU CB C 5.291 -11.346 3.350 1.00 . A A . 42 GLU CB 1 1 1 591 1 1 42 GLU CD C 3.263 -12.859 3.198 1.00 . A A . 42 GLU CD 1 1 1 592 1 1 42 GLU CG C 3.762 -11.437 3.359 1.00 . A A . 42 GLU CG 1 1 1 593 1 1 42 GLU H H 5.135 -9.268 1.656 1.00 . A A . 42 GLU H 1 1 1 594 1 1 42 GLU HA H 5.444 -9.580 4.532 1.00 . A A . 42 GLU HA 1 1 1 595 1 1 42 GLU HB2 H 5.662 -11.699 2.400 1.00 . A A . 42 GLU HB2 1 1 1 596 1 1 42 GLU HB3 H 5.673 -12.011 4.112 1.00 . A A . 42 GLU HB3 1 1 1 597 1 1 42 GLU HG2 H 3.390 -11.046 4.294 1.00 . A A . 42 GLU HG2 1 1 1 598 1 1 42 GLU HG3 H 3.362 -10.845 2.550 1.00 . A A . 42 GLU HG3 1 1 1 599 1 1 42 GLU N N 5.403 -8.994 2.557 1.00 . A A . 42 GLU N 1 1 1 600 1 1 42 GLU O O 7.880 -10.489 4.767 1.00 . A A . 42 GLU O 1 1 1 601 1 1 42 GLU OE1 O 3.207 -13.362 2.064 1.00 . A A . 42 GLU OE1 1 1 1 602 1 1 42 GLU OE2 O 2.962 -13.521 4.229 1.00 . A A . 42 GLU OE2 1 1 1 603 1 1 43 ASN C C 10.396 -8.444 3.050 1.00 . A A . 43 ASN C 1 1 1 604 1 1 43 ASN CA C 9.588 -9.730 2.860 1.00 . A A . 43 ASN CA 1 1 1 605 1 1 43 ASN CB C 10.097 -10.500 1.649 1.00 . A A . 43 ASN CB 1 1 1 606 1 1 43 ASN CG C 9.651 -11.940 1.596 1.00 . A A . 43 ASN CG 1 1 1 607 1 1 43 ASN H H 7.764 -9.072 2.025 1.00 . A A . 43 ASN H 1 1 1 608 1 1 43 ASN HA H 9.765 -10.354 3.723 1.00 . A A . 43 ASN HA 1 1 1 609 1 1 43 ASN HB2 H 9.736 -10.013 0.756 1.00 . A A . 43 ASN HB2 1 1 1 610 1 1 43 ASN HB3 H 11.170 -10.479 1.633 1.00 . A A . 43 ASN HB3 1 1 1 611 1 1 43 ASN HD21 H 8.098 -11.446 0.490 1.00 . A A . 43 ASN HD21 1 1 1 612 1 1 43 ASN HD22 H 8.309 -13.122 0.900 1.00 . A A . 43 ASN HD22 1 1 1 613 1 1 43 ASN N N 8.146 -9.544 2.790 1.00 . A A . 43 ASN N 1 1 1 614 1 1 43 ASN ND2 N 8.576 -12.185 0.928 1.00 . A A . 43 ASN ND2 1 1 1 615 1 1 43 ASN O O 11.459 -8.477 3.663 1.00 . A A . 43 ASN O 1 1 1 616 1 1 43 ASN OD1 O 10.303 -12.823 2.136 1.00 . A A . 43 ASN OD1 1 1 1 617 1 1 44 GLU C C 9.926 -4.964 3.336 1.00 . A A . 44 GLU C 1 1 1 618 1 1 44 GLU CA C 10.679 -6.077 2.627 1.00 . A A . 44 GLU CA 1 1 1 619 1 1 44 GLU CB C 11.120 -5.581 1.239 1.00 . A A . 44 GLU CB 1 1 1 620 1 1 44 GLU CD C 12.526 -5.839 -0.835 1.00 . A A . 44 GLU CD 1 1 1 621 1 1 44 GLU CG C 12.157 -6.430 0.519 1.00 . A A . 44 GLU CG 1 1 1 622 1 1 44 GLU H H 9.008 -7.282 2.166 1.00 . A A . 44 GLU H 1 1 1 623 1 1 44 GLU HA H 11.568 -6.291 3.205 1.00 . A A . 44 GLU HA 1 1 1 624 1 1 44 GLU HB2 H 10.240 -5.534 0.615 1.00 . A A . 44 GLU HB2 1 1 1 625 1 1 44 GLU HB3 H 11.514 -4.583 1.355 1.00 . A A . 44 GLU HB3 1 1 1 626 1 1 44 GLU HG2 H 13.044 -6.483 1.133 1.00 . A A . 44 GLU HG2 1 1 1 627 1 1 44 GLU HG3 H 11.755 -7.420 0.369 1.00 . A A . 44 GLU HG3 1 1 1 628 1 1 44 GLU N N 9.911 -7.323 2.554 1.00 . A A . 44 GLU N 1 1 1 629 1 1 44 GLU O O 8.723 -5.062 3.597 1.00 . A A . 44 GLU O 1 1 1 630 1 1 44 GLU OE1 O 13.218 -4.789 -0.869 1.00 . A A . 44 GLU OE1 1 1 1 631 1 1 44 GLU OE2 O 12.115 -6.403 -1.859 1.00 . A A . 44 GLU OE2 1 1 1 632 1 1 45 ASP C C 9.652 -1.718 3.256 1.00 . A A . 45 ASP C 1 1 1 633 1 1 45 ASP CA C 10.152 -2.718 4.307 1.00 . A A . 45 ASP CA 1 1 1 634 1 1 45 ASP CB C 11.309 -2.107 5.104 1.00 . A A . 45 ASP CB 1 1 1 635 1 1 45 ASP CG C 10.913 -0.948 5.977 1.00 . A A . 45 ASP CG 1 1 1 636 1 1 45 ASP H H 11.613 -3.931 3.394 1.00 . A A . 45 ASP H 1 1 1 637 1 1 45 ASP HA H 9.351 -2.979 4.983 1.00 . A A . 45 ASP HA 1 1 1 638 1 1 45 ASP HB2 H 11.738 -2.869 5.736 1.00 . A A . 45 ASP HB2 1 1 1 639 1 1 45 ASP HB3 H 12.055 -1.766 4.403 1.00 . A A . 45 ASP HB3 1 1 1 640 1 1 45 ASP N N 10.662 -3.911 3.632 1.00 . A A . 45 ASP N 1 1 1 641 1 1 45 ASP O O 10.431 -1.251 2.418 1.00 . A A . 45 ASP O 1 1 1 642 1 1 45 ASP OD1 O 10.393 -1.206 7.082 1.00 . A A . 45 ASP OD1 1 1 1 643 1 1 45 ASP OD2 O 11.166 0.206 5.588 1.00 . A A . 45 ASP OD2 1 1 1 644 1 1 46 TYR C C 7.983 0.967 2.594 1.00 . A A . 46 TYR C 1 1 1 645 1 1 46 TYR CA C 7.780 -0.537 2.280 1.00 . A A . 46 TYR CA 1 1 1 646 1 1 46 TYR CB C 6.292 -0.852 1.944 1.00 . A A . 46 TYR CB 1 1 1 647 1 1 46 TYR CD1 C 6.299 0.115 -0.400 1.00 . A A . 46 TYR CD1 1 1 1 648 1 1 46 TYR CD2 C 4.683 0.956 1.135 1.00 . A A . 46 TYR CD2 1 1 1 649 1 1 46 TYR CE1 C 5.849 0.993 -1.361 1.00 . A A . 46 TYR CE1 1 1 1 650 1 1 46 TYR CE2 C 4.211 1.834 0.154 1.00 . A A . 46 TYR CE2 1 1 1 651 1 1 46 TYR CG C 5.735 0.082 0.867 1.00 . A A . 46 TYR CG 1 1 1 652 1 1 46 TYR CZ C 4.811 1.845 -1.085 1.00 . A A . 46 TYR CZ 1 1 1 653 1 1 46 TYR H H 7.815 -1.926 3.917 1.00 . A A . 46 TYR H 1 1 1 654 1 1 46 TYR HA H 8.358 -0.728 1.387 1.00 . A A . 46 TYR HA 1 1 1 655 1 1 46 TYR HB2 H 6.204 -1.859 1.571 1.00 . A A . 46 TYR HB2 1 1 1 656 1 1 46 TYR HB3 H 5.684 -0.746 2.832 1.00 . A A . 46 TYR HB3 1 1 1 657 1 1 46 TYR HD1 H 7.107 -0.556 -0.643 1.00 . A A . 46 TYR HD1 1 1 1 658 1 1 46 TYR HD2 H 4.239 0.914 2.120 1.00 . A A . 46 TYR HD2 1 1 1 659 1 1 46 TYR HE1 H 6.293 1.006 -2.345 1.00 . A A . 46 TYR HE1 1 1 1 660 1 1 46 TYR HE2 H 3.384 2.511 0.330 1.00 . A A . 46 TYR HE2 1 1 1 661 1 1 46 TYR HH H 4.307 2.276 -2.882 1.00 . A A . 46 TYR HH 1 1 1 662 1 1 46 TYR N N 8.354 -1.445 3.257 1.00 . A A . 46 TYR N 1 1 1 663 1 1 46 TYR O O 7.369 1.543 3.496 1.00 . A A . 46 TYR O 1 1 1 664 1 1 46 TYR OH O 4.395 2.739 -2.045 1.00 . A A . 46 TYR OH 1 1 1 665 1 1 47 ILE C C 8.183 3.606 0.732 1.00 . A A . 47 ILE C 1 1 1 666 1 1 47 ILE CA C 9.065 2.990 1.824 1.00 . A A . 47 ILE CA 1 1 1 667 1 1 47 ILE CB C 10.567 3.327 1.549 1.00 . A A . 47 ILE CB 1 1 1 668 1 1 47 ILE CD1 C 11.215 3.031 4.013 1.00 . A A . 47 ILE CD1 1 1 1 669 1 1 47 ILE CG1 C 11.479 2.623 2.568 1.00 . A A . 47 ILE CG1 1 1 1 670 1 1 47 ILE CG2 C 10.803 4.823 1.601 1.00 . A A . 47 ILE CG2 1 1 1 671 1 1 47 ILE H H 9.264 0.918 1.210 1.00 . A A . 47 ILE H 1 1 1 672 1 1 47 ILE HA H 8.764 3.368 2.792 1.00 . A A . 47 ILE HA 1 1 1 673 1 1 47 ILE HB H 10.823 2.982 0.559 1.00 . A A . 47 ILE HB 1 1 1 674 1 1 47 ILE HD11 H 11.330 4.103 4.101 1.00 . A A . 47 ILE HD11 1 1 1 675 1 1 47 ILE HD12 H 11.900 2.525 4.676 1.00 . A A . 47 ILE HD12 1 1 1 676 1 1 47 ILE HD13 H 10.202 2.760 4.269 1.00 . A A . 47 ILE HD13 1 1 1 677 1 1 47 ILE HG12 H 11.344 1.553 2.500 1.00 . A A . 47 ILE HG12 1 1 1 678 1 1 47 ILE HG13 H 12.507 2.864 2.339 1.00 . A A . 47 ILE HG13 1 1 1 679 1 1 47 ILE HG21 H 11.855 5.036 1.463 1.00 . A A . 47 ILE HG21 1 1 1 680 1 1 47 ILE HG22 H 10.465 5.158 2.575 1.00 . A A . 47 ILE HG22 1 1 1 681 1 1 47 ILE HG23 H 10.219 5.312 0.833 1.00 . A A . 47 ILE HG23 1 1 1 682 1 1 47 ILE N N 8.830 1.566 1.801 1.00 . A A . 47 ILE N 1 1 1 683 1 1 47 ILE O O 8.037 3.016 -0.325 1.00 . A A . 47 ILE O 1 1 1 684 1 1 48 CYS C C 7.400 6.457 -0.782 1.00 . A A . 48 CYS C 1 1 1 685 1 1 48 CYS CA C 6.685 5.344 -0.036 1.00 . A A . 48 CYS CA 1 1 1 686 1 1 48 CYS CB C 5.446 5.958 0.614 1.00 . A A . 48 CYS CB 1 1 1 687 1 1 48 CYS H H 7.747 5.357 1.737 1.00 . A A . 48 CYS H 1 1 1 688 1 1 48 CYS HA H 6.390 4.565 -0.723 1.00 . A A . 48 CYS HA 1 1 1 689 1 1 48 CYS HB2 H 4.702 6.100 -0.159 1.00 . A A . 48 CYS HB2 1 1 1 690 1 1 48 CYS HB3 H 5.054 5.291 1.363 1.00 . A A . 48 CYS HB3 1 1 1 691 1 1 48 CYS N N 7.592 4.781 0.967 1.00 . A A . 48 CYS N 1 1 1 692 1 1 48 CYS O O 8.516 6.827 -0.423 1.00 . A A . 48 CYS O 1 1 1 693 1 1 48 CYS SG S 5.739 7.577 1.386 1.00 . A A . 48 CYS SG 1 1 1 694 1 1 49 ILE C C 7.613 9.346 -1.667 1.00 . A A . 49 ILE C 1 1 1 695 1 1 49 ILE CA C 7.215 8.127 -2.550 1.00 . A A . 49 ILE CA 1 1 1 696 1 1 49 ILE CB C 6.187 8.542 -3.636 1.00 . A A . 49 ILE CB 1 1 1 697 1 1 49 ILE CD1 C 5.886 10.062 -5.629 1.00 . A A . 49 ILE CD1 1 1 1 698 1 1 49 ILE CG1 C 6.752 9.666 -4.475 1.00 . A A . 49 ILE CG1 1 1 1 699 1 1 49 ILE CG2 C 4.832 8.924 -3.031 1.00 . A A . 49 ILE CG2 1 1 1 700 1 1 49 ILE H H 5.848 6.627 -1.979 1.00 . A A . 49 ILE H 1 1 1 701 1 1 49 ILE HA H 8.104 7.791 -3.062 1.00 . A A . 49 ILE HA 1 1 1 702 1 1 49 ILE HB H 6.020 7.690 -4.279 1.00 . A A . 49 ILE HB 1 1 1 703 1 1 49 ILE HD11 H 4.923 10.387 -5.267 1.00 . A A . 49 ILE HD11 1 1 1 704 1 1 49 ILE HD12 H 5.770 9.184 -6.247 1.00 . A A . 49 ILE HD12 1 1 1 705 1 1 49 ILE HD13 H 6.381 10.848 -6.181 1.00 . A A . 49 ILE HD13 1 1 1 706 1 1 49 ILE HG12 H 6.876 10.514 -3.817 1.00 . A A . 49 ILE HG12 1 1 1 707 1 1 49 ILE HG13 H 7.720 9.360 -4.850 1.00 . A A . 49 ILE HG13 1 1 1 708 1 1 49 ILE HG21 H 4.979 9.759 -2.362 1.00 . A A . 49 ILE HG21 1 1 1 709 1 1 49 ILE HG22 H 4.422 8.093 -2.477 1.00 . A A . 49 ILE HG22 1 1 1 710 1 1 49 ILE HG23 H 4.158 9.211 -3.824 1.00 . A A . 49 ILE HG23 1 1 1 711 1 1 49 ILE N N 6.717 7.020 -1.766 1.00 . A A . 49 ILE N 1 1 1 712 1 1 49 ILE O O 8.628 9.992 -1.904 1.00 . A A . 49 ILE O 1 1 1 713 1 1 50 ASN C C 8.226 10.426 1.267 1.00 . A A . 50 ASN C 1 1 1 714 1 1 50 ASN CA C 7.091 10.740 0.287 1.00 . A A . 50 ASN CA 1 1 1 715 1 1 50 ASN CB C 5.817 11.145 1.051 1.00 . A A . 50 ASN CB 1 1 1 716 1 1 50 ASN CG C 4.734 11.708 0.147 1.00 . A A . 50 ASN CG 1 1 1 717 1 1 50 ASN H H 6.071 9.022 -0.450 1.00 . A A . 50 ASN H 1 1 1 718 1 1 50 ASN HA H 7.403 11.564 -0.336 1.00 . A A . 50 ASN HA 1 1 1 719 1 1 50 ASN HB2 H 5.427 10.271 1.544 1.00 . A A . 50 ASN HB2 1 1 1 720 1 1 50 ASN HB3 H 6.065 11.889 1.793 1.00 . A A . 50 ASN HB3 1 1 1 721 1 1 50 ASN HD21 H 5.373 13.559 0.480 1.00 . A A . 50 ASN HD21 1 1 1 722 1 1 50 ASN HD22 H 4.008 13.392 -0.571 1.00 . A A . 50 ASN HD22 1 1 1 723 1 1 50 ASN N N 6.837 9.606 -0.623 1.00 . A A . 50 ASN N 1 1 1 724 1 1 50 ASN ND2 N 4.706 13.017 0.005 1.00 . A A . 50 ASN ND2 1 1 1 725 1 1 50 ASN O O 9.001 11.298 1.623 1.00 . A A . 50 ASN O 1 1 1 726 1 1 50 ASN OD1 O 3.922 10.970 -0.405 1.00 . A A . 50 ASN OD1 1 1 1 727 1 1 51 CYS C C 10.737 8.687 1.773 1.00 . A A . 51 CYS C 1 1 1 728 1 1 51 CYS CA C 9.407 8.732 2.549 1.00 . A A . 51 CYS CA 1 1 1 729 1 1 51 CYS CB C 9.127 7.334 3.145 1.00 . A A . 51 CYS CB 1 1 1 730 1 1 51 CYS H H 7.645 8.538 1.351 1.00 . A A . 51 CYS H 1 1 1 731 1 1 51 CYS HA H 9.486 9.450 3.354 1.00 . A A . 51 CYS HA 1 1 1 732 1 1 51 CYS HB2 H 8.798 6.689 2.344 1.00 . A A . 51 CYS HB2 1 1 1 733 1 1 51 CYS HB3 H 10.059 6.947 3.532 1.00 . A A . 51 CYS HB3 1 1 1 734 1 1 51 CYS N N 8.324 9.169 1.673 1.00 . A A . 51 CYS N 1 1 1 735 1 1 51 CYS O O 11.807 8.907 2.323 1.00 . A A . 51 CYS O 1 1 1 736 1 1 51 CYS SG S 7.872 7.200 4.458 1.00 . A A . 51 CYS SG 1 1 1 737 1 1 52 ALA C C 12.400 9.632 -0.788 1.00 . A A . 52 ALA C 1 1 1 738 1 1 52 ALA CA C 11.827 8.277 -0.351 1.00 . A A . 52 ALA CA 1 1 1 739 1 1 52 ALA CB C 11.504 7.409 -1.552 1.00 . A A . 52 ALA CB 1 1 1 740 1 1 52 ALA H H 9.731 8.393 0.116 1.00 . A A . 52 ALA H 1 1 1 741 1 1 52 ALA HA H 12.575 7.773 0.243 1.00 . A A . 52 ALA HA 1 1 1 742 1 1 52 ALA HB1 H 11.103 6.473 -1.188 1.00 . A A . 52 ALA HB1 1 1 1 743 1 1 52 ALA HB2 H 12.395 7.223 -2.137 1.00 . A A . 52 ALA HB2 1 1 1 744 1 1 52 ALA HB3 H 10.755 7.900 -2.156 1.00 . A A . 52 ALA HB3 1 1 1 745 1 1 52 ALA N N 10.640 8.434 0.490 1.00 . A A . 52 ALA N 1 1 1 746 2 2 1 ZN ZN ZN 5.749 7.446 3.664 1.00 . B A . 53 ZN ZN 1 1 1 747 3 2 1 ZN ZN ZN -5.284 2.719 -2.043 1.00 . C A . 54 ZN ZN 1 1 2 748 1 1 1 SER C C -11.189 5.601 1.521 1.00 . A A . 1 SER C 1 1 2 749 1 1 1 SER CA C -12.241 5.630 2.660 1.00 . A A . 1 SER CA 1 1 2 750 1 1 1 SER CB C -12.281 4.282 3.412 1.00 . A A . 1 SER CB 1 1 2 751 1 1 1 SER HA H -11.966 6.418 3.345 1.00 . A A . 1 SER HA 1 1 2 752 1 1 1 SER HB2 H -12.528 3.493 2.717 1.00 . A A . 1 SER HB2 1 1 2 753 1 1 1 SER HB3 H -11.316 4.091 3.858 1.00 . A A . 1 SER HB3 1 1 2 754 1 1 1 SER HG H -14.128 4.256 4.012 1.00 . A A . 1 SER HG 1 1 2 755 1 1 1 SER N N -13.590 5.963 2.139 1.00 . A A . 1 SER N 1 1 2 756 1 1 1 SER O O -11.099 4.634 0.747 1.00 . A A . 1 SER O 1 1 2 757 1 1 1 SER OG O -13.270 4.301 4.451 1.00 . A A . 1 SER OG 1 1 2 758 1 1 2 VAL C C -8.078 6.613 1.123 1.00 . A A . 2 VAL C 1 1 2 759 1 1 2 VAL CA C -9.402 6.783 0.406 1.00 . A A . 2 VAL CA 1 1 2 760 1 1 2 VAL CB C -9.447 8.164 -0.321 1.00 . A A . 2 VAL CB 1 1 2 761 1 1 2 VAL CG1 C -8.362 8.264 -1.395 1.00 . A A . 2 VAL CG1 1 1 2 762 1 1 2 VAL CG2 C -10.824 8.398 -0.934 1.00 . A A . 2 VAL CG2 1 1 2 763 1 1 2 VAL H H -10.563 7.444 2.005 1.00 . A A . 2 VAL H 1 1 2 764 1 1 2 VAL HA H -9.535 5.986 -0.308 1.00 . A A . 2 VAL HA 1 1 2 765 1 1 2 VAL HB H -9.265 8.937 0.415 1.00 . A A . 2 VAL HB 1 1 2 766 1 1 2 VAL HG11 H -7.395 8.121 -0.938 1.00 . A A . 2 VAL HG11 1 1 2 767 1 1 2 VAL HG12 H -8.407 9.251 -1.831 1.00 . A A . 2 VAL HG12 1 1 2 768 1 1 2 VAL HG13 H -8.528 7.519 -2.160 1.00 . A A . 2 VAL HG13 1 1 2 769 1 1 2 VAL HG21 H -11.037 7.636 -1.668 1.00 . A A . 2 VAL HG21 1 1 2 770 1 1 2 VAL HG22 H -10.849 9.369 -1.400 1.00 . A A . 2 VAL HG22 1 1 2 771 1 1 2 VAL HG23 H -11.573 8.372 -0.158 1.00 . A A . 2 VAL HG23 1 1 2 772 1 1 2 VAL N N -10.442 6.685 1.397 1.00 . A A . 2 VAL N 1 1 2 773 1 1 2 VAL O O -7.896 7.177 2.197 1.00 . A A . 2 VAL O 1 1 2 774 1 1 3 CYS C C -4.868 6.576 0.694 1.00 . A A . 3 CYS C 1 1 2 775 1 1 3 CYS CA C -5.917 5.575 1.228 1.00 . A A . 3 CYS CA 1 1 2 776 1 1 3 CYS CB C -5.450 4.124 0.973 1.00 . A A . 3 CYS CB 1 1 2 777 1 1 3 CYS H H -7.348 5.387 -0.291 1.00 . A A . 3 CYS H 1 1 2 778 1 1 3 CYS HA H -6.057 5.729 2.289 1.00 . A A . 3 CYS HA 1 1 2 779 1 1 3 CYS HB2 H -4.987 3.737 1.865 1.00 . A A . 3 CYS HB2 1 1 2 780 1 1 3 CYS HB3 H -6.308 3.511 0.735 1.00 . A A . 3 CYS HB3 1 1 2 781 1 1 3 CYS N N -7.180 5.818 0.568 1.00 . A A . 3 CYS N 1 1 2 782 1 1 3 CYS O O -5.194 7.462 -0.111 1.00 . A A . 3 CYS O 1 1 2 783 1 1 3 CYS SG S -4.265 3.937 -0.387 1.00 . A A . 3 CYS SG 1 1 2 784 1 1 4 ALA C C -1.930 6.595 -0.583 1.00 . A A . 4 ALA C 1 1 2 785 1 1 4 ALA CA C -2.575 7.253 0.634 1.00 . A A . 4 ALA CA 1 1 2 786 1 1 4 ALA CB C -1.529 7.463 1.742 1.00 . A A . 4 ALA CB 1 1 2 787 1 1 4 ALA H H -3.432 5.649 1.689 1.00 . A A . 4 ALA H 1 1 2 788 1 1 4 ALA HA H -2.986 8.211 0.358 1.00 . A A . 4 ALA HA 1 1 2 789 1 1 4 ALA HB1 H -1.123 6.509 2.045 1.00 . A A . 4 ALA HB1 1 1 2 790 1 1 4 ALA HB2 H -1.959 7.952 2.607 1.00 . A A . 4 ALA HB2 1 1 2 791 1 1 4 ALA HB3 H -0.717 8.069 1.361 1.00 . A A . 4 ALA HB3 1 1 2 792 1 1 4 ALA N N -3.632 6.411 1.103 1.00 . A A . 4 ALA N 1 1 2 793 1 1 4 ALA O O -1.511 5.462 -0.502 1.00 . A A . 4 ALA O 1 1 2 794 1 1 5 ALA C C -1.491 7.933 -3.999 1.00 . A A . 5 ALA C 1 1 2 795 1 1 5 ALA CA C -1.270 6.882 -2.950 1.00 . A A . 5 ALA CA 1 1 2 796 1 1 5 ALA CB C -1.754 5.519 -3.475 1.00 . A A . 5 ALA CB 1 1 2 797 1 1 5 ALA H H -2.540 8.075 -1.789 1.00 . A A . 5 ALA H 1 1 2 798 1 1 5 ALA HA H -0.214 6.824 -2.743 1.00 . A A . 5 ALA HA 1 1 2 799 1 1 5 ALA HB1 H -1.641 4.771 -2.705 1.00 . A A . 5 ALA HB1 1 1 2 800 1 1 5 ALA HB2 H -1.156 5.203 -4.318 1.00 . A A . 5 ALA HB2 1 1 2 801 1 1 5 ALA HB3 H -2.791 5.578 -3.765 1.00 . A A . 5 ALA HB3 1 1 2 802 1 1 5 ALA N N -1.962 7.285 -1.728 1.00 . A A . 5 ALA N 1 1 2 803 1 1 5 ALA O O -2.554 8.542 -4.026 1.00 . A A . 5 ALA O 1 1 2 804 1 1 6 GLN C C -1.816 8.944 -6.755 1.00 . A A . 6 GLN C 1 1 2 805 1 1 6 GLN CA C -0.539 9.153 -5.946 1.00 . A A . 6 GLN CA 1 1 2 806 1 1 6 GLN CB C 0.659 8.914 -6.880 1.00 . A A . 6 GLN CB 1 1 2 807 1 1 6 GLN CD C 3.128 8.552 -7.179 1.00 . A A . 6 GLN CD 1 1 2 808 1 1 6 GLN CG C 2.019 8.928 -6.204 1.00 . A A . 6 GLN CG 1 1 2 809 1 1 6 GLN H H 0.429 7.842 -4.654 1.00 . A A . 6 GLN H 1 1 2 810 1 1 6 GLN HA H -0.481 10.155 -5.549 1.00 . A A . 6 GLN HA 1 1 2 811 1 1 6 GLN HB2 H 0.580 7.950 -7.352 1.00 . A A . 6 GLN HB2 1 1 2 812 1 1 6 GLN HB3 H 0.668 9.667 -7.651 1.00 . A A . 6 GLN HB3 1 1 2 813 1 1 6 GLN HE21 H 2.923 6.610 -6.743 1.00 . A A . 6 GLN HE21 1 1 2 814 1 1 6 GLN HE22 H 4.116 7.008 -7.920 1.00 . A A . 6 GLN HE22 1 1 2 815 1 1 6 GLN HG2 H 2.216 9.919 -5.819 1.00 . A A . 6 GLN HG2 1 1 2 816 1 1 6 GLN HG3 H 2.013 8.204 -5.402 1.00 . A A . 6 GLN HG3 1 1 2 817 1 1 6 GLN N N -0.465 8.177 -4.833 1.00 . A A . 6 GLN N 1 1 2 818 1 1 6 GLN NE2 N 3.413 7.263 -7.283 1.00 . A A . 6 GLN NE2 1 1 2 819 1 1 6 GLN O O -2.502 9.890 -7.113 1.00 . A A . 6 GLN O 1 1 2 820 1 1 6 GLN OE1 O 3.710 9.399 -7.838 1.00 . A A . 6 GLN OE1 1 1 2 821 1 1 7 ASN C C -3.929 6.153 -6.965 1.00 . A A . 7 ASN C 1 1 2 822 1 1 7 ASN CA C -3.346 7.345 -7.661 1.00 . A A . 7 ASN CA 1 1 2 823 1 1 7 ASN CB C -3.158 7.069 -9.175 1.00 . A A . 7 ASN CB 1 1 2 824 1 1 7 ASN CG C -4.474 6.703 -9.873 1.00 . A A . 7 ASN CG 1 1 2 825 1 1 7 ASN H H -1.364 7.117 -6.773 1.00 . A A . 7 ASN H 1 1 2 826 1 1 7 ASN HA H -4.038 8.166 -7.537 1.00 . A A . 7 ASN HA 1 1 2 827 1 1 7 ASN HB2 H -2.749 7.942 -9.664 1.00 . A A . 7 ASN HB2 1 1 2 828 1 1 7 ASN HB3 H -2.464 6.249 -9.293 1.00 . A A . 7 ASN HB3 1 1 2 829 1 1 7 ASN HD21 H -4.175 4.776 -9.538 1.00 . A A . 7 ASN HD21 1 1 2 830 1 1 7 ASN HD22 H -5.620 5.173 -10.396 1.00 . A A . 7 ASN HD22 1 1 2 831 1 1 7 ASN N N -2.104 7.708 -7.026 1.00 . A A . 7 ASN N 1 1 2 832 1 1 7 ASN ND2 N -4.786 5.427 -9.942 1.00 . A A . 7 ASN ND2 1 1 2 833 1 1 7 ASN O O -3.468 5.027 -7.139 1.00 . A A . 7 ASN O 1 1 2 834 1 1 7 ASN OD1 O -5.187 7.569 -10.356 1.00 . A A . 7 ASN OD1 1 1 2 835 1 1 8 CYS C C -6.744 4.838 -6.205 1.00 . A A . 8 CYS C 1 1 2 836 1 1 8 CYS CA C -5.516 5.305 -5.471 1.00 . A A . 8 CYS CA 1 1 2 837 1 1 8 CYS CB C -5.842 5.609 -4.018 1.00 . A A . 8 CYS CB 1 1 2 838 1 1 8 CYS H H -5.256 7.292 -6.005 1.00 . A A . 8 CYS H 1 1 2 839 1 1 8 CYS HA H -4.780 4.521 -5.497 1.00 . A A . 8 CYS HA 1 1 2 840 1 1 8 CYS HB2 H -4.934 5.835 -3.485 1.00 . A A . 8 CYS HB2 1 1 2 841 1 1 8 CYS HB3 H -6.511 6.455 -3.970 1.00 . A A . 8 CYS HB3 1 1 2 842 1 1 8 CYS N N -4.911 6.383 -6.143 1.00 . A A . 8 CYS N 1 1 2 843 1 1 8 CYS O O -7.699 5.585 -6.389 1.00 . A A . 8 CYS O 1 1 2 844 1 1 8 CYS SG S -6.659 4.230 -3.182 1.00 . A A . 8 CYS SG 1 1 2 845 1 1 9 GLN C C -9.003 2.691 -6.377 1.00 . A A . 9 GLN C 1 1 2 846 1 1 9 GLN CA C -7.803 2.928 -7.330 1.00 . A A . 9 GLN CA 1 1 2 847 1 1 9 GLN CB C -7.329 1.562 -7.856 1.00 . A A . 9 GLN CB 1 1 2 848 1 1 9 GLN CD C -5.818 0.216 -9.380 1.00 . A A . 9 GLN CD 1 1 2 849 1 1 9 GLN CG C -6.160 1.605 -8.831 1.00 . A A . 9 GLN CG 1 1 2 850 1 1 9 GLN H H -5.861 3.103 -6.485 1.00 . A A . 9 GLN H 1 1 2 851 1 1 9 GLN HA H -8.096 3.544 -8.168 1.00 . A A . 9 GLN HA 1 1 2 852 1 1 9 GLN HB2 H -6.985 1.009 -6.994 1.00 . A A . 9 GLN HB2 1 1 2 853 1 1 9 GLN HB3 H -8.143 1.014 -8.305 1.00 . A A . 9 GLN HB3 1 1 2 854 1 1 9 GLN HE21 H -3.896 0.697 -9.622 1.00 . A A . 9 GLN HE21 1 1 2 855 1 1 9 GLN HE22 H -4.362 -0.890 -10.081 1.00 . A A . 9 GLN HE22 1 1 2 856 1 1 9 GLN HG2 H -6.358 2.283 -9.642 1.00 . A A . 9 GLN HG2 1 1 2 857 1 1 9 GLN HG3 H -5.303 1.965 -8.283 1.00 . A A . 9 GLN HG3 1 1 2 858 1 1 9 GLN N N -6.698 3.589 -6.624 1.00 . A A . 9 GLN N 1 1 2 859 1 1 9 GLN NE2 N -4.576 -0.006 -9.719 1.00 . A A . 9 GLN NE2 1 1 2 860 1 1 9 GLN O O -10.076 2.305 -6.808 1.00 . A A . 9 GLN O 1 1 2 861 1 1 9 GLN OE1 O -6.680 -0.646 -9.495 1.00 . A A . 9 GLN OE1 1 1 2 862 1 1 10 ARG C C -10.403 1.266 -4.085 1.00 . A A . 10 ARG C 1 1 2 863 1 1 10 ARG CA C -9.720 2.681 -3.986 1.00 . A A . 10 ARG CA 1 1 2 864 1 1 10 ARG CB C -10.746 3.837 -3.886 1.00 . A A . 10 ARG CB 1 1 2 865 1 1 10 ARG CD C -12.626 4.967 -2.642 1.00 . A A . 10 ARG CD 1 1 2 866 1 1 10 ARG CG C -11.693 3.768 -2.674 1.00 . A A . 10 ARG CG 1 1 2 867 1 1 10 ARG CZ C -14.534 5.871 -1.297 1.00 . A A . 10 ARG CZ 1 1 2 868 1 1 10 ARG H H -7.911 3.356 -4.872 1.00 . A A . 10 ARG H 1 1 2 869 1 1 10 ARG HA H -9.130 2.654 -3.081 1.00 . A A . 10 ARG HA 1 1 2 870 1 1 10 ARG HB2 H -10.209 4.773 -3.846 1.00 . A A . 10 ARG HB2 1 1 2 871 1 1 10 ARG HB3 H -11.337 3.813 -4.792 1.00 . A A . 10 ARG HB3 1 1 2 872 1 1 10 ARG HD2 H -12.021 5.857 -2.546 1.00 . A A . 10 ARG HD2 1 1 2 873 1 1 10 ARG HD3 H -13.169 5.004 -3.574 1.00 . A A . 10 ARG HD3 1 1 2 874 1 1 10 ARG HE H -13.465 4.164 -0.909 1.00 . A A . 10 ARG HE 1 1 2 875 1 1 10 ARG HG2 H -12.277 2.860 -2.721 1.00 . A A . 10 ARG HG2 1 1 2 876 1 1 10 ARG HG3 H -11.093 3.765 -1.775 1.00 . A A . 10 ARG HG3 1 1 2 877 1 1 10 ARG HH11 H -14.066 7.004 -2.946 1.00 . A A . 10 ARG HH11 1 1 2 878 1 1 10 ARG HH12 H -15.353 7.609 -2.013 1.00 . A A . 10 ARG HH12 1 1 2 879 1 1 10 ARG HH21 H -15.289 5.027 0.426 1.00 . A A . 10 ARG HH21 1 1 2 880 1 1 10 ARG HH22 H -16.059 6.466 -0.037 1.00 . A A . 10 ARG HH22 1 1 2 881 1 1 10 ARG N N -8.765 2.931 -5.085 1.00 . A A . 10 ARG N 1 1 2 882 1 1 10 ARG NE N -13.582 4.933 -1.512 1.00 . A A . 10 ARG NE 1 1 2 883 1 1 10 ARG NH1 N -14.661 6.897 -2.143 1.00 . A A . 10 ARG NH1 1 1 2 884 1 1 10 ARG NH2 N -15.351 5.780 -0.240 1.00 . A A . 10 ARG NH2 1 1 2 885 1 1 10 ARG O O -11.615 1.148 -4.014 1.00 . A A . 10 ARG O 1 1 2 886 1 1 11 PRO C C -10.426 -1.685 -2.876 1.00 . A A . 11 PRO C 1 1 2 887 1 1 11 PRO CA C -10.151 -1.180 -4.285 1.00 . A A . 11 PRO CA 1 1 2 888 1 1 11 PRO CB C -9.005 -2.013 -4.921 1.00 . A A . 11 PRO CB 1 1 2 889 1 1 11 PRO CD C -8.150 0.122 -4.360 1.00 . A A . 11 PRO CD 1 1 2 890 1 1 11 PRO CG C -7.962 -1.025 -5.295 1.00 . A A . 11 PRO CG 1 1 2 891 1 1 11 PRO HA H -11.041 -1.243 -4.897 1.00 . A A . 11 PRO HA 1 1 2 892 1 1 11 PRO HB2 H -8.613 -2.685 -4.175 1.00 . A A . 11 PRO HB2 1 1 2 893 1 1 11 PRO HB3 H -9.363 -2.563 -5.779 1.00 . A A . 11 PRO HB3 1 1 2 894 1 1 11 PRO HD2 H -7.689 -0.078 -3.402 1.00 . A A . 11 PRO HD2 1 1 2 895 1 1 11 PRO HD3 H -7.777 1.042 -4.787 1.00 . A A . 11 PRO HD3 1 1 2 896 1 1 11 PRO HG2 H -6.979 -1.458 -5.181 1.00 . A A . 11 PRO HG2 1 1 2 897 1 1 11 PRO HG3 H -8.122 -0.710 -6.316 1.00 . A A . 11 PRO HG3 1 1 2 898 1 1 11 PRO N N -9.602 0.161 -4.231 1.00 . A A . 11 PRO N 1 1 2 899 1 1 11 PRO O O -9.572 -1.541 -1.973 1.00 . A A . 11 PRO O 1 1 2 900 1 1 12 CYS C C -12.437 -4.211 -1.546 1.00 . A A . 12 CYS C 1 1 2 901 1 1 12 CYS CA C -11.945 -2.785 -1.391 1.00 . A A . 12 CYS CA 1 1 2 902 1 1 12 CYS CB C -13.009 -1.882 -0.756 1.00 . A A . 12 CYS CB 1 1 2 903 1 1 12 CYS H H -12.218 -2.367 -3.421 1.00 . A A . 12 CYS H 1 1 2 904 1 1 12 CYS HA H -11.056 -2.769 -0.779 1.00 . A A . 12 CYS HA 1 1 2 905 1 1 12 CYS HB2 H -12.599 -0.887 -0.695 1.00 . A A . 12 CYS HB2 1 1 2 906 1 1 12 CYS HB3 H -13.888 -1.871 -1.386 1.00 . A A . 12 CYS HB3 1 1 2 907 1 1 12 CYS HG H -14.652 -3.026 0.783 1.00 . A A . 12 CYS HG 1 1 2 908 1 1 12 CYS N N -11.578 -2.267 -2.681 1.00 . A A . 12 CYS N 1 1 2 909 1 1 12 CYS O O -13.456 -4.456 -2.182 1.00 . A A . 12 CYS O 1 1 2 910 1 1 12 CYS SG S -13.518 -2.356 0.918 1.00 . A A . 12 CYS SG 1 1 2 911 1 1 13 LYS C C -11.745 -7.150 0.293 1.00 . A A . 13 LYS C 1 1 2 912 1 1 13 LYS CA C -12.031 -6.549 -1.054 1.00 . A A . 13 LYS CA 1 1 2 913 1 1 13 LYS CB C -11.174 -7.288 -2.104 1.00 . A A . 13 LYS CB 1 1 2 914 1 1 13 LYS CD C -10.407 -7.620 -4.446 1.00 . A A . 13 LYS CD 1 1 2 915 1 1 13 LYS CE C -10.440 -7.123 -5.877 1.00 . A A . 13 LYS CE 1 1 2 916 1 1 13 LYS CG C -11.276 -6.775 -3.527 1.00 . A A . 13 LYS CG 1 1 2 917 1 1 13 LYS H H -10.888 -4.903 -0.484 1.00 . A A . 13 LYS H 1 1 2 918 1 1 13 LYS HA H -13.075 -6.656 -1.296 1.00 . A A . 13 LYS HA 1 1 2 919 1 1 13 LYS HB2 H -10.138 -7.224 -1.802 1.00 . A A . 13 LYS HB2 1 1 2 920 1 1 13 LYS HB3 H -11.480 -8.323 -2.085 1.00 . A A . 13 LYS HB3 1 1 2 921 1 1 13 LYS HD2 H -9.386 -7.587 -4.094 1.00 . A A . 13 LYS HD2 1 1 2 922 1 1 13 LYS HD3 H -10.742 -8.647 -4.428 1.00 . A A . 13 LYS HD3 1 1 2 923 1 1 13 LYS HE2 H -11.464 -7.075 -6.227 1.00 . A A . 13 LYS HE2 1 1 2 924 1 1 13 LYS HE3 H -10.000 -6.138 -5.897 1.00 . A A . 13 LYS HE3 1 1 2 925 1 1 13 LYS HG2 H -12.306 -6.834 -3.850 1.00 . A A . 13 LYS HG2 1 1 2 926 1 1 13 LYS HG3 H -10.935 -5.752 -3.555 1.00 . A A . 13 LYS HG3 1 1 2 927 1 1 13 LYS HZ1 H -10.100 -8.940 -6.812 1.00 . A A . 13 LYS HZ1 1 1 2 928 1 1 13 LYS HZ2 H -8.685 -8.117 -6.417 1.00 . A A . 13 LYS HZ2 1 1 2 929 1 1 13 LYS HZ3 H -9.592 -7.605 -7.729 1.00 . A A . 13 LYS HZ3 1 1 2 930 1 1 13 LYS N N -11.691 -5.142 -0.995 1.00 . A A . 13 LYS N 1 1 2 931 1 1 13 LYS NZ N -9.654 -8.005 -6.771 1.00 . A A . 13 LYS NZ 1 1 2 932 1 1 13 LYS O O -11.161 -6.480 1.145 1.00 . A A . 13 LYS O 1 1 2 933 1 1 14 ASP C C -10.312 -9.454 1.589 1.00 . A A . 14 ASP C 1 1 2 934 1 1 14 ASP CA C -11.774 -9.096 1.708 1.00 . A A . 14 ASP CA 1 1 2 935 1 1 14 ASP CB C -12.619 -10.377 1.917 1.00 . A A . 14 ASP CB 1 1 2 936 1 1 14 ASP CG C -14.067 -10.092 2.255 1.00 . A A . 14 ASP CG 1 1 2 937 1 1 14 ASP H H -12.748 -8.826 -0.144 1.00 . A A . 14 ASP H 1 1 2 938 1 1 14 ASP HA H -11.912 -8.429 2.545 1.00 . A A . 14 ASP HA 1 1 2 939 1 1 14 ASP HB2 H -12.612 -10.953 1.001 1.00 . A A . 14 ASP HB2 1 1 2 940 1 1 14 ASP HB3 H -12.184 -10.977 2.703 1.00 . A A . 14 ASP HB3 1 1 2 941 1 1 14 ASP N N -12.161 -8.384 0.505 1.00 . A A . 14 ASP N 1 1 2 942 1 1 14 ASP O O -9.484 -9.075 2.422 1.00 . A A . 14 ASP O 1 1 2 943 1 1 14 ASP OD1 O -14.889 -9.982 1.336 1.00 . A A . 14 ASP OD1 1 1 2 944 1 1 14 ASP OD2 O -14.398 -9.985 3.452 1.00 . A A . 14 ASP OD2 1 1 2 945 1 1 15 LYS C C -7.822 -9.444 -0.330 1.00 . A A . 15 LYS C 1 1 2 946 1 1 15 LYS CA C -8.641 -10.596 0.264 1.00 . A A . 15 LYS CA 1 1 2 947 1 1 15 LYS CB C -8.668 -11.724 -0.763 1.00 . A A . 15 LYS CB 1 1 2 948 1 1 15 LYS CD C -9.692 -13.856 -1.549 1.00 . A A . 15 LYS CD 1 1 2 949 1 1 15 LYS CE C -10.583 -15.040 -1.209 1.00 . A A . 15 LYS CE 1 1 2 950 1 1 15 LYS CG C -9.506 -12.924 -0.361 1.00 . A A . 15 LYS CG 1 1 2 951 1 1 15 LYS H H -10.667 -10.633 -0.012 1.00 . A A . 15 LYS H 1 1 2 952 1 1 15 LYS HA H -8.176 -10.974 1.160 1.00 . A A . 15 LYS HA 1 1 2 953 1 1 15 LYS HB2 H -9.050 -11.331 -1.693 1.00 . A A . 15 LYS HB2 1 1 2 954 1 1 15 LYS HB3 H -7.657 -12.063 -0.936 1.00 . A A . 15 LYS HB3 1 1 2 955 1 1 15 LYS HD2 H -10.136 -13.306 -2.365 1.00 . A A . 15 LYS HD2 1 1 2 956 1 1 15 LYS HD3 H -8.722 -14.216 -1.856 1.00 . A A . 15 LYS HD3 1 1 2 957 1 1 15 LYS HE2 H -10.085 -15.655 -0.472 1.00 . A A . 15 LYS HE2 1 1 2 958 1 1 15 LYS HE3 H -11.511 -14.667 -0.804 1.00 . A A . 15 LYS HE3 1 1 2 959 1 1 15 LYS HG2 H -8.993 -13.449 0.432 1.00 . A A . 15 LYS HG2 1 1 2 960 1 1 15 LYS HG3 H -10.470 -12.594 -0.002 1.00 . A A . 15 LYS HG3 1 1 2 961 1 1 15 LYS HZ1 H -11.432 -15.283 -3.085 1.00 . A A . 15 LYS HZ1 1 1 2 962 1 1 15 LYS HZ2 H -11.456 -16.693 -2.198 1.00 . A A . 15 LYS HZ2 1 1 2 963 1 1 15 LYS HZ3 H -10.027 -16.180 -2.909 1.00 . A A . 15 LYS HZ3 1 1 2 964 1 1 15 LYS N N -10.004 -10.203 0.567 1.00 . A A . 15 LYS N 1 1 2 965 1 1 15 LYS NZ N -10.881 -15.855 -2.415 1.00 . A A . 15 LYS NZ 1 1 2 966 1 1 15 LYS O O -7.818 -9.257 -1.560 1.00 . A A . 15 LYS O 1 1 2 967 1 1 16 VAL C C -5.555 -6.948 1.254 1.00 . A A . 16 VAL C 1 1 2 968 1 1 16 VAL CA C -6.280 -7.607 0.093 1.00 . A A . 16 VAL CA 1 1 2 969 1 1 16 VAL CB C -6.875 -6.542 -0.873 1.00 . A A . 16 VAL CB 1 1 2 970 1 1 16 VAL CG1 C -8.036 -5.809 -0.247 1.00 . A A . 16 VAL CG1 1 1 2 971 1 1 16 VAL CG2 C -5.785 -5.570 -1.308 1.00 . A A . 16 VAL CG2 1 1 2 972 1 1 16 VAL H H -7.379 -8.742 1.487 1.00 . A A . 16 VAL H 1 1 2 973 1 1 16 VAL HA H -5.519 -8.156 -0.442 1.00 . A A . 16 VAL HA 1 1 2 974 1 1 16 VAL HB H -7.244 -7.043 -1.754 1.00 . A A . 16 VAL HB 1 1 2 975 1 1 16 VAL HG11 H -8.402 -5.057 -0.927 1.00 . A A . 16 VAL HG11 1 1 2 976 1 1 16 VAL HG12 H -7.649 -5.362 0.655 1.00 . A A . 16 VAL HG12 1 1 2 977 1 1 16 VAL HG13 H -8.815 -6.511 0.012 1.00 . A A . 16 VAL HG13 1 1 2 978 1 1 16 VAL HG21 H -5.464 -5.029 -0.428 1.00 . A A . 16 VAL HG21 1 1 2 979 1 1 16 VAL HG22 H -6.181 -4.881 -2.037 1.00 . A A . 16 VAL HG22 1 1 2 980 1 1 16 VAL HG23 H -4.940 -6.116 -1.704 1.00 . A A . 16 VAL HG23 1 1 2 981 1 1 16 VAL N N -7.204 -8.647 0.526 1.00 . A A . 16 VAL N 1 1 2 982 1 1 16 VAL O O -6.103 -6.132 1.985 1.00 . A A . 16 VAL O 1 1 2 983 1 1 17 ASP C C -3.001 -5.410 2.049 1.00 . A A . 17 ASP C 1 1 2 984 1 1 17 ASP CA C -3.457 -6.812 2.440 1.00 . A A . 17 ASP CA 1 1 2 985 1 1 17 ASP CB C -2.240 -7.726 2.693 1.00 . A A . 17 ASP CB 1 1 2 986 1 1 17 ASP CG C -2.628 -9.070 3.271 1.00 . A A . 17 ASP CG 1 1 2 987 1 1 17 ASP H H -4.114 -8.170 0.930 1.00 . A A . 17 ASP H 1 1 2 988 1 1 17 ASP HA H -4.022 -6.733 3.357 1.00 . A A . 17 ASP HA 1 1 2 989 1 1 17 ASP HB2 H -1.731 -7.906 1.760 1.00 . A A . 17 ASP HB2 1 1 2 990 1 1 17 ASP HB3 H -1.564 -7.242 3.382 1.00 . A A . 17 ASP HB3 1 1 2 991 1 1 17 ASP N N -4.354 -7.377 1.444 1.00 . A A . 17 ASP N 1 1 2 992 1 1 17 ASP O O -2.699 -5.131 0.868 1.00 . A A . 17 ASP O 1 1 2 993 1 1 17 ASP OD1 O -3.105 -9.926 2.505 1.00 . A A . 17 ASP OD1 1 1 2 994 1 1 17 ASP OD2 O -2.477 -9.271 4.496 1.00 . A A . 17 ASP OD2 1 1 2 995 1 1 18 TRP C C -1.170 -2.964 3.429 1.00 . A A . 18 TRP C 1 1 2 996 1 1 18 TRP CA C -2.582 -3.138 2.894 1.00 . A A . 18 TRP CA 1 1 2 997 1 1 18 TRP CB C -3.539 -2.253 3.703 1.00 . A A . 18 TRP CB 1 1 2 998 1 1 18 TRP CD1 C -5.783 -3.370 3.102 1.00 . A A . 18 TRP CD1 1 1 2 999 1 1 18 TRP CD2 C -5.803 -1.138 2.970 1.00 . A A . 18 TRP CD2 1 1 2 1000 1 1 18 TRP CE2 C -7.081 -1.618 2.627 1.00 . A A . 18 TRP CE2 1 1 2 1001 1 1 18 TRP CE3 C -5.580 0.237 2.962 1.00 . A A . 18 TRP CE3 1 1 2 1002 1 1 18 TRP CG C -4.979 -2.275 3.256 1.00 . A A . 18 TRP CG 1 1 2 1003 1 1 18 TRP CH2 C -7.881 0.567 2.294 1.00 . A A . 18 TRP CH2 1 1 2 1004 1 1 18 TRP CZ2 C -8.129 -0.772 2.281 1.00 . A A . 18 TRP CZ2 1 1 2 1005 1 1 18 TRP CZ3 C -6.622 1.076 2.624 1.00 . A A . 18 TRP CZ3 1 1 2 1006 1 1 18 TRP H H -3.178 -4.861 3.936 1.00 . A A . 18 TRP H 1 1 2 1007 1 1 18 TRP HA H -2.623 -2.864 1.849 1.00 . A A . 18 TRP HA 1 1 2 1008 1 1 18 TRP HB2 H -3.533 -2.587 4.729 1.00 . A A . 18 TRP HB2 1 1 2 1009 1 1 18 TRP HB3 H -3.187 -1.235 3.657 1.00 . A A . 18 TRP HB3 1 1 2 1010 1 1 18 TRP HD1 H -5.448 -4.387 3.247 1.00 . A A . 18 TRP HD1 1 1 2 1011 1 1 18 TRP HE1 H -7.763 -3.624 2.517 1.00 . A A . 18 TRP HE1 1 1 2 1012 1 1 18 TRP HE3 H -4.612 0.640 3.219 1.00 . A A . 18 TRP HE3 1 1 2 1013 1 1 18 TRP HH2 H -8.672 1.254 2.032 1.00 . A A . 18 TRP HH2 1 1 2 1014 1 1 18 TRP HZ2 H -9.108 -1.155 2.024 1.00 . A A . 18 TRP HZ2 1 1 2 1015 1 1 18 TRP HZ3 H -6.465 2.144 2.614 1.00 . A A . 18 TRP HZ3 1 1 2 1016 1 1 18 TRP N N -2.963 -4.542 3.035 1.00 . A A . 18 TRP N 1 1 2 1017 1 1 18 TRP NE1 N -7.037 -2.989 2.701 1.00 . A A . 18 TRP NE1 1 1 2 1018 1 1 18 TRP O O -0.699 -3.800 4.200 1.00 . A A . 18 TRP O 1 1 2 1019 1 1 19 VAL C C 0.989 -0.279 4.121 1.00 . A A . 19 VAL C 1 1 2 1020 1 1 19 VAL CA C 0.867 -1.662 3.489 1.00 . A A . 19 VAL CA 1 1 2 1021 1 1 19 VAL CB C 1.914 -1.806 2.338 1.00 . A A . 19 VAL CB 1 1 2 1022 1 1 19 VAL CG1 C 1.965 -3.229 1.821 1.00 . A A . 19 VAL CG1 1 1 2 1023 1 1 19 VAL CG2 C 1.606 -0.848 1.192 1.00 . A A . 19 VAL CG2 1 1 2 1024 1 1 19 VAL H H -0.839 -1.148 2.504 1.00 . A A . 19 VAL H 1 1 2 1025 1 1 19 VAL HA H 1.097 -2.384 4.258 1.00 . A A . 19 VAL HA 1 1 2 1026 1 1 19 VAL HB H 2.888 -1.560 2.732 1.00 . A A . 19 VAL HB 1 1 2 1027 1 1 19 VAL HG11 H 2.706 -3.292 1.036 1.00 . A A . 19 VAL HG11 1 1 2 1028 1 1 19 VAL HG12 H 0.992 -3.495 1.435 1.00 . A A . 19 VAL HG12 1 1 2 1029 1 1 19 VAL HG13 H 2.218 -3.911 2.618 1.00 . A A . 19 VAL HG13 1 1 2 1030 1 1 19 VAL HG21 H 1.668 0.168 1.547 1.00 . A A . 19 VAL HG21 1 1 2 1031 1 1 19 VAL HG22 H 0.611 -1.047 0.824 1.00 . A A . 19 VAL HG22 1 1 2 1032 1 1 19 VAL HG23 H 2.304 -1.009 0.386 1.00 . A A . 19 VAL HG23 1 1 2 1033 1 1 19 VAL N N -0.494 -1.896 3.042 1.00 . A A . 19 VAL N 1 1 2 1034 1 1 19 VAL O O 0.382 0.675 3.653 1.00 . A A . 19 VAL O 1 1 2 1035 1 1 20 GLN C C 3.443 1.446 5.641 1.00 . A A . 20 GLN C 1 1 2 1036 1 1 20 GLN CA C 1.992 1.058 5.872 1.00 . A A . 20 GLN CA 1 1 2 1037 1 1 20 GLN CB C 1.702 0.931 7.378 1.00 . A A . 20 GLN CB 1 1 2 1038 1 1 20 GLN CD C 1.661 2.095 9.661 1.00 . A A . 20 GLN CD 1 1 2 1039 1 1 20 GLN CG C 2.011 2.196 8.179 1.00 . A A . 20 GLN CG 1 1 2 1040 1 1 20 GLN H H 2.116 -1.028 5.540 1.00 . A A . 20 GLN H 1 1 2 1041 1 1 20 GLN HA H 1.343 1.807 5.440 1.00 . A A . 20 GLN HA 1 1 2 1042 1 1 20 GLN HB2 H 0.656 0.705 7.501 1.00 . A A . 20 GLN HB2 1 1 2 1043 1 1 20 GLN HB3 H 2.298 0.123 7.775 1.00 . A A . 20 GLN HB3 1 1 2 1044 1 1 20 GLN HE21 H 3.128 3.350 10.132 1.00 . A A . 20 GLN HE21 1 1 2 1045 1 1 20 GLN HE22 H 2.206 2.771 11.447 1.00 . A A . 20 GLN HE22 1 1 2 1046 1 1 20 GLN HG2 H 3.070 2.385 8.101 1.00 . A A . 20 GLN HG2 1 1 2 1047 1 1 20 GLN HG3 H 1.464 3.024 7.745 1.00 . A A . 20 GLN HG3 1 1 2 1048 1 1 20 GLN N N 1.730 -0.199 5.194 1.00 . A A . 20 GLN N 1 1 2 1049 1 1 20 GLN NE2 N 2.401 2.802 10.490 1.00 . A A . 20 GLN NE2 1 1 2 1050 1 1 20 GLN O O 4.323 0.585 5.654 1.00 . A A . 20 GLN O 1 1 2 1051 1 1 20 GLN OE1 O 0.741 1.383 10.057 1.00 . A A . 20 GLN OE1 1 1 2 1052 1 1 21 CYS C C 5.674 3.540 6.554 1.00 . A A . 21 CYS C 1 1 2 1053 1 1 21 CYS CA C 5.070 3.140 5.206 1.00 . A A . 21 CYS CA 1 1 2 1054 1 1 21 CYS CB C 5.223 4.258 4.139 1.00 . A A . 21 CYS CB 1 1 2 1055 1 1 21 CYS H H 2.953 3.348 5.319 1.00 . A A . 21 CYS H 1 1 2 1056 1 1 21 CYS HA H 5.604 2.262 4.877 1.00 . A A . 21 CYS HA 1 1 2 1057 1 1 21 CYS HB2 H 6.245 4.546 3.962 1.00 . A A . 21 CYS HB2 1 1 2 1058 1 1 21 CYS HB3 H 4.795 3.930 3.204 1.00 . A A . 21 CYS HB3 1 1 2 1059 1 1 21 CYS N N 3.704 2.719 5.380 1.00 . A A . 21 CYS N 1 1 2 1060 1 1 21 CYS O O 5.390 4.628 7.097 1.00 . A A . 21 CYS O 1 1 2 1061 1 1 21 CYS SG S 4.434 5.820 4.508 1.00 . A A . 21 CYS SG 1 1 2 1062 1 1 22 ASP C C 8.366 3.789 8.271 1.00 . A A . 22 ASP C 1 1 2 1063 1 1 22 ASP CA C 7.140 2.915 8.406 1.00 . A A . 22 ASP CA 1 1 2 1064 1 1 22 ASP CB C 7.501 1.596 9.112 1.00 . A A . 22 ASP CB 1 1 2 1065 1 1 22 ASP CG C 6.303 0.754 9.406 1.00 . A A . 22 ASP CG 1 1 2 1066 1 1 22 ASP H H 6.780 1.896 6.551 1.00 . A A . 22 ASP H 1 1 2 1067 1 1 22 ASP HA H 6.405 3.438 9.005 1.00 . A A . 22 ASP HA 1 1 2 1068 1 1 22 ASP HB2 H 8.173 1.011 8.505 1.00 . A A . 22 ASP HB2 1 1 2 1069 1 1 22 ASP HB3 H 7.994 1.808 10.050 1.00 . A A . 22 ASP HB3 1 1 2 1070 1 1 22 ASP N N 6.526 2.686 7.080 1.00 . A A . 22 ASP N 1 1 2 1071 1 1 22 ASP O O 9.215 3.835 9.148 1.00 . A A . 22 ASP O 1 1 2 1072 1 1 22 ASP OD1 O 5.433 1.206 10.191 1.00 . A A . 22 ASP OD1 1 1 2 1073 1 1 22 ASP OD2 O 6.230 -0.382 8.884 1.00 . A A . 22 ASP OD2 1 1 2 1074 1 1 23 GLY C C 9.319 6.791 7.481 1.00 . A A . 23 GLY C 1 1 2 1075 1 1 23 GLY CA C 9.529 5.393 6.924 1.00 . A A . 23 GLY CA 1 1 2 1076 1 1 23 GLY H H 7.608 4.557 6.621 1.00 . A A . 23 GLY H 1 1 2 1077 1 1 23 GLY HA2 H 10.410 4.951 7.370 1.00 . A A . 23 GLY HA2 1 1 2 1078 1 1 23 GLY HA3 H 9.678 5.465 5.855 1.00 . A A . 23 GLY HA3 1 1 2 1079 1 1 23 GLY N N 8.408 4.551 7.185 1.00 . A A . 23 GLY N 1 1 2 1080 1 1 23 GLY O O 10.261 7.564 7.580 1.00 . A A . 23 GLY O 1 1 2 1081 1 1 24 GLY C C 6.384 8.952 8.311 1.00 . A A . 24 GLY C 1 1 2 1082 1 1 24 GLY CA C 7.835 8.461 8.378 1.00 . A A . 24 GLY CA 1 1 2 1083 1 1 24 GLY H H 7.374 6.442 7.810 1.00 . A A . 24 GLY H 1 1 2 1084 1 1 24 GLY HA2 H 8.144 8.474 9.411 1.00 . A A . 24 GLY HA2 1 1 2 1085 1 1 24 GLY HA3 H 8.461 9.155 7.832 1.00 . A A . 24 GLY HA3 1 1 2 1086 1 1 24 GLY N N 8.076 7.123 7.858 1.00 . A A . 24 GLY N 1 1 2 1087 1 1 24 GLY O O 5.981 9.782 9.127 1.00 . A A . 24 GLY O 1 1 2 1088 1 1 25 CYS C C 3.253 8.204 8.110 1.00 . A A . 25 CYS C 1 1 2 1089 1 1 25 CYS CA C 4.224 9.000 7.232 1.00 . A A . 25 CYS CA 1 1 2 1090 1 1 25 CYS CB C 3.736 8.913 5.789 1.00 . A A . 25 CYS CB 1 1 2 1091 1 1 25 CYS H H 5.931 7.765 6.778 1.00 . A A . 25 CYS H 1 1 2 1092 1 1 25 CYS HA H 4.222 10.035 7.545 1.00 . A A . 25 CYS HA 1 1 2 1093 1 1 25 CYS HB2 H 3.486 7.882 5.577 1.00 . A A . 25 CYS HB2 1 1 2 1094 1 1 25 CYS HB3 H 2.849 9.518 5.683 1.00 . A A . 25 CYS HB3 1 1 2 1095 1 1 25 CYS N N 5.598 8.471 7.364 1.00 . A A . 25 CYS N 1 1 2 1096 1 1 25 CYS O O 2.262 8.744 8.594 1.00 . A A . 25 CYS O 1 1 2 1097 1 1 25 CYS SG S 4.924 9.442 4.550 1.00 . A A . 25 CYS SG 1 1 2 1098 1 1 26 ASP C C 1.333 5.795 8.398 1.00 . A A . 26 ASP C 1 1 2 1099 1 1 26 ASP CA C 2.705 5.960 9.056 1.00 . A A . 26 ASP CA 1 1 2 1100 1 1 26 ASP CB C 2.524 6.363 10.550 1.00 . A A . 26 ASP CB 1 1 2 1101 1 1 26 ASP CG C 3.810 6.368 11.359 1.00 . A A . 26 ASP CG 1 1 2 1102 1 1 26 ASP H H 4.439 6.606 7.990 1.00 . A A . 26 ASP H 1 1 2 1103 1 1 26 ASP HA H 3.192 4.998 9.014 1.00 . A A . 26 ASP HA 1 1 2 1104 1 1 26 ASP HB2 H 2.092 7.349 10.610 1.00 . A A . 26 ASP HB2 1 1 2 1105 1 1 26 ASP HB3 H 1.842 5.655 11.001 1.00 . A A . 26 ASP HB3 1 1 2 1106 1 1 26 ASP N N 3.568 6.915 8.310 1.00 . A A . 26 ASP N 1 1 2 1107 1 1 26 ASP O O 0.387 5.312 9.016 1.00 . A A . 26 ASP O 1 1 2 1108 1 1 26 ASP OD1 O 4.167 5.300 11.910 1.00 . A A . 26 ASP OD1 1 1 2 1109 1 1 26 ASP OD2 O 4.455 7.437 11.469 1.00 . A A . 26 ASP OD2 1 1 2 1110 1 1 27 GLU C C -0.154 4.728 5.694 1.00 . A A . 27 GLU C 1 1 2 1111 1 1 27 GLU CA C -0.003 6.085 6.391 1.00 . A A . 27 GLU CA 1 1 2 1112 1 1 27 GLU CB C -0.146 7.279 5.414 1.00 . A A . 27 GLU CB 1 1 2 1113 1 1 27 GLU CD C -0.449 9.831 5.222 1.00 . A A . 27 GLU CD 1 1 2 1114 1 1 27 GLU CG C -0.190 8.634 6.136 1.00 . A A . 27 GLU CG 1 1 2 1115 1 1 27 GLU H H 2.039 6.502 6.674 1.00 . A A . 27 GLU H 1 1 2 1116 1 1 27 GLU HA H -0.797 6.146 7.122 1.00 . A A . 27 GLU HA 1 1 2 1117 1 1 27 GLU HB2 H 0.724 7.283 4.775 1.00 . A A . 27 GLU HB2 1 1 2 1118 1 1 27 GLU HB3 H -1.031 7.173 4.805 1.00 . A A . 27 GLU HB3 1 1 2 1119 1 1 27 GLU HG2 H -0.971 8.602 6.878 1.00 . A A . 27 GLU HG2 1 1 2 1120 1 1 27 GLU HG3 H 0.761 8.773 6.625 1.00 . A A . 27 GLU HG3 1 1 2 1121 1 1 27 GLU N N 1.244 6.166 7.131 1.00 . A A . 27 GLU N 1 1 2 1122 1 1 27 GLU O O 0.827 3.986 5.543 1.00 . A A . 27 GLU O 1 1 2 1123 1 1 27 GLU OE1 O -1.645 10.175 5.024 1.00 . A A . 27 GLU OE1 1 1 2 1124 1 1 27 GLU OE2 O 0.513 10.441 4.734 1.00 . A A . 27 GLU OE2 1 1 2 1125 1 1 28 TRP C C -1.987 3.231 3.192 1.00 . A A . 28 TRP C 1 1 2 1126 1 1 28 TRP CA C -1.710 3.125 4.680 1.00 . A A . 28 TRP CA 1 1 2 1127 1 1 28 TRP CB C -2.886 2.461 5.396 1.00 . A A . 28 TRP CB 1 1 2 1128 1 1 28 TRP CD1 C -2.538 2.794 7.908 1.00 . A A . 28 TRP CD1 1 1 2 1129 1 1 28 TRP CD2 C -2.276 0.681 7.212 1.00 . A A . 28 TRP CD2 1 1 2 1130 1 1 28 TRP CE2 C -2.054 0.725 8.595 1.00 . A A . 28 TRP CE2 1 1 2 1131 1 1 28 TRP CE3 C -2.159 -0.545 6.540 1.00 . A A . 28 TRP CE3 1 1 2 1132 1 1 28 TRP CG C -2.575 2.019 6.791 1.00 . A A . 28 TRP CG 1 1 2 1133 1 1 28 TRP CH2 C -1.640 -1.607 8.655 1.00 . A A . 28 TRP CH2 1 1 2 1134 1 1 28 TRP CZ2 C -1.744 -0.419 9.337 1.00 . A A . 28 TRP CZ2 1 1 2 1135 1 1 28 TRP CZ3 C -1.850 -1.677 7.271 1.00 . A A . 28 TRP CZ3 1 1 2 1136 1 1 28 TRP H H -2.048 5.132 5.381 1.00 . A A . 28 TRP H 1 1 2 1137 1 1 28 TRP HA H -0.845 2.487 4.804 1.00 . A A . 28 TRP HA 1 1 2 1138 1 1 28 TRP HB2 H -3.729 3.134 5.435 1.00 . A A . 28 TRP HB2 1 1 2 1139 1 1 28 TRP HB3 H -3.168 1.585 4.830 1.00 . A A . 28 TRP HB3 1 1 2 1140 1 1 28 TRP HD1 H -2.723 3.858 7.920 1.00 . A A . 28 TRP HD1 1 1 2 1141 1 1 28 TRP HE1 H -2.119 2.353 9.915 1.00 . A A . 28 TRP HE1 1 1 2 1142 1 1 28 TRP HE3 H -2.313 -0.613 5.472 1.00 . A A . 28 TRP HE3 1 1 2 1143 1 1 28 TRP HH2 H -1.401 -2.515 9.191 1.00 . A A . 28 TRP HH2 1 1 2 1144 1 1 28 TRP HZ2 H -1.580 -0.392 10.404 1.00 . A A . 28 TRP HZ2 1 1 2 1145 1 1 28 TRP HZ3 H -1.762 -2.631 6.775 1.00 . A A . 28 TRP HZ3 1 1 2 1146 1 1 28 TRP N N -1.380 4.422 5.284 1.00 . A A . 28 TRP N 1 1 2 1147 1 1 28 TRP NE1 N -2.219 2.027 8.997 1.00 . A A . 28 TRP NE1 1 1 2 1148 1 1 28 TRP O O -2.796 4.061 2.750 1.00 . A A . 28 TRP O 1 1 2 1149 1 1 29 PHE C C -1.901 0.990 0.530 1.00 . A A . 29 PHE C 1 1 2 1150 1 1 29 PHE CA C -1.383 2.375 0.994 1.00 . A A . 29 PHE CA 1 1 2 1151 1 1 29 PHE CB C 0.051 2.593 0.400 1.00 . A A . 29 PHE CB 1 1 2 1152 1 1 29 PHE CD1 C 1.271 3.787 2.240 1.00 . A A . 29 PHE CD1 1 1 2 1153 1 1 29 PHE CD2 C 1.117 4.888 0.148 1.00 . A A . 29 PHE CD2 1 1 2 1154 1 1 29 PHE CE1 C 1.960 4.836 2.748 1.00 . A A . 29 PHE CE1 1 1 2 1155 1 1 29 PHE CE2 C 1.818 5.958 0.663 1.00 . A A . 29 PHE CE2 1 1 2 1156 1 1 29 PHE CG C 0.824 3.787 0.943 1.00 . A A . 29 PHE CG 1 1 2 1157 1 1 29 PHE CZ C 2.242 5.922 1.974 1.00 . A A . 29 PHE CZ 1 1 2 1158 1 1 29 PHE H H -0.717 1.751 2.896 1.00 . A A . 29 PHE H 1 1 2 1159 1 1 29 PHE HA H -2.036 3.161 0.651 1.00 . A A . 29 PHE HA 1 1 2 1160 1 1 29 PHE HB2 H 0.664 1.723 0.570 1.00 . A A . 29 PHE HB2 1 1 2 1161 1 1 29 PHE HB3 H -0.047 2.735 -0.666 1.00 . A A . 29 PHE HB3 1 1 2 1162 1 1 29 PHE HD1 H 1.053 2.930 2.860 1.00 . A A . 29 PHE HD1 1 1 2 1163 1 1 29 PHE HD2 H 0.784 4.917 -0.882 1.00 . A A . 29 PHE HD2 1 1 2 1164 1 1 29 PHE HE1 H 2.296 4.814 3.775 1.00 . A A . 29 PHE HE1 1 1 2 1165 1 1 29 PHE HE2 H 2.038 6.816 0.046 1.00 . A A . 29 PHE HE2 1 1 2 1166 1 1 29 PHE HZ H 2.801 6.729 2.425 1.00 . A A . 29 PHE HZ 1 1 2 1167 1 1 29 PHE N N -1.316 2.386 2.438 1.00 . A A . 29 PHE N 1 1 2 1168 1 1 29 PHE O O -1.830 0.011 1.275 1.00 . A A . 29 PHE O 1 1 2 1169 1 1 30 HIS C C -1.684 -0.864 -2.115 1.00 . A A . 30 HIS C 1 1 2 1170 1 1 30 HIS CA C -2.810 -0.376 -1.277 1.00 . A A . 30 HIS CA 1 1 2 1171 1 1 30 HIS CB C -4.022 -0.253 -2.216 1.00 . A A . 30 HIS CB 1 1 2 1172 1 1 30 HIS CD2 C -6.251 -0.968 -1.141 1.00 . A A . 30 HIS CD2 1 1 2 1173 1 1 30 HIS CE1 C -7.203 1.000 -1.121 1.00 . A A . 30 HIS CE1 1 1 2 1174 1 1 30 HIS CG C -5.358 -0.070 -1.622 1.00 . A A . 30 HIS CG 1 1 2 1175 1 1 30 HIS H H -2.464 1.752 -1.189 1.00 . A A . 30 HIS H 1 1 2 1176 1 1 30 HIS HA H -3.029 -1.080 -0.488 1.00 . A A . 30 HIS HA 1 1 2 1177 1 1 30 HIS HB2 H -3.848 0.688 -2.712 1.00 . A A . 30 HIS HB2 1 1 2 1178 1 1 30 HIS HB3 H -4.069 -0.979 -3.014 1.00 . A A . 30 HIS HB3 1 1 2 1179 1 1 30 HIS HD2 H -6.083 -2.031 -1.020 1.00 . A A . 30 HIS HD2 1 1 2 1180 1 1 30 HIS HE1 H -7.931 1.786 -0.991 1.00 . A A . 30 HIS HE1 1 1 2 1181 1 1 30 HIS HE2 H -8.288 -0.703 -0.874 1.00 . A A . 30 HIS HE2 1 1 2 1182 1 1 30 HIS N N -2.412 0.916 -0.683 1.00 . A A . 30 HIS N 1 1 2 1183 1 1 30 HIS ND1 N -5.973 1.147 -1.594 1.00 . A A . 30 HIS ND1 1 1 2 1184 1 1 30 HIS NE2 N -7.394 -0.278 -0.844 1.00 . A A . 30 HIS NE2 1 1 2 1185 1 1 30 HIS O O -1.090 -0.083 -2.833 1.00 . A A . 30 HIS O 1 1 2 1186 1 1 31 GLN C C -0.554 -2.427 -4.360 1.00 . A A . 31 GLN C 1 1 2 1187 1 1 31 GLN CA C -0.351 -2.721 -2.882 1.00 . A A . 31 GLN CA 1 1 2 1188 1 1 31 GLN CB C -0.163 -4.212 -2.629 1.00 . A A . 31 GLN CB 1 1 2 1189 1 1 31 GLN CD C 0.576 -5.993 -1.020 1.00 . A A . 31 GLN CD 1 1 2 1190 1 1 31 GLN CG C 0.465 -4.517 -1.291 1.00 . A A . 31 GLN CG 1 1 2 1191 1 1 31 GLN H H -1.899 -2.693 -1.408 1.00 . A A . 31 GLN H 1 1 2 1192 1 1 31 GLN HA H 0.548 -2.207 -2.580 1.00 . A A . 31 GLN HA 1 1 2 1193 1 1 31 GLN HB2 H -1.116 -4.719 -2.677 1.00 . A A . 31 GLN HB2 1 1 2 1194 1 1 31 GLN HB3 H 0.484 -4.617 -3.393 1.00 . A A . 31 GLN HB3 1 1 2 1195 1 1 31 GLN HE21 H -1.113 -5.965 -0.038 1.00 . A A . 31 GLN HE21 1 1 2 1196 1 1 31 GLN HE22 H -0.348 -7.495 -0.146 1.00 . A A . 31 GLN HE22 1 1 2 1197 1 1 31 GLN HG2 H 1.460 -4.096 -1.284 1.00 . A A . 31 GLN HG2 1 1 2 1198 1 1 31 GLN HG3 H -0.126 -4.047 -0.524 1.00 . A A . 31 GLN HG3 1 1 2 1199 1 1 31 GLN N N -1.402 -2.142 -2.051 1.00 . A A . 31 GLN N 1 1 2 1200 1 1 31 GLN NE2 N -0.383 -6.539 -0.341 1.00 . A A . 31 GLN NE2 1 1 2 1201 1 1 31 GLN O O 0.319 -1.922 -4.991 1.00 . A A . 31 GLN O 1 1 2 1202 1 1 31 GLN OE1 O 1.543 -6.620 -1.383 1.00 . A A . 31 GLN OE1 1 1 2 1203 1 1 32 VAL C C -1.941 -0.953 -6.678 1.00 . A A . 32 VAL C 1 1 2 1204 1 1 32 VAL CA C -1.985 -2.463 -6.293 1.00 . A A . 32 VAL CA 1 1 2 1205 1 1 32 VAL CB C -3.333 -3.091 -6.742 1.00 . A A . 32 VAL CB 1 1 2 1206 1 1 32 VAL CG1 C -4.479 -2.456 -6.003 1.00 . A A . 32 VAL CG1 1 1 2 1207 1 1 32 VAL CG2 C -3.520 -2.929 -8.224 1.00 . A A . 32 VAL CG2 1 1 2 1208 1 1 32 VAL H H -2.458 -3.001 -4.304 1.00 . A A . 32 VAL H 1 1 2 1209 1 1 32 VAL HA H -1.189 -2.957 -6.822 1.00 . A A . 32 VAL HA 1 1 2 1210 1 1 32 VAL HB H -3.331 -4.147 -6.510 1.00 . A A . 32 VAL HB 1 1 2 1211 1 1 32 VAL HG11 H -5.428 -2.859 -6.323 1.00 . A A . 32 VAL HG11 1 1 2 1212 1 1 32 VAL HG12 H -4.419 -1.400 -6.228 1.00 . A A . 32 VAL HG12 1 1 2 1213 1 1 32 VAL HG13 H -4.325 -2.599 -4.945 1.00 . A A . 32 VAL HG13 1 1 2 1214 1 1 32 VAL HG21 H -4.480 -3.321 -8.519 1.00 . A A . 32 VAL HG21 1 1 2 1215 1 1 32 VAL HG22 H -2.715 -3.427 -8.741 1.00 . A A . 32 VAL HG22 1 1 2 1216 1 1 32 VAL HG23 H -3.483 -1.867 -8.420 1.00 . A A . 32 VAL HG23 1 1 2 1217 1 1 32 VAL N N -1.735 -2.677 -4.876 1.00 . A A . 32 VAL N 1 1 2 1218 1 1 32 VAL O O -1.356 -0.576 -7.684 1.00 . A A . 32 VAL O 1 1 2 1219 1 1 33 CYS C C -1.293 2.018 -6.027 1.00 . A A . 33 CYS C 1 1 2 1220 1 1 33 CYS CA C -2.660 1.300 -6.110 1.00 . A A . 33 CYS CA 1 1 2 1221 1 1 33 CYS CB C -3.756 1.976 -5.216 1.00 . A A . 33 CYS CB 1 1 2 1222 1 1 33 CYS H H -2.856 -0.603 -5.054 1.00 . A A . 33 CYS H 1 1 2 1223 1 1 33 CYS HA H -2.960 1.406 -7.144 1.00 . A A . 33 CYS HA 1 1 2 1224 1 1 33 CYS HB2 H -4.144 2.850 -5.690 1.00 . A A . 33 CYS HB2 1 1 2 1225 1 1 33 CYS HB3 H -4.573 1.275 -5.129 1.00 . A A . 33 CYS HB3 1 1 2 1226 1 1 33 CYS N N -2.530 -0.122 -5.832 1.00 . A A . 33 CYS N 1 1 2 1227 1 1 33 CYS O O -1.080 3.027 -6.693 1.00 . A A . 33 CYS O 1 1 2 1228 1 1 33 CYS SG S -3.276 2.417 -3.556 1.00 . A A . 33 CYS SG 1 1 2 1229 1 1 34 VAL C C 1.997 1.165 -5.840 1.00 . A A . 34 VAL C 1 1 2 1230 1 1 34 VAL CA C 0.932 2.067 -5.113 1.00 . A A . 34 VAL CA 1 1 2 1231 1 1 34 VAL CB C 1.301 2.305 -3.620 1.00 . A A . 34 VAL CB 1 1 2 1232 1 1 34 VAL CG1 C 1.890 1.122 -2.920 1.00 . A A . 34 VAL CG1 1 1 2 1233 1 1 34 VAL CG2 C 2.076 3.560 -3.443 1.00 . A A . 34 VAL CG2 1 1 2 1234 1 1 34 VAL H H -0.510 0.734 -4.614 1.00 . A A . 34 VAL H 1 1 2 1235 1 1 34 VAL HA H 0.891 3.024 -5.617 1.00 . A A . 34 VAL HA 1 1 2 1236 1 1 34 VAL HB H 0.404 2.392 -3.037 1.00 . A A . 34 VAL HB 1 1 2 1237 1 1 34 VAL HG11 H 2.031 1.322 -1.866 1.00 . A A . 34 VAL HG11 1 1 2 1238 1 1 34 VAL HG12 H 2.858 0.984 -3.370 1.00 . A A . 34 VAL HG12 1 1 2 1239 1 1 34 VAL HG13 H 1.273 0.248 -3.071 1.00 . A A . 34 VAL HG13 1 1 2 1240 1 1 34 VAL HG21 H 2.956 3.508 -4.063 1.00 . A A . 34 VAL HG21 1 1 2 1241 1 1 34 VAL HG22 H 2.320 3.680 -2.401 1.00 . A A . 34 VAL HG22 1 1 2 1242 1 1 34 VAL HG23 H 1.399 4.343 -3.755 1.00 . A A . 34 VAL HG23 1 1 2 1243 1 1 34 VAL N N -0.367 1.490 -5.216 1.00 . A A . 34 VAL N 1 1 2 1244 1 1 34 VAL O O 3.206 1.389 -5.735 1.00 . A A . 34 VAL O 1 1 2 1245 1 1 35 GLY C C 3.314 -1.658 -6.632 1.00 . A A . 35 GLY C 1 1 2 1246 1 1 35 GLY CA C 2.364 -0.717 -7.409 1.00 . A A . 35 GLY CA 1 1 2 1247 1 1 35 GLY H H 0.524 0.168 -6.703 1.00 . A A . 35 GLY H 1 1 2 1248 1 1 35 GLY HA2 H 1.714 -1.338 -8.007 1.00 . A A . 35 GLY HA2 1 1 2 1249 1 1 35 GLY HA3 H 2.953 -0.123 -8.097 1.00 . A A . 35 GLY HA3 1 1 2 1250 1 1 35 GLY N N 1.504 0.187 -6.612 1.00 . A A . 35 GLY N 1 1 2 1251 1 1 35 GLY O O 4.446 -1.891 -7.068 1.00 . A A . 35 GLY O 1 1 2 1252 1 1 36 VAL C C 3.149 -4.569 -5.075 1.00 . A A . 36 VAL C 1 1 2 1253 1 1 36 VAL CA C 3.611 -3.159 -4.725 1.00 . A A . 36 VAL CA 1 1 2 1254 1 1 36 VAL CB C 3.360 -2.919 -3.205 1.00 . A A . 36 VAL CB 1 1 2 1255 1 1 36 VAL CG1 C 3.970 -4.001 -2.329 1.00 . A A . 36 VAL CG1 1 1 2 1256 1 1 36 VAL CG2 C 3.828 -1.566 -2.785 1.00 . A A . 36 VAL CG2 1 1 2 1257 1 1 36 VAL H H 1.975 -1.935 -5.180 1.00 . A A . 36 VAL H 1 1 2 1258 1 1 36 VAL HA H 4.662 -3.046 -4.932 1.00 . A A . 36 VAL HA 1 1 2 1259 1 1 36 VAL HB H 2.291 -2.958 -3.082 1.00 . A A . 36 VAL HB 1 1 2 1260 1 1 36 VAL HG11 H 3.377 -4.890 -2.482 1.00 . A A . 36 VAL HG11 1 1 2 1261 1 1 36 VAL HG12 H 3.970 -3.742 -1.279 1.00 . A A . 36 VAL HG12 1 1 2 1262 1 1 36 VAL HG13 H 4.967 -4.223 -2.677 1.00 . A A . 36 VAL HG13 1 1 2 1263 1 1 36 VAL HG21 H 3.255 -0.826 -3.327 1.00 . A A . 36 VAL HG21 1 1 2 1264 1 1 36 VAL HG22 H 4.880 -1.436 -2.994 1.00 . A A . 36 VAL HG22 1 1 2 1265 1 1 36 VAL HG23 H 3.663 -1.448 -1.722 1.00 . A A . 36 VAL HG23 1 1 2 1266 1 1 36 VAL N N 2.861 -2.191 -5.519 1.00 . A A . 36 VAL N 1 1 2 1267 1 1 36 VAL O O 1.985 -4.772 -5.437 1.00 . A A . 36 VAL O 1 1 2 1268 1 1 37 SER C C 3.500 -7.541 -3.845 1.00 . A A . 37 SER C 1 1 2 1269 1 1 37 SER CA C 3.693 -6.889 -5.210 1.00 . A A . 37 SER CA 1 1 2 1270 1 1 37 SER CB C 4.823 -7.564 -5.993 1.00 . A A . 37 SER CB 1 1 2 1271 1 1 37 SER H H 4.982 -5.458 -4.702 1.00 . A A . 37 SER H 1 1 2 1272 1 1 37 SER HA H 2.778 -6.926 -5.779 1.00 . A A . 37 SER HA 1 1 2 1273 1 1 37 SER HB2 H 4.618 -8.622 -6.080 1.00 . A A . 37 SER HB2 1 1 2 1274 1 1 37 SER HB3 H 4.883 -7.133 -6.981 1.00 . A A . 37 SER HB3 1 1 2 1275 1 1 37 SER HG H 6.664 -6.875 -5.892 1.00 . A A . 37 SER HG 1 1 2 1276 1 1 37 SER N N 4.042 -5.531 -4.980 1.00 . A A . 37 SER N 1 1 2 1277 1 1 37 SER O O 4.128 -7.107 -2.874 1.00 . A A . 37 SER O 1 1 2 1278 1 1 37 SER OG O 6.069 -7.387 -5.328 1.00 . A A . 37 SER OG 1 1 2 1279 1 1 38 PRO C C 3.669 -9.822 -1.807 1.00 . A A . 38 PRO C 1 1 2 1280 1 1 38 PRO CA C 2.391 -9.256 -2.437 1.00 . A A . 38 PRO CA 1 1 2 1281 1 1 38 PRO CB C 1.406 -10.389 -2.803 1.00 . A A . 38 PRO CB 1 1 2 1282 1 1 38 PRO CD C 1.886 -9.211 -4.825 1.00 . A A . 38 PRO CD 1 1 2 1283 1 1 38 PRO CG C 1.595 -10.576 -4.272 1.00 . A A . 38 PRO CG 1 1 2 1284 1 1 38 PRO HA H 1.927 -8.572 -1.738 1.00 . A A . 38 PRO HA 1 1 2 1285 1 1 38 PRO HB2 H 1.643 -11.281 -2.238 1.00 . A A . 38 PRO HB2 1 1 2 1286 1 1 38 PRO HB3 H 0.399 -10.070 -2.574 1.00 . A A . 38 PRO HB3 1 1 2 1287 1 1 38 PRO HD2 H 2.479 -9.287 -5.726 1.00 . A A . 38 PRO HD2 1 1 2 1288 1 1 38 PRO HD3 H 0.969 -8.672 -5.012 1.00 . A A . 38 PRO HD3 1 1 2 1289 1 1 38 PRO HG2 H 2.448 -11.219 -4.430 1.00 . A A . 38 PRO HG2 1 1 2 1290 1 1 38 PRO HG3 H 0.709 -10.994 -4.725 1.00 . A A . 38 PRO HG3 1 1 2 1291 1 1 38 PRO N N 2.655 -8.589 -3.734 1.00 . A A . 38 PRO N 1 1 2 1292 1 1 38 PRO O O 3.746 -10.002 -0.607 1.00 . A A . 38 PRO O 1 1 2 1293 1 1 39 GLU C C 6.733 -9.516 -1.479 1.00 . A A . 39 GLU C 1 1 2 1294 1 1 39 GLU CA C 5.933 -10.593 -2.218 1.00 . A A . 39 GLU CA 1 1 2 1295 1 1 39 GLU CB C 6.713 -11.086 -3.444 1.00 . A A . 39 GLU CB 1 1 2 1296 1 1 39 GLU CD C 8.733 -12.226 -4.391 1.00 . A A . 39 GLU CD 1 1 2 1297 1 1 39 GLU CG C 8.042 -11.750 -3.132 1.00 . A A . 39 GLU CG 1 1 2 1298 1 1 39 GLU H H 4.585 -9.796 -3.582 1.00 . A A . 39 GLU H 1 1 2 1299 1 1 39 GLU HA H 5.754 -11.435 -1.560 1.00 . A A . 39 GLU HA 1 1 2 1300 1 1 39 GLU HB2 H 6.106 -11.802 -3.977 1.00 . A A . 39 GLU HB2 1 1 2 1301 1 1 39 GLU HB3 H 6.909 -10.252 -4.103 1.00 . A A . 39 GLU HB3 1 1 2 1302 1 1 39 GLU HG2 H 8.669 -11.022 -2.633 1.00 . A A . 39 GLU HG2 1 1 2 1303 1 1 39 GLU HG3 H 7.869 -12.592 -2.481 1.00 . A A . 39 GLU HG3 1 1 2 1304 1 1 39 GLU N N 4.670 -10.058 -2.641 1.00 . A A . 39 GLU N 1 1 2 1305 1 1 39 GLU O O 7.452 -9.803 -0.529 1.00 . A A . 39 GLU O 1 1 2 1306 1 1 39 GLU OE1 O 8.266 -13.219 -4.986 1.00 . A A . 39 GLU OE1 1 1 2 1307 1 1 39 GLU OE2 O 9.710 -11.606 -4.825 1.00 . A A . 39 GLU OE2 1 1 2 1308 1 1 40 MET C C 6.909 -6.825 0.048 1.00 . A A . 40 MET C 1 1 2 1309 1 1 40 MET CA C 7.374 -7.179 -1.342 1.00 . A A . 40 MET CA 1 1 2 1310 1 1 40 MET CB C 7.369 -5.913 -2.211 1.00 . A A . 40 MET CB 1 1 2 1311 1 1 40 MET CE C 7.306 -2.470 -2.445 1.00 . A A . 40 MET CE 1 1 2 1312 1 1 40 MET CG C 8.463 -4.925 -1.768 1.00 . A A . 40 MET CG 1 1 2 1313 1 1 40 MET H H 5.906 -8.061 -2.599 1.00 . A A . 40 MET H 1 1 2 1314 1 1 40 MET HA H 8.392 -7.532 -1.274 1.00 . A A . 40 MET HA 1 1 2 1315 1 1 40 MET HB2 H 7.385 -6.131 -3.264 1.00 . A A . 40 MET HB2 1 1 2 1316 1 1 40 MET HB3 H 6.424 -5.433 -2.008 1.00 . A A . 40 MET HB3 1 1 2 1317 1 1 40 MET HE1 H 7.326 -1.568 -3.040 1.00 . A A . 40 MET HE1 1 1 2 1318 1 1 40 MET HE2 H 7.351 -2.210 -1.397 1.00 . A A . 40 MET HE2 1 1 2 1319 1 1 40 MET HE3 H 6.404 -3.021 -2.640 1.00 . A A . 40 MET HE3 1 1 2 1320 1 1 40 MET HG2 H 8.073 -4.547 -0.831 1.00 . A A . 40 MET HG2 1 1 2 1321 1 1 40 MET HG3 H 9.394 -5.448 -1.607 1.00 . A A . 40 MET HG3 1 1 2 1322 1 1 40 MET N N 6.577 -8.254 -1.911 1.00 . A A . 40 MET N 1 1 2 1323 1 1 40 MET O O 7.724 -6.593 0.928 1.00 . A A . 40 MET O 1 1 2 1324 1 1 40 MET SD S 8.709 -3.480 -2.844 1.00 . A A . 40 MET SD 1 1 2 1325 1 1 41 ALA C C 5.490 -7.207 2.720 1.00 . A A . 41 ALA C 1 1 2 1326 1 1 41 ALA CA C 4.971 -6.409 1.509 1.00 . A A . 41 ALA CA 1 1 2 1327 1 1 41 ALA CB C 3.435 -6.530 1.395 1.00 . A A . 41 ALA CB 1 1 2 1328 1 1 41 ALA H H 5.016 -7.091 -0.501 1.00 . A A . 41 ALA H 1 1 2 1329 1 1 41 ALA HA H 5.203 -5.359 1.660 1.00 . A A . 41 ALA HA 1 1 2 1330 1 1 41 ALA HB1 H 3.153 -7.566 1.287 1.00 . A A . 41 ALA HB1 1 1 2 1331 1 1 41 ALA HB2 H 3.068 -5.982 0.536 1.00 . A A . 41 ALA HB2 1 1 2 1332 1 1 41 ALA HB3 H 2.951 -6.123 2.272 1.00 . A A . 41 ALA HB3 1 1 2 1333 1 1 41 ALA N N 5.596 -6.827 0.244 1.00 . A A . 41 ALA N 1 1 2 1334 1 1 41 ALA O O 5.853 -6.632 3.740 1.00 . A A . 41 ALA O 1 1 2 1335 1 1 42 GLU C C 7.471 -9.603 3.733 1.00 . A A . 42 GLU C 1 1 2 1336 1 1 42 GLU CA C 5.948 -9.354 3.703 1.00 . A A . 42 GLU CA 1 1 2 1337 1 1 42 GLU CB C 5.178 -10.684 3.722 1.00 . A A . 42 GLU CB 1 1 2 1338 1 1 42 GLU CD C 2.954 -11.827 3.927 1.00 . A A . 42 GLU CD 1 1 2 1339 1 1 42 GLU CG C 3.677 -10.519 3.779 1.00 . A A . 42 GLU CG 1 1 2 1340 1 1 42 GLU H H 5.212 -8.822 1.724 1.00 . A A . 42 GLU H 1 1 2 1341 1 1 42 GLU HA H 5.710 -8.816 4.607 1.00 . A A . 42 GLU HA 1 1 2 1342 1 1 42 GLU HB2 H 5.407 -11.247 2.830 1.00 . A A . 42 GLU HB2 1 1 2 1343 1 1 42 GLU HB3 H 5.474 -11.259 4.588 1.00 . A A . 42 GLU HB3 1 1 2 1344 1 1 42 GLU HG2 H 3.454 -9.926 4.654 1.00 . A A . 42 GLU HG2 1 1 2 1345 1 1 42 GLU HG3 H 3.332 -10.016 2.889 1.00 . A A . 42 GLU HG3 1 1 2 1346 1 1 42 GLU N N 5.528 -8.508 2.593 1.00 . A A . 42 GLU N 1 1 2 1347 1 1 42 GLU O O 8.007 -10.044 4.759 1.00 . A A . 42 GLU O 1 1 2 1348 1 1 42 GLU OE1 O 3.061 -12.706 3.033 1.00 . A A . 42 GLU OE1 1 1 2 1349 1 1 42 GLU OE2 O 2.253 -12.004 4.949 1.00 . A A . 42 GLU OE2 1 1 2 1350 1 1 43 ASN C C 10.550 -8.428 2.601 1.00 . A A . 43 ASN C 1 1 2 1351 1 1 43 ASN CA C 9.597 -9.630 2.554 1.00 . A A . 43 ASN CA 1 1 2 1352 1 1 43 ASN CB C 9.893 -10.488 1.322 1.00 . A A . 43 ASN CB 1 1 2 1353 1 1 43 ASN CG C 9.417 -11.930 1.443 1.00 . A A . 43 ASN CG 1 1 2 1354 1 1 43 ASN H H 7.756 -8.818 1.902 1.00 . A A . 43 ASN H 1 1 2 1355 1 1 43 ASN HA H 9.808 -10.239 3.423 1.00 . A A . 43 ASN HA 1 1 2 1356 1 1 43 ASN HB2 H 9.404 -10.049 0.465 1.00 . A A . 43 ASN HB2 1 1 2 1357 1 1 43 ASN HB3 H 10.956 -10.475 1.172 1.00 . A A . 43 ASN HB3 1 1 2 1358 1 1 43 ASN HD21 H 8.998 -11.995 -0.497 1.00 . A A . 43 ASN HD21 1 1 2 1359 1 1 43 ASN HD22 H 8.655 -13.436 0.396 1.00 . A A . 43 ASN HD22 1 1 2 1360 1 1 43 ASN N N 8.173 -9.296 2.644 1.00 . A A . 43 ASN N 1 1 2 1361 1 1 43 ASN ND2 N 8.987 -12.514 0.338 1.00 . A A . 43 ASN ND2 1 1 2 1362 1 1 43 ASN O O 11.677 -8.560 3.085 1.00 . A A . 43 ASN O 1 1 2 1363 1 1 43 ASN OD1 O 9.429 -12.509 2.520 1.00 . A A . 43 ASN OD1 1 1 2 1364 1 1 44 GLU C C 10.371 -4.893 2.681 1.00 . A A . 44 GLU C 1 1 2 1365 1 1 44 GLU CA C 11.023 -6.118 2.075 1.00 . A A . 44 GLU CA 1 1 2 1366 1 1 44 GLU CB C 11.577 -5.811 0.664 1.00 . A A . 44 GLU CB 1 1 2 1367 1 1 44 GLU CD C 13.147 -6.470 -1.195 1.00 . A A . 44 GLU CD 1 1 2 1368 1 1 44 GLU CG C 12.504 -6.878 0.105 1.00 . A A . 44 GLU CG 1 1 2 1369 1 1 44 GLU H H 9.214 -7.194 1.784 1.00 . A A . 44 GLU H 1 1 2 1370 1 1 44 GLU HA H 11.848 -6.370 2.723 1.00 . A A . 44 GLU HA 1 1 2 1371 1 1 44 GLU HB2 H 10.748 -5.707 -0.020 1.00 . A A . 44 GLU HB2 1 1 2 1372 1 1 44 GLU HB3 H 12.115 -4.874 0.685 1.00 . A A . 44 GLU HB3 1 1 2 1373 1 1 44 GLU HG2 H 13.293 -7.034 0.822 1.00 . A A . 44 GLU HG2 1 1 2 1374 1 1 44 GLU HG3 H 11.970 -7.804 -0.046 1.00 . A A . 44 GLU HG3 1 1 2 1375 1 1 44 GLU N N 10.137 -7.289 2.105 1.00 . A A . 44 GLU N 1 1 2 1376 1 1 44 GLU O O 9.164 -4.856 2.879 1.00 . A A . 44 GLU O 1 1 2 1377 1 1 44 GLU OE1 O 14.206 -5.819 -1.148 1.00 . A A . 44 GLU OE1 1 1 2 1378 1 1 44 GLU OE2 O 12.635 -6.810 -2.267 1.00 . A A . 44 GLU OE2 1 1 2 1379 1 1 45 ASP C C 9.969 -1.778 2.626 1.00 . A A . 45 ASP C 1 1 2 1380 1 1 45 ASP CA C 10.744 -2.661 3.609 1.00 . A A . 45 ASP CA 1 1 2 1381 1 1 45 ASP CB C 11.962 -1.864 4.106 1.00 . A A . 45 ASP CB 1 1 2 1382 1 1 45 ASP CG C 12.903 -2.640 5.002 1.00 . A A . 45 ASP CG 1 1 2 1383 1 1 45 ASP H H 12.133 -3.968 2.727 1.00 . A A . 45 ASP H 1 1 2 1384 1 1 45 ASP HA H 10.120 -2.902 4.461 1.00 . A A . 45 ASP HA 1 1 2 1385 1 1 45 ASP HB2 H 12.534 -1.517 3.257 1.00 . A A . 45 ASP HB2 1 1 2 1386 1 1 45 ASP HB3 H 11.608 -0.998 4.646 1.00 . A A . 45 ASP HB3 1 1 2 1387 1 1 45 ASP N N 11.184 -3.888 2.958 1.00 . A A . 45 ASP N 1 1 2 1388 1 1 45 ASP O O 10.524 -1.296 1.618 1.00 . A A . 45 ASP O 1 1 2 1389 1 1 45 ASP OD1 O 12.683 -2.668 6.238 1.00 . A A . 45 ASP OD1 1 1 2 1390 1 1 45 ASP OD2 O 13.902 -3.218 4.465 1.00 . A A . 45 ASP OD2 1 1 2 1391 1 1 46 TYR C C 8.155 0.811 2.435 1.00 . A A . 46 TYR C 1 1 2 1392 1 1 46 TYR CA C 7.912 -0.672 2.075 1.00 . A A . 46 TYR CA 1 1 2 1393 1 1 46 TYR CB C 6.398 -1.011 2.069 1.00 . A A . 46 TYR CB 1 1 2 1394 1 1 46 TYR CD1 C 5.477 0.063 -0.035 1.00 . A A . 46 TYR CD1 1 1 2 1395 1 1 46 TYR CD2 C 4.966 1.069 2.053 1.00 . A A . 46 TYR CD2 1 1 2 1396 1 1 46 TYR CE1 C 4.772 1.070 -0.678 1.00 . A A . 46 TYR CE1 1 1 2 1397 1 1 46 TYR CE2 C 4.264 2.054 1.414 1.00 . A A . 46 TYR CE2 1 1 2 1398 1 1 46 TYR CG C 5.588 0.054 1.343 1.00 . A A . 46 TYR CG 1 1 2 1399 1 1 46 TYR CZ C 4.175 2.046 0.051 1.00 . A A . 46 TYR CZ 1 1 2 1400 1 1 46 TYR H H 8.304 -2.065 3.644 1.00 . A A . 46 TYR H 1 1 2 1401 1 1 46 TYR HA H 8.287 -0.783 1.069 1.00 . A A . 46 TYR HA 1 1 2 1402 1 1 46 TYR HB2 H 6.237 -1.946 1.546 1.00 . A A . 46 TYR HB2 1 1 2 1403 1 1 46 TYR HB3 H 6.042 -1.061 3.086 1.00 . A A . 46 TYR HB3 1 1 2 1404 1 1 46 TYR HD1 H 5.948 -0.723 -0.606 1.00 . A A . 46 TYR HD1 1 1 2 1405 1 1 46 TYR HD2 H 5.037 1.072 3.132 1.00 . A A . 46 TYR HD2 1 1 2 1406 1 1 46 TYR HE1 H 4.660 1.102 -1.753 1.00 . A A . 46 TYR HE1 1 1 2 1407 1 1 46 TYR HE2 H 3.781 2.843 1.973 1.00 . A A . 46 TYR HE2 1 1 2 1408 1 1 46 TYR HH H 2.902 2.649 -1.211 1.00 . A A . 46 TYR HH 1 1 2 1409 1 1 46 TYR N N 8.696 -1.571 2.895 1.00 . A A . 46 TYR N 1 1 2 1410 1 1 46 TYR O O 7.765 1.297 3.502 1.00 . A A . 46 TYR O 1 1 2 1411 1 1 46 TYR OH O 3.504 3.042 -0.578 1.00 . A A . 46 TYR OH 1 1 2 1412 1 1 47 ILE C C 8.097 3.565 0.629 1.00 . A A . 47 ILE C 1 1 2 1413 1 1 47 ILE CA C 9.026 2.911 1.657 1.00 . A A . 47 ILE CA 1 1 2 1414 1 1 47 ILE CB C 10.513 3.288 1.366 1.00 . A A . 47 ILE CB 1 1 2 1415 1 1 47 ILE CD1 C 11.272 2.738 3.777 1.00 . A A . 47 ILE CD1 1 1 2 1416 1 1 47 ILE CG1 C 11.477 2.498 2.286 1.00 . A A . 47 ILE CG1 1 1 2 1417 1 1 47 ILE CG2 C 10.721 4.776 1.566 1.00 . A A . 47 ILE CG2 1 1 2 1418 1 1 47 ILE H H 9.140 0.895 0.843 1.00 . A A . 47 ILE H 1 1 2 1419 1 1 47 ILE HA H 8.747 3.227 2.653 1.00 . A A . 47 ILE HA 1 1 2 1420 1 1 47 ILE HB H 10.742 3.058 0.337 1.00 . A A . 47 ILE HB 1 1 2 1421 1 1 47 ILE HD11 H 10.279 2.424 4.070 1.00 . A A . 47 ILE HD11 1 1 2 1422 1 1 47 ILE HD12 H 11.391 3.792 3.977 1.00 . A A . 47 ILE HD12 1 1 2 1423 1 1 47 ILE HD13 H 12.012 2.188 4.342 1.00 . A A . 47 ILE HD13 1 1 2 1424 1 1 47 ILE HG12 H 11.360 1.437 2.109 1.00 . A A . 47 ILE HG12 1 1 2 1425 1 1 47 ILE HG13 H 12.490 2.780 2.038 1.00 . A A . 47 ILE HG13 1 1 2 1426 1 1 47 ILE HG21 H 10.405 5.014 2.577 1.00 . A A . 47 ILE HG21 1 1 2 1427 1 1 47 ILE HG22 H 10.112 5.308 0.849 1.00 . A A . 47 ILE HG22 1 1 2 1428 1 1 47 ILE HG23 H 11.763 5.026 1.433 1.00 . A A . 47 ILE HG23 1 1 2 1429 1 1 47 ILE N N 8.822 1.491 1.550 1.00 . A A . 47 ILE N 1 1 2 1430 1 1 47 ILE O O 7.821 2.953 -0.390 1.00 . A A . 47 ILE O 1 1 2 1431 1 1 48 CYS C C 7.337 6.537 -0.753 1.00 . A A . 48 CYS C 1 1 2 1432 1 1 48 CYS CA C 6.654 5.377 -0.046 1.00 . A A . 48 CYS CA 1 1 2 1433 1 1 48 CYS CB C 5.441 5.937 0.684 1.00 . A A . 48 CYS CB 1 1 2 1434 1 1 48 CYS H H 7.828 5.355 1.632 1.00 . A A . 48 CYS H 1 1 2 1435 1 1 48 CYS HA H 6.330 4.642 -0.765 1.00 . A A . 48 CYS HA 1 1 2 1436 1 1 48 CYS HB2 H 4.635 6.056 -0.025 1.00 . A A . 48 CYS HB2 1 1 2 1437 1 1 48 CYS HB3 H 5.160 5.253 1.464 1.00 . A A . 48 CYS HB3 1 1 2 1438 1 1 48 CYS N N 7.590 4.776 0.884 1.00 . A A . 48 CYS N 1 1 2 1439 1 1 48 CYS O O 8.467 6.890 -0.408 1.00 . A A . 48 CYS O 1 1 2 1440 1 1 48 CYS SG S 5.722 7.566 1.432 1.00 . A A . 48 CYS SG 1 1 2 1441 1 1 49 ILE C C 7.548 9.474 -1.520 1.00 . A A . 49 ILE C 1 1 2 1442 1 1 49 ILE CA C 7.095 8.296 -2.435 1.00 . A A . 49 ILE CA 1 1 2 1443 1 1 49 ILE CB C 6.013 8.759 -3.445 1.00 . A A . 49 ILE CB 1 1 2 1444 1 1 49 ILE CD1 C 5.559 10.386 -5.316 1.00 . A A . 49 ILE CD1 1 1 2 1445 1 1 49 ILE CG1 C 6.510 9.939 -4.245 1.00 . A A . 49 ILE CG1 1 1 2 1446 1 1 49 ILE CG2 C 4.684 9.071 -2.753 1.00 . A A . 49 ILE CG2 1 1 2 1447 1 1 49 ILE H H 5.737 6.777 -1.856 1.00 . A A . 49 ILE H 1 1 2 1448 1 1 49 ILE HA H 7.951 7.974 -3.012 1.00 . A A . 49 ILE HA 1 1 2 1449 1 1 49 ILE HB H 5.842 7.928 -4.112 1.00 . A A . 49 ILE HB 1 1 2 1450 1 1 49 ILE HD11 H 5.992 11.203 -5.872 1.00 . A A . 49 ILE HD11 1 1 2 1451 1 1 49 ILE HD12 H 4.618 10.671 -4.871 1.00 . A A . 49 ILE HD12 1 1 2 1452 1 1 49 ILE HD13 H 5.395 9.517 -5.940 1.00 . A A . 49 ILE HD13 1 1 2 1453 1 1 49 ILE HG12 H 6.656 10.741 -3.541 1.00 . A A . 49 ILE HG12 1 1 2 1454 1 1 49 ILE HG13 H 7.452 9.680 -4.703 1.00 . A A . 49 ILE HG13 1 1 2 1455 1 1 49 ILE HG21 H 3.964 9.395 -3.490 1.00 . A A . 49 ILE HG21 1 1 2 1456 1 1 49 ILE HG22 H 4.843 9.847 -2.019 1.00 . A A . 49 ILE HG22 1 1 2 1457 1 1 49 ILE HG23 H 4.317 8.184 -2.258 1.00 . A A . 49 ILE HG23 1 1 2 1458 1 1 49 ILE N N 6.625 7.153 -1.676 1.00 . A A . 49 ILE N 1 1 2 1459 1 1 49 ILE O O 8.591 10.080 -1.756 1.00 . A A . 49 ILE O 1 1 2 1460 1 1 50 ASN C C 8.259 10.467 1.392 1.00 . A A . 50 ASN C 1 1 2 1461 1 1 50 ASN CA C 7.091 10.840 0.478 1.00 . A A . 50 ASN CA 1 1 2 1462 1 1 50 ASN CB C 5.859 11.198 1.331 1.00 . A A . 50 ASN CB 1 1 2 1463 1 1 50 ASN CG C 4.707 11.770 0.531 1.00 . A A . 50 ASN CG 1 1 2 1464 1 1 50 ASN H H 5.994 9.179 -0.300 1.00 . A A . 50 ASN H 1 1 2 1465 1 1 50 ASN HA H 7.376 11.702 -0.108 1.00 . A A . 50 ASN HA 1 1 2 1466 1 1 50 ASN HB2 H 5.502 10.306 1.827 1.00 . A A . 50 ASN HB2 1 1 2 1467 1 1 50 ASN HB3 H 6.162 11.920 2.072 1.00 . A A . 50 ASN HB3 1 1 2 1468 1 1 50 ASN HD21 H 5.351 13.618 0.851 1.00 . A A . 50 ASN HD21 1 1 2 1469 1 1 50 ASN HD22 H 3.892 13.452 -0.061 1.00 . A A . 50 ASN HD22 1 1 2 1470 1 1 50 ASN N N 6.782 9.743 -0.460 1.00 . A A . 50 ASN N 1 1 2 1471 1 1 50 ASN ND2 N 4.656 13.076 0.425 1.00 . A A . 50 ASN ND2 1 1 2 1472 1 1 50 ASN O O 9.051 11.310 1.779 1.00 . A A . 50 ASN O 1 1 2 1473 1 1 50 ASN OD1 O 3.868 11.038 0.023 1.00 . A A . 50 ASN OD1 1 1 2 1474 1 1 51 CYS C C 10.750 8.619 1.772 1.00 . A A . 51 CYS C 1 1 2 1475 1 1 51 CYS CA C 9.439 8.706 2.558 1.00 . A A . 51 CYS CA 1 1 2 1476 1 1 51 CYS CB C 9.110 7.329 3.176 1.00 . A A . 51 CYS CB 1 1 2 1477 1 1 51 CYS H H 7.691 8.592 1.329 1.00 . A A . 51 CYS H 1 1 2 1478 1 1 51 CYS HA H 9.575 9.421 3.356 1.00 . A A . 51 CYS HA 1 1 2 1479 1 1 51 CYS HB2 H 8.754 6.680 2.391 1.00 . A A . 51 CYS HB2 1 1 2 1480 1 1 51 CYS HB3 H 10.035 6.919 3.557 1.00 . A A . 51 CYS HB3 1 1 2 1481 1 1 51 CYS N N 8.360 9.192 1.712 1.00 . A A . 51 CYS N 1 1 2 1482 1 1 51 CYS O O 11.830 8.786 2.327 1.00 . A A . 51 CYS O 1 1 2 1483 1 1 51 CYS SG S 7.862 7.280 4.503 1.00 . A A . 51 CYS SG 1 1 2 1484 1 1 52 ALA C C 12.350 9.575 -0.850 1.00 . A A . 52 ALA C 1 1 2 1485 1 1 52 ALA CA C 11.802 8.224 -0.381 1.00 . A A . 52 ALA CA 1 1 2 1486 1 1 52 ALA CB C 11.461 7.340 -1.565 1.00 . A A . 52 ALA CB 1 1 2 1487 1 1 52 ALA H H 9.732 8.387 0.084 1.00 . A A . 52 ALA H 1 1 2 1488 1 1 52 ALA HA H 12.556 7.722 0.210 1.00 . A A . 52 ALA HA 1 1 2 1489 1 1 52 ALA HB1 H 10.700 7.824 -2.158 1.00 . A A . 52 ALA HB1 1 1 2 1490 1 1 52 ALA HB2 H 11.070 6.408 -1.181 1.00 . A A . 52 ALA HB2 1 1 2 1491 1 1 52 ALA HB3 H 12.342 7.167 -2.170 1.00 . A A . 52 ALA HB3 1 1 2 1492 1 1 52 ALA N N 10.636 8.395 0.472 1.00 . A A . 52 ALA N 1 1 2 1493 2 2 1 ZN ZN ZN 5.748 7.513 3.708 1.00 . B A . 53 ZN ZN 1 1 2 1494 3 2 1 ZN ZN ZN -5.109 2.862 -2.179 1.00 . C A . 54 ZN ZN 1 1 3 1495 1 1 1 SER C C -11.576 6.068 1.239 1.00 . A A . 1 SER C 1 1 3 1496 1 1 1 SER CA C -12.643 6.141 2.372 1.00 . A A . 1 SER CA 1 1 3 1497 1 1 1 SER CB C -14.085 6.220 1.802 1.00 . A A . 1 SER CB 1 1 3 1498 1 1 1 SER HA H -12.537 5.269 3.002 1.00 . A A . 1 SER HA 1 1 3 1499 1 1 1 SER HB2 H -14.780 6.354 2.618 1.00 . A A . 1 SER HB2 1 1 3 1500 1 1 1 SER HB3 H -14.154 7.074 1.145 1.00 . A A . 1 SER HB3 1 1 3 1501 1 1 1 SER HG H -14.497 4.349 1.746 1.00 . A A . 1 SER HG 1 1 3 1502 1 1 1 SER N N -12.385 7.339 3.209 1.00 . A A . 1 SER N 1 1 3 1503 1 1 1 SER O O -11.666 5.270 0.282 1.00 . A A . 1 SER O 1 1 3 1504 1 1 1 SER OG O -14.447 5.048 1.084 1.00 . A A . 1 SER OG 1 1 3 1505 1 1 2 VAL C C -8.181 6.711 1.260 1.00 . A A . 2 VAL C 1 1 3 1506 1 1 2 VAL CA C -9.453 6.959 0.449 1.00 . A A . 2 VAL CA 1 1 3 1507 1 1 2 VAL CB C -9.364 8.364 -0.225 1.00 . A A . 2 VAL CB 1 1 3 1508 1 1 2 VAL CG1 C -8.245 8.409 -1.251 1.00 . A A . 2 VAL CG1 1 1 3 1509 1 1 2 VAL CG2 C -10.693 8.763 -0.858 1.00 . A A . 2 VAL CG2 1 1 3 1510 1 1 2 VAL H H -10.552 7.489 2.160 1.00 . A A . 2 VAL H 1 1 3 1511 1 1 2 VAL HA H -9.564 6.186 -0.300 1.00 . A A . 2 VAL HA 1 1 3 1512 1 1 2 VAL HB H -9.126 9.079 0.550 1.00 . A A . 2 VAL HB 1 1 3 1513 1 1 2 VAL HG11 H -8.232 9.376 -1.731 1.00 . A A . 2 VAL HG11 1 1 3 1514 1 1 2 VAL HG12 H -8.412 7.646 -1.995 1.00 . A A . 2 VAL HG12 1 1 3 1515 1 1 2 VAL HG13 H -7.294 8.250 -0.763 1.00 . A A . 2 VAL HG13 1 1 3 1516 1 1 2 VAL HG21 H -10.596 9.718 -1.346 1.00 . A A . 2 VAL HG21 1 1 3 1517 1 1 2 VAL HG22 H -11.461 8.816 -0.101 1.00 . A A . 2 VAL HG22 1 1 3 1518 1 1 2 VAL HG23 H -10.966 8.016 -1.586 1.00 . A A . 2 VAL HG23 1 1 3 1519 1 1 2 VAL N N -10.563 6.896 1.378 1.00 . A A . 2 VAL N 1 1 3 1520 1 1 2 VAL O O -8.056 7.240 2.363 1.00 . A A . 2 VAL O 1 1 3 1521 1 1 3 CYS C C -4.935 6.534 1.036 1.00 . A A . 3 CYS C 1 1 3 1522 1 1 3 CYS CA C -6.061 5.606 1.520 1.00 . A A . 3 CYS CA 1 1 3 1523 1 1 3 CYS CB C -5.635 4.121 1.349 1.00 . A A . 3 CYS CB 1 1 3 1524 1 1 3 CYS H H -7.389 5.509 -0.138 1.00 . A A . 3 CYS H 1 1 3 1525 1 1 3 CYS HA H -6.273 5.815 2.560 1.00 . A A . 3 CYS HA 1 1 3 1526 1 1 3 CYS HB2 H -5.176 3.791 2.267 1.00 . A A . 3 CYS HB2 1 1 3 1527 1 1 3 CYS HB3 H -6.506 3.514 1.149 1.00 . A A . 3 CYS HB3 1 1 3 1528 1 1 3 CYS N N -7.267 5.897 0.752 1.00 . A A . 3 CYS N 1 1 3 1529 1 1 3 CYS O O -5.178 7.434 0.216 1.00 . A A . 3 CYS O 1 1 3 1530 1 1 3 CYS SG S -4.422 3.814 0.050 1.00 . A A . 3 CYS SG 1 1 3 1531 1 1 4 ALA C C -2.033 6.461 -0.191 1.00 . A A . 4 ALA C 1 1 3 1532 1 1 4 ALA CA C -2.613 7.101 1.070 1.00 . A A . 4 ALA CA 1 1 3 1533 1 1 4 ALA CB C -1.553 7.156 2.164 1.00 . A A . 4 ALA CB 1 1 3 1534 1 1 4 ALA H H -3.584 5.555 2.121 1.00 . A A . 4 ALA H 1 1 3 1535 1 1 4 ALA HA H -2.953 8.100 0.850 1.00 . A A . 4 ALA HA 1 1 3 1536 1 1 4 ALA HB1 H -1.946 7.656 3.040 1.00 . A A . 4 ALA HB1 1 1 3 1537 1 1 4 ALA HB2 H -0.667 7.665 1.812 1.00 . A A . 4 ALA HB2 1 1 3 1538 1 1 4 ALA HB3 H -1.281 6.145 2.431 1.00 . A A . 4 ALA HB3 1 1 3 1539 1 1 4 ALA N N -3.730 6.311 1.511 1.00 . A A . 4 ALA N 1 1 3 1540 1 1 4 ALA O O -1.670 5.308 -0.170 1.00 . A A . 4 ALA O 1 1 3 1541 1 1 5 ALA C C -1.576 7.908 -3.513 1.00 . A A . 5 ALA C 1 1 3 1542 1 1 5 ALA CA C -1.384 6.795 -2.534 1.00 . A A . 5 ALA CA 1 1 3 1543 1 1 5 ALA CB C -1.964 5.493 -3.125 1.00 . A A . 5 ALA CB 1 1 3 1544 1 1 5 ALA H H -2.619 7.984 -1.286 1.00 . A A . 5 ALA H 1 1 3 1545 1 1 5 ALA HA H -0.330 6.673 -2.335 1.00 . A A . 5 ALA HA 1 1 3 1546 1 1 5 ALA HB1 H -1.825 4.684 -2.426 1.00 . A A . 5 ALA HB1 1 1 3 1547 1 1 5 ALA HB2 H -1.460 5.235 -4.044 1.00 . A A . 5 ALA HB2 1 1 3 1548 1 1 5 ALA HB3 H -3.020 5.606 -3.322 1.00 . A A . 5 ALA HB3 1 1 3 1549 1 1 5 ALA N N -2.049 7.186 -1.286 1.00 . A A . 5 ALA N 1 1 3 1550 1 1 5 ALA O O -2.588 8.604 -3.442 1.00 . A A . 5 ALA O 1 1 3 1551 1 1 6 GLN C C -1.996 8.890 -6.239 1.00 . A A . 6 GLN C 1 1 3 1552 1 1 6 GLN CA C -0.685 9.125 -5.492 1.00 . A A . 6 GLN CA 1 1 3 1553 1 1 6 GLN CB C 0.461 8.883 -6.504 1.00 . A A . 6 GLN CB 1 1 3 1554 1 1 6 GLN CD C 2.894 8.518 -6.988 1.00 . A A . 6 GLN CD 1 1 3 1555 1 1 6 GLN CG C 1.854 8.874 -5.927 1.00 . A A . 6 GLN CG 1 1 3 1556 1 1 6 GLN H H 0.330 7.788 -4.253 1.00 . A A . 6 GLN H 1 1 3 1557 1 1 6 GLN HA H -0.621 10.132 -5.107 1.00 . A A . 6 GLN HA 1 1 3 1558 1 1 6 GLN HB2 H 0.340 7.923 -6.978 1.00 . A A . 6 GLN HB2 1 1 3 1559 1 1 6 GLN HB3 H 0.426 9.656 -7.255 1.00 . A A . 6 GLN HB3 1 1 3 1560 1 1 6 GLN HE21 H 2.704 6.559 -6.627 1.00 . A A . 6 GLN HE21 1 1 3 1561 1 1 6 GLN HE22 H 3.829 7.022 -7.839 1.00 . A A . 6 GLN HE22 1 1 3 1562 1 1 6 GLN HG2 H 2.082 9.846 -5.518 1.00 . A A . 6 GLN HG2 1 1 3 1563 1 1 6 GLN HG3 H 1.895 8.128 -5.148 1.00 . A A . 6 GLN HG3 1 1 3 1564 1 1 6 GLN N N -0.573 8.141 -4.384 1.00 . A A . 6 GLN N 1 1 3 1565 1 1 6 GLN NE2 N 3.159 7.244 -7.153 1.00 . A A . 6 GLN NE2 1 1 3 1566 1 1 6 GLN O O -2.735 9.810 -6.539 1.00 . A A . 6 GLN O 1 1 3 1567 1 1 6 GLN OE1 O 3.431 9.387 -7.648 1.00 . A A . 6 GLN OE1 1 1 3 1568 1 1 7 ASN C C -4.126 6.123 -6.388 1.00 . A A . 7 ASN C 1 1 3 1569 1 1 7 ASN CA C -3.468 7.246 -7.147 1.00 . A A . 7 ASN CA 1 1 3 1570 1 1 7 ASN CB C -3.159 6.813 -8.593 1.00 . A A . 7 ASN CB 1 1 3 1571 1 1 7 ASN CG C -4.391 6.286 -9.330 1.00 . A A . 7 ASN CG 1 1 3 1572 1 1 7 ASN H H -1.536 7.071 -6.176 1.00 . A A . 7 ASN H 1 1 3 1573 1 1 7 ASN HA H -4.135 8.098 -7.184 1.00 . A A . 7 ASN HA 1 1 3 1574 1 1 7 ASN HB2 H -2.774 7.664 -9.137 1.00 . A A . 7 ASN HB2 1 1 3 1575 1 1 7 ASN HB3 H -2.414 6.031 -8.576 1.00 . A A . 7 ASN HB3 1 1 3 1576 1 1 7 ASN HD21 H -3.934 4.452 -8.792 1.00 . A A . 7 ASN HD21 1 1 3 1577 1 1 7 ASN HD22 H -5.360 4.621 -9.752 1.00 . A A . 7 ASN HD22 1 1 3 1578 1 1 7 ASN N N -2.263 7.652 -6.483 1.00 . A A . 7 ASN N 1 1 3 1579 1 1 7 ASN ND2 N -4.584 4.991 -9.293 1.00 . A A . 7 ASN ND2 1 1 3 1580 1 1 7 ASN O O -3.681 4.980 -6.462 1.00 . A A . 7 ASN O 1 1 3 1581 1 1 7 ASN OD1 O -5.134 7.029 -9.946 1.00 . A A . 7 ASN OD1 1 1 3 1582 1 1 8 CYS C C -7.032 4.962 -5.719 1.00 . A A . 8 CYS C 1 1 3 1583 1 1 8 CYS CA C -5.803 5.381 -4.960 1.00 . A A . 8 CYS CA 1 1 3 1584 1 1 8 CYS CB C -6.116 5.678 -3.493 1.00 . A A . 8 CYS CB 1 1 3 1585 1 1 8 CYS H H -5.482 7.341 -5.547 1.00 . A A . 8 CYS H 1 1 3 1586 1 1 8 CYS HA H -5.109 4.557 -5.001 1.00 . A A . 8 CYS HA 1 1 3 1587 1 1 8 CYS HB2 H -5.200 5.892 -2.961 1.00 . A A . 8 CYS HB2 1 1 3 1588 1 1 8 CYS HB3 H -6.788 6.521 -3.436 1.00 . A A . 8 CYS HB3 1 1 3 1589 1 1 8 CYS N N -5.144 6.422 -5.637 1.00 . A A . 8 CYS N 1 1 3 1590 1 1 8 CYS O O -7.999 5.710 -5.843 1.00 . A A . 8 CYS O 1 1 3 1591 1 1 8 CYS SG S -6.917 4.273 -2.652 1.00 . A A . 8 CYS SG 1 1 3 1592 1 1 9 GLN C C -9.244 2.827 -6.062 1.00 . A A . 9 GLN C 1 1 3 1593 1 1 9 GLN CA C -8.053 3.121 -6.976 1.00 . A A . 9 GLN CA 1 1 3 1594 1 1 9 GLN CB C -7.559 1.791 -7.552 1.00 . A A . 9 GLN CB 1 1 3 1595 1 1 9 GLN CD C -5.984 0.517 -9.050 1.00 . A A . 9 GLN CD 1 1 3 1596 1 1 9 GLN CG C -6.373 1.886 -8.495 1.00 . A A . 9 GLN CG 1 1 3 1597 1 1 9 GLN H H -6.123 3.270 -6.157 1.00 . A A . 9 GLN H 1 1 3 1598 1 1 9 GLN HA H -8.361 3.751 -7.796 1.00 . A A . 9 GLN HA 1 1 3 1599 1 1 9 GLN HB2 H -7.233 1.201 -6.708 1.00 . A A . 9 GLN HB2 1 1 3 1600 1 1 9 GLN HB3 H -8.359 1.251 -8.033 1.00 . A A . 9 GLN HB3 1 1 3 1601 1 1 9 GLN HE21 H -4.076 1.045 -9.152 1.00 . A A . 9 GLN HE21 1 1 3 1602 1 1 9 GLN HE22 H -4.469 -0.548 -9.694 1.00 . A A . 9 GLN HE22 1 1 3 1603 1 1 9 GLN HG2 H -6.611 2.551 -9.314 1.00 . A A . 9 GLN HG2 1 1 3 1604 1 1 9 GLN HG3 H -5.531 2.283 -7.948 1.00 . A A . 9 GLN HG3 1 1 3 1605 1 1 9 GLN N N -6.967 3.752 -6.239 1.00 . A A . 9 GLN N 1 1 3 1606 1 1 9 GLN NE2 N -4.715 0.325 -9.316 1.00 . A A . 9 GLN NE2 1 1 3 1607 1 1 9 GLN O O -10.326 2.511 -6.537 1.00 . A A . 9 GLN O 1 1 3 1608 1 1 9 GLN OE1 O -6.822 -0.363 -9.198 1.00 . A A . 9 GLN OE1 1 1 3 1609 1 1 10 ARG C C -10.508 1.139 -3.889 1.00 . A A . 10 ARG C 1 1 3 1610 1 1 10 ARG CA C -9.992 2.587 -3.706 1.00 . A A . 10 ARG CA 1 1 3 1611 1 1 10 ARG CB C -11.171 3.571 -3.686 1.00 . A A . 10 ARG CB 1 1 3 1612 1 1 10 ARG CD C -12.035 5.888 -3.346 1.00 . A A . 10 ARG CD 1 1 3 1613 1 1 10 ARG CG C -10.810 4.999 -3.329 1.00 . A A . 10 ARG CG 1 1 3 1614 1 1 10 ARG CZ C -14.358 5.556 -2.512 1.00 . A A . 10 ARG CZ 1 1 3 1615 1 1 10 ARG H H -8.175 3.372 -4.473 1.00 . A A . 10 ARG H 1 1 3 1616 1 1 10 ARG HA H -9.475 2.651 -2.759 1.00 . A A . 10 ARG HA 1 1 3 1617 1 1 10 ARG HB2 H -11.605 3.571 -4.675 1.00 . A A . 10 ARG HB2 1 1 3 1618 1 1 10 ARG HB3 H -11.905 3.204 -2.985 1.00 . A A . 10 ARG HB3 1 1 3 1619 1 1 10 ARG HD2 H -11.726 6.909 -3.186 1.00 . A A . 10 ARG HD2 1 1 3 1620 1 1 10 ARG HD3 H -12.480 5.800 -4.325 1.00 . A A . 10 ARG HD3 1 1 3 1621 1 1 10 ARG HE H -12.659 5.195 -1.472 1.00 . A A . 10 ARG HE 1 1 3 1622 1 1 10 ARG HG2 H -10.392 5.006 -2.334 1.00 . A A . 10 ARG HG2 1 1 3 1623 1 1 10 ARG HG3 H -10.088 5.377 -4.040 1.00 . A A . 10 ARG HG3 1 1 3 1624 1 1 10 ARG HH11 H -14.276 6.244 -4.444 1.00 . A A . 10 ARG HH11 1 1 3 1625 1 1 10 ARG HH12 H -15.851 5.993 -3.827 1.00 . A A . 10 ARG HH12 1 1 3 1626 1 1 10 ARG HH21 H -14.833 4.939 -0.620 1.00 . A A . 10 ARG HH21 1 1 3 1627 1 1 10 ARG HH22 H -16.166 5.253 -1.627 1.00 . A A . 10 ARG HH22 1 1 3 1628 1 1 10 ARG N N -9.018 2.958 -4.746 1.00 . A A . 10 ARG N 1 1 3 1629 1 1 10 ARG NE N -13.033 5.500 -2.331 1.00 . A A . 10 ARG NE 1 1 3 1630 1 1 10 ARG NH1 N -14.862 5.967 -3.674 1.00 . A A . 10 ARG NH1 1 1 3 1631 1 1 10 ARG NH2 N -15.170 5.231 -1.522 1.00 . A A . 10 ARG NH2 1 1 3 1632 1 1 10 ARG O O -11.700 0.890 -3.712 1.00 . A A . 10 ARG O 1 1 3 1633 1 1 11 PRO C C -10.694 -1.820 -3.195 1.00 . A A . 11 PRO C 1 1 3 1634 1 1 11 PRO CA C -10.068 -1.231 -4.432 1.00 . A A . 11 PRO CA 1 1 3 1635 1 1 11 PRO CB C -8.784 -1.991 -4.790 1.00 . A A . 11 PRO CB 1 1 3 1636 1 1 11 PRO CD C -8.152 0.216 -4.223 1.00 . A A . 11 PRO CD 1 1 3 1637 1 1 11 PRO CG C -7.799 -0.924 -5.104 1.00 . A A . 11 PRO CG 1 1 3 1638 1 1 11 PRO HA H -10.786 -1.285 -5.244 1.00 . A A . 11 PRO HA 1 1 3 1639 1 1 11 PRO HB2 H -8.469 -2.586 -3.944 1.00 . A A . 11 PRO HB2 1 1 3 1640 1 1 11 PRO HB3 H -8.965 -2.627 -5.643 1.00 . A A . 11 PRO HB3 1 1 3 1641 1 1 11 PRO HD2 H -7.714 0.101 -3.240 1.00 . A A . 11 PRO HD2 1 1 3 1642 1 1 11 PRO HD3 H -7.839 1.149 -4.669 1.00 . A A . 11 PRO HD3 1 1 3 1643 1 1 11 PRO HG2 H -6.800 -1.273 -4.887 1.00 . A A . 11 PRO HG2 1 1 3 1644 1 1 11 PRO HG3 H -7.901 -0.640 -6.140 1.00 . A A . 11 PRO HG3 1 1 3 1645 1 1 11 PRO N N -9.613 0.131 -4.171 1.00 . A A . 11 PRO N 1 1 3 1646 1 1 11 PRO O O -10.107 -1.750 -2.090 1.00 . A A . 11 PRO O 1 1 3 1647 1 1 12 CYS C C -12.680 -4.447 -2.411 1.00 . A A . 12 CYS C 1 1 3 1648 1 1 12 CYS CA C -12.570 -2.947 -2.280 1.00 . A A . 12 CYS CA 1 1 3 1649 1 1 12 CYS CB C -13.950 -2.310 -2.170 1.00 . A A . 12 CYS CB 1 1 3 1650 1 1 12 CYS H H -12.245 -2.477 -4.258 1.00 . A A . 12 CYS H 1 1 3 1651 1 1 12 CYS HA H -12.021 -2.718 -1.380 1.00 . A A . 12 CYS HA 1 1 3 1652 1 1 12 CYS HB2 H -14.481 -2.506 -3.088 1.00 . A A . 12 CYS HB2 1 1 3 1653 1 1 12 CYS HB3 H -14.481 -2.752 -1.339 1.00 . A A . 12 CYS HB3 1 1 3 1654 1 1 12 CYS HG H -13.005 0.026 -2.728 1.00 . A A . 12 CYS HG 1 1 3 1655 1 1 12 CYS N N -11.850 -2.398 -3.365 1.00 . A A . 12 CYS N 1 1 3 1656 1 1 12 CYS O O -13.490 -4.957 -3.189 1.00 . A A . 12 CYS O 1 1 3 1657 1 1 12 CYS SG S -13.917 -0.510 -1.920 1.00 . A A . 12 CYS SG 1 1 3 1658 1 1 13 LYS C C -11.590 -6.878 -0.162 1.00 . A A . 13 LYS C 1 1 3 1659 1 1 13 LYS CA C -11.849 -6.558 -1.583 1.00 . A A . 13 LYS CA 1 1 3 1660 1 1 13 LYS CB C -10.824 -7.289 -2.465 1.00 . A A . 13 LYS CB 1 1 3 1661 1 1 13 LYS CD C -10.102 -8.188 -4.666 1.00 . A A . 13 LYS CD 1 1 3 1662 1 1 13 LYS CE C -10.363 -8.299 -6.154 1.00 . A A . 13 LYS CE 1 1 3 1663 1 1 13 LYS CG C -11.076 -7.250 -3.966 1.00 . A A . 13 LYS CG 1 1 3 1664 1 1 13 LYS H H -11.092 -4.668 -1.240 1.00 . A A . 13 LYS H 1 1 3 1665 1 1 13 LYS HA H -12.842 -6.894 -1.828 1.00 . A A . 13 LYS HA 1 1 3 1666 1 1 13 LYS HB2 H -9.869 -6.821 -2.292 1.00 . A A . 13 LYS HB2 1 1 3 1667 1 1 13 LYS HB3 H -10.770 -8.318 -2.145 1.00 . A A . 13 LYS HB3 1 1 3 1668 1 1 13 LYS HD2 H -9.094 -7.821 -4.538 1.00 . A A . 13 LYS HD2 1 1 3 1669 1 1 13 LYS HD3 H -10.186 -9.169 -4.221 1.00 . A A . 13 LYS HD3 1 1 3 1670 1 1 13 LYS HE2 H -11.386 -8.598 -6.318 1.00 . A A . 13 LYS HE2 1 1 3 1671 1 1 13 LYS HE3 H -10.177 -7.345 -6.622 1.00 . A A . 13 LYS HE3 1 1 3 1672 1 1 13 LYS HG2 H -12.095 -7.548 -4.171 1.00 . A A . 13 LYS HG2 1 1 3 1673 1 1 13 LYS HG3 H -10.904 -6.246 -4.327 1.00 . A A . 13 LYS HG3 1 1 3 1674 1 1 13 LYS HZ1 H -9.715 -9.393 -7.795 1.00 . A A . 13 LYS HZ1 1 1 3 1675 1 1 13 LYS HZ2 H -9.611 -10.243 -6.341 1.00 . A A . 13 LYS HZ2 1 1 3 1676 1 1 13 LYS HZ3 H -8.472 -9.063 -6.714 1.00 . A A . 13 LYS HZ3 1 1 3 1677 1 1 13 LYS N N -11.812 -5.127 -1.719 1.00 . A A . 13 LYS N 1 1 3 1678 1 1 13 LYS NZ N -9.480 -9.308 -6.787 1.00 . A A . 13 LYS NZ 1 1 3 1679 1 1 13 LYS O O -10.964 -6.087 0.535 1.00 . A A . 13 LYS O 1 1 3 1680 1 1 14 ASP C C -10.475 -9.074 1.687 1.00 . A A . 14 ASP C 1 1 3 1681 1 1 14 ASP CA C -11.819 -8.421 1.640 1.00 . A A . 14 ASP CA 1 1 3 1682 1 1 14 ASP CB C -12.900 -9.363 2.166 1.00 . A A . 14 ASP CB 1 1 3 1683 1 1 14 ASP CG C -14.244 -8.683 2.283 1.00 . A A . 14 ASP CG 1 1 3 1684 1 1 14 ASP H H -12.674 -8.539 -0.280 1.00 . A A . 14 ASP H 1 1 3 1685 1 1 14 ASP HA H -11.775 -7.548 2.275 1.00 . A A . 14 ASP HA 1 1 3 1686 1 1 14 ASP HB2 H -12.986 -10.176 1.461 1.00 . A A . 14 ASP HB2 1 1 3 1687 1 1 14 ASP HB3 H -12.605 -9.760 3.125 1.00 . A A . 14 ASP HB3 1 1 3 1688 1 1 14 ASP N N -12.090 -7.995 0.291 1.00 . A A . 14 ASP N 1 1 3 1689 1 1 14 ASP O O -9.696 -8.830 2.599 1.00 . A A . 14 ASP O 1 1 3 1690 1 1 14 ASP OD1 O -14.493 -7.985 3.305 1.00 . A A . 14 ASP OD1 1 1 3 1691 1 1 14 ASP OD2 O -15.072 -8.839 1.334 1.00 . A A . 14 ASP OD2 1 1 3 1692 1 1 15 LYS C C -7.908 -9.619 -0.097 1.00 . A A . 15 LYS C 1 1 3 1693 1 1 15 LYS CA C -8.898 -10.537 0.619 1.00 . A A . 15 LYS CA 1 1 3 1694 1 1 15 LYS CB C -9.018 -11.865 -0.135 1.00 . A A . 15 LYS CB 1 1 3 1695 1 1 15 LYS CD C -10.175 -14.080 -0.389 1.00 . A A . 15 LYS CD 1 1 3 1696 1 1 15 LYS CE C -11.243 -15.002 0.166 1.00 . A A . 15 LYS CE 1 1 3 1697 1 1 15 LYS CG C -10.070 -12.812 0.432 1.00 . A A . 15 LYS CG 1 1 3 1698 1 1 15 LYS H H -10.783 -10.238 -0.001 1.00 . A A . 15 LYS H 1 1 3 1699 1 1 15 LYS HA H -8.547 -10.740 1.619 1.00 . A A . 15 LYS HA 1 1 3 1700 1 1 15 LYS HB2 H -9.255 -11.676 -1.172 1.00 . A A . 15 LYS HB2 1 1 3 1701 1 1 15 LYS HB3 H -8.059 -12.355 -0.080 1.00 . A A . 15 LYS HB3 1 1 3 1702 1 1 15 LYS HD2 H -10.427 -13.821 -1.406 1.00 . A A . 15 LYS HD2 1 1 3 1703 1 1 15 LYS HD3 H -9.222 -14.586 -0.372 1.00 . A A . 15 LYS HD3 1 1 3 1704 1 1 15 LYS HE2 H -11.022 -15.203 1.200 1.00 . A A . 15 LYS HE2 1 1 3 1705 1 1 15 LYS HE3 H -12.195 -14.497 0.110 1.00 . A A . 15 LYS HE3 1 1 3 1706 1 1 15 LYS HG2 H -9.791 -13.077 1.441 1.00 . A A . 15 LYS HG2 1 1 3 1707 1 1 15 LYS HG3 H -11.030 -12.316 0.434 1.00 . A A . 15 LYS HG3 1 1 3 1708 1 1 15 LYS HZ1 H -12.074 -16.875 -0.172 1.00 . A A . 15 LYS HZ1 1 1 3 1709 1 1 15 LYS HZ2 H -10.428 -16.781 -0.554 1.00 . A A . 15 LYS HZ2 1 1 3 1710 1 1 15 LYS HZ3 H -11.553 -16.097 -1.586 1.00 . A A . 15 LYS HZ3 1 1 3 1711 1 1 15 LYS N N -10.184 -9.910 0.702 1.00 . A A . 15 LYS N 1 1 3 1712 1 1 15 LYS NZ N -11.335 -16.269 -0.581 1.00 . A A . 15 LYS NZ 1 1 3 1713 1 1 15 LYS O O -7.806 -9.650 -1.333 1.00 . A A . 15 LYS O 1 1 3 1714 1 1 16 VAL C C -5.454 -7.157 1.233 1.00 . A A . 16 VAL C 1 1 3 1715 1 1 16 VAL CA C -6.236 -7.846 0.119 1.00 . A A . 16 VAL CA 1 1 3 1716 1 1 16 VAL CB C -6.800 -6.786 -0.887 1.00 . A A . 16 VAL CB 1 1 3 1717 1 1 16 VAL CG1 C -7.911 -5.987 -0.247 1.00 . A A . 16 VAL CG1 1 1 3 1718 1 1 16 VAL CG2 C -5.684 -5.855 -1.376 1.00 . A A . 16 VAL CG2 1 1 3 1719 1 1 16 VAL H H -7.456 -8.682 1.620 1.00 . A A . 16 VAL H 1 1 3 1720 1 1 16 VAL HA H -5.540 -8.486 -0.403 1.00 . A A . 16 VAL HA 1 1 3 1721 1 1 16 VAL HB H -7.215 -7.304 -1.736 1.00 . A A . 16 VAL HB 1 1 3 1722 1 1 16 VAL HG11 H -7.499 -5.525 0.636 1.00 . A A . 16 VAL HG11 1 1 3 1723 1 1 16 VAL HG12 H -8.696 -6.676 0.038 1.00 . A A . 16 VAL HG12 1 1 3 1724 1 1 16 VAL HG13 H -8.301 -5.242 -0.921 1.00 . A A . 16 VAL HG13 1 1 3 1725 1 1 16 VAL HG21 H -6.094 -5.168 -2.102 1.00 . A A . 16 VAL HG21 1 1 3 1726 1 1 16 VAL HG22 H -4.888 -6.438 -1.823 1.00 . A A . 16 VAL HG22 1 1 3 1727 1 1 16 VAL HG23 H -5.292 -5.308 -0.532 1.00 . A A . 16 VAL HG23 1 1 3 1728 1 1 16 VAL N N -7.252 -8.749 0.659 1.00 . A A . 16 VAL N 1 1 3 1729 1 1 16 VAL O O -5.999 -6.380 2.018 1.00 . A A . 16 VAL O 1 1 3 1730 1 1 17 ASP C C -2.844 -5.503 1.910 1.00 . A A . 17 ASP C 1 1 3 1731 1 1 17 ASP CA C -3.279 -6.933 2.279 1.00 . A A . 17 ASP CA 1 1 3 1732 1 1 17 ASP CB C -2.065 -7.846 2.465 1.00 . A A . 17 ASP CB 1 1 3 1733 1 1 17 ASP CG C -2.474 -9.243 2.877 1.00 . A A . 17 ASP CG 1 1 3 1734 1 1 17 ASP H H -3.969 -8.279 0.773 1.00 . A A . 17 ASP H 1 1 3 1735 1 1 17 ASP HA H -3.811 -6.888 3.216 1.00 . A A . 17 ASP HA 1 1 3 1736 1 1 17 ASP HB2 H -1.503 -7.912 1.544 1.00 . A A . 17 ASP HB2 1 1 3 1737 1 1 17 ASP HB3 H -1.439 -7.428 3.242 1.00 . A A . 17 ASP HB3 1 1 3 1738 1 1 17 ASP N N -4.211 -7.507 1.317 1.00 . A A . 17 ASP N 1 1 3 1739 1 1 17 ASP O O -2.673 -5.154 0.719 1.00 . A A . 17 ASP O 1 1 3 1740 1 1 17 ASP OD1 O -2.585 -9.508 4.097 1.00 . A A . 17 ASP OD1 1 1 3 1741 1 1 17 ASP OD2 O -2.723 -10.069 1.978 1.00 . A A . 17 ASP OD2 1 1 3 1742 1 1 18 TRP C C -0.884 -3.076 3.329 1.00 . A A . 18 TRP C 1 1 3 1743 1 1 18 TRP CA C -2.310 -3.276 2.855 1.00 . A A . 18 TRP CA 1 1 3 1744 1 1 18 TRP CB C -3.257 -2.461 3.755 1.00 . A A . 18 TRP CB 1 1 3 1745 1 1 18 TRP CD1 C -5.470 -3.569 3.103 1.00 . A A . 18 TRP CD1 1 1 3 1746 1 1 18 TRP CD2 C -5.550 -1.342 3.181 1.00 . A A . 18 TRP CD2 1 1 3 1747 1 1 18 TRP CE2 C -6.821 -1.827 2.816 1.00 . A A . 18 TRP CE2 1 1 3 1748 1 1 18 TRP CE3 C -5.360 0.036 3.299 1.00 . A A . 18 TRP CE3 1 1 3 1749 1 1 18 TRP CG C -4.700 -2.478 3.345 1.00 . A A . 18 TRP CG 1 1 3 1750 1 1 18 TRP CH2 C -7.685 0.359 2.696 1.00 . A A . 18 TRP CH2 1 1 3 1751 1 1 18 TRP CZ2 C -7.894 -0.984 2.568 1.00 . A A . 18 TRP CZ2 1 1 3 1752 1 1 18 TRP CZ3 C -6.430 0.871 3.058 1.00 . A A . 18 TRP CZ3 1 1 3 1753 1 1 18 TRP H H -2.739 -5.089 3.839 1.00 . A A . 18 TRP H 1 1 3 1754 1 1 18 TRP HA H -2.395 -2.925 1.838 1.00 . A A . 18 TRP HA 1 1 3 1755 1 1 18 TRP HB2 H -3.220 -2.861 4.757 1.00 . A A . 18 TRP HB2 1 1 3 1756 1 1 18 TRP HB3 H -2.929 -1.432 3.759 1.00 . A A . 18 TRP HB3 1 1 3 1757 1 1 18 TRP HD1 H -5.116 -4.588 3.147 1.00 . A A . 18 TRP HD1 1 1 3 1758 1 1 18 TRP HE1 H -7.437 -3.845 2.537 1.00 . A A . 18 TRP HE1 1 1 3 1759 1 1 18 TRP HE3 H -4.401 0.441 3.578 1.00 . A A . 18 TRP HE3 1 1 3 1760 1 1 18 TRP HH2 H -8.492 1.053 2.514 1.00 . A A . 18 TRP HH2 1 1 3 1761 1 1 18 TRP HZ2 H -8.863 -1.363 2.288 1.00 . A A . 18 TRP HZ2 1 1 3 1762 1 1 18 TRP HZ3 H -6.294 1.940 3.142 1.00 . A A . 18 TRP HZ3 1 1 3 1763 1 1 18 TRP N N -2.656 -4.701 2.942 1.00 . A A . 18 TRP N 1 1 3 1764 1 1 18 TRP NE1 N -6.735 -3.193 2.762 1.00 . A A . 18 TRP NE1 1 1 3 1765 1 1 18 TRP O O -0.349 -3.924 4.043 1.00 . A A . 18 TRP O 1 1 3 1766 1 1 19 VAL C C 1.232 -0.352 4.007 1.00 . A A . 19 VAL C 1 1 3 1767 1 1 19 VAL CA C 1.109 -1.710 3.334 1.00 . A A . 19 VAL CA 1 1 3 1768 1 1 19 VAL CB C 2.103 -1.796 2.123 1.00 . A A . 19 VAL CB 1 1 3 1769 1 1 19 VAL CG1 C 2.165 -3.200 1.578 1.00 . A A . 19 VAL CG1 1 1 3 1770 1 1 19 VAL CG2 C 1.702 -0.824 1.014 1.00 . A A . 19 VAL CG2 1 1 3 1771 1 1 19 VAL H H -0.668 -1.210 2.471 1.00 . A A . 19 VAL H 1 1 3 1772 1 1 19 VAL HA H 1.379 -2.468 4.055 1.00 . A A . 19 VAL HA 1 1 3 1773 1 1 19 VAL HB H 3.093 -1.530 2.462 1.00 . A A . 19 VAL HB 1 1 3 1774 1 1 19 VAL HG11 H 1.189 -3.505 1.229 1.00 . A A . 19 VAL HG11 1 1 3 1775 1 1 19 VAL HG12 H 2.479 -3.864 2.368 1.00 . A A . 19 VAL HG12 1 1 3 1776 1 1 19 VAL HG13 H 2.875 -3.264 0.768 1.00 . A A . 19 VAL HG13 1 1 3 1777 1 1 19 VAL HG21 H 2.405 -0.876 0.198 1.00 . A A . 19 VAL HG21 1 1 3 1778 1 1 19 VAL HG22 H 1.702 0.176 1.419 1.00 . A A . 19 VAL HG22 1 1 3 1779 1 1 19 VAL HG23 H 0.714 -1.067 0.653 1.00 . A A . 19 VAL HG23 1 1 3 1780 1 1 19 VAL N N -0.266 -1.969 2.954 1.00 . A A . 19 VAL N 1 1 3 1781 1 1 19 VAL O O 0.599 0.620 3.596 1.00 . A A . 19 VAL O 1 1 3 1782 1 1 20 GLN C C 3.681 1.359 5.444 1.00 . A A . 20 GLN C 1 1 3 1783 1 1 20 GLN CA C 2.266 0.920 5.780 1.00 . A A . 20 GLN CA 1 1 3 1784 1 1 20 GLN CB C 2.158 0.682 7.293 1.00 . A A . 20 GLN CB 1 1 3 1785 1 1 20 GLN CD C 2.366 1.626 9.627 1.00 . A A . 20 GLN CD 1 1 3 1786 1 1 20 GLN CG C 2.418 1.918 8.142 1.00 . A A . 20 GLN CG 1 1 3 1787 1 1 20 GLN H H 2.376 -1.143 5.391 1.00 . A A . 20 GLN H 1 1 3 1788 1 1 20 GLN HA H 1.572 1.689 5.477 1.00 . A A . 20 GLN HA 1 1 3 1789 1 1 20 GLN HB2 H 1.180 0.287 7.520 1.00 . A A . 20 GLN HB2 1 1 3 1790 1 1 20 GLN HB3 H 2.882 -0.068 7.559 1.00 . A A . 20 GLN HB3 1 1 3 1791 1 1 20 GLN HE21 H 3.694 3.040 10.011 1.00 . A A . 20 GLN HE21 1 1 3 1792 1 1 20 GLN HE22 H 3.124 2.217 11.375 1.00 . A A . 20 GLN HE22 1 1 3 1793 1 1 20 GLN HG2 H 3.385 2.335 7.900 1.00 . A A . 20 GLN HG2 1 1 3 1794 1 1 20 GLN HG3 H 1.657 2.644 7.908 1.00 . A A . 20 GLN HG3 1 1 3 1795 1 1 20 GLN N N 1.987 -0.307 5.063 1.00 . A A . 20 GLN N 1 1 3 1796 1 1 20 GLN NE2 N 3.120 2.352 10.407 1.00 . A A . 20 GLN NE2 1 1 3 1797 1 1 20 GLN O O 4.565 0.520 5.320 1.00 . A A . 20 GLN O 1 1 3 1798 1 1 20 GLN OE1 O 1.646 0.738 10.067 1.00 . A A . 20 GLN OE1 1 1 3 1799 1 1 21 CYS C C 5.949 3.366 6.325 1.00 . A A . 21 CYS C 1 1 3 1800 1 1 21 CYS CA C 5.262 3.069 5.005 1.00 . A A . 21 CYS CA 1 1 3 1801 1 1 21 CYS CB C 5.384 4.227 3.982 1.00 . A A . 21 CYS CB 1 1 3 1802 1 1 21 CYS H H 3.153 3.273 5.259 1.00 . A A . 21 CYS H 1 1 3 1803 1 1 21 CYS HA H 5.753 2.193 4.609 1.00 . A A . 21 CYS HA 1 1 3 1804 1 1 21 CYS HB2 H 6.396 4.465 3.714 1.00 . A A . 21 CYS HB2 1 1 3 1805 1 1 21 CYS HB3 H 4.886 3.929 3.077 1.00 . A A . 21 CYS HB3 1 1 3 1806 1 1 21 CYS N N 3.906 2.643 5.240 1.00 . A A . 21 CYS N 1 1 3 1807 1 1 21 CYS O O 5.788 4.453 6.920 1.00 . A A . 21 CYS O 1 1 3 1808 1 1 21 CYS SG S 4.662 5.791 4.449 1.00 . A A . 21 CYS SG 1 1 3 1809 1 1 22 ASP C C 8.696 3.321 7.934 1.00 . A A . 22 ASP C 1 1 3 1810 1 1 22 ASP CA C 7.430 2.476 8.065 1.00 . A A . 22 ASP CA 1 1 3 1811 1 1 22 ASP CB C 7.805 1.051 8.583 1.00 . A A . 22 ASP CB 1 1 3 1812 1 1 22 ASP CG C 6.620 0.176 8.983 1.00 . A A . 22 ASP CG 1 1 3 1813 1 1 22 ASP H H 6.872 1.642 6.172 1.00 . A A . 22 ASP H 1 1 3 1814 1 1 22 ASP HA H 6.769 2.952 8.777 1.00 . A A . 22 ASP HA 1 1 3 1815 1 1 22 ASP HB2 H 8.341 0.528 7.807 1.00 . A A . 22 ASP HB2 1 1 3 1816 1 1 22 ASP HB3 H 8.456 1.166 9.436 1.00 . A A . 22 ASP HB3 1 1 3 1817 1 1 22 ASP N N 6.732 2.411 6.769 1.00 . A A . 22 ASP N 1 1 3 1818 1 1 22 ASP O O 9.574 3.283 8.778 1.00 . A A . 22 ASP O 1 1 3 1819 1 1 22 ASP OD1 O 5.942 -0.383 8.082 1.00 . A A . 22 ASP OD1 1 1 3 1820 1 1 22 ASP OD2 O 6.374 0.008 10.192 1.00 . A A . 22 ASP OD2 1 1 3 1821 1 1 23 GLY C C 9.708 6.373 7.044 1.00 . A A . 23 GLY C 1 1 3 1822 1 1 23 GLY CA C 9.889 4.930 6.630 1.00 . A A . 23 GLY CA 1 1 3 1823 1 1 23 GLY H H 7.926 4.196 6.366 1.00 . A A . 23 GLY H 1 1 3 1824 1 1 23 GLY HA2 H 10.728 4.511 7.173 1.00 . A A . 23 GLY HA2 1 1 3 1825 1 1 23 GLY HA3 H 10.091 4.886 5.570 1.00 . A A . 23 GLY HA3 1 1 3 1826 1 1 23 GLY N N 8.743 4.137 6.894 1.00 . A A . 23 GLY N 1 1 3 1827 1 1 23 GLY O O 10.581 7.186 6.810 1.00 . A A . 23 GLY O 1 1 3 1828 1 1 24 GLY C C 6.951 8.626 8.149 1.00 . A A . 24 GLY C 1 1 3 1829 1 1 24 GLY CA C 8.393 8.101 8.074 1.00 . A A . 24 GLY CA 1 1 3 1830 1 1 24 GLY H H 7.871 6.045 7.842 1.00 . A A . 24 GLY H 1 1 3 1831 1 1 24 GLY HA2 H 8.827 8.222 9.051 1.00 . A A . 24 GLY HA2 1 1 3 1832 1 1 24 GLY HA3 H 8.936 8.724 7.379 1.00 . A A . 24 GLY HA3 1 1 3 1833 1 1 24 GLY N N 8.561 6.716 7.652 1.00 . A A . 24 GLY N 1 1 3 1834 1 1 24 GLY O O 6.653 9.447 8.994 1.00 . A A . 24 GLY O 1 1 3 1835 1 1 25 CYS C C 3.774 7.869 8.107 1.00 . A A . 25 CYS C 1 1 3 1836 1 1 25 CYS CA C 4.695 8.744 7.270 1.00 . A A . 25 CYS CA 1 1 3 1837 1 1 25 CYS CB C 4.113 8.817 5.858 1.00 . A A . 25 CYS CB 1 1 3 1838 1 1 25 CYS H H 6.323 7.488 6.631 1.00 . A A . 25 CYS H 1 1 3 1839 1 1 25 CYS HA H 4.763 9.744 7.677 1.00 . A A . 25 CYS HA 1 1 3 1840 1 1 25 CYS HB2 H 3.777 7.833 5.565 1.00 . A A . 25 CYS HB2 1 1 3 1841 1 1 25 CYS HB3 H 3.269 9.491 5.860 1.00 . A A . 25 CYS HB3 1 1 3 1842 1 1 25 CYS N N 6.058 8.181 7.263 1.00 . A A . 25 CYS N 1 1 3 1843 1 1 25 CYS O O 2.815 8.353 8.701 1.00 . A A . 25 CYS O 1 1 3 1844 1 1 25 CYS SG S 5.256 9.380 4.589 1.00 . A A . 25 CYS SG 1 1 3 1845 1 1 26 ASP C C 1.843 5.461 8.300 1.00 . A A . 26 ASP C 1 1 3 1846 1 1 26 ASP CA C 3.270 5.544 8.843 1.00 . A A . 26 ASP CA 1 1 3 1847 1 1 26 ASP CB C 3.275 5.760 10.376 1.00 . A A . 26 ASP CB 1 1 3 1848 1 1 26 ASP CG C 4.629 5.525 11.008 1.00 . A A . 26 ASP CG 1 1 3 1849 1 1 26 ASP H H 4.930 6.299 7.723 1.00 . A A . 26 ASP H 1 1 3 1850 1 1 26 ASP HA H 3.745 4.599 8.631 1.00 . A A . 26 ASP HA 1 1 3 1851 1 1 26 ASP HB2 H 2.977 6.773 10.599 1.00 . A A . 26 ASP HB2 1 1 3 1852 1 1 26 ASP HB3 H 2.557 5.089 10.820 1.00 . A A . 26 ASP HB3 1 1 3 1853 1 1 26 ASP N N 4.084 6.564 8.138 1.00 . A A . 26 ASP N 1 1 3 1854 1 1 26 ASP O O 0.935 4.955 8.968 1.00 . A A . 26 ASP O 1 1 3 1855 1 1 26 ASP OD1 O 5.476 6.412 10.940 1.00 . A A . 26 ASP OD1 1 1 3 1856 1 1 26 ASP OD2 O 4.839 4.435 11.579 1.00 . A A . 26 ASP OD2 1 1 3 1857 1 1 27 GLU C C 0.093 4.528 5.767 1.00 . A A . 27 GLU C 1 1 3 1858 1 1 27 GLU CA C 0.338 5.865 6.453 1.00 . A A . 27 GLU CA 1 1 3 1859 1 1 27 GLU CB C 0.102 7.055 5.532 1.00 . A A . 27 GLU CB 1 1 3 1860 1 1 27 GLU CD C -0.198 9.560 5.375 1.00 . A A . 27 GLU CD 1 1 3 1861 1 1 27 GLU CG C 0.091 8.385 6.275 1.00 . A A . 27 GLU CG 1 1 3 1862 1 1 27 GLU H H 2.402 6.277 6.561 1.00 . A A . 27 GLU H 1 1 3 1863 1 1 27 GLU HA H -0.357 5.913 7.273 1.00 . A A . 27 GLU HA 1 1 3 1864 1 1 27 GLU HB2 H 0.886 7.072 4.791 1.00 . A A . 27 GLU HB2 1 1 3 1865 1 1 27 GLU HB3 H -0.840 6.928 5.024 1.00 . A A . 27 GLU HB3 1 1 3 1866 1 1 27 GLU HG2 H -0.667 8.340 7.042 1.00 . A A . 27 GLU HG2 1 1 3 1867 1 1 27 GLU HG3 H 1.054 8.538 6.742 1.00 . A A . 27 GLU HG3 1 1 3 1868 1 1 27 GLU N N 1.650 5.913 7.070 1.00 . A A . 27 GLU N 1 1 3 1869 1 1 27 GLU O O 1.036 3.759 5.546 1.00 . A A . 27 GLU O 1 1 3 1870 1 1 27 GLU OE1 O 0.747 10.123 4.806 1.00 . A A . 27 GLU OE1 1 1 3 1871 1 1 27 GLU OE2 O -1.385 9.944 5.246 1.00 . A A . 27 GLU OE2 1 1 3 1872 1 1 28 TRP C C -1.961 3.087 3.412 1.00 . A A . 28 TRP C 1 1 3 1873 1 1 28 TRP CA C -1.591 2.965 4.882 1.00 . A A . 28 TRP CA 1 1 3 1874 1 1 28 TRP CB C -2.746 2.379 5.702 1.00 . A A . 28 TRP CB 1 1 3 1875 1 1 28 TRP CD1 C -2.206 2.976 8.147 1.00 . A A . 28 TRP CD1 1 1 3 1876 1 1 28 TRP CD2 C -2.049 0.798 7.672 1.00 . A A . 28 TRP CD2 1 1 3 1877 1 1 28 TRP CE2 C -1.718 0.993 9.028 1.00 . A A . 28 TRP CE2 1 1 3 1878 1 1 28 TRP CE3 C -2.021 -0.492 7.144 1.00 . A A . 28 TRP CE3 1 1 3 1879 1 1 28 TRP CG C -2.349 2.080 7.124 1.00 . A A . 28 TRP CG 1 1 3 1880 1 1 28 TRP CH2 C -1.348 -1.310 9.324 1.00 . A A . 28 TRP CH2 1 1 3 1881 1 1 28 TRP CZ2 C -1.367 -0.056 9.863 1.00 . A A . 28 TRP CZ2 1 1 3 1882 1 1 28 TRP CZ3 C -1.675 -1.538 7.977 1.00 . A A . 28 TRP CZ3 1 1 3 1883 1 1 28 TRP H H -1.830 4.970 5.577 1.00 . A A . 28 TRP H 1 1 3 1884 1 1 28 TRP HA H -0.747 2.290 4.945 1.00 . A A . 28 TRP HA 1 1 3 1885 1 1 28 TRP HB2 H -3.571 3.073 5.717 1.00 . A A . 28 TRP HB2 1 1 3 1886 1 1 28 TRP HB3 H -3.063 1.454 5.245 1.00 . A A . 28 TRP HB3 1 1 3 1887 1 1 28 TRP HD1 H -2.368 4.040 8.052 1.00 . A A . 28 TRP HD1 1 1 3 1888 1 1 28 TRP HE1 H -1.648 2.768 10.148 1.00 . A A . 28 TRP HE1 1 1 3 1889 1 1 28 TRP HE3 H -2.268 -0.680 6.112 1.00 . A A . 28 TRP HE3 1 1 3 1890 1 1 28 TRP HH2 H -1.077 -2.153 9.943 1.00 . A A . 28 TRP HH2 1 1 3 1891 1 1 28 TRP HZ2 H -1.113 0.106 10.900 1.00 . A A . 28 TRP HZ2 1 1 3 1892 1 1 28 TRP HZ3 H -1.648 -2.550 7.594 1.00 . A A . 28 TRP HZ3 1 1 3 1893 1 1 28 TRP N N -1.173 4.255 5.445 1.00 . A A . 28 TRP N 1 1 3 1894 1 1 28 TRP NE1 N -1.822 2.337 9.287 1.00 . A A . 28 TRP NE1 1 1 3 1895 1 1 28 TRP O O -2.834 3.889 3.032 1.00 . A A . 28 TRP O 1 1 3 1896 1 1 29 PHE C C -1.961 0.918 0.721 1.00 . A A . 29 PHE C 1 1 3 1897 1 1 29 PHE CA C -1.434 2.301 1.168 1.00 . A A . 29 PHE CA 1 1 3 1898 1 1 29 PHE CB C -0.033 2.521 0.507 1.00 . A A . 29 PHE CB 1 1 3 1899 1 1 29 PHE CD1 C 1.259 3.722 2.326 1.00 . A A . 29 PHE CD1 1 1 3 1900 1 1 29 PHE CD2 C 1.080 4.802 0.212 1.00 . A A . 29 PHE CD2 1 1 3 1901 1 1 29 PHE CE1 C 1.990 4.770 2.804 1.00 . A A . 29 PHE CE1 1 1 3 1902 1 1 29 PHE CE2 C 1.820 5.865 0.700 1.00 . A A . 29 PHE CE2 1 1 3 1903 1 1 29 PHE CG C 0.776 3.713 1.031 1.00 . A A . 29 PHE CG 1 1 3 1904 1 1 29 PHE CZ C 2.276 5.839 2.003 1.00 . A A . 29 PHE CZ 1 1 3 1905 1 1 29 PHE H H -0.647 1.659 2.995 1.00 . A A . 29 PHE H 1 1 3 1906 1 1 29 PHE HA H -2.101 3.094 0.868 1.00 . A A . 29 PHE HA 1 1 3 1907 1 1 29 PHE HB2 H 0.576 1.635 0.610 1.00 . A A . 29 PHE HB2 1 1 3 1908 1 1 29 PHE HB3 H -0.199 2.688 -0.550 1.00 . A A . 29 PHE HB3 1 1 3 1909 1 1 29 PHE HD1 H 1.033 2.884 2.966 1.00 . A A . 29 PHE HD1 1 1 3 1910 1 1 29 PHE HD2 H 0.721 4.818 -0.809 1.00 . A A . 29 PHE HD2 1 1 3 1911 1 1 29 PHE HE1 H 2.349 4.745 3.824 1.00 . A A . 29 PHE HE1 1 1 3 1912 1 1 29 PHE HE2 H 2.041 6.706 0.060 1.00 . A A . 29 PHE HE2 1 1 3 1913 1 1 29 PHE HZ H 2.863 6.641 2.425 1.00 . A A . 29 PHE HZ 1 1 3 1914 1 1 29 PHE N N -1.291 2.296 2.607 1.00 . A A . 29 PHE N 1 1 3 1915 1 1 29 PHE O O -1.841 -0.069 1.452 1.00 . A A . 29 PHE O 1 1 3 1916 1 1 30 HIS C C -1.852 -0.906 -1.948 1.00 . A A . 30 HIS C 1 1 3 1917 1 1 30 HIS CA C -2.957 -0.422 -1.071 1.00 . A A . 30 HIS CA 1 1 3 1918 1 1 30 HIS CB C -4.206 -0.263 -1.979 1.00 . A A . 30 HIS CB 1 1 3 1919 1 1 30 HIS CD2 C -6.427 -1.019 -0.874 1.00 . A A . 30 HIS CD2 1 1 3 1920 1 1 30 HIS CE1 C -7.371 0.953 -0.752 1.00 . A A . 30 HIS CE1 1 1 3 1921 1 1 30 HIS CG C -5.535 -0.105 -1.336 1.00 . A A . 30 HIS CG 1 1 3 1922 1 1 30 HIS H H -2.604 1.701 -0.951 1.00 . A A . 30 HIS H 1 1 3 1923 1 1 30 HIS HA H -3.158 -1.140 -0.291 1.00 . A A . 30 HIS HA 1 1 3 1924 1 1 30 HIS HB2 H -4.056 0.690 -2.466 1.00 . A A . 30 HIS HB2 1 1 3 1925 1 1 30 HIS HB3 H -4.272 -0.963 -2.794 1.00 . A A . 30 HIS HB3 1 1 3 1926 1 1 30 HIS HD2 H -6.282 -2.085 -0.793 1.00 . A A . 30 HIS HD2 1 1 3 1927 1 1 30 HIS HE1 H -8.093 1.732 -0.563 1.00 . A A . 30 HIS HE1 1 1 3 1928 1 1 30 HIS HE2 H -8.428 -0.765 -0.369 1.00 . A A . 30 HIS HE2 1 1 3 1929 1 1 30 HIS N N -2.531 0.852 -0.469 1.00 . A A . 30 HIS N 1 1 3 1930 1 1 30 HIS ND1 N -6.152 1.112 -1.249 1.00 . A A . 30 HIS ND1 1 1 3 1931 1 1 30 HIS NE2 N -7.557 -0.336 -0.521 1.00 . A A . 30 HIS NE2 1 1 3 1932 1 1 30 HIS O O -1.274 -0.108 -2.669 1.00 . A A . 30 HIS O 1 1 3 1933 1 1 31 GLN C C -0.807 -2.421 -4.269 1.00 . A A . 31 GLN C 1 1 3 1934 1 1 31 GLN CA C -0.545 -2.747 -2.797 1.00 . A A . 31 GLN CA 1 1 3 1935 1 1 31 GLN CB C -0.299 -4.252 -2.577 1.00 . A A . 31 GLN CB 1 1 3 1936 1 1 31 GLN CD C 0.631 -6.064 -1.097 1.00 . A A . 31 GLN CD 1 1 3 1937 1 1 31 GLN CG C 0.377 -4.589 -1.250 1.00 . A A . 31 GLN CG 1 1 3 1938 1 1 31 GLN H H -2.044 -2.781 -1.286 1.00 . A A . 31 GLN H 1 1 3 1939 1 1 31 GLN HA H 0.347 -2.207 -2.520 1.00 . A A . 31 GLN HA 1 1 3 1940 1 1 31 GLN HB2 H -1.236 -4.788 -2.609 1.00 . A A . 31 GLN HB2 1 1 3 1941 1 1 31 GLN HB3 H 0.337 -4.613 -3.373 1.00 . A A . 31 GLN HB3 1 1 3 1942 1 1 31 GLN HE21 H -1.104 -6.290 -0.183 1.00 . A A . 31 GLN HE21 1 1 3 1943 1 1 31 GLN HE22 H -0.196 -7.729 -0.379 1.00 . A A . 31 GLN HE22 1 1 3 1944 1 1 31 GLN HG2 H 1.325 -4.080 -1.198 1.00 . A A . 31 GLN HG2 1 1 3 1945 1 1 31 GLN HG3 H -0.223 -4.256 -0.418 1.00 . A A . 31 GLN HG3 1 1 3 1946 1 1 31 GLN N N -1.571 -2.202 -1.922 1.00 . A A . 31 GLN N 1 1 3 1947 1 1 31 GLN NE2 N -0.307 -6.762 -0.495 1.00 . A A . 31 GLN NE2 1 1 3 1948 1 1 31 GLN O O 0.039 -1.919 -4.928 1.00 . A A . 31 GLN O 1 1 3 1949 1 1 31 GLN OE1 O 1.670 -6.563 -1.487 1.00 . A A . 31 GLN OE1 1 1 3 1950 1 1 32 VAL C C -2.313 -0.850 -6.488 1.00 . A A . 32 VAL C 1 1 3 1951 1 1 32 VAL CA C -2.313 -2.374 -6.164 1.00 . A A . 32 VAL CA 1 1 3 1952 1 1 32 VAL CB C -3.672 -3.000 -6.593 1.00 . A A . 32 VAL CB 1 1 3 1953 1 1 32 VAL CG1 C -4.793 -2.406 -5.794 1.00 . A A . 32 VAL CG1 1 1 3 1954 1 1 32 VAL CG2 C -3.928 -2.760 -8.054 1.00 . A A . 32 VAL CG2 1 1 3 1955 1 1 32 VAL H H -2.723 -2.991 -4.165 1.00 . A A . 32 VAL H 1 1 3 1956 1 1 32 VAL HA H -1.530 -2.837 -6.742 1.00 . A A . 32 VAL HA 1 1 3 1957 1 1 32 VAL HB H -3.645 -4.065 -6.423 1.00 . A A . 32 VAL HB 1 1 3 1958 1 1 32 VAL HG11 H -4.635 -2.622 -4.750 1.00 . A A . 32 VAL HG11 1 1 3 1959 1 1 32 VAL HG12 H -5.752 -2.740 -6.172 1.00 . A A . 32 VAL HG12 1 1 3 1960 1 1 32 VAL HG13 H -4.701 -1.339 -5.952 1.00 . A A . 32 VAL HG13 1 1 3 1961 1 1 32 VAL HG21 H -3.923 -1.686 -8.171 1.00 . A A . 32 VAL HG21 1 1 3 1962 1 1 32 VAL HG22 H -4.894 -3.162 -8.323 1.00 . A A . 32 VAL HG22 1 1 3 1963 1 1 32 VAL HG23 H -3.124 -3.189 -8.628 1.00 . A A . 32 VAL HG23 1 1 3 1964 1 1 32 VAL N N -2.017 -2.644 -4.745 1.00 . A A . 32 VAL N 1 1 3 1965 1 1 32 VAL O O -1.840 -0.422 -7.538 1.00 . A A . 32 VAL O 1 1 3 1966 1 1 33 CYS C C -1.660 2.122 -5.766 1.00 . A A . 33 CYS C 1 1 3 1967 1 1 33 CYS CA C -3.000 1.375 -5.802 1.00 . A A . 33 CYS CA 1 1 3 1968 1 1 33 CYS CB C -4.077 2.026 -4.880 1.00 . A A . 33 CYS CB 1 1 3 1969 1 1 33 CYS H H -3.078 -0.560 -4.768 1.00 . A A . 33 CYS H 1 1 3 1970 1 1 33 CYS HA H -3.321 1.476 -6.828 1.00 . A A . 33 CYS HA 1 1 3 1971 1 1 33 CYS HB2 H -4.466 2.894 -5.367 1.00 . A A . 33 CYS HB2 1 1 3 1972 1 1 33 CYS HB3 H -4.897 1.332 -4.781 1.00 . A A . 33 CYS HB3 1 1 3 1973 1 1 33 CYS N N -2.831 -0.053 -5.559 1.00 . A A . 33 CYS N 1 1 3 1974 1 1 33 CYS O O -1.495 3.119 -6.447 1.00 . A A . 33 CYS O 1 1 3 1975 1 1 33 CYS SG S -3.543 2.486 -3.227 1.00 . A A . 33 CYS SG 1 1 3 1976 1 1 34 VAL C C 1.639 1.373 -5.728 1.00 . A A . 34 VAL C 1 1 3 1977 1 1 34 VAL CA C 0.595 2.237 -4.937 1.00 . A A . 34 VAL CA 1 1 3 1978 1 1 34 VAL CB C 1.027 2.447 -3.467 1.00 . A A . 34 VAL CB 1 1 3 1979 1 1 34 VAL CG1 C 1.664 1.254 -2.843 1.00 . A A . 34 VAL CG1 1 1 3 1980 1 1 34 VAL CG2 C 1.814 3.693 -3.317 1.00 . A A . 34 VAL CG2 1 1 3 1981 1 1 34 VAL H H -0.792 0.851 -4.392 1.00 . A A . 34 VAL H 1 1 3 1982 1 1 34 VAL HA H 0.518 3.197 -5.426 1.00 . A A . 34 VAL HA 1 1 3 1983 1 1 34 VAL HB H 0.175 2.533 -2.817 1.00 . A A . 34 VAL HB 1 1 3 1984 1 1 34 VAL HG11 H 1.010 0.396 -2.903 1.00 . A A . 34 VAL HG11 1 1 3 1985 1 1 34 VAL HG12 H 1.855 1.475 -1.802 1.00 . A A . 34 VAL HG12 1 1 3 1986 1 1 34 VAL HG13 H 2.591 1.062 -3.362 1.00 . A A . 34 VAL HG13 1 1 3 1987 1 1 34 VAL HG21 H 1.994 3.853 -2.265 1.00 . A A . 34 VAL HG21 1 1 3 1988 1 1 34 VAL HG22 H 1.155 4.466 -3.687 1.00 . A A . 34 VAL HG22 1 1 3 1989 1 1 34 VAL HG23 H 2.724 3.636 -3.893 1.00 . A A . 34 VAL HG23 1 1 3 1990 1 1 34 VAL N N -0.689 1.619 -4.990 1.00 . A A . 34 VAL N 1 1 3 1991 1 1 34 VAL O O 2.844 1.677 -5.759 1.00 . A A . 34 VAL O 1 1 3 1992 1 1 35 GLY C C 2.982 -1.427 -6.443 1.00 . A A . 35 GLY C 1 1 3 1993 1 1 35 GLY CA C 1.948 -0.576 -7.215 1.00 . A A . 35 GLY CA 1 1 3 1994 1 1 35 GLY H H 0.144 0.331 -6.437 1.00 . A A . 35 GLY H 1 1 3 1995 1 1 35 GLY HA2 H 1.304 -1.273 -7.728 1.00 . A A . 35 GLY HA2 1 1 3 1996 1 1 35 GLY HA3 H 2.468 0.022 -7.952 1.00 . A A . 35 GLY HA3 1 1 3 1997 1 1 35 GLY N N 1.124 0.349 -6.415 1.00 . A A . 35 GLY N 1 1 3 1998 1 1 35 GLY O O 4.122 -1.549 -6.870 1.00 . A A . 35 GLY O 1 1 3 1999 1 1 36 VAL C C 3.056 -4.358 -4.988 1.00 . A A . 36 VAL C 1 1 3 2000 1 1 36 VAL CA C 3.429 -2.941 -4.587 1.00 . A A . 36 VAL CA 1 1 3 2001 1 1 36 VAL CB C 3.185 -2.789 -3.049 1.00 . A A . 36 VAL CB 1 1 3 2002 1 1 36 VAL CG1 C 3.928 -3.811 -2.222 1.00 . A A . 36 VAL CG1 1 1 3 2003 1 1 36 VAL CG2 C 3.538 -1.419 -2.595 1.00 . A A . 36 VAL CG2 1 1 3 2004 1 1 36 VAL H H 1.706 -1.810 -4.953 1.00 . A A . 36 VAL H 1 1 3 2005 1 1 36 VAL HA H 4.467 -2.733 -4.806 1.00 . A A . 36 VAL HA 1 1 3 2006 1 1 36 VAL HB H 2.137 -2.941 -2.856 1.00 . A A . 36 VAL HB 1 1 3 2007 1 1 36 VAL HG11 H 4.991 -3.681 -2.342 1.00 . A A . 36 VAL HG11 1 1 3 2008 1 1 36 VAL HG12 H 3.651 -4.791 -2.587 1.00 . A A . 36 VAL HG12 1 1 3 2009 1 1 36 VAL HG13 H 3.641 -3.718 -1.186 1.00 . A A . 36 VAL HG13 1 1 3 2010 1 1 36 VAL HG21 H 2.843 -0.729 -3.052 1.00 . A A . 36 VAL HG21 1 1 3 2011 1 1 36 VAL HG22 H 4.548 -1.173 -2.887 1.00 . A A . 36 VAL HG22 1 1 3 2012 1 1 36 VAL HG23 H 3.454 -1.382 -1.518 1.00 . A A . 36 VAL HG23 1 1 3 2013 1 1 36 VAL N N 2.592 -2.006 -5.332 1.00 . A A . 36 VAL N 1 1 3 2014 1 1 36 VAL O O 1.891 -4.621 -5.324 1.00 . A A . 36 VAL O 1 1 3 2015 1 1 37 SER C C 3.715 -7.341 -3.884 1.00 . A A . 37 SER C 1 1 3 2016 1 1 37 SER CA C 3.758 -6.631 -5.231 1.00 . A A . 37 SER CA 1 1 3 2017 1 1 37 SER CB C 4.888 -7.164 -6.112 1.00 . A A . 37 SER CB 1 1 3 2018 1 1 37 SER H H 4.968 -5.157 -4.765 1.00 . A A . 37 SER H 1 1 3 2019 1 1 37 SER HA H 2.809 -6.763 -5.724 1.00 . A A . 37 SER HA 1 1 3 2020 1 1 37 SER HB2 H 4.791 -8.235 -6.203 1.00 . A A . 37 SER HB2 1 1 3 2021 1 1 37 SER HB3 H 4.828 -6.706 -7.088 1.00 . A A . 37 SER HB3 1 1 3 2022 1 1 37 SER HG H 6.812 -6.869 -6.241 1.00 . A A . 37 SER HG 1 1 3 2023 1 1 37 SER N N 4.011 -5.253 -4.972 1.00 . A A . 37 SER N 1 1 3 2024 1 1 37 SER O O 4.361 -6.866 -2.938 1.00 . A A . 37 SER O 1 1 3 2025 1 1 37 SER OG O 6.156 -6.859 -5.538 1.00 . A A . 37 SER OG 1 1 3 2026 1 1 38 PRO C C 4.131 -9.436 -1.732 1.00 . A A . 38 PRO C 1 1 3 2027 1 1 38 PRO CA C 2.800 -9.202 -2.474 1.00 . A A . 38 PRO CA 1 1 3 2028 1 1 38 PRO CB C 2.165 -10.542 -2.901 1.00 . A A . 38 PRO CB 1 1 3 2029 1 1 38 PRO CD C 2.268 -9.167 -4.842 1.00 . A A . 38 PRO CD 1 1 3 2030 1 1 38 PRO CG C 2.347 -10.591 -4.385 1.00 . A A . 38 PRO CG 1 1 3 2031 1 1 38 PRO HA H 2.129 -8.670 -1.814 1.00 . A A . 38 PRO HA 1 1 3 2032 1 1 38 PRO HB2 H 2.669 -11.359 -2.405 1.00 . A A . 38 PRO HB2 1 1 3 2033 1 1 38 PRO HB3 H 1.116 -10.516 -2.641 1.00 . A A . 38 PRO HB3 1 1 3 2034 1 1 38 PRO HD2 H 2.758 -9.038 -5.795 1.00 . A A . 38 PRO HD2 1 1 3 2035 1 1 38 PRO HD3 H 1.239 -8.847 -4.889 1.00 . A A . 38 PRO HD3 1 1 3 2036 1 1 38 PRO HG2 H 3.331 -10.980 -4.599 1.00 . A A . 38 PRO HG2 1 1 3 2037 1 1 38 PRO HG3 H 1.582 -11.190 -4.854 1.00 . A A . 38 PRO HG3 1 1 3 2038 1 1 38 PRO N N 2.977 -8.478 -3.762 1.00 . A A . 38 PRO N 1 1 3 2039 1 1 38 PRO O O 4.213 -9.278 -0.513 1.00 . A A . 38 PRO O 1 1 3 2040 1 1 39 GLU C C 7.131 -8.786 -1.368 1.00 . A A . 39 GLU C 1 1 3 2041 1 1 39 GLU CA C 6.480 -10.018 -1.973 1.00 . A A . 39 GLU CA 1 1 3 2042 1 1 39 GLU CB C 7.346 -10.565 -3.087 1.00 . A A . 39 GLU CB 1 1 3 2043 1 1 39 GLU CD C 7.810 -12.429 -4.680 1.00 . A A . 39 GLU CD 1 1 3 2044 1 1 39 GLU CG C 6.995 -11.969 -3.503 1.00 . A A . 39 GLU CG 1 1 3 2045 1 1 39 GLU H H 5.093 -9.873 -3.460 1.00 . A A . 39 GLU H 1 1 3 2046 1 1 39 GLU HA H 6.435 -10.769 -1.200 1.00 . A A . 39 GLU HA 1 1 3 2047 1 1 39 GLU HB2 H 7.238 -9.918 -3.946 1.00 . A A . 39 GLU HB2 1 1 3 2048 1 1 39 GLU HB3 H 8.368 -10.547 -2.760 1.00 . A A . 39 GLU HB3 1 1 3 2049 1 1 39 GLU HG2 H 7.214 -12.631 -2.675 1.00 . A A . 39 GLU HG2 1 1 3 2050 1 1 39 GLU HG3 H 5.944 -12.023 -3.747 1.00 . A A . 39 GLU HG3 1 1 3 2051 1 1 39 GLU N N 5.160 -9.764 -2.491 1.00 . A A . 39 GLU N 1 1 3 2052 1 1 39 GLU O O 7.882 -8.895 -0.436 1.00 . A A . 39 GLU O 1 1 3 2053 1 1 39 GLU OE1 O 9.029 -12.620 -4.528 1.00 . A A . 39 GLU OE1 1 1 3 2054 1 1 39 GLU OE2 O 7.223 -12.643 -5.758 1.00 . A A . 39 GLU OE2 1 1 3 2055 1 1 40 MET C C 6.941 -6.159 0.049 1.00 . A A . 40 MET C 1 1 3 2056 1 1 40 MET CA C 7.501 -6.456 -1.330 1.00 . A A . 40 MET CA 1 1 3 2057 1 1 40 MET CB C 7.408 -5.245 -2.270 1.00 . A A . 40 MET CB 1 1 3 2058 1 1 40 MET CE C 6.947 -2.214 -3.363 1.00 . A A . 40 MET CE 1 1 3 2059 1 1 40 MET CG C 8.337 -4.100 -1.849 1.00 . A A . 40 MET CG 1 1 3 2060 1 1 40 MET H H 6.134 -7.504 -2.543 1.00 . A A . 40 MET H 1 1 3 2061 1 1 40 MET HA H 8.536 -6.740 -1.196 1.00 . A A . 40 MET HA 1 1 3 2062 1 1 40 MET HB2 H 7.453 -5.494 -3.317 1.00 . A A . 40 MET HB2 1 1 3 2063 1 1 40 MET HB3 H 6.401 -4.891 -2.132 1.00 . A A . 40 MET HB3 1 1 3 2064 1 1 40 MET HE1 H 6.556 -1.839 -2.428 1.00 . A A . 40 MET HE1 1 1 3 2065 1 1 40 MET HE2 H 6.338 -3.034 -3.708 1.00 . A A . 40 MET HE2 1 1 3 2066 1 1 40 MET HE3 H 6.949 -1.429 -4.106 1.00 . A A . 40 MET HE3 1 1 3 2067 1 1 40 MET HG2 H 7.835 -3.624 -1.021 1.00 . A A . 40 MET HG2 1 1 3 2068 1 1 40 MET HG3 H 9.288 -4.502 -1.526 1.00 . A A . 40 MET HG3 1 1 3 2069 1 1 40 MET N N 6.833 -7.610 -1.861 1.00 . A A . 40 MET N 1 1 3 2070 1 1 40 MET O O 7.651 -5.716 0.924 1.00 . A A . 40 MET O 1 1 3 2071 1 1 40 MET SD S 8.601 -2.820 -3.110 1.00 . A A . 40 MET SD 1 1 3 2072 1 1 41 ALA C C 5.554 -7.284 2.575 1.00 . A A . 41 ALA C 1 1 3 2073 1 1 41 ALA CA C 4.989 -6.297 1.512 1.00 . A A . 41 ALA CA 1 1 3 2074 1 1 41 ALA CB C 3.467 -6.504 1.346 1.00 . A A . 41 ALA CB 1 1 3 2075 1 1 41 ALA H H 5.109 -6.653 -0.567 1.00 . A A . 41 ALA H 1 1 3 2076 1 1 41 ALA HA H 5.151 -5.287 1.855 1.00 . A A . 41 ALA HA 1 1 3 2077 1 1 41 ALA HB1 H 3.249 -7.506 1.005 1.00 . A A . 41 ALA HB1 1 1 3 2078 1 1 41 ALA HB2 H 3.047 -5.810 0.631 1.00 . A A . 41 ALA HB2 1 1 3 2079 1 1 41 ALA HB3 H 2.972 -6.347 2.291 1.00 . A A . 41 ALA HB3 1 1 3 2080 1 1 41 ALA N N 5.657 -6.426 0.220 1.00 . A A . 41 ALA N 1 1 3 2081 1 1 41 ALA O O 5.853 -6.889 3.717 1.00 . A A . 41 ALA O 1 1 3 2082 1 1 42 GLU C C 7.669 -9.717 3.232 1.00 . A A . 42 GLU C 1 1 3 2083 1 1 42 GLU CA C 6.151 -9.578 3.141 1.00 . A A . 42 GLU CA 1 1 3 2084 1 1 42 GLU CB C 5.574 -10.955 2.823 1.00 . A A . 42 GLU CB 1 1 3 2085 1 1 42 GLU CD C 3.662 -12.540 2.736 1.00 . A A . 42 GLU CD 1 1 3 2086 1 1 42 GLU CG C 4.077 -11.109 2.999 1.00 . A A . 42 GLU CG 1 1 3 2087 1 1 42 GLU H H 5.432 -8.734 1.267 1.00 . A A . 42 GLU H 1 1 3 2088 1 1 42 GLU HA H 5.779 -9.288 4.112 1.00 . A A . 42 GLU HA 1 1 3 2089 1 1 42 GLU HB2 H 5.809 -11.203 1.801 1.00 . A A . 42 GLU HB2 1 1 3 2090 1 1 42 GLU HB3 H 6.060 -11.685 3.452 1.00 . A A . 42 GLU HB3 1 1 3 2091 1 1 42 GLU HG2 H 3.818 -10.845 4.018 1.00 . A A . 42 GLU HG2 1 1 3 2092 1 1 42 GLU HG3 H 3.551 -10.455 2.322 1.00 . A A . 42 GLU HG3 1 1 3 2093 1 1 42 GLU N N 5.690 -8.541 2.197 1.00 . A A . 42 GLU N 1 1 3 2094 1 1 42 GLU O O 8.195 -10.117 4.273 1.00 . A A . 42 GLU O 1 1 3 2095 1 1 42 GLU OE1 O 3.778 -13.379 3.674 1.00 . A A . 42 GLU OE1 1 1 3 2096 1 1 42 GLU OE2 O 3.275 -12.860 1.593 1.00 . A A . 42 GLU OE2 1 1 3 2097 1 1 43 ASN C C 10.671 -8.428 2.268 1.00 . A A . 43 ASN C 1 1 3 2098 1 1 43 ASN CA C 9.790 -9.666 2.107 1.00 . A A . 43 ASN CA 1 1 3 2099 1 1 43 ASN CB C 10.130 -10.386 0.791 1.00 . A A . 43 ASN CB 1 1 3 2100 1 1 43 ASN CG C 9.417 -11.728 0.613 1.00 . A A . 43 ASN CG 1 1 3 2101 1 1 43 ASN H H 7.972 -8.952 1.392 1.00 . A A . 43 ASN H 1 1 3 2102 1 1 43 ASN HA H 10.013 -10.346 2.910 1.00 . A A . 43 ASN HA 1 1 3 2103 1 1 43 ASN HB2 H 9.830 -9.733 -0.019 1.00 . A A . 43 ASN HB2 1 1 3 2104 1 1 43 ASN HB3 H 11.197 -10.526 0.743 1.00 . A A . 43 ASN HB3 1 1 3 2105 1 1 43 ASN HD21 H 10.932 -12.637 1.420 1.00 . A A . 43 ASN HD21 1 1 3 2106 1 1 43 ASN HD22 H 9.620 -13.663 0.927 1.00 . A A . 43 ASN HD22 1 1 3 2107 1 1 43 ASN N N 8.371 -9.391 2.174 1.00 . A A . 43 ASN N 1 1 3 2108 1 1 43 ASN ND2 N 10.048 -12.786 1.029 1.00 . A A . 43 ASN ND2 1 1 3 2109 1 1 43 ASN O O 11.803 -8.541 2.731 1.00 . A A . 43 ASN O 1 1 3 2110 1 1 43 ASN OD1 O 8.317 -11.801 0.099 1.00 . A A . 43 ASN OD1 1 1 3 2111 1 1 44 GLU C C 10.376 -4.916 2.731 1.00 . A A . 44 GLU C 1 1 3 2112 1 1 44 GLU CA C 11.025 -6.060 1.948 1.00 . A A . 44 GLU CA 1 1 3 2113 1 1 44 GLU CB C 11.459 -5.608 0.530 1.00 . A A . 44 GLU CB 1 1 3 2114 1 1 44 GLU CD C 12.794 -6.169 -1.585 1.00 . A A . 44 GLU CD 1 1 3 2115 1 1 44 GLU CG C 12.276 -6.660 -0.236 1.00 . A A . 44 GLU CG 1 1 3 2116 1 1 44 GLU H H 9.238 -7.154 1.640 1.00 . A A . 44 GLU H 1 1 3 2117 1 1 44 GLU HA H 11.908 -6.339 2.503 1.00 . A A . 44 GLU HA 1 1 3 2118 1 1 44 GLU HB2 H 10.571 -5.390 -0.047 1.00 . A A . 44 GLU HB2 1 1 3 2119 1 1 44 GLU HB3 H 12.050 -4.708 0.623 1.00 . A A . 44 GLU HB3 1 1 3 2120 1 1 44 GLU HG2 H 13.125 -6.940 0.369 1.00 . A A . 44 GLU HG2 1 1 3 2121 1 1 44 GLU HG3 H 11.657 -7.531 -0.398 1.00 . A A . 44 GLU HG3 1 1 3 2122 1 1 44 GLU N N 10.176 -7.258 1.904 1.00 . A A . 44 GLU N 1 1 3 2123 1 1 44 GLU O O 9.240 -5.021 3.180 1.00 . A A . 44 GLU O 1 1 3 2124 1 1 44 GLU OE1 O 12.012 -6.064 -2.530 1.00 . A A . 44 GLU OE1 1 1 3 2125 1 1 44 GLU OE2 O 14.029 -5.933 -1.708 1.00 . A A . 44 GLU OE2 1 1 3 2126 1 1 45 ASP C C 9.941 -1.731 2.736 1.00 . A A . 45 ASP C 1 1 3 2127 1 1 45 ASP CA C 10.682 -2.688 3.672 1.00 . A A . 45 ASP CA 1 1 3 2128 1 1 45 ASP CB C 11.903 -1.945 4.280 1.00 . A A . 45 ASP CB 1 1 3 2129 1 1 45 ASP CG C 12.816 -2.832 5.124 1.00 . A A . 45 ASP CG 1 1 3 2130 1 1 45 ASP H H 12.058 -3.874 2.601 1.00 . A A . 45 ASP H 1 1 3 2131 1 1 45 ASP HA H 10.028 -3.001 4.472 1.00 . A A . 45 ASP HA 1 1 3 2132 1 1 45 ASP HB2 H 12.487 -1.521 3.474 1.00 . A A . 45 ASP HB2 1 1 3 2133 1 1 45 ASP HB3 H 11.546 -1.141 4.903 1.00 . A A . 45 ASP HB3 1 1 3 2134 1 1 45 ASP N N 11.137 -3.859 2.927 1.00 . A A . 45 ASP N 1 1 3 2135 1 1 45 ASP O O 10.530 -1.198 1.791 1.00 . A A . 45 ASP O 1 1 3 2136 1 1 45 ASP OD1 O 13.759 -3.409 4.559 1.00 . A A . 45 ASP OD1 1 1 3 2137 1 1 45 ASP OD2 O 12.603 -2.947 6.362 1.00 . A A . 45 ASP OD2 1 1 3 2138 1 1 46 TYR C C 8.177 0.894 2.444 1.00 . A A . 46 TYR C 1 1 3 2139 1 1 46 TYR CA C 7.878 -0.586 2.141 1.00 . A A . 46 TYR CA 1 1 3 2140 1 1 46 TYR CB C 6.334 -0.862 2.121 1.00 . A A . 46 TYR CB 1 1 3 2141 1 1 46 TYR CD1 C 5.452 0.174 -0.060 1.00 . A A . 46 TYR CD1 1 1 3 2142 1 1 46 TYR CD2 C 4.924 1.246 1.994 1.00 . A A . 46 TYR CD2 1 1 3 2143 1 1 46 TYR CE1 C 4.765 1.180 -0.745 1.00 . A A . 46 TYR CE1 1 1 3 2144 1 1 46 TYR CE2 C 4.237 2.221 1.302 1.00 . A A . 46 TYR CE2 1 1 3 2145 1 1 46 TYR CG C 5.544 0.202 1.338 1.00 . A A . 46 TYR CG 1 1 3 2146 1 1 46 TYR CZ C 4.170 2.179 -0.050 1.00 . A A . 46 TYR CZ 1 1 3 2147 1 1 46 TYR H H 8.232 -2.023 3.705 1.00 . A A . 46 TYR H 1 1 3 2148 1 1 46 TYR HA H 8.264 -0.755 1.146 1.00 . A A . 46 TYR HA 1 1 3 2149 1 1 46 TYR HB2 H 6.127 -1.811 1.649 1.00 . A A . 46 TYR HB2 1 1 3 2150 1 1 46 TYR HB3 H 5.951 -0.883 3.132 1.00 . A A . 46 TYR HB3 1 1 3 2151 1 1 46 TYR HD1 H 5.925 -0.627 -0.612 1.00 . A A . 46 TYR HD1 1 1 3 2152 1 1 46 TYR HD2 H 4.978 1.269 3.069 1.00 . A A . 46 TYR HD2 1 1 3 2153 1 1 46 TYR HE1 H 4.649 1.205 -1.820 1.00 . A A . 46 TYR HE1 1 1 3 2154 1 1 46 TYR HE2 H 3.744 3.039 1.804 1.00 . A A . 46 TYR HE2 1 1 3 2155 1 1 46 TYR HH H 2.982 2.750 -1.379 1.00 . A A . 46 TYR HH 1 1 3 2156 1 1 46 TYR N N 8.648 -1.517 2.976 1.00 . A A . 46 TYR N 1 1 3 2157 1 1 46 TYR O O 7.904 1.413 3.534 1.00 . A A . 46 TYR O 1 1 3 2158 1 1 46 TYR OH O 3.532 3.167 -0.717 1.00 . A A . 46 TYR OH 1 1 3 2159 1 1 47 ILE C C 8.053 3.611 0.478 1.00 . A A . 47 ILE C 1 1 3 2160 1 1 47 ILE CA C 9.020 2.952 1.488 1.00 . A A . 47 ILE CA 1 1 3 2161 1 1 47 ILE CB C 10.495 3.225 1.066 1.00 . A A . 47 ILE CB 1 1 3 2162 1 1 47 ILE CD1 C 11.455 2.674 3.410 1.00 . A A . 47 ILE CD1 1 1 3 2163 1 1 47 ILE CG1 C 11.483 2.380 1.908 1.00 . A A . 47 ILE CG1 1 1 3 2164 1 1 47 ILE CG2 C 10.821 4.695 1.230 1.00 . A A . 47 ILE CG2 1 1 3 2165 1 1 47 ILE H H 8.953 0.937 0.718 1.00 . A A . 47 ILE H 1 1 3 2166 1 1 47 ILE HA H 8.830 3.345 2.480 1.00 . A A . 47 ILE HA 1 1 3 2167 1 1 47 ILE HB H 10.602 2.954 0.027 1.00 . A A . 47 ILE HB 1 1 3 2168 1 1 47 ILE HD11 H 10.475 2.457 3.811 1.00 . A A . 47 ILE HD11 1 1 3 2169 1 1 47 ILE HD12 H 11.693 3.716 3.578 1.00 . A A . 47 ILE HD12 1 1 3 2170 1 1 47 ILE HD13 H 12.185 2.050 3.901 1.00 . A A . 47 ILE HD13 1 1 3 2171 1 1 47 ILE HG12 H 11.236 1.337 1.782 1.00 . A A . 47 ILE HG12 1 1 3 2172 1 1 47 ILE HG13 H 12.488 2.553 1.548 1.00 . A A . 47 ILE HG13 1 1 3 2173 1 1 47 ILE HG21 H 10.646 4.913 2.276 1.00 . A A . 47 ILE HG21 1 1 3 2174 1 1 47 ILE HG22 H 10.158 5.281 0.612 1.00 . A A . 47 ILE HG22 1 1 3 2175 1 1 47 ILE HG23 H 11.852 4.905 0.983 1.00 . A A . 47 ILE HG23 1 1 3 2176 1 1 47 ILE N N 8.740 1.535 1.462 1.00 . A A . 47 ILE N 1 1 3 2177 1 1 47 ILE O O 7.718 3.001 -0.525 1.00 . A A . 47 ILE O 1 1 3 2178 1 1 48 CYS C C 7.283 6.579 -0.920 1.00 . A A . 48 CYS C 1 1 3 2179 1 1 48 CYS CA C 6.617 5.426 -0.172 1.00 . A A . 48 CYS CA 1 1 3 2180 1 1 48 CYS CB C 5.433 6.013 0.597 1.00 . A A . 48 CYS CB 1 1 3 2181 1 1 48 CYS H H 7.866 5.383 1.482 1.00 . A A . 48 CYS H 1 1 3 2182 1 1 48 CYS HA H 6.259 4.672 -0.858 1.00 . A A . 48 CYS HA 1 1 3 2183 1 1 48 CYS HB2 H 4.626 6.166 -0.101 1.00 . A A . 48 CYS HB2 1 1 3 2184 1 1 48 CYS HB3 H 5.127 5.332 1.375 1.00 . A A . 48 CYS HB3 1 1 3 2185 1 1 48 CYS N N 7.581 4.821 0.737 1.00 . A A . 48 CYS N 1 1 3 2186 1 1 48 CYS O O 8.430 6.895 -0.664 1.00 . A A . 48 CYS O 1 1 3 2187 1 1 48 CYS SG S 5.785 7.619 1.363 1.00 . A A . 48 CYS SG 1 1 3 2188 1 1 49 ILE C C 7.514 9.534 -1.664 1.00 . A A . 49 ILE C 1 1 3 2189 1 1 49 ILE CA C 6.968 8.380 -2.568 1.00 . A A . 49 ILE CA 1 1 3 2190 1 1 49 ILE CB C 5.815 8.896 -3.468 1.00 . A A . 49 ILE CB 1 1 3 2191 1 1 49 ILE CD1 C 5.281 10.600 -5.246 1.00 . A A . 49 ILE CD1 1 1 3 2192 1 1 49 ILE CG1 C 6.291 10.084 -4.271 1.00 . A A . 49 ILE CG1 1 1 3 2193 1 1 49 ILE CG2 C 4.552 9.225 -2.660 1.00 . A A . 49 ILE CG2 1 1 3 2194 1 1 49 ILE H H 5.627 6.864 -1.925 1.00 . A A . 49 ILE H 1 1 3 2195 1 1 49 ILE HA H 7.770 8.081 -3.228 1.00 . A A . 49 ILE HA 1 1 3 2196 1 1 49 ILE HB H 5.562 8.100 -4.153 1.00 . A A . 49 ILE HB 1 1 3 2197 1 1 49 ILE HD11 H 5.683 11.454 -5.767 1.00 . A A . 49 ILE HD11 1 1 3 2198 1 1 49 ILE HD12 H 4.390 10.880 -4.708 1.00 . A A . 49 ILE HD12 1 1 3 2199 1 1 49 ILE HD13 H 5.034 9.808 -5.939 1.00 . A A . 49 ILE HD13 1 1 3 2200 1 1 49 ILE HG12 H 6.535 10.867 -3.571 1.00 . A A . 49 ILE HG12 1 1 3 2201 1 1 49 ILE HG13 H 7.178 9.781 -4.809 1.00 . A A . 49 ILE HG13 1 1 3 2202 1 1 49 ILE HG21 H 4.793 9.978 -1.922 1.00 . A A . 49 ILE HG21 1 1 3 2203 1 1 49 ILE HG22 H 4.184 8.333 -2.175 1.00 . A A . 49 ILE HG22 1 1 3 2204 1 1 49 ILE HG23 H 3.792 9.605 -3.324 1.00 . A A . 49 ILE HG23 1 1 3 2205 1 1 49 ILE N N 6.525 7.224 -1.796 1.00 . A A . 49 ILE N 1 1 3 2206 1 1 49 ILE O O 8.536 10.156 -1.969 1.00 . A A . 49 ILE O 1 1 3 2207 1 1 50 ASN C C 8.414 10.437 1.231 1.00 . A A . 50 ASN C 1 1 3 2208 1 1 50 ASN CA C 7.225 10.847 0.395 1.00 . A A . 50 ASN CA 1 1 3 2209 1 1 50 ASN CB C 6.050 11.224 1.311 1.00 . A A . 50 ASN CB 1 1 3 2210 1 1 50 ASN CG C 4.861 11.782 0.554 1.00 . A A . 50 ASN CG 1 1 3 2211 1 1 50 ASN H H 6.081 9.197 -0.325 1.00 . A A . 50 ASN H 1 1 3 2212 1 1 50 ASN HA H 7.496 11.708 -0.196 1.00 . A A . 50 ASN HA 1 1 3 2213 1 1 50 ASN HB2 H 5.731 10.340 1.840 1.00 . A A . 50 ASN HB2 1 1 3 2214 1 1 50 ASN HB3 H 6.392 11.966 2.019 1.00 . A A . 50 ASN HB3 1 1 3 2215 1 1 50 ASN HD21 H 5.477 13.641 0.858 1.00 . A A . 50 ASN HD21 1 1 3 2216 1 1 50 ASN HD22 H 4.006 13.458 -0.020 1.00 . A A . 50 ASN HD22 1 1 3 2217 1 1 50 ASN N N 6.849 9.768 -0.540 1.00 . A A . 50 ASN N 1 1 3 2218 1 1 50 ASN ND2 N 4.779 13.088 0.455 1.00 . A A . 50 ASN ND2 1 1 3 2219 1 1 50 ASN O O 9.217 11.259 1.617 1.00 . A A . 50 ASN O 1 1 3 2220 1 1 50 ASN OD1 O 3.999 11.040 0.095 1.00 . A A . 50 ASN OD1 1 1 3 2221 1 1 51 CYS C C 10.905 8.507 1.363 1.00 . A A . 51 CYS C 1 1 3 2222 1 1 51 CYS CA C 9.646 8.617 2.244 1.00 . A A . 51 CYS CA 1 1 3 2223 1 1 51 CYS CB C 9.312 7.228 2.839 1.00 . A A . 51 CYS CB 1 1 3 2224 1 1 51 CYS H H 7.825 8.567 1.135 1.00 . A A . 51 CYS H 1 1 3 2225 1 1 51 CYS HA H 9.849 9.300 3.057 1.00 . A A . 51 CYS HA 1 1 3 2226 1 1 51 CYS HB2 H 8.866 6.625 2.064 1.00 . A A . 51 CYS HB2 1 1 3 2227 1 1 51 CYS HB3 H 10.238 6.763 3.148 1.00 . A A . 51 CYS HB3 1 1 3 2228 1 1 51 CYS N N 8.526 9.149 1.489 1.00 . A A . 51 CYS N 1 1 3 2229 1 1 51 CYS O O 12.020 8.657 1.839 1.00 . A A . 51 CYS O 1 1 3 2230 1 1 51 CYS SG S 8.157 7.168 4.245 1.00 . A A . 51 CYS SG 1 1 3 2231 1 1 52 ALA C C 12.336 9.396 -1.413 1.00 . A A . 52 ALA C 1 1 3 2232 1 1 52 ALA CA C 11.821 8.065 -0.851 1.00 . A A . 52 ALA CA 1 1 3 2233 1 1 52 ALA CB C 11.405 7.134 -1.986 1.00 . A A . 52 ALA CB 1 1 3 2234 1 1 52 ALA H H 9.777 8.272 -0.245 1.00 . A A . 52 ALA H 1 1 3 2235 1 1 52 ALA HA H 12.609 7.580 -0.288 1.00 . A A . 52 ALA HA 1 1 3 2236 1 1 52 ALA HB1 H 11.072 6.197 -1.566 1.00 . A A . 52 ALA HB1 1 1 3 2237 1 1 52 ALA HB2 H 12.248 6.941 -2.631 1.00 . A A . 52 ALA HB2 1 1 3 2238 1 1 52 ALA HB3 H 10.604 7.573 -2.564 1.00 . A A . 52 ALA HB3 1 1 3 2239 1 1 52 ALA N N 10.703 8.268 0.080 1.00 . A A . 52 ALA N 1 1 3 2240 2 2 1 ZN ZN ZN 5.982 7.475 3.623 1.00 . B A . 53 ZN ZN 1 1 3 2241 3 2 1 ZN ZN ZN -5.322 2.857 -1.775 1.00 . C A . 54 ZN ZN 1 1 4 2242 1 1 1 SER C C -11.710 5.977 1.377 1.00 . A A . 1 SER C 1 1 4 2243 1 1 1 SER CA C -12.721 6.001 2.544 1.00 . A A . 1 SER CA 1 1 4 2244 1 1 1 SER CB C -14.034 6.720 2.162 1.00 . A A . 1 SER CB 1 1 4 2245 1 1 1 SER HA H -12.931 4.974 2.797 1.00 . A A . 1 SER HA 1 1 4 2246 1 1 1 SER HB2 H -14.392 6.339 1.220 1.00 . A A . 1 SER HB2 1 1 4 2247 1 1 1 SER HB3 H -14.781 6.551 2.924 1.00 . A A . 1 SER HB3 1 1 4 2248 1 1 1 SER HG H -14.128 8.530 2.857 1.00 . A A . 1 SER HG 1 1 4 2249 1 1 1 SER N N -12.132 6.649 3.751 1.00 . A A . 1 SER N 1 1 4 2250 1 1 1 SER O O -11.906 5.288 0.355 1.00 . A A . 1 SER O 1 1 4 2251 1 1 1 SER OG O -13.836 8.134 2.030 1.00 . A A . 1 SER OG 1 1 4 2252 1 1 2 VAL C C -8.227 6.628 1.344 1.00 . A A . 2 VAL C 1 1 4 2253 1 1 2 VAL CA C -9.538 6.821 0.584 1.00 . A A . 2 VAL CA 1 1 4 2254 1 1 2 VAL CB C -9.524 8.215 -0.125 1.00 . A A . 2 VAL CB 1 1 4 2255 1 1 2 VAL CG1 C -8.409 8.303 -1.156 1.00 . A A . 2 VAL CG1 1 1 4 2256 1 1 2 VAL CG2 C -10.872 8.527 -0.774 1.00 . A A . 2 VAL CG2 1 1 4 2257 1 1 2 VAL H H -10.538 7.258 2.377 1.00 . A A . 2 VAL H 1 1 4 2258 1 1 2 VAL HA H -9.663 6.035 -0.149 1.00 . A A . 2 VAL HA 1 1 4 2259 1 1 2 VAL HB H -9.338 8.959 0.634 1.00 . A A . 2 VAL HB 1 1 4 2260 1 1 2 VAL HG11 H -8.444 9.258 -1.657 1.00 . A A . 2 VAL HG11 1 1 4 2261 1 1 2 VAL HG12 H -8.528 7.512 -1.881 1.00 . A A . 2 VAL HG12 1 1 4 2262 1 1 2 VAL HG13 H -7.454 8.209 -0.661 1.00 . A A . 2 VAL HG13 1 1 4 2263 1 1 2 VAL HG21 H -10.831 9.478 -1.286 1.00 . A A . 2 VAL HG21 1 1 4 2264 1 1 2 VAL HG22 H -11.649 8.551 -0.022 1.00 . A A . 2 VAL HG22 1 1 4 2265 1 1 2 VAL HG23 H -11.105 7.753 -1.488 1.00 . A A . 2 VAL HG23 1 1 4 2266 1 1 2 VAL N N -10.622 6.734 1.548 1.00 . A A . 2 VAL N 1 1 4 2267 1 1 2 VAL O O -8.055 7.192 2.429 1.00 . A A . 2 VAL O 1 1 4 2268 1 1 3 CYS C C -5.005 6.580 1.001 1.00 . A A . 3 CYS C 1 1 4 2269 1 1 3 CYS CA C -6.071 5.584 1.511 1.00 . A A . 3 CYS CA 1 1 4 2270 1 1 3 CYS CB C -5.586 4.110 1.283 1.00 . A A . 3 CYS CB 1 1 4 2271 1 1 3 CYS H H -7.473 5.384 -0.044 1.00 . A A . 3 CYS H 1 1 4 2272 1 1 3 CYS HA H -6.254 5.741 2.566 1.00 . A A . 3 CYS HA 1 1 4 2273 1 1 3 CYS HB2 H -5.093 3.763 2.177 1.00 . A A . 3 CYS HB2 1 1 4 2274 1 1 3 CYS HB3 H -6.439 3.474 1.089 1.00 . A A . 3 CYS HB3 1 1 4 2275 1 1 3 CYS N N -7.319 5.828 0.813 1.00 . A A . 3 CYS N 1 1 4 2276 1 1 3 CYS O O -5.318 7.511 0.220 1.00 . A A . 3 CYS O 1 1 4 2277 1 1 3 CYS SG S -4.394 3.881 -0.065 1.00 . A A . 3 CYS SG 1 1 4 2278 1 1 4 ALA C C -2.092 6.545 -0.290 1.00 . A A . 4 ALA C 1 1 4 2279 1 1 4 ALA CA C -2.689 7.210 0.944 1.00 . A A . 4 ALA CA 1 1 4 2280 1 1 4 ALA CB C -1.625 7.339 2.029 1.00 . A A . 4 ALA CB 1 1 4 2281 1 1 4 ALA H H -3.578 5.642 2.029 1.00 . A A . 4 ALA H 1 1 4 2282 1 1 4 ALA HA H -3.065 8.190 0.694 1.00 . A A . 4 ALA HA 1 1 4 2283 1 1 4 ALA HB1 H -1.302 6.348 2.311 1.00 . A A . 4 ALA HB1 1 1 4 2284 1 1 4 ALA HB2 H -2.015 7.847 2.900 1.00 . A A . 4 ALA HB2 1 1 4 2285 1 1 4 ALA HB3 H -0.774 7.877 1.632 1.00 . A A . 4 ALA HB3 1 1 4 2286 1 1 4 ALA N N -3.774 6.389 1.418 1.00 . A A . 4 ALA N 1 1 4 2287 1 1 4 ALA O O -1.693 5.415 -0.220 1.00 . A A . 4 ALA O 1 1 4 2288 1 1 5 ALA C C -1.650 7.821 -3.695 1.00 . A A . 5 ALA C 1 1 4 2289 1 1 5 ALA CA C -1.463 6.774 -2.650 1.00 . A A . 5 ALA CA 1 1 4 2290 1 1 5 ALA CB C -2.009 5.439 -3.169 1.00 . A A . 5 ALA CB 1 1 4 2291 1 1 5 ALA H H -2.704 8.011 -1.448 1.00 . A A . 5 ALA H 1 1 4 2292 1 1 5 ALA HA H -0.408 6.677 -2.443 1.00 . A A . 5 ALA HA 1 1 4 2293 1 1 5 ALA HB1 H -3.055 5.549 -3.410 1.00 . A A . 5 ALA HB1 1 1 4 2294 1 1 5 ALA HB2 H -1.898 4.682 -2.409 1.00 . A A . 5 ALA HB2 1 1 4 2295 1 1 5 ALA HB3 H -1.470 5.125 -4.051 1.00 . A A . 5 ALA HB3 1 1 4 2296 1 1 5 ALA N N -2.128 7.219 -1.419 1.00 . A A . 5 ALA N 1 1 4 2297 1 1 5 ALA O O -2.690 8.477 -3.715 1.00 . A A . 5 ALA O 1 1 4 2298 1 1 6 GLN C C -1.927 8.688 -6.510 1.00 . A A . 6 GLN C 1 1 4 2299 1 1 6 GLN CA C -0.662 8.961 -5.681 1.00 . A A . 6 GLN CA 1 1 4 2300 1 1 6 GLN CB C 0.561 8.658 -6.570 1.00 . A A . 6 GLN CB 1 1 4 2301 1 1 6 GLN CD C 3.033 8.203 -6.713 1.00 . A A . 6 GLN CD 1 1 4 2302 1 1 6 GLN CG C 1.899 8.744 -5.858 1.00 . A A . 6 GLN CG 1 1 4 2303 1 1 6 GLN H H 0.288 7.701 -4.335 1.00 . A A . 6 GLN H 1 1 4 2304 1 1 6 GLN HA H -0.604 9.986 -5.344 1.00 . A A . 6 GLN HA 1 1 4 2305 1 1 6 GLN HB2 H 0.494 7.651 -6.951 1.00 . A A . 6 GLN HB2 1 1 4 2306 1 1 6 GLN HB3 H 0.585 9.353 -7.396 1.00 . A A . 6 GLN HB3 1 1 4 2307 1 1 6 GLN HE21 H 2.760 6.382 -5.976 1.00 . A A . 6 GLN HE21 1 1 4 2308 1 1 6 GLN HE22 H 4.029 6.575 -7.129 1.00 . A A . 6 GLN HE22 1 1 4 2309 1 1 6 GLN HG2 H 2.109 9.777 -5.616 1.00 . A A . 6 GLN HG2 1 1 4 2310 1 1 6 GLN HG3 H 1.854 8.167 -4.947 1.00 . A A . 6 GLN HG3 1 1 4 2311 1 1 6 GLN N N -0.611 8.035 -4.526 1.00 . A A . 6 GLN N 1 1 4 2312 1 1 6 GLN NE2 N 3.289 6.926 -6.591 1.00 . A A . 6 GLN NE2 1 1 4 2313 1 1 6 GLN O O -2.641 9.595 -6.886 1.00 . A A . 6 GLN O 1 1 4 2314 1 1 6 GLN OE1 O 3.657 8.927 -7.477 1.00 . A A . 6 GLN OE1 1 1 4 2315 1 1 7 ASN C C -4.080 5.938 -6.646 1.00 . A A . 7 ASN C 1 1 4 2316 1 1 7 ASN CA C -3.380 6.991 -7.444 1.00 . A A . 7 ASN CA 1 1 4 2317 1 1 7 ASN CB C -3.059 6.416 -8.856 1.00 . A A . 7 ASN CB 1 1 4 2318 1 1 7 ASN CG C -2.490 7.435 -9.845 1.00 . A A . 7 ASN CG 1 1 4 2319 1 1 7 ASN H H -1.461 6.865 -6.398 1.00 . A A . 7 ASN H 1 1 4 2320 1 1 7 ASN HA H -4.038 7.843 -7.559 1.00 . A A . 7 ASN HA 1 1 4 2321 1 1 7 ASN HB2 H -2.345 5.612 -8.759 1.00 . A A . 7 ASN HB2 1 1 4 2322 1 1 7 ASN HB3 H -3.966 6.006 -9.279 1.00 . A A . 7 ASN HB3 1 1 4 2323 1 1 7 ASN HD21 H -1.495 6.011 -10.829 1.00 . A A . 7 ASN HD21 1 1 4 2324 1 1 7 ASN HD22 H -1.343 7.617 -11.431 1.00 . A A . 7 ASN HD22 1 1 4 2325 1 1 7 ASN N N -2.184 7.427 -6.737 1.00 . A A . 7 ASN N 1 1 4 2326 1 1 7 ASN ND2 N -1.695 6.966 -10.787 1.00 . A A . 7 ASN ND2 1 1 4 2327 1 1 7 ASN O O -3.687 4.776 -6.681 1.00 . A A . 7 ASN O 1 1 4 2328 1 1 7 ASN OD1 O -2.776 8.622 -9.776 1.00 . A A . 7 ASN OD1 1 1 4 2329 1 1 8 CYS C C -7.029 4.870 -5.871 1.00 . A A . 8 CYS C 1 1 4 2330 1 1 8 CYS CA C -5.769 5.301 -5.169 1.00 . A A . 8 CYS CA 1 1 4 2331 1 1 8 CYS CB C -6.033 5.653 -3.707 1.00 . A A . 8 CYS CB 1 1 4 2332 1 1 8 CYS H H -5.423 7.224 -5.860 1.00 . A A . 8 CYS H 1 1 4 2333 1 1 8 CYS HA H -5.090 4.466 -5.194 1.00 . A A . 8 CYS HA 1 1 4 2334 1 1 8 CYS HB2 H -5.099 5.852 -3.201 1.00 . A A . 8 CYS HB2 1 1 4 2335 1 1 8 CYS HB3 H -6.678 6.518 -3.662 1.00 . A A . 8 CYS HB3 1 1 4 2336 1 1 8 CYS N N -5.092 6.302 -5.901 1.00 . A A . 8 CYS N 1 1 4 2337 1 1 8 CYS O O -7.984 5.625 -5.985 1.00 . A A . 8 CYS O 1 1 4 2338 1 1 8 CYS SG S -6.857 4.300 -2.801 1.00 . A A . 8 CYS SG 1 1 4 2339 1 1 9 GLN C C -9.271 2.688 -6.080 1.00 . A A . 9 GLN C 1 1 4 2340 1 1 9 GLN CA C -8.099 2.985 -7.030 1.00 . A A . 9 GLN CA 1 1 4 2341 1 1 9 GLN CB C -7.586 1.663 -7.606 1.00 . A A . 9 GLN CB 1 1 4 2342 1 1 9 GLN CD C -5.871 0.471 -9.025 1.00 . A A . 9 GLN CD 1 1 4 2343 1 1 9 GLN CG C -6.397 1.807 -8.541 1.00 . A A . 9 GLN CG 1 1 4 2344 1 1 9 GLN H H -6.152 3.158 -6.237 1.00 . A A . 9 GLN H 1 1 4 2345 1 1 9 GLN HA H -8.431 3.605 -7.847 1.00 . A A . 9 GLN HA 1 1 4 2346 1 1 9 GLN HB2 H -7.280 1.048 -6.772 1.00 . A A . 9 GLN HB2 1 1 4 2347 1 1 9 GLN HB3 H -8.388 1.159 -8.124 1.00 . A A . 9 GLN HB3 1 1 4 2348 1 1 9 GLN HE21 H -4.052 1.219 -9.113 1.00 . A A . 9 GLN HE21 1 1 4 2349 1 1 9 GLN HE22 H -4.221 -0.435 -9.592 1.00 . A A . 9 GLN HE22 1 1 4 2350 1 1 9 GLN HG2 H -6.662 2.404 -9.399 1.00 . A A . 9 GLN HG2 1 1 4 2351 1 1 9 GLN HG3 H -5.604 2.299 -8.001 1.00 . A A . 9 GLN HG3 1 1 4 2352 1 1 9 GLN N N -6.997 3.637 -6.335 1.00 . A A . 9 GLN N 1 1 4 2353 1 1 9 GLN NE2 N -4.585 0.413 -9.264 1.00 . A A . 9 GLN NE2 1 1 4 2354 1 1 9 GLN O O -10.338 2.279 -6.520 1.00 . A A . 9 GLN O 1 1 4 2355 1 1 9 GLN OE1 O -6.608 -0.495 -9.151 1.00 . A A . 9 GLN OE1 1 1 4 2356 1 1 10 ARG C C -10.525 1.115 -3.724 1.00 . A A . 10 ARG C 1 1 4 2357 1 1 10 ARG CA C -10.007 2.600 -3.694 1.00 . A A . 10 ARG CA 1 1 4 2358 1 1 10 ARG CB C -11.195 3.583 -3.737 1.00 . A A . 10 ARG CB 1 1 4 2359 1 1 10 ARG CD C -12.053 5.941 -3.519 1.00 . A A . 10 ARG CD 1 1 4 2360 1 1 10 ARG CG C -10.816 5.052 -3.565 1.00 . A A . 10 ARG CG 1 1 4 2361 1 1 10 ARG CZ C -14.216 5.868 -2.269 1.00 . A A . 10 ARG CZ 1 1 4 2362 1 1 10 ARG H H -8.202 3.352 -4.540 1.00 . A A . 10 ARG H 1 1 4 2363 1 1 10 ARG HA H -9.478 2.749 -2.762 1.00 . A A . 10 ARG HA 1 1 4 2364 1 1 10 ARG HB2 H -11.670 3.469 -4.701 1.00 . A A . 10 ARG HB2 1 1 4 2365 1 1 10 ARG HB3 H -11.900 3.308 -2.967 1.00 . A A . 10 ARG HB3 1 1 4 2366 1 1 10 ARG HD2 H -11.735 6.972 -3.464 1.00 . A A . 10 ARG HD2 1 1 4 2367 1 1 10 ARG HD3 H -12.619 5.788 -4.426 1.00 . A A . 10 ARG HD3 1 1 4 2368 1 1 10 ARG HE H -12.453 5.177 -1.608 1.00 . A A . 10 ARG HE 1 1 4 2369 1 1 10 ARG HG2 H -10.281 5.154 -2.633 1.00 . A A . 10 ARG HG2 1 1 4 2370 1 1 10 ARG HG3 H -10.191 5.356 -4.392 1.00 . A A . 10 ARG HG3 1 1 4 2371 1 1 10 ARG HH11 H -14.397 6.766 -4.113 1.00 . A A . 10 ARG HH11 1 1 4 2372 1 1 10 ARG HH12 H -15.840 6.661 -3.196 1.00 . A A . 10 ARG HH12 1 1 4 2373 1 1 10 ARG HH21 H -14.422 5.041 -0.412 1.00 . A A . 10 ARG HH21 1 1 4 2374 1 1 10 ARG HH22 H -15.868 5.660 -1.082 1.00 . A A . 10 ARG HH22 1 1 4 2375 1 1 10 ARG N N -9.043 2.910 -4.776 1.00 . A A . 10 ARG N 1 1 4 2376 1 1 10 ARG NE N -12.910 5.615 -2.361 1.00 . A A . 10 ARG NE 1 1 4 2377 1 1 10 ARG NH1 N -14.855 6.471 -3.264 1.00 . A A . 10 ARG NH1 1 1 4 2378 1 1 10 ARG NH2 N -14.881 5.499 -1.175 1.00 . A A . 10 ARG NH2 1 1 4 2379 1 1 10 ARG O O -11.689 0.878 -3.448 1.00 . A A . 10 ARG O 1 1 4 2380 1 1 11 PRO C C -10.496 -1.892 -2.715 1.00 . A A . 11 PRO C 1 1 4 2381 1 1 11 PRO CA C -10.088 -1.322 -4.072 1.00 . A A . 11 PRO CA 1 1 4 2382 1 1 11 PRO CB C -8.844 -2.064 -4.606 1.00 . A A . 11 PRO CB 1 1 4 2383 1 1 11 PRO CD C -8.198 0.177 -4.137 1.00 . A A . 11 PRO CD 1 1 4 2384 1 1 11 PRO CG C -7.893 -0.983 -5.015 1.00 . A A . 11 PRO CG 1 1 4 2385 1 1 11 PRO HA H -10.917 -1.437 -4.756 1.00 . A A . 11 PRO HA 1 1 4 2386 1 1 11 PRO HB2 H -8.424 -2.681 -3.825 1.00 . A A . 11 PRO HB2 1 1 4 2387 1 1 11 PRO HB3 H -9.123 -2.681 -5.447 1.00 . A A . 11 PRO HB3 1 1 4 2388 1 1 11 PRO HD2 H -7.685 0.103 -3.188 1.00 . A A . 11 PRO HD2 1 1 4 2389 1 1 11 PRO HD3 H -7.936 1.098 -4.637 1.00 . A A . 11 PRO HD3 1 1 4 2390 1 1 11 PRO HG2 H -6.873 -1.302 -4.855 1.00 . A A . 11 PRO HG2 1 1 4 2391 1 1 11 PRO HG3 H -8.060 -0.718 -6.048 1.00 . A A . 11 PRO HG3 1 1 4 2392 1 1 11 PRO N N -9.639 0.080 -3.969 1.00 . A A . 11 PRO N 1 1 4 2393 1 1 11 PRO O O -9.790 -1.685 -1.699 1.00 . A A . 11 PRO O 1 1 4 2394 1 1 12 CYS C C -12.348 -4.694 -1.736 1.00 . A A . 12 CYS C 1 1 4 2395 1 1 12 CYS CA C -12.120 -3.207 -1.499 1.00 . A A . 12 CYS CA 1 1 4 2396 1 1 12 CYS CB C -13.441 -2.535 -1.104 1.00 . A A . 12 CYS CB 1 1 4 2397 1 1 12 CYS H H -12.123 -2.750 -3.519 1.00 . A A . 12 CYS H 1 1 4 2398 1 1 12 CYS HA H -11.405 -3.078 -0.700 1.00 . A A . 12 CYS HA 1 1 4 2399 1 1 12 CYS HB2 H -13.279 -1.474 -0.988 1.00 . A A . 12 CYS HB2 1 1 4 2400 1 1 12 CYS HB3 H -14.146 -2.707 -1.906 1.00 . A A . 12 CYS HB3 1 1 4 2401 1 1 12 CYS HG H -14.097 -2.204 1.336 1.00 . A A . 12 CYS HG 1 1 4 2402 1 1 12 CYS N N -11.602 -2.603 -2.699 1.00 . A A . 12 CYS N 1 1 4 2403 1 1 12 CYS O O -13.131 -5.070 -2.607 1.00 . A A . 12 CYS O 1 1 4 2404 1 1 12 CYS SG S -14.188 -3.165 0.429 1.00 . A A . 12 CYS SG 1 1 4 2405 1 1 13 LYS C C -11.431 -7.509 0.310 1.00 . A A . 13 LYS C 1 1 4 2406 1 1 13 LYS CA C -11.763 -6.975 -1.046 1.00 . A A . 13 LYS CA 1 1 4 2407 1 1 13 LYS CB C -10.817 -7.640 -2.072 1.00 . A A . 13 LYS CB 1 1 4 2408 1 1 13 LYS CD C -10.115 -8.055 -4.426 1.00 . A A . 13 LYS CD 1 1 4 2409 1 1 13 LYS CE C -10.303 -7.707 -5.890 1.00 . A A . 13 LYS CE 1 1 4 2410 1 1 13 LYS CG C -11.041 -7.262 -3.526 1.00 . A A . 13 LYS CG 1 1 4 2411 1 1 13 LYS H H -10.954 -5.183 -0.369 1.00 . A A . 13 LYS H 1 1 4 2412 1 1 13 LYS HA H -12.787 -7.209 -1.290 1.00 . A A . 13 LYS HA 1 1 4 2413 1 1 13 LYS HB2 H -9.807 -7.356 -1.817 1.00 . A A . 13 LYS HB2 1 1 4 2414 1 1 13 LYS HB3 H -10.911 -8.712 -1.968 1.00 . A A . 13 LYS HB3 1 1 4 2415 1 1 13 LYS HD2 H -9.091 -7.838 -4.157 1.00 . A A . 13 LYS HD2 1 1 4 2416 1 1 13 LYS HD3 H -10.304 -9.109 -4.285 1.00 . A A . 13 LYS HD3 1 1 4 2417 1 1 13 LYS HE2 H -11.324 -7.896 -6.181 1.00 . A A . 13 LYS HE2 1 1 4 2418 1 1 13 LYS HE3 H -10.051 -6.669 -6.047 1.00 . A A . 13 LYS HE3 1 1 4 2419 1 1 13 LYS HG2 H -12.073 -7.448 -3.786 1.00 . A A . 13 LYS HG2 1 1 4 2420 1 1 13 LYS HG3 H -10.821 -6.211 -3.643 1.00 . A A . 13 LYS HG3 1 1 4 2421 1 1 13 LYS HZ1 H -9.547 -8.286 -7.753 1.00 . A A . 13 LYS HZ1 1 1 4 2422 1 1 13 LYS HZ2 H -9.661 -9.546 -6.650 1.00 . A A . 13 LYS HZ2 1 1 4 2423 1 1 13 LYS HZ3 H -8.423 -8.404 -6.526 1.00 . A A . 13 LYS HZ3 1 1 4 2424 1 1 13 LYS N N -11.621 -5.523 -1.004 1.00 . A A . 13 LYS N 1 1 4 2425 1 1 13 LYS NZ N -9.431 -8.534 -6.751 1.00 . A A . 13 LYS NZ 1 1 4 2426 1 1 13 LYS O O -10.828 -6.804 1.115 1.00 . A A . 13 LYS O 1 1 4 2427 1 1 14 ASP C C -10.093 -10.025 1.714 1.00 . A A . 14 ASP C 1 1 4 2428 1 1 14 ASP CA C -11.462 -9.415 1.849 1.00 . A A . 14 ASP CA 1 1 4 2429 1 1 14 ASP CB C -12.458 -10.538 2.184 1.00 . A A . 14 ASP CB 1 1 4 2430 1 1 14 ASP CG C -13.868 -10.052 2.333 1.00 . A A . 14 ASP CG 1 1 4 2431 1 1 14 ASP H H -12.353 -9.249 -0.077 1.00 . A A . 14 ASP H 1 1 4 2432 1 1 14 ASP HA H -11.464 -8.684 2.644 1.00 . A A . 14 ASP HA 1 1 4 2433 1 1 14 ASP HB2 H -12.443 -11.268 1.389 1.00 . A A . 14 ASP HB2 1 1 4 2434 1 1 14 ASP HB3 H -12.147 -11.016 3.101 1.00 . A A . 14 ASP HB3 1 1 4 2435 1 1 14 ASP N N -11.808 -8.755 0.573 1.00 . A A . 14 ASP N 1 1 4 2436 1 1 14 ASP O O -9.503 -10.507 2.673 1.00 . A A . 14 ASP O 1 1 4 2437 1 1 14 ASP OD1 O -14.211 -9.562 3.401 1.00 . A A . 14 ASP OD1 1 1 4 2438 1 1 14 ASP OD2 O -14.651 -10.195 1.346 1.00 . A A . 14 ASP OD2 1 1 4 2439 1 1 15 LYS C C -7.520 -9.511 -0.571 1.00 . A A . 15 LYS C 1 1 4 2440 1 1 15 LYS CA C -8.336 -10.555 0.156 1.00 . A A . 15 LYS CA 1 1 4 2441 1 1 15 LYS CB C -8.546 -11.776 -0.748 1.00 . A A . 15 LYS CB 1 1 4 2442 1 1 15 LYS CD C -9.673 -13.967 -1.148 1.00 . A A . 15 LYS CD 1 1 4 2443 1 1 15 LYS CE C -10.573 -15.051 -0.582 1.00 . A A . 15 LYS CE 1 1 4 2444 1 1 15 LYS CG C -9.408 -12.871 -0.140 1.00 . A A . 15 LYS CG 1 1 4 2445 1 1 15 LYS H H -10.095 -9.504 -0.178 1.00 . A A . 15 LYS H 1 1 4 2446 1 1 15 LYS HA H -7.816 -10.859 1.051 1.00 . A A . 15 LYS HA 1 1 4 2447 1 1 15 LYS HB2 H -9.014 -11.461 -1.670 1.00 . A A . 15 LYS HB2 1 1 4 2448 1 1 15 LYS HB3 H -7.584 -12.200 -0.981 1.00 . A A . 15 LYS HB3 1 1 4 2449 1 1 15 LYS HD2 H -10.144 -13.538 -2.019 1.00 . A A . 15 LYS HD2 1 1 4 2450 1 1 15 LYS HD3 H -8.723 -14.399 -1.423 1.00 . A A . 15 LYS HD3 1 1 4 2451 1 1 15 LYS HE2 H -10.067 -15.529 0.241 1.00 . A A . 15 LYS HE2 1 1 4 2452 1 1 15 LYS HE3 H -11.492 -14.610 -0.226 1.00 . A A . 15 LYS HE3 1 1 4 2453 1 1 15 LYS HG2 H -8.899 -13.291 0.713 1.00 . A A . 15 LYS HG2 1 1 4 2454 1 1 15 LYS HG3 H -10.354 -12.443 0.163 1.00 . A A . 15 LYS HG3 1 1 4 2455 1 1 15 LYS HZ1 H -11.441 -16.844 -1.136 1.00 . A A . 15 LYS HZ1 1 1 4 2456 1 1 15 LYS HZ2 H -10.026 -16.512 -1.959 1.00 . A A . 15 LYS HZ2 1 1 4 2457 1 1 15 LYS HZ3 H -11.464 -15.714 -2.365 1.00 . A A . 15 LYS HZ3 1 1 4 2458 1 1 15 LYS N N -9.596 -9.986 0.510 1.00 . A A . 15 LYS N 1 1 4 2459 1 1 15 LYS NZ N -10.892 -16.078 -1.577 1.00 . A A . 15 LYS NZ 1 1 4 2460 1 1 15 LYS O O -7.646 -9.359 -1.789 1.00 . A A . 15 LYS O 1 1 4 2461 1 1 16 VAL C C -5.153 -6.990 0.812 1.00 . A A . 16 VAL C 1 1 4 2462 1 1 16 VAL CA C -5.904 -7.675 -0.332 1.00 . A A . 16 VAL CA 1 1 4 2463 1 1 16 VAL CB C -6.663 -6.604 -1.205 1.00 . A A . 16 VAL CB 1 1 4 2464 1 1 16 VAL CG1 C -7.801 -5.981 -0.428 1.00 . A A . 16 VAL CG1 1 1 4 2465 1 1 16 VAL CG2 C -5.699 -5.525 -1.712 1.00 . A A . 16 VAL CG2 1 1 4 2466 1 1 16 VAL H H -6.792 -8.837 1.173 1.00 . A A . 16 VAL H 1 1 4 2467 1 1 16 VAL HA H -5.176 -8.182 -0.953 1.00 . A A . 16 VAL HA 1 1 4 2468 1 1 16 VAL HB H -7.101 -7.100 -2.056 1.00 . A A . 16 VAL HB 1 1 4 2469 1 1 16 VAL HG11 H -8.480 -6.773 -0.152 1.00 . A A . 16 VAL HG11 1 1 4 2470 1 1 16 VAL HG12 H -8.305 -5.235 -1.022 1.00 . A A . 16 VAL HG12 1 1 4 2471 1 1 16 VAL HG13 H -7.358 -5.569 0.470 1.00 . A A . 16 VAL HG13 1 1 4 2472 1 1 16 VAL HG21 H -6.250 -4.830 -2.330 1.00 . A A . 16 VAL HG21 1 1 4 2473 1 1 16 VAL HG22 H -4.911 -5.987 -2.291 1.00 . A A . 16 VAL HG22 1 1 4 2474 1 1 16 VAL HG23 H -5.283 -4.997 -0.865 1.00 . A A . 16 VAL HG23 1 1 4 2475 1 1 16 VAL N N -6.774 -8.725 0.195 1.00 . A A . 16 VAL N 1 1 4 2476 1 1 16 VAL O O -5.687 -6.153 1.515 1.00 . A A . 16 VAL O 1 1 4 2477 1 1 17 ASP C C -2.686 -5.408 1.760 1.00 . A A . 17 ASP C 1 1 4 2478 1 1 17 ASP CA C -3.082 -6.861 2.046 1.00 . A A . 17 ASP CA 1 1 4 2479 1 1 17 ASP CB C -1.856 -7.741 2.230 1.00 . A A . 17 ASP CB 1 1 4 2480 1 1 17 ASP CG C -2.278 -9.123 2.610 1.00 . A A . 17 ASP CG 1 1 4 2481 1 1 17 ASP H H -3.733 -8.253 0.568 1.00 . A A . 17 ASP H 1 1 4 2482 1 1 17 ASP HA H -3.639 -6.879 2.972 1.00 . A A . 17 ASP HA 1 1 4 2483 1 1 17 ASP HB2 H -1.225 -7.776 1.351 1.00 . A A . 17 ASP HB2 1 1 4 2484 1 1 17 ASP HB3 H -1.278 -7.332 3.046 1.00 . A A . 17 ASP HB3 1 1 4 2485 1 1 17 ASP N N -3.974 -7.429 1.036 1.00 . A A . 17 ASP N 1 1 4 2486 1 1 17 ASP O O -2.493 -4.995 0.595 1.00 . A A . 17 ASP O 1 1 4 2487 1 1 17 ASP OD1 O -2.616 -9.905 1.695 1.00 . A A . 17 ASP OD1 1 1 4 2488 1 1 17 ASP OD2 O -2.343 -9.414 3.832 1.00 . A A . 17 ASP OD2 1 1 4 2489 1 1 18 TRP C C -0.848 -3.018 3.325 1.00 . A A . 18 TRP C 1 1 4 2490 1 1 18 TRP CA C -2.254 -3.228 2.808 1.00 . A A . 18 TRP CA 1 1 4 2491 1 1 18 TRP CB C -3.236 -2.464 3.711 1.00 . A A . 18 TRP CB 1 1 4 2492 1 1 18 TRP CD1 C -5.406 -3.605 3.030 1.00 . A A . 18 TRP CD1 1 1 4 2493 1 1 18 TRP CD2 C -5.534 -1.382 3.093 1.00 . A A . 18 TRP CD2 1 1 4 2494 1 1 18 TRP CE2 C -6.790 -1.893 2.713 1.00 . A A . 18 TRP CE2 1 1 4 2495 1 1 18 TRP CE3 C -5.371 -0.002 3.203 1.00 . A A . 18 TRP CE3 1 1 4 2496 1 1 18 TRP CG C -4.665 -2.504 3.277 1.00 . A A . 18 TRP CG 1 1 4 2497 1 1 18 TRP CH2 C -7.698 0.272 2.565 1.00 . A A . 18 TRP CH2 1 1 4 2498 1 1 18 TRP CZ2 C -7.880 -1.075 2.453 1.00 . A A . 18 TRP CZ2 1 1 4 2499 1 1 18 TRP CZ3 C -6.455 0.810 2.948 1.00 . A A . 18 TRP CZ3 1 1 4 2500 1 1 18 TRP H H -2.688 -5.082 3.703 1.00 . A A . 18 TRP H 1 1 4 2501 1 1 18 TRP HA H -2.334 -2.852 1.800 1.00 . A A . 18 TRP HA 1 1 4 2502 1 1 18 TRP HB2 H -3.207 -2.897 4.699 1.00 . A A . 18 TRP HB2 1 1 4 2503 1 1 18 TRP HB3 H -2.930 -1.428 3.758 1.00 . A A . 18 TRP HB3 1 1 4 2504 1 1 18 TRP HD1 H -5.019 -4.612 3.083 1.00 . A A . 18 TRP HD1 1 1 4 2505 1 1 18 TRP HE1 H -7.361 -3.923 2.438 1.00 . A A . 18 TRP HE1 1 1 4 2506 1 1 18 TRP HE3 H -4.425 0.425 3.489 1.00 . A A . 18 TRP HE3 1 1 4 2507 1 1 18 TRP HH2 H -8.516 0.950 2.371 1.00 . A A . 18 TRP HH2 1 1 4 2508 1 1 18 TRP HZ2 H -8.835 -1.481 2.163 1.00 . A A . 18 TRP HZ2 1 1 4 2509 1 1 18 TRP HZ3 H -6.330 1.880 3.024 1.00 . A A . 18 TRP HZ3 1 1 4 2510 1 1 18 TRP N N -2.567 -4.655 2.830 1.00 . A A . 18 TRP N 1 1 4 2511 1 1 18 TRP NE1 N -6.676 -3.256 2.670 1.00 . A A . 18 TRP NE1 1 1 4 2512 1 1 18 TRP O O -0.309 -3.880 4.037 1.00 . A A . 18 TRP O 1 1 4 2513 1 1 19 VAL C C 1.207 -0.245 4.076 1.00 . A A . 19 VAL C 1 1 4 2514 1 1 19 VAL CA C 1.104 -1.617 3.417 1.00 . A A . 19 VAL CA 1 1 4 2515 1 1 19 VAL CB C 2.140 -1.730 2.236 1.00 . A A . 19 VAL CB 1 1 4 2516 1 1 19 VAL CG1 C 2.219 -3.155 1.714 1.00 . A A . 19 VAL CG1 1 1 4 2517 1 1 19 VAL CG2 C 1.774 -0.776 1.096 1.00 . A A . 19 VAL CG2 1 1 4 2518 1 1 19 VAL H H -0.676 -1.145 2.511 1.00 . A A . 19 VAL H 1 1 4 2519 1 1 19 VAL HA H 1.352 -2.359 4.161 1.00 . A A . 19 VAL HA 1 1 4 2520 1 1 19 VAL HB H 3.125 -1.468 2.596 1.00 . A A . 19 VAL HB 1 1 4 2521 1 1 19 VAL HG11 H 1.252 -3.463 1.344 1.00 . A A . 19 VAL HG11 1 1 4 2522 1 1 19 VAL HG12 H 2.506 -3.806 2.525 1.00 . A A . 19 VAL HG12 1 1 4 2523 1 1 19 VAL HG13 H 2.953 -3.234 0.927 1.00 . A A . 19 VAL HG13 1 1 4 2524 1 1 19 VAL HG21 H 0.799 -1.042 0.716 1.00 . A A . 19 VAL HG21 1 1 4 2525 1 1 19 VAL HG22 H 2.503 -0.828 0.302 1.00 . A A . 19 VAL HG22 1 1 4 2526 1 1 19 VAL HG23 H 1.743 0.235 1.471 1.00 . A A . 19 VAL HG23 1 1 4 2527 1 1 19 VAL N N -0.253 -1.891 3.000 1.00 . A A . 19 VAL N 1 1 4 2528 1 1 19 VAL O O 0.618 0.730 3.608 1.00 . A A . 19 VAL O 1 1 4 2529 1 1 20 GLN C C 3.585 1.479 5.531 1.00 . A A . 20 GLN C 1 1 4 2530 1 1 20 GLN CA C 2.173 1.037 5.898 1.00 . A A . 20 GLN CA 1 1 4 2531 1 1 20 GLN CB C 2.071 0.796 7.423 1.00 . A A . 20 GLN CB 1 1 4 2532 1 1 20 GLN CD C 2.162 1.786 9.769 1.00 . A A . 20 GLN CD 1 1 4 2533 1 1 20 GLN CG C 2.301 2.046 8.276 1.00 . A A . 20 GLN CG 1 1 4 2534 1 1 20 GLN H H 2.292 -1.011 5.544 1.00 . A A . 20 GLN H 1 1 4 2535 1 1 20 GLN HA H 1.468 1.794 5.585 1.00 . A A . 20 GLN HA 1 1 4 2536 1 1 20 GLN HB2 H 1.111 0.363 7.660 1.00 . A A . 20 GLN HB2 1 1 4 2537 1 1 20 GLN HB3 H 2.817 0.066 7.692 1.00 . A A . 20 GLN HB3 1 1 4 2538 1 1 20 GLN HE21 H 3.475 3.206 10.193 1.00 . A A . 20 GLN HE21 1 1 4 2539 1 1 20 GLN HE22 H 2.826 2.429 11.550 1.00 . A A . 20 GLN HE22 1 1 4 2540 1 1 20 GLN HG2 H 3.287 2.441 8.084 1.00 . A A . 20 GLN HG2 1 1 4 2541 1 1 20 GLN HG3 H 1.573 2.786 7.985 1.00 . A A . 20 GLN HG3 1 1 4 2542 1 1 20 GLN N N 1.907 -0.194 5.176 1.00 . A A . 20 GLN N 1 1 4 2543 1 1 20 GLN NE2 N 2.877 2.531 10.575 1.00 . A A . 20 GLN NE2 1 1 4 2544 1 1 20 GLN O O 4.457 0.639 5.372 1.00 . A A . 20 GLN O 1 1 4 2545 1 1 20 GLN OE1 O 1.401 0.922 10.190 1.00 . A A . 20 GLN OE1 1 1 4 2546 1 1 21 CYS C C 5.921 3.519 6.270 1.00 . A A . 21 CYS C 1 1 4 2547 1 1 21 CYS CA C 5.152 3.190 5.007 1.00 . A A . 21 CYS CA 1 1 4 2548 1 1 21 CYS CB C 5.206 4.316 3.959 1.00 . A A . 21 CYS CB 1 1 4 2549 1 1 21 CYS H H 3.050 3.384 5.395 1.00 . A A . 21 CYS H 1 1 4 2550 1 1 21 CYS HA H 5.630 2.312 4.602 1.00 . A A . 21 CYS HA 1 1 4 2551 1 1 21 CYS HB2 H 6.201 4.572 3.639 1.00 . A A . 21 CYS HB2 1 1 4 2552 1 1 21 CYS HB3 H 4.675 3.989 3.085 1.00 . A A . 21 CYS HB3 1 1 4 2553 1 1 21 CYS N N 3.807 2.762 5.323 1.00 . A A . 21 CYS N 1 1 4 2554 1 1 21 CYS O O 5.763 4.610 6.877 1.00 . A A . 21 CYS O 1 1 4 2555 1 1 21 CYS SG S 4.470 5.870 4.423 1.00 . A A . 21 CYS SG 1 1 4 2556 1 1 22 ASP C C 8.770 3.600 7.716 1.00 . A A . 22 ASP C 1 1 4 2557 1 1 22 ASP CA C 7.572 2.675 7.876 1.00 . A A . 22 ASP CA 1 1 4 2558 1 1 22 ASP CB C 8.033 1.272 8.329 1.00 . A A . 22 ASP CB 1 1 4 2559 1 1 22 ASP CG C 6.926 0.407 8.917 1.00 . A A . 22 ASP CG 1 1 4 2560 1 1 22 ASP H H 6.898 1.815 6.057 1.00 . A A . 22 ASP H 1 1 4 2561 1 1 22 ASP HA H 6.931 3.085 8.643 1.00 . A A . 22 ASP HA 1 1 4 2562 1 1 22 ASP HB2 H 8.444 0.751 7.477 1.00 . A A . 22 ASP HB2 1 1 4 2563 1 1 22 ASP HB3 H 8.809 1.399 9.067 1.00 . A A . 22 ASP HB3 1 1 4 2564 1 1 22 ASP N N 6.775 2.596 6.646 1.00 . A A . 22 ASP N 1 1 4 2565 1 1 22 ASP O O 9.692 3.591 8.522 1.00 . A A . 22 ASP O 1 1 4 2566 1 1 22 ASP OD1 O 6.033 -0.031 8.168 1.00 . A A . 22 ASP OD1 1 1 4 2567 1 1 22 ASP OD2 O 6.962 0.145 10.152 1.00 . A A . 22 ASP OD2 1 1 4 2568 1 1 23 GLY C C 9.537 6.713 7.150 1.00 . A A . 23 GLY C 1 1 4 2569 1 1 23 GLY CA C 9.770 5.374 6.460 1.00 . A A . 23 GLY CA 1 1 4 2570 1 1 23 GLY H H 7.886 4.454 6.195 1.00 . A A . 23 GLY H 1 1 4 2571 1 1 23 GLY HA2 H 10.696 4.937 6.811 1.00 . A A . 23 GLY HA2 1 1 4 2572 1 1 23 GLY HA3 H 9.839 5.534 5.393 1.00 . A A . 23 GLY HA3 1 1 4 2573 1 1 23 GLY N N 8.710 4.454 6.713 1.00 . A A . 23 GLY N 1 1 4 2574 1 1 23 GLY O O 10.420 7.559 7.183 1.00 . A A . 23 GLY O 1 1 4 2575 1 1 24 GLY C C 6.680 8.752 8.307 1.00 . A A . 24 GLY C 1 1 4 2576 1 1 24 GLY CA C 8.100 8.184 8.384 1.00 . A A . 24 GLY CA 1 1 4 2577 1 1 24 GLY H H 7.644 6.233 7.661 1.00 . A A . 24 GLY H 1 1 4 2578 1 1 24 GLY HA2 H 8.352 8.061 9.425 1.00 . A A . 24 GLY HA2 1 1 4 2579 1 1 24 GLY HA3 H 8.770 8.909 7.944 1.00 . A A . 24 GLY HA3 1 1 4 2580 1 1 24 GLY N N 8.333 6.928 7.695 1.00 . A A . 24 GLY N 1 1 4 2581 1 1 24 GLY O O 6.344 9.631 9.073 1.00 . A A . 24 GLY O 1 1 4 2582 1 1 25 CYS C C 3.533 8.020 8.178 1.00 . A A . 25 CYS C 1 1 4 2583 1 1 25 CYS CA C 4.485 8.850 7.308 1.00 . A A . 25 CYS CA 1 1 4 2584 1 1 25 CYS CB C 3.936 8.847 5.871 1.00 . A A . 25 CYS CB 1 1 4 2585 1 1 25 CYS H H 6.129 7.558 6.794 1.00 . A A . 25 CYS H 1 1 4 2586 1 1 25 CYS HA H 4.550 9.867 7.671 1.00 . A A . 25 CYS HA 1 1 4 2587 1 1 25 CYS HB2 H 3.675 7.834 5.603 1.00 . A A . 25 CYS HB2 1 1 4 2588 1 1 25 CYS HB3 H 3.047 9.458 5.838 1.00 . A A . 25 CYS HB3 1 1 4 2589 1 1 25 CYS N N 5.843 8.277 7.386 1.00 . A A . 25 CYS N 1 1 4 2590 1 1 25 CYS O O 2.553 8.529 8.701 1.00 . A A . 25 CYS O 1 1 4 2591 1 1 25 CYS SG S 5.062 9.435 4.592 1.00 . A A . 25 CYS SG 1 1 4 2592 1 1 26 ASP C C 1.619 5.586 8.404 1.00 . A A . 26 ASP C 1 1 4 2593 1 1 26 ASP CA C 3.014 5.709 9.026 1.00 . A A . 26 ASP CA 1 1 4 2594 1 1 26 ASP CB C 2.921 5.964 10.547 1.00 . A A . 26 ASP CB 1 1 4 2595 1 1 26 ASP CG C 4.224 5.800 11.265 1.00 . A A . 26 ASP CG 1 1 4 2596 1 1 26 ASP H H 4.732 6.446 7.970 1.00 . A A . 26 ASP H 1 1 4 2597 1 1 26 ASP HA H 3.517 4.768 8.857 1.00 . A A . 26 ASP HA 1 1 4 2598 1 1 26 ASP HB2 H 2.598 6.977 10.721 1.00 . A A . 26 ASP HB2 1 1 4 2599 1 1 26 ASP HB3 H 2.199 5.300 10.997 1.00 . A A . 26 ASP HB3 1 1 4 2600 1 1 26 ASP N N 3.860 6.719 8.318 1.00 . A A . 26 ASP N 1 1 4 2601 1 1 26 ASP O O 0.695 5.029 9.005 1.00 . A A . 26 ASP O 1 1 4 2602 1 1 26 ASP OD1 O 4.547 4.677 11.658 1.00 . A A . 26 ASP OD1 1 1 4 2603 1 1 26 ASP OD2 O 4.928 6.811 11.452 1.00 . A A . 26 ASP OD2 1 1 4 2604 1 1 27 GLU C C 0.003 4.662 5.785 1.00 . A A . 27 GLU C 1 1 4 2605 1 1 27 GLU CA C 0.218 6.016 6.463 1.00 . A A . 27 GLU CA 1 1 4 2606 1 1 27 GLU CB C 0.088 7.182 5.472 1.00 . A A . 27 GLU CB 1 1 4 2607 1 1 27 GLU CD C -0.084 9.712 5.174 1.00 . A A . 27 GLU CD 1 1 4 2608 1 1 27 GLU CG C 0.056 8.554 6.151 1.00 . A A . 27 GLU CG 1 1 4 2609 1 1 27 GLU H H 2.281 6.425 6.735 1.00 . A A . 27 GLU H 1 1 4 2610 1 1 27 GLU HA H -0.535 6.120 7.228 1.00 . A A . 27 GLU HA 1 1 4 2611 1 1 27 GLU HB2 H 0.933 7.131 4.804 1.00 . A A . 27 GLU HB2 1 1 4 2612 1 1 27 GLU HB3 H -0.816 7.054 4.896 1.00 . A A . 27 GLU HB3 1 1 4 2613 1 1 27 GLU HG2 H -0.802 8.575 6.807 1.00 . A A . 27 GLU HG2 1 1 4 2614 1 1 27 GLU HG3 H 0.961 8.692 6.725 1.00 . A A . 27 GLU HG3 1 1 4 2615 1 1 27 GLU N N 1.489 6.056 7.173 1.00 . A A . 27 GLU N 1 1 4 2616 1 1 27 GLU O O 0.961 3.901 5.592 1.00 . A A . 27 GLU O 1 1 4 2617 1 1 27 GLU OE1 O -1.252 10.078 4.841 1.00 . A A . 27 GLU OE1 1 1 4 2618 1 1 27 GLU OE2 O 0.956 10.276 4.754 1.00 . A A . 27 GLU OE2 1 1 4 2619 1 1 28 TRP C C -1.972 3.184 3.357 1.00 . A A . 28 TRP C 1 1 4 2620 1 1 28 TRP CA C -1.633 3.073 4.845 1.00 . A A . 28 TRP CA 1 1 4 2621 1 1 28 TRP CB C -2.797 2.445 5.626 1.00 . A A . 28 TRP CB 1 1 4 2622 1 1 28 TRP CD1 C -2.338 2.928 8.117 1.00 . A A . 28 TRP CD1 1 1 4 2623 1 1 28 TRP CD2 C -2.112 0.781 7.531 1.00 . A A . 28 TRP CD2 1 1 4 2624 1 1 28 TRP CE2 C -1.834 0.905 8.908 1.00 . A A . 28 TRP CE2 1 1 4 2625 1 1 28 TRP CE3 C -2.040 -0.475 6.936 1.00 . A A . 28 TRP CE3 1 1 4 2626 1 1 28 TRP CG C -2.430 2.085 7.045 1.00 . A A . 28 TRP CG 1 1 4 2627 1 1 28 TRP CH2 C -1.419 -1.400 9.084 1.00 . A A . 28 TRP CH2 1 1 4 2628 1 1 28 TRP CZ2 C -1.474 -0.181 9.690 1.00 . A A . 28 TRP CZ2 1 1 4 2629 1 1 28 TRP CZ3 C -1.692 -1.556 7.715 1.00 . A A . 28 TRP CZ3 1 1 4 2630 1 1 28 TRP H H -1.920 5.082 5.531 1.00 . A A . 28 TRP H 1 1 4 2631 1 1 28 TRP HA H -0.772 2.421 4.923 1.00 . A A . 28 TRP HA 1 1 4 2632 1 1 28 TRP HB2 H -3.629 3.128 5.651 1.00 . A A . 28 TRP HB2 1 1 4 2633 1 1 28 TRP HB3 H -3.104 1.539 5.123 1.00 . A A . 28 TRP HB3 1 1 4 2634 1 1 28 TRP HD1 H -2.523 3.990 8.076 1.00 . A A . 28 TRP HD1 1 1 4 2635 1 1 28 TRP HE1 H -1.839 2.614 10.129 1.00 . A A . 28 TRP HE1 1 1 4 2636 1 1 28 TRP HE3 H -2.247 -0.611 5.888 1.00 . A A . 28 TRP HE3 1 1 4 2637 1 1 28 TRP HH2 H -1.146 -2.274 9.659 1.00 . A A . 28 TRP HH2 1 1 4 2638 1 1 28 TRP HZ2 H -1.256 -0.079 10.744 1.00 . A A . 28 TRP HZ2 1 1 4 2639 1 1 28 TRP HZ3 H -1.632 -2.542 7.277 1.00 . A A . 28 TRP HZ3 1 1 4 2640 1 1 28 TRP N N -1.252 4.372 5.423 1.00 . A A . 28 TRP N 1 1 4 2641 1 1 28 TRP NE1 N -1.975 2.228 9.239 1.00 . A A . 28 TRP NE1 1 1 4 2642 1 1 28 TRP O O -2.813 4.006 2.944 1.00 . A A . 28 TRP O 1 1 4 2643 1 1 29 PHE C C -1.978 0.939 0.685 1.00 . A A . 29 PHE C 1 1 4 2644 1 1 29 PHE CA C -1.452 2.326 1.122 1.00 . A A . 29 PHE CA 1 1 4 2645 1 1 29 PHE CB C -0.059 2.548 0.453 1.00 . A A . 29 PHE CB 1 1 4 2646 1 1 29 PHE CD1 C 1.192 3.853 2.220 1.00 . A A . 29 PHE CD1 1 1 4 2647 1 1 29 PHE CD2 C 1.012 4.816 0.051 1.00 . A A . 29 PHE CD2 1 1 4 2648 1 1 29 PHE CE1 C 1.909 4.931 2.645 1.00 . A A . 29 PHE CE1 1 1 4 2649 1 1 29 PHE CE2 C 1.737 5.908 0.483 1.00 . A A . 29 PHE CE2 1 1 4 2650 1 1 29 PHE CG C 0.723 3.770 0.921 1.00 . A A . 29 PHE CG 1 1 4 2651 1 1 29 PHE CZ C 2.188 5.956 1.788 1.00 . A A . 29 PHE CZ 1 1 4 2652 1 1 29 PHE H H -0.667 1.734 2.985 1.00 . A A . 29 PHE H 1 1 4 2653 1 1 29 PHE HA H -2.125 3.111 0.812 1.00 . A A . 29 PHE HA 1 1 4 2654 1 1 29 PHE HB2 H 0.574 1.686 0.597 1.00 . A A . 29 PHE HB2 1 1 4 2655 1 1 29 PHE HB3 H -0.223 2.661 -0.608 1.00 . A A . 29 PHE HB3 1 1 4 2656 1 1 29 PHE HD1 H 0.975 3.048 2.906 1.00 . A A . 29 PHE HD1 1 1 4 2657 1 1 29 PHE HD2 H 0.658 4.780 -0.972 1.00 . A A . 29 PHE HD2 1 1 4 2658 1 1 29 PHE HE1 H 2.267 4.970 3.666 1.00 . A A . 29 PHE HE1 1 1 4 2659 1 1 29 PHE HE2 H 1.951 6.713 -0.204 1.00 . A A . 29 PHE HE2 1 1 4 2660 1 1 29 PHE HZ H 2.765 6.782 2.172 1.00 . A A . 29 PHE HZ 1 1 4 2661 1 1 29 PHE N N -1.311 2.354 2.572 1.00 . A A . 29 PHE N 1 1 4 2662 1 1 29 PHE O O -1.876 -0.037 1.433 1.00 . A A . 29 PHE O 1 1 4 2663 1 1 30 HIS C C -1.844 -0.924 -1.992 1.00 . A A . 30 HIS C 1 1 4 2664 1 1 30 HIS CA C -2.952 -0.424 -1.119 1.00 . A A . 30 HIS CA 1 1 4 2665 1 1 30 HIS CB C -4.198 -0.273 -2.037 1.00 . A A . 30 HIS CB 1 1 4 2666 1 1 30 HIS CD2 C -6.433 -0.974 -0.934 1.00 . A A . 30 HIS CD2 1 1 4 2667 1 1 30 HIS CE1 C -7.354 1.011 -0.832 1.00 . A A . 30 HIS CE1 1 1 4 2668 1 1 30 HIS CG C -5.529 -0.080 -1.403 1.00 . A A . 30 HIS CG 1 1 4 2669 1 1 30 HIS H H -2.595 1.687 -1.042 1.00 . A A . 30 HIS H 1 1 4 2670 1 1 30 HIS HA H -3.162 -1.132 -0.332 1.00 . A A . 30 HIS HA 1 1 4 2671 1 1 30 HIS HB2 H -4.038 0.659 -2.563 1.00 . A A . 30 HIS HB2 1 1 4 2672 1 1 30 HIS HB3 H -4.268 -1.010 -2.820 1.00 . A A . 30 HIS HB3 1 1 4 2673 1 1 30 HIS HD2 H -6.307 -2.043 -0.856 1.00 . A A . 30 HIS HD2 1 1 4 2674 1 1 30 HIS HE1 H -8.063 1.805 -0.654 1.00 . A A . 30 HIS HE1 1 1 4 2675 1 1 30 HIS HE2 H -8.450 -0.691 -0.567 1.00 . A A . 30 HIS HE2 1 1 4 2676 1 1 30 HIS N N -2.527 0.857 -0.527 1.00 . A A . 30 HIS N 1 1 4 2677 1 1 30 HIS ND1 N -6.132 1.151 -1.326 1.00 . A A . 30 HIS ND1 1 1 4 2678 1 1 30 HIS NE2 N -7.558 -0.271 -0.589 1.00 . A A . 30 HIS NE2 1 1 4 2679 1 1 30 HIS O O -1.217 -0.130 -2.677 1.00 . A A . 30 HIS O 1 1 4 2680 1 1 31 GLN C C -0.821 -2.460 -4.340 1.00 . A A . 31 GLN C 1 1 4 2681 1 1 31 GLN CA C -0.592 -2.793 -2.871 1.00 . A A . 31 GLN CA 1 1 4 2682 1 1 31 GLN CB C -0.397 -4.297 -2.687 1.00 . A A . 31 GLN CB 1 1 4 2683 1 1 31 GLN CD C 0.424 -6.187 -1.279 1.00 . A A . 31 GLN CD 1 1 4 2684 1 1 31 GLN CG C 0.224 -4.700 -1.367 1.00 . A A . 31 GLN CG 1 1 4 2685 1 1 31 GLN H H -2.152 -2.796 -1.408 1.00 . A A . 31 GLN H 1 1 4 2686 1 1 31 GLN HA H 0.304 -2.285 -2.552 1.00 . A A . 31 GLN HA 1 1 4 2687 1 1 31 GLN HB2 H -1.342 -4.813 -2.778 1.00 . A A . 31 GLN HB2 1 1 4 2688 1 1 31 GLN HB3 H 0.259 -4.643 -3.471 1.00 . A A . 31 GLN HB3 1 1 4 2689 1 1 31 GLN HE21 H -1.355 -6.379 -0.469 1.00 . A A . 31 GLN HE21 1 1 4 2690 1 1 31 GLN HE22 H -0.485 -7.849 -0.672 1.00 . A A . 31 GLN HE22 1 1 4 2691 1 1 31 GLN HG2 H 1.184 -4.217 -1.273 1.00 . A A . 31 GLN HG2 1 1 4 2692 1 1 31 GLN HG3 H -0.408 -4.375 -0.559 1.00 . A A . 31 GLN HG3 1 1 4 2693 1 1 31 GLN N N -1.621 -2.231 -2.008 1.00 . A A . 31 GLN N 1 1 4 2694 1 1 31 GLN NE2 N -0.562 -6.876 -0.758 1.00 . A A . 31 GLN NE2 1 1 4 2695 1 1 31 GLN O O 0.055 -1.999 -4.998 1.00 . A A . 31 GLN O 1 1 4 2696 1 1 31 GLN OE1 O 1.459 -6.705 -1.662 1.00 . A A . 31 GLN OE1 1 1 4 2697 1 1 32 VAL C C -2.282 -0.887 -6.570 1.00 . A A . 32 VAL C 1 1 4 2698 1 1 32 VAL CA C -2.299 -2.399 -6.241 1.00 . A A . 32 VAL CA 1 1 4 2699 1 1 32 VAL CB C -3.659 -3.013 -6.676 1.00 . A A . 32 VAL CB 1 1 4 2700 1 1 32 VAL CG1 C -4.780 -2.402 -5.886 1.00 . A A . 32 VAL CG1 1 1 4 2701 1 1 32 VAL CG2 C -3.902 -2.784 -8.138 1.00 . A A . 32 VAL CG2 1 1 4 2702 1 1 32 VAL H H -2.752 -2.998 -4.269 1.00 . A A . 32 VAL H 1 1 4 2703 1 1 32 VAL HA H -1.522 -2.872 -6.815 1.00 . A A . 32 VAL HA 1 1 4 2704 1 1 32 VAL HB H -3.650 -4.075 -6.487 1.00 . A A . 32 VAL HB 1 1 4 2705 1 1 32 VAL HG11 H -4.699 -1.341 -6.094 1.00 . A A . 32 VAL HG11 1 1 4 2706 1 1 32 VAL HG12 H -4.601 -2.595 -4.841 1.00 . A A . 32 VAL HG12 1 1 4 2707 1 1 32 VAL HG13 H -5.738 -2.772 -6.225 1.00 . A A . 32 VAL HG13 1 1 4 2708 1 1 32 VAL HG21 H -3.122 -3.236 -8.727 1.00 . A A . 32 VAL HG21 1 1 4 2709 1 1 32 VAL HG22 H -3.875 -1.708 -8.256 1.00 . A A . 32 VAL HG22 1 1 4 2710 1 1 32 VAL HG23 H -4.869 -3.180 -8.411 1.00 . A A . 32 VAL HG23 1 1 4 2711 1 1 32 VAL N N -2.024 -2.661 -4.830 1.00 . A A . 32 VAL N 1 1 4 2712 1 1 32 VAL O O -1.775 -0.471 -7.603 1.00 . A A . 32 VAL O 1 1 4 2713 1 1 33 CYS C C -1.637 2.075 -5.879 1.00 . A A . 33 CYS C 1 1 4 2714 1 1 33 CYS CA C -2.980 1.328 -5.903 1.00 . A A . 33 CYS CA 1 1 4 2715 1 1 33 CYS CB C -4.054 1.965 -4.959 1.00 . A A . 33 CYS CB 1 1 4 2716 1 1 33 CYS H H -3.063 -0.577 -4.855 1.00 . A A . 33 CYS H 1 1 4 2717 1 1 33 CYS HA H -3.317 1.443 -6.922 1.00 . A A . 33 CYS HA 1 1 4 2718 1 1 33 CYS HB2 H -4.502 2.803 -5.445 1.00 . A A . 33 CYS HB2 1 1 4 2719 1 1 33 CYS HB3 H -4.836 1.230 -4.835 1.00 . A A . 33 CYS HB3 1 1 4 2720 1 1 33 CYS N N -2.808 -0.091 -5.656 1.00 . A A . 33 CYS N 1 1 4 2721 1 1 33 CYS O O -1.462 3.036 -6.599 1.00 . A A . 33 CYS O 1 1 4 2722 1 1 33 CYS SG S -3.505 2.456 -3.317 1.00 . A A . 33 CYS SG 1 1 4 2723 1 1 34 VAL C C 1.663 1.398 -5.790 1.00 . A A . 34 VAL C 1 1 4 2724 1 1 34 VAL CA C 0.608 2.248 -5.019 1.00 . A A . 34 VAL CA 1 1 4 2725 1 1 34 VAL CB C 1.042 2.445 -3.556 1.00 . A A . 34 VAL CB 1 1 4 2726 1 1 34 VAL CG1 C 1.696 1.231 -2.950 1.00 . A A . 34 VAL CG1 1 1 4 2727 1 1 34 VAL CG2 C 1.814 3.695 -3.402 1.00 . A A . 34 VAL CG2 1 1 4 2728 1 1 34 VAL H H -0.791 0.874 -4.431 1.00 . A A . 34 VAL H 1 1 4 2729 1 1 34 VAL HA H 0.533 3.215 -5.497 1.00 . A A . 34 VAL HA 1 1 4 2730 1 1 34 VAL HB H 0.182 2.509 -2.914 1.00 . A A . 34 VAL HB 1 1 4 2731 1 1 34 VAL HG11 H 1.925 1.400 -1.907 1.00 . A A . 34 VAL HG11 1 1 4 2732 1 1 34 VAL HG12 H 2.613 1.046 -3.490 1.00 . A A . 34 VAL HG12 1 1 4 2733 1 1 34 VAL HG13 H 1.040 0.378 -3.052 1.00 . A A . 34 VAL HG13 1 1 4 2734 1 1 34 VAL HG21 H 2.712 3.630 -3.996 1.00 . A A . 34 VAL HG21 1 1 4 2735 1 1 34 VAL HG22 H 2.042 3.816 -2.356 1.00 . A A . 34 VAL HG22 1 1 4 2736 1 1 34 VAL HG23 H 1.155 4.481 -3.743 1.00 . A A . 34 VAL HG23 1 1 4 2737 1 1 34 VAL N N -0.677 1.612 -5.067 1.00 . A A . 34 VAL N 1 1 4 2738 1 1 34 VAL O O 2.864 1.753 -5.852 1.00 . A A . 34 VAL O 1 1 4 2739 1 1 35 GLY C C 3.071 -1.330 -6.258 1.00 . A A . 35 GLY C 1 1 4 2740 1 1 35 GLY CA C 2.035 -0.604 -7.136 1.00 . A A . 35 GLY CA 1 1 4 2741 1 1 35 GLY H H 0.195 0.307 -6.473 1.00 . A A . 35 GLY H 1 1 4 2742 1 1 35 GLY HA2 H 1.413 -1.360 -7.587 1.00 . A A . 35 GLY HA2 1 1 4 2743 1 1 35 GLY HA3 H 2.549 -0.054 -7.910 1.00 . A A . 35 GLY HA3 1 1 4 2744 1 1 35 GLY N N 1.176 0.337 -6.426 1.00 . A A . 35 GLY N 1 1 4 2745 1 1 35 GLY O O 4.256 -1.080 -6.354 1.00 . A A . 35 GLY O 1 1 4 2746 1 1 36 VAL C C 3.105 -4.519 -5.010 1.00 . A A . 36 VAL C 1 1 4 2747 1 1 36 VAL CA C 3.428 -3.089 -4.606 1.00 . A A . 36 VAL CA 1 1 4 2748 1 1 36 VAL CB C 3.090 -2.917 -3.083 1.00 . A A . 36 VAL CB 1 1 4 2749 1 1 36 VAL CG1 C 3.753 -3.974 -2.214 1.00 . A A . 36 VAL CG1 1 1 4 2750 1 1 36 VAL CG2 C 3.468 -1.546 -2.597 1.00 . A A . 36 VAL CG2 1 1 4 2751 1 1 36 VAL H H 1.649 -2.414 -5.295 1.00 . A A . 36 VAL H 1 1 4 2752 1 1 36 VAL HA H 4.469 -2.852 -4.780 1.00 . A A . 36 VAL HA 1 1 4 2753 1 1 36 VAL HB H 2.024 -3.024 -2.982 1.00 . A A . 36 VAL HB 1 1 4 2754 1 1 36 VAL HG11 H 3.330 -4.932 -2.485 1.00 . A A . 36 VAL HG11 1 1 4 2755 1 1 36 VAL HG12 H 3.555 -3.772 -1.174 1.00 . A A . 36 VAL HG12 1 1 4 2756 1 1 36 VAL HG13 H 4.821 -4.006 -2.384 1.00 . A A . 36 VAL HG13 1 1 4 2757 1 1 36 VAL HG21 H 2.882 -0.799 -3.111 1.00 . A A . 36 VAL HG21 1 1 4 2758 1 1 36 VAL HG22 H 4.517 -1.372 -2.786 1.00 . A A . 36 VAL HG22 1 1 4 2759 1 1 36 VAL HG23 H 3.286 -1.477 -1.534 1.00 . A A . 36 VAL HG23 1 1 4 2760 1 1 36 VAL N N 2.608 -2.225 -5.428 1.00 . A A . 36 VAL N 1 1 4 2761 1 1 36 VAL O O 1.960 -4.801 -5.410 1.00 . A A . 36 VAL O 1 1 4 2762 1 1 37 SER C C 3.615 -7.517 -3.931 1.00 . A A . 37 SER C 1 1 4 2763 1 1 37 SER CA C 3.827 -6.779 -5.246 1.00 . A A . 37 SER CA 1 1 4 2764 1 1 37 SER CB C 5.033 -7.323 -6.009 1.00 . A A . 37 SER CB 1 1 4 2765 1 1 37 SER H H 5.003 -5.303 -4.651 1.00 . A A . 37 SER H 1 1 4 2766 1 1 37 SER HA H 2.939 -6.853 -5.856 1.00 . A A . 37 SER HA 1 1 4 2767 1 1 37 SER HB2 H 4.923 -8.391 -6.132 1.00 . A A . 37 SER HB2 1 1 4 2768 1 1 37 SER HB3 H 5.081 -6.849 -6.979 1.00 . A A . 37 SER HB3 1 1 4 2769 1 1 37 SER HG H 6.986 -7.316 -5.837 1.00 . A A . 37 SER HG 1 1 4 2770 1 1 37 SER N N 4.067 -5.407 -4.940 1.00 . A A . 37 SER N 1 1 4 2771 1 1 37 SER O O 4.167 -7.085 -2.910 1.00 . A A . 37 SER O 1 1 4 2772 1 1 37 SER OG O 6.236 -7.053 -5.295 1.00 . A A . 37 SER OG 1 1 4 2773 1 1 38 PRO C C 3.742 -9.712 -1.836 1.00 . A A . 38 PRO C 1 1 4 2774 1 1 38 PRO CA C 2.503 -9.367 -2.679 1.00 . A A . 38 PRO CA 1 1 4 2775 1 1 38 PRO CB C 1.814 -10.649 -3.196 1.00 . A A . 38 PRO CB 1 1 4 2776 1 1 38 PRO CD C 2.231 -9.271 -5.090 1.00 . A A . 38 PRO CD 1 1 4 2777 1 1 38 PRO CG C 2.173 -10.704 -4.647 1.00 . A A . 38 PRO CG 1 1 4 2778 1 1 38 PRO HA H 1.827 -8.808 -2.046 1.00 . A A . 38 PRO HA 1 1 4 2779 1 1 38 PRO HB2 H 2.185 -11.509 -2.653 1.00 . A A . 38 PRO HB2 1 1 4 2780 1 1 38 PRO HB3 H 0.747 -10.545 -3.061 1.00 . A A . 38 PRO HB3 1 1 4 2781 1 1 38 PRO HD2 H 2.842 -9.150 -5.971 1.00 . A A . 38 PRO HD2 1 1 4 2782 1 1 38 PRO HD3 H 1.231 -8.895 -5.246 1.00 . A A . 38 PRO HD3 1 1 4 2783 1 1 38 PRO HG2 H 3.149 -11.154 -4.750 1.00 . A A . 38 PRO HG2 1 1 4 2784 1 1 38 PRO HG3 H 1.431 -11.250 -5.207 1.00 . A A . 38 PRO HG3 1 1 4 2785 1 1 38 PRO N N 2.839 -8.627 -3.920 1.00 . A A . 38 PRO N 1 1 4 2786 1 1 38 PRO O O 3.712 -9.648 -0.614 1.00 . A A . 38 PRO O 1 1 4 2787 1 1 39 GLU C C 6.770 -9.171 -1.238 1.00 . A A . 39 GLU C 1 1 4 2788 1 1 39 GLU CA C 6.061 -10.370 -1.853 1.00 . A A . 39 GLU CA 1 1 4 2789 1 1 39 GLU CB C 6.981 -11.056 -2.819 1.00 . A A . 39 GLU CB 1 1 4 2790 1 1 39 GLU CD C 7.555 -13.092 -4.117 1.00 . A A . 39 GLU CD 1 1 4 2791 1 1 39 GLU CG C 6.585 -12.461 -3.160 1.00 . A A . 39 GLU CG 1 1 4 2792 1 1 39 GLU H H 4.873 -10.065 -3.485 1.00 . A A . 39 GLU H 1 1 4 2793 1 1 39 GLU HA H 5.835 -11.069 -1.064 1.00 . A A . 39 GLU HA 1 1 4 2794 1 1 39 GLU HB2 H 6.998 -10.475 -3.730 1.00 . A A . 39 GLU HB2 1 1 4 2795 1 1 39 GLU HB3 H 7.967 -11.059 -2.397 1.00 . A A . 39 GLU HB3 1 1 4 2796 1 1 39 GLU HG2 H 6.549 -13.049 -2.253 1.00 . A A . 39 GLU HG2 1 1 4 2797 1 1 39 GLU HG3 H 5.603 -12.450 -3.607 1.00 . A A . 39 GLU HG3 1 1 4 2798 1 1 39 GLU N N 4.831 -10.033 -2.509 1.00 . A A . 39 GLU N 1 1 4 2799 1 1 39 GLU O O 7.506 -9.320 -0.262 1.00 . A A . 39 GLU O 1 1 4 2800 1 1 39 GLU OE1 O 8.746 -13.214 -3.767 1.00 . A A . 39 GLU OE1 1 1 4 2801 1 1 39 GLU OE2 O 7.138 -13.464 -5.223 1.00 . A A . 39 GLU OE2 1 1 4 2802 1 1 40 MET C C 6.665 -6.484 0.091 1.00 . A A . 40 MET C 1 1 4 2803 1 1 40 MET CA C 7.271 -6.843 -1.245 1.00 . A A . 40 MET CA 1 1 4 2804 1 1 40 MET CB C 7.243 -5.612 -2.176 1.00 . A A . 40 MET CB 1 1 4 2805 1 1 40 MET CE C 6.932 -2.275 -2.599 1.00 . A A . 40 MET CE 1 1 4 2806 1 1 40 MET CG C 8.301 -4.572 -1.766 1.00 . A A . 40 MET CG 1 1 4 2807 1 1 40 MET H H 5.895 -7.859 -2.490 1.00 . A A . 40 MET H 1 1 4 2808 1 1 40 MET HA H 8.292 -7.161 -1.089 1.00 . A A . 40 MET HA 1 1 4 2809 1 1 40 MET HB2 H 7.263 -5.862 -3.223 1.00 . A A . 40 MET HB2 1 1 4 2810 1 1 40 MET HB3 H 6.282 -5.151 -2.003 1.00 . A A . 40 MET HB3 1 1 4 2811 1 1 40 MET HE1 H 6.145 -2.871 -3.035 1.00 . A A . 40 MET HE1 1 1 4 2812 1 1 40 MET HE2 H 6.955 -1.312 -3.089 1.00 . A A . 40 MET HE2 1 1 4 2813 1 1 40 MET HE3 H 6.761 -2.161 -1.538 1.00 . A A . 40 MET HE3 1 1 4 2814 1 1 40 MET HG2 H 7.977 -4.203 -0.805 1.00 . A A . 40 MET HG2 1 1 4 2815 1 1 40 MET HG3 H 9.261 -5.063 -1.664 1.00 . A A . 40 MET HG3 1 1 4 2816 1 1 40 MET N N 6.557 -7.979 -1.777 1.00 . A A . 40 MET N 1 1 4 2817 1 1 40 MET O O 7.357 -6.065 0.989 1.00 . A A . 40 MET O 1 1 4 2818 1 1 40 MET SD S 8.474 -3.127 -2.854 1.00 . A A . 40 MET SD 1 1 4 2819 1 1 41 ALA C C 5.162 -7.159 2.652 1.00 . A A . 41 ALA C 1 1 4 2820 1 1 41 ALA CA C 4.615 -6.395 1.427 1.00 . A A . 41 ALA CA 1 1 4 2821 1 1 41 ALA CB C 3.120 -6.696 1.217 1.00 . A A . 41 ALA CB 1 1 4 2822 1 1 41 ALA H H 4.837 -6.958 -0.584 1.00 . A A . 41 ALA H 1 1 4 2823 1 1 41 ALA HA H 4.708 -5.332 1.617 1.00 . A A . 41 ALA HA 1 1 4 2824 1 1 41 ALA HB1 H 2.554 -6.438 2.100 1.00 . A A . 41 ALA HB1 1 1 4 2825 1 1 41 ALA HB2 H 2.959 -7.738 0.990 1.00 . A A . 41 ALA HB2 1 1 4 2826 1 1 41 ALA HB3 H 2.737 -6.118 0.387 1.00 . A A . 41 ALA HB3 1 1 4 2827 1 1 41 ALA N N 5.356 -6.675 0.199 1.00 . A A . 41 ALA N 1 1 4 2828 1 1 41 ALA O O 5.313 -6.590 3.732 1.00 . A A . 41 ALA O 1 1 4 2829 1 1 42 GLU C C 7.457 -9.378 3.668 1.00 . A A . 42 GLU C 1 1 4 2830 1 1 42 GLU CA C 5.939 -9.261 3.589 1.00 . A A . 42 GLU CA 1 1 4 2831 1 1 42 GLU CB C 5.350 -10.662 3.566 1.00 . A A . 42 GLU CB 1 1 4 2832 1 1 42 GLU CD C 3.363 -12.148 3.802 1.00 . A A . 42 GLU CD 1 1 4 2833 1 1 42 GLU CG C 3.842 -10.726 3.701 1.00 . A A . 42 GLU CG 1 1 4 2834 1 1 42 GLU H H 5.254 -8.749 1.564 1.00 . A A . 42 GLU H 1 1 4 2835 1 1 42 GLU HA H 5.602 -8.791 4.503 1.00 . A A . 42 GLU HA 1 1 4 2836 1 1 42 GLU HB2 H 5.618 -11.135 2.630 1.00 . A A . 42 GLU HB2 1 1 4 2837 1 1 42 GLU HB3 H 5.792 -11.230 4.372 1.00 . A A . 42 GLU HB3 1 1 4 2838 1 1 42 GLU HG2 H 3.543 -10.189 4.588 1.00 . A A . 42 GLU HG2 1 1 4 2839 1 1 42 GLU HG3 H 3.386 -10.253 2.848 1.00 . A A . 42 GLU HG3 1 1 4 2840 1 1 42 GLU N N 5.442 -8.438 2.473 1.00 . A A . 42 GLU N 1 1 4 2841 1 1 42 GLU O O 8.016 -9.452 4.767 1.00 . A A . 42 GLU O 1 1 4 2842 1 1 42 GLU OE1 O 3.368 -12.869 2.774 1.00 . A A . 42 GLU OE1 1 1 4 2843 1 1 42 GLU OE2 O 2.989 -12.575 4.920 1.00 . A A . 42 GLU OE2 1 1 4 2844 1 1 43 ASN C C 10.438 -8.466 2.549 1.00 . A A . 43 ASN C 1 1 4 2845 1 1 43 ASN CA C 9.553 -9.682 2.538 1.00 . A A . 43 ASN CA 1 1 4 2846 1 1 43 ASN CB C 9.931 -10.580 1.351 1.00 . A A . 43 ASN CB 1 1 4 2847 1 1 43 ASN CG C 9.391 -12.003 1.433 1.00 . A A . 43 ASN CG 1 1 4 2848 1 1 43 ASN H H 7.759 -9.060 1.685 1.00 . A A . 43 ASN H 1 1 4 2849 1 1 43 ASN HA H 9.720 -10.252 3.442 1.00 . A A . 43 ASN HA 1 1 4 2850 1 1 43 ASN HB2 H 9.539 -10.137 0.448 1.00 . A A . 43 ASN HB2 1 1 4 2851 1 1 43 ASN HB3 H 11.006 -10.613 1.279 1.00 . A A . 43 ASN HB3 1 1 4 2852 1 1 43 ASN HD21 H 9.237 -12.088 -0.542 1.00 . A A . 43 ASN HD21 1 1 4 2853 1 1 43 ASN HD22 H 8.751 -13.500 0.320 1.00 . A A . 43 ASN HD22 1 1 4 2854 1 1 43 ASN N N 8.136 -9.359 2.541 1.00 . A A . 43 ASN N 1 1 4 2855 1 1 43 ASN ND2 N 9.096 -12.585 0.290 1.00 . A A . 43 ASN ND2 1 1 4 2856 1 1 43 ASN O O 11.594 -8.542 2.959 1.00 . A A . 43 ASN O 1 1 4 2857 1 1 43 ASN OD1 O 9.241 -12.574 2.510 1.00 . A A . 43 ASN OD1 1 1 4 2858 1 1 44 GLU C C 10.110 -4.970 2.701 1.00 . A A . 44 GLU C 1 1 4 2859 1 1 44 GLU CA C 10.747 -6.165 2.016 1.00 . A A . 44 GLU CA 1 1 4 2860 1 1 44 GLU CB C 11.172 -5.871 0.564 1.00 . A A . 44 GLU CB 1 1 4 2861 1 1 44 GLU CD C 12.527 -6.722 -1.438 1.00 . A A . 44 GLU CD 1 1 4 2862 1 1 44 GLU CG C 11.993 -7.018 -0.057 1.00 . A A . 44 GLU CG 1 1 4 2863 1 1 44 GLU H H 8.975 -7.274 1.868 1.00 . A A . 44 GLU H 1 1 4 2864 1 1 44 GLU HA H 11.638 -6.383 2.588 1.00 . A A . 44 GLU HA 1 1 4 2865 1 1 44 GLU HB2 H 10.280 -5.726 -0.023 1.00 . A A . 44 GLU HB2 1 1 4 2866 1 1 44 GLU HB3 H 11.768 -4.969 0.540 1.00 . A A . 44 GLU HB3 1 1 4 2867 1 1 44 GLU HG2 H 12.839 -7.212 0.586 1.00 . A A . 44 GLU HG2 1 1 4 2868 1 1 44 GLU HG3 H 11.382 -7.908 -0.089 1.00 . A A . 44 GLU HG3 1 1 4 2869 1 1 44 GLU N N 9.925 -7.344 2.107 1.00 . A A . 44 GLU N 1 1 4 2870 1 1 44 GLU O O 8.948 -5.001 3.086 1.00 . A A . 44 GLU O 1 1 4 2871 1 1 44 GLU OE1 O 11.814 -6.935 -2.430 1.00 . A A . 44 GLU OE1 1 1 4 2872 1 1 44 GLU OE2 O 13.709 -6.295 -1.533 1.00 . A A . 44 GLU OE2 1 1 4 2873 1 1 45 ASP C C 9.838 -1.736 2.657 1.00 . A A . 45 ASP C 1 1 4 2874 1 1 45 ASP CA C 10.490 -2.756 3.597 1.00 . A A . 45 ASP CA 1 1 4 2875 1 1 45 ASP CB C 11.740 -2.170 4.256 1.00 . A A . 45 ASP CB 1 1 4 2876 1 1 45 ASP CG C 11.454 -1.083 5.251 1.00 . A A . 45 ASP CG 1 1 4 2877 1 1 45 ASP H H 11.806 -3.975 2.516 1.00 . A A . 45 ASP H 1 1 4 2878 1 1 45 ASP HA H 9.787 -3.033 4.370 1.00 . A A . 45 ASP HA 1 1 4 2879 1 1 45 ASP HB2 H 12.289 -2.960 4.749 1.00 . A A . 45 ASP HB2 1 1 4 2880 1 1 45 ASP HB3 H 12.356 -1.762 3.467 1.00 . A A . 45 ASP HB3 1 1 4 2881 1 1 45 ASP N N 10.895 -3.945 2.868 1.00 . A A . 45 ASP N 1 1 4 2882 1 1 45 ASP O O 10.448 -1.298 1.677 1.00 . A A . 45 ASP O 1 1 4 2883 1 1 45 ASP OD1 O 11.157 -1.421 6.414 1.00 . A A . 45 ASP OD1 1 1 4 2884 1 1 45 ASP OD2 O 11.593 0.102 4.905 1.00 . A A . 45 ASP OD2 1 1 4 2885 1 1 46 TYR C C 8.146 1.042 2.436 1.00 . A A . 46 TYR C 1 1 4 2886 1 1 46 TYR CA C 7.847 -0.439 2.116 1.00 . A A . 46 TYR CA 1 1 4 2887 1 1 46 TYR CB C 6.310 -0.714 2.099 1.00 . A A . 46 TYR CB 1 1 4 2888 1 1 46 TYR CD1 C 5.395 0.243 -0.090 1.00 . A A . 46 TYR CD1 1 1 4 2889 1 1 46 TYR CD2 C 4.909 1.395 1.930 1.00 . A A . 46 TYR CD2 1 1 4 2890 1 1 46 TYR CE1 C 4.694 1.208 -0.801 1.00 . A A . 46 TYR CE1 1 1 4 2891 1 1 46 TYR CE2 C 4.225 2.348 1.221 1.00 . A A . 46 TYR CE2 1 1 4 2892 1 1 46 TYR CG C 5.515 0.324 1.301 1.00 . A A . 46 TYR CG 1 1 4 2893 1 1 46 TYR CZ C 4.121 2.249 -0.128 1.00 . A A . 46 TYR CZ 1 1 4 2894 1 1 46 TYR H H 8.182 -1.837 3.705 1.00 . A A . 46 TYR H 1 1 4 2895 1 1 46 TYR HA H 8.223 -0.612 1.117 1.00 . A A . 46 TYR HA 1 1 4 2896 1 1 46 TYR HB2 H 6.113 -1.670 1.631 1.00 . A A . 46 TYR HB2 1 1 4 2897 1 1 46 TYR HB3 H 5.930 -0.721 3.108 1.00 . A A . 46 TYR HB3 1 1 4 2898 1 1 46 TYR HD1 H 5.847 -0.582 -0.618 1.00 . A A . 46 TYR HD1 1 1 4 2899 1 1 46 TYR HD2 H 4.981 1.485 2.998 1.00 . A A . 46 TYR HD2 1 1 4 2900 1 1 46 TYR HE1 H 4.558 1.186 -1.875 1.00 . A A . 46 TYR HE1 1 1 4 2901 1 1 46 TYR HE2 H 3.743 3.187 1.703 1.00 . A A . 46 TYR HE2 1 1 4 2902 1 1 46 TYR HH H 2.873 2.744 -1.409 1.00 . A A . 46 TYR HH 1 1 4 2903 1 1 46 TYR N N 8.589 -1.392 2.936 1.00 . A A . 46 TYR N 1 1 4 2904 1 1 46 TYR O O 7.738 1.593 3.467 1.00 . A A . 46 TYR O 1 1 4 2905 1 1 46 TYR OH O 3.465 3.204 -0.811 1.00 . A A . 46 TYR OH 1 1 4 2906 1 1 47 ILE C C 8.110 3.685 0.520 1.00 . A A . 47 ILE C 1 1 4 2907 1 1 47 ILE CA C 9.097 3.058 1.534 1.00 . A A . 47 ILE CA 1 1 4 2908 1 1 47 ILE CB C 10.574 3.352 1.105 1.00 . A A . 47 ILE CB 1 1 4 2909 1 1 47 ILE CD1 C 11.502 3.020 3.499 1.00 . A A . 47 ILE CD1 1 1 4 2910 1 1 47 ILE CG1 C 11.578 2.611 2.028 1.00 . A A . 47 ILE CG1 1 1 4 2911 1 1 47 ILE CG2 C 10.848 4.844 1.142 1.00 . A A . 47 ILE CG2 1 1 4 2912 1 1 47 ILE H H 9.152 0.996 0.867 1.00 . A A . 47 ILE H 1 1 4 2913 1 1 47 ILE HA H 8.904 3.456 2.521 1.00 . A A . 47 ILE HA 1 1 4 2914 1 1 47 ILE HB H 10.712 2.999 0.093 1.00 . A A . 47 ILE HB 1 1 4 2915 1 1 47 ILE HD11 H 10.520 2.807 3.892 1.00 . A A . 47 ILE HD11 1 1 4 2916 1 1 47 ILE HD12 H 11.701 4.083 3.568 1.00 . A A . 47 ILE HD12 1 1 4 2917 1 1 47 ILE HD13 H 12.239 2.462 4.055 1.00 . A A . 47 ILE HD13 1 1 4 2918 1 1 47 ILE HG12 H 11.397 1.549 1.965 1.00 . A A . 47 ILE HG12 1 1 4 2919 1 1 47 ILE HG13 H 12.585 2.804 1.682 1.00 . A A . 47 ILE HG13 1 1 4 2920 1 1 47 ILE HG21 H 10.174 5.360 0.475 1.00 . A A . 47 ILE HG21 1 1 4 2921 1 1 47 ILE HG22 H 11.872 5.047 0.867 1.00 . A A . 47 ILE HG22 1 1 4 2922 1 1 47 ILE HG23 H 10.663 5.160 2.160 1.00 . A A . 47 ILE HG23 1 1 4 2923 1 1 47 ILE N N 8.838 1.645 1.528 1.00 . A A . 47 ILE N 1 1 4 2924 1 1 47 ILE O O 7.762 3.045 -0.465 1.00 . A A . 47 ILE O 1 1 4 2925 1 1 48 CYS C C 7.315 6.626 -0.907 1.00 . A A . 48 CYS C 1 1 4 2926 1 1 48 CYS CA C 6.667 5.468 -0.164 1.00 . A A . 48 CYS CA 1 1 4 2927 1 1 48 CYS CB C 5.447 6.027 0.595 1.00 . A A . 48 CYS CB 1 1 4 2928 1 1 48 CYS H H 7.906 5.503 1.461 1.00 . A A . 48 CYS H 1 1 4 2929 1 1 48 CYS HA H 6.339 4.702 -0.852 1.00 . A A . 48 CYS HA 1 1 4 2930 1 1 48 CYS HB2 H 4.646 6.152 -0.115 1.00 . A A . 48 CYS HB2 1 1 4 2931 1 1 48 CYS HB3 H 5.152 5.342 1.372 1.00 . A A . 48 CYS HB3 1 1 4 2932 1 1 48 CYS N N 7.634 4.898 0.750 1.00 . A A . 48 CYS N 1 1 4 2933 1 1 48 CYS O O 8.459 6.980 -0.626 1.00 . A A . 48 CYS O 1 1 4 2934 1 1 48 CYS SG S 5.721 7.654 1.358 1.00 . A A . 48 CYS SG 1 1 4 2935 1 1 49 ILE C C 7.492 9.557 -1.669 1.00 . A A . 49 ILE C 1 1 4 2936 1 1 49 ILE CA C 6.985 8.393 -2.576 1.00 . A A . 49 ILE CA 1 1 4 2937 1 1 49 ILE CB C 5.837 8.878 -3.509 1.00 . A A . 49 ILE CB 1 1 4 2938 1 1 49 ILE CD1 C 5.294 10.572 -5.284 1.00 . A A . 49 ILE CD1 1 1 4 2939 1 1 49 ILE CG1 C 6.284 10.100 -4.279 1.00 . A A . 49 ILE CG1 1 1 4 2940 1 1 49 ILE CG2 C 4.525 9.135 -2.746 1.00 . A A . 49 ILE CG2 1 1 4 2941 1 1 49 ILE H H 5.673 6.851 -1.948 1.00 . A A . 49 ILE H 1 1 4 2942 1 1 49 ILE HA H 7.811 8.104 -3.213 1.00 . A A . 49 ILE HA 1 1 4 2943 1 1 49 ILE HB H 5.645 8.084 -4.215 1.00 . A A . 49 ILE HB 1 1 4 2944 1 1 49 ILE HD11 H 4.355 10.783 -4.796 1.00 . A A . 49 ILE HD11 1 1 4 2945 1 1 49 ILE HD12 H 5.148 9.759 -5.978 1.00 . A A . 49 ILE HD12 1 1 4 2946 1 1 49 ILE HD13 H 5.666 11.444 -5.796 1.00 . A A . 49 ILE HD13 1 1 4 2947 1 1 49 ILE HG12 H 6.438 10.879 -3.550 1.00 . A A . 49 ILE HG12 1 1 4 2948 1 1 49 ILE HG13 H 7.210 9.861 -4.780 1.00 . A A . 49 ILE HG13 1 1 4 2949 1 1 49 ILE HG21 H 4.184 8.210 -2.308 1.00 . A A . 49 ILE HG21 1 1 4 2950 1 1 49 ILE HG22 H 3.771 9.496 -3.431 1.00 . A A . 49 ILE HG22 1 1 4 2951 1 1 49 ILE HG23 H 4.696 9.858 -1.961 1.00 . A A . 49 ILE HG23 1 1 4 2952 1 1 49 ILE N N 6.560 7.233 -1.802 1.00 . A A . 49 ILE N 1 1 4 2953 1 1 49 ILE O O 8.524 10.168 -1.939 1.00 . A A . 49 ILE O 1 1 4 2954 1 1 50 ASN C C 8.298 10.503 1.235 1.00 . A A . 50 ASN C 1 1 4 2955 1 1 50 ASN CA C 7.130 10.891 0.360 1.00 . A A . 50 ASN CA 1 1 4 2956 1 1 50 ASN CB C 5.930 11.286 1.229 1.00 . A A . 50 ASN CB 1 1 4 2957 1 1 50 ASN CG C 4.779 11.844 0.422 1.00 . A A . 50 ASN CG 1 1 4 2958 1 1 50 ASN H H 6.006 9.239 -0.402 1.00 . A A . 50 ASN H 1 1 4 2959 1 1 50 ASN HA H 7.422 11.744 -0.233 1.00 . A A . 50 ASN HA 1 1 4 2960 1 1 50 ASN HB2 H 5.589 10.402 1.744 1.00 . A A . 50 ASN HB2 1 1 4 2961 1 1 50 ASN HB3 H 6.244 12.028 1.951 1.00 . A A . 50 ASN HB3 1 1 4 2962 1 1 50 ASN HD21 H 5.434 13.694 0.697 1.00 . A A . 50 ASN HD21 1 1 4 2963 1 1 50 ASN HD22 H 3.997 13.531 -0.230 1.00 . A A . 50 ASN HD22 1 1 4 2964 1 1 50 ASN N N 6.783 9.807 -0.579 1.00 . A A . 50 ASN N 1 1 4 2965 1 1 50 ASN ND2 N 4.736 13.148 0.283 1.00 . A A . 50 ASN ND2 1 1 4 2966 1 1 50 ASN O O 9.126 11.328 1.557 1.00 . A A . 50 ASN O 1 1 4 2967 1 1 50 ASN OD1 O 3.918 11.103 -0.052 1.00 . A A . 50 ASN OD1 1 1 4 2968 1 1 51 CYS C C 10.774 8.638 1.624 1.00 . A A . 51 CYS C 1 1 4 2969 1 1 51 CYS CA C 9.470 8.708 2.415 1.00 . A A . 51 CYS CA 1 1 4 2970 1 1 51 CYS CB C 9.147 7.312 2.984 1.00 . A A . 51 CYS CB 1 1 4 2971 1 1 51 CYS H H 7.681 8.612 1.257 1.00 . A A . 51 CYS H 1 1 4 2972 1 1 51 CYS HA H 9.613 9.393 3.237 1.00 . A A . 51 CYS HA 1 1 4 2973 1 1 51 CYS HB2 H 8.738 6.707 2.190 1.00 . A A . 51 CYS HB2 1 1 4 2974 1 1 51 CYS HB3 H 10.065 6.855 3.325 1.00 . A A . 51 CYS HB3 1 1 4 2975 1 1 51 CYS N N 8.372 9.223 1.587 1.00 . A A . 51 CYS N 1 1 4 2976 1 1 51 CYS O O 11.853 8.692 2.183 1.00 . A A . 51 CYS O 1 1 4 2977 1 1 51 CYS SG S 7.947 7.231 4.342 1.00 . A A . 51 CYS SG 1 1 4 2978 1 1 52 ALA C C 12.362 9.801 -0.859 1.00 . A A . 52 ALA C 1 1 4 2979 1 1 52 ALA CA C 11.823 8.411 -0.526 1.00 . A A . 52 ALA CA 1 1 4 2980 1 1 52 ALA CB C 11.476 7.647 -1.793 1.00 . A A . 52 ALA CB 1 1 4 2981 1 1 52 ALA H H 9.753 8.509 -0.057 1.00 . A A . 52 ALA H 1 1 4 2982 1 1 52 ALA HA H 12.583 7.857 0.012 1.00 . A A . 52 ALA HA 1 1 4 2983 1 1 52 ALA HB1 H 11.115 6.670 -1.512 1.00 . A A . 52 ALA HB1 1 1 4 2984 1 1 52 ALA HB2 H 12.355 7.535 -2.407 1.00 . A A . 52 ALA HB2 1 1 4 2985 1 1 52 ALA HB3 H 10.712 8.173 -2.350 1.00 . A A . 52 ALA HB3 1 1 4 2986 1 1 52 ALA N N 10.657 8.509 0.325 1.00 . A A . 52 ALA N 1 1 4 2987 2 2 1 ZN ZN ZN 5.809 7.539 3.636 1.00 . B A . 53 ZN ZN 1 1 4 2988 3 2 1 ZN ZN ZN -5.285 2.882 -1.878 1.00 . C A . 54 ZN ZN 1 1 5 2989 1 1 1 SER C C -11.643 6.273 1.578 1.00 . A A . 1 SER C 1 1 5 2990 1 1 1 SER CA C -12.767 6.519 2.628 1.00 . A A . 1 SER CA 1 1 5 2991 1 1 1 SER CB C -12.358 5.987 4.026 1.00 . A A . 1 SER CB 1 1 5 2992 1 1 1 SER HA H -12.927 7.583 2.682 1.00 . A A . 1 SER HA 1 1 5 2993 1 1 1 SER HB2 H -12.209 4.919 3.979 1.00 . A A . 1 SER HB2 1 1 5 2994 1 1 1 SER HB3 H -11.439 6.459 4.342 1.00 . A A . 1 SER HB3 1 1 5 2995 1 1 1 SER HG H -13.960 5.506 5.034 1.00 . A A . 1 SER HG 1 1 5 2996 1 1 1 SER N N -14.062 5.904 2.203 1.00 . A A . 1 SER N 1 1 5 2997 1 1 1 SER O O -11.739 5.363 0.733 1.00 . A A . 1 SER O 1 1 5 2998 1 1 1 SER OG O -13.374 6.269 5.011 1.00 . A A . 1 SER OG 1 1 5 2999 1 1 2 VAL C C -8.233 6.727 1.482 1.00 . A A . 2 VAL C 1 1 5 3000 1 1 2 VAL CA C -9.500 7.016 0.699 1.00 . A A . 2 VAL CA 1 1 5 3001 1 1 2 VAL CB C -9.354 8.362 -0.101 1.00 . A A . 2 VAL CB 1 1 5 3002 1 1 2 VAL CG1 C -8.208 8.315 -1.100 1.00 . A A . 2 VAL CG1 1 1 5 3003 1 1 2 VAL CG2 C -10.654 8.713 -0.812 1.00 . A A . 2 VAL CG2 1 1 5 3004 1 1 2 VAL H H -10.544 7.781 2.319 1.00 . A A . 2 VAL H 1 1 5 3005 1 1 2 VAL HA H -9.685 6.210 0.006 1.00 . A A . 2 VAL HA 1 1 5 3006 1 1 2 VAL HB H -9.136 9.148 0.602 1.00 . A A . 2 VAL HB 1 1 5 3007 1 1 2 VAL HG11 H -7.283 8.150 -0.573 1.00 . A A . 2 VAL HG11 1 1 5 3008 1 1 2 VAL HG12 H -8.141 9.258 -1.621 1.00 . A A . 2 VAL HG12 1 1 5 3009 1 1 2 VAL HG13 H -8.362 7.521 -1.816 1.00 . A A . 2 VAL HG13 1 1 5 3010 1 1 2 VAL HG21 H -11.439 8.830 -0.080 1.00 . A A . 2 VAL HG21 1 1 5 3011 1 1 2 VAL HG22 H -10.915 7.918 -1.497 1.00 . A A . 2 VAL HG22 1 1 5 3012 1 1 2 VAL HG23 H -10.528 9.626 -1.375 1.00 . A A . 2 VAL HG23 1 1 5 3013 1 1 2 VAL N N -10.606 7.092 1.627 1.00 . A A . 2 VAL N 1 1 5 3014 1 1 2 VAL O O -8.076 7.230 2.587 1.00 . A A . 2 VAL O 1 1 5 3015 1 1 3 CYS C C -5.030 6.546 1.204 1.00 . A A . 3 CYS C 1 1 5 3016 1 1 3 CYS CA C -6.122 5.551 1.649 1.00 . A A . 3 CYS CA 1 1 5 3017 1 1 3 CYS CB C -5.666 4.111 1.296 1.00 . A A . 3 CYS CB 1 1 5 3018 1 1 3 CYS H H -7.507 5.487 0.066 1.00 . A A . 3 CYS H 1 1 5 3019 1 1 3 CYS HA H -6.279 5.639 2.716 1.00 . A A . 3 CYS HA 1 1 5 3020 1 1 3 CYS HB2 H -5.162 3.678 2.146 1.00 . A A . 3 CYS HB2 1 1 5 3021 1 1 3 CYS HB3 H -6.533 3.510 1.065 1.00 . A A . 3 CYS HB3 1 1 5 3022 1 1 3 CYS N N -7.360 5.882 0.947 1.00 . A A . 3 CYS N 1 1 5 3023 1 1 3 CYS O O -5.322 7.503 0.491 1.00 . A A . 3 CYS O 1 1 5 3024 1 1 3 CYS SG S -4.536 4.017 -0.123 1.00 . A A . 3 CYS SG 1 1 5 3025 1 1 4 ALA C C -2.089 6.527 -0.079 1.00 . A A . 4 ALA C 1 1 5 3026 1 1 4 ALA CA C -2.703 7.142 1.167 1.00 . A A . 4 ALA CA 1 1 5 3027 1 1 4 ALA CB C -1.653 7.251 2.258 1.00 . A A . 4 ALA CB 1 1 5 3028 1 1 4 ALA H H -3.614 5.525 2.168 1.00 . A A . 4 ALA H 1 1 5 3029 1 1 4 ALA HA H -3.076 8.125 0.930 1.00 . A A . 4 ALA HA 1 1 5 3030 1 1 4 ALA HB1 H -0.796 7.824 1.930 1.00 . A A . 4 ALA HB1 1 1 5 3031 1 1 4 ALA HB2 H -1.303 6.262 2.521 1.00 . A A . 4 ALA HB2 1 1 5 3032 1 1 4 ALA HB3 H -2.090 7.727 3.125 1.00 . A A . 4 ALA HB3 1 1 5 3033 1 1 4 ALA N N -3.796 6.313 1.609 1.00 . A A . 4 ALA N 1 1 5 3034 1 1 4 ALA O O -1.698 5.384 -0.054 1.00 . A A . 4 ALA O 1 1 5 3035 1 1 5 ALA C C -1.591 7.982 -3.444 1.00 . A A . 5 ALA C 1 1 5 3036 1 1 5 ALA CA C -1.428 6.879 -2.424 1.00 . A A . 5 ALA CA 1 1 5 3037 1 1 5 ALA CB C -1.957 5.553 -3.008 1.00 . A A . 5 ALA CB 1 1 5 3038 1 1 5 ALA H H -2.676 8.064 -1.211 1.00 . A A . 5 ALA H 1 1 5 3039 1 1 5 ALA HA H -0.375 6.777 -2.215 1.00 . A A . 5 ALA HA 1 1 5 3040 1 1 5 ALA HB1 H -2.986 5.689 -3.305 1.00 . A A . 5 ALA HB1 1 1 5 3041 1 1 5 ALA HB2 H -1.873 4.786 -2.250 1.00 . A A . 5 ALA HB2 1 1 5 3042 1 1 5 ALA HB3 H -1.367 5.237 -3.860 1.00 . A A . 5 ALA HB3 1 1 5 3043 1 1 5 ALA N N -2.110 7.263 -1.184 1.00 . A A . 5 ALA N 1 1 5 3044 1 1 5 ALA O O -2.603 8.697 -3.427 1.00 . A A . 5 ALA O 1 1 5 3045 1 1 6 GLN C C -1.864 8.916 -6.231 1.00 . A A . 6 GLN C 1 1 5 3046 1 1 6 GLN CA C -0.574 9.100 -5.431 1.00 . A A . 6 GLN CA 1 1 5 3047 1 1 6 GLN CB C 0.613 8.752 -6.357 1.00 . A A . 6 GLN CB 1 1 5 3048 1 1 6 GLN CD C 1.487 11.028 -6.978 1.00 . A A . 6 GLN CD 1 1 5 3049 1 1 6 GLN CG C 0.863 9.740 -7.475 1.00 . A A . 6 GLN CG 1 1 5 3050 1 1 6 GLN H H 0.332 7.802 -4.102 1.00 . A A . 6 GLN H 1 1 5 3051 1 1 6 GLN HA H -0.467 10.125 -5.106 1.00 . A A . 6 GLN HA 1 1 5 3052 1 1 6 GLN HB2 H 1.511 8.723 -5.758 1.00 . A A . 6 GLN HB2 1 1 5 3053 1 1 6 GLN HB3 H 0.449 7.778 -6.796 1.00 . A A . 6 GLN HB3 1 1 5 3054 1 1 6 GLN HE21 H -0.298 11.888 -6.703 1.00 . A A . 6 GLN HE21 1 1 5 3055 1 1 6 GLN HE22 H 1.084 12.834 -6.310 1.00 . A A . 6 GLN HE22 1 1 5 3056 1 1 6 GLN HG2 H 1.530 9.295 -8.200 1.00 . A A . 6 GLN HG2 1 1 5 3057 1 1 6 GLN HG3 H -0.090 9.980 -7.927 1.00 . A A . 6 GLN HG3 1 1 5 3058 1 1 6 GLN N N -0.554 8.165 -4.293 1.00 . A A . 6 GLN N 1 1 5 3059 1 1 6 GLN NE2 N 0.675 12.001 -6.635 1.00 . A A . 6 GLN NE2 1 1 5 3060 1 1 6 GLN O O -2.467 9.873 -6.687 1.00 . A A . 6 GLN O 1 1 5 3061 1 1 6 GLN OE1 O 2.698 11.153 -6.923 1.00 . A A . 6 GLN OE1 1 1 5 3062 1 1 7 ASN C C -4.154 6.212 -6.357 1.00 . A A . 7 ASN C 1 1 5 3063 1 1 7 ASN CA C -3.471 7.342 -7.068 1.00 . A A . 7 ASN CA 1 1 5 3064 1 1 7 ASN CB C -3.203 6.947 -8.528 1.00 . A A . 7 ASN CB 1 1 5 3065 1 1 7 ASN CG C -4.485 6.600 -9.274 1.00 . A A . 7 ASN CG 1 1 5 3066 1 1 7 ASN H H -1.569 7.085 -6.015 1.00 . A A . 7 ASN H 1 1 5 3067 1 1 7 ASN HA H -4.124 8.204 -7.060 1.00 . A A . 7 ASN HA 1 1 5 3068 1 1 7 ASN HB2 H -2.730 7.780 -9.028 1.00 . A A . 7 ASN HB2 1 1 5 3069 1 1 7 ASN HB3 H -2.551 6.085 -8.555 1.00 . A A . 7 ASN HB3 1 1 5 3070 1 1 7 ASN HD21 H -4.691 8.477 -9.853 1.00 . A A . 7 ASN HD21 1 1 5 3071 1 1 7 ASN HD22 H -5.900 7.378 -10.395 1.00 . A A . 7 ASN HD22 1 1 5 3072 1 1 7 ASN N N -2.242 7.686 -6.394 1.00 . A A . 7 ASN N 1 1 5 3073 1 1 7 ASN ND2 N -5.085 7.580 -9.895 1.00 . A A . 7 ASN ND2 1 1 5 3074 1 1 7 ASN O O -3.649 5.106 -6.335 1.00 . A A . 7 ASN O 1 1 5 3075 1 1 7 ASN OD1 O -4.930 5.444 -9.290 1.00 . A A . 7 ASN OD1 1 1 5 3076 1 1 8 CYS C C -7.186 4.978 -5.885 1.00 . A A . 8 CYS C 1 1 5 3077 1 1 8 CYS CA C -5.958 5.403 -5.119 1.00 . A A . 8 CYS CA 1 1 5 3078 1 1 8 CYS CB C -6.261 5.627 -3.656 1.00 . A A . 8 CYS CB 1 1 5 3079 1 1 8 CYS H H -5.637 7.385 -5.720 1.00 . A A . 8 CYS H 1 1 5 3080 1 1 8 CYS HA H -5.265 4.583 -5.189 1.00 . A A . 8 CYS HA 1 1 5 3081 1 1 8 CYS HB2 H -5.346 5.847 -3.131 1.00 . A A . 8 CYS HB2 1 1 5 3082 1 1 8 CYS HB3 H -6.953 6.446 -3.527 1.00 . A A . 8 CYS HB3 1 1 5 3083 1 1 8 CYS N N -5.277 6.475 -5.745 1.00 . A A . 8 CYS N 1 1 5 3084 1 1 8 CYS O O -8.142 5.735 -6.043 1.00 . A A . 8 CYS O 1 1 5 3085 1 1 8 CYS SG S -6.996 4.156 -2.887 1.00 . A A . 8 CYS SG 1 1 5 3086 1 1 9 GLN C C -9.379 2.722 -6.246 1.00 . A A . 9 GLN C 1 1 5 3087 1 1 9 GLN CA C -8.167 3.096 -7.135 1.00 . A A . 9 GLN CA 1 1 5 3088 1 1 9 GLN CB C -7.560 1.818 -7.714 1.00 . A A . 9 GLN CB 1 1 5 3089 1 1 9 GLN CD C -5.660 0.773 -9.019 1.00 . A A . 9 GLN CD 1 1 5 3090 1 1 9 GLN CG C -6.302 2.056 -8.553 1.00 . A A . 9 GLN CG 1 1 5 3091 1 1 9 GLN H H -6.301 3.244 -6.192 1.00 . A A . 9 GLN H 1 1 5 3092 1 1 9 GLN HA H -8.466 3.732 -7.955 1.00 . A A . 9 GLN HA 1 1 5 3093 1 1 9 GLN HB2 H -7.283 1.177 -6.889 1.00 . A A . 9 GLN HB2 1 1 5 3094 1 1 9 GLN HB3 H -8.286 1.297 -8.319 1.00 . A A . 9 GLN HB3 1 1 5 3095 1 1 9 GLN HE21 H -3.871 1.631 -8.984 1.00 . A A . 9 GLN HE21 1 1 5 3096 1 1 9 GLN HE22 H -3.900 -0.006 -9.508 1.00 . A A . 9 GLN HE22 1 1 5 3097 1 1 9 GLN HG2 H -6.529 2.644 -9.423 1.00 . A A . 9 GLN HG2 1 1 5 3098 1 1 9 GLN HG3 H -5.577 2.572 -7.937 1.00 . A A . 9 GLN HG3 1 1 5 3099 1 1 9 GLN N N -7.123 3.747 -6.356 1.00 . A A . 9 GLN N 1 1 5 3100 1 1 9 GLN NE2 N -4.351 0.800 -9.181 1.00 . A A . 9 GLN NE2 1 1 5 3101 1 1 9 GLN O O -10.419 2.329 -6.744 1.00 . A A . 9 GLN O 1 1 5 3102 1 1 9 GLN OE1 O -6.326 -0.232 -9.222 1.00 . A A . 9 GLN OE1 1 1 5 3103 1 1 10 ARG C C -10.636 0.977 -4.036 1.00 . A A . 10 ARG C 1 1 5 3104 1 1 10 ARG CA C -10.185 2.460 -3.888 1.00 . A A . 10 ARG CA 1 1 5 3105 1 1 10 ARG CB C -11.416 3.385 -3.869 1.00 . A A . 10 ARG CB 1 1 5 3106 1 1 10 ARG CD C -12.381 5.684 -3.505 1.00 . A A . 10 ARG CD 1 1 5 3107 1 1 10 ARG CG C -11.111 4.846 -3.566 1.00 . A A . 10 ARG CG 1 1 5 3108 1 1 10 ARG CZ C -14.552 5.693 -2.259 1.00 . A A . 10 ARG CZ 1 1 5 3109 1 1 10 ARG H H -8.358 3.298 -4.646 1.00 . A A . 10 ARG H 1 1 5 3110 1 1 10 ARG HA H -9.686 2.522 -2.928 1.00 . A A . 10 ARG HA 1 1 5 3111 1 1 10 ARG HB2 H -11.907 3.334 -4.831 1.00 . A A . 10 ARG HB2 1 1 5 3112 1 1 10 ARG HB3 H -12.092 3.016 -3.111 1.00 . A A . 10 ARG HB3 1 1 5 3113 1 1 10 ARG HD2 H -12.097 6.714 -3.339 1.00 . A A . 10 ARG HD2 1 1 5 3114 1 1 10 ARG HD3 H -12.898 5.600 -4.446 1.00 . A A . 10 ARG HD3 1 1 5 3115 1 1 10 ARG HE H -12.874 4.647 -1.770 1.00 . A A . 10 ARG HE 1 1 5 3116 1 1 10 ARG HG2 H -10.608 4.914 -2.610 1.00 . A A . 10 ARG HG2 1 1 5 3117 1 1 10 ARG HG3 H -10.467 5.248 -4.337 1.00 . A A . 10 ARG HG3 1 1 5 3118 1 1 10 ARG HH11 H -14.647 6.794 -4.000 1.00 . A A . 10 ARG HH11 1 1 5 3119 1 1 10 ARG HH12 H -16.054 6.830 -3.019 1.00 . A A . 10 ARG HH12 1 1 5 3120 1 1 10 ARG HH21 H -14.880 4.709 -0.484 1.00 . A A . 10 ARG HH21 1 1 5 3121 1 1 10 ARG HH22 H -16.207 5.596 -1.059 1.00 . A A . 10 ARG HH22 1 1 5 3122 1 1 10 ARG N N -9.193 2.870 -4.926 1.00 . A A . 10 ARG N 1 1 5 3123 1 1 10 ARG NE N -13.282 5.262 -2.420 1.00 . A A . 10 ARG NE 1 1 5 3124 1 1 10 ARG NH1 N -15.119 6.493 -3.167 1.00 . A A . 10 ARG NH1 1 1 5 3125 1 1 10 ARG NH2 N -15.251 5.307 -1.194 1.00 . A A . 10 ARG NH2 1 1 5 3126 1 1 10 ARG O O -11.835 0.696 -4.062 1.00 . A A . 10 ARG O 1 1 5 3127 1 1 11 PRO C C -10.374 -1.997 -2.891 1.00 . A A . 11 PRO C 1 1 5 3128 1 1 11 PRO CA C -10.026 -1.413 -4.247 1.00 . A A . 11 PRO CA 1 1 5 3129 1 1 11 PRO CB C -8.716 -2.049 -4.746 1.00 . A A . 11 PRO CB 1 1 5 3130 1 1 11 PRO CD C -8.240 0.177 -4.105 1.00 . A A . 11 PRO CD 1 1 5 3131 1 1 11 PRO CG C -7.796 -0.904 -5.020 1.00 . A A . 11 PRO CG 1 1 5 3132 1 1 11 PRO HA H -10.816 -1.584 -4.962 1.00 . A A . 11 PRO HA 1 1 5 3133 1 1 11 PRO HB2 H -8.328 -2.644 -3.937 1.00 . A A . 11 PRO HB2 1 1 5 3134 1 1 11 PRO HB3 H -8.888 -2.663 -5.615 1.00 . A A . 11 PRO HB3 1 1 5 3135 1 1 11 PRO HD2 H -7.836 0.022 -3.114 1.00 . A A . 11 PRO HD2 1 1 5 3136 1 1 11 PRO HD3 H -7.965 1.151 -4.480 1.00 . A A . 11 PRO HD3 1 1 5 3137 1 1 11 PRO HG2 H -6.773 -1.183 -4.811 1.00 . A A . 11 PRO HG2 1 1 5 3138 1 1 11 PRO HG3 H -7.906 -0.586 -6.044 1.00 . A A . 11 PRO HG3 1 1 5 3139 1 1 11 PRO N N -9.681 0.003 -4.121 1.00 . A A . 11 PRO N 1 1 5 3140 1 1 11 PRO O O -9.608 -1.812 -1.906 1.00 . A A . 11 PRO O 1 1 5 3141 1 1 12 CYS C C -12.137 -4.820 -1.840 1.00 . A A . 12 CYS C 1 1 5 3142 1 1 12 CYS CA C -11.917 -3.315 -1.621 1.00 . A A . 12 CYS CA 1 1 5 3143 1 1 12 CYS CB C -13.217 -2.653 -1.134 1.00 . A A . 12 CYS CB 1 1 5 3144 1 1 12 CYS H H -12.043 -2.804 -3.630 1.00 . A A . 12 CYS H 1 1 5 3145 1 1 12 CYS HA H -11.153 -3.160 -0.871 1.00 . A A . 12 CYS HA 1 1 5 3146 1 1 12 CYS HB2 H -13.041 -1.598 -0.998 1.00 . A A . 12 CYS HB2 1 1 5 3147 1 1 12 CYS HB3 H -13.983 -2.778 -1.882 1.00 . A A . 12 CYS HB3 1 1 5 3148 1 1 12 CYS HG H -15.056 -3.815 0.149 1.00 . A A . 12 CYS HG 1 1 5 3149 1 1 12 CYS N N -11.476 -2.701 -2.831 1.00 . A A . 12 CYS N 1 1 5 3150 1 1 12 CYS O O -13.020 -5.231 -2.580 1.00 . A A . 12 CYS O 1 1 5 3151 1 1 12 CYS SG S -13.861 -3.306 0.422 1.00 . A A . 12 CYS SG 1 1 5 3152 1 1 13 LYS C C -11.015 -7.558 0.144 1.00 . A A . 13 LYS C 1 1 5 3153 1 1 13 LYS CA C -11.383 -7.053 -1.235 1.00 . A A . 13 LYS CA 1 1 5 3154 1 1 13 LYS CB C -10.443 -7.713 -2.271 1.00 . A A . 13 LYS CB 1 1 5 3155 1 1 13 LYS CD C -9.898 -8.291 -4.642 1.00 . A A . 13 LYS CD 1 1 5 3156 1 1 13 LYS CE C -10.287 -8.132 -6.105 1.00 . A A . 13 LYS CE 1 1 5 3157 1 1 13 LYS CG C -10.782 -7.454 -3.729 1.00 . A A . 13 LYS CG 1 1 5 3158 1 1 13 LYS H H -10.549 -5.218 -0.725 1.00 . A A . 13 LYS H 1 1 5 3159 1 1 13 LYS HA H -12.403 -7.330 -1.448 1.00 . A A . 13 LYS HA 1 1 5 3160 1 1 13 LYS HB2 H -9.439 -7.354 -2.094 1.00 . A A . 13 LYS HB2 1 1 5 3161 1 1 13 LYS HB3 H -10.457 -8.779 -2.100 1.00 . A A . 13 LYS HB3 1 1 5 3162 1 1 13 LYS HD2 H -8.868 -7.995 -4.521 1.00 . A A . 13 LYS HD2 1 1 5 3163 1 1 13 LYS HD3 H -10.014 -9.330 -4.373 1.00 . A A . 13 LYS HD3 1 1 5 3164 1 1 13 LYS HE2 H -11.327 -8.406 -6.227 1.00 . A A . 13 LYS HE2 1 1 5 3165 1 1 13 LYS HE3 H -10.141 -7.097 -6.381 1.00 . A A . 13 LYS HE3 1 1 5 3166 1 1 13 LYS HG2 H -11.818 -7.714 -3.889 1.00 . A A . 13 LYS HG2 1 1 5 3167 1 1 13 LYS HG3 H -10.625 -6.408 -3.943 1.00 . A A . 13 LYS HG3 1 1 5 3168 1 1 13 LYS HZ1 H -8.457 -8.749 -6.985 1.00 . A A . 13 LYS HZ1 1 1 5 3169 1 1 13 LYS HZ2 H -9.795 -8.924 -7.977 1.00 . A A . 13 LYS HZ2 1 1 5 3170 1 1 13 LYS HZ3 H -9.559 -9.996 -6.727 1.00 . A A . 13 LYS HZ3 1 1 5 3171 1 1 13 LYS N N -11.289 -5.606 -1.232 1.00 . A A . 13 LYS N 1 1 5 3172 1 1 13 LYS NZ N -9.467 -8.995 -6.994 1.00 . A A . 13 LYS NZ 1 1 5 3173 1 1 13 LYS O O -10.323 -6.877 0.880 1.00 . A A . 13 LYS O 1 1 5 3174 1 1 14 ASP C C -9.832 -10.100 1.755 1.00 . A A . 14 ASP C 1 1 5 3175 1 1 14 ASP CA C -11.138 -9.334 1.799 1.00 . A A . 14 ASP CA 1 1 5 3176 1 1 14 ASP CB C -12.261 -10.254 2.290 1.00 . A A . 14 ASP CB 1 1 5 3177 1 1 14 ASP CG C -13.585 -9.531 2.442 1.00 . A A . 14 ASP CG 1 1 5 3178 1 1 14 ASP H H -12.044 -9.227 -0.133 1.00 . A A . 14 ASP H 1 1 5 3179 1 1 14 ASP HA H -11.034 -8.514 2.490 1.00 . A A . 14 ASP HA 1 1 5 3180 1 1 14 ASP HB2 H -12.381 -11.069 1.586 1.00 . A A . 14 ASP HB2 1 1 5 3181 1 1 14 ASP HB3 H -11.990 -10.666 3.251 1.00 . A A . 14 ASP HB3 1 1 5 3182 1 1 14 ASP N N -11.456 -8.743 0.487 1.00 . A A . 14 ASP N 1 1 5 3183 1 1 14 ASP O O -9.416 -10.698 2.740 1.00 . A A . 14 ASP O 1 1 5 3184 1 1 14 ASP OD1 O -13.831 -8.913 3.510 1.00 . A A . 14 ASP OD1 1 1 5 3185 1 1 14 ASP OD2 O -14.392 -9.576 1.491 1.00 . A A . 14 ASP OD2 1 1 5 3186 1 1 15 LYS C C -6.805 -9.773 0.149 1.00 . A A . 15 LYS C 1 1 5 3187 1 1 15 LYS CA C -7.919 -10.761 0.455 1.00 . A A . 15 LYS CA 1 1 5 3188 1 1 15 LYS CB C -7.986 -11.849 -0.658 1.00 . A A . 15 LYS CB 1 1 5 3189 1 1 15 LYS CD C -8.878 -14.040 -1.501 1.00 . A A . 15 LYS CD 1 1 5 3190 1 1 15 LYS CE C -9.819 -15.218 -1.257 1.00 . A A . 15 LYS CE 1 1 5 3191 1 1 15 LYS CG C -8.949 -13.004 -0.386 1.00 . A A . 15 LYS CG 1 1 5 3192 1 1 15 LYS H H -9.575 -9.550 -0.115 1.00 . A A . 15 LYS H 1 1 5 3193 1 1 15 LYS HA H -7.691 -11.241 1.396 1.00 . A A . 15 LYS HA 1 1 5 3194 1 1 15 LYS HB2 H -8.317 -11.375 -1.566 1.00 . A A . 15 LYS HB2 1 1 5 3195 1 1 15 LYS HB3 H -7.000 -12.265 -0.809 1.00 . A A . 15 LYS HB3 1 1 5 3196 1 1 15 LYS HD2 H -9.132 -13.571 -2.438 1.00 . A A . 15 LYS HD2 1 1 5 3197 1 1 15 LYS HD3 H -7.864 -14.407 -1.557 1.00 . A A . 15 LYS HD3 1 1 5 3198 1 1 15 LYS HE2 H -9.572 -15.653 -0.303 1.00 . A A . 15 LYS HE2 1 1 5 3199 1 1 15 LYS HE3 H -10.840 -14.867 -1.242 1.00 . A A . 15 LYS HE3 1 1 5 3200 1 1 15 LYS HG2 H -8.688 -13.481 0.550 1.00 . A A . 15 LYS HG2 1 1 5 3201 1 1 15 LYS HG3 H -9.955 -12.617 -0.319 1.00 . A A . 15 LYS HG3 1 1 5 3202 1 1 15 LYS HZ1 H -9.912 -15.900 -3.267 1.00 . A A . 15 LYS HZ1 1 1 5 3203 1 1 15 LYS HZ2 H -10.330 -17.052 -2.110 1.00 . A A . 15 LYS HZ2 1 1 5 3204 1 1 15 LYS HZ3 H -8.732 -16.661 -2.326 1.00 . A A . 15 LYS HZ3 1 1 5 3205 1 1 15 LYS N N -9.182 -10.069 0.616 1.00 . A A . 15 LYS N 1 1 5 3206 1 1 15 LYS NZ N -9.691 -16.260 -2.316 1.00 . A A . 15 LYS NZ 1 1 5 3207 1 1 15 LYS O O -5.677 -10.177 -0.115 1.00 . A A . 15 LYS O 1 1 5 3208 1 1 16 VAL C C -5.446 -6.906 1.135 1.00 . A A . 16 VAL C 1 1 5 3209 1 1 16 VAL CA C -6.107 -7.474 -0.128 1.00 . A A . 16 VAL CA 1 1 5 3210 1 1 16 VAL CB C -6.633 -6.319 -1.041 1.00 . A A . 16 VAL CB 1 1 5 3211 1 1 16 VAL CG1 C -7.782 -5.584 -0.391 1.00 . A A . 16 VAL CG1 1 1 5 3212 1 1 16 VAL CG2 C -5.503 -5.347 -1.387 1.00 . A A . 16 VAL CG2 1 1 5 3213 1 1 16 VAL H H -8.008 -8.193 0.479 1.00 . A A . 16 VAL H 1 1 5 3214 1 1 16 VAL HA H -5.340 -8.011 -0.666 1.00 . A A . 16 VAL HA 1 1 5 3215 1 1 16 VAL HB H -7.005 -6.744 -1.960 1.00 . A A . 16 VAL HB 1 1 5 3216 1 1 16 VAL HG11 H -8.110 -4.760 -1.007 1.00 . A A . 16 VAL HG11 1 1 5 3217 1 1 16 VAL HG12 H -7.411 -5.226 0.559 1.00 . A A . 16 VAL HG12 1 1 5 3218 1 1 16 VAL HG13 H -8.592 -6.278 -0.210 1.00 . A A . 16 VAL HG13 1 1 5 3219 1 1 16 VAL HG21 H -5.163 -4.887 -0.471 1.00 . A A . 16 VAL HG21 1 1 5 3220 1 1 16 VAL HG22 H -5.873 -4.584 -2.057 1.00 . A A . 16 VAL HG22 1 1 5 3221 1 1 16 VAL HG23 H -4.679 -5.884 -1.832 1.00 . A A . 16 VAL HG23 1 1 5 3222 1 1 16 VAL N N -7.113 -8.476 0.195 1.00 . A A . 16 VAL N 1 1 5 3223 1 1 16 VAL O O -6.052 -6.171 1.913 1.00 . A A . 16 VAL O 1 1 5 3224 1 1 17 ASP C C -2.878 -5.426 2.094 1.00 . A A . 17 ASP C 1 1 5 3225 1 1 17 ASP CA C -3.436 -6.827 2.436 1.00 . A A . 17 ASP CA 1 1 5 3226 1 1 17 ASP CB C -2.335 -7.827 2.782 1.00 . A A . 17 ASP CB 1 1 5 3227 1 1 17 ASP CG C -1.561 -7.444 4.027 1.00 . A A . 17 ASP CG 1 1 5 3228 1 1 17 ASP H H -3.984 -8.082 0.799 1.00 . A A . 17 ASP H 1 1 5 3229 1 1 17 ASP HA H -4.092 -6.716 3.287 1.00 . A A . 17 ASP HA 1 1 5 3230 1 1 17 ASP HB2 H -2.798 -8.788 2.938 1.00 . A A . 17 ASP HB2 1 1 5 3231 1 1 17 ASP HB3 H -1.651 -7.900 1.949 1.00 . A A . 17 ASP HB3 1 1 5 3232 1 1 17 ASP N N -4.250 -7.329 1.353 1.00 . A A . 17 ASP N 1 1 5 3233 1 1 17 ASP O O -2.715 -5.074 0.897 1.00 . A A . 17 ASP O 1 1 5 3234 1 1 17 ASP OD1 O -2.188 -7.313 5.113 1.00 . A A . 17 ASP OD1 1 1 5 3235 1 1 17 ASP OD2 O -0.350 -7.266 3.943 1.00 . A A . 17 ASP OD2 1 1 5 3236 1 1 18 TRP C C -0.822 -3.037 3.514 1.00 . A A . 18 TRP C 1 1 5 3237 1 1 18 TRP CA C -2.231 -3.237 3.023 1.00 . A A . 18 TRP CA 1 1 5 3238 1 1 18 TRP CB C -3.174 -2.370 3.877 1.00 . A A . 18 TRP CB 1 1 5 3239 1 1 18 TRP CD1 C -5.402 -3.466 3.212 1.00 . A A . 18 TRP CD1 1 1 5 3240 1 1 18 TRP CD2 C -5.454 -1.239 3.273 1.00 . A A . 18 TRP CD2 1 1 5 3241 1 1 18 TRP CE2 C -6.723 -1.710 2.895 1.00 . A A . 18 TRP CE2 1 1 5 3242 1 1 18 TRP CE3 C -5.244 0.129 3.379 1.00 . A A . 18 TRP CE3 1 1 5 3243 1 1 18 TRP CG C -4.616 -2.379 3.451 1.00 . A A . 18 TRP CG 1 1 5 3244 1 1 18 TRP CH2 C -7.547 0.488 2.759 1.00 . A A . 18 TRP CH2 1 1 5 3245 1 1 18 TRP CZ2 C -7.776 -0.863 2.642 1.00 . A A . 18 TRP CZ2 1 1 5 3246 1 1 18 TRP CZ3 C -6.289 0.981 3.125 1.00 . A A . 18 TRP CZ3 1 1 5 3247 1 1 18 TRP H H -2.621 -5.053 4.020 1.00 . A A . 18 TRP H 1 1 5 3248 1 1 18 TRP HA H -2.306 -2.917 1.993 1.00 . A A . 18 TRP HA 1 1 5 3249 1 1 18 TRP HB2 H -3.131 -2.704 4.903 1.00 . A A . 18 TRP HB2 1 1 5 3250 1 1 18 TRP HB3 H -2.826 -1.349 3.825 1.00 . A A . 18 TRP HB3 1 1 5 3251 1 1 18 TRP HD1 H -5.045 -4.481 3.272 1.00 . A A . 18 TRP HD1 1 1 5 3252 1 1 18 TRP HE1 H -7.378 -3.713 2.630 1.00 . A A . 18 TRP HE1 1 1 5 3253 1 1 18 TRP HE3 H -4.280 0.520 3.664 1.00 . A A . 18 TRP HE3 1 1 5 3254 1 1 18 TRP HH2 H -8.343 1.195 2.565 1.00 . A A . 18 TRP HH2 1 1 5 3255 1 1 18 TRP HZ2 H -8.740 -1.252 2.355 1.00 . A A . 18 TRP HZ2 1 1 5 3256 1 1 18 TRP HZ3 H -6.148 2.050 3.203 1.00 . A A . 18 TRP HZ3 1 1 5 3257 1 1 18 TRP N N -2.607 -4.648 3.126 1.00 . A A . 18 TRP N 1 1 5 3258 1 1 18 TRP NE1 N -6.658 -3.080 2.859 1.00 . A A . 18 TRP NE1 1 1 5 3259 1 1 18 TRP O O -0.310 -3.843 4.282 1.00 . A A . 18 TRP O 1 1 5 3260 1 1 19 VAL C C 1.291 -0.302 4.118 1.00 . A A . 19 VAL C 1 1 5 3261 1 1 19 VAL CA C 1.165 -1.693 3.492 1.00 . A A . 19 VAL CA 1 1 5 3262 1 1 19 VAL CB C 2.147 -1.819 2.281 1.00 . A A . 19 VAL CB 1 1 5 3263 1 1 19 VAL CG1 C 2.197 -3.247 1.767 1.00 . A A . 19 VAL CG1 1 1 5 3264 1 1 19 VAL CG2 C 1.748 -0.875 1.149 1.00 . A A . 19 VAL CG2 1 1 5 3265 1 1 19 VAL H H -0.567 -1.181 2.628 1.00 . A A . 19 VAL H 1 1 5 3266 1 1 19 VAL HA H 1.444 -2.427 4.233 1.00 . A A . 19 VAL HA 1 1 5 3267 1 1 19 VAL HB H 3.137 -1.552 2.616 1.00 . A A . 19 VAL HB 1 1 5 3268 1 1 19 VAL HG11 H 1.214 -3.549 1.433 1.00 . A A . 19 VAL HG11 1 1 5 3269 1 1 19 VAL HG12 H 2.520 -3.896 2.566 1.00 . A A . 19 VAL HG12 1 1 5 3270 1 1 19 VAL HG13 H 2.892 -3.305 0.944 1.00 . A A . 19 VAL HG13 1 1 5 3271 1 1 19 VAL HG21 H 0.752 -1.116 0.809 1.00 . A A . 19 VAL HG21 1 1 5 3272 1 1 19 VAL HG22 H 2.446 -0.960 0.329 1.00 . A A . 19 VAL HG22 1 1 5 3273 1 1 19 VAL HG23 H 1.762 0.142 1.519 1.00 . A A . 19 VAL HG23 1 1 5 3274 1 1 19 VAL N N -0.197 -1.947 3.116 1.00 . A A . 19 VAL N 1 1 5 3275 1 1 19 VAL O O 0.645 0.644 3.679 1.00 . A A . 19 VAL O 1 1 5 3276 1 1 20 GLN C C 3.765 1.465 5.495 1.00 . A A . 20 GLN C 1 1 5 3277 1 1 20 GLN CA C 2.345 1.044 5.833 1.00 . A A . 20 GLN CA 1 1 5 3278 1 1 20 GLN CB C 2.206 0.874 7.358 1.00 . A A . 20 GLN CB 1 1 5 3279 1 1 20 GLN CD C 2.313 1.957 9.653 1.00 . A A . 20 GLN CD 1 1 5 3280 1 1 20 GLN CG C 2.414 2.160 8.155 1.00 . A A . 20 GLN CG 1 1 5 3281 1 1 20 GLN H H 2.453 -1.060 5.479 1.00 . A A . 20 GLN H 1 1 5 3282 1 1 20 GLN HA H 1.649 1.797 5.489 1.00 . A A . 20 GLN HA 1 1 5 3283 1 1 20 GLN HB2 H 1.212 0.495 7.560 1.00 . A A . 20 GLN HB2 1 1 5 3284 1 1 20 GLN HB3 H 2.927 0.137 7.682 1.00 . A A . 20 GLN HB3 1 1 5 3285 1 1 20 GLN HE21 H 3.587 3.443 9.982 1.00 . A A . 20 GLN HE21 1 1 5 3286 1 1 20 GLN HE22 H 2.975 2.664 11.369 1.00 . A A . 20 GLN HE22 1 1 5 3287 1 1 20 GLN HG2 H 3.390 2.557 7.928 1.00 . A A . 20 GLN HG2 1 1 5 3288 1 1 20 GLN HG3 H 1.677 2.885 7.852 1.00 . A A . 20 GLN HG3 1 1 5 3289 1 1 20 GLN N N 2.067 -0.217 5.158 1.00 . A A . 20 GLN N 1 1 5 3290 1 1 20 GLN NE2 N 3.019 2.762 10.398 1.00 . A A . 20 GLN NE2 1 1 5 3291 1 1 20 GLN O O 4.641 0.612 5.388 1.00 . A A . 20 GLN O 1 1 5 3292 1 1 20 GLN OE1 O 1.591 1.086 10.137 1.00 . A A . 20 GLN OE1 1 1 5 3293 1 1 21 CYS C C 5.972 3.585 6.370 1.00 . A A . 21 CYS C 1 1 5 3294 1 1 21 CYS CA C 5.358 3.187 5.032 1.00 . A A . 21 CYS CA 1 1 5 3295 1 1 21 CYS CB C 5.473 4.309 3.966 1.00 . A A . 21 CYS CB 1 1 5 3296 1 1 21 CYS H H 3.240 3.379 5.228 1.00 . A A . 21 CYS H 1 1 5 3297 1 1 21 CYS HA H 5.905 2.314 4.701 1.00 . A A . 21 CYS HA 1 1 5 3298 1 1 21 CYS HB2 H 6.492 4.574 3.752 1.00 . A A . 21 CYS HB2 1 1 5 3299 1 1 21 CYS HB3 H 5.029 3.957 3.047 1.00 . A A . 21 CYS HB3 1 1 5 3300 1 1 21 CYS N N 3.993 2.747 5.248 1.00 . A A . 21 CYS N 1 1 5 3301 1 1 21 CYS O O 5.698 4.668 6.909 1.00 . A A . 21 CYS O 1 1 5 3302 1 1 21 CYS SG S 4.686 5.876 4.341 1.00 . A A . 21 CYS SG 1 1 5 3303 1 1 22 ASP C C 8.663 3.776 8.160 1.00 . A A . 22 ASP C 1 1 5 3304 1 1 22 ASP CA C 7.432 2.873 8.227 1.00 . A A . 22 ASP CA 1 1 5 3305 1 1 22 ASP CB C 7.837 1.499 8.795 1.00 . A A . 22 ASP CB 1 1 5 3306 1 1 22 ASP CG C 6.665 0.626 9.234 1.00 . A A . 22 ASP CG 1 1 5 3307 1 1 22 ASP H H 7.067 1.941 6.350 1.00 . A A . 22 ASP H 1 1 5 3308 1 1 22 ASP HA H 6.710 3.325 8.891 1.00 . A A . 22 ASP HA 1 1 5 3309 1 1 22 ASP HB2 H 8.359 0.974 8.011 1.00 . A A . 22 ASP HB2 1 1 5 3310 1 1 22 ASP HB3 H 8.502 1.648 9.634 1.00 . A A . 22 ASP HB3 1 1 5 3311 1 1 22 ASP N N 6.811 2.717 6.893 1.00 . A A . 22 ASP N 1 1 5 3312 1 1 22 ASP O O 9.559 3.719 9.010 1.00 . A A . 22 ASP O 1 1 5 3313 1 1 22 ASP OD1 O 5.976 0.069 8.379 1.00 . A A . 22 ASP OD1 1 1 5 3314 1 1 22 ASP OD2 O 6.448 0.492 10.471 1.00 . A A . 22 ASP OD2 1 1 5 3315 1 1 23 GLY C C 9.504 6.969 7.293 1.00 . A A . 23 GLY C 1 1 5 3316 1 1 23 GLY CA C 9.785 5.515 6.970 1.00 . A A . 23 GLY CA 1 1 5 3317 1 1 23 GLY H H 7.832 4.717 6.683 1.00 . A A . 23 GLY H 1 1 5 3318 1 1 23 GLY HA2 H 10.603 5.183 7.594 1.00 . A A . 23 GLY HA2 1 1 5 3319 1 1 23 GLY HA3 H 10.091 5.431 5.933 1.00 . A A . 23 GLY HA3 1 1 5 3320 1 1 23 GLY N N 8.662 4.659 7.192 1.00 . A A . 23 GLY N 1 1 5 3321 1 1 23 GLY O O 10.335 7.815 7.015 1.00 . A A . 23 GLY O 1 1 5 3322 1 1 24 GLY C C 6.610 9.119 8.130 1.00 . A A . 24 GLY C 1 1 5 3323 1 1 24 GLY CA C 8.081 8.684 8.197 1.00 . A A . 24 GLY CA 1 1 5 3324 1 1 24 GLY H H 7.657 6.625 8.136 1.00 . A A . 24 GLY H 1 1 5 3325 1 1 24 GLY HA2 H 8.461 8.903 9.186 1.00 . A A . 24 GLY HA2 1 1 5 3326 1 1 24 GLY HA3 H 8.642 9.273 7.488 1.00 . A A . 24 GLY HA3 1 1 5 3327 1 1 24 GLY N N 8.334 7.284 7.876 1.00 . A A . 24 GLY N 1 1 5 3328 1 1 24 GLY O O 6.157 9.885 8.979 1.00 . A A . 24 GLY O 1 1 5 3329 1 1 25 CYS C C 3.585 8.233 7.896 1.00 . A A . 25 CYS C 1 1 5 3330 1 1 25 CYS CA C 4.459 9.097 7.008 1.00 . A A . 25 CYS CA 1 1 5 3331 1 1 25 CYS CB C 3.954 8.961 5.563 1.00 . A A . 25 CYS CB 1 1 5 3332 1 1 25 CYS H H 6.213 7.957 6.542 1.00 . A A . 25 CYS H 1 1 5 3333 1 1 25 CYS HA H 4.397 10.129 7.321 1.00 . A A . 25 CYS HA 1 1 5 3334 1 1 25 CYS HB2 H 3.754 7.921 5.351 1.00 . A A . 25 CYS HB2 1 1 5 3335 1 1 25 CYS HB3 H 3.043 9.528 5.439 1.00 . A A . 25 CYS HB3 1 1 5 3336 1 1 25 CYS N N 5.857 8.640 7.141 1.00 . A A . 25 CYS N 1 1 5 3337 1 1 25 CYS O O 2.620 8.707 8.487 1.00 . A A . 25 CYS O 1 1 5 3338 1 1 25 CYS SG S 5.105 9.503 4.301 1.00 . A A . 25 CYS SG 1 1 5 3339 1 1 26 ASP C C 1.792 5.769 8.272 1.00 . A A . 26 ASP C 1 1 5 3340 1 1 26 ASP CA C 3.256 5.918 8.748 1.00 . A A . 26 ASP CA 1 1 5 3341 1 1 26 ASP CB C 3.354 6.165 10.295 1.00 . A A . 26 ASP CB 1 1 5 3342 1 1 26 ASP CG C 4.740 5.928 10.877 1.00 . A A . 26 ASP CG 1 1 5 3343 1 1 26 ASP H H 4.835 6.690 7.577 1.00 . A A . 26 ASP H 1 1 5 3344 1 1 26 ASP HA H 3.748 4.985 8.514 1.00 . A A . 26 ASP HA 1 1 5 3345 1 1 26 ASP HB2 H 3.104 7.186 10.550 1.00 . A A . 26 ASP HB2 1 1 5 3346 1 1 26 ASP HB3 H 2.675 5.496 10.808 1.00 . A A . 26 ASP HB3 1 1 5 3347 1 1 26 ASP N N 3.981 6.942 7.987 1.00 . A A . 26 ASP N 1 1 5 3348 1 1 26 ASP O O 0.939 5.283 8.999 1.00 . A A . 26 ASP O 1 1 5 3349 1 1 26 ASP OD1 O 5.647 6.764 10.643 1.00 . A A . 26 ASP OD1 1 1 5 3350 1 1 26 ASP OD2 O 4.916 4.903 11.610 1.00 . A A . 26 ASP OD2 1 1 5 3351 1 1 27 GLU C C 0.002 4.646 5.789 1.00 . A A . 27 GLU C 1 1 5 3352 1 1 27 GLU CA C 0.208 6.047 6.402 1.00 . A A . 27 GLU CA 1 1 5 3353 1 1 27 GLU CB C -0.008 7.147 5.323 1.00 . A A . 27 GLU CB 1 1 5 3354 1 1 27 GLU CD C -0.216 9.630 4.770 1.00 . A A . 27 GLU CD 1 1 5 3355 1 1 27 GLU CG C 0.096 8.588 5.837 1.00 . A A . 27 GLU CG 1 1 5 3356 1 1 27 GLU H H 2.290 6.459 6.465 1.00 . A A . 27 GLU H 1 1 5 3357 1 1 27 GLU HA H -0.530 6.169 7.183 1.00 . A A . 27 GLU HA 1 1 5 3358 1 1 27 GLU HB2 H 0.739 7.026 4.553 1.00 . A A . 27 GLU HB2 1 1 5 3359 1 1 27 GLU HB3 H -0.976 7.005 4.871 1.00 . A A . 27 GLU HB3 1 1 5 3360 1 1 27 GLU HG2 H -0.613 8.744 6.637 1.00 . A A . 27 GLU HG2 1 1 5 3361 1 1 27 GLU HG3 H 1.103 8.764 6.186 1.00 . A A . 27 GLU HG3 1 1 5 3362 1 1 27 GLU N N 1.541 6.138 7.005 1.00 . A A . 27 GLU N 1 1 5 3363 1 1 27 GLU O O 0.959 3.877 5.655 1.00 . A A . 27 GLU O 1 1 5 3364 1 1 27 GLU OE1 O 0.533 9.728 3.785 1.00 . A A . 27 GLU OE1 1 1 5 3365 1 1 27 GLU OE2 O -1.206 10.384 4.928 1.00 . A A . 27 GLU OE2 1 1 5 3366 1 1 28 TRP C C -1.954 3.096 3.407 1.00 . A A . 28 TRP C 1 1 5 3367 1 1 28 TRP CA C -1.595 3.022 4.891 1.00 . A A . 28 TRP CA 1 1 5 3368 1 1 28 TRP CB C -2.739 2.405 5.712 1.00 . A A . 28 TRP CB 1 1 5 3369 1 1 28 TRP CD1 C -2.229 2.948 8.177 1.00 . A A . 28 TRP CD1 1 1 5 3370 1 1 28 TRP CD2 C -1.993 0.779 7.640 1.00 . A A . 28 TRP CD2 1 1 5 3371 1 1 28 TRP CE2 C -1.684 0.941 8.995 1.00 . A A . 28 TRP CE2 1 1 5 3372 1 1 28 TRP CE3 C -1.927 -0.495 7.087 1.00 . A A . 28 TRP CE3 1 1 5 3373 1 1 28 TRP CG C -2.339 2.075 7.126 1.00 . A A . 28 TRP CG 1 1 5 3374 1 1 28 TRP CH2 C -1.244 -1.362 9.232 1.00 . A A . 28 TRP CH2 1 1 5 3375 1 1 28 TRP CZ2 C -1.298 -0.120 9.800 1.00 . A A . 28 TRP CZ2 1 1 5 3376 1 1 28 TRP CZ3 C -1.548 -1.556 7.886 1.00 . A A . 28 TRP CZ3 1 1 5 3377 1 1 28 TRP H H -1.894 5.054 5.501 1.00 . A A . 28 TRP H 1 1 5 3378 1 1 28 TRP HA H -0.725 2.385 4.985 1.00 . A A . 28 TRP HA 1 1 5 3379 1 1 28 TRP HB2 H -3.556 3.108 5.762 1.00 . A A . 28 TRP HB2 1 1 5 3380 1 1 28 TRP HB3 H -3.071 1.499 5.232 1.00 . A A . 28 TRP HB3 1 1 5 3381 1 1 28 TRP HD1 H -2.426 4.009 8.108 1.00 . A A . 28 TRP HD1 1 1 5 3382 1 1 28 TRP HE1 H -1.657 2.693 10.171 1.00 . A A . 28 TRP HE1 1 1 5 3383 1 1 28 TRP HE3 H -2.158 -0.662 6.047 1.00 . A A . 28 TRP HE3 1 1 5 3384 1 1 28 TRP HH2 H -0.956 -2.219 9.825 1.00 . A A . 28 TRP HH2 1 1 5 3385 1 1 28 TRP HZ2 H -1.063 0.025 10.842 1.00 . A A . 28 TRP HZ2 1 1 5 3386 1 1 28 TRP HZ3 H -1.485 -2.552 7.474 1.00 . A A . 28 TRP HZ3 1 1 5 3387 1 1 28 TRP N N -1.233 4.336 5.421 1.00 . A A . 28 TRP N 1 1 5 3388 1 1 28 TRP NE1 N -1.822 2.282 9.295 1.00 . A A . 28 TRP NE1 1 1 5 3389 1 1 28 TRP O O -2.821 3.888 2.999 1.00 . A A . 28 TRP O 1 1 5 3390 1 1 29 PHE C C -1.947 0.890 0.699 1.00 . A A . 29 PHE C 1 1 5 3391 1 1 29 PHE CA C -1.407 2.261 1.176 1.00 . A A . 29 PHE CA 1 1 5 3392 1 1 29 PHE CB C 0.009 2.470 0.557 1.00 . A A . 29 PHE CB 1 1 5 3393 1 1 29 PHE CD1 C 1.310 3.663 2.359 1.00 . A A . 29 PHE CD1 1 1 5 3394 1 1 29 PHE CD2 C 1.035 4.774 0.277 1.00 . A A . 29 PHE CD2 1 1 5 3395 1 1 29 PHE CE1 C 2.029 4.721 2.829 1.00 . A A . 29 PHE CE1 1 1 5 3396 1 1 29 PHE CE2 C 1.758 5.848 0.757 1.00 . A A . 29 PHE CE2 1 1 5 3397 1 1 29 PHE CG C 0.791 3.669 1.078 1.00 . A A . 29 PHE CG 1 1 5 3398 1 1 29 PHE CZ C 2.250 5.812 2.036 1.00 . A A . 29 PHE CZ 1 1 5 3399 1 1 29 PHE H H -0.669 1.617 3.031 1.00 . A A . 29 PHE H 1 1 5 3400 1 1 29 PHE HA H -2.049 3.064 0.857 1.00 . A A . 29 PHE HA 1 1 5 3401 1 1 29 PHE HB2 H 0.616 1.594 0.705 1.00 . A A . 29 PHE HB2 1 1 5 3402 1 1 29 PHE HB3 H -0.112 2.598 -0.507 1.00 . A A . 29 PHE HB3 1 1 5 3403 1 1 29 PHE HD1 H 1.133 2.806 3.000 1.00 . A A . 29 PHE HD1 1 1 5 3404 1 1 29 PHE HD2 H 0.640 4.798 -0.730 1.00 . A A . 29 PHE HD2 1 1 5 3405 1 1 29 PHE HE1 H 2.421 4.692 3.835 1.00 . A A . 29 PHE HE1 1 1 5 3406 1 1 29 PHE HE2 H 1.939 6.707 0.128 1.00 . A A . 29 PHE HE2 1 1 5 3407 1 1 29 PHE HZ H 2.826 6.626 2.452 1.00 . A A . 29 PHE HZ 1 1 5 3408 1 1 29 PHE N N -1.290 2.264 2.623 1.00 . A A . 29 PHE N 1 1 5 3409 1 1 29 PHE O O -1.860 -0.108 1.416 1.00 . A A . 29 PHE O 1 1 5 3410 1 1 30 HIS C C -1.862 -0.886 -2.059 1.00 . A A . 30 HIS C 1 1 5 3411 1 1 30 HIS CA C -2.952 -0.408 -1.137 1.00 . A A . 30 HIS CA 1 1 5 3412 1 1 30 HIS CB C -4.204 -0.217 -2.006 1.00 . A A . 30 HIS CB 1 1 5 3413 1 1 30 HIS CD2 C -6.358 -0.989 -0.804 1.00 . A A . 30 HIS CD2 1 1 5 3414 1 1 30 HIS CE1 C -7.346 0.963 -0.704 1.00 . A A . 30 HIS CE1 1 1 5 3415 1 1 30 HIS CG C -5.509 -0.067 -1.325 1.00 . A A . 30 HIS CG 1 1 5 3416 1 1 30 HIS H H -2.565 1.714 -0.972 1.00 . A A . 30 HIS H 1 1 5 3417 1 1 30 HIS HA H -3.157 -1.130 -0.362 1.00 . A A . 30 HIS HA 1 1 5 3418 1 1 30 HIS HB2 H -4.028 0.767 -2.422 1.00 . A A . 30 HIS HB2 1 1 5 3419 1 1 30 HIS HB3 H -4.294 -0.848 -2.874 1.00 . A A . 30 HIS HB3 1 1 5 3420 1 1 30 HIS HD2 H -6.168 -2.047 -0.697 1.00 . A A . 30 HIS HD2 1 1 5 3421 1 1 30 HIS HE1 H -8.081 1.730 -0.534 1.00 . A A . 30 HIS HE1 1 1 5 3422 1 1 30 HIS HE2 H -8.373 -0.764 -0.342 1.00 . A A . 30 HIS HE2 1 1 5 3423 1 1 30 HIS N N -2.507 0.852 -0.509 1.00 . A A . 30 HIS N 1 1 5 3424 1 1 30 HIS ND1 N -6.146 1.142 -1.249 1.00 . A A . 30 HIS ND1 1 1 5 3425 1 1 30 HIS NE2 N -7.495 -0.324 -0.426 1.00 . A A . 30 HIS NE2 1 1 5 3426 1 1 30 HIS O O -1.308 -0.082 -2.800 1.00 . A A . 30 HIS O 1 1 5 3427 1 1 31 GLN C C -0.764 -2.377 -4.399 1.00 . A A . 31 GLN C 1 1 5 3428 1 1 31 GLN CA C -0.550 -2.744 -2.915 1.00 . A A . 31 GLN CA 1 1 5 3429 1 1 31 GLN CB C -0.383 -4.258 -2.736 1.00 . A A . 31 GLN CB 1 1 5 3430 1 1 31 GLN CD C 0.408 -6.150 -1.256 1.00 . A A . 31 GLN CD 1 1 5 3431 1 1 31 GLN CG C 0.204 -4.654 -1.395 1.00 . A A . 31 GLN CG 1 1 5 3432 1 1 31 GLN H H -2.057 -2.740 -1.396 1.00 . A A . 31 GLN H 1 1 5 3433 1 1 31 GLN HA H 0.359 -2.257 -2.590 1.00 . A A . 31 GLN HA 1 1 5 3434 1 1 31 GLN HB2 H -1.349 -4.729 -2.839 1.00 . A A . 31 GLN HB2 1 1 5 3435 1 1 31 GLN HB3 H 0.266 -4.627 -3.515 1.00 . A A . 31 GLN HB3 1 1 5 3436 1 1 31 GLN HE21 H -1.355 -6.362 -0.412 1.00 . A A . 31 GLN HE21 1 1 5 3437 1 1 31 GLN HE22 H -0.416 -7.795 -0.587 1.00 . A A . 31 GLN HE22 1 1 5 3438 1 1 31 GLN HG2 H 1.164 -4.168 -1.289 1.00 . A A . 31 GLN HG2 1 1 5 3439 1 1 31 GLN HG3 H -0.439 -4.311 -0.602 1.00 . A A . 31 GLN HG3 1 1 5 3440 1 1 31 GLN N N -1.581 -2.177 -2.037 1.00 . A A . 31 GLN N 1 1 5 3441 1 1 31 GLN NE2 N -0.554 -6.836 -0.710 1.00 . A A . 31 GLN NE2 1 1 5 3442 1 1 31 GLN O O 0.136 -1.954 -5.049 1.00 . A A . 31 GLN O 1 1 5 3443 1 1 31 GLN OE1 O 1.440 -6.677 -1.621 1.00 . A A . 31 GLN OE1 1 1 5 3444 1 1 32 VAL C C -2.179 -0.663 -6.594 1.00 . A A . 32 VAL C 1 1 5 3445 1 1 32 VAL CA C -2.209 -2.187 -6.320 1.00 . A A . 32 VAL CA 1 1 5 3446 1 1 32 VAL CB C -3.552 -2.794 -6.826 1.00 . A A . 32 VAL CB 1 1 5 3447 1 1 32 VAL CG1 C -4.689 -2.236 -6.032 1.00 . A A . 32 VAL CG1 1 1 5 3448 1 1 32 VAL CG2 C -3.763 -2.484 -8.290 1.00 . A A . 32 VAL CG2 1 1 5 3449 1 1 32 VAL H H -2.698 -2.824 -4.334 1.00 . A A . 32 VAL H 1 1 5 3450 1 1 32 VAL HA H -1.400 -2.622 -6.881 1.00 . A A . 32 VAL HA 1 1 5 3451 1 1 32 VAL HB H -3.521 -3.868 -6.698 1.00 . A A . 32 VAL HB 1 1 5 3452 1 1 32 VAL HG11 H -4.646 -1.165 -6.192 1.00 . A A . 32 VAL HG11 1 1 5 3453 1 1 32 VAL HG12 H -4.509 -2.450 -4.991 1.00 . A A . 32 VAL HG12 1 1 5 3454 1 1 32 VAL HG13 H -5.635 -2.627 -6.375 1.00 . A A . 32 VAL HG13 1 1 5 3455 1 1 32 VAL HG21 H -2.925 -2.828 -8.881 1.00 . A A . 32 VAL HG21 1 1 5 3456 1 1 32 VAL HG22 H -3.815 -1.407 -8.341 1.00 . A A . 32 VAL HG22 1 1 5 3457 1 1 32 VAL HG23 H -4.696 -2.905 -8.638 1.00 . A A . 32 VAL HG23 1 1 5 3458 1 1 32 VAL N N -1.968 -2.505 -4.901 1.00 . A A . 32 VAL N 1 1 5 3459 1 1 32 VAL O O -1.623 -0.215 -7.591 1.00 . A A . 32 VAL O 1 1 5 3460 1 1 33 CYS C C -1.541 2.268 -5.798 1.00 . A A . 33 CYS C 1 1 5 3461 1 1 33 CYS CA C -2.896 1.541 -5.889 1.00 . A A . 33 CYS CA 1 1 5 3462 1 1 33 CYS CB C -3.987 2.175 -4.955 1.00 . A A . 33 CYS CB 1 1 5 3463 1 1 33 CYS H H -3.067 -0.401 -4.918 1.00 . A A . 33 CYS H 1 1 5 3464 1 1 33 CYS HA H -3.198 1.697 -6.915 1.00 . A A . 33 CYS HA 1 1 5 3465 1 1 33 CYS HB2 H -4.256 3.121 -5.364 1.00 . A A . 33 CYS HB2 1 1 5 3466 1 1 33 CYS HB3 H -4.865 1.547 -4.957 1.00 . A A . 33 CYS HB3 1 1 5 3467 1 1 33 CYS N N -2.757 0.109 -5.683 1.00 . A A . 33 CYS N 1 1 5 3468 1 1 33 CYS O O -1.350 3.308 -6.403 1.00 . A A . 33 CYS O 1 1 5 3469 1 1 33 CYS SG S -3.525 2.466 -3.251 1.00 . A A . 33 CYS SG 1 1 5 3470 1 1 34 VAL C C 1.758 1.440 -5.688 1.00 . A A . 34 VAL C 1 1 5 3471 1 1 34 VAL CA C 0.692 2.302 -4.933 1.00 . A A . 34 VAL CA 1 1 5 3472 1 1 34 VAL CB C 1.087 2.464 -3.442 1.00 . A A . 34 VAL CB 1 1 5 3473 1 1 34 VAL CG1 C 1.706 1.237 -2.842 1.00 . A A . 34 VAL CG1 1 1 5 3474 1 1 34 VAL CG2 C 1.873 3.701 -3.244 1.00 . A A . 34 VAL CG2 1 1 5 3475 1 1 34 VAL H H -0.761 0.928 -4.477 1.00 . A A . 34 VAL H 1 1 5 3476 1 1 34 VAL HA H 0.644 3.283 -5.384 1.00 . A A . 34 VAL HA 1 1 5 3477 1 1 34 VAL HB H 0.216 2.517 -2.815 1.00 . A A . 34 VAL HB 1 1 5 3478 1 1 34 VAL HG11 H 1.899 1.394 -1.792 1.00 . A A . 34 VAL HG11 1 1 5 3479 1 1 34 VAL HG12 H 2.650 1.072 -3.337 1.00 . A A . 34 VAL HG12 1 1 5 3480 1 1 34 VAL HG13 H 1.060 0.381 -2.976 1.00 . A A . 34 VAL HG13 1 1 5 3481 1 1 34 VAL HG21 H 2.067 3.826 -2.191 1.00 . A A . 34 VAL HG21 1 1 5 3482 1 1 34 VAL HG22 H 1.229 4.499 -3.580 1.00 . A A . 34 VAL HG22 1 1 5 3483 1 1 34 VAL HG23 H 2.773 3.654 -3.837 1.00 . A A . 34 VAL HG23 1 1 5 3484 1 1 34 VAL N N -0.602 1.711 -5.039 1.00 . A A . 34 VAL N 1 1 5 3485 1 1 34 VAL O O 2.968 1.725 -5.648 1.00 . A A . 34 VAL O 1 1 5 3486 1 1 35 GLY C C 3.188 -1.289 -6.304 1.00 . A A . 35 GLY C 1 1 5 3487 1 1 35 GLY CA C 2.151 -0.491 -7.152 1.00 . A A . 35 GLY CA 1 1 5 3488 1 1 35 GLY H H 0.295 0.422 -6.519 1.00 . A A . 35 GLY H 1 1 5 3489 1 1 35 GLY HA2 H 1.526 -1.200 -7.668 1.00 . A A . 35 GLY HA2 1 1 5 3490 1 1 35 GLY HA3 H 2.676 0.094 -7.891 1.00 . A A . 35 GLY HA3 1 1 5 3491 1 1 35 GLY N N 1.274 0.437 -6.415 1.00 . A A . 35 GLY N 1 1 5 3492 1 1 35 GLY O O 4.404 -1.133 -6.495 1.00 . A A . 35 GLY O 1 1 5 3493 1 1 36 VAL C C 3.108 -4.492 -4.994 1.00 . A A . 36 VAL C 1 1 5 3494 1 1 36 VAL CA C 3.502 -3.068 -4.596 1.00 . A A . 36 VAL CA 1 1 5 3495 1 1 36 VAL CB C 3.119 -2.892 -3.091 1.00 . A A . 36 VAL CB 1 1 5 3496 1 1 36 VAL CG1 C 3.764 -3.929 -2.185 1.00 . A A . 36 VAL CG1 1 1 5 3497 1 1 36 VAL CG2 C 3.478 -1.529 -2.628 1.00 . A A . 36 VAL CG2 1 1 5 3498 1 1 36 VAL H H 1.744 -2.274 -5.262 1.00 . A A . 36 VAL H 1 1 5 3499 1 1 36 VAL HA H 4.561 -2.864 -4.720 1.00 . A A . 36 VAL HA 1 1 5 3500 1 1 36 VAL HB H 2.052 -2.994 -3.011 1.00 . A A . 36 VAL HB 1 1 5 3501 1 1 36 VAL HG11 H 3.476 -3.720 -1.165 1.00 . A A . 36 VAL HG11 1 1 5 3502 1 1 36 VAL HG12 H 4.840 -3.911 -2.297 1.00 . A A . 36 VAL HG12 1 1 5 3503 1 1 36 VAL HG13 H 3.417 -4.917 -2.450 1.00 . A A . 36 VAL HG13 1 1 5 3504 1 1 36 VAL HG21 H 3.238 -1.410 -1.583 1.00 . A A . 36 VAL HG21 1 1 5 3505 1 1 36 VAL HG22 H 2.916 -0.815 -3.206 1.00 . A A . 36 VAL HG22 1 1 5 3506 1 1 36 VAL HG23 H 4.535 -1.365 -2.781 1.00 . A A . 36 VAL HG23 1 1 5 3507 1 1 36 VAL N N 2.706 -2.148 -5.426 1.00 . A A . 36 VAL N 1 1 5 3508 1 1 36 VAL O O 1.949 -4.724 -5.347 1.00 . A A . 36 VAL O 1 1 5 3509 1 1 37 SER C C 3.459 -7.565 -3.951 1.00 . A A . 37 SER C 1 1 5 3510 1 1 37 SER CA C 3.689 -6.787 -5.261 1.00 . A A . 37 SER CA 1 1 5 3511 1 1 37 SER CB C 4.829 -7.397 -6.083 1.00 . A A . 37 SER CB 1 1 5 3512 1 1 37 SER H H 4.964 -5.351 -4.688 1.00 . A A . 37 SER H 1 1 5 3513 1 1 37 SER HA H 2.777 -6.809 -5.842 1.00 . A A . 37 SER HA 1 1 5 3514 1 1 37 SER HB2 H 4.646 -8.451 -6.210 1.00 . A A . 37 SER HB2 1 1 5 3515 1 1 37 SER HB3 H 4.889 -6.911 -7.044 1.00 . A A . 37 SER HB3 1 1 5 3516 1 1 37 SER HG H 6.756 -7.601 -5.989 1.00 . A A . 37 SER HG 1 1 5 3517 1 1 37 SER N N 4.020 -5.425 -4.950 1.00 . A A . 37 SER N 1 1 5 3518 1 1 37 SER O O 3.987 -7.179 -2.916 1.00 . A A . 37 SER O 1 1 5 3519 1 1 37 SER OG O 6.076 -7.229 -5.421 1.00 . A A . 37 SER OG 1 1 5 3520 1 1 38 PRO C C 3.639 -9.970 -2.036 1.00 . A A . 38 PRO C 1 1 5 3521 1 1 38 PRO CA C 2.375 -9.479 -2.761 1.00 . A A . 38 PRO CA 1 1 5 3522 1 1 38 PRO CB C 1.585 -10.667 -3.306 1.00 . A A . 38 PRO CB 1 1 5 3523 1 1 38 PRO CD C 2.001 -9.224 -5.154 1.00 . A A . 38 PRO CD 1 1 5 3524 1 1 38 PRO CG C 1.842 -10.660 -4.774 1.00 . A A . 38 PRO CG 1 1 5 3525 1 1 38 PRO HA H 1.759 -8.916 -2.068 1.00 . A A . 38 PRO HA 1 1 5 3526 1 1 38 PRO HB2 H 1.950 -11.582 -2.862 1.00 . A A . 38 PRO HB2 1 1 5 3527 1 1 38 PRO HB3 H 0.536 -10.528 -3.099 1.00 . A A . 38 PRO HB3 1 1 5 3528 1 1 38 PRO HD2 H 2.619 -9.108 -6.035 1.00 . A A . 38 PRO HD2 1 1 5 3529 1 1 38 PRO HD3 H 1.040 -8.754 -5.297 1.00 . A A . 38 PRO HD3 1 1 5 3530 1 1 38 PRO HG2 H 2.760 -11.191 -4.966 1.00 . A A . 38 PRO HG2 1 1 5 3531 1 1 38 PRO HG3 H 1.021 -11.116 -5.304 1.00 . A A . 38 PRO HG3 1 1 5 3532 1 1 38 PRO N N 2.673 -8.674 -3.974 1.00 . A A . 38 PRO N 1 1 5 3533 1 1 38 PRO O O 3.650 -10.084 -0.817 1.00 . A A . 38 PRO O 1 1 5 3534 1 1 39 GLU C C 6.628 -9.534 -1.469 1.00 . A A . 39 GLU C 1 1 5 3535 1 1 39 GLU CA C 5.944 -10.670 -2.215 1.00 . A A . 39 GLU CA 1 1 5 3536 1 1 39 GLU CB C 6.878 -11.162 -3.300 1.00 . A A . 39 GLU CB 1 1 5 3537 1 1 39 GLU CD C 7.528 -12.843 -5.012 1.00 . A A . 39 GLU CD 1 1 5 3538 1 1 39 GLU CG C 6.485 -12.440 -3.985 1.00 . A A . 39 GLU CG 1 1 5 3539 1 1 39 GLU H H 4.735 -10.113 -3.757 1.00 . A A . 39 GLU H 1 1 5 3540 1 1 39 GLU HA H 5.737 -11.485 -1.537 1.00 . A A . 39 GLU HA 1 1 5 3541 1 1 39 GLU HB2 H 6.944 -10.400 -4.063 1.00 . A A . 39 GLU HB2 1 1 5 3542 1 1 39 GLU HB3 H 7.837 -11.298 -2.843 1.00 . A A . 39 GLU HB3 1 1 5 3543 1 1 39 GLU HG2 H 6.383 -13.212 -3.237 1.00 . A A . 39 GLU HG2 1 1 5 3544 1 1 39 GLU HG3 H 5.538 -12.292 -4.482 1.00 . A A . 39 GLU HG3 1 1 5 3545 1 1 39 GLU N N 4.710 -10.230 -2.789 1.00 . A A . 39 GLU N 1 1 5 3546 1 1 39 GLU O O 7.343 -9.756 -0.512 1.00 . A A . 39 GLU O 1 1 5 3547 1 1 39 GLU OE1 O 8.628 -13.280 -4.616 1.00 . A A . 39 GLU OE1 1 1 5 3548 1 1 39 GLU OE2 O 7.253 -12.713 -6.217 1.00 . A A . 39 GLU OE2 1 1 5 3549 1 1 40 MET C C 6.484 -6.892 0.029 1.00 . A A . 40 MET C 1 1 5 3550 1 1 40 MET CA C 7.014 -7.142 -1.366 1.00 . A A . 40 MET CA 1 1 5 3551 1 1 40 MET CB C 6.702 -5.964 -2.283 1.00 . A A . 40 MET CB 1 1 5 3552 1 1 40 MET CE C 7.648 -1.942 -2.717 1.00 . A A . 40 MET CE 1 1 5 3553 1 1 40 MET CG C 7.357 -4.627 -1.978 1.00 . A A . 40 MET CG 1 1 5 3554 1 1 40 MET H H 5.715 -8.197 -2.625 1.00 . A A . 40 MET H 1 1 5 3555 1 1 40 MET HA H 8.084 -7.296 -1.326 1.00 . A A . 40 MET HA 1 1 5 3556 1 1 40 MET HB2 H 6.897 -6.196 -3.316 1.00 . A A . 40 MET HB2 1 1 5 3557 1 1 40 MET HB3 H 5.634 -5.813 -2.213 1.00 . A A . 40 MET HB3 1 1 5 3558 1 1 40 MET HE1 H 8.725 -2.027 -2.769 1.00 . A A . 40 MET HE1 1 1 5 3559 1 1 40 MET HE2 H 7.307 -1.715 -1.719 1.00 . A A . 40 MET HE2 1 1 5 3560 1 1 40 MET HE3 H 7.275 -1.182 -3.387 1.00 . A A . 40 MET HE3 1 1 5 3561 1 1 40 MET HG2 H 7.075 -4.266 -0.992 1.00 . A A . 40 MET HG2 1 1 5 3562 1 1 40 MET HG3 H 8.433 -4.741 -2.024 1.00 . A A . 40 MET HG3 1 1 5 3563 1 1 40 MET N N 6.379 -8.326 -1.913 1.00 . A A . 40 MET N 1 1 5 3564 1 1 40 MET O O 7.242 -6.668 0.942 1.00 . A A . 40 MET O 1 1 5 3565 1 1 40 MET SD S 6.886 -3.440 -3.270 1.00 . A A . 40 MET SD 1 1 5 3566 1 1 41 ALA C C 4.957 -7.698 2.551 1.00 . A A . 41 ALA C 1 1 5 3567 1 1 41 ALA CA C 4.500 -6.729 1.448 1.00 . A A . 41 ALA CA 1 1 5 3568 1 1 41 ALA CB C 3.004 -6.830 1.247 1.00 . A A . 41 ALA CB 1 1 5 3569 1 1 41 ALA H H 4.605 -7.147 -0.598 1.00 . A A . 41 ALA H 1 1 5 3570 1 1 41 ALA HA H 4.723 -5.722 1.779 1.00 . A A . 41 ALA HA 1 1 5 3571 1 1 41 ALA HB1 H 2.715 -6.133 0.472 1.00 . A A . 41 ALA HB1 1 1 5 3572 1 1 41 ALA HB2 H 2.485 -6.587 2.161 1.00 . A A . 41 ALA HB2 1 1 5 3573 1 1 41 ALA HB3 H 2.748 -7.834 0.928 1.00 . A A . 41 ALA HB3 1 1 5 3574 1 1 41 ALA N N 5.176 -6.958 0.176 1.00 . A A . 41 ALA N 1 1 5 3575 1 1 41 ALA O O 5.218 -7.289 3.680 1.00 . A A . 41 ALA O 1 1 5 3576 1 1 42 GLU C C 6.923 -10.162 3.382 1.00 . A A . 42 GLU C 1 1 5 3577 1 1 42 GLU CA C 5.414 -9.979 3.207 1.00 . A A . 42 GLU CA 1 1 5 3578 1 1 42 GLU CB C 4.744 -11.327 2.914 1.00 . A A . 42 GLU CB 1 1 5 3579 1 1 42 GLU CD C 2.602 -12.645 2.751 1.00 . A A . 42 GLU CD 1 1 5 3580 1 1 42 GLU CG C 3.226 -11.284 2.972 1.00 . A A . 42 GLU CG 1 1 5 3581 1 1 42 GLU H H 4.821 -9.153 1.280 1.00 . A A . 42 GLU H 1 1 5 3582 1 1 42 GLU HA H 5.030 -9.622 4.151 1.00 . A A . 42 GLU HA 1 1 5 3583 1 1 42 GLU HB2 H 5.026 -11.657 1.924 1.00 . A A . 42 GLU HB2 1 1 5 3584 1 1 42 GLU HB3 H 5.084 -12.058 3.633 1.00 . A A . 42 GLU HB3 1 1 5 3585 1 1 42 GLU HG2 H 2.929 -10.902 3.938 1.00 . A A . 42 GLU HG2 1 1 5 3586 1 1 42 GLU HG3 H 2.879 -10.606 2.207 1.00 . A A . 42 GLU HG3 1 1 5 3587 1 1 42 GLU N N 5.050 -8.964 2.212 1.00 . A A . 42 GLU N 1 1 5 3588 1 1 42 GLU O O 7.365 -10.769 4.355 1.00 . A A . 42 GLU O 1 1 5 3589 1 1 42 GLU OE1 O 2.424 -13.395 3.732 1.00 . A A . 42 GLU OE1 1 1 5 3590 1 1 42 GLU OE2 O 2.268 -12.984 1.595 1.00 . A A . 42 GLU OE2 1 1 5 3591 1 1 43 ASN C C 10.008 -8.659 2.672 1.00 . A A . 43 ASN C 1 1 5 3592 1 1 43 ASN CA C 9.143 -9.899 2.527 1.00 . A A . 43 ASN CA 1 1 5 3593 1 1 43 ASN CB C 9.596 -10.710 1.317 1.00 . A A . 43 ASN CB 1 1 5 3594 1 1 43 ASN CG C 9.097 -12.145 1.330 1.00 . A A . 43 ASN CG 1 1 5 3595 1 1 43 ASN H H 7.350 -9.131 1.723 1.00 . A A . 43 ASN H 1 1 5 3596 1 1 43 ASN HA H 9.317 -10.515 3.396 1.00 . A A . 43 ASN HA 1 1 5 3597 1 1 43 ASN HB2 H 9.197 -10.230 0.436 1.00 . A A . 43 ASN HB2 1 1 5 3598 1 1 43 ASN HB3 H 10.670 -10.701 1.257 1.00 . A A . 43 ASN HB3 1 1 5 3599 1 1 43 ASN HD21 H 8.953 -12.159 -0.650 1.00 . A A . 43 ASN HD21 1 1 5 3600 1 1 43 ASN HD22 H 8.503 -13.621 0.161 1.00 . A A . 43 ASN HD22 1 1 5 3601 1 1 43 ASN N N 7.712 -9.651 2.467 1.00 . A A . 43 ASN N 1 1 5 3602 1 1 43 ASN ND2 N 8.823 -12.694 0.159 1.00 . A A . 43 ASN ND2 1 1 5 3603 1 1 43 ASN O O 11.046 -8.707 3.341 1.00 . A A . 43 ASN O 1 1 5 3604 1 1 43 ASN OD1 O 8.931 -12.750 2.380 1.00 . A A . 43 ASN OD1 1 1 5 3605 1 1 44 GLU C C 9.881 -5.143 2.640 1.00 . A A . 44 GLU C 1 1 5 3606 1 1 44 GLU CA C 10.502 -6.410 2.060 1.00 . A A . 44 GLU CA 1 1 5 3607 1 1 44 GLU CB C 11.107 -6.181 0.655 1.00 . A A . 44 GLU CB 1 1 5 3608 1 1 44 GLU CD C 12.623 -7.165 -1.171 1.00 . A A . 44 GLU CD 1 1 5 3609 1 1 44 GLU CG C 11.906 -7.385 0.150 1.00 . A A . 44 GLU CG 1 1 5 3610 1 1 44 GLU H H 8.719 -7.459 1.696 1.00 . A A . 44 GLU H 1 1 5 3611 1 1 44 GLU HA H 11.314 -6.671 2.721 1.00 . A A . 44 GLU HA 1 1 5 3612 1 1 44 GLU HB2 H 10.327 -5.958 -0.059 1.00 . A A . 44 GLU HB2 1 1 5 3613 1 1 44 GLU HB3 H 11.782 -5.342 0.722 1.00 . A A . 44 GLU HB3 1 1 5 3614 1 1 44 GLU HG2 H 12.647 -7.611 0.902 1.00 . A A . 44 GLU HG2 1 1 5 3615 1 1 44 GLU HG3 H 11.237 -8.226 0.053 1.00 . A A . 44 GLU HG3 1 1 5 3616 1 1 44 GLU N N 9.617 -7.552 2.082 1.00 . A A . 44 GLU N 1 1 5 3617 1 1 44 GLU O O 8.659 -4.993 2.719 1.00 . A A . 44 GLU O 1 1 5 3618 1 1 44 GLU OE1 O 11.970 -7.103 -2.208 1.00 . A A . 44 GLU OE1 1 1 5 3619 1 1 44 GLU OE2 O 13.882 -7.072 -1.165 1.00 . A A . 44 GLU OE2 1 1 5 3620 1 1 45 ASP C C 9.775 -2.009 2.696 1.00 . A A . 45 ASP C 1 1 5 3621 1 1 45 ASP CA C 10.403 -3.004 3.681 1.00 . A A . 45 ASP CA 1 1 5 3622 1 1 45 ASP CB C 11.699 -2.458 4.316 1.00 . A A . 45 ASP CB 1 1 5 3623 1 1 45 ASP CG C 11.604 -1.097 4.927 1.00 . A A . 45 ASP CG 1 1 5 3624 1 1 45 ASP H H 11.699 -4.441 2.893 1.00 . A A . 45 ASP H 1 1 5 3625 1 1 45 ASP HA H 9.705 -3.210 4.477 1.00 . A A . 45 ASP HA 1 1 5 3626 1 1 45 ASP HB2 H 12.002 -3.131 5.104 1.00 . A A . 45 ASP HB2 1 1 5 3627 1 1 45 ASP HB3 H 12.484 -2.446 3.575 1.00 . A A . 45 ASP HB3 1 1 5 3628 1 1 45 ASP N N 10.751 -4.256 3.034 1.00 . A A . 45 ASP N 1 1 5 3629 1 1 45 ASP O O 10.417 -1.572 1.721 1.00 . A A . 45 ASP O 1 1 5 3630 1 1 45 ASP OD1 O 10.840 -0.925 5.863 1.00 . A A . 45 ASP OD1 1 1 5 3631 1 1 45 ASP OD2 O 12.381 -0.209 4.497 1.00 . A A . 45 ASP OD2 1 1 5 3632 1 1 46 TYR C C 8.067 0.697 2.509 1.00 . A A . 46 TYR C 1 1 5 3633 1 1 46 TYR CA C 7.784 -0.755 2.127 1.00 . A A . 46 TYR CA 1 1 5 3634 1 1 46 TYR CB C 6.245 -1.040 2.080 1.00 . A A . 46 TYR CB 1 1 5 3635 1 1 46 TYR CD1 C 5.333 0.052 -0.044 1.00 . A A . 46 TYR CD1 1 1 5 3636 1 1 46 TYR CD2 C 4.907 1.102 2.037 1.00 . A A . 46 TYR CD2 1 1 5 3637 1 1 46 TYR CE1 C 4.666 1.086 -0.689 1.00 . A A . 46 TYR CE1 1 1 5 3638 1 1 46 TYR CE2 C 4.244 2.109 1.397 1.00 . A A . 46 TYR CE2 1 1 5 3639 1 1 46 TYR CG C 5.470 0.052 1.343 1.00 . A A . 46 TYR CG 1 1 5 3640 1 1 46 TYR CZ C 4.131 2.097 0.047 1.00 . A A . 46 TYR CZ 1 1 5 3641 1 1 46 TYR H H 8.049 -2.199 3.640 1.00 . A A . 46 TYR H 1 1 5 3642 1 1 46 TYR HA H 8.163 -0.881 1.126 1.00 . A A . 46 TYR HA 1 1 5 3643 1 1 46 TYR HB2 H 6.056 -1.964 1.555 1.00 . A A . 46 TYR HB2 1 1 5 3644 1 1 46 TYR HB3 H 5.849 -1.102 3.085 1.00 . A A . 46 TYR HB3 1 1 5 3645 1 1 46 TYR HD1 H 5.756 -0.751 -0.624 1.00 . A A . 46 TYR HD1 1 1 5 3646 1 1 46 TYR HD2 H 4.993 1.116 3.114 1.00 . A A . 46 TYR HD2 1 1 5 3647 1 1 46 TYR HE1 H 4.530 1.115 -1.763 1.00 . A A . 46 TYR HE1 1 1 5 3648 1 1 46 TYR HE2 H 3.802 2.922 1.947 1.00 . A A . 46 TYR HE2 1 1 5 3649 1 1 46 TYR HH H 2.870 2.749 -1.196 1.00 . A A . 46 TYR HH 1 1 5 3650 1 1 46 TYR N N 8.506 -1.707 2.925 1.00 . A A . 46 TYR N 1 1 5 3651 1 1 46 TYR O O 7.684 1.183 3.581 1.00 . A A . 46 TYR O 1 1 5 3652 1 1 46 TYR OH O 3.504 3.117 -0.579 1.00 . A A . 46 TYR OH 1 1 5 3653 1 1 47 ILE C C 8.166 3.449 0.592 1.00 . A A . 47 ILE C 1 1 5 3654 1 1 47 ILE CA C 8.976 2.768 1.705 1.00 . A A . 47 ILE CA 1 1 5 3655 1 1 47 ILE CB C 10.496 3.042 1.562 1.00 . A A . 47 ILE CB 1 1 5 3656 1 1 47 ILE CD1 C 10.915 2.715 4.088 1.00 . A A . 47 ILE CD1 1 1 5 3657 1 1 47 ILE CG1 C 11.286 2.306 2.667 1.00 . A A . 47 ILE CG1 1 1 5 3658 1 1 47 ILE CG2 C 10.792 4.512 1.628 1.00 . A A . 47 ILE CG2 1 1 5 3659 1 1 47 ILE H H 8.991 0.788 0.867 1.00 . A A . 47 ILE H 1 1 5 3660 1 1 47 ILE HA H 8.622 3.108 2.668 1.00 . A A . 47 ILE HA 1 1 5 3661 1 1 47 ILE HB H 10.823 2.665 0.608 1.00 . A A . 47 ILE HB 1 1 5 3662 1 1 47 ILE HD11 H 11.091 3.773 4.213 1.00 . A A . 47 ILE HD11 1 1 5 3663 1 1 47 ILE HD12 H 11.516 2.159 4.793 1.00 . A A . 47 ILE HD12 1 1 5 3664 1 1 47 ILE HD13 H 9.872 2.500 4.262 1.00 . A A . 47 ILE HD13 1 1 5 3665 1 1 47 ILE HG12 H 11.111 1.245 2.592 1.00 . A A . 47 ILE HG12 1 1 5 3666 1 1 47 ILE HG13 H 12.337 2.512 2.529 1.00 . A A . 47 ILE HG13 1 1 5 3667 1 1 47 ILE HG21 H 11.850 4.683 1.482 1.00 . A A . 47 ILE HG21 1 1 5 3668 1 1 47 ILE HG22 H 10.507 4.863 2.614 1.00 . A A . 47 ILE HG22 1 1 5 3669 1 1 47 ILE HG23 H 10.218 5.025 0.870 1.00 . A A . 47 ILE HG23 1 1 5 3670 1 1 47 ILE N N 8.713 1.363 1.607 1.00 . A A . 47 ILE N 1 1 5 3671 1 1 47 ILE O O 8.062 2.905 -0.495 1.00 . A A . 47 ILE O 1 1 5 3672 1 1 48 CYS C C 7.482 6.267 -0.934 1.00 . A A . 48 CYS C 1 1 5 3673 1 1 48 CYS CA C 6.694 5.239 -0.150 1.00 . A A . 48 CYS CA 1 1 5 3674 1 1 48 CYS CB C 5.518 5.974 0.506 1.00 . A A . 48 CYS CB 1 1 5 3675 1 1 48 CYS H H 7.729 5.147 1.656 1.00 . A A . 48 CYS H 1 1 5 3676 1 1 48 CYS HA H 6.322 4.487 -0.829 1.00 . A A . 48 CYS HA 1 1 5 3677 1 1 48 CYS HB2 H 4.786 6.180 -0.265 1.00 . A A . 48 CYS HB2 1 1 5 3678 1 1 48 CYS HB3 H 5.071 5.361 1.271 1.00 . A A . 48 CYS HB3 1 1 5 3679 1 1 48 CYS N N 7.575 4.619 0.853 1.00 . A A . 48 CYS N 1 1 5 3680 1 1 48 CYS O O 8.623 6.540 -0.603 1.00 . A A . 48 CYS O 1 1 5 3681 1 1 48 CYS SG S 5.977 7.582 1.229 1.00 . A A . 48 CYS SG 1 1 5 3682 1 1 49 ILE C C 7.969 9.094 -1.924 1.00 . A A . 49 ILE C 1 1 5 3683 1 1 49 ILE CA C 7.415 7.908 -2.758 1.00 . A A . 49 ILE CA 1 1 5 3684 1 1 49 ILE CB C 6.397 8.400 -3.817 1.00 . A A . 49 ILE CB 1 1 5 3685 1 1 49 ILE CD1 C 6.162 9.889 -5.842 1.00 . A A . 49 ILE CD1 1 1 5 3686 1 1 49 ILE CG1 C 7.037 9.455 -4.700 1.00 . A A . 49 ILE CG1 1 1 5 3687 1 1 49 ILE CG2 C 5.105 8.922 -3.173 1.00 . A A . 49 ILE CG2 1 1 5 3688 1 1 49 ILE H H 5.938 6.526 -2.126 1.00 . A A . 49 ILE H 1 1 5 3689 1 1 49 ILE HA H 8.250 7.479 -3.291 1.00 . A A . 49 ILE HA 1 1 5 3690 1 1 49 ILE HB H 6.133 7.554 -4.435 1.00 . A A . 49 ILE HB 1 1 5 3691 1 1 49 ILE HD11 H 5.982 9.012 -6.445 1.00 . A A . 49 ILE HD11 1 1 5 3692 1 1 49 ILE HD12 H 6.662 10.643 -6.427 1.00 . A A . 49 ILE HD12 1 1 5 3693 1 1 49 ILE HD13 H 5.231 10.266 -5.444 1.00 . A A . 49 ILE HD13 1 1 5 3694 1 1 49 ILE HG12 H 7.237 10.301 -4.062 1.00 . A A . 49 ILE HG12 1 1 5 3695 1 1 49 ILE HG13 H 7.965 9.056 -5.083 1.00 . A A . 49 ILE HG13 1 1 5 3696 1 1 49 ILE HG21 H 5.345 9.737 -2.506 1.00 . A A . 49 ILE HG21 1 1 5 3697 1 1 49 ILE HG22 H 4.624 8.129 -2.618 1.00 . A A . 49 ILE HG22 1 1 5 3698 1 1 49 ILE HG23 H 4.443 9.275 -3.950 1.00 . A A . 49 ILE HG23 1 1 5 3699 1 1 49 ILE N N 6.839 6.864 -1.933 1.00 . A A . 49 ILE N 1 1 5 3700 1 1 49 ILE O O 9.030 9.628 -2.222 1.00 . A A . 49 ILE O 1 1 5 3701 1 1 50 ASN C C 8.777 10.169 0.945 1.00 . A A . 50 ASN C 1 1 5 3702 1 1 50 ASN CA C 7.684 10.576 -0.016 1.00 . A A . 50 ASN CA 1 1 5 3703 1 1 50 ASN CB C 6.500 11.189 0.739 1.00 . A A . 50 ASN CB 1 1 5 3704 1 1 50 ASN CG C 5.497 11.857 -0.185 1.00 . A A . 50 ASN CG 1 1 5 3705 1 1 50 ASN H H 6.491 8.905 -0.640 1.00 . A A . 50 ASN H 1 1 5 3706 1 1 50 ASN HA H 8.093 11.324 -0.681 1.00 . A A . 50 ASN HA 1 1 5 3707 1 1 50 ASN HB2 H 5.986 10.415 1.293 1.00 . A A . 50 ASN HB2 1 1 5 3708 1 1 50 ASN HB3 H 6.881 11.925 1.427 1.00 . A A . 50 ASN HB3 1 1 5 3709 1 1 50 ASN HD21 H 6.462 13.593 -0.047 1.00 . A A . 50 ASN HD21 1 1 5 3710 1 1 50 ASN HD22 H 5.051 13.572 -1.055 1.00 . A A . 50 ASN HD22 1 1 5 3711 1 1 50 ASN N N 7.276 9.448 -0.862 1.00 . A A . 50 ASN N 1 1 5 3712 1 1 50 ASN ND2 N 5.691 13.140 -0.450 1.00 . A A . 50 ASN ND2 1 1 5 3713 1 1 50 ASN O O 9.617 10.971 1.317 1.00 . A A . 50 ASN O 1 1 5 3714 1 1 50 ASN OD1 O 4.558 11.231 -0.652 1.00 . A A . 50 ASN OD1 1 1 5 3715 1 1 51 CYS C C 11.081 8.078 1.408 1.00 . A A . 51 CYS C 1 1 5 3716 1 1 51 CYS CA C 9.806 8.392 2.209 1.00 . A A . 51 CYS CA 1 1 5 3717 1 1 51 CYS CB C 9.332 7.146 2.987 1.00 . A A . 51 CYS CB 1 1 5 3718 1 1 51 CYS H H 8.043 8.331 1.038 1.00 . A A . 51 CYS H 1 1 5 3719 1 1 51 CYS HA H 10.023 9.179 2.914 1.00 . A A . 51 CYS HA 1 1 5 3720 1 1 51 CYS HB2 H 8.878 6.443 2.301 1.00 . A A . 51 CYS HB2 1 1 5 3721 1 1 51 CYS HB3 H 10.210 6.706 3.440 1.00 . A A . 51 CYS HB3 1 1 5 3722 1 1 51 CYS N N 8.765 8.917 1.349 1.00 . A A . 51 CYS N 1 1 5 3723 1 1 51 CYS O O 12.191 8.134 1.928 1.00 . A A . 51 CYS O 1 1 5 3724 1 1 51 CYS SG S 8.107 7.424 4.306 1.00 . A A . 51 CYS SG 1 1 5 3725 1 1 52 ALA C C 12.461 8.578 -1.634 1.00 . A A . 52 ALA C 1 1 5 3726 1 1 52 ALA CA C 12.022 7.400 -0.743 1.00 . A A . 52 ALA CA 1 1 5 3727 1 1 52 ALA CB C 11.641 6.193 -1.594 1.00 . A A . 52 ALA CB 1 1 5 3728 1 1 52 ALA H H 9.989 7.821 -0.208 1.00 . A A . 52 ALA H 1 1 5 3729 1 1 52 ALA HA H 12.842 7.119 -0.103 1.00 . A A . 52 ALA HA 1 1 5 3730 1 1 52 ALA HB1 H 11.331 5.381 -0.952 1.00 . A A . 52 ALA HB1 1 1 5 3731 1 1 52 ALA HB2 H 12.489 5.885 -2.186 1.00 . A A . 52 ALA HB2 1 1 5 3732 1 1 52 ALA HB3 H 10.829 6.463 -2.254 1.00 . A A . 52 ALA HB3 1 1 5 3733 1 1 52 ALA N N 10.908 7.771 0.140 1.00 . A A . 52 ALA N 1 1 5 3734 2 2 1 ZN ZN ZN 5.977 7.578 3.503 1.00 . B A . 53 ZN ZN 1 1 5 3735 3 2 1 ZN ZN ZN -5.363 2.875 -1.871 1.00 . C A . 54 ZN ZN 1 1 6 3736 1 1 1 SER C C -11.190 5.823 2.061 1.00 . A A . 1 SER C 1 1 6 3737 1 1 1 SER CA C -12.198 5.884 3.230 1.00 . A A . 1 SER CA 1 1 6 3738 1 1 1 SER CB C -13.381 6.819 2.892 1.00 . A A . 1 SER CB 1 1 6 3739 1 1 1 SER HA H -12.566 4.889 3.427 1.00 . A A . 1 SER HA 1 1 6 3740 1 1 1 SER HB2 H -14.069 6.842 3.725 1.00 . A A . 1 SER HB2 1 1 6 3741 1 1 1 SER HB3 H -12.996 7.810 2.698 1.00 . A A . 1 SER HB3 1 1 6 3742 1 1 1 SER HG H -14.337 5.451 1.865 1.00 . A A . 1 SER HG 1 1 6 3743 1 1 1 SER N N -11.518 6.350 4.467 1.00 . A A . 1 SER N 1 1 6 3744 1 1 1 SER O O -10.976 4.763 1.446 1.00 . A A . 1 SER O 1 1 6 3745 1 1 1 SER OG O -14.114 6.379 1.742 1.00 . A A . 1 SER OG 1 1 6 3746 1 1 2 VAL C C -8.207 6.870 1.369 1.00 . A A . 2 VAL C 1 1 6 3747 1 1 2 VAL CA C -9.567 6.994 0.722 1.00 . A A . 2 VAL CA 1 1 6 3748 1 1 2 VAL CB C -9.650 8.331 -0.064 1.00 . A A . 2 VAL CB 1 1 6 3749 1 1 2 VAL CG1 C -8.649 8.360 -1.229 1.00 . A A . 2 VAL CG1 1 1 6 3750 1 1 2 VAL CG2 C -11.080 8.592 -0.555 1.00 . A A . 2 VAL CG2 1 1 6 3751 1 1 2 VAL H H -10.710 7.743 2.315 1.00 . A A . 2 VAL H 1 1 6 3752 1 1 2 VAL HA H -9.744 6.160 0.056 1.00 . A A . 2 VAL HA 1 1 6 3753 1 1 2 VAL HB H -9.374 9.117 0.618 1.00 . A A . 2 VAL HB 1 1 6 3754 1 1 2 VAL HG11 H -8.880 7.567 -1.924 1.00 . A A . 2 VAL HG11 1 1 6 3755 1 1 2 VAL HG12 H -7.644 8.217 -0.850 1.00 . A A . 2 VAL HG12 1 1 6 3756 1 1 2 VAL HG13 H -8.691 9.310 -1.738 1.00 . A A . 2 VAL HG13 1 1 6 3757 1 1 2 VAL HG21 H -11.755 8.633 0.290 1.00 . A A . 2 VAL HG21 1 1 6 3758 1 1 2 VAL HG22 H -11.386 7.794 -1.211 1.00 . A A . 2 VAL HG22 1 1 6 3759 1 1 2 VAL HG23 H -11.126 9.536 -1.079 1.00 . A A . 2 VAL HG23 1 1 6 3760 1 1 2 VAL N N -10.545 6.938 1.780 1.00 . A A . 2 VAL N 1 1 6 3761 1 1 2 VAL O O -7.941 7.532 2.373 1.00 . A A . 2 VAL O 1 1 6 3762 1 1 3 CYS C C -5.029 6.764 0.875 1.00 . A A . 3 CYS C 1 1 6 3763 1 1 3 CYS CA C -6.085 5.776 1.439 1.00 . A A . 3 CYS CA 1 1 6 3764 1 1 3 CYS CB C -5.663 4.286 1.229 1.00 . A A . 3 CYS CB 1 1 6 3765 1 1 3 CYS H H -7.613 5.571 0.002 1.00 . A A . 3 CYS H 1 1 6 3766 1 1 3 CYS HA H -6.183 5.961 2.500 1.00 . A A . 3 CYS HA 1 1 6 3767 1 1 3 CYS HB2 H -5.250 3.904 2.151 1.00 . A A . 3 CYS HB2 1 1 6 3768 1 1 3 CYS HB3 H -6.539 3.708 0.977 1.00 . A A . 3 CYS HB3 1 1 6 3769 1 1 3 CYS N N -7.367 6.023 0.830 1.00 . A A . 3 CYS N 1 1 6 3770 1 1 3 CYS O O -5.349 7.647 0.055 1.00 . A A . 3 CYS O 1 1 6 3771 1 1 3 CYS SG S -4.416 3.980 -0.058 1.00 . A A . 3 CYS SG 1 1 6 3772 1 1 4 ALA C C -2.050 6.715 -0.346 1.00 . A A . 4 ALA C 1 1 6 3773 1 1 4 ALA CA C -2.713 7.428 0.829 1.00 . A A . 4 ALA CA 1 1 6 3774 1 1 4 ALA CB C -1.686 7.664 1.963 1.00 . A A . 4 ALA CB 1 1 6 3775 1 1 4 ALA H H -3.614 5.831 1.874 1.00 . A A . 4 ALA H 1 1 6 3776 1 1 4 ALA HA H -3.116 8.375 0.508 1.00 . A A . 4 ALA HA 1 1 6 3777 1 1 4 ALA HB1 H -1.277 6.732 2.325 1.00 . A A . 4 ALA HB1 1 1 6 3778 1 1 4 ALA HB2 H -2.148 8.174 2.796 1.00 . A A . 4 ALA HB2 1 1 6 3779 1 1 4 ALA HB3 H -0.874 8.275 1.590 1.00 . A A . 4 ALA HB3 1 1 6 3780 1 1 4 ALA N N -3.794 6.599 1.292 1.00 . A A . 4 ALA N 1 1 6 3781 1 1 4 ALA O O -1.660 5.591 -0.206 1.00 . A A . 4 ALA O 1 1 6 3782 1 1 5 ALA C C -1.412 7.811 -3.834 1.00 . A A . 5 ALA C 1 1 6 3783 1 1 5 ALA CA C -1.317 6.820 -2.702 1.00 . A A . 5 ALA CA 1 1 6 3784 1 1 5 ALA CB C -1.885 5.475 -3.176 1.00 . A A . 5 ALA CB 1 1 6 3785 1 1 5 ALA H H -2.600 8.132 -1.655 1.00 . A A . 5 ALA H 1 1 6 3786 1 1 5 ALA HA H -0.279 6.688 -2.436 1.00 . A A . 5 ALA HA 1 1 6 3787 1 1 5 ALA HB1 H -1.325 5.089 -4.017 1.00 . A A . 5 ALA HB1 1 1 6 3788 1 1 5 ALA HB2 H -2.914 5.590 -3.488 1.00 . A A . 5 ALA HB2 1 1 6 3789 1 1 5 ALA HB3 H -1.849 4.760 -2.368 1.00 . A A . 5 ALA HB3 1 1 6 3790 1 1 5 ALA N N -2.042 7.340 -1.522 1.00 . A A . 5 ALA N 1 1 6 3791 1 1 5 ALA O O -2.390 8.551 -3.907 1.00 . A A . 5 ALA O 1 1 6 3792 1 1 6 GLN C C -1.655 8.493 -6.723 1.00 . A A . 6 GLN C 1 1 6 3793 1 1 6 GLN CA C -0.349 8.687 -5.927 1.00 . A A . 6 GLN CA 1 1 6 3794 1 1 6 GLN CB C 0.798 8.178 -6.822 1.00 . A A . 6 GLN CB 1 1 6 3795 1 1 6 GLN CD C 3.197 7.458 -7.045 1.00 . A A . 6 GLN CD 1 1 6 3796 1 1 6 GLN CG C 2.173 8.179 -6.188 1.00 . A A . 6 GLN CG 1 1 6 3797 1 1 6 GLN H H 0.509 7.493 -4.449 1.00 . A A . 6 GLN H 1 1 6 3798 1 1 6 GLN HA H -0.175 9.723 -5.694 1.00 . A A . 6 GLN HA 1 1 6 3799 1 1 6 GLN HB2 H 0.593 7.151 -7.082 1.00 . A A . 6 GLN HB2 1 1 6 3800 1 1 6 GLN HB3 H 0.835 8.771 -7.722 1.00 . A A . 6 GLN HB3 1 1 6 3801 1 1 6 GLN HE21 H 2.778 5.724 -6.176 1.00 . A A . 6 GLN HE21 1 1 6 3802 1 1 6 GLN HE22 H 3.978 5.687 -7.394 1.00 . A A . 6 GLN HE22 1 1 6 3803 1 1 6 GLN HG2 H 2.492 9.205 -6.070 1.00 . A A . 6 GLN HG2 1 1 6 3804 1 1 6 GLN HG3 H 2.117 7.696 -5.221 1.00 . A A . 6 GLN HG3 1 1 6 3805 1 1 6 GLN N N -0.364 7.858 -4.687 1.00 . A A . 6 GLN N 1 1 6 3806 1 1 6 GLN NE2 N 3.326 6.171 -6.847 1.00 . A A . 6 GLN NE2 1 1 6 3807 1 1 6 GLN O O -2.231 9.448 -7.234 1.00 . A A . 6 GLN O 1 1 6 3808 1 1 6 GLN OE1 O 3.851 8.044 -7.881 1.00 . A A . 6 GLN OE1 1 1 6 3809 1 1 7 ASN C C -3.993 5.835 -6.685 1.00 . A A . 7 ASN C 1 1 6 3810 1 1 7 ASN CA C -3.325 6.934 -7.446 1.00 . A A . 7 ASN CA 1 1 6 3811 1 1 7 ASN CB C -3.140 6.534 -8.915 1.00 . A A . 7 ASN CB 1 1 6 3812 1 1 7 ASN CG C -4.464 6.247 -9.614 1.00 . A A . 7 ASN CG 1 1 6 3813 1 1 7 ASN H H -1.410 6.686 -6.398 1.00 . A A . 7 ASN H 1 1 6 3814 1 1 7 ASN HA H -3.954 7.813 -7.401 1.00 . A A . 7 ASN HA 1 1 6 3815 1 1 7 ASN HB2 H -2.649 7.328 -9.457 1.00 . A A . 7 ASN HB2 1 1 6 3816 1 1 7 ASN HB3 H -2.542 5.633 -8.961 1.00 . A A . 7 ASN HB3 1 1 6 3817 1 1 7 ASN HD21 H -3.568 5.062 -10.937 1.00 . A A . 7 ASN HD21 1 1 6 3818 1 1 7 ASN HD22 H -5.259 5.248 -11.126 1.00 . A A . 7 ASN HD22 1 1 6 3819 1 1 7 ASN N N -2.075 7.271 -6.813 1.00 . A A . 7 ASN N 1 1 6 3820 1 1 7 ASN ND2 N -4.425 5.443 -10.648 1.00 . A A . 7 ASN ND2 1 1 6 3821 1 1 7 ASN O O -3.572 4.683 -6.735 1.00 . A A . 7 ASN O 1 1 6 3822 1 1 7 ASN OD1 O -5.508 6.781 -9.248 1.00 . A A . 7 ASN OD1 1 1 6 3823 1 1 8 CYS C C -6.899 4.636 -5.926 1.00 . A A . 8 CYS C 1 1 6 3824 1 1 8 CYS CA C -5.666 5.155 -5.203 1.00 . A A . 8 CYS CA 1 1 6 3825 1 1 8 CYS CB C -6.005 5.573 -3.783 1.00 . A A . 8 CYS CB 1 1 6 3826 1 1 8 CYS H H -5.359 7.078 -5.950 1.00 . A A . 8 CYS H 1 1 6 3827 1 1 8 CYS HA H -4.940 4.361 -5.161 1.00 . A A . 8 CYS HA 1 1 6 3828 1 1 8 CYS HB2 H -5.114 5.861 -3.247 1.00 . A A . 8 CYS HB2 1 1 6 3829 1 1 8 CYS HB3 H -6.695 6.404 -3.808 1.00 . A A . 8 CYS HB3 1 1 6 3830 1 1 8 CYS N N -5.010 6.164 -5.954 1.00 . A A . 8 CYS N 1 1 6 3831 1 1 8 CYS O O -7.903 5.328 -6.033 1.00 . A A . 8 CYS O 1 1 6 3832 1 1 8 CYS SG S -6.813 4.248 -2.852 1.00 . A A . 8 CYS SG 1 1 6 3833 1 1 9 GLN C C -9.064 2.387 -6.169 1.00 . A A . 9 GLN C 1 1 6 3834 1 1 9 GLN CA C -7.877 2.681 -7.106 1.00 . A A . 9 GLN CA 1 1 6 3835 1 1 9 GLN CB C -7.310 1.349 -7.637 1.00 . A A . 9 GLN CB 1 1 6 3836 1 1 9 GLN CD C -5.533 0.178 -9.024 1.00 . A A . 9 GLN CD 1 1 6 3837 1 1 9 GLN CG C -6.088 1.504 -8.542 1.00 . A A . 9 GLN CG 1 1 6 3838 1 1 9 GLN H H -5.952 2.924 -6.286 1.00 . A A . 9 GLN H 1 1 6 3839 1 1 9 GLN HA H -8.201 3.275 -7.948 1.00 . A A . 9 GLN HA 1 1 6 3840 1 1 9 GLN HB2 H -7.013 0.761 -6.782 1.00 . A A . 9 GLN HB2 1 1 6 3841 1 1 9 GLN HB3 H -8.064 0.794 -8.177 1.00 . A A . 9 GLN HB3 1 1 6 3842 1 1 9 GLN HE21 H -3.682 0.913 -9.066 1.00 . A A . 9 GLN HE21 1 1 6 3843 1 1 9 GLN HE22 H -3.853 -0.715 -9.555 1.00 . A A . 9 GLN HE22 1 1 6 3844 1 1 9 GLN HG2 H -6.341 2.089 -9.412 1.00 . A A . 9 GLN HG2 1 1 6 3845 1 1 9 GLN HG3 H -5.312 2.016 -7.997 1.00 . A A . 9 GLN HG3 1 1 6 3846 1 1 9 GLN N N -6.803 3.392 -6.391 1.00 . A A . 9 GLN N 1 1 6 3847 1 1 9 GLN NE2 N -4.239 0.125 -9.231 1.00 . A A . 9 GLN NE2 1 1 6 3848 1 1 9 GLN O O -10.108 1.920 -6.605 1.00 . A A . 9 GLN O 1 1 6 3849 1 1 9 GLN OE1 O -6.268 -0.794 -9.194 1.00 . A A . 9 GLN OE1 1 1 6 3850 1 1 10 ARG C C -10.481 0.958 -3.817 1.00 . A A . 10 ARG C 1 1 6 3851 1 1 10 ARG CA C -9.876 2.399 -3.808 1.00 . A A . 10 ARG CA 1 1 6 3852 1 1 10 ARG CB C -10.965 3.475 -3.878 1.00 . A A . 10 ARG CB 1 1 6 3853 1 1 10 ARG CD C -11.518 5.931 -3.675 1.00 . A A . 10 ARG CD 1 1 6 3854 1 1 10 ARG CG C -10.484 4.849 -3.427 1.00 . A A . 10 ARG CG 1 1 6 3855 1 1 10 ARG CZ C -12.555 7.108 -5.618 1.00 . A A . 10 ARG CZ 1 1 6 3856 1 1 10 ARG H H -8.017 3.081 -4.631 1.00 . A A . 10 ARG H 1 1 6 3857 1 1 10 ARG HA H -9.370 2.505 -2.863 1.00 . A A . 10 ARG HA 1 1 6 3858 1 1 10 ARG HB2 H -11.294 3.557 -4.903 1.00 . A A . 10 ARG HB2 1 1 6 3859 1 1 10 ARG HB3 H -11.785 3.169 -3.244 1.00 . A A . 10 ARG HB3 1 1 6 3860 1 1 10 ARG HD2 H -12.452 5.601 -3.248 1.00 . A A . 10 ARG HD2 1 1 6 3861 1 1 10 ARG HD3 H -11.198 6.843 -3.192 1.00 . A A . 10 ARG HD3 1 1 6 3862 1 1 10 ARG HE H -11.120 5.695 -5.721 1.00 . A A . 10 ARG HE 1 1 6 3863 1 1 10 ARG HG2 H -10.284 4.797 -2.368 1.00 . A A . 10 ARG HG2 1 1 6 3864 1 1 10 ARG HG3 H -9.577 5.089 -3.958 1.00 . A A . 10 ARG HG3 1 1 6 3865 1 1 10 ARG HH11 H -13.488 7.594 -3.844 1.00 . A A . 10 ARG HH11 1 1 6 3866 1 1 10 ARG HH12 H -14.048 8.410 -5.218 1.00 . A A . 10 ARG HH12 1 1 6 3867 1 1 10 ARG HH21 H -11.954 6.882 -7.552 1.00 . A A . 10 ARG HH21 1 1 6 3868 1 1 10 ARG HH22 H -13.180 8.050 -7.291 1.00 . A A . 10 ARG HH22 1 1 6 3869 1 1 10 ARG N N -8.864 2.653 -4.861 1.00 . A A . 10 ARG N 1 1 6 3870 1 1 10 ARG NE N -11.712 6.198 -5.114 1.00 . A A . 10 ARG NE 1 1 6 3871 1 1 10 ARG NH1 N -13.413 7.733 -4.832 1.00 . A A . 10 ARG NH1 1 1 6 3872 1 1 10 ARG NH2 N -12.569 7.350 -6.910 1.00 . A A . 10 ARG NH2 1 1 6 3873 1 1 10 ARG O O -11.673 0.800 -3.611 1.00 . A A . 10 ARG O 1 1 6 3874 1 1 11 PRO C C -10.492 -1.989 -2.599 1.00 . A A . 11 PRO C 1 1 6 3875 1 1 11 PRO CA C -10.136 -1.500 -4.000 1.00 . A A . 11 PRO CA 1 1 6 3876 1 1 11 PRO CB C -8.932 -2.304 -4.549 1.00 . A A . 11 PRO CB 1 1 6 3877 1 1 11 PRO CD C -8.190 -0.109 -4.116 1.00 . A A . 11 PRO CD 1 1 6 3878 1 1 11 PRO CG C -7.953 -1.278 -4.999 1.00 . A A . 11 PRO CG 1 1 6 3879 1 1 11 PRO HA H -10.987 -1.617 -4.653 1.00 . A A . 11 PRO HA 1 1 6 3880 1 1 11 PRO HB2 H -8.525 -2.877 -3.732 1.00 . A A . 11 PRO HB2 1 1 6 3881 1 1 11 PRO HB3 H -9.244 -2.945 -5.362 1.00 . A A . 11 PRO HB3 1 1 6 3882 1 1 11 PRO HD2 H -7.693 -0.262 -3.170 1.00 . A A . 11 PRO HD2 1 1 6 3883 1 1 11 PRO HD3 H -7.857 0.810 -4.576 1.00 . A A . 11 PRO HD3 1 1 6 3884 1 1 11 PRO HG2 H -6.946 -1.651 -4.870 1.00 . A A . 11 PRO HG2 1 1 6 3885 1 1 11 PRO HG3 H -8.133 -1.022 -6.034 1.00 . A A . 11 PRO HG3 1 1 6 3886 1 1 11 PRO N N -9.639 -0.127 -3.971 1.00 . A A . 11 PRO N 1 1 6 3887 1 1 11 PRO O O -9.734 -1.743 -1.625 1.00 . A A . 11 PRO O 1 1 6 3888 1 1 12 CYS C C -12.451 -4.682 -1.460 1.00 . A A . 12 CYS C 1 1 6 3889 1 1 12 CYS CA C -12.071 -3.218 -1.256 1.00 . A A . 12 CYS CA 1 1 6 3890 1 1 12 CYS CB C -13.263 -2.406 -0.721 1.00 . A A . 12 CYS CB 1 1 6 3891 1 1 12 CYS H H -12.176 -2.815 -3.289 1.00 . A A . 12 CYS H 1 1 6 3892 1 1 12 CYS HA H -11.257 -3.155 -0.549 1.00 . A A . 12 CYS HA 1 1 6 3893 1 1 12 CYS HB2 H -12.945 -1.381 -0.608 1.00 . A A . 12 CYS HB2 1 1 6 3894 1 1 12 CYS HB3 H -14.078 -2.439 -1.429 1.00 . A A . 12 CYS HB3 1 1 6 3895 1 1 12 CYS HG H -15.146 -2.486 0.978 1.00 . A A . 12 CYS HG 1 1 6 3896 1 1 12 CYS N N -11.612 -2.670 -2.498 1.00 . A A . 12 CYS N 1 1 6 3897 1 1 12 CYS O O -13.357 -5.000 -2.232 1.00 . A A . 12 CYS O 1 1 6 3898 1 1 12 CYS SG S -13.898 -2.935 0.891 1.00 . A A . 12 CYS SG 1 1 6 3899 1 1 13 LYS C C -11.483 -7.528 0.484 1.00 . A A . 13 LYS C 1 1 6 3900 1 1 13 LYS CA C -11.923 -6.990 -0.854 1.00 . A A . 13 LYS CA 1 1 6 3901 1 1 13 LYS CB C -11.045 -7.659 -1.938 1.00 . A A . 13 LYS CB 1 1 6 3902 1 1 13 LYS CD C -10.309 -7.904 -4.320 1.00 . A A . 13 LYS CD 1 1 6 3903 1 1 13 LYS CE C -10.527 -7.522 -5.781 1.00 . A A . 13 LYS CE 1 1 6 3904 1 1 13 LYS CG C -11.293 -7.216 -3.372 1.00 . A A . 13 LYS CG 1 1 6 3905 1 1 13 LYS H H -10.971 -5.252 -0.253 1.00 . A A . 13 LYS H 1 1 6 3906 1 1 13 LYS HA H -12.967 -7.194 -1.043 1.00 . A A . 13 LYS HA 1 1 6 3907 1 1 13 LYS HB2 H -10.010 -7.450 -1.717 1.00 . A A . 13 LYS HB2 1 1 6 3908 1 1 13 LYS HB3 H -11.194 -8.727 -1.881 1.00 . A A . 13 LYS HB3 1 1 6 3909 1 1 13 LYS HD2 H -9.310 -7.604 -4.042 1.00 . A A . 13 LYS HD2 1 1 6 3910 1 1 13 LYS HD3 H -10.392 -8.975 -4.216 1.00 . A A . 13 LYS HD3 1 1 6 3911 1 1 13 LYS HE2 H -10.491 -6.445 -5.856 1.00 . A A . 13 LYS HE2 1 1 6 3912 1 1 13 LYS HE3 H -9.740 -7.953 -6.382 1.00 . A A . 13 LYS HE3 1 1 6 3913 1 1 13 LYS HG2 H -12.314 -7.455 -3.626 1.00 . A A . 13 LYS HG2 1 1 6 3914 1 1 13 LYS HG3 H -11.160 -6.144 -3.430 1.00 . A A . 13 LYS HG3 1 1 6 3915 1 1 13 LYS HZ1 H -11.928 -7.724 -7.306 1.00 . A A . 13 LYS HZ1 1 1 6 3916 1 1 13 LYS HZ2 H -12.662 -7.560 -5.812 1.00 . A A . 13 LYS HZ2 1 1 6 3917 1 1 13 LYS HZ3 H -11.940 -9.008 -6.265 1.00 . A A . 13 LYS HZ3 1 1 6 3918 1 1 13 LYS N N -11.710 -5.554 -0.820 1.00 . A A . 13 LYS N 1 1 6 3919 1 1 13 LYS NZ N -11.841 -7.975 -6.298 1.00 . A A . 13 LYS NZ 1 1 6 3920 1 1 13 LYS O O -10.835 -6.808 1.233 1.00 . A A . 13 LYS O 1 1 6 3921 1 1 14 ASP C C -9.850 -9.699 1.826 1.00 . A A . 14 ASP C 1 1 6 3922 1 1 14 ASP CA C -11.328 -9.402 1.996 1.00 . A A . 14 ASP CA 1 1 6 3923 1 1 14 ASP CB C -12.042 -10.748 2.264 1.00 . A A . 14 ASP CB 1 1 6 3924 1 1 14 ASP CG C -13.507 -10.643 2.615 1.00 . A A . 14 ASP CG 1 1 6 3925 1 1 14 ASP H H -12.447 -9.240 0.201 1.00 . A A . 14 ASP H 1 1 6 3926 1 1 14 ASP HA H -11.484 -8.740 2.832 1.00 . A A . 14 ASP HA 1 1 6 3927 1 1 14 ASP HB2 H -11.966 -11.357 1.379 1.00 . A A . 14 ASP HB2 1 1 6 3928 1 1 14 ASP HB3 H -11.526 -11.253 3.071 1.00 . A A . 14 ASP HB3 1 1 6 3929 1 1 14 ASP N N -11.826 -8.757 0.781 1.00 . A A . 14 ASP N 1 1 6 3930 1 1 14 ASP O O -9.006 -9.194 2.550 1.00 . A A . 14 ASP O 1 1 6 3931 1 1 14 ASP OD1 O -14.330 -10.463 1.702 1.00 . A A . 14 ASP OD1 1 1 6 3932 1 1 14 ASP OD2 O -13.842 -10.800 3.808 1.00 . A A . 14 ASP OD2 1 1 6 3933 1 1 15 LYS C C -7.211 -10.000 -0.004 1.00 . A A . 15 LYS C 1 1 6 3934 1 1 15 LYS CA C -8.249 -11.056 0.491 1.00 . A A . 15 LYS CA 1 1 6 3935 1 1 15 LYS CB C -8.464 -12.112 -0.618 1.00 . A A . 15 LYS CB 1 1 6 3936 1 1 15 LYS CD C -9.654 -14.208 -1.414 1.00 . A A . 15 LYS CD 1 1 6 3937 1 1 15 LYS CE C -10.672 -15.309 -1.093 1.00 . A A . 15 LYS CE 1 1 6 3938 1 1 15 LYS CG C -9.467 -13.229 -0.252 1.00 . A A . 15 LYS CG 1 1 6 3939 1 1 15 LYS H H -10.253 -10.941 0.272 1.00 . A A . 15 LYS H 1 1 6 3940 1 1 15 LYS HA H -7.853 -11.588 1.342 1.00 . A A . 15 LYS HA 1 1 6 3941 1 1 15 LYS HB2 H -8.843 -11.599 -1.490 1.00 . A A . 15 LYS HB2 1 1 6 3942 1 1 15 LYS HB3 H -7.518 -12.577 -0.869 1.00 . A A . 15 LYS HB3 1 1 6 3943 1 1 15 LYS HD2 H -9.977 -13.683 -2.300 1.00 . A A . 15 LYS HD2 1 1 6 3944 1 1 15 LYS HD3 H -8.695 -14.663 -1.609 1.00 . A A . 15 LYS HD3 1 1 6 3945 1 1 15 LYS HE2 H -10.724 -15.981 -1.935 1.00 . A A . 15 LYS HE2 1 1 6 3946 1 1 15 LYS HE3 H -10.302 -15.851 -0.235 1.00 . A A . 15 LYS HE3 1 1 6 3947 1 1 15 LYS HG2 H -9.117 -13.773 0.612 1.00 . A A . 15 LYS HG2 1 1 6 3948 1 1 15 LYS HG3 H -10.418 -12.779 -0.018 1.00 . A A . 15 LYS HG3 1 1 6 3949 1 1 15 LYS HZ1 H -12.696 -15.582 -0.748 1.00 . A A . 15 LYS HZ1 1 1 6 3950 1 1 15 LYS HZ2 H -12.369 -14.170 -1.579 1.00 . A A . 15 LYS HZ2 1 1 6 3951 1 1 15 LYS HZ3 H -12.091 -14.271 0.106 1.00 . A A . 15 LYS HZ3 1 1 6 3952 1 1 15 LYS N N -9.573 -10.528 0.834 1.00 . A A . 15 LYS N 1 1 6 3953 1 1 15 LYS NZ N -12.037 -14.776 -0.800 1.00 . A A . 15 LYS NZ 1 1 6 3954 1 1 15 LYS O O -6.323 -10.355 -0.767 1.00 . A A . 15 LYS O 1 1 6 3955 1 1 16 VAL C C -5.568 -7.106 1.193 1.00 . A A . 16 VAL C 1 1 6 3956 1 1 16 VAL CA C -6.293 -7.762 0.021 1.00 . A A . 16 VAL CA 1 1 6 3957 1 1 16 VAL CB C -6.828 -6.684 -0.970 1.00 . A A . 16 VAL CB 1 1 6 3958 1 1 16 VAL CG1 C -7.969 -5.902 -0.358 1.00 . A A . 16 VAL CG1 1 1 6 3959 1 1 16 VAL CG2 C -5.686 -5.743 -1.386 1.00 . A A . 16 VAL CG2 1 1 6 3960 1 1 16 VAL H H -7.984 -8.492 1.088 1.00 . A A . 16 VAL H 1 1 6 3961 1 1 16 VAL HA H -5.541 -8.340 -0.496 1.00 . A A . 16 VAL HA 1 1 6 3962 1 1 16 VAL HB H -7.191 -7.175 -1.859 1.00 . A A . 16 VAL HB 1 1 6 3963 1 1 16 VAL HG11 H -8.781 -6.573 -0.114 1.00 . A A . 16 VAL HG11 1 1 6 3964 1 1 16 VAL HG12 H -8.295 -5.142 -1.050 1.00 . A A . 16 VAL HG12 1 1 6 3965 1 1 16 VAL HG13 H -7.573 -5.464 0.546 1.00 . A A . 16 VAL HG13 1 1 6 3966 1 1 16 VAL HG21 H -6.025 -5.031 -2.128 1.00 . A A . 16 VAL HG21 1 1 6 3967 1 1 16 VAL HG22 H -4.880 -6.333 -1.804 1.00 . A A . 16 VAL HG22 1 1 6 3968 1 1 16 VAL HG23 H -5.311 -5.221 -0.512 1.00 . A A . 16 VAL HG23 1 1 6 3969 1 1 16 VAL N N -7.286 -8.749 0.444 1.00 . A A . 16 VAL N 1 1 6 3970 1 1 16 VAL O O -6.141 -6.358 1.977 1.00 . A A . 16 VAL O 1 1 6 3971 1 1 17 ASP C C -2.991 -5.461 1.956 1.00 . A A . 17 ASP C 1 1 6 3972 1 1 17 ASP CA C -3.428 -6.892 2.324 1.00 . A A . 17 ASP CA 1 1 6 3973 1 1 17 ASP CB C -2.220 -7.809 2.511 1.00 . A A . 17 ASP CB 1 1 6 3974 1 1 17 ASP CG C -1.234 -7.313 3.554 1.00 . A A . 17 ASP CG 1 1 6 3975 1 1 17 ASP H H -4.086 -8.214 0.749 1.00 . A A . 17 ASP H 1 1 6 3976 1 1 17 ASP HA H -3.979 -6.847 3.252 1.00 . A A . 17 ASP HA 1 1 6 3977 1 1 17 ASP HB2 H -2.561 -8.789 2.812 1.00 . A A . 17 ASP HB2 1 1 6 3978 1 1 17 ASP HB3 H -1.700 -7.895 1.568 1.00 . A A . 17 ASP HB3 1 1 6 3979 1 1 17 ASP N N -4.333 -7.464 1.320 1.00 . A A . 17 ASP N 1 1 6 3980 1 1 17 ASP O O -2.834 -5.116 0.755 1.00 . A A . 17 ASP O 1 1 6 3981 1 1 17 ASP OD1 O -1.521 -7.443 4.768 1.00 . A A . 17 ASP OD1 1 1 6 3982 1 1 17 ASP OD2 O -0.184 -6.797 3.171 1.00 . A A . 17 ASP OD2 1 1 6 3983 1 1 18 TRP C C -1.028 -3.026 3.393 1.00 . A A . 18 TRP C 1 1 6 3984 1 1 18 TRP CA C -2.442 -3.233 2.858 1.00 . A A . 18 TRP CA 1 1 6 3985 1 1 18 TRP CB C -3.414 -2.374 3.683 1.00 . A A . 18 TRP CB 1 1 6 3986 1 1 18 TRP CD1 C -5.637 -3.515 3.023 1.00 . A A . 18 TRP CD1 1 1 6 3987 1 1 18 TRP CD2 C -5.729 -1.283 3.072 1.00 . A A . 18 TRP CD2 1 1 6 3988 1 1 18 TRP CE2 C -6.998 -1.776 2.701 1.00 . A A . 18 TRP CE2 1 1 6 3989 1 1 18 TRP CE3 C -5.543 0.094 3.171 1.00 . A A . 18 TRP CE3 1 1 6 3990 1 1 18 TRP CG C -4.866 -2.413 3.252 1.00 . A A . 18 TRP CG 1 1 6 3991 1 1 18 TRP CH2 C -7.862 0.415 2.561 1.00 . A A . 18 TRP CH2 1 1 6 3992 1 1 18 TRP CZ2 C -8.074 -0.940 2.447 1.00 . A A . 18 TRP CZ2 1 1 6 3993 1 1 18 TRP CZ3 C -6.612 0.932 2.923 1.00 . A A . 18 TRP CZ3 1 1 6 3994 1 1 18 TRP H H -2.851 -5.028 3.887 1.00 . A A . 18 TRP H 1 1 6 3995 1 1 18 TRP HA H -2.499 -2.945 1.821 1.00 . A A . 18 TRP HA 1 1 6 3996 1 1 18 TRP HB2 H -3.384 -2.713 4.708 1.00 . A A . 18 TRP HB2 1 1 6 3997 1 1 18 TRP HB3 H -3.068 -1.353 3.629 1.00 . A A . 18 TRP HB3 1 1 6 3998 1 1 18 TRP HD1 H -5.277 -4.532 3.078 1.00 . A A . 18 TRP HD1 1 1 6 3999 1 1 18 TRP HE1 H -7.612 -3.790 2.444 1.00 . A A . 18 TRP HE1 1 1 6 4000 1 1 18 TRP HE3 H -4.583 0.497 3.449 1.00 . A A . 18 TRP HE3 1 1 6 4001 1 1 18 TRP HH2 H -8.676 1.101 2.379 1.00 . A A . 18 TRP HH2 1 1 6 4002 1 1 18 TRP HZ2 H -9.042 -1.332 2.164 1.00 . A A . 18 TRP HZ2 1 1 6 4003 1 1 18 TRP HZ3 H -6.477 2.001 2.999 1.00 . A A . 18 TRP HZ3 1 1 6 4004 1 1 18 TRP N N -2.797 -4.646 2.982 1.00 . A A . 18 TRP N 1 1 6 4005 1 1 18 TRP NE1 N -6.909 -3.143 2.665 1.00 . A A . 18 TRP NE1 1 1 6 4006 1 1 18 TRP O O -0.547 -3.813 4.185 1.00 . A A . 18 TRP O 1 1 6 4007 1 1 19 VAL C C 1.093 -0.323 4.086 1.00 . A A . 19 VAL C 1 1 6 4008 1 1 19 VAL CA C 0.989 -1.692 3.436 1.00 . A A . 19 VAL CA 1 1 6 4009 1 1 19 VAL CB C 2.045 -1.806 2.286 1.00 . A A . 19 VAL CB 1 1 6 4010 1 1 19 VAL CG1 C 2.180 -3.246 1.811 1.00 . A A . 19 VAL CG1 1 1 6 4011 1 1 19 VAL CG2 C 1.686 -0.895 1.107 1.00 . A A . 19 VAL CG2 1 1 6 4012 1 1 19 VAL H H -0.728 -1.196 2.470 1.00 . A A . 19 VAL H 1 1 6 4013 1 1 19 VAL HA H 1.218 -2.433 4.190 1.00 . A A . 19 VAL HA 1 1 6 4014 1 1 19 VAL HB H 3.000 -1.489 2.680 1.00 . A A . 19 VAL HB 1 1 6 4015 1 1 19 VAL HG11 H 2.503 -3.881 2.623 1.00 . A A . 19 VAL HG11 1 1 6 4016 1 1 19 VAL HG12 H 2.896 -3.291 1.008 1.00 . A A . 19 VAL HG12 1 1 6 4017 1 1 19 VAL HG13 H 1.224 -3.595 1.446 1.00 . A A . 19 VAL HG13 1 1 6 4018 1 1 19 VAL HG21 H 1.718 0.143 1.407 1.00 . A A . 19 VAL HG21 1 1 6 4019 1 1 19 VAL HG22 H 0.697 -1.138 0.747 1.00 . A A . 19 VAL HG22 1 1 6 4020 1 1 19 VAL HG23 H 2.404 -1.042 0.314 1.00 . A A . 19 VAL HG23 1 1 6 4021 1 1 19 VAL N N -0.377 -1.947 2.997 1.00 . A A . 19 VAL N 1 1 6 4022 1 1 19 VAL O O 0.483 0.643 3.632 1.00 . A A . 19 VAL O 1 1 6 4023 1 1 20 GLN C C 3.502 1.396 5.615 1.00 . A A . 20 GLN C 1 1 6 4024 1 1 20 GLN CA C 2.065 0.955 5.885 1.00 . A A . 20 GLN CA 1 1 6 4025 1 1 20 GLN CB C 1.838 0.721 7.391 1.00 . A A . 20 GLN CB 1 1 6 4026 1 1 20 GLN CD C 1.822 1.713 9.743 1.00 . A A . 20 GLN CD 1 1 6 4027 1 1 20 GLN CG C 2.044 1.960 8.256 1.00 . A A . 20 GLN CG 1 1 6 4028 1 1 20 GLN H H 2.198 -1.115 5.483 1.00 . A A . 20 GLN H 1 1 6 4029 1 1 20 GLN HA H 1.388 1.716 5.531 1.00 . A A . 20 GLN HA 1 1 6 4030 1 1 20 GLN HB2 H 0.834 0.365 7.562 1.00 . A A . 20 GLN HB2 1 1 6 4031 1 1 20 GLN HB3 H 2.526 -0.041 7.728 1.00 . A A . 20 GLN HB3 1 1 6 4032 1 1 20 GLN HE21 H 3.141 3.118 10.201 1.00 . A A . 20 GLN HE21 1 1 6 4033 1 1 20 GLN HE22 H 2.418 2.329 11.520 1.00 . A A . 20 GLN HE22 1 1 6 4034 1 1 20 GLN HG2 H 3.059 2.299 8.118 1.00 . A A . 20 GLN HG2 1 1 6 4035 1 1 20 GLN HG3 H 1.375 2.742 7.928 1.00 . A A . 20 GLN HG3 1 1 6 4036 1 1 20 GLN N N 1.815 -0.274 5.159 1.00 . A A . 20 GLN N 1 1 6 4037 1 1 20 GLN NE2 N 2.516 2.450 10.556 1.00 . A A . 20 GLN NE2 1 1 6 4038 1 1 20 GLN O O 4.399 0.564 5.523 1.00 . A A . 20 GLN O 1 1 6 4039 1 1 20 GLN OE1 O 1.026 0.859 10.152 1.00 . A A . 20 GLN OE1 1 1 6 4040 1 1 21 CYS C C 5.752 3.554 6.507 1.00 . A A . 21 CYS C 1 1 6 4041 1 1 21 CYS CA C 5.082 3.151 5.186 1.00 . A A . 21 CYS CA 1 1 6 4042 1 1 21 CYS CB C 5.140 4.293 4.141 1.00 . A A . 21 CYS CB 1 1 6 4043 1 1 21 CYS H H 2.960 3.300 5.430 1.00 . A A . 21 CYS H 1 1 6 4044 1 1 21 CYS HA H 5.661 2.315 4.819 1.00 . A A . 21 CYS HA 1 1 6 4045 1 1 21 CYS HB2 H 6.141 4.597 3.889 1.00 . A A . 21 CYS HB2 1 1 6 4046 1 1 21 CYS HB3 H 4.641 3.954 3.246 1.00 . A A . 21 CYS HB3 1 1 6 4047 1 1 21 CYS N N 3.723 2.688 5.418 1.00 . A A . 21 CYS N 1 1 6 4048 1 1 21 CYS O O 5.474 4.621 7.078 1.00 . A A . 21 CYS O 1 1 6 4049 1 1 21 CYS SG S 4.352 5.823 4.598 1.00 . A A . 21 CYS SG 1 1 6 4050 1 1 22 ASP C C 8.598 3.802 8.049 1.00 . A A . 22 ASP C 1 1 6 4051 1 1 22 ASP CA C 7.382 2.927 8.243 1.00 . A A . 22 ASP CA 1 1 6 4052 1 1 22 ASP CB C 7.794 1.585 8.866 1.00 . A A . 22 ASP CB 1 1 6 4053 1 1 22 ASP CG C 6.623 0.748 9.347 1.00 . A A . 22 ASP CG 1 1 6 4054 1 1 22 ASP H H 6.946 1.975 6.390 1.00 . A A . 22 ASP H 1 1 6 4055 1 1 22 ASP HA H 6.696 3.430 8.906 1.00 . A A . 22 ASP HA 1 1 6 4056 1 1 22 ASP HB2 H 8.335 1.013 8.122 1.00 . A A . 22 ASP HB2 1 1 6 4057 1 1 22 ASP HB3 H 8.452 1.781 9.704 1.00 . A A . 22 ASP HB3 1 1 6 4058 1 1 22 ASP N N 6.677 2.732 6.953 1.00 . A A . 22 ASP N 1 1 6 4059 1 1 22 ASP O O 9.544 3.758 8.817 1.00 . A A . 22 ASP O 1 1 6 4060 1 1 22 ASP OD1 O 6.186 0.945 10.499 1.00 . A A . 22 ASP OD1 1 1 6 4061 1 1 22 ASP OD2 O 6.155 -0.111 8.588 1.00 . A A . 22 ASP OD2 1 1 6 4062 1 1 23 GLY C C 9.379 6.897 7.372 1.00 . A A . 23 GLY C 1 1 6 4063 1 1 23 GLY CA C 9.611 5.534 6.759 1.00 . A A . 23 GLY CA 1 1 6 4064 1 1 23 GLY H H 7.697 4.684 6.532 1.00 . A A . 23 GLY H 1 1 6 4065 1 1 23 GLY HA2 H 10.524 5.119 7.162 1.00 . A A . 23 GLY HA2 1 1 6 4066 1 1 23 GLY HA3 H 9.710 5.650 5.688 1.00 . A A . 23 GLY HA3 1 1 6 4067 1 1 23 GLY N N 8.531 4.648 7.039 1.00 . A A . 23 GLY N 1 1 6 4068 1 1 23 GLY O O 10.258 7.742 7.340 1.00 . A A . 23 GLY O 1 1 6 4069 1 1 24 GLY C C 6.444 8.877 8.500 1.00 . A A . 24 GLY C 1 1 6 4070 1 1 24 GLY CA C 7.911 8.419 8.523 1.00 . A A . 24 GLY CA 1 1 6 4071 1 1 24 GLY H H 7.489 6.426 7.936 1.00 . A A . 24 GLY H 1 1 6 4072 1 1 24 GLY HA2 H 8.263 8.421 9.544 1.00 . A A . 24 GLY HA2 1 1 6 4073 1 1 24 GLY HA3 H 8.500 9.135 7.973 1.00 . A A . 24 GLY HA3 1 1 6 4074 1 1 24 GLY N N 8.175 7.124 7.920 1.00 . A A . 24 GLY N 1 1 6 4075 1 1 24 GLY O O 6.070 9.743 9.287 1.00 . A A . 24 GLY O 1 1 6 4076 1 1 25 CYS C C 3.256 7.964 8.400 1.00 . A A . 25 CYS C 1 1 6 4077 1 1 25 CYS CA C 4.206 8.822 7.534 1.00 . A A . 25 CYS CA 1 1 6 4078 1 1 25 CYS CB C 3.686 8.806 6.088 1.00 . A A . 25 CYS CB 1 1 6 4079 1 1 25 CYS H H 5.948 7.626 7.016 1.00 . A A . 25 CYS H 1 1 6 4080 1 1 25 CYS HA H 4.202 9.836 7.899 1.00 . A A . 25 CYS HA 1 1 6 4081 1 1 25 CYS HB2 H 3.442 7.793 5.810 1.00 . A A . 25 CYS HB2 1 1 6 4082 1 1 25 CYS HB3 H 2.786 9.401 6.032 1.00 . A A . 25 CYS HB3 1 1 6 4083 1 1 25 CYS N N 5.611 8.326 7.609 1.00 . A A . 25 CYS N 1 1 6 4084 1 1 25 CYS O O 2.274 8.478 8.955 1.00 . A A . 25 CYS O 1 1 6 4085 1 1 25 CYS SG S 4.834 9.435 4.839 1.00 . A A . 25 CYS SG 1 1 6 4086 1 1 26 ASP C C 1.332 5.520 8.536 1.00 . A A . 26 ASP C 1 1 6 4087 1 1 26 ASP CA C 2.719 5.639 9.193 1.00 . A A . 26 ASP CA 1 1 6 4088 1 1 26 ASP CB C 2.578 5.904 10.721 1.00 . A A . 26 ASP CB 1 1 6 4089 1 1 26 ASP CG C 3.877 5.731 11.490 1.00 . A A . 26 ASP CG 1 1 6 4090 1 1 26 ASP H H 4.453 6.376 8.166 1.00 . A A . 26 ASP H 1 1 6 4091 1 1 26 ASP HA H 3.203 4.687 9.048 1.00 . A A . 26 ASP HA 1 1 6 4092 1 1 26 ASP HB2 H 2.207 6.902 10.893 1.00 . A A . 26 ASP HB2 1 1 6 4093 1 1 26 ASP HB3 H 1.857 5.209 11.130 1.00 . A A . 26 ASP HB3 1 1 6 4094 1 1 26 ASP N N 3.577 6.655 8.506 1.00 . A A . 26 ASP N 1 1 6 4095 1 1 26 ASP O O 0.398 4.979 9.123 1.00 . A A . 26 ASP O 1 1 6 4096 1 1 26 ASP OD1 O 4.185 4.583 11.893 1.00 . A A . 26 ASP OD1 1 1 6 4097 1 1 26 ASP OD2 O 4.591 6.731 11.699 1.00 . A A . 26 ASP OD2 1 1 6 4098 1 1 27 GLU C C -0.201 4.610 5.835 1.00 . A A . 27 GLU C 1 1 6 4099 1 1 27 GLU CA C -0.022 5.943 6.552 1.00 . A A . 27 GLU CA 1 1 6 4100 1 1 27 GLU CB C -0.142 7.152 5.595 1.00 . A A . 27 GLU CB 1 1 6 4101 1 1 27 GLU CD C -0.398 9.693 5.495 1.00 . A A . 27 GLU CD 1 1 6 4102 1 1 27 GLU CG C -0.178 8.475 6.355 1.00 . A A . 27 GLU CG 1 1 6 4103 1 1 27 GLU H H 2.023 6.349 6.858 1.00 . A A . 27 GLU H 1 1 6 4104 1 1 27 GLU HA H -0.828 5.997 7.269 1.00 . A A . 27 GLU HA 1 1 6 4105 1 1 27 GLU HB2 H 0.701 7.158 4.920 1.00 . A A . 27 GLU HB2 1 1 6 4106 1 1 27 GLU HB3 H -1.045 7.075 5.013 1.00 . A A . 27 GLU HB3 1 1 6 4107 1 1 27 GLU HG2 H -0.957 8.451 7.102 1.00 . A A . 27 GLU HG2 1 1 6 4108 1 1 27 GLU HG3 H 0.781 8.581 6.843 1.00 . A A . 27 GLU HG3 1 1 6 4109 1 1 27 GLU N N 1.230 5.980 7.290 1.00 . A A . 27 GLU N 1 1 6 4110 1 1 27 GLU O O 0.768 3.865 5.632 1.00 . A A . 27 GLU O 1 1 6 4111 1 1 27 GLU OE1 O -1.554 9.974 5.130 1.00 . A A . 27 GLU OE1 1 1 6 4112 1 1 27 GLU OE2 O 0.576 10.412 5.221 1.00 . A A . 27 GLU OE2 1 1 6 4113 1 1 28 TRP C C -2.064 3.197 3.362 1.00 . A A . 28 TRP C 1 1 6 4114 1 1 28 TRP CA C -1.790 3.050 4.847 1.00 . A A . 28 TRP CA 1 1 6 4115 1 1 28 TRP CB C -2.977 2.416 5.560 1.00 . A A . 28 TRP CB 1 1 6 4116 1 1 28 TRP CD1 C -2.590 2.683 8.089 1.00 . A A . 28 TRP CD1 1 1 6 4117 1 1 28 TRP CD2 C -2.292 0.610 7.302 1.00 . A A . 28 TRP CD2 1 1 6 4118 1 1 28 TRP CE2 C -2.043 0.602 8.684 1.00 . A A . 28 TRP CE2 1 1 6 4119 1 1 28 TRP CE3 C -2.175 -0.581 6.591 1.00 . A A . 28 TRP CE3 1 1 6 4120 1 1 28 TRP CG C -2.637 1.944 6.938 1.00 . A A . 28 TRP CG 1 1 6 4121 1 1 28 TRP CH2 C -1.567 -1.709 8.643 1.00 . A A . 28 TRP CH2 1 1 6 4122 1 1 28 TRP CZ2 C -1.672 -0.555 9.370 1.00 . A A . 28 TRP CZ2 1 1 6 4123 1 1 28 TRP CZ3 C -1.817 -1.730 7.262 1.00 . A A . 28 TRP CZ3 1 1 6 4124 1 1 28 TRP H H -2.097 5.017 5.611 1.00 . A A . 28 TRP H 1 1 6 4125 1 1 28 TRP HA H -0.944 2.389 4.948 1.00 . A A . 28 TRP HA 1 1 6 4126 1 1 28 TRP HB2 H -3.771 3.141 5.640 1.00 . A A . 28 TRP HB2 1 1 6 4127 1 1 28 TRP HB3 H -3.321 1.563 4.990 1.00 . A A . 28 TRP HB3 1 1 6 4128 1 1 28 TRP HD1 H -2.800 3.739 8.145 1.00 . A A . 28 TRP HD1 1 1 6 4129 1 1 28 TRP HE1 H -2.106 2.187 10.064 1.00 . A A . 28 TRP HE1 1 1 6 4130 1 1 28 TRP HE3 H -2.362 -0.607 5.530 1.00 . A A . 28 TRP HE3 1 1 6 4131 1 1 28 TRP HH2 H -1.284 -2.622 9.146 1.00 . A A . 28 TRP HH2 1 1 6 4132 1 1 28 TRP HZ2 H -1.478 -0.564 10.434 1.00 . A A . 28 TRP HZ2 1 1 6 4133 1 1 28 TRP HZ3 H -1.723 -2.651 6.708 1.00 . A A . 28 TRP HZ3 1 1 6 4134 1 1 28 TRP N N -1.428 4.319 5.470 1.00 . A A . 28 TRP N 1 1 6 4135 1 1 28 TRP NE1 N -2.219 1.886 9.138 1.00 . A A . 28 TRP NE1 1 1 6 4136 1 1 28 TRP O O -2.859 4.049 2.937 1.00 . A A . 28 TRP O 1 1 6 4137 1 1 29 PHE C C -1.957 1.009 0.705 1.00 . A A . 29 PHE C 1 1 6 4138 1 1 29 PHE CA C -1.464 2.379 1.157 1.00 . A A . 29 PHE CA 1 1 6 4139 1 1 29 PHE CB C -0.036 2.599 0.557 1.00 . A A . 29 PHE CB 1 1 6 4140 1 1 29 PHE CD1 C 1.161 3.846 2.380 1.00 . A A . 29 PHE CD1 1 1 6 4141 1 1 29 PHE CD2 C 0.990 4.894 0.271 1.00 . A A . 29 PHE CD2 1 1 6 4142 1 1 29 PHE CE1 C 1.841 4.923 2.866 1.00 . A A . 29 PHE CE1 1 1 6 4143 1 1 29 PHE CE2 C 1.675 5.992 0.762 1.00 . A A . 29 PHE CE2 1 1 6 4144 1 1 29 PHE CG C 0.713 3.811 1.084 1.00 . A A . 29 PHE CG 1 1 6 4145 1 1 29 PHE CZ C 2.102 5.997 2.069 1.00 . A A . 29 PHE CZ 1 1 6 4146 1 1 29 PHE H H -0.774 1.734 3.020 1.00 . A A . 29 PHE H 1 1 6 4147 1 1 29 PHE HA H -2.115 3.168 0.816 1.00 . A A . 29 PHE HA 1 1 6 4148 1 1 29 PHE HB2 H 0.585 1.735 0.726 1.00 . A A . 29 PHE HB2 1 1 6 4149 1 1 29 PHE HB3 H -0.155 2.723 -0.508 1.00 . A A . 29 PHE HB3 1 1 6 4150 1 1 29 PHE HD1 H 0.956 3.008 3.028 1.00 . A A . 29 PHE HD1 1 1 6 4151 1 1 29 PHE HD2 H 0.653 4.889 -0.755 1.00 . A A . 29 PHE HD2 1 1 6 4152 1 1 29 PHE HE1 H 2.184 4.923 3.889 1.00 . A A . 29 PHE HE1 1 1 6 4153 1 1 29 PHE HE2 H 1.876 6.835 0.119 1.00 . A A . 29 PHE HE2 1 1 6 4154 1 1 29 PHE HZ H 2.652 6.825 2.492 1.00 . A A . 29 PHE HZ 1 1 6 4155 1 1 29 PHE N N -1.387 2.375 2.593 1.00 . A A . 29 PHE N 1 1 6 4156 1 1 29 PHE O O -1.821 0.017 1.434 1.00 . A A . 29 PHE O 1 1 6 4157 1 1 30 HIS C C -1.763 -0.828 -1.898 1.00 . A A . 30 HIS C 1 1 6 4158 1 1 30 HIS CA C -2.904 -0.353 -1.061 1.00 . A A . 30 HIS CA 1 1 6 4159 1 1 30 HIS CB C -4.130 -0.255 -1.994 1.00 . A A . 30 HIS CB 1 1 6 4160 1 1 30 HIS CD2 C -6.373 -0.969 -0.926 1.00 . A A . 30 HIS CD2 1 1 6 4161 1 1 30 HIS CE1 C -7.318 0.995 -0.861 1.00 . A A . 30 HIS CE1 1 1 6 4162 1 1 30 HIS CG C -5.469 -0.065 -1.384 1.00 . A A . 30 HIS CG 1 1 6 4163 1 1 30 HIS H H -2.599 1.793 -0.959 1.00 . A A . 30 HIS H 1 1 6 4164 1 1 30 HIS HA H -3.089 -1.056 -0.266 1.00 . A A . 30 HIS HA 1 1 6 4165 1 1 30 HIS HB2 H -3.977 0.656 -2.555 1.00 . A A . 30 HIS HB2 1 1 6 4166 1 1 30 HIS HB3 H -4.179 -1.027 -2.743 1.00 . A A . 30 HIS HB3 1 1 6 4167 1 1 30 HIS HD2 H -6.215 -2.035 -0.829 1.00 . A A . 30 HIS HD2 1 1 6 4168 1 1 30 HIS HE1 H -8.054 1.772 -0.729 1.00 . A A . 30 HIS HE1 1 1 6 4169 1 1 30 HIS HE2 H -8.396 -0.724 -0.647 1.00 . A A . 30 HIS HE2 1 1 6 4170 1 1 30 HIS N N -2.516 0.938 -0.482 1.00 . A A . 30 HIS N 1 1 6 4171 1 1 30 HIS ND1 N -6.085 1.157 -1.327 1.00 . A A . 30 HIS ND1 1 1 6 4172 1 1 30 HIS NE2 N -7.509 -0.288 -0.616 1.00 . A A . 30 HIS NE2 1 1 6 4173 1 1 30 HIS O O -1.176 -0.030 -2.606 1.00 . A A . 30 HIS O 1 1 6 4174 1 1 31 GLN C C -0.553 -2.324 -4.143 1.00 . A A . 31 GLN C 1 1 6 4175 1 1 31 GLN CA C -0.381 -2.659 -2.660 1.00 . A A . 31 GLN CA 1 1 6 4176 1 1 31 GLN CB C -0.186 -4.152 -2.430 1.00 . A A . 31 GLN CB 1 1 6 4177 1 1 31 GLN CD C 0.626 -5.955 -0.880 1.00 . A A . 31 GLN CD 1 1 6 4178 1 1 31 GLN CG C 0.467 -4.478 -1.103 1.00 . A A . 31 GLN CG 1 1 6 4179 1 1 31 GLN H H -1.927 -2.692 -1.201 1.00 . A A . 31 GLN H 1 1 6 4180 1 1 31 GLN HA H 0.495 -2.133 -2.310 1.00 . A A . 31 GLN HA 1 1 6 4181 1 1 31 GLN HB2 H -1.143 -4.653 -2.457 1.00 . A A . 31 GLN HB2 1 1 6 4182 1 1 31 GLN HB3 H 0.443 -4.541 -3.218 1.00 . A A . 31 GLN HB3 1 1 6 4183 1 1 31 GLN HE21 H -1.036 -5.986 0.120 1.00 . A A . 31 GLN HE21 1 1 6 4184 1 1 31 GLN HE22 H -0.248 -7.497 -0.026 1.00 . A A . 31 GLN HE22 1 1 6 4185 1 1 31 GLN HG2 H 1.449 -4.031 -1.078 1.00 . A A . 31 GLN HG2 1 1 6 4186 1 1 31 GLN HG3 H -0.138 -4.066 -0.312 1.00 . A A . 31 GLN HG3 1 1 6 4187 1 1 31 GLN N N -1.455 -2.108 -1.836 1.00 . A A . 31 GLN N 1 1 6 4188 1 1 31 GLN NE2 N -0.300 -6.540 -0.209 1.00 . A A . 31 GLN NE2 1 1 6 4189 1 1 31 GLN O O 0.292 -1.700 -4.719 1.00 . A A . 31 GLN O 1 1 6 4190 1 1 31 GLN OE1 O 1.605 -6.542 -1.276 1.00 . A A . 31 GLN OE1 1 1 6 4191 1 1 32 VAL C C -1.977 -0.906 -6.468 1.00 . A A . 32 VAL C 1 1 6 4192 1 1 32 VAL CA C -1.929 -2.432 -6.130 1.00 . A A . 32 VAL CA 1 1 6 4193 1 1 32 VAL CB C -3.259 -3.105 -6.572 1.00 . A A . 32 VAL CB 1 1 6 4194 1 1 32 VAL CG1 C -4.398 -2.555 -5.766 1.00 . A A . 32 VAL CG1 1 1 6 4195 1 1 32 VAL CG2 C -3.515 -2.876 -8.035 1.00 . A A . 32 VAL CG2 1 1 6 4196 1 1 32 VAL H H -2.396 -3.057 -4.163 1.00 . A A . 32 VAL H 1 1 6 4197 1 1 32 VAL HA H -1.120 -2.884 -6.676 1.00 . A A . 32 VAL HA 1 1 6 4198 1 1 32 VAL HB H -3.198 -4.168 -6.389 1.00 . A A . 32 VAL HB 1 1 6 4199 1 1 32 VAL HG11 H -4.399 -1.492 -5.963 1.00 . A A . 32 VAL HG11 1 1 6 4200 1 1 32 VAL HG12 H -4.179 -2.713 -4.718 1.00 . A A . 32 VAL HG12 1 1 6 4201 1 1 32 VAL HG13 H -5.330 -3.001 -6.077 1.00 . A A . 32 VAL HG13 1 1 6 4202 1 1 32 VAL HG21 H -3.577 -1.804 -8.138 1.00 . A A . 32 VAL HG21 1 1 6 4203 1 1 32 VAL HG22 H -4.452 -3.320 -8.331 1.00 . A A . 32 VAL HG22 1 1 6 4204 1 1 32 VAL HG23 H -2.712 -3.267 -8.638 1.00 . A A . 32 VAL HG23 1 1 6 4205 1 1 32 VAL N N -1.686 -2.665 -4.704 1.00 . A A . 32 VAL N 1 1 6 4206 1 1 32 VAL O O -1.499 -0.459 -7.508 1.00 . A A . 32 VAL O 1 1 6 4207 1 1 33 CYS C C -1.410 2.056 -5.710 1.00 . A A . 33 CYS C 1 1 6 4208 1 1 33 CYS CA C -2.740 1.293 -5.800 1.00 . A A . 33 CYS CA 1 1 6 4209 1 1 33 CYS CB C -3.873 1.914 -4.901 1.00 . A A . 33 CYS CB 1 1 6 4210 1 1 33 CYS H H -2.796 -0.643 -4.763 1.00 . A A . 33 CYS H 1 1 6 4211 1 1 33 CYS HA H -3.043 1.381 -6.835 1.00 . A A . 33 CYS HA 1 1 6 4212 1 1 33 CYS HB2 H -4.350 2.706 -5.437 1.00 . A A . 33 CYS HB2 1 1 6 4213 1 1 33 CYS HB3 H -4.626 1.152 -4.770 1.00 . A A . 33 CYS HB3 1 1 6 4214 1 1 33 CYS N N -2.546 -0.124 -5.551 1.00 . A A . 33 CYS N 1 1 6 4215 1 1 33 CYS O O -1.249 3.106 -6.313 1.00 . A A . 33 CYS O 1 1 6 4216 1 1 33 CYS SG S -3.399 2.484 -3.258 1.00 . A A . 33 CYS SG 1 1 6 4217 1 1 34 VAL C C 1.915 1.321 -5.610 1.00 . A A . 34 VAL C 1 1 6 4218 1 1 34 VAL CA C 0.818 2.161 -4.888 1.00 . A A . 34 VAL CA 1 1 6 4219 1 1 34 VAL CB C 1.173 2.433 -3.413 1.00 . A A . 34 VAL CB 1 1 6 4220 1 1 34 VAL CG1 C 1.793 1.265 -2.703 1.00 . A A . 34 VAL CG1 1 1 6 4221 1 1 34 VAL CG2 C 1.921 3.704 -3.266 1.00 . A A . 34 VAL CG2 1 1 6 4222 1 1 34 VAL H H -0.552 0.726 -4.422 1.00 . A A . 34 VAL H 1 1 6 4223 1 1 34 VAL HA H 0.732 3.110 -5.397 1.00 . A A . 34 VAL HA 1 1 6 4224 1 1 34 VAL HB H 0.272 2.519 -2.835 1.00 . A A . 34 VAL HB 1 1 6 4225 1 1 34 VAL HG11 H 1.170 0.388 -2.785 1.00 . A A . 34 VAL HG11 1 1 6 4226 1 1 34 VAL HG12 H 1.906 1.518 -1.659 1.00 . A A . 34 VAL HG12 1 1 6 4227 1 1 34 VAL HG13 H 2.764 1.084 -3.140 1.00 . A A . 34 VAL HG13 1 1 6 4228 1 1 34 VAL HG21 H 1.283 4.435 -3.737 1.00 . A A . 34 VAL HG21 1 1 6 4229 1 1 34 VAL HG22 H 2.862 3.632 -3.787 1.00 . A A . 34 VAL HG22 1 1 6 4230 1 1 34 VAL HG23 H 2.011 3.916 -2.212 1.00 . A A . 34 VAL HG23 1 1 6 4231 1 1 34 VAL N N -0.450 1.523 -4.978 1.00 . A A . 34 VAL N 1 1 6 4232 1 1 34 VAL O O 3.109 1.613 -5.525 1.00 . A A . 34 VAL O 1 1 6 4233 1 1 35 GLY C C 3.317 -1.493 -6.348 1.00 . A A . 35 GLY C 1 1 6 4234 1 1 35 GLY CA C 2.379 -0.550 -7.154 1.00 . A A . 35 GLY CA 1 1 6 4235 1 1 35 GLY H H 0.487 0.302 -6.491 1.00 . A A . 35 GLY H 1 1 6 4236 1 1 35 GLY HA2 H 1.767 -1.178 -7.785 1.00 . A A . 35 GLY HA2 1 1 6 4237 1 1 35 GLY HA3 H 2.981 0.074 -7.797 1.00 . A A . 35 GLY HA3 1 1 6 4238 1 1 35 GLY N N 1.466 0.334 -6.385 1.00 . A A . 35 GLY N 1 1 6 4239 1 1 35 GLY O O 4.461 -1.733 -6.756 1.00 . A A . 35 GLY O 1 1 6 4240 1 1 36 VAL C C 3.083 -4.389 -4.853 1.00 . A A . 36 VAL C 1 1 6 4241 1 1 36 VAL CA C 3.583 -2.998 -4.469 1.00 . A A . 36 VAL CA 1 1 6 4242 1 1 36 VAL CB C 3.297 -2.796 -2.957 1.00 . A A . 36 VAL CB 1 1 6 4243 1 1 36 VAL CG1 C 3.956 -3.862 -2.094 1.00 . A A . 36 VAL CG1 1 1 6 4244 1 1 36 VAL CG2 C 3.724 -1.433 -2.529 1.00 . A A . 36 VAL CG2 1 1 6 4245 1 1 36 VAL H H 1.971 -1.756 -4.897 1.00 . A A . 36 VAL H 1 1 6 4246 1 1 36 VAL HA H 4.650 -2.874 -4.640 1.00 . A A . 36 VAL HA 1 1 6 4247 1 1 36 VAL HB H 2.231 -2.875 -2.813 1.00 . A A . 36 VAL HB 1 1 6 4248 1 1 36 VAL HG11 H 3.750 -3.677 -1.050 1.00 . A A . 36 VAL HG11 1 1 6 4249 1 1 36 VAL HG12 H 5.020 -3.912 -2.286 1.00 . A A . 36 VAL HG12 1 1 6 4250 1 1 36 VAL HG13 H 3.522 -4.807 -2.374 1.00 . A A . 36 VAL HG13 1 1 6 4251 1 1 36 VAL HG21 H 4.766 -1.267 -2.762 1.00 . A A . 36 VAL HG21 1 1 6 4252 1 1 36 VAL HG22 H 3.554 -1.313 -1.471 1.00 . A A . 36 VAL HG22 1 1 6 4253 1 1 36 VAL HG23 H 3.091 -0.727 -3.047 1.00 . A A . 36 VAL HG23 1 1 6 4254 1 1 36 VAL N N 2.851 -2.015 -5.248 1.00 . A A . 36 VAL N 1 1 6 4255 1 1 36 VAL O O 1.884 -4.574 -5.112 1.00 . A A . 36 VAL O 1 1 6 4256 1 1 37 SER C C 3.447 -7.435 -3.823 1.00 . A A . 37 SER C 1 1 6 4257 1 1 37 SER CA C 3.568 -6.695 -5.165 1.00 . A A . 37 SER CA 1 1 6 4258 1 1 37 SER CB C 4.630 -7.337 -6.073 1.00 . A A . 37 SER CB 1 1 6 4259 1 1 37 SER H H 4.912 -5.275 -4.681 1.00 . A A . 37 SER H 1 1 6 4260 1 1 37 SER HA H 2.612 -6.684 -5.668 1.00 . A A . 37 SER HA 1 1 6 4261 1 1 37 SER HB2 H 4.391 -8.375 -6.253 1.00 . A A . 37 SER HB2 1 1 6 4262 1 1 37 SER HB3 H 4.662 -6.811 -7.016 1.00 . A A . 37 SER HB3 1 1 6 4263 1 1 37 SER HG H 6.541 -6.938 -6.145 1.00 . A A . 37 SER HG 1 1 6 4264 1 1 37 SER N N 3.955 -5.351 -4.883 1.00 . A A . 37 SER N 1 1 6 4265 1 1 37 SER O O 4.131 -7.070 -2.867 1.00 . A A . 37 SER O 1 1 6 4266 1 1 37 SER OG O 5.921 -7.259 -5.479 1.00 . A A . 37 SER OG 1 1 6 4267 1 1 38 PRO C C 3.692 -9.772 -1.860 1.00 . A A . 38 PRO C 1 1 6 4268 1 1 38 PRO CA C 2.389 -9.195 -2.437 1.00 . A A . 38 PRO CA 1 1 6 4269 1 1 38 PRO CB C 1.418 -10.329 -2.828 1.00 . A A . 38 PRO CB 1 1 6 4270 1 1 38 PRO CD C 1.782 -9.028 -4.790 1.00 . A A . 38 PRO CD 1 1 6 4271 1 1 38 PRO CG C 1.540 -10.424 -4.306 1.00 . A A . 38 PRO CG 1 1 6 4272 1 1 38 PRO HA H 1.924 -8.557 -1.698 1.00 . A A . 38 PRO HA 1 1 6 4273 1 1 38 PRO HB2 H 1.703 -11.245 -2.333 1.00 . A A . 38 PRO HB2 1 1 6 4274 1 1 38 PRO HB3 H 0.414 -10.055 -2.537 1.00 . A A . 38 PRO HB3 1 1 6 4275 1 1 38 PRO HD2 H 2.321 -9.042 -5.725 1.00 . A A . 38 PRO HD2 1 1 6 4276 1 1 38 PRO HD3 H 0.856 -8.481 -4.894 1.00 . A A . 38 PRO HD3 1 1 6 4277 1 1 38 PRO HG2 H 2.399 -11.030 -4.542 1.00 . A A . 38 PRO HG2 1 1 6 4278 1 1 38 PRO HG3 H 0.644 -10.836 -4.743 1.00 . A A . 38 PRO HG3 1 1 6 4279 1 1 38 PRO N N 2.602 -8.470 -3.716 1.00 . A A . 38 PRO N 1 1 6 4280 1 1 38 PRO O O 3.841 -9.925 -0.657 1.00 . A A . 38 PRO O 1 1 6 4281 1 1 39 GLU C C 6.808 -9.569 -1.704 1.00 . A A . 39 GLU C 1 1 6 4282 1 1 39 GLU CA C 5.911 -10.634 -2.378 1.00 . A A . 39 GLU CA 1 1 6 4283 1 1 39 GLU CB C 6.565 -11.217 -3.635 1.00 . A A . 39 GLU CB 1 1 6 4284 1 1 39 GLU CD C 8.348 -12.601 -4.703 1.00 . A A . 39 GLU CD 1 1 6 4285 1 1 39 GLU CG C 7.859 -11.984 -3.417 1.00 . A A . 39 GLU CG 1 1 6 4286 1 1 39 GLU H H 4.516 -9.777 -3.679 1.00 . A A . 39 GLU H 1 1 6 4287 1 1 39 GLU HA H 5.728 -11.426 -1.668 1.00 . A A . 39 GLU HA 1 1 6 4288 1 1 39 GLU HB2 H 5.864 -11.881 -4.114 1.00 . A A . 39 GLU HB2 1 1 6 4289 1 1 39 GLU HB3 H 6.767 -10.413 -4.325 1.00 . A A . 39 GLU HB3 1 1 6 4290 1 1 39 GLU HG2 H 8.602 -11.284 -3.064 1.00 . A A . 39 GLU HG2 1 1 6 4291 1 1 39 GLU HG3 H 7.702 -12.759 -2.681 1.00 . A A . 39 GLU HG3 1 1 6 4292 1 1 39 GLU N N 4.640 -10.048 -2.745 1.00 . A A . 39 GLU N 1 1 6 4293 1 1 39 GLU O O 7.682 -9.880 -0.907 1.00 . A A . 39 GLU O 1 1 6 4294 1 1 39 GLU OE1 O 7.940 -13.742 -5.020 1.00 . A A . 39 GLU OE1 1 1 6 4295 1 1 39 GLU OE2 O 9.098 -11.944 -5.440 1.00 . A A . 39 GLU OE2 1 1 6 4296 1 1 40 MET C C 6.914 -6.878 -0.105 1.00 . A A . 40 MET C 1 1 6 4297 1 1 40 MET CA C 7.291 -7.155 -1.544 1.00 . A A . 40 MET CA 1 1 6 4298 1 1 40 MET CB C 6.930 -5.939 -2.403 1.00 . A A . 40 MET CB 1 1 6 4299 1 1 40 MET CE C 7.684 -1.840 -2.668 1.00 . A A . 40 MET CE 1 1 6 4300 1 1 40 MET CG C 7.567 -4.593 -2.056 1.00 . A A . 40 MET CG 1 1 6 4301 1 1 40 MET H H 5.803 -8.151 -2.656 1.00 . A A . 40 MET H 1 1 6 4302 1 1 40 MET HA H 8.352 -7.333 -1.619 1.00 . A A . 40 MET HA 1 1 6 4303 1 1 40 MET HB2 H 7.073 -6.122 -3.452 1.00 . A A . 40 MET HB2 1 1 6 4304 1 1 40 MET HB3 H 5.866 -5.823 -2.272 1.00 . A A . 40 MET HB3 1 1 6 4305 1 1 40 MET HE1 H 7.301 -1.080 -3.335 1.00 . A A . 40 MET HE1 1 1 6 4306 1 1 40 MET HE2 H 8.760 -1.845 -2.672 1.00 . A A . 40 MET HE2 1 1 6 4307 1 1 40 MET HE3 H 7.308 -1.662 -1.671 1.00 . A A . 40 MET HE3 1 1 6 4308 1 1 40 MET HG2 H 7.314 -4.277 -1.047 1.00 . A A . 40 MET HG2 1 1 6 4309 1 1 40 MET HG3 H 8.636 -4.688 -2.143 1.00 . A A . 40 MET HG3 1 1 6 4310 1 1 40 MET N N 6.550 -8.320 -2.045 1.00 . A A . 40 MET N 1 1 6 4311 1 1 40 MET O O 7.778 -6.683 0.740 1.00 . A A . 40 MET O 1 1 6 4312 1 1 40 MET SD S 7.016 -3.371 -3.276 1.00 . A A . 40 MET SD 1 1 6 4313 1 1 41 ALA C C 5.609 -7.498 2.573 1.00 . A A . 41 ALA C 1 1 6 4314 1 1 41 ALA CA C 5.037 -6.590 1.473 1.00 . A A . 41 ALA CA 1 1 6 4315 1 1 41 ALA CB C 3.513 -6.711 1.398 1.00 . A A . 41 ALA CB 1 1 6 4316 1 1 41 ALA H H 4.973 -7.116 -0.564 1.00 . A A . 41 ALA H 1 1 6 4317 1 1 41 ALA HA H 5.276 -5.567 1.717 1.00 . A A . 41 ALA HA 1 1 6 4318 1 1 41 ALA HB1 H 3.112 -6.051 0.639 1.00 . A A . 41 ALA HB1 1 1 6 4319 1 1 41 ALA HB2 H 3.070 -6.437 2.340 1.00 . A A . 41 ALA HB2 1 1 6 4320 1 1 41 ALA HB3 H 3.229 -7.726 1.161 1.00 . A A . 41 ALA HB3 1 1 6 4321 1 1 41 ALA N N 5.603 -6.899 0.155 1.00 . A A . 41 ALA N 1 1 6 4322 1 1 41 ALA O O 6.027 -7.015 3.626 1.00 . A A . 41 ALA O 1 1 6 4323 1 1 42 GLU C C 7.692 -9.819 3.367 1.00 . A A . 42 GLU C 1 1 6 4324 1 1 42 GLU CA C 6.145 -9.760 3.286 1.00 . A A . 42 GLU CA 1 1 6 4325 1 1 42 GLU CB C 5.587 -11.170 3.013 1.00 . A A . 42 GLU CB 1 1 6 4326 1 1 42 GLU CD C 3.617 -12.724 2.899 1.00 . A A . 42 GLU CD 1 1 6 4327 1 1 42 GLU CG C 4.074 -11.281 2.994 1.00 . A A . 42 GLU CG 1 1 6 4328 1 1 42 GLU H H 5.274 -9.041 1.442 1.00 . A A . 42 GLU H 1 1 6 4329 1 1 42 GLU HA H 5.774 -9.436 4.249 1.00 . A A . 42 GLU HA 1 1 6 4330 1 1 42 GLU HB2 H 5.933 -11.512 2.051 1.00 . A A . 42 GLU HB2 1 1 6 4331 1 1 42 GLU HB3 H 5.951 -11.848 3.772 1.00 . A A . 42 GLU HB3 1 1 6 4332 1 1 42 GLU HG2 H 3.688 -10.864 3.914 1.00 . A A . 42 GLU HG2 1 1 6 4333 1 1 42 GLU HG3 H 3.664 -10.739 2.154 1.00 . A A . 42 GLU HG3 1 1 6 4334 1 1 42 GLU N N 5.647 -8.788 2.310 1.00 . A A . 42 GLU N 1 1 6 4335 1 1 42 GLU O O 8.238 -10.420 4.299 1.00 . A A . 42 GLU O 1 1 6 4336 1 1 42 GLU OE1 O 3.678 -13.330 1.795 1.00 . A A . 42 GLU OE1 1 1 6 4337 1 1 42 GLU OE2 O 3.191 -13.280 3.943 1.00 . A A . 42 GLU OE2 1 1 6 4338 1 1 43 ASN C C 10.677 -8.073 2.528 1.00 . A A . 43 ASN C 1 1 6 4339 1 1 43 ASN CA C 9.845 -9.365 2.343 1.00 . A A . 43 ASN CA 1 1 6 4340 1 1 43 ASN CB C 10.278 -10.104 1.075 1.00 . A A . 43 ASN CB 1 1 6 4341 1 1 43 ASN CG C 10.036 -11.601 1.143 1.00 . A A . 43 ASN CG 1 1 6 4342 1 1 43 ASN H H 7.943 -8.686 1.716 1.00 . A A . 43 ASN H 1 1 6 4343 1 1 43 ASN HA H 10.080 -10.016 3.172 1.00 . A A . 43 ASN HA 1 1 6 4344 1 1 43 ASN HB2 H 9.720 -9.719 0.232 1.00 . A A . 43 ASN HB2 1 1 6 4345 1 1 43 ASN HB3 H 11.330 -9.928 0.928 1.00 . A A . 43 ASN HB3 1 1 6 4346 1 1 43 ASN HD21 H 9.584 -11.666 -0.784 1.00 . A A . 43 ASN HD21 1 1 6 4347 1 1 43 ASN HD22 H 9.523 -13.161 0.093 1.00 . A A . 43 ASN HD22 1 1 6 4348 1 1 43 ASN N N 8.389 -9.225 2.400 1.00 . A A . 43 ASN N 1 1 6 4349 1 1 43 ASN ND2 N 9.682 -12.196 0.034 1.00 . A A . 43 ASN ND2 1 1 6 4350 1 1 43 ASN O O 11.720 -8.114 3.198 1.00 . A A . 43 ASN O 1 1 6 4351 1 1 43 ASN OD1 O 10.147 -12.214 2.191 1.00 . A A . 43 ASN OD1 1 1 6 4352 1 1 44 GLU C C 10.333 -4.552 2.631 1.00 . A A . 44 GLU C 1 1 6 4353 1 1 44 GLU CA C 11.077 -5.733 2.022 1.00 . A A . 44 GLU CA 1 1 6 4354 1 1 44 GLU CB C 11.659 -5.338 0.647 1.00 . A A . 44 GLU CB 1 1 6 4355 1 1 44 GLU CD C 13.237 -5.853 -1.237 1.00 . A A . 44 GLU CD 1 1 6 4356 1 1 44 GLU CG C 12.608 -6.353 0.041 1.00 . A A . 44 GLU CG 1 1 6 4357 1 1 44 GLU H H 9.361 -6.888 1.551 1.00 . A A . 44 GLU H 1 1 6 4358 1 1 44 GLU HA H 11.904 -5.963 2.679 1.00 . A A . 44 GLU HA 1 1 6 4359 1 1 44 GLU HB2 H 10.861 -5.159 -0.059 1.00 . A A . 44 GLU HB2 1 1 6 4360 1 1 44 GLU HB3 H 12.196 -4.411 0.777 1.00 . A A . 44 GLU HB3 1 1 6 4361 1 1 44 GLU HG2 H 13.390 -6.592 0.749 1.00 . A A . 44 GLU HG2 1 1 6 4362 1 1 44 GLU HG3 H 12.034 -7.242 -0.184 1.00 . A A . 44 GLU HG3 1 1 6 4363 1 1 44 GLU N N 10.255 -6.950 1.963 1.00 . A A . 44 GLU N 1 1 6 4364 1 1 44 GLU O O 9.103 -4.564 2.744 1.00 . A A . 44 GLU O 1 1 6 4365 1 1 44 GLU OE1 O 12.647 -6.030 -2.304 1.00 . A A . 44 GLU OE1 1 1 6 4366 1 1 44 GLU OE2 O 14.351 -5.272 -1.174 1.00 . A A . 44 GLU OE2 1 1 6 4367 1 1 45 ASP C C 9.793 -1.488 2.661 1.00 . A A . 45 ASP C 1 1 6 4368 1 1 45 ASP CA C 10.545 -2.329 3.653 1.00 . A A . 45 ASP CA 1 1 6 4369 1 1 45 ASP CB C 11.666 -1.426 4.201 1.00 . A A . 45 ASP CB 1 1 6 4370 1 1 45 ASP CG C 12.662 -2.125 5.077 1.00 . A A . 45 ASP CG 1 1 6 4371 1 1 45 ASP H H 12.061 -3.540 2.830 1.00 . A A . 45 ASP H 1 1 6 4372 1 1 45 ASP HA H 9.920 -2.638 4.477 1.00 . A A . 45 ASP HA 1 1 6 4373 1 1 45 ASP HB2 H 12.192 -0.966 3.375 1.00 . A A . 45 ASP HB2 1 1 6 4374 1 1 45 ASP HB3 H 11.204 -0.635 4.775 1.00 . A A . 45 ASP HB3 1 1 6 4375 1 1 45 ASP N N 11.093 -3.515 2.996 1.00 . A A . 45 ASP N 1 1 6 4376 1 1 45 ASP O O 10.384 -0.963 1.701 1.00 . A A . 45 ASP O 1 1 6 4377 1 1 45 ASP OD1 O 12.424 -2.239 6.293 1.00 . A A . 45 ASP OD1 1 1 6 4378 1 1 45 ASP OD2 O 13.710 -2.550 4.546 1.00 . A A . 45 ASP OD2 1 1 6 4379 1 1 46 TYR C C 8.029 1.018 2.389 1.00 . A A . 46 TYR C 1 1 6 4380 1 1 46 TYR CA C 7.750 -0.459 2.041 1.00 . A A . 46 TYR CA 1 1 6 4381 1 1 46 TYR CB C 6.235 -0.757 2.075 1.00 . A A . 46 TYR CB 1 1 6 4382 1 1 46 TYR CD1 C 5.416 0.352 -0.039 1.00 . A A . 46 TYR CD1 1 1 6 4383 1 1 46 TYR CD2 C 4.774 1.284 2.052 1.00 . A A . 46 TYR CD2 1 1 6 4384 1 1 46 TYR CE1 C 4.740 1.358 -0.694 1.00 . A A . 46 TYR CE1 1 1 6 4385 1 1 46 TYR CE2 C 4.094 2.270 1.399 1.00 . A A . 46 TYR CE2 1 1 6 4386 1 1 46 TYR CG C 5.443 0.301 1.349 1.00 . A A . 46 TYR CG 1 1 6 4387 1 1 46 TYR CZ C 4.089 2.305 0.038 1.00 . A A . 46 TYR CZ 1 1 6 4388 1 1 46 TYR H H 8.070 -1.917 3.513 1.00 . A A . 46 TYR H 1 1 6 4389 1 1 46 TYR HA H 8.099 -0.610 1.030 1.00 . A A . 46 TYR HA 1 1 6 4390 1 1 46 TYR HB2 H 6.050 -1.710 1.602 1.00 . A A . 46 TYR HB2 1 1 6 4391 1 1 46 TYR HB3 H 5.894 -0.789 3.100 1.00 . A A . 46 TYR HB3 1 1 6 4392 1 1 46 TYR HD1 H 5.932 -0.417 -0.596 1.00 . A A . 46 TYR HD1 1 1 6 4393 1 1 46 TYR HD2 H 4.765 1.274 3.132 1.00 . A A . 46 TYR HD2 1 1 6 4394 1 1 46 TYR HE1 H 4.689 1.423 -1.772 1.00 . A A . 46 TYR HE1 1 1 6 4395 1 1 46 TYR HE2 H 3.564 3.030 1.955 1.00 . A A . 46 TYR HE2 1 1 6 4396 1 1 46 TYR HH H 2.900 2.890 -1.267 1.00 . A A . 46 TYR HH 1 1 6 4397 1 1 46 TYR N N 8.511 -1.357 2.846 1.00 . A A . 46 TYR N 1 1 6 4398 1 1 46 TYR O O 7.696 1.509 3.475 1.00 . A A . 46 TYR O 1 1 6 4399 1 1 46 TYR OH O 3.444 3.307 -0.596 1.00 . A A . 46 TYR OH 1 1 6 4400 1 1 47 ILE C C 7.979 3.785 0.547 1.00 . A A . 47 ILE C 1 1 6 4401 1 1 47 ILE CA C 8.893 3.113 1.565 1.00 . A A . 47 ILE CA 1 1 6 4402 1 1 47 ILE CB C 10.389 3.461 1.281 1.00 . A A . 47 ILE CB 1 1 6 4403 1 1 47 ILE CD1 C 11.075 2.884 3.711 1.00 . A A . 47 ILE CD1 1 1 6 4404 1 1 47 ILE CG1 C 11.330 2.671 2.218 1.00 . A A . 47 ILE CG1 1 1 6 4405 1 1 47 ILE CG2 C 10.636 4.945 1.437 1.00 . A A . 47 ILE CG2 1 1 6 4406 1 1 47 ILE H H 8.943 1.119 0.726 1.00 . A A . 47 ILE H 1 1 6 4407 1 1 47 ILE HA H 8.613 3.437 2.556 1.00 . A A . 47 ILE HA 1 1 6 4408 1 1 47 ILE HB H 10.607 3.189 0.260 1.00 . A A . 47 ILE HB 1 1 6 4409 1 1 47 ILE HD11 H 11.186 3.934 3.946 1.00 . A A . 47 ILE HD11 1 1 6 4410 1 1 47 ILE HD12 H 11.773 2.296 4.289 1.00 . A A . 47 ILE HD12 1 1 6 4411 1 1 47 ILE HD13 H 10.072 2.556 3.937 1.00 . A A . 47 ILE HD13 1 1 6 4412 1 1 47 ILE HG12 H 11.203 1.616 2.028 1.00 . A A . 47 ILE HG12 1 1 6 4413 1 1 47 ILE HG13 H 12.353 2.953 2.011 1.00 . A A . 47 ILE HG13 1 1 6 4414 1 1 47 ILE HG21 H 10.022 5.483 0.734 1.00 . A A . 47 ILE HG21 1 1 6 4415 1 1 47 ILE HG22 H 11.677 5.181 1.271 1.00 . A A . 47 ILE HG22 1 1 6 4416 1 1 47 ILE HG23 H 10.352 5.223 2.443 1.00 . A A . 47 ILE HG23 1 1 6 4417 1 1 47 ILE N N 8.658 1.694 1.466 1.00 . A A . 47 ILE N 1 1 6 4418 1 1 47 ILE O O 7.828 3.276 -0.563 1.00 . A A . 47 ILE O 1 1 6 4419 1 1 48 CYS C C 7.056 6.629 -0.761 1.00 . A A . 48 CYS C 1 1 6 4420 1 1 48 CYS CA C 6.383 5.508 0.004 1.00 . A A . 48 CYS CA 1 1 6 4421 1 1 48 CYS CB C 5.188 6.099 0.767 1.00 . A A . 48 CYS CB 1 1 6 4422 1 1 48 CYS H H 7.524 5.422 1.712 1.00 . A A . 48 CYS H 1 1 6 4423 1 1 48 CYS HA H 6.032 4.756 -0.688 1.00 . A A . 48 CYS HA 1 1 6 4424 1 1 48 CYS HB2 H 4.369 6.230 0.074 1.00 . A A . 48 CYS HB2 1 1 6 4425 1 1 48 CYS HB3 H 4.883 5.408 1.537 1.00 . A A . 48 CYS HB3 1 1 6 4426 1 1 48 CYS N N 7.350 4.907 0.903 1.00 . A A . 48 CYS N 1 1 6 4427 1 1 48 CYS O O 8.204 6.972 -0.479 1.00 . A A . 48 CYS O 1 1 6 4428 1 1 48 CYS SG S 5.499 7.716 1.546 1.00 . A A . 48 CYS SG 1 1 6 4429 1 1 49 ILE C C 7.245 9.546 -1.615 1.00 . A A . 49 ILE C 1 1 6 4430 1 1 49 ILE CA C 6.784 8.326 -2.485 1.00 . A A . 49 ILE CA 1 1 6 4431 1 1 49 ILE CB C 5.695 8.739 -3.508 1.00 . A A . 49 ILE CB 1 1 6 4432 1 1 49 ILE CD1 C 5.279 10.211 -5.507 1.00 . A A . 49 ILE CD1 1 1 6 4433 1 1 49 ILE CG1 C 6.196 9.870 -4.378 1.00 . A A . 49 ILE CG1 1 1 6 4434 1 1 49 ILE CG2 C 4.378 9.108 -2.814 1.00 . A A . 49 ILE CG2 1 1 6 4435 1 1 49 ILE H H 5.423 6.859 -1.817 1.00 . A A . 49 ILE H 1 1 6 4436 1 1 49 ILE HA H 7.642 7.988 -3.049 1.00 . A A . 49 ILE HA 1 1 6 4437 1 1 49 ILE HB H 5.475 7.888 -4.140 1.00 . A A . 49 ILE HB 1 1 6 4438 1 1 49 ILE HD11 H 4.318 10.473 -5.099 1.00 . A A . 49 ILE HD11 1 1 6 4439 1 1 49 ILE HD12 H 5.179 9.323 -6.112 1.00 . A A . 49 ILE HD12 1 1 6 4440 1 1 49 ILE HD13 H 5.688 11.022 -6.093 1.00 . A A . 49 ILE HD13 1 1 6 4441 1 1 49 ILE HG12 H 6.300 10.739 -3.747 1.00 . A A . 49 ILE HG12 1 1 6 4442 1 1 49 ILE HG13 H 7.156 9.597 -4.785 1.00 . A A . 49 ILE HG13 1 1 6 4443 1 1 49 ILE HG21 H 4.009 8.268 -2.242 1.00 . A A . 49 ILE HG21 1 1 6 4444 1 1 49 ILE HG22 H 3.646 9.365 -3.566 1.00 . A A . 49 ILE HG22 1 1 6 4445 1 1 49 ILE HG23 H 4.545 9.947 -2.156 1.00 . A A . 49 ILE HG23 1 1 6 4446 1 1 49 ILE N N 6.319 7.223 -1.678 1.00 . A A . 49 ILE N 1 1 6 4447 1 1 49 ILE O O 8.222 10.211 -1.934 1.00 . A A . 49 ILE O 1 1 6 4448 1 1 50 ASN C C 8.071 10.528 1.284 1.00 . A A . 50 ASN C 1 1 6 4449 1 1 50 ASN CA C 6.897 10.894 0.399 1.00 . A A . 50 ASN CA 1 1 6 4450 1 1 50 ASN CB C 5.697 11.303 1.257 1.00 . A A . 50 ASN CB 1 1 6 4451 1 1 50 ASN CG C 4.549 11.840 0.433 1.00 . A A . 50 ASN CG 1 1 6 4452 1 1 50 ASN H H 5.798 9.207 -0.274 1.00 . A A . 50 ASN H 1 1 6 4453 1 1 50 ASN HA H 7.181 11.723 -0.231 1.00 . A A . 50 ASN HA 1 1 6 4454 1 1 50 ASN HB2 H 5.362 10.439 1.808 1.00 . A A . 50 ASN HB2 1 1 6 4455 1 1 50 ASN HB3 H 6.007 12.075 1.948 1.00 . A A . 50 ASN HB3 1 1 6 4456 1 1 50 ASN HD21 H 5.185 13.710 0.644 1.00 . A A . 50 ASN HD21 1 1 6 4457 1 1 50 ASN HD22 H 3.759 13.490 -0.268 1.00 . A A . 50 ASN HD22 1 1 6 4458 1 1 50 ASN N N 6.558 9.786 -0.500 1.00 . A A . 50 ASN N 1 1 6 4459 1 1 50 ASN ND2 N 4.502 13.133 0.254 1.00 . A A . 50 ASN ND2 1 1 6 4460 1 1 50 ASN O O 8.898 11.367 1.605 1.00 . A A . 50 ASN O 1 1 6 4461 1 1 50 ASN OD1 O 3.693 11.082 -0.032 1.00 . A A . 50 ASN OD1 1 1 6 4462 1 1 51 CYS C C 10.552 8.700 1.622 1.00 . A A . 51 CYS C 1 1 6 4463 1 1 51 CYS CA C 9.261 8.772 2.467 1.00 . A A . 51 CYS CA 1 1 6 4464 1 1 51 CYS CB C 8.965 7.385 3.079 1.00 . A A . 51 CYS CB 1 1 6 4465 1 1 51 CYS H H 7.438 8.656 1.358 1.00 . A A . 51 CYS H 1 1 6 4466 1 1 51 CYS HA H 9.415 9.484 3.267 1.00 . A A . 51 CYS HA 1 1 6 4467 1 1 51 CYS HB2 H 8.569 6.750 2.303 1.00 . A A . 51 CYS HB2 1 1 6 4468 1 1 51 CYS HB3 H 9.913 6.983 3.404 1.00 . A A . 51 CYS HB3 1 1 6 4469 1 1 51 CYS N N 8.149 9.258 1.661 1.00 . A A . 51 CYS N 1 1 6 4470 1 1 51 CYS O O 11.656 8.792 2.139 1.00 . A A . 51 CYS O 1 1 6 4471 1 1 51 CYS SG S 7.797 7.299 4.479 1.00 . A A . 51 CYS SG 1 1 6 4472 1 1 52 ALA C C 12.008 9.772 -1.109 1.00 . A A . 52 ALA C 1 1 6 4473 1 1 52 ALA CA C 11.533 8.411 -0.585 1.00 . A A . 52 ALA CA 1 1 6 4474 1 1 52 ALA CB C 11.192 7.484 -1.742 1.00 . A A . 52 ALA CB 1 1 6 4475 1 1 52 ALA H H 9.473 8.562 -0.034 1.00 . A A . 52 ALA H 1 1 6 4476 1 1 52 ALA HA H 12.314 7.947 0.001 1.00 . A A . 52 ALA HA 1 1 6 4477 1 1 52 ALA HB1 H 12.069 7.362 -2.360 1.00 . A A . 52 ALA HB1 1 1 6 4478 1 1 52 ALA HB2 H 10.393 7.912 -2.328 1.00 . A A . 52 ALA HB2 1 1 6 4479 1 1 52 ALA HB3 H 10.877 6.527 -1.352 1.00 . A A . 52 ALA HB3 1 1 6 4480 1 1 52 ALA N N 10.390 8.545 0.316 1.00 . A A . 52 ALA N 1 1 6 4481 2 2 1 ZN ZN ZN 5.630 7.567 3.826 1.00 . B A . 53 ZN ZN 1 1 6 4482 3 2 1 ZN ZN ZN -5.239 2.887 -1.869 1.00 . C A . 54 ZN ZN 1 1 7 4483 1 1 1 SER C C -11.268 5.704 2.489 1.00 . A A . 1 SER C 1 1 7 4484 1 1 1 SER CA C -12.241 5.862 3.684 1.00 . A A . 1 SER CA 1 1 7 4485 1 1 1 SER CB C -12.298 4.569 4.528 1.00 . A A . 1 SER CB 1 1 7 4486 1 1 1 SER HA H -11.868 6.672 4.294 1.00 . A A . 1 SER HA 1 1 7 4487 1 1 1 SER HB2 H -12.601 3.733 3.916 1.00 . A A . 1 SER HB2 1 1 7 4488 1 1 1 SER HB3 H -11.322 4.379 4.950 1.00 . A A . 1 SER HB3 1 1 7 4489 1 1 1 SER HG H -13.993 5.185 5.250 1.00 . A A . 1 SER HG 1 1 7 4490 1 1 1 SER N N -13.604 6.205 3.210 1.00 . A A . 1 SER N 1 1 7 4491 1 1 1 SER O O -11.361 4.750 1.706 1.00 . A A . 1 SER O 1 1 7 4492 1 1 1 SER OG O -13.233 4.710 5.596 1.00 . A A . 1 SER OG 1 1 7 4493 1 1 2 VAL C C -8.001 6.453 1.796 1.00 . A A . 2 VAL C 1 1 7 4494 1 1 2 VAL CA C -9.397 6.655 1.236 1.00 . A A . 2 VAL CA 1 1 7 4495 1 1 2 VAL CB C -9.455 7.990 0.427 1.00 . A A . 2 VAL CB 1 1 7 4496 1 1 2 VAL CG1 C -8.480 7.983 -0.747 1.00 . A A . 2 VAL CG1 1 1 7 4497 1 1 2 VAL CG2 C -10.881 8.282 -0.051 1.00 . A A . 2 VAL CG2 1 1 7 4498 1 1 2 VAL H H -10.294 7.388 2.991 1.00 . A A . 2 VAL H 1 1 7 4499 1 1 2 VAL HA H -9.631 5.830 0.578 1.00 . A A . 2 VAL HA 1 1 7 4500 1 1 2 VAL HB H -9.157 8.788 1.089 1.00 . A A . 2 VAL HB 1 1 7 4501 1 1 2 VAL HG11 H -8.587 8.909 -1.296 1.00 . A A . 2 VAL HG11 1 1 7 4502 1 1 2 VAL HG12 H -8.682 7.132 -1.381 1.00 . A A . 2 VAL HG12 1 1 7 4503 1 1 2 VAL HG13 H -7.470 7.911 -0.372 1.00 . A A . 2 VAL HG13 1 1 7 4504 1 1 2 VAL HG21 H -10.902 9.182 -0.650 1.00 . A A . 2 VAL HG21 1 1 7 4505 1 1 2 VAL HG22 H -11.528 8.394 0.807 1.00 . A A . 2 VAL HG22 1 1 7 4506 1 1 2 VAL HG23 H -11.235 7.449 -0.639 1.00 . A A . 2 VAL HG23 1 1 7 4507 1 1 2 VAL N N -10.355 6.660 2.338 1.00 . A A . 2 VAL N 1 1 7 4508 1 1 2 VAL O O -7.659 7.048 2.814 1.00 . A A . 2 VAL O 1 1 7 4509 1 1 3 CYS C C -4.888 6.328 1.029 1.00 . A A . 3 CYS C 1 1 7 4510 1 1 3 CYS CA C -5.882 5.317 1.645 1.00 . A A . 3 CYS CA 1 1 7 4511 1 1 3 CYS CB C -5.470 3.870 1.255 1.00 . A A . 3 CYS CB 1 1 7 4512 1 1 3 CYS H H -7.511 5.090 0.382 1.00 . A A . 3 CYS H 1 1 7 4513 1 1 3 CYS HA H -5.879 5.401 2.720 1.00 . A A . 3 CYS HA 1 1 7 4514 1 1 3 CYS HB2 H -4.987 3.393 2.096 1.00 . A A . 3 CYS HB2 1 1 7 4515 1 1 3 CYS HB3 H -6.358 3.308 1.001 1.00 . A A . 3 CYS HB3 1 1 7 4516 1 1 3 CYS N N -7.219 5.593 1.168 1.00 . A A . 3 CYS N 1 1 7 4517 1 1 3 CYS O O -5.284 7.209 0.255 1.00 . A A . 3 CYS O 1 1 7 4518 1 1 3 CYS SG S -4.330 3.765 -0.154 1.00 . A A . 3 CYS SG 1 1 7 4519 1 1 4 ALA C C -2.042 6.414 -0.501 1.00 . A A . 4 ALA C 1 1 7 4520 1 1 4 ALA CA C -2.590 7.014 0.809 1.00 . A A . 4 ALA CA 1 1 7 4521 1 1 4 ALA CB C -1.468 7.163 1.831 1.00 . A A . 4 ALA CB 1 1 7 4522 1 1 4 ALA H H -3.352 5.414 1.913 1.00 . A A . 4 ALA H 1 1 7 4523 1 1 4 ALA HA H -3.006 7.988 0.609 1.00 . A A . 4 ALA HA 1 1 7 4524 1 1 4 ALA HB1 H -1.875 7.569 2.743 1.00 . A A . 4 ALA HB1 1 1 7 4525 1 1 4 ALA HB2 H -0.695 7.814 1.454 1.00 . A A . 4 ALA HB2 1 1 7 4526 1 1 4 ALA HB3 H -1.041 6.193 2.037 1.00 . A A . 4 ALA HB3 1 1 7 4527 1 1 4 ALA N N -3.616 6.168 1.342 1.00 . A A . 4 ALA N 1 1 7 4528 1 1 4 ALA O O -1.618 5.273 -0.531 1.00 . A A . 4 ALA O 1 1 7 4529 1 1 5 ALA C C -1.991 7.983 -3.837 1.00 . A A . 5 ALA C 1 1 7 4530 1 1 5 ALA CA C -1.565 6.883 -2.896 1.00 . A A . 5 ALA CA 1 1 7 4531 1 1 5 ALA CB C -2.012 5.515 -3.459 1.00 . A A . 5 ALA CB 1 1 7 4532 1 1 5 ALA H H -2.767 7.941 -1.541 1.00 . A A . 5 ALA H 1 1 7 4533 1 1 5 ALA HA H -0.489 6.911 -2.793 1.00 . A A . 5 ALA HA 1 1 7 4534 1 1 5 ALA HB1 H -3.083 5.515 -3.579 1.00 . A A . 5 ALA HB1 1 1 7 4535 1 1 5 ALA HB2 H -1.738 4.725 -2.774 1.00 . A A . 5 ALA HB2 1 1 7 4536 1 1 5 ALA HB3 H -1.542 5.309 -4.410 1.00 . A A . 5 ALA HB3 1 1 7 4537 1 1 5 ALA N N -2.168 7.172 -1.586 1.00 . A A . 5 ALA N 1 1 7 4538 1 1 5 ALA O O -3.133 8.393 -3.787 1.00 . A A . 5 ALA O 1 1 7 4539 1 1 6 GLN C C -2.559 9.144 -6.511 1.00 . A A . 6 GLN C 1 1 7 4540 1 1 6 GLN CA C -1.366 9.556 -5.645 1.00 . A A . 6 GLN CA 1 1 7 4541 1 1 6 GLN CB C -0.128 9.850 -6.517 1.00 . A A . 6 GLN CB 1 1 7 4542 1 1 6 GLN CD C 2.278 10.684 -6.620 1.00 . A A . 6 GLN CD 1 1 7 4543 1 1 6 GLN CG C 1.048 10.475 -5.750 1.00 . A A . 6 GLN CG 1 1 7 4544 1 1 6 GLN H H -0.114 8.280 -4.533 1.00 . A A . 6 GLN H 1 1 7 4545 1 1 6 GLN HA H -1.630 10.449 -5.099 1.00 . A A . 6 GLN HA 1 1 7 4546 1 1 6 GLN HB2 H 0.221 8.916 -6.929 1.00 . A A . 6 GLN HB2 1 1 7 4547 1 1 6 GLN HB3 H -0.421 10.521 -7.309 1.00 . A A . 6 GLN HB3 1 1 7 4548 1 1 6 GLN HE21 H 2.837 12.245 -5.544 1.00 . A A . 6 GLN HE21 1 1 7 4549 1 1 6 GLN HE22 H 3.854 11.823 -6.880 1.00 . A A . 6 GLN HE22 1 1 7 4550 1 1 6 GLN HG2 H 0.742 11.435 -5.352 1.00 . A A . 6 GLN HG2 1 1 7 4551 1 1 6 GLN HG3 H 1.305 9.831 -4.924 1.00 . A A . 6 GLN HG3 1 1 7 4552 1 1 6 GLN N N -1.054 8.515 -4.637 1.00 . A A . 6 GLN N 1 1 7 4553 1 1 6 GLN NE2 N 3.070 11.678 -6.308 1.00 . A A . 6 GLN NE2 1 1 7 4554 1 1 6 GLN O O -3.431 9.951 -6.808 1.00 . A A . 6 GLN O 1 1 7 4555 1 1 6 GLN OE1 O 2.516 9.935 -7.550 1.00 . A A . 6 GLN OE1 1 1 7 4556 1 1 7 ASN C C -4.260 6.146 -6.847 1.00 . A A . 7 ASN C 1 1 7 4557 1 1 7 ASN CA C -3.715 7.330 -7.611 1.00 . A A . 7 ASN CA 1 1 7 4558 1 1 7 ASN CB C -3.397 6.906 -9.068 1.00 . A A . 7 ASN CB 1 1 7 4559 1 1 7 ASN CG C -3.022 8.054 -10.004 1.00 . A A . 7 ASN CG 1 1 7 4560 1 1 7 ASN H H -1.765 7.365 -6.727 1.00 . A A . 7 ASN H 1 1 7 4561 1 1 7 ASN HA H -4.476 8.094 -7.623 1.00 . A A . 7 ASN HA 1 1 7 4562 1 1 7 ASN HB2 H -2.585 6.193 -9.070 1.00 . A A . 7 ASN HB2 1 1 7 4563 1 1 7 ASN HB3 H -4.268 6.410 -9.471 1.00 . A A . 7 ASN HB3 1 1 7 4564 1 1 7 ASN HD21 H -1.944 6.821 -11.110 1.00 . A A . 7 ASN HD21 1 1 7 4565 1 1 7 ASN HD22 H -1.983 8.485 -11.614 1.00 . A A . 7 ASN HD22 1 1 7 4566 1 1 7 ASN N N -2.572 7.886 -6.911 1.00 . A A . 7 ASN N 1 1 7 4567 1 1 7 ASN ND2 N -2.238 7.755 -11.008 1.00 . A A . 7 ASN ND2 1 1 7 4568 1 1 7 ASN O O -3.800 5.014 -7.018 1.00 . A A . 7 ASN O 1 1 7 4569 1 1 7 ASN OD1 O -3.446 9.196 -9.833 1.00 . A A . 7 ASN OD1 1 1 7 4570 1 1 8 CYS C C -7.029 4.798 -5.931 1.00 . A A . 8 CYS C 1 1 7 4571 1 1 8 CYS CA C -5.774 5.275 -5.242 1.00 . A A . 8 CYS CA 1 1 7 4572 1 1 8 CYS CB C -6.033 5.559 -3.757 1.00 . A A . 8 CYS CB 1 1 7 4573 1 1 8 CYS H H -5.530 7.287 -5.773 1.00 . A A . 8 CYS H 1 1 7 4574 1 1 8 CYS HA H -5.049 4.483 -5.320 1.00 . A A . 8 CYS HA 1 1 7 4575 1 1 8 CYS HB2 H -5.118 5.828 -3.253 1.00 . A A . 8 CYS HB2 1 1 7 4576 1 1 8 CYS HB3 H -6.719 6.388 -3.692 1.00 . A A . 8 CYS HB3 1 1 7 4577 1 1 8 CYS N N -5.197 6.380 -5.955 1.00 . A A . 8 CYS N 1 1 7 4578 1 1 8 CYS O O -8.004 5.526 -6.049 1.00 . A A . 8 CYS O 1 1 7 4579 1 1 8 CYS SG S -6.808 4.141 -2.884 1.00 . A A . 8 CYS SG 1 1 7 4580 1 1 9 GLN C C -9.247 2.593 -6.112 1.00 . A A . 9 GLN C 1 1 7 4581 1 1 9 GLN CA C -8.072 2.887 -7.081 1.00 . A A . 9 GLN CA 1 1 7 4582 1 1 9 GLN CB C -7.539 1.557 -7.634 1.00 . A A . 9 GLN CB 1 1 7 4583 1 1 9 GLN CD C -5.830 0.335 -9.034 1.00 . A A . 9 GLN CD 1 1 7 4584 1 1 9 GLN CG C -6.345 1.687 -8.569 1.00 . A A . 9 GLN CG 1 1 7 4585 1 1 9 GLN H H -6.120 3.104 -6.276 1.00 . A A . 9 GLN H 1 1 7 4586 1 1 9 GLN HA H -8.394 3.506 -7.904 1.00 . A A . 9 GLN HA 1 1 7 4587 1 1 9 GLN HB2 H -7.220 0.970 -6.787 1.00 . A A . 9 GLN HB2 1 1 7 4588 1 1 9 GLN HB3 H -8.315 1.014 -8.159 1.00 . A A . 9 GLN HB3 1 1 7 4589 1 1 9 GLN HE21 H -3.970 1.024 -9.122 1.00 . A A . 9 GLN HE21 1 1 7 4590 1 1 9 GLN HE22 H -4.193 -0.606 -9.601 1.00 . A A . 9 GLN HE22 1 1 7 4591 1 1 9 GLN HG2 H -6.627 2.262 -9.437 1.00 . A A . 9 GLN HG2 1 1 7 4592 1 1 9 GLN HG3 H -5.540 2.196 -8.053 1.00 . A A . 9 GLN HG3 1 1 7 4593 1 1 9 GLN N N -6.973 3.563 -6.385 1.00 . A A . 9 GLN N 1 1 7 4594 1 1 9 GLN NE2 N -4.545 0.245 -9.269 1.00 . A A . 9 GLN NE2 1 1 7 4595 1 1 9 GLN O O -10.310 2.168 -6.525 1.00 . A A . 9 GLN O 1 1 7 4596 1 1 9 GLN OE1 O -6.580 -0.619 -9.157 1.00 . A A . 9 GLN OE1 1 1 7 4597 1 1 10 ARG C C -10.563 1.096 -3.765 1.00 . A A . 10 ARG C 1 1 7 4598 1 1 10 ARG CA C -9.950 2.533 -3.718 1.00 . A A . 10 ARG CA 1 1 7 4599 1 1 10 ARG CB C -11.035 3.624 -3.585 1.00 . A A . 10 ARG CB 1 1 7 4600 1 1 10 ARG CD C -11.539 6.023 -2.946 1.00 . A A . 10 ARG CD 1 1 7 4601 1 1 10 ARG CG C -10.464 4.985 -3.238 1.00 . A A . 10 ARG CG 1 1 7 4602 1 1 10 ARG CZ C -12.861 7.552 -4.367 1.00 . A A . 10 ARG CZ 1 1 7 4603 1 1 10 ARG H H -8.168 3.297 -4.613 1.00 . A A . 10 ARG H 1 1 7 4604 1 1 10 ARG HA H -9.350 2.544 -2.818 1.00 . A A . 10 ARG HA 1 1 7 4605 1 1 10 ARG HB2 H -11.587 3.715 -4.509 1.00 . A A . 10 ARG HB2 1 1 7 4606 1 1 10 ARG HB3 H -11.721 3.336 -2.804 1.00 . A A . 10 ARG HB3 1 1 7 4607 1 1 10 ARG HD2 H -12.163 5.652 -2.154 1.00 . A A . 10 ARG HD2 1 1 7 4608 1 1 10 ARG HD3 H -11.045 6.925 -2.617 1.00 . A A . 10 ARG HD3 1 1 7 4609 1 1 10 ARG HE H -12.610 5.578 -4.686 1.00 . A A . 10 ARG HE 1 1 7 4610 1 1 10 ARG HG2 H -9.805 4.900 -2.389 1.00 . A A . 10 ARG HG2 1 1 7 4611 1 1 10 ARG HG3 H -9.882 5.324 -4.081 1.00 . A A . 10 ARG HG3 1 1 7 4612 1 1 10 ARG HH11 H -12.007 8.482 -2.757 1.00 . A A . 10 ARG HH11 1 1 7 4613 1 1 10 ARG HH12 H -12.929 9.501 -3.763 1.00 . A A . 10 ARG HH12 1 1 7 4614 1 1 10 ARG HH21 H -13.856 6.952 -6.006 1.00 . A A . 10 ARG HH21 1 1 7 4615 1 1 10 ARG HH22 H -14.022 8.611 -5.667 1.00 . A A . 10 ARG HH22 1 1 7 4616 1 1 10 ARG N N -9.007 2.837 -4.819 1.00 . A A . 10 ARG N 1 1 7 4617 1 1 10 ARG NE N -12.381 6.333 -4.094 1.00 . A A . 10 ARG NE 1 1 7 4618 1 1 10 ARG NH1 N -12.575 8.581 -3.574 1.00 . A A . 10 ARG NH1 1 1 7 4619 1 1 10 ARG NH2 N -13.625 7.727 -5.409 1.00 . A A . 10 ARG NH2 1 1 7 4620 1 1 10 ARG O O -11.751 0.927 -3.548 1.00 . A A . 10 ARG O 1 1 7 4621 1 1 11 PRO C C -10.552 -1.903 -2.693 1.00 . A A . 11 PRO C 1 1 7 4622 1 1 11 PRO CA C -10.234 -1.338 -4.071 1.00 . A A . 11 PRO CA 1 1 7 4623 1 1 11 PRO CB C -9.068 -2.139 -4.690 1.00 . A A . 11 PRO CB 1 1 7 4624 1 1 11 PRO CD C -8.285 0.050 -4.176 1.00 . A A . 11 PRO CD 1 1 7 4625 1 1 11 PRO CG C -8.048 -1.123 -5.075 1.00 . A A . 11 PRO CG 1 1 7 4626 1 1 11 PRO HA H -11.107 -1.411 -4.700 1.00 . A A . 11 PRO HA 1 1 7 4627 1 1 11 PRO HB2 H -8.670 -2.807 -3.939 1.00 . A A . 11 PRO HB2 1 1 7 4628 1 1 11 PRO HB3 H -9.415 -2.707 -5.539 1.00 . A A . 11 PRO HB3 1 1 7 4629 1 1 11 PRO HD2 H -7.777 -0.075 -3.232 1.00 . A A . 11 PRO HD2 1 1 7 4630 1 1 11 PRO HD3 H -7.978 0.968 -4.654 1.00 . A A . 11 PRO HD3 1 1 7 4631 1 1 11 PRO HG2 H -7.049 -1.499 -4.906 1.00 . A A . 11 PRO HG2 1 1 7 4632 1 1 11 PRO HG3 H -8.178 -0.833 -6.109 1.00 . A A . 11 PRO HG3 1 1 7 4633 1 1 11 PRO N N -9.731 0.025 -3.995 1.00 . A A . 11 PRO N 1 1 7 4634 1 1 11 PRO O O -9.720 -1.811 -1.748 1.00 . A A . 11 PRO O 1 1 7 4635 1 1 12 CYS C C -12.462 -4.571 -1.674 1.00 . A A . 12 CYS C 1 1 7 4636 1 1 12 CYS CA C -12.157 -3.105 -1.375 1.00 . A A . 12 CYS CA 1 1 7 4637 1 1 12 CYS CB C -13.407 -2.377 -0.831 1.00 . A A . 12 CYS CB 1 1 7 4638 1 1 12 CYS H H -12.347 -2.494 -3.330 1.00 . A A . 12 CYS H 1 1 7 4639 1 1 12 CYS HA H -11.367 -3.051 -0.640 1.00 . A A . 12 CYS HA 1 1 7 4640 1 1 12 CYS HB2 H -13.151 -1.341 -0.651 1.00 . A A . 12 CYS HB2 1 1 7 4641 1 1 12 CYS HB3 H -14.192 -2.412 -1.574 1.00 . A A . 12 CYS HB3 1 1 7 4642 1 1 12 CYS HG H -13.385 -2.532 1.728 1.00 . A A . 12 CYS HG 1 1 7 4643 1 1 12 CYS N N -11.716 -2.482 -2.578 1.00 . A A . 12 CYS N 1 1 7 4644 1 1 12 CYS O O -13.339 -4.882 -2.497 1.00 . A A . 12 CYS O 1 1 7 4645 1 1 12 CYS SG S -14.063 -3.047 0.714 1.00 . A A . 12 CYS SG 1 1 7 4646 1 1 13 LYS C C -11.482 -7.555 0.099 1.00 . A A . 13 LYS C 1 1 7 4647 1 1 13 LYS CA C -11.855 -6.899 -1.203 1.00 . A A . 13 LYS CA 1 1 7 4648 1 1 13 LYS CB C -10.994 -7.510 -2.339 1.00 . A A . 13 LYS CB 1 1 7 4649 1 1 13 LYS CD C -10.484 -7.757 -4.789 1.00 . A A . 13 LYS CD 1 1 7 4650 1 1 13 LYS CE C -10.828 -7.299 -6.191 1.00 . A A . 13 LYS CE 1 1 7 4651 1 1 13 LYS CG C -11.296 -7.004 -3.742 1.00 . A A . 13 LYS CG 1 1 7 4652 1 1 13 LYS H H -10.971 -5.170 -0.461 1.00 . A A . 13 LYS H 1 1 7 4653 1 1 13 LYS HA H -12.895 -7.082 -1.400 1.00 . A A . 13 LYS HA 1 1 7 4654 1 1 13 LYS HB2 H -9.955 -7.303 -2.131 1.00 . A A . 13 LYS HB2 1 1 7 4655 1 1 13 LYS HB3 H -11.146 -8.580 -2.321 1.00 . A A . 13 LYS HB3 1 1 7 4656 1 1 13 LYS HD2 H -9.432 -7.588 -4.614 1.00 . A A . 13 LYS HD2 1 1 7 4657 1 1 13 LYS HD3 H -10.682 -8.815 -4.703 1.00 . A A . 13 LYS HD3 1 1 7 4658 1 1 13 LYS HE2 H -11.891 -7.426 -6.326 1.00 . A A . 13 LYS HE2 1 1 7 4659 1 1 13 LYS HE3 H -10.571 -6.256 -6.294 1.00 . A A . 13 LYS HE3 1 1 7 4660 1 1 13 LYS HG2 H -12.349 -7.143 -3.937 1.00 . A A . 13 LYS HG2 1 1 7 4661 1 1 13 LYS HG3 H -11.054 -5.950 -3.792 1.00 . A A . 13 LYS HG3 1 1 7 4662 1 1 13 LYS HZ1 H -10.365 -7.746 -8.180 1.00 . A A . 13 LYS HZ1 1 1 7 4663 1 1 13 LYS HZ2 H -10.391 -9.091 -7.160 1.00 . A A . 13 LYS HZ2 1 1 7 4664 1 1 13 LYS HZ3 H -9.090 -8.039 -7.112 1.00 . A A . 13 LYS HZ3 1 1 7 4665 1 1 13 LYS N N -11.684 -5.459 -1.067 1.00 . A A . 13 LYS N 1 1 7 4666 1 1 13 LYS NZ N -10.121 -8.086 -7.229 1.00 . A A . 13 LYS NZ 1 1 7 4667 1 1 13 LYS O O -10.739 -6.976 0.889 1.00 . A A . 13 LYS O 1 1 7 4668 1 1 14 ASP C C -10.308 -10.181 1.426 1.00 . A A . 14 ASP C 1 1 7 4669 1 1 14 ASP CA C -11.687 -9.551 1.530 1.00 . A A . 14 ASP CA 1 1 7 4670 1 1 14 ASP CB C -12.742 -10.644 1.789 1.00 . A A . 14 ASP CB 1 1 7 4671 1 1 14 ASP CG C -14.114 -10.086 2.119 1.00 . A A . 14 ASP CG 1 1 7 4672 1 1 14 ASP H H -12.627 -9.137 -0.334 1.00 . A A . 14 ASP H 1 1 7 4673 1 1 14 ASP HA H -11.700 -8.855 2.358 1.00 . A A . 14 ASP HA 1 1 7 4674 1 1 14 ASP HB2 H -12.830 -11.274 0.916 1.00 . A A . 14 ASP HB2 1 1 7 4675 1 1 14 ASP HB3 H -12.402 -11.236 2.625 1.00 . A A . 14 ASP HB3 1 1 7 4676 1 1 14 ASP N N -11.997 -8.765 0.321 1.00 . A A . 14 ASP N 1 1 7 4677 1 1 14 ASP O O -9.773 -10.717 2.395 1.00 . A A . 14 ASP O 1 1 7 4678 1 1 14 ASP OD1 O -14.380 -9.826 3.306 1.00 . A A . 14 ASP OD1 1 1 7 4679 1 1 14 ASP OD2 O -14.933 -9.904 1.182 1.00 . A A . 14 ASP OD2 1 1 7 4680 1 1 15 LYS C C -7.527 -9.518 -0.550 1.00 . A A . 15 LYS C 1 1 7 4681 1 1 15 LYS CA C -8.411 -10.607 0.016 1.00 . A A . 15 LYS CA 1 1 7 4682 1 1 15 LYS CB C -8.370 -11.836 -0.913 1.00 . A A . 15 LYS CB 1 1 7 4683 1 1 15 LYS CD C -8.805 -14.242 -1.339 1.00 . A A . 15 LYS CD 1 1 7 4684 1 1 15 LYS CE C -9.528 -15.509 -0.926 1.00 . A A . 15 LYS CE 1 1 7 4685 1 1 15 LYS CG C -9.130 -13.064 -0.437 1.00 . A A . 15 LYS CG 1 1 7 4686 1 1 15 LYS H H -10.216 -9.647 -0.475 1.00 . A A . 15 LYS H 1 1 7 4687 1 1 15 LYS HA H -8.010 -10.884 0.978 1.00 . A A . 15 LYS HA 1 1 7 4688 1 1 15 LYS HB2 H -8.788 -11.542 -1.863 1.00 . A A . 15 LYS HB2 1 1 7 4689 1 1 15 LYS HB3 H -7.337 -12.117 -1.057 1.00 . A A . 15 LYS HB3 1 1 7 4690 1 1 15 LYS HD2 H -9.100 -13.996 -2.349 1.00 . A A . 15 LYS HD2 1 1 7 4691 1 1 15 LYS HD3 H -7.737 -14.414 -1.324 1.00 . A A . 15 LYS HD3 1 1 7 4692 1 1 15 LYS HE2 H -9.123 -16.341 -1.481 1.00 . A A . 15 LYS HE2 1 1 7 4693 1 1 15 LYS HE3 H -9.368 -15.676 0.130 1.00 . A A . 15 LYS HE3 1 1 7 4694 1 1 15 LYS HG2 H -8.828 -13.293 0.575 1.00 . A A . 15 LYS HG2 1 1 7 4695 1 1 15 LYS HG3 H -10.194 -12.877 -0.467 1.00 . A A . 15 LYS HG3 1 1 7 4696 1 1 15 LYS HZ1 H -11.451 -14.616 -0.758 1.00 . A A . 15 LYS HZ1 1 1 7 4697 1 1 15 LYS HZ2 H -11.446 -16.311 -0.841 1.00 . A A . 15 LYS HZ2 1 1 7 4698 1 1 15 LYS HZ3 H -11.153 -15.406 -2.211 1.00 . A A . 15 LYS HZ3 1 1 7 4699 1 1 15 LYS N N -9.732 -10.103 0.241 1.00 . A A . 15 LYS N 1 1 7 4700 1 1 15 LYS NZ N -10.988 -15.445 -1.182 1.00 . A A . 15 LYS NZ 1 1 7 4701 1 1 15 LYS O O -7.415 -9.371 -1.768 1.00 . A A . 15 LYS O 1 1 7 4702 1 1 16 VAL C C -5.398 -7.012 1.162 1.00 . A A . 16 VAL C 1 1 7 4703 1 1 16 VAL CA C -6.039 -7.664 -0.060 1.00 . A A . 16 VAL CA 1 1 7 4704 1 1 16 VAL CB C -6.671 -6.577 -1.014 1.00 . A A . 16 VAL CB 1 1 7 4705 1 1 16 VAL CG1 C -7.873 -5.910 -0.378 1.00 . A A . 16 VAL CG1 1 1 7 4706 1 1 16 VAL CG2 C -5.627 -5.543 -1.420 1.00 . A A . 16 VAL CG2 1 1 7 4707 1 1 16 VAL H H -7.179 -8.811 1.285 1.00 . A A . 16 VAL H 1 1 7 4708 1 1 16 VAL HA H -5.241 -8.167 -0.590 1.00 . A A . 16 VAL HA 1 1 7 4709 1 1 16 VAL HB H -7.024 -7.072 -1.905 1.00 . A A . 16 VAL HB 1 1 7 4710 1 1 16 VAL HG11 H -8.659 -6.635 -0.212 1.00 . A A . 16 VAL HG11 1 1 7 4711 1 1 16 VAL HG12 H -8.225 -5.086 -0.976 1.00 . A A . 16 VAL HG12 1 1 7 4712 1 1 16 VAL HG13 H -7.501 -5.579 0.583 1.00 . A A . 16 VAL HG13 1 1 7 4713 1 1 16 VAL HG21 H -5.255 -5.063 -0.530 1.00 . A A . 16 VAL HG21 1 1 7 4714 1 1 16 VAL HG22 H -6.064 -4.805 -2.077 1.00 . A A . 16 VAL HG22 1 1 7 4715 1 1 16 VAL HG23 H -4.805 -6.041 -1.917 1.00 . A A . 16 VAL HG23 1 1 7 4716 1 1 16 VAL N N -6.966 -8.715 0.329 1.00 . A A . 16 VAL N 1 1 7 4717 1 1 16 VAL O O -5.990 -6.201 1.848 1.00 . A A . 16 VAL O 1 1 7 4718 1 1 17 ASP C C -2.875 -5.521 2.143 1.00 . A A . 17 ASP C 1 1 7 4719 1 1 17 ASP CA C -3.431 -6.890 2.524 1.00 . A A . 17 ASP CA 1 1 7 4720 1 1 17 ASP CB C -2.336 -7.850 2.981 1.00 . A A . 17 ASP CB 1 1 7 4721 1 1 17 ASP CG C -2.919 -9.061 3.656 1.00 . A A . 17 ASP CG 1 1 7 4722 1 1 17 ASP H H -3.983 -8.288 1.014 1.00 . A A . 17 ASP H 1 1 7 4723 1 1 17 ASP HA H -4.106 -6.725 3.354 1.00 . A A . 17 ASP HA 1 1 7 4724 1 1 17 ASP HB2 H -1.788 -8.199 2.116 1.00 . A A . 17 ASP HB2 1 1 7 4725 1 1 17 ASP HB3 H -1.668 -7.356 3.665 1.00 . A A . 17 ASP HB3 1 1 7 4726 1 1 17 ASP N N -4.242 -7.466 1.469 1.00 . A A . 17 ASP N 1 1 7 4727 1 1 17 ASP O O -2.575 -5.244 0.961 1.00 . A A . 17 ASP O 1 1 7 4728 1 1 17 ASP OD1 O -3.135 -9.021 4.890 1.00 . A A . 17 ASP OD1 1 1 7 4729 1 1 17 ASP OD2 O -3.213 -10.052 2.959 1.00 . A A . 17 ASP OD2 1 1 7 4730 1 1 18 TRP C C -0.947 -3.118 3.525 1.00 . A A . 18 TRP C 1 1 7 4731 1 1 18 TRP CA C -2.358 -3.290 3.014 1.00 . A A . 18 TRP CA 1 1 7 4732 1 1 18 TRP CB C -3.310 -2.401 3.835 1.00 . A A . 18 TRP CB 1 1 7 4733 1 1 18 TRP CD1 C -5.527 -3.555 3.213 1.00 . A A . 18 TRP CD1 1 1 7 4734 1 1 18 TRP CD2 C -5.611 -1.327 3.156 1.00 . A A . 18 TRP CD2 1 1 7 4735 1 1 18 TRP CE2 C -6.873 -1.837 2.780 1.00 . A A . 18 TRP CE2 1 1 7 4736 1 1 18 TRP CE3 C -5.435 0.055 3.202 1.00 . A A . 18 TRP CE3 1 1 7 4737 1 1 18 TRP CG C -4.751 -2.443 3.397 1.00 . A A . 18 TRP CG 1 1 7 4738 1 1 18 TRP CH2 C -7.738 0.338 2.528 1.00 . A A . 18 TRP CH2 1 1 7 4739 1 1 18 TRP CZ2 C -7.946 -1.012 2.464 1.00 . A A . 18 TRP CZ2 1 1 7 4740 1 1 18 TRP CZ3 C -6.494 0.871 2.895 1.00 . A A . 18 TRP CZ3 1 1 7 4741 1 1 18 TRP H H -2.919 -5.018 4.051 1.00 . A A . 18 TRP H 1 1 7 4742 1 1 18 TRP HA H -2.417 -3.002 1.976 1.00 . A A . 18 TRP HA 1 1 7 4743 1 1 18 TRP HB2 H -3.285 -2.721 4.867 1.00 . A A . 18 TRP HB2 1 1 7 4744 1 1 18 TRP HB3 H -2.967 -1.379 3.785 1.00 . A A . 18 TRP HB3 1 1 7 4745 1 1 18 TRP HD1 H -5.170 -4.569 3.329 1.00 . A A . 18 TRP HD1 1 1 7 4746 1 1 18 TRP HE1 H -7.478 -3.868 2.588 1.00 . A A . 18 TRP HE1 1 1 7 4747 1 1 18 TRP HE3 H -4.483 0.481 3.488 1.00 . A A . 18 TRP HE3 1 1 7 4748 1 1 18 TRP HH2 H -8.538 1.025 2.291 1.00 . A A . 18 TRP HH2 1 1 7 4749 1 1 18 TRP HZ2 H -8.912 -1.402 2.182 1.00 . A A . 18 TRP HZ2 1 1 7 4750 1 1 18 TRP HZ3 H -6.362 1.943 2.928 1.00 . A A . 18 TRP HZ3 1 1 7 4751 1 1 18 TRP N N -2.756 -4.684 3.147 1.00 . A A . 18 TRP N 1 1 7 4752 1 1 18 TRP NE1 N -6.780 -3.206 2.800 1.00 . A A . 18 TRP NE1 1 1 7 4753 1 1 18 TRP O O -0.459 -3.952 4.284 1.00 . A A . 18 TRP O 1 1 7 4754 1 1 19 VAL C C 1.207 -0.424 4.166 1.00 . A A . 19 VAL C 1 1 7 4755 1 1 19 VAL CA C 1.080 -1.813 3.540 1.00 . A A . 19 VAL CA 1 1 7 4756 1 1 19 VAL CB C 2.101 -1.970 2.354 1.00 . A A . 19 VAL CB 1 1 7 4757 1 1 19 VAL CG1 C 2.145 -3.406 1.870 1.00 . A A . 19 VAL CG1 1 1 7 4758 1 1 19 VAL CG2 C 1.734 -1.050 1.190 1.00 . A A . 19 VAL CG2 1 1 7 4759 1 1 19 VAL H H -0.653 -1.343 2.550 1.00 . A A . 19 VAL H 1 1 7 4760 1 1 19 VAL HA H 1.323 -2.547 4.294 1.00 . A A . 19 VAL HA 1 1 7 4761 1 1 19 VAL HB H 3.084 -1.700 2.708 1.00 . A A . 19 VAL HB 1 1 7 4762 1 1 19 VAL HG11 H 2.452 -4.077 2.658 1.00 . A A . 19 VAL HG11 1 1 7 4763 1 1 19 VAL HG12 H 2.853 -3.474 1.056 1.00 . A A . 19 VAL HG12 1 1 7 4764 1 1 19 VAL HG13 H 1.160 -3.682 1.527 1.00 . A A . 19 VAL HG13 1 1 7 4765 1 1 19 VAL HG21 H 2.452 -1.158 0.393 1.00 . A A . 19 VAL HG21 1 1 7 4766 1 1 19 VAL HG22 H 1.729 -0.032 1.543 1.00 . A A . 19 VAL HG22 1 1 7 4767 1 1 19 VAL HG23 H 0.752 -1.313 0.828 1.00 . A A . 19 VAL HG23 1 1 7 4768 1 1 19 VAL N N -0.285 -2.058 3.116 1.00 . A A . 19 VAL N 1 1 7 4769 1 1 19 VAL O O 0.685 0.557 3.632 1.00 . A A . 19 VAL O 1 1 7 4770 1 1 20 GLN C C 3.518 1.328 5.619 1.00 . A A . 20 GLN C 1 1 7 4771 1 1 20 GLN CA C 2.093 0.912 5.944 1.00 . A A . 20 GLN CA 1 1 7 4772 1 1 20 GLN CB C 1.900 0.781 7.482 1.00 . A A . 20 GLN CB 1 1 7 4773 1 1 20 GLN CD C 1.975 1.987 9.777 1.00 . A A . 20 GLN CD 1 1 7 4774 1 1 20 GLN CG C 2.218 2.070 8.265 1.00 . A A . 20 GLN CG 1 1 7 4775 1 1 20 GLN H H 2.195 -1.158 5.731 1.00 . A A . 20 GLN H 1 1 7 4776 1 1 20 GLN HA H 1.391 1.637 5.551 1.00 . A A . 20 GLN HA 1 1 7 4777 1 1 20 GLN HB2 H 0.872 0.507 7.667 1.00 . A A . 20 GLN HB2 1 1 7 4778 1 1 20 GLN HB3 H 2.530 -0.014 7.855 1.00 . A A . 20 GLN HB3 1 1 7 4779 1 1 20 GLN HE21 H 3.391 3.346 10.124 1.00 . A A . 20 GLN HE21 1 1 7 4780 1 1 20 GLN HE22 H 2.575 2.756 11.510 1.00 . A A . 20 GLN HE22 1 1 7 4781 1 1 20 GLN HG2 H 3.265 2.283 8.121 1.00 . A A . 20 GLN HG2 1 1 7 4782 1 1 20 GLN HG3 H 1.633 2.876 7.847 1.00 . A A . 20 GLN HG3 1 1 7 4783 1 1 20 GLN N N 1.847 -0.355 5.296 1.00 . A A . 20 GLN N 1 1 7 4784 1 1 20 GLN NE2 N 2.724 2.764 10.543 1.00 . A A . 20 GLN NE2 1 1 7 4785 1 1 20 GLN O O 4.401 0.480 5.594 1.00 . A A . 20 GLN O 1 1 7 4786 1 1 20 GLN OE1 O 1.119 1.250 10.249 1.00 . A A . 20 GLN OE1 1 1 7 4787 1 1 21 CYS C C 5.776 3.402 6.393 1.00 . A A . 21 CYS C 1 1 7 4788 1 1 21 CYS CA C 5.116 3.014 5.079 1.00 . A A . 21 CYS CA 1 1 7 4789 1 1 21 CYS CB C 5.244 4.130 4.008 1.00 . A A . 21 CYS CB 1 1 7 4790 1 1 21 CYS H H 2.983 3.207 5.252 1.00 . A A . 21 CYS H 1 1 7 4791 1 1 21 CYS HA H 5.646 2.135 4.742 1.00 . A A . 21 CYS HA 1 1 7 4792 1 1 21 CYS HB2 H 6.270 4.334 3.776 1.00 . A A . 21 CYS HB2 1 1 7 4793 1 1 21 CYS HB3 H 4.766 3.786 3.108 1.00 . A A . 21 CYS HB3 1 1 7 4794 1 1 21 CYS N N 3.752 2.597 5.313 1.00 . A A . 21 CYS N 1 1 7 4795 1 1 21 CYS O O 5.528 4.480 6.960 1.00 . A A . 21 CYS O 1 1 7 4796 1 1 21 CYS SG S 4.519 5.714 4.418 1.00 . A A . 21 CYS SG 1 1 7 4797 1 1 22 ASP C C 8.552 3.601 7.980 1.00 . A A . 22 ASP C 1 1 7 4798 1 1 22 ASP CA C 7.320 2.710 8.153 1.00 . A A . 22 ASP CA 1 1 7 4799 1 1 22 ASP CB C 7.722 1.353 8.794 1.00 . A A . 22 ASP CB 1 1 7 4800 1 1 22 ASP CG C 6.564 0.560 9.420 1.00 . A A . 22 ASP CG 1 1 7 4801 1 1 22 ASP H H 6.832 1.728 6.342 1.00 . A A . 22 ASP H 1 1 7 4802 1 1 22 ASP HA H 6.622 3.212 8.803 1.00 . A A . 22 ASP HA 1 1 7 4803 1 1 22 ASP HB2 H 8.146 0.733 8.020 1.00 . A A . 22 ASP HB2 1 1 7 4804 1 1 22 ASP HB3 H 8.469 1.524 9.556 1.00 . A A . 22 ASP HB3 1 1 7 4805 1 1 22 ASP N N 6.622 2.527 6.871 1.00 . A A . 22 ASP N 1 1 7 4806 1 1 22 ASP O O 9.402 3.692 8.865 1.00 . A A . 22 ASP O 1 1 7 4807 1 1 22 ASP OD1 O 5.845 -0.155 8.706 1.00 . A A . 22 ASP OD1 1 1 7 4808 1 1 22 ASP OD2 O 6.390 0.642 10.668 1.00 . A A . 22 ASP OD2 1 1 7 4809 1 1 23 GLY C C 9.482 6.592 7.163 1.00 . A A . 23 GLY C 1 1 7 4810 1 1 23 GLY CA C 9.690 5.197 6.572 1.00 . A A . 23 GLY CA 1 1 7 4811 1 1 23 GLY H H 7.813 4.269 6.267 1.00 . A A . 23 GLY H 1 1 7 4812 1 1 23 GLY HA2 H 10.588 4.765 6.983 1.00 . A A . 23 GLY HA2 1 1 7 4813 1 1 23 GLY HA3 H 9.806 5.282 5.501 1.00 . A A . 23 GLY HA3 1 1 7 4814 1 1 23 GLY N N 8.590 4.326 6.855 1.00 . A A . 23 GLY N 1 1 7 4815 1 1 23 GLY O O 10.382 7.428 7.116 1.00 . A A . 23 GLY O 1 1 7 4816 1 1 24 GLY C C 6.630 8.755 8.193 1.00 . A A . 24 GLY C 1 1 7 4817 1 1 24 GLY CA C 8.045 8.162 8.327 1.00 . A A . 24 GLY CA 1 1 7 4818 1 1 24 GLY H H 7.598 6.149 7.724 1.00 . A A . 24 GLY H 1 1 7 4819 1 1 24 GLY HA2 H 8.249 8.081 9.386 1.00 . A A . 24 GLY HA2 1 1 7 4820 1 1 24 GLY HA3 H 8.749 8.869 7.913 1.00 . A A . 24 GLY HA3 1 1 7 4821 1 1 24 GLY N N 8.276 6.855 7.712 1.00 . A A . 24 GLY N 1 1 7 4822 1 1 24 GLY O O 6.333 9.728 8.873 1.00 . A A . 24 GLY O 1 1 7 4823 1 1 25 CYS C C 3.401 8.048 8.085 1.00 . A A . 25 CYS C 1 1 7 4824 1 1 25 CYS CA C 4.397 8.808 7.199 1.00 . A A . 25 CYS CA 1 1 7 4825 1 1 25 CYS CB C 3.875 8.762 5.755 1.00 . A A . 25 CYS CB 1 1 7 4826 1 1 25 CYS H H 6.031 7.467 6.763 1.00 . A A . 25 CYS H 1 1 7 4827 1 1 25 CYS HA H 4.452 9.836 7.530 1.00 . A A . 25 CYS HA 1 1 7 4828 1 1 25 CYS HB2 H 3.612 7.743 5.522 1.00 . A A . 25 CYS HB2 1 1 7 4829 1 1 25 CYS HB3 H 2.983 9.366 5.687 1.00 . A A . 25 CYS HB3 1 1 7 4830 1 1 25 CYS N N 5.763 8.215 7.322 1.00 . A A . 25 CYS N 1 1 7 4831 1 1 25 CYS O O 2.405 8.602 8.527 1.00 . A A . 25 CYS O 1 1 7 4832 1 1 25 CYS SG S 5.020 9.319 4.480 1.00 . A A . 25 CYS SG 1 1 7 4833 1 1 26 ASP C C 1.478 5.613 8.379 1.00 . A A . 26 ASP C 1 1 7 4834 1 1 26 ASP CA C 2.814 5.832 9.089 1.00 . A A . 26 ASP CA 1 1 7 4835 1 1 26 ASP CB C 2.541 6.315 10.538 1.00 . A A . 26 ASP CB 1 1 7 4836 1 1 26 ASP CG C 3.766 6.417 11.415 1.00 . A A . 26 ASP CG 1 1 7 4837 1 1 26 ASP H H 4.571 6.455 7.999 1.00 . A A . 26 ASP H 1 1 7 4838 1 1 26 ASP HA H 3.313 4.878 9.128 1.00 . A A . 26 ASP HA 1 1 7 4839 1 1 26 ASP HB2 H 2.043 7.270 10.519 1.00 . A A . 26 ASP HB2 1 1 7 4840 1 1 26 ASP HB3 H 1.862 5.605 10.988 1.00 . A A . 26 ASP HB3 1 1 7 4841 1 1 26 ASP N N 3.698 6.758 8.320 1.00 . A A . 26 ASP N 1 1 7 4842 1 1 26 ASP O O 0.533 5.103 8.973 1.00 . A A . 26 ASP O 1 1 7 4843 1 1 26 ASP OD1 O 4.428 7.464 11.410 1.00 . A A . 26 ASP OD1 1 1 7 4844 1 1 26 ASP OD2 O 4.048 5.455 12.159 1.00 . A A . 26 ASP OD2 1 1 7 4845 1 1 27 GLU C C 0.037 4.508 5.671 1.00 . A A . 27 GLU C 1 1 7 4846 1 1 27 GLU CA C 0.177 5.853 6.365 1.00 . A A . 27 GLU CA 1 1 7 4847 1 1 27 GLU CB C -0.009 7.047 5.410 1.00 . A A . 27 GLU CB 1 1 7 4848 1 1 27 GLU CD C -0.410 9.579 5.259 1.00 . A A . 27 GLU CD 1 1 7 4849 1 1 27 GLU CG C -0.095 8.386 6.152 1.00 . A A . 27 GLU CG 1 1 7 4850 1 1 27 GLU H H 2.218 6.284 6.661 1.00 . A A . 27 GLU H 1 1 7 4851 1 1 27 GLU HA H -0.614 5.890 7.102 1.00 . A A . 27 GLU HA 1 1 7 4852 1 1 27 GLU HB2 H 0.843 7.085 4.750 1.00 . A A . 27 GLU HB2 1 1 7 4853 1 1 27 GLU HB3 H -0.900 6.914 4.816 1.00 . A A . 27 GLU HB3 1 1 7 4854 1 1 27 GLU HG2 H -0.871 8.308 6.895 1.00 . A A . 27 GLU HG2 1 1 7 4855 1 1 27 GLU HG3 H 0.856 8.551 6.640 1.00 . A A . 27 GLU HG3 1 1 7 4856 1 1 27 GLU N N 1.416 5.957 7.109 1.00 . A A . 27 GLU N 1 1 7 4857 1 1 27 GLU O O 1.030 3.799 5.450 1.00 . A A . 27 GLU O 1 1 7 4858 1 1 27 GLU OE1 O 0.512 10.104 4.608 1.00 . A A . 27 GLU OE1 1 1 7 4859 1 1 27 GLU OE2 O -1.580 10.021 5.228 1.00 . A A . 27 GLU OE2 1 1 7 4860 1 1 28 TRP C C -1.872 3.012 3.295 1.00 . A A . 28 TRP C 1 1 7 4861 1 1 28 TRP CA C -1.549 2.889 4.763 1.00 . A A . 28 TRP CA 1 1 7 4862 1 1 28 TRP CB C -2.723 2.258 5.523 1.00 . A A . 28 TRP CB 1 1 7 4863 1 1 28 TRP CD1 C -2.331 2.604 8.039 1.00 . A A . 28 TRP CD1 1 1 7 4864 1 1 28 TRP CD2 C -1.963 0.524 7.316 1.00 . A A . 28 TRP CD2 1 1 7 4865 1 1 28 TRP CE2 C -1.703 0.569 8.692 1.00 . A A . 28 TRP CE2 1 1 7 4866 1 1 28 TRP CE3 C -1.800 -0.689 6.634 1.00 . A A . 28 TRP CE3 1 1 7 4867 1 1 28 TRP CG C -2.360 1.833 6.913 1.00 . A A . 28 TRP CG 1 1 7 4868 1 1 28 TRP CH2 C -1.139 -1.728 8.718 1.00 . A A . 28 TRP CH2 1 1 7 4869 1 1 28 TRP CZ2 C -1.297 -0.556 9.410 1.00 . A A . 28 TRP CZ2 1 1 7 4870 1 1 28 TRP CZ3 C -1.392 -1.802 7.349 1.00 . A A . 28 TRP CZ3 1 1 7 4871 1 1 28 TRP H H -1.876 4.864 5.470 1.00 . A A . 28 TRP H 1 1 7 4872 1 1 28 TRP HA H -0.692 2.239 4.870 1.00 . A A . 28 TRP HA 1 1 7 4873 1 1 28 TRP HB2 H -3.527 2.974 5.580 1.00 . A A . 28 TRP HB2 1 1 7 4874 1 1 28 TRP HB3 H -3.077 1.390 4.988 1.00 . A A . 28 TRP HB3 1 1 7 4875 1 1 28 TRP HD1 H -2.580 3.657 8.066 1.00 . A A . 28 TRP HD1 1 1 7 4876 1 1 28 TRP HE1 H -1.829 2.181 10.025 1.00 . A A . 28 TRP HE1 1 1 7 4877 1 1 28 TRP HE3 H -1.989 -0.754 5.572 1.00 . A A . 28 TRP HE3 1 1 7 4878 1 1 28 TRP HH2 H -0.829 -2.625 9.235 1.00 . A A . 28 TRP HH2 1 1 7 4879 1 1 28 TRP HZ2 H -1.099 -0.515 10.473 1.00 . A A . 28 TRP HZ2 1 1 7 4880 1 1 28 TRP HZ3 H -1.255 -2.750 6.847 1.00 . A A . 28 TRP HZ3 1 1 7 4881 1 1 28 TRP N N -1.198 4.170 5.342 1.00 . A A . 28 TRP N 1 1 7 4882 1 1 28 TRP NE1 N -1.934 1.850 9.110 1.00 . A A . 28 TRP NE1 1 1 7 4883 1 1 28 TRP O O -2.706 3.828 2.897 1.00 . A A . 28 TRP O 1 1 7 4884 1 1 29 PHE C C -1.855 0.822 0.634 1.00 . A A . 29 PHE C 1 1 7 4885 1 1 29 PHE CA C -1.342 2.206 1.070 1.00 . A A . 29 PHE CA 1 1 7 4886 1 1 29 PHE CB C 0.047 2.455 0.396 1.00 . A A . 29 PHE CB 1 1 7 4887 1 1 29 PHE CD1 C 1.323 3.668 2.197 1.00 . A A . 29 PHE CD1 1 1 7 4888 1 1 29 PHE CD2 C 1.081 4.760 0.106 1.00 . A A . 29 PHE CD2 1 1 7 4889 1 1 29 PHE CE1 C 2.039 4.718 2.672 1.00 . A A . 29 PHE CE1 1 1 7 4890 1 1 29 PHE CE2 C 1.802 5.833 0.593 1.00 . A A . 29 PHE CE2 1 1 7 4891 1 1 29 PHE CG C 0.825 3.660 0.912 1.00 . A A . 29 PHE CG 1 1 7 4892 1 1 29 PHE CZ C 2.280 5.802 1.884 1.00 . A A . 29 PHE CZ 1 1 7 4893 1 1 29 PHE H H -0.540 1.614 2.929 1.00 . A A . 29 PHE H 1 1 7 4894 1 1 29 PHE HA H -2.033 2.977 0.752 1.00 . A A . 29 PHE HA 1 1 7 4895 1 1 29 PHE HB2 H 0.689 1.594 0.481 1.00 . A A . 29 PHE HB2 1 1 7 4896 1 1 29 PHE HB3 H -0.124 2.628 -0.657 1.00 . A A . 29 PHE HB3 1 1 7 4897 1 1 29 PHE HD1 H 1.137 2.816 2.836 1.00 . A A . 29 PHE HD1 1 1 7 4898 1 1 29 PHE HD2 H 0.702 4.800 -0.906 1.00 . A A . 29 PHE HD2 1 1 7 4899 1 1 29 PHE HE1 H 2.418 4.689 3.683 1.00 . A A . 29 PHE HE1 1 1 7 4900 1 1 29 PHE HE2 H 1.997 6.686 -0.040 1.00 . A A . 29 PHE HE2 1 1 7 4901 1 1 29 PHE HZ H 2.855 6.611 2.311 1.00 . A A . 29 PHE HZ 1 1 7 4902 1 1 29 PHE N N -1.198 2.213 2.508 1.00 . A A . 29 PHE N 1 1 7 4903 1 1 29 PHE O O -1.709 -0.171 1.366 1.00 . A A . 29 PHE O 1 1 7 4904 1 1 30 HIS C C -1.779 -1.022 -2.020 1.00 . A A . 30 HIS C 1 1 7 4905 1 1 30 HIS CA C -2.878 -0.523 -1.144 1.00 . A A . 30 HIS CA 1 1 7 4906 1 1 30 HIS CB C -4.108 -0.361 -2.052 1.00 . A A . 30 HIS CB 1 1 7 4907 1 1 30 HIS CD2 C -6.322 -1.110 -0.960 1.00 . A A . 30 HIS CD2 1 1 7 4908 1 1 30 HIS CE1 C -7.293 0.851 -0.892 1.00 . A A . 30 HIS CE1 1 1 7 4909 1 1 30 HIS CG C -5.440 -0.199 -1.436 1.00 . A A . 30 HIS CG 1 1 7 4910 1 1 30 HIS H H -2.551 1.585 -1.061 1.00 . A A . 30 HIS H 1 1 7 4911 1 1 30 HIS HA H -3.094 -1.241 -0.366 1.00 . A A . 30 HIS HA 1 1 7 4912 1 1 30 HIS HB2 H -3.940 0.607 -2.497 1.00 . A A . 30 HIS HB2 1 1 7 4913 1 1 30 HIS HB3 H -4.161 -1.032 -2.892 1.00 . A A . 30 HIS HB3 1 1 7 4914 1 1 30 HIS HD2 H -6.140 -2.171 -0.864 1.00 . A A . 30 HIS HD2 1 1 7 4915 1 1 30 HIS HE1 H -8.027 1.623 -0.732 1.00 . A A . 30 HIS HE1 1 1 7 4916 1 1 30 HIS HE2 H -8.342 -0.884 -0.629 1.00 . A A . 30 HIS HE2 1 1 7 4917 1 1 30 HIS N N -2.442 0.756 -0.548 1.00 . A A . 30 HIS N 1 1 7 4918 1 1 30 HIS ND1 N -6.067 1.023 -1.380 1.00 . A A . 30 HIS ND1 1 1 7 4919 1 1 30 HIS NE2 N -7.465 -0.437 -0.637 1.00 . A A . 30 HIS NE2 1 1 7 4920 1 1 30 HIS O O -1.190 -0.238 -2.754 1.00 . A A . 30 HIS O 1 1 7 4921 1 1 31 GLN C C -0.773 -2.631 -4.318 1.00 . A A . 31 GLN C 1 1 7 4922 1 1 31 GLN CA C -0.509 -2.897 -2.834 1.00 . A A . 31 GLN CA 1 1 7 4923 1 1 31 GLN CB C -0.292 -4.385 -2.557 1.00 . A A . 31 GLN CB 1 1 7 4924 1 1 31 GLN CD C 0.513 -6.151 -0.945 1.00 . A A . 31 GLN CD 1 1 7 4925 1 1 31 GLN CG C 0.348 -4.676 -1.210 1.00 . A A . 31 GLN CG 1 1 7 4926 1 1 31 GLN H H -2.045 -2.844 -1.346 1.00 . A A . 31 GLN H 1 1 7 4927 1 1 31 GLN HA H 0.397 -2.362 -2.581 1.00 . A A . 31 GLN HA 1 1 7 4928 1 1 31 GLN HB2 H -1.239 -4.902 -2.620 1.00 . A A . 31 GLN HB2 1 1 7 4929 1 1 31 GLN HB3 H 0.362 -4.768 -3.329 1.00 . A A . 31 GLN HB3 1 1 7 4930 1 1 31 GLN HE21 H -1.188 -6.220 0.042 1.00 . A A . 31 GLN HE21 1 1 7 4931 1 1 31 GLN HE22 H -0.353 -7.707 -0.098 1.00 . A A . 31 GLN HE22 1 1 7 4932 1 1 31 GLN HG2 H 1.327 -4.221 -1.201 1.00 . A A . 31 GLN HG2 1 1 7 4933 1 1 31 GLN HG3 H -0.246 -4.231 -0.430 1.00 . A A . 31 GLN HG3 1 1 7 4934 1 1 31 GLN N N -1.529 -2.306 -1.983 1.00 . A A . 31 GLN N 1 1 7 4935 1 1 31 GLN NE2 N -0.430 -6.749 -0.267 1.00 . A A . 31 GLN NE2 1 1 7 4936 1 1 31 GLN O O 0.109 -2.261 -5.029 1.00 . A A . 31 GLN O 1 1 7 4937 1 1 31 GLN OE1 O 1.507 -6.726 -1.302 1.00 . A A . 31 GLN OE1 1 1 7 4938 1 1 32 VAL C C -2.256 -1.022 -6.548 1.00 . A A . 32 VAL C 1 1 7 4939 1 1 32 VAL CA C -2.297 -2.529 -6.173 1.00 . A A . 32 VAL CA 1 1 7 4940 1 1 32 VAL CB C -3.674 -3.124 -6.563 1.00 . A A . 32 VAL CB 1 1 7 4941 1 1 32 VAL CG1 C -4.766 -2.470 -5.760 1.00 . A A . 32 VAL CG1 1 1 7 4942 1 1 32 VAL CG2 C -3.936 -2.923 -8.033 1.00 . A A . 32 VAL CG2 1 1 7 4943 1 1 32 VAL H H -2.698 -3.020 -4.132 1.00 . A A . 32 VAL H 1 1 7 4944 1 1 32 VAL HA H -1.536 -3.031 -6.745 1.00 . A A . 32 VAL HA 1 1 7 4945 1 1 32 VAL HB H -3.671 -4.183 -6.356 1.00 . A A . 32 VAL HB 1 1 7 4946 1 1 32 VAL HG11 H -4.698 -1.424 -6.027 1.00 . A A . 32 VAL HG11 1 1 7 4947 1 1 32 VAL HG12 H -4.533 -2.573 -4.711 1.00 . A A . 32 VAL HG12 1 1 7 4948 1 1 32 VAL HG13 H -5.744 -2.852 -6.010 1.00 . A A . 32 VAL HG13 1 1 7 4949 1 1 32 VAL HG21 H -3.135 -3.361 -8.603 1.00 . A A . 32 VAL HG21 1 1 7 4950 1 1 32 VAL HG22 H -3.958 -1.857 -8.190 1.00 . A A . 32 VAL HG22 1 1 7 4951 1 1 32 VAL HG23 H -4.882 -3.375 -8.280 1.00 . A A . 32 VAL HG23 1 1 7 4952 1 1 32 VAL N N -1.995 -2.756 -4.754 1.00 . A A . 32 VAL N 1 1 7 4953 1 1 32 VAL O O -1.732 -0.642 -7.585 1.00 . A A . 32 VAL O 1 1 7 4954 1 1 33 CYS C C -1.601 1.938 -5.983 1.00 . A A . 33 CYS C 1 1 7 4955 1 1 33 CYS CA C -2.945 1.218 -5.973 1.00 . A A . 33 CYS CA 1 1 7 4956 1 1 33 CYS CB C -3.993 1.913 -5.044 1.00 . A A . 33 CYS CB 1 1 7 4957 1 1 33 CYS H H -3.058 -0.637 -4.851 1.00 . A A . 33 CYS H 1 1 7 4958 1 1 33 CYS HA H -3.284 1.312 -6.992 1.00 . A A . 33 CYS HA 1 1 7 4959 1 1 33 CYS HB2 H -4.342 2.808 -5.513 1.00 . A A . 33 CYS HB2 1 1 7 4960 1 1 33 CYS HB3 H -4.845 1.255 -4.952 1.00 . A A . 33 CYS HB3 1 1 7 4961 1 1 33 CYS N N -2.788 -0.191 -5.673 1.00 . A A . 33 CYS N 1 1 7 4962 1 1 33 CYS O O -1.409 2.886 -6.743 1.00 . A A . 33 CYS O 1 1 7 4963 1 1 33 CYS SG S -3.443 2.337 -3.390 1.00 . A A . 33 CYS SG 1 1 7 4964 1 1 34 VAL C C 1.688 1.216 -5.874 1.00 . A A . 34 VAL C 1 1 7 4965 1 1 34 VAL CA C 0.627 2.090 -5.127 1.00 . A A . 34 VAL CA 1 1 7 4966 1 1 34 VAL CB C 1.055 2.335 -3.664 1.00 . A A . 34 VAL CB 1 1 7 4967 1 1 34 VAL CG1 C 1.732 1.158 -3.018 1.00 . A A . 34 VAL CG1 1 1 7 4968 1 1 34 VAL CG2 C 1.791 3.612 -3.538 1.00 . A A . 34 VAL CG2 1 1 7 4969 1 1 34 VAL H H -0.798 0.755 -4.518 1.00 . A A . 34 VAL H 1 1 7 4970 1 1 34 VAL HA H 0.545 3.047 -5.626 1.00 . A A . 34 VAL HA 1 1 7 4971 1 1 34 VAL HB H 0.197 2.385 -3.018 1.00 . A A . 34 VAL HB 1 1 7 4972 1 1 34 VAL HG11 H 1.920 1.347 -1.972 1.00 . A A . 34 VAL HG11 1 1 7 4973 1 1 34 VAL HG12 H 2.676 1.019 -3.521 1.00 . A A . 34 VAL HG12 1 1 7 4974 1 1 34 VAL HG13 H 1.123 0.271 -3.131 1.00 . A A . 34 VAL HG13 1 1 7 4975 1 1 34 VAL HG21 H 1.999 3.769 -2.491 1.00 . A A . 34 VAL HG21 1 1 7 4976 1 1 34 VAL HG22 H 1.098 4.367 -3.881 1.00 . A A . 34 VAL HG22 1 1 7 4977 1 1 34 VAL HG23 H 2.678 3.571 -4.151 1.00 . A A . 34 VAL HG23 1 1 7 4978 1 1 34 VAL N N -0.659 1.478 -5.165 1.00 . A A . 34 VAL N 1 1 7 4979 1 1 34 VAL O O 2.884 1.551 -5.920 1.00 . A A . 34 VAL O 1 1 7 4980 1 1 35 GLY C C 3.152 -1.511 -6.324 1.00 . A A . 35 GLY C 1 1 7 4981 1 1 35 GLY CA C 2.125 -0.772 -7.215 1.00 . A A . 35 GLY CA 1 1 7 4982 1 1 35 GLY H H 0.241 0.102 -6.599 1.00 . A A . 35 GLY H 1 1 7 4983 1 1 35 GLY HA2 H 1.523 -1.513 -7.716 1.00 . A A . 35 GLY HA2 1 1 7 4984 1 1 35 GLY HA3 H 2.657 -0.230 -7.980 1.00 . A A . 35 GLY HA3 1 1 7 4985 1 1 35 GLY N N 1.219 0.154 -6.520 1.00 . A A . 35 GLY N 1 1 7 4986 1 1 35 GLY O O 4.359 -1.288 -6.428 1.00 . A A . 35 GLY O 1 1 7 4987 1 1 36 VAL C C 3.025 -4.668 -4.949 1.00 . A A . 36 VAL C 1 1 7 4988 1 1 36 VAL CA C 3.464 -3.257 -4.647 1.00 . A A . 36 VAL CA 1 1 7 4989 1 1 36 VAL CB C 3.194 -2.985 -3.125 1.00 . A A . 36 VAL CB 1 1 7 4990 1 1 36 VAL CG1 C 3.899 -3.984 -2.212 1.00 . A A . 36 VAL CG1 1 1 7 4991 1 1 36 VAL CG2 C 3.580 -1.588 -2.748 1.00 . A A . 36 VAL CG2 1 1 7 4992 1 1 36 VAL H H 1.706 -2.561 -5.337 1.00 . A A . 36 VAL H 1 1 7 4993 1 1 36 VAL HA H 4.510 -3.108 -4.867 1.00 . A A . 36 VAL HA 1 1 7 4994 1 1 36 VAL HB H 2.131 -3.088 -2.975 1.00 . A A . 36 VAL HB 1 1 7 4995 1 1 36 VAL HG11 H 4.969 -3.962 -2.368 1.00 . A A . 36 VAL HG11 1 1 7 4996 1 1 36 VAL HG12 H 3.525 -4.964 -2.474 1.00 . A A . 36 VAL HG12 1 1 7 4997 1 1 36 VAL HG13 H 3.655 -3.778 -1.180 1.00 . A A . 36 VAL HG13 1 1 7 4998 1 1 36 VAL HG21 H 4.607 -1.384 -3.012 1.00 . A A . 36 VAL HG21 1 1 7 4999 1 1 36 VAL HG22 H 3.456 -1.456 -1.685 1.00 . A A . 36 VAL HG22 1 1 7 5000 1 1 36 VAL HG23 H 2.918 -0.892 -3.247 1.00 . A A . 36 VAL HG23 1 1 7 5001 1 1 36 VAL N N 2.665 -2.386 -5.484 1.00 . A A . 36 VAL N 1 1 7 5002 1 1 36 VAL O O 1.863 -4.887 -5.315 1.00 . A A . 36 VAL O 1 1 7 5003 1 1 37 SER C C 3.482 -7.619 -3.627 1.00 . A A . 37 SER C 1 1 7 5004 1 1 37 SER CA C 3.558 -6.980 -5.012 1.00 . A A . 37 SER CA 1 1 7 5005 1 1 37 SER CB C 4.639 -7.649 -5.861 1.00 . A A . 37 SER CB 1 1 7 5006 1 1 37 SER H H 4.853 -5.511 -4.592 1.00 . A A . 37 SER H 1 1 7 5007 1 1 37 SER HA H 2.610 -7.039 -5.526 1.00 . A A . 37 SER HA 1 1 7 5008 1 1 37 SER HB2 H 4.422 -8.705 -5.918 1.00 . A A . 37 SER HB2 1 1 7 5009 1 1 37 SER HB3 H 4.609 -7.218 -6.849 1.00 . A A . 37 SER HB3 1 1 7 5010 1 1 37 SER HG H 6.411 -6.858 -5.896 1.00 . A A . 37 SER HG 1 1 7 5011 1 1 37 SER N N 3.908 -5.614 -4.834 1.00 . A A . 37 SER N 1 1 7 5012 1 1 37 SER O O 4.161 -7.148 -2.703 1.00 . A A . 37 SER O 1 1 7 5013 1 1 37 SER OG O 5.927 -7.433 -5.292 1.00 . A A . 37 SER OG 1 1 7 5014 1 1 38 PRO C C 3.923 -9.827 -1.576 1.00 . A A . 38 PRO C 1 1 7 5015 1 1 38 PRO CA C 2.544 -9.377 -2.116 1.00 . A A . 38 PRO CA 1 1 7 5016 1 1 38 PRO CB C 1.678 -10.587 -2.447 1.00 . A A . 38 PRO CB 1 1 7 5017 1 1 38 PRO CD C 1.717 -9.220 -4.421 1.00 . A A . 38 PRO CD 1 1 7 5018 1 1 38 PRO CG C 0.850 -10.136 -3.598 1.00 . A A . 38 PRO CG 1 1 7 5019 1 1 38 PRO HA H 2.037 -8.745 -1.398 1.00 . A A . 38 PRO HA 1 1 7 5020 1 1 38 PRO HB2 H 2.305 -11.427 -2.700 1.00 . A A . 38 PRO HB2 1 1 7 5021 1 1 38 PRO HB3 H 1.065 -10.842 -1.593 1.00 . A A . 38 PRO HB3 1 1 7 5022 1 1 38 PRO HD2 H 2.228 -9.765 -5.203 1.00 . A A . 38 PRO HD2 1 1 7 5023 1 1 38 PRO HD3 H 1.116 -8.431 -4.853 1.00 . A A . 38 PRO HD3 1 1 7 5024 1 1 38 PRO HG2 H 0.571 -11.002 -4.171 1.00 . A A . 38 PRO HG2 1 1 7 5025 1 1 38 PRO HG3 H -0.028 -9.623 -3.243 1.00 . A A . 38 PRO HG3 1 1 7 5026 1 1 38 PRO N N 2.654 -8.669 -3.429 1.00 . A A . 38 PRO N 1 1 7 5027 1 1 38 PRO O O 4.123 -9.996 -0.368 1.00 . A A . 38 PRO O 1 1 7 5028 1 1 39 GLU C C 6.977 -9.230 -1.544 1.00 . A A . 39 GLU C 1 1 7 5029 1 1 39 GLU CA C 6.224 -10.386 -2.215 1.00 . A A . 39 GLU CA 1 1 7 5030 1 1 39 GLU CB C 6.891 -10.812 -3.537 1.00 . A A . 39 GLU CB 1 1 7 5031 1 1 39 GLU CD C 8.773 -11.919 -4.754 1.00 . A A . 39 GLU CD 1 1 7 5032 1 1 39 GLU CG C 8.270 -11.446 -3.416 1.00 . A A . 39 GLU CG 1 1 7 5033 1 1 39 GLU H H 4.679 -9.721 -3.429 1.00 . A A . 39 GLU H 1 1 7 5034 1 1 39 GLU HA H 6.253 -11.209 -1.516 1.00 . A A . 39 GLU HA 1 1 7 5035 1 1 39 GLU HB2 H 6.248 -11.526 -4.029 1.00 . A A . 39 GLU HB2 1 1 7 5036 1 1 39 GLU HB3 H 6.979 -9.933 -4.157 1.00 . A A . 39 GLU HB3 1 1 7 5037 1 1 39 GLU HG2 H 8.947 -10.696 -3.041 1.00 . A A . 39 GLU HG2 1 1 7 5038 1 1 39 GLU HG3 H 8.231 -12.291 -2.745 1.00 . A A . 39 GLU HG3 1 1 7 5039 1 1 39 GLU N N 4.875 -9.966 -2.503 1.00 . A A . 39 GLU N 1 1 7 5040 1 1 39 GLU O O 7.736 -9.427 -0.653 1.00 . A A . 39 GLU O 1 1 7 5041 1 1 39 GLU OE1 O 8.192 -12.892 -5.284 1.00 . A A . 39 GLU OE1 1 1 7 5042 1 1 39 GLU OE2 O 9.726 -11.342 -5.292 1.00 . A A . 39 GLU OE2 1 1 7 5043 1 1 40 MET C C 6.878 -6.628 0.026 1.00 . A A . 40 MET C 1 1 7 5044 1 1 40 MET CA C 7.410 -6.883 -1.356 1.00 . A A . 40 MET CA 1 1 7 5045 1 1 40 MET CB C 7.348 -5.604 -2.190 1.00 . A A . 40 MET CB 1 1 7 5046 1 1 40 MET CE C 6.978 -2.498 -3.129 1.00 . A A . 40 MET CE 1 1 7 5047 1 1 40 MET CG C 8.212 -4.478 -1.585 1.00 . A A . 40 MET CG 1 1 7 5048 1 1 40 MET H H 6.026 -7.848 -2.640 1.00 . A A . 40 MET H 1 1 7 5049 1 1 40 MET HA H 8.438 -7.188 -1.250 1.00 . A A . 40 MET HA 1 1 7 5050 1 1 40 MET HB2 H 7.475 -5.765 -3.246 1.00 . A A . 40 MET HB2 1 1 7 5051 1 1 40 MET HB3 H 6.324 -5.279 -2.094 1.00 . A A . 40 MET HB3 1 1 7 5052 1 1 40 MET HE1 H 6.431 -3.291 -3.616 1.00 . A A . 40 MET HE1 1 1 7 5053 1 1 40 MET HE2 H 7.076 -1.658 -3.803 1.00 . A A . 40 MET HE2 1 1 7 5054 1 1 40 MET HE3 H 6.480 -2.183 -2.224 1.00 . A A . 40 MET HE3 1 1 7 5055 1 1 40 MET HG2 H 7.647 -4.092 -0.747 1.00 . A A . 40 MET HG2 1 1 7 5056 1 1 40 MET HG3 H 9.131 -4.922 -1.231 1.00 . A A . 40 MET HG3 1 1 7 5057 1 1 40 MET N N 6.713 -7.999 -1.959 1.00 . A A . 40 MET N 1 1 7 5058 1 1 40 MET O O 7.624 -6.311 0.934 1.00 . A A . 40 MET O 1 1 7 5059 1 1 40 MET SD S 8.584 -3.099 -2.707 1.00 . A A . 40 MET SD 1 1 7 5060 1 1 41 ALA C C 5.428 -7.411 2.588 1.00 . A A . 41 ALA C 1 1 7 5061 1 1 41 ALA CA C 4.880 -6.565 1.430 1.00 . A A . 41 ALA CA 1 1 7 5062 1 1 41 ALA CB C 3.390 -6.837 1.254 1.00 . A A . 41 ALA CB 1 1 7 5063 1 1 41 ALA H H 5.071 -7.051 -0.631 1.00 . A A . 41 ALA H 1 1 7 5064 1 1 41 ALA HA H 4.990 -5.517 1.679 1.00 . A A . 41 ALA HA 1 1 7 5065 1 1 41 ALA HB1 H 2.869 -6.612 2.172 1.00 . A A . 41 ALA HB1 1 1 7 5066 1 1 41 ALA HB2 H 3.233 -7.873 0.994 1.00 . A A . 41 ALA HB2 1 1 7 5067 1 1 41 ALA HB3 H 2.987 -6.219 0.463 1.00 . A A . 41 ALA HB3 1 1 7 5068 1 1 41 ALA N N 5.585 -6.791 0.164 1.00 . A A . 41 ALA N 1 1 7 5069 1 1 41 ALA O O 5.674 -6.893 3.675 1.00 . A A . 41 ALA O 1 1 7 5070 1 1 42 GLU C C 7.565 -9.771 3.443 1.00 . A A . 42 GLU C 1 1 7 5071 1 1 42 GLU CA C 6.052 -9.570 3.439 1.00 . A A . 42 GLU CA 1 1 7 5072 1 1 42 GLU CB C 5.360 -10.928 3.387 1.00 . A A . 42 GLU CB 1 1 7 5073 1 1 42 GLU CD C 3.223 -12.244 3.563 1.00 . A A . 42 GLU CD 1 1 7 5074 1 1 42 GLU CG C 3.841 -10.870 3.458 1.00 . A A . 42 GLU CG 1 1 7 5075 1 1 42 GLU H H 5.370 -8.997 1.452 1.00 . A A . 42 GLU H 1 1 7 5076 1 1 42 GLU HA H 5.767 -9.086 4.365 1.00 . A A . 42 GLU HA 1 1 7 5077 1 1 42 GLU HB2 H 5.645 -11.409 2.464 1.00 . A A . 42 GLU HB2 1 1 7 5078 1 1 42 GLU HB3 H 5.720 -11.537 4.202 1.00 . A A . 42 GLU HB3 1 1 7 5079 1 1 42 GLU HG2 H 3.556 -10.294 4.328 1.00 . A A . 42 GLU HG2 1 1 7 5080 1 1 42 GLU HG3 H 3.468 -10.388 2.566 1.00 . A A . 42 GLU HG3 1 1 7 5081 1 1 42 GLU N N 5.599 -8.694 2.360 1.00 . A A . 42 GLU N 1 1 7 5082 1 1 42 GLU O O 8.139 -10.229 4.443 1.00 . A A . 42 GLU O 1 1 7 5083 1 1 42 GLU OE1 O 3.223 -12.996 2.556 1.00 . A A . 42 GLU OE1 1 1 7 5084 1 1 42 GLU OE2 O 2.736 -12.602 4.654 1.00 . A A . 42 GLU OE2 1 1 7 5085 1 1 43 ASN C C 10.529 -8.502 2.401 1.00 . A A . 43 ASN C 1 1 7 5086 1 1 43 ASN CA C 9.624 -9.735 2.243 1.00 . A A . 43 ASN CA 1 1 7 5087 1 1 43 ASN CB C 9.905 -10.494 0.945 1.00 . A A . 43 ASN CB 1 1 7 5088 1 1 43 ASN CG C 9.165 -11.838 0.865 1.00 . A A . 43 ASN CG 1 1 7 5089 1 1 43 ASN H H 7.774 -9.004 1.600 1.00 . A A . 43 ASN H 1 1 7 5090 1 1 43 ASN HA H 9.852 -10.400 3.063 1.00 . A A . 43 ASN HA 1 1 7 5091 1 1 43 ASN HB2 H 9.595 -9.885 0.108 1.00 . A A . 43 ASN HB2 1 1 7 5092 1 1 43 ASN HB3 H 10.962 -10.683 0.874 1.00 . A A . 43 ASN HB3 1 1 7 5093 1 1 43 ASN HD21 H 10.705 -12.759 1.603 1.00 . A A . 43 ASN HD21 1 1 7 5094 1 1 43 ASN HD22 H 9.349 -13.751 1.251 1.00 . A A . 43 ASN HD22 1 1 7 5095 1 1 43 ASN N N 8.219 -9.439 2.354 1.00 . A A . 43 ASN N 1 1 7 5096 1 1 43 ASN ND2 N 9.802 -12.882 1.278 1.00 . A A . 43 ASN ND2 1 1 7 5097 1 1 43 ASN O O 11.722 -8.657 2.676 1.00 . A A . 43 ASN O 1 1 7 5098 1 1 43 ASN OD1 O 8.031 -11.920 0.405 1.00 . A A . 43 ASN OD1 1 1 7 5099 1 1 44 GLU C C 10.000 -4.983 3.153 1.00 . A A . 44 GLU C 1 1 7 5100 1 1 44 GLU CA C 10.784 -6.061 2.408 1.00 . A A . 44 GLU CA 1 1 7 5101 1 1 44 GLU CB C 11.322 -5.464 1.085 1.00 . A A . 44 GLU CB 1 1 7 5102 1 1 44 GLU CD C 12.926 -5.627 -0.865 1.00 . A A . 44 GLU CD 1 1 7 5103 1 1 44 GLU CG C 12.272 -6.354 0.303 1.00 . A A . 44 GLU CG 1 1 7 5104 1 1 44 GLU H H 9.037 -7.213 1.997 1.00 . A A . 44 GLU H 1 1 7 5105 1 1 44 GLU HA H 11.621 -6.337 3.034 1.00 . A A . 44 GLU HA 1 1 7 5106 1 1 44 GLU HB2 H 10.473 -5.234 0.461 1.00 . A A . 44 GLU HB2 1 1 7 5107 1 1 44 GLU HB3 H 11.831 -4.540 1.324 1.00 . A A . 44 GLU HB3 1 1 7 5108 1 1 44 GLU HG2 H 13.038 -6.704 0.978 1.00 . A A . 44 GLU HG2 1 1 7 5109 1 1 44 GLU HG3 H 11.713 -7.200 -0.068 1.00 . A A . 44 GLU HG3 1 1 7 5110 1 1 44 GLU N N 9.986 -7.293 2.230 1.00 . A A . 44 GLU N 1 1 7 5111 1 1 44 GLU O O 8.837 -5.174 3.513 1.00 . A A . 44 GLU O 1 1 7 5112 1 1 44 GLU OE1 O 12.230 -5.283 -1.839 1.00 . A A . 44 GLU OE1 1 1 7 5113 1 1 44 GLU OE2 O 14.152 -5.398 -0.822 1.00 . A A . 44 GLU OE2 1 1 7 5114 1 1 45 ASP C C 9.523 -1.729 3.055 1.00 . A A . 45 ASP C 1 1 7 5115 1 1 45 ASP CA C 10.092 -2.714 4.073 1.00 . A A . 45 ASP CA 1 1 7 5116 1 1 45 ASP CB C 11.169 -2.045 4.934 1.00 . A A . 45 ASP CB 1 1 7 5117 1 1 45 ASP CG C 10.723 -0.739 5.571 1.00 . A A . 45 ASP CG 1 1 7 5118 1 1 45 ASP H H 11.610 -3.842 3.142 1.00 . A A . 45 ASP H 1 1 7 5119 1 1 45 ASP HA H 9.297 -3.050 4.719 1.00 . A A . 45 ASP HA 1 1 7 5120 1 1 45 ASP HB2 H 11.438 -2.728 5.728 1.00 . A A . 45 ASP HB2 1 1 7 5121 1 1 45 ASP HB3 H 12.029 -1.854 4.310 1.00 . A A . 45 ASP HB3 1 1 7 5122 1 1 45 ASP N N 10.667 -3.878 3.403 1.00 . A A . 45 ASP N 1 1 7 5123 1 1 45 ASP O O 10.232 -1.279 2.146 1.00 . A A . 45 ASP O 1 1 7 5124 1 1 45 ASP OD1 O 9.766 -0.766 6.369 1.00 . A A . 45 ASP OD1 1 1 7 5125 1 1 45 ASP OD2 O 11.369 0.312 5.299 1.00 . A A . 45 ASP OD2 1 1 7 5126 1 1 46 TYR C C 7.910 0.969 2.526 1.00 . A A . 46 TYR C 1 1 7 5127 1 1 46 TYR CA C 7.583 -0.512 2.256 1.00 . A A . 46 TYR CA 1 1 7 5128 1 1 46 TYR CB C 6.044 -0.743 2.152 1.00 . A A . 46 TYR CB 1 1 7 5129 1 1 46 TYR CD1 C 5.292 0.137 -0.096 1.00 . A A . 46 TYR CD1 1 1 7 5130 1 1 46 TYR CD2 C 4.793 1.418 1.831 1.00 . A A . 46 TYR CD2 1 1 7 5131 1 1 46 TYR CE1 C 4.680 1.112 -0.881 1.00 . A A . 46 TYR CE1 1 1 7 5132 1 1 46 TYR CE2 C 4.195 2.366 1.055 1.00 . A A . 46 TYR CE2 1 1 7 5133 1 1 46 TYR CG C 5.356 0.283 1.276 1.00 . A A . 46 TYR CG 1 1 7 5134 1 1 46 TYR CZ C 4.144 2.205 -0.289 1.00 . A A . 46 TYR CZ 1 1 7 5135 1 1 46 TYR H H 7.749 -1.890 3.890 1.00 . A A . 46 TYR H 1 1 7 5136 1 1 46 TYR HA H 8.004 -0.721 1.285 1.00 . A A . 46 TYR HA 1 1 7 5137 1 1 46 TYR HB2 H 5.836 -1.702 1.701 1.00 . A A . 46 TYR HB2 1 1 7 5138 1 1 46 TYR HB3 H 5.605 -0.682 3.136 1.00 . A A . 46 TYR HB3 1 1 7 5139 1 1 46 TYR HD1 H 5.718 -0.744 -0.557 1.00 . A A . 46 TYR HD1 1 1 7 5140 1 1 46 TYR HD2 H 4.843 1.538 2.903 1.00 . A A . 46 TYR HD2 1 1 7 5141 1 1 46 TYR HE1 H 4.594 1.040 -1.958 1.00 . A A . 46 TYR HE1 1 1 7 5142 1 1 46 TYR HE2 H 3.751 3.254 1.476 1.00 . A A . 46 TYR HE2 1 1 7 5143 1 1 46 TYR HH H 2.969 2.726 -1.669 1.00 . A A . 46 TYR HH 1 1 7 5144 1 1 46 TYR N N 8.235 -1.439 3.170 1.00 . A A . 46 TYR N 1 1 7 5145 1 1 46 TYR O O 7.429 1.591 3.483 1.00 . A A . 46 TYR O 1 1 7 5146 1 1 46 TYR OH O 3.567 3.163 -1.055 1.00 . A A . 46 TYR OH 1 1 7 5147 1 1 47 ILE C C 8.085 3.497 0.576 1.00 . A A . 47 ILE C 1 1 7 5148 1 1 47 ILE CA C 9.027 2.906 1.636 1.00 . A A . 47 ILE CA 1 1 7 5149 1 1 47 ILE CB C 10.512 3.162 1.236 1.00 . A A . 47 ILE CB 1 1 7 5150 1 1 47 ILE CD1 C 11.397 2.976 3.635 1.00 . A A . 47 ILE CD1 1 1 7 5151 1 1 47 ILE CG1 C 11.485 2.464 2.203 1.00 . A A . 47 ILE CG1 1 1 7 5152 1 1 47 ILE CG2 C 10.800 4.646 1.234 1.00 . A A . 47 ILE CG2 1 1 7 5153 1 1 47 ILE H H 9.135 0.805 1.104 1.00 . A A . 47 ILE H 1 1 7 5154 1 1 47 ILE HA H 8.808 3.350 2.595 1.00 . A A . 47 ILE HA 1 1 7 5155 1 1 47 ILE HB H 10.666 2.775 0.241 1.00 . A A . 47 ILE HB 1 1 7 5156 1 1 47 ILE HD11 H 10.395 2.824 4.010 1.00 . A A . 47 ILE HD11 1 1 7 5157 1 1 47 ILE HD12 H 11.627 4.032 3.657 1.00 . A A . 47 ILE HD12 1 1 7 5158 1 1 47 ILE HD13 H 12.101 2.440 4.258 1.00 . A A . 47 ILE HD13 1 1 7 5159 1 1 47 ILE HG12 H 11.287 1.402 2.204 1.00 . A A . 47 ILE HG12 1 1 7 5160 1 1 47 ILE HG13 H 12.502 2.617 1.860 1.00 . A A . 47 ILE HG13 1 1 7 5161 1 1 47 ILE HG21 H 10.181 5.156 0.511 1.00 . A A . 47 ILE HG21 1 1 7 5162 1 1 47 ILE HG22 H 11.847 4.805 1.015 1.00 . A A . 47 ILE HG22 1 1 7 5163 1 1 47 ILE HG23 H 10.567 5.003 2.231 1.00 . A A . 47 ILE HG23 1 1 7 5164 1 1 47 ILE N N 8.743 1.494 1.676 1.00 . A A . 47 ILE N 1 1 7 5165 1 1 47 ILE O O 7.868 2.876 -0.461 1.00 . A A . 47 ILE O 1 1 7 5166 1 1 48 CYS C C 7.274 6.272 -0.951 1.00 . A A . 48 CYS C 1 1 7 5167 1 1 48 CYS CA C 6.571 5.204 -0.143 1.00 . A A . 48 CYS CA 1 1 7 5168 1 1 48 CYS CB C 5.347 5.832 0.532 1.00 . A A . 48 CYS CB 1 1 7 5169 1 1 48 CYS H H 7.656 5.267 1.572 1.00 . A A . 48 CYS H 1 1 7 5170 1 1 48 CYS HA H 6.252 4.399 -0.785 1.00 . A A . 48 CYS HA 1 1 7 5171 1 1 48 CYS HB2 H 4.572 5.933 -0.215 1.00 . A A . 48 CYS HB2 1 1 7 5172 1 1 48 CYS HB3 H 4.979 5.177 1.301 1.00 . A A . 48 CYS HB3 1 1 7 5173 1 1 48 CYS N N 7.499 4.667 0.823 1.00 . A A . 48 CYS N 1 1 7 5174 1 1 48 CYS O O 8.395 6.641 -0.631 1.00 . A A . 48 CYS O 1 1 7 5175 1 1 48 CYS SG S 5.629 7.477 1.264 1.00 . A A . 48 CYS SG 1 1 7 5176 1 1 49 ILE C C 7.517 9.093 -1.993 1.00 . A A . 49 ILE C 1 1 7 5177 1 1 49 ILE CA C 7.138 7.821 -2.805 1.00 . A A . 49 ILE CA 1 1 7 5178 1 1 49 ILE CB C 6.157 8.155 -3.959 1.00 . A A . 49 ILE CB 1 1 7 5179 1 1 49 ILE CD1 C 5.973 9.479 -6.112 1.00 . A A . 49 ILE CD1 1 1 7 5180 1 1 49 ILE CG1 C 6.766 9.213 -4.862 1.00 . A A . 49 ILE CG1 1 1 7 5181 1 1 49 ILE CG2 C 4.782 8.581 -3.438 1.00 . A A . 49 ILE CG2 1 1 7 5182 1 1 49 ILE H H 5.736 6.370 -2.149 1.00 . A A . 49 ILE H 1 1 7 5183 1 1 49 ILE HA H 8.052 7.448 -3.251 1.00 . A A . 49 ILE HA 1 1 7 5184 1 1 49 ILE HB H 6.009 7.252 -4.530 1.00 . A A . 49 ILE HB 1 1 7 5185 1 1 49 ILE HD11 H 6.478 10.222 -6.714 1.00 . A A . 49 ILE HD11 1 1 7 5186 1 1 49 ILE HD12 H 4.981 9.810 -5.838 1.00 . A A . 49 ILE HD12 1 1 7 5187 1 1 49 ILE HD13 H 5.904 8.532 -6.622 1.00 . A A . 49 ILE HD13 1 1 7 5188 1 1 49 ILE HG12 H 6.815 10.119 -4.280 1.00 . A A . 49 ILE HG12 1 1 7 5189 1 1 49 ILE HG13 H 7.760 8.896 -5.138 1.00 . A A . 49 ILE HG13 1 1 7 5190 1 1 49 ILE HG21 H 4.353 7.778 -2.851 1.00 . A A . 49 ILE HG21 1 1 7 5191 1 1 49 ILE HG22 H 4.138 8.800 -4.277 1.00 . A A . 49 ILE HG22 1 1 7 5192 1 1 49 ILE HG23 H 4.890 9.468 -2.834 1.00 . A A . 49 ILE HG23 1 1 7 5193 1 1 49 ILE N N 6.612 6.773 -1.958 1.00 . A A . 49 ILE N 1 1 7 5194 1 1 49 ILE O O 8.537 9.714 -2.253 1.00 . A A . 49 ILE O 1 1 7 5195 1 1 50 ASN C C 8.120 10.289 0.849 1.00 . A A . 50 ASN C 1 1 7 5196 1 1 50 ASN CA C 6.974 10.580 -0.125 1.00 . A A . 50 ASN CA 1 1 7 5197 1 1 50 ASN CB C 5.702 10.993 0.641 1.00 . A A . 50 ASN CB 1 1 7 5198 1 1 50 ASN CG C 4.579 11.463 -0.270 1.00 . A A . 50 ASN CG 1 1 7 5199 1 1 50 ASN H H 5.945 8.846 -0.804 1.00 . A A . 50 ASN H 1 1 7 5200 1 1 50 ASN HA H 7.263 11.386 -0.784 1.00 . A A . 50 ASN HA 1 1 7 5201 1 1 50 ASN HB2 H 5.327 10.144 1.192 1.00 . A A . 50 ASN HB2 1 1 7 5202 1 1 50 ASN HB3 H 5.940 11.789 1.329 1.00 . A A . 50 ASN HB3 1 1 7 5203 1 1 50 ASN HD21 H 5.176 13.349 -0.121 1.00 . A A . 50 ASN HD21 1 1 7 5204 1 1 50 ASN HD22 H 3.793 13.071 -1.107 1.00 . A A . 50 ASN HD22 1 1 7 5205 1 1 50 ASN N N 6.720 9.420 -0.980 1.00 . A A . 50 ASN N 1 1 7 5206 1 1 50 ASN ND2 N 4.515 12.752 -0.521 1.00 . A A . 50 ASN ND2 1 1 7 5207 1 1 50 ASN O O 8.842 11.180 1.249 1.00 . A A . 50 ASN O 1 1 7 5208 1 1 50 ASN OD1 O 3.765 10.665 -0.739 1.00 . A A . 50 ASN OD1 1 1 7 5209 1 1 51 CYS C C 10.688 8.501 1.275 1.00 . A A . 51 CYS C 1 1 7 5210 1 1 51 CYS CA C 9.384 8.606 2.085 1.00 . A A . 51 CYS CA 1 1 7 5211 1 1 51 CYS CB C 9.115 7.242 2.782 1.00 . A A . 51 CYS CB 1 1 7 5212 1 1 51 CYS H H 7.616 8.376 0.887 1.00 . A A . 51 CYS H 1 1 7 5213 1 1 51 CYS HA H 9.508 9.371 2.838 1.00 . A A . 51 CYS HA 1 1 7 5214 1 1 51 CYS HB2 H 8.702 6.572 2.046 1.00 . A A . 51 CYS HB2 1 1 7 5215 1 1 51 CYS HB3 H 10.059 6.835 3.109 1.00 . A A . 51 CYS HB3 1 1 7 5216 1 1 51 CYS N N 8.273 9.021 1.223 1.00 . A A . 51 CYS N 1 1 7 5217 1 1 51 CYS O O 11.778 8.679 1.800 1.00 . A A . 51 CYS O 1 1 7 5218 1 1 51 CYS SG S 7.967 7.218 4.194 1.00 . A A . 51 CYS SG 1 1 7 5219 1 1 52 ALA C C 12.248 9.357 -1.418 1.00 . A A . 52 ALA C 1 1 7 5220 1 1 52 ALA CA C 11.705 8.027 -0.884 1.00 . A A . 52 ALA CA 1 1 7 5221 1 1 52 ALA CB C 11.312 7.099 -2.036 1.00 . A A . 52 ALA CB 1 1 7 5222 1 1 52 ALA H H 9.632 8.192 -0.346 1.00 . A A . 52 ALA H 1 1 7 5223 1 1 52 ALA HA H 12.466 7.531 -0.294 1.00 . A A . 52 ALA HA 1 1 7 5224 1 1 52 ALA HB1 H 10.529 7.577 -2.608 1.00 . A A . 52 ALA HB1 1 1 7 5225 1 1 52 ALA HB2 H 10.943 6.161 -1.639 1.00 . A A . 52 ALA HB2 1 1 7 5226 1 1 52 ALA HB3 H 12.162 6.916 -2.677 1.00 . A A . 52 ALA HB3 1 1 7 5227 1 1 52 ALA N N 10.552 8.232 -0.001 1.00 . A A . 52 ALA N 1 1 7 5228 2 2 1 ZN ZN ZN 5.791 7.415 3.544 1.00 . B A . 53 ZN ZN 1 1 7 5229 3 2 1 ZN ZN ZN -5.226 2.750 -1.950 1.00 . C A . 54 ZN ZN 1 1 8 5230 1 1 1 SER C C -11.485 5.622 1.762 1.00 . A A . 1 SER C 1 1 8 5231 1 1 1 SER CA C -12.465 5.475 2.960 1.00 . A A . 1 SER CA 1 1 8 5232 1 1 1 SER CB C -13.841 6.103 2.645 1.00 . A A . 1 SER CB 1 1 8 5233 1 1 1 SER HA H -12.581 4.424 3.176 1.00 . A A . 1 SER HA 1 1 8 5234 1 1 1 SER HB2 H -13.715 7.150 2.417 1.00 . A A . 1 SER HB2 1 1 8 5235 1 1 1 SER HB3 H -14.288 5.596 1.800 1.00 . A A . 1 SER HB3 1 1 8 5236 1 1 1 SER HG H -14.324 5.349 4.379 1.00 . A A . 1 SER HG 1 1 8 5237 1 1 1 SER N N -11.899 6.106 4.174 1.00 . A A . 1 SER N 1 1 8 5238 1 1 1 SER O O -11.667 5.017 0.691 1.00 . A A . 1 SER O 1 1 8 5239 1 1 1 SER OG O -14.725 5.986 3.772 1.00 . A A . 1 SER OG 1 1 8 5240 1 1 2 VAL C C -8.092 6.476 1.600 1.00 . A A . 2 VAL C 1 1 8 5241 1 1 2 VAL CA C -9.448 6.641 0.938 1.00 . A A . 2 VAL CA 1 1 8 5242 1 1 2 VAL CB C -9.536 8.063 0.290 1.00 . A A . 2 VAL CB 1 1 8 5243 1 1 2 VAL CG1 C -8.600 8.161 -0.906 1.00 . A A . 2 VAL CG1 1 1 8 5244 1 1 2 VAL CG2 C -10.962 8.404 -0.126 1.00 . A A . 2 VAL CG2 1 1 8 5245 1 1 2 VAL H H -10.364 6.867 2.823 1.00 . A A . 2 VAL H 1 1 8 5246 1 1 2 VAL HA H -9.548 5.886 0.173 1.00 . A A . 2 VAL HA 1 1 8 5247 1 1 2 VAL HB H -9.205 8.782 1.026 1.00 . A A . 2 VAL HB 1 1 8 5248 1 1 2 VAL HG11 H -8.913 7.449 -1.654 1.00 . A A . 2 VAL HG11 1 1 8 5249 1 1 2 VAL HG12 H -7.591 7.916 -0.607 1.00 . A A . 2 VAL HG12 1 1 8 5250 1 1 2 VAL HG13 H -8.634 9.156 -1.325 1.00 . A A . 2 VAL HG13 1 1 8 5251 1 1 2 VAL HG21 H -11.597 8.352 0.746 1.00 . A A . 2 VAL HG21 1 1 8 5252 1 1 2 VAL HG22 H -11.307 7.684 -0.851 1.00 . A A . 2 VAL HG22 1 1 8 5253 1 1 2 VAL HG23 H -10.995 9.396 -0.552 1.00 . A A . 2 VAL HG23 1 1 8 5254 1 1 2 VAL N N -10.458 6.425 1.950 1.00 . A A . 2 VAL N 1 1 8 5255 1 1 2 VAL O O -7.855 7.051 2.659 1.00 . A A . 2 VAL O 1 1 8 5256 1 1 3 CYS C C -4.925 6.444 1.061 1.00 . A A . 3 CYS C 1 1 8 5257 1 1 3 CYS CA C -5.925 5.383 1.568 1.00 . A A . 3 CYS CA 1 1 8 5258 1 1 3 CYS CB C -5.450 3.995 1.083 1.00 . A A . 3 CYS CB 1 1 8 5259 1 1 3 CYS H H -7.450 5.227 0.162 1.00 . A A . 3 CYS H 1 1 8 5260 1 1 3 CYS HA H -5.970 5.393 2.646 1.00 . A A . 3 CYS HA 1 1 8 5261 1 1 3 CYS HB2 H -4.838 3.534 1.846 1.00 . A A . 3 CYS HB2 1 1 8 5262 1 1 3 CYS HB3 H -6.325 3.390 0.898 1.00 . A A . 3 CYS HB3 1 1 8 5263 1 1 3 CYS N N -7.231 5.670 1.002 1.00 . A A . 3 CYS N 1 1 8 5264 1 1 3 CYS O O -5.327 7.417 0.390 1.00 . A A . 3 CYS O 1 1 8 5265 1 1 3 CYS SG S -4.484 4.069 -0.448 1.00 . A A . 3 CYS SG 1 1 8 5266 1 1 4 ALA C C -2.070 6.504 -0.477 1.00 . A A . 4 ALA C 1 1 8 5267 1 1 4 ALA CA C -2.619 7.112 0.825 1.00 . A A . 4 ALA CA 1 1 8 5268 1 1 4 ALA CB C -1.491 7.271 1.836 1.00 . A A . 4 ALA CB 1 1 8 5269 1 1 4 ALA H H -3.374 5.475 1.897 1.00 . A A . 4 ALA H 1 1 8 5270 1 1 4 ALA HA H -3.058 8.076 0.627 1.00 . A A . 4 ALA HA 1 1 8 5271 1 1 4 ALA HB1 H -1.040 6.312 2.045 1.00 . A A . 4 ALA HB1 1 1 8 5272 1 1 4 ALA HB2 H -1.880 7.686 2.752 1.00 . A A . 4 ALA HB2 1 1 8 5273 1 1 4 ALA HB3 H -0.730 7.936 1.451 1.00 . A A . 4 ALA HB3 1 1 8 5274 1 1 4 ALA N N -3.639 6.245 1.353 1.00 . A A . 4 ALA N 1 1 8 5275 1 1 4 ALA O O -1.632 5.371 -0.487 1.00 . A A . 4 ALA O 1 1 8 5276 1 1 5 ALA C C -2.009 8.020 -3.837 1.00 . A A . 5 ALA C 1 1 8 5277 1 1 5 ALA CA C -1.605 6.927 -2.881 1.00 . A A . 5 ALA CA 1 1 8 5278 1 1 5 ALA CB C -2.072 5.559 -3.435 1.00 . A A . 5 ALA CB 1 1 8 5279 1 1 5 ALA H H -2.812 8.006 -1.540 1.00 . A A . 5 ALA H 1 1 8 5280 1 1 5 ALA HA H -0.533 6.930 -2.771 1.00 . A A . 5 ALA HA 1 1 8 5281 1 1 5 ALA HB1 H -1.622 5.340 -4.393 1.00 . A A . 5 ALA HB1 1 1 8 5282 1 1 5 ALA HB2 H -3.144 5.542 -3.561 1.00 . A A . 5 ALA HB2 1 1 8 5283 1 1 5 ALA HB3 H -1.783 4.780 -2.744 1.00 . A A . 5 ALA HB3 1 1 8 5284 1 1 5 ALA N N -2.205 7.242 -1.575 1.00 . A A . 5 ALA N 1 1 8 5285 1 1 5 ALA O O -3.180 8.408 -3.853 1.00 . A A . 5 ALA O 1 1 8 5286 1 1 6 GLN C C -2.464 9.241 -6.510 1.00 . A A . 6 GLN C 1 1 8 5287 1 1 6 GLN CA C -1.305 9.628 -5.584 1.00 . A A . 6 GLN CA 1 1 8 5288 1 1 6 GLN CB C -0.042 9.889 -6.407 1.00 . A A . 6 GLN CB 1 1 8 5289 1 1 6 GLN CD C 2.367 10.478 -6.494 1.00 . A A . 6 GLN CD 1 1 8 5290 1 1 6 GLN CG C 1.152 10.360 -5.613 1.00 . A A . 6 GLN CG 1 1 8 5291 1 1 6 GLN H H -0.105 8.317 -4.444 1.00 . A A . 6 GLN H 1 1 8 5292 1 1 6 GLN HA H -1.569 10.529 -5.043 1.00 . A A . 6 GLN HA 1 1 8 5293 1 1 6 GLN HB2 H 0.295 8.977 -6.875 1.00 . A A . 6 GLN HB2 1 1 8 5294 1 1 6 GLN HB3 H -0.238 10.625 -7.169 1.00 . A A . 6 GLN HB3 1 1 8 5295 1 1 6 GLN HE21 H 1.951 12.365 -6.907 1.00 . A A . 6 GLN HE21 1 1 8 5296 1 1 6 GLN HE22 H 3.371 11.701 -7.639 1.00 . A A . 6 GLN HE22 1 1 8 5297 1 1 6 GLN HG2 H 0.934 11.318 -5.168 1.00 . A A . 6 GLN HG2 1 1 8 5298 1 1 6 GLN HG3 H 1.365 9.628 -4.847 1.00 . A A . 6 GLN HG3 1 1 8 5299 1 1 6 GLN N N -1.044 8.562 -4.585 1.00 . A A . 6 GLN N 1 1 8 5300 1 1 6 GLN NE2 N 2.578 11.627 -7.067 1.00 . A A . 6 GLN NE2 1 1 8 5301 1 1 6 GLN O O -3.336 10.059 -6.828 1.00 . A A . 6 GLN O 1 1 8 5302 1 1 6 GLN OE1 O 3.110 9.530 -6.647 1.00 . A A . 6 GLN OE1 1 1 8 5303 1 1 7 ASN C C -4.102 6.258 -7.004 1.00 . A A . 7 ASN C 1 1 8 5304 1 1 7 ASN CA C -3.563 7.486 -7.697 1.00 . A A . 7 ASN CA 1 1 8 5305 1 1 7 ASN CB C -3.157 7.174 -9.157 1.00 . A A . 7 ASN CB 1 1 8 5306 1 1 7 ASN CG C -4.332 6.651 -10.005 1.00 . A A . 7 ASN CG 1 1 8 5307 1 1 7 ASN H H -1.672 7.487 -6.701 1.00 . A A . 7 ASN H 1 1 8 5308 1 1 7 ASN HA H -4.340 8.237 -7.700 1.00 . A A . 7 ASN HA 1 1 8 5309 1 1 7 ASN HB2 H -2.793 8.082 -9.613 1.00 . A A . 7 ASN HB2 1 1 8 5310 1 1 7 ASN HB3 H -2.361 6.439 -9.170 1.00 . A A . 7 ASN HB3 1 1 8 5311 1 1 7 ASN HD21 H -4.823 8.491 -10.505 1.00 . A A . 7 ASN HD21 1 1 8 5312 1 1 7 ASN HD22 H -5.811 7.241 -11.168 1.00 . A A . 7 ASN HD22 1 1 8 5313 1 1 7 ASN N N -2.464 8.017 -6.930 1.00 . A A . 7 ASN N 1 1 8 5314 1 1 7 ASN ND2 N -5.061 7.550 -10.619 1.00 . A A . 7 ASN ND2 1 1 8 5315 1 1 7 ASN O O -3.536 5.177 -7.097 1.00 . A A . 7 ASN O 1 1 8 5316 1 1 7 ASN OD1 O -4.570 5.445 -10.104 1.00 . A A . 7 ASN OD1 1 1 8 5317 1 1 8 CYS C C -6.934 4.817 -6.352 1.00 . A A . 8 CYS C 1 1 8 5318 1 1 8 CYS CA C -5.733 5.318 -5.584 1.00 . A A . 8 CYS CA 1 1 8 5319 1 1 8 CYS CB C -6.109 5.618 -4.115 1.00 . A A . 8 CYS CB 1 1 8 5320 1 1 8 CYS H H -5.548 7.320 -6.148 1.00 . A A . 8 CYS H 1 1 8 5321 1 1 8 CYS HA H -4.966 4.559 -5.593 1.00 . A A . 8 CYS HA 1 1 8 5322 1 1 8 CYS HB2 H -5.258 5.953 -3.540 1.00 . A A . 8 CYS HB2 1 1 8 5323 1 1 8 CYS HB3 H -6.832 6.419 -4.106 1.00 . A A . 8 CYS HB3 1 1 8 5324 1 1 8 CYS N N -5.151 6.431 -6.252 1.00 . A A . 8 CYS N 1 1 8 5325 1 1 8 CYS O O -7.887 5.546 -6.580 1.00 . A A . 8 CYS O 1 1 8 5326 1 1 8 CYS SG S -6.887 4.193 -3.262 1.00 . A A . 8 CYS SG 1 1 8 5327 1 1 9 GLN C C -9.131 2.601 -6.499 1.00 . A A . 9 GLN C 1 1 8 5328 1 1 9 GLN CA C -7.946 2.856 -7.451 1.00 . A A . 9 GLN CA 1 1 8 5329 1 1 9 GLN CB C -7.403 1.519 -7.946 1.00 . A A . 9 GLN CB 1 1 8 5330 1 1 9 GLN CD C -5.613 0.283 -9.258 1.00 . A A . 9 GLN CD 1 1 8 5331 1 1 9 GLN CG C -6.166 1.639 -8.830 1.00 . A A . 9 GLN CG 1 1 8 5332 1 1 9 GLN H H -6.021 3.101 -6.567 1.00 . A A . 9 GLN H 1 1 8 5333 1 1 9 GLN HA H -8.273 3.441 -8.294 1.00 . A A . 9 GLN HA 1 1 8 5334 1 1 9 GLN HB2 H -7.131 0.937 -7.079 1.00 . A A . 9 GLN HB2 1 1 8 5335 1 1 9 GLN HB3 H -8.164 0.992 -8.499 1.00 . A A . 9 GLN HB3 1 1 8 5336 1 1 9 GLN HE21 H -3.773 0.995 -9.232 1.00 . A A . 9 GLN HE21 1 1 8 5337 1 1 9 GLN HE22 H -3.942 -0.657 -9.690 1.00 . A A . 9 GLN HE22 1 1 8 5338 1 1 9 GLN HG2 H -6.413 2.207 -9.712 1.00 . A A . 9 GLN HG2 1 1 8 5339 1 1 9 GLN HG3 H -5.401 2.160 -8.274 1.00 . A A . 9 GLN HG3 1 1 8 5340 1 1 9 GLN N N -6.865 3.561 -6.743 1.00 . A A . 9 GLN N 1 1 8 5341 1 1 9 GLN NE2 N -4.321 0.203 -9.406 1.00 . A A . 9 GLN NE2 1 1 8 5342 1 1 9 GLN O O -10.194 2.166 -6.916 1.00 . A A . 9 GLN O 1 1 8 5343 1 1 9 GLN OE1 O -6.342 -0.677 -9.415 1.00 . A A . 9 GLN OE1 1 1 8 5344 1 1 10 ARG C C -10.574 1.350 -4.117 1.00 . A A . 10 ARG C 1 1 8 5345 1 1 10 ARG CA C -9.802 2.715 -4.106 1.00 . A A . 10 ARG CA 1 1 8 5346 1 1 10 ARG CB C -10.674 3.978 -3.947 1.00 . A A . 10 ARG CB 1 1 8 5347 1 1 10 ARG CD C -12.081 5.456 -2.534 1.00 . A A . 10 ARG CD 1 1 8 5348 1 1 10 ARG CG C -11.623 4.022 -2.762 1.00 . A A . 10 ARG CG 1 1 8 5349 1 1 10 ARG CZ C -12.290 7.234 -4.309 1.00 . A A . 10 ARG CZ 1 1 8 5350 1 1 10 ARG H H -8.038 3.349 -5.043 1.00 . A A . 10 ARG H 1 1 8 5351 1 1 10 ARG HA H -9.154 2.657 -3.244 1.00 . A A . 10 ARG HA 1 1 8 5352 1 1 10 ARG HB2 H -10.010 4.824 -3.849 1.00 . A A . 10 ARG HB2 1 1 8 5353 1 1 10 ARG HB3 H -11.252 4.112 -4.849 1.00 . A A . 10 ARG HB3 1 1 8 5354 1 1 10 ARG HD2 H -12.757 5.475 -1.694 1.00 . A A . 10 ARG HD2 1 1 8 5355 1 1 10 ARG HD3 H -11.214 6.039 -2.257 1.00 . A A . 10 ARG HD3 1 1 8 5356 1 1 10 ARG HE H -13.478 5.588 -4.081 1.00 . A A . 10 ARG HE 1 1 8 5357 1 1 10 ARG HG2 H -12.490 3.414 -2.976 1.00 . A A . 10 ARG HG2 1 1 8 5358 1 1 10 ARG HG3 H -11.126 3.669 -1.870 1.00 . A A . 10 ARG HG3 1 1 8 5359 1 1 10 ARG HH11 H -10.651 7.543 -3.102 1.00 . A A . 10 ARG HH11 1 1 8 5360 1 1 10 ARG HH12 H -10.889 8.731 -4.297 1.00 . A A . 10 ARG HH12 1 1 8 5361 1 1 10 ARG HH21 H -13.762 7.267 -5.717 1.00 . A A . 10 ARG HH21 1 1 8 5362 1 1 10 ARG HH22 H -12.709 8.579 -5.795 1.00 . A A . 10 ARG HH22 1 1 8 5363 1 1 10 ARG N N -8.886 2.902 -5.222 1.00 . A A . 10 ARG N 1 1 8 5364 1 1 10 ARG NE N -12.700 6.073 -3.728 1.00 . A A . 10 ARG NE 1 1 8 5365 1 1 10 ARG NH1 N -11.199 7.878 -3.865 1.00 . A A . 10 ARG NH1 1 1 8 5366 1 1 10 ARG NH2 N -12.952 7.721 -5.334 1.00 . A A . 10 ARG NH2 1 1 8 5367 1 1 10 ARG O O -11.800 1.303 -4.094 1.00 . A A . 10 ARG O 1 1 8 5368 1 1 11 PRO C C -10.657 -1.655 -2.761 1.00 . A A . 11 PRO C 1 1 8 5369 1 1 11 PRO CA C -10.410 -1.122 -4.165 1.00 . A A . 11 PRO CA 1 1 8 5370 1 1 11 PRO CB C -9.309 -1.980 -4.821 1.00 . A A . 11 PRO CB 1 1 8 5371 1 1 11 PRO CD C -8.383 0.120 -4.247 1.00 . A A . 11 PRO CD 1 1 8 5372 1 1 11 PRO CG C -8.221 -1.029 -5.181 1.00 . A A . 11 PRO CG 1 1 8 5373 1 1 11 PRO HA H -11.307 -1.183 -4.761 1.00 . A A . 11 PRO HA 1 1 8 5374 1 1 11 PRO HB2 H -8.951 -2.654 -4.054 1.00 . A A . 11 PRO HB2 1 1 8 5375 1 1 11 PRO HB3 H -9.689 -2.526 -5.675 1.00 . A A . 11 PRO HB3 1 1 8 5376 1 1 11 PRO HD2 H -7.948 -0.100 -3.283 1.00 . A A . 11 PRO HD2 1 1 8 5377 1 1 11 PRO HD3 H -7.966 1.023 -4.665 1.00 . A A . 11 PRO HD3 1 1 8 5378 1 1 11 PRO HG2 H -7.251 -1.489 -5.057 1.00 . A A . 11 PRO HG2 1 1 8 5379 1 1 11 PRO HG3 H -8.353 -0.703 -6.201 1.00 . A A . 11 PRO HG3 1 1 8 5380 1 1 11 PRO N N -9.824 0.212 -4.155 1.00 . A A . 11 PRO N 1 1 8 5381 1 1 11 PRO O O -9.852 -1.398 -1.827 1.00 . A A . 11 PRO O 1 1 8 5382 1 1 12 CYS C C -12.286 -4.519 -1.603 1.00 . A A . 12 CYS C 1 1 8 5383 1 1 12 CYS CA C -12.059 -3.024 -1.354 1.00 . A A . 12 CYS CA 1 1 8 5384 1 1 12 CYS CB C -13.334 -2.390 -0.778 1.00 . A A . 12 CYS CB 1 1 8 5385 1 1 12 CYS H H -12.342 -2.553 -3.352 1.00 . A A . 12 CYS H 1 1 8 5386 1 1 12 CYS HA H -11.243 -2.886 -0.661 1.00 . A A . 12 CYS HA 1 1 8 5387 1 1 12 CYS HB2 H -14.166 -2.609 -1.431 1.00 . A A . 12 CYS HB2 1 1 8 5388 1 1 12 CYS HB3 H -13.532 -2.820 0.194 1.00 . A A . 12 CYS HB3 1 1 8 5389 1 1 12 CYS HG H -13.947 -0.082 -1.602 1.00 . A A . 12 CYS HG 1 1 8 5390 1 1 12 CYS N N -11.725 -2.401 -2.606 1.00 . A A . 12 CYS N 1 1 8 5391 1 1 12 CYS O O -13.064 -4.888 -2.482 1.00 . A A . 12 CYS O 1 1 8 5392 1 1 12 CYS SG S -13.263 -0.593 -0.587 1.00 . A A . 12 CYS SG 1 1 8 5393 1 1 13 LYS C C -11.580 -7.392 0.409 1.00 . A A . 13 LYS C 1 1 8 5394 1 1 13 LYS CA C -11.753 -6.790 -0.956 1.00 . A A . 13 LYS CA 1 1 8 5395 1 1 13 LYS CB C -10.719 -7.461 -1.870 1.00 . A A . 13 LYS CB 1 1 8 5396 1 1 13 LYS CD C -9.702 -7.925 -4.071 1.00 . A A . 13 LYS CD 1 1 8 5397 1 1 13 LYS CE C -9.637 -7.635 -5.552 1.00 . A A . 13 LYS CE 1 1 8 5398 1 1 13 LYS CG C -10.722 -7.069 -3.328 1.00 . A A . 13 LYS CG 1 1 8 5399 1 1 13 LYS H H -10.933 -5.029 -0.217 1.00 . A A . 13 LYS H 1 1 8 5400 1 1 13 LYS HA H -12.743 -6.989 -1.330 1.00 . A A . 13 LYS HA 1 1 8 5401 1 1 13 LYS HB2 H -9.730 -7.276 -1.480 1.00 . A A . 13 LYS HB2 1 1 8 5402 1 1 13 LYS HB3 H -10.893 -8.524 -1.805 1.00 . A A . 13 LYS HB3 1 1 8 5403 1 1 13 LYS HD2 H -8.727 -7.734 -3.649 1.00 . A A . 13 LYS HD2 1 1 8 5404 1 1 13 LYS HD3 H -9.953 -8.962 -3.920 1.00 . A A . 13 LYS HD3 1 1 8 5405 1 1 13 LYS HE2 H -10.619 -7.782 -5.973 1.00 . A A . 13 LYS HE2 1 1 8 5406 1 1 13 LYS HE3 H -9.324 -6.612 -5.697 1.00 . A A . 13 LYS HE3 1 1 8 5407 1 1 13 LYS HG2 H -11.717 -7.218 -3.721 1.00 . A A . 13 LYS HG2 1 1 8 5408 1 1 13 LYS HG3 H -10.444 -6.027 -3.408 1.00 . A A . 13 LYS HG3 1 1 8 5409 1 1 13 LYS HZ1 H -7.722 -8.463 -5.788 1.00 . A A . 13 LYS HZ1 1 1 8 5410 1 1 13 LYS HZ2 H -8.548 -8.301 -7.230 1.00 . A A . 13 LYS HZ2 1 1 8 5411 1 1 13 LYS HZ3 H -8.935 -9.538 -6.163 1.00 . A A . 13 LYS HZ3 1 1 8 5412 1 1 13 LYS N N -11.584 -5.353 -0.870 1.00 . A A . 13 LYS N 1 1 8 5413 1 1 13 LYS NZ N -8.663 -8.537 -6.225 1.00 . A A . 13 LYS NZ 1 1 8 5414 1 1 13 LYS O O -10.996 -6.770 1.292 1.00 . A A . 13 LYS O 1 1 8 5415 1 1 14 ASP C C -10.523 -10.060 1.728 1.00 . A A . 14 ASP C 1 1 8 5416 1 1 14 ASP CA C -11.868 -9.379 1.797 1.00 . A A . 14 ASP CA 1 1 8 5417 1 1 14 ASP CB C -12.945 -10.467 1.975 1.00 . A A . 14 ASP CB 1 1 8 5418 1 1 14 ASP CG C -14.353 -9.951 2.077 1.00 . A A . 14 ASP CG 1 1 8 5419 1 1 14 ASP H H -12.560 -9.015 -0.180 1.00 . A A . 14 ASP H 1 1 8 5420 1 1 14 ASP HA H -11.903 -8.692 2.630 1.00 . A A . 14 ASP HA 1 1 8 5421 1 1 14 ASP HB2 H -12.913 -11.106 1.109 1.00 . A A . 14 ASP HB2 1 1 8 5422 1 1 14 ASP HB3 H -12.722 -11.055 2.852 1.00 . A A . 14 ASP HB3 1 1 8 5423 1 1 14 ASP N N -12.057 -8.616 0.564 1.00 . A A . 14 ASP N 1 1 8 5424 1 1 14 ASP O O -10.051 -10.663 2.692 1.00 . A A . 14 ASP O 1 1 8 5425 1 1 14 ASP OD1 O -14.771 -9.549 3.185 1.00 . A A . 14 ASP OD1 1 1 8 5426 1 1 14 ASP OD2 O -15.082 -9.987 1.050 1.00 . A A . 14 ASP OD2 1 1 8 5427 1 1 15 LYS C C -7.702 -9.530 -0.345 1.00 . A A . 15 LYS C 1 1 8 5428 1 1 15 LYS CA C -8.633 -10.573 0.303 1.00 . A A . 15 LYS CA 1 1 8 5429 1 1 15 LYS CB C -8.765 -11.826 -0.611 1.00 . A A . 15 LYS CB 1 1 8 5430 1 1 15 LYS CD C -9.784 -14.109 -1.037 1.00 . A A . 15 LYS CD 1 1 8 5431 1 1 15 LYS CE C -10.705 -15.194 -0.491 1.00 . A A . 15 LYS CE 1 1 8 5432 1 1 15 LYS CG C -9.645 -12.944 -0.045 1.00 . A A . 15 LYS CG 1 1 8 5433 1 1 15 LYS H H -10.383 -9.512 -0.165 1.00 . A A . 15 LYS H 1 1 8 5434 1 1 15 LYS HA H -8.217 -10.873 1.257 1.00 . A A . 15 LYS HA 1 1 8 5435 1 1 15 LYS HB2 H -9.192 -11.522 -1.556 1.00 . A A . 15 LYS HB2 1 1 8 5436 1 1 15 LYS HB3 H -7.783 -12.228 -0.810 1.00 . A A . 15 LYS HB3 1 1 8 5437 1 1 15 LYS HD2 H -10.215 -13.740 -1.956 1.00 . A A . 15 LYS HD2 1 1 8 5438 1 1 15 LYS HD3 H -8.813 -14.543 -1.230 1.00 . A A . 15 LYS HD3 1 1 8 5439 1 1 15 LYS HE2 H -10.283 -15.583 0.424 1.00 . A A . 15 LYS HE2 1 1 8 5440 1 1 15 LYS HE3 H -11.658 -14.740 -0.274 1.00 . A A . 15 LYS HE3 1 1 8 5441 1 1 15 LYS HG2 H -9.202 -13.305 0.873 1.00 . A A . 15 LYS HG2 1 1 8 5442 1 1 15 LYS HG3 H -10.627 -12.544 0.166 1.00 . A A . 15 LYS HG3 1 1 8 5443 1 1 15 LYS HZ1 H -11.249 -15.957 -2.368 1.00 . A A . 15 LYS HZ1 1 1 8 5444 1 1 15 LYS HZ2 H -11.584 -17.022 -1.107 1.00 . A A . 15 LYS HZ2 1 1 8 5445 1 1 15 LYS HZ3 H -10.015 -16.806 -1.652 1.00 . A A . 15 LYS HZ3 1 1 8 5446 1 1 15 LYS N N -9.925 -9.991 0.556 1.00 . A A . 15 LYS N 1 1 8 5447 1 1 15 LYS NZ N -10.907 -16.312 -1.452 1.00 . A A . 15 LYS NZ 1 1 8 5448 1 1 15 LYS O O -7.644 -9.414 -1.577 1.00 . A A . 15 LYS O 1 1 8 5449 1 1 16 VAL C C -5.359 -7.057 1.204 1.00 . A A . 16 VAL C 1 1 8 5450 1 1 16 VAL CA C -6.096 -7.716 0.021 1.00 . A A . 16 VAL CA 1 1 8 5451 1 1 16 VAL CB C -6.723 -6.611 -0.908 1.00 . A A . 16 VAL CB 1 1 8 5452 1 1 16 VAL CG1 C -7.824 -5.852 -0.196 1.00 . A A . 16 VAL CG1 1 1 8 5453 1 1 16 VAL CG2 C -5.639 -5.648 -1.389 1.00 . A A . 16 VAL CG2 1 1 8 5454 1 1 16 VAL H H -7.235 -8.795 1.447 1.00 . A A . 16 VAL H 1 1 8 5455 1 1 16 VAL HA H -5.362 -8.271 -0.550 1.00 . A A . 16 VAL HA 1 1 8 5456 1 1 16 VAL HB H -7.149 -7.102 -1.772 1.00 . A A . 16 VAL HB 1 1 8 5457 1 1 16 VAL HG11 H -8.237 -5.082 -0.830 1.00 . A A . 16 VAL HG11 1 1 8 5458 1 1 16 VAL HG12 H -7.351 -5.421 0.673 1.00 . A A . 16 VAL HG12 1 1 8 5459 1 1 16 VAL HG13 H -8.584 -6.539 0.140 1.00 . A A . 16 VAL HG13 1 1 8 5460 1 1 16 VAL HG21 H -4.866 -6.180 -1.925 1.00 . A A . 16 VAL HG21 1 1 8 5461 1 1 16 VAL HG22 H -5.203 -5.172 -0.520 1.00 . A A . 16 VAL HG22 1 1 8 5462 1 1 16 VAL HG23 H -6.076 -4.897 -2.027 1.00 . A A . 16 VAL HG23 1 1 8 5463 1 1 16 VAL N N -7.060 -8.721 0.486 1.00 . A A . 16 VAL N 1 1 8 5464 1 1 16 VAL O O -5.921 -6.274 1.956 1.00 . A A . 16 VAL O 1 1 8 5465 1 1 17 ASP C C -2.821 -5.462 2.012 1.00 . A A . 17 ASP C 1 1 8 5466 1 1 17 ASP CA C -3.276 -6.868 2.397 1.00 . A A . 17 ASP CA 1 1 8 5467 1 1 17 ASP CB C -2.075 -7.776 2.642 1.00 . A A . 17 ASP CB 1 1 8 5468 1 1 17 ASP CG C -2.498 -9.174 2.999 1.00 . A A . 17 ASP CG 1 1 8 5469 1 1 17 ASP H H -3.864 -8.224 0.859 1.00 . A A . 17 ASP H 1 1 8 5470 1 1 17 ASP HA H -3.848 -6.803 3.313 1.00 . A A . 17 ASP HA 1 1 8 5471 1 1 17 ASP HB2 H -1.494 -7.832 1.733 1.00 . A A . 17 ASP HB2 1 1 8 5472 1 1 17 ASP HB3 H -1.454 -7.394 3.438 1.00 . A A . 17 ASP HB3 1 1 8 5473 1 1 17 ASP N N -4.145 -7.445 1.379 1.00 . A A . 17 ASP N 1 1 8 5474 1 1 17 ASP O O -2.608 -5.149 0.814 1.00 . A A . 17 ASP O 1 1 8 5475 1 1 17 ASP OD1 O -2.694 -9.467 4.199 1.00 . A A . 17 ASP OD1 1 1 8 5476 1 1 17 ASP OD2 O -2.670 -9.990 2.059 1.00 . A A . 17 ASP OD2 1 1 8 5477 1 1 18 TRP C C -0.858 -3.047 3.352 1.00 . A A . 18 TRP C 1 1 8 5478 1 1 18 TRP CA C -2.293 -3.227 2.879 1.00 . A A . 18 TRP CA 1 1 8 5479 1 1 18 TRP CB C -3.232 -2.334 3.722 1.00 . A A . 18 TRP CB 1 1 8 5480 1 1 18 TRP CD1 C -5.465 -3.474 3.095 1.00 . A A . 18 TRP CD1 1 1 8 5481 1 1 18 TRP CD2 C -5.557 -1.240 3.111 1.00 . A A . 18 TRP CD2 1 1 8 5482 1 1 18 TRP CE2 C -6.830 -1.745 2.767 1.00 . A A . 18 TRP CE2 1 1 8 5483 1 1 18 TRP CE3 C -5.383 0.140 3.201 1.00 . A A . 18 TRP CE3 1 1 8 5484 1 1 18 TRP CG C -4.692 -2.368 3.307 1.00 . A A . 18 TRP CG 1 1 8 5485 1 1 18 TRP CH2 C -7.711 0.445 2.599 1.00 . A A . 18 TRP CH2 1 1 8 5486 1 1 18 TRP CZ2 C -7.915 -0.911 2.496 1.00 . A A . 18 TRP CZ2 1 1 8 5487 1 1 18 TRP CZ3 C -6.460 0.969 2.935 1.00 . A A . 18 TRP CZ3 1 1 8 5488 1 1 18 TRP H H -2.801 -4.968 3.927 1.00 . A A . 18 TRP H 1 1 8 5489 1 1 18 TRP HA H -2.364 -2.936 1.841 1.00 . A A . 18 TRP HA 1 1 8 5490 1 1 18 TRP HB2 H -3.178 -2.622 4.762 1.00 . A A . 18 TRP HB2 1 1 8 5491 1 1 18 TRP HB3 H -2.887 -1.315 3.625 1.00 . A A . 18 TRP HB3 1 1 8 5492 1 1 18 TRP HD1 H -5.096 -4.488 3.167 1.00 . A A . 18 TRP HD1 1 1 8 5493 1 1 18 TRP HE1 H -7.453 -3.745 2.535 1.00 . A A . 18 TRP HE1 1 1 8 5494 1 1 18 TRP HE3 H -4.424 0.565 3.459 1.00 . A A . 18 TRP HE3 1 1 8 5495 1 1 18 TRP HH2 H -8.522 1.129 2.403 1.00 . A A . 18 TRP HH2 1 1 8 5496 1 1 18 TRP HZ2 H -8.888 -1.302 2.235 1.00 . A A . 18 TRP HZ2 1 1 8 5497 1 1 18 TRP HZ3 H -6.343 2.041 3.004 1.00 . A A . 18 TRP HZ3 1 1 8 5498 1 1 18 TRP N N -2.671 -4.627 3.017 1.00 . A A . 18 TRP N 1 1 8 5499 1 1 18 TRP NE1 N -6.739 -3.108 2.746 1.00 . A A . 18 TRP NE1 1 1 8 5500 1 1 18 TRP O O -0.343 -3.882 4.090 1.00 . A A . 18 TRP O 1 1 8 5501 1 1 19 VAL C C 1.296 -0.383 4.019 1.00 . A A . 19 VAL C 1 1 8 5502 1 1 19 VAL CA C 1.168 -1.733 3.324 1.00 . A A . 19 VAL CA 1 1 8 5503 1 1 19 VAL CB C 2.167 -1.808 2.122 1.00 . A A . 19 VAL CB 1 1 8 5504 1 1 19 VAL CG1 C 2.219 -3.211 1.550 1.00 . A A . 19 VAL CG1 1 1 8 5505 1 1 19 VAL CG2 C 1.795 -0.816 1.023 1.00 . A A . 19 VAL CG2 1 1 8 5506 1 1 19 VAL H H -0.602 -1.235 2.419 1.00 . A A . 19 VAL H 1 1 8 5507 1 1 19 VAL HA H 1.437 -2.495 4.044 1.00 . A A . 19 VAL HA 1 1 8 5508 1 1 19 VAL HB H 3.152 -1.558 2.489 1.00 . A A . 19 VAL HB 1 1 8 5509 1 1 19 VAL HG11 H 2.920 -3.227 0.732 1.00 . A A . 19 VAL HG11 1 1 8 5510 1 1 19 VAL HG12 H 1.242 -3.490 1.183 1.00 . A A . 19 VAL HG12 1 1 8 5511 1 1 19 VAL HG13 H 2.531 -3.906 2.315 1.00 . A A . 19 VAL HG13 1 1 8 5512 1 1 19 VAL HG21 H 1.826 0.185 1.422 1.00 . A A . 19 VAL HG21 1 1 8 5513 1 1 19 VAL HG22 H 0.801 -1.036 0.665 1.00 . A A . 19 VAL HG22 1 1 8 5514 1 1 19 VAL HG23 H 2.496 -0.901 0.204 1.00 . A A . 19 VAL HG23 1 1 8 5515 1 1 19 VAL N N -0.210 -1.975 2.938 1.00 . A A . 19 VAL N 1 1 8 5516 1 1 19 VAL O O 0.616 0.575 3.656 1.00 . A A . 19 VAL O 1 1 8 5517 1 1 20 GLN C C 3.817 1.330 5.504 1.00 . A A . 20 GLN C 1 1 8 5518 1 1 20 GLN CA C 2.390 0.887 5.766 1.00 . A A . 20 GLN CA 1 1 8 5519 1 1 20 GLN CB C 2.156 0.672 7.261 1.00 . A A . 20 GLN CB 1 1 8 5520 1 1 20 GLN CD C 2.035 1.699 9.581 1.00 . A A . 20 GLN CD 1 1 8 5521 1 1 20 GLN CG C 2.279 1.934 8.103 1.00 . A A . 20 GLN CG 1 1 8 5522 1 1 20 GLN H H 2.583 -1.163 5.289 1.00 . A A . 20 GLN H 1 1 8 5523 1 1 20 GLN HA H 1.720 1.652 5.399 1.00 . A A . 20 GLN HA 1 1 8 5524 1 1 20 GLN HB2 H 1.160 0.278 7.390 1.00 . A A . 20 GLN HB2 1 1 8 5525 1 1 20 GLN HB3 H 2.880 -0.044 7.612 1.00 . A A . 20 GLN HB3 1 1 8 5526 1 1 20 GLN HE21 H 1.250 3.505 9.763 1.00 . A A . 20 GLN HE21 1 1 8 5527 1 1 20 GLN HE22 H 1.343 2.585 11.213 1.00 . A A . 20 GLN HE22 1 1 8 5528 1 1 20 GLN HG2 H 3.273 2.335 7.986 1.00 . A A . 20 GLN HG2 1 1 8 5529 1 1 20 GLN HG3 H 1.560 2.659 7.755 1.00 . A A . 20 GLN HG3 1 1 8 5530 1 1 20 GLN N N 2.129 -0.335 5.024 1.00 . A A . 20 GLN N 1 1 8 5531 1 1 20 GLN NE2 N 1.485 2.687 10.248 1.00 . A A . 20 GLN NE2 1 1 8 5532 1 1 20 GLN O O 4.705 0.495 5.387 1.00 . A A . 20 GLN O 1 1 8 5533 1 1 20 GLN OE1 O 2.309 0.635 10.109 1.00 . A A . 20 GLN OE1 1 1 8 5534 1 1 21 CYS C C 6.079 3.421 6.431 1.00 . A A . 21 CYS C 1 1 8 5535 1 1 21 CYS CA C 5.370 3.090 5.116 1.00 . A A . 21 CYS CA 1 1 8 5536 1 1 21 CYS CB C 5.430 4.258 4.111 1.00 . A A . 21 CYS CB 1 1 8 5537 1 1 21 CYS H H 3.254 3.216 5.361 1.00 . A A . 21 CYS H 1 1 8 5538 1 1 21 CYS HA H 5.922 2.257 4.704 1.00 . A A . 21 CYS HA 1 1 8 5539 1 1 21 CYS HB2 H 6.435 4.616 3.995 1.00 . A A . 21 CYS HB2 1 1 8 5540 1 1 21 CYS HB3 H 5.038 3.945 3.158 1.00 . A A . 21 CYS HB3 1 1 8 5541 1 1 21 CYS N N 4.029 2.618 5.336 1.00 . A A . 21 CYS N 1 1 8 5542 1 1 21 CYS O O 5.826 4.470 7.054 1.00 . A A . 21 CYS O 1 1 8 5543 1 1 21 CYS SG S 4.571 5.750 4.562 1.00 . A A . 21 CYS SG 1 1 8 5544 1 1 22 ASP C C 8.902 3.700 7.928 1.00 . A A . 22 ASP C 1 1 8 5545 1 1 22 ASP CA C 7.784 2.674 8.074 1.00 . A A . 22 ASP CA 1 1 8 5546 1 1 22 ASP CB C 8.381 1.319 8.501 1.00 . A A . 22 ASP CB 1 1 8 5547 1 1 22 ASP CG C 7.367 0.345 9.091 1.00 . A A . 22 ASP CG 1 1 8 5548 1 1 22 ASP H H 7.173 1.783 6.226 1.00 . A A . 22 ASP H 1 1 8 5549 1 1 22 ASP HA H 7.107 3.014 8.845 1.00 . A A . 22 ASP HA 1 1 8 5550 1 1 22 ASP HB2 H 8.833 0.853 7.639 1.00 . A A . 22 ASP HB2 1 1 8 5551 1 1 22 ASP HB3 H 9.147 1.509 9.236 1.00 . A A . 22 ASP HB3 1 1 8 5552 1 1 22 ASP N N 7.000 2.546 6.821 1.00 . A A . 22 ASP N 1 1 8 5553 1 1 22 ASP O O 9.919 3.648 8.612 1.00 . A A . 22 ASP O 1 1 8 5554 1 1 22 ASP OD1 O 6.659 -0.316 8.320 1.00 . A A . 22 ASP OD1 1 1 8 5555 1 1 22 ASP OD2 O 7.310 0.228 10.351 1.00 . A A . 22 ASP OD2 1 1 8 5556 1 1 23 GLY C C 9.325 6.911 7.757 1.00 . A A . 23 GLY C 1 1 8 5557 1 1 23 GLY CA C 9.641 5.704 6.882 1.00 . A A . 23 GLY CA 1 1 8 5558 1 1 23 GLY H H 7.801 4.667 6.654 1.00 . A A . 23 GLY H 1 1 8 5559 1 1 23 GLY HA2 H 10.616 5.313 7.143 1.00 . A A . 23 GLY HA2 1 1 8 5560 1 1 23 GLY HA3 H 9.651 5.994 5.838 1.00 . A A . 23 GLY HA3 1 1 8 5561 1 1 23 GLY N N 8.678 4.669 7.084 1.00 . A A . 23 GLY N 1 1 8 5562 1 1 23 GLY O O 10.204 7.685 8.081 1.00 . A A . 23 GLY O 1 1 8 5563 1 1 24 GLY C C 6.289 8.795 8.737 1.00 . A A . 24 GLY C 1 1 8 5564 1 1 24 GLY CA C 7.668 8.170 9.029 1.00 . A A . 24 GLY CA 1 1 8 5565 1 1 24 GLY H H 7.414 6.334 7.930 1.00 . A A . 24 GLY H 1 1 8 5566 1 1 24 GLY HA2 H 7.675 7.814 10.050 1.00 . A A . 24 GLY HA2 1 1 8 5567 1 1 24 GLY HA3 H 8.428 8.933 8.933 1.00 . A A . 24 GLY HA3 1 1 8 5568 1 1 24 GLY N N 8.045 7.042 8.174 1.00 . A A . 24 GLY N 1 1 8 5569 1 1 24 GLY O O 5.927 9.789 9.364 1.00 . A A . 24 GLY O 1 1 8 5570 1 1 25 CYS C C 3.146 8.023 8.307 1.00 . A A . 25 CYS C 1 1 8 5571 1 1 25 CYS CA C 4.179 8.826 7.525 1.00 . A A . 25 CYS CA 1 1 8 5572 1 1 25 CYS CB C 3.793 8.769 6.043 1.00 . A A . 25 CYS CB 1 1 8 5573 1 1 25 CYS H H 5.885 7.530 7.230 1.00 . A A . 25 CYS H 1 1 8 5574 1 1 25 CYS HA H 4.175 9.850 7.870 1.00 . A A . 25 CYS HA 1 1 8 5575 1 1 25 CYS HB2 H 3.602 7.738 5.785 1.00 . A A . 25 CYS HB2 1 1 8 5576 1 1 25 CYS HB3 H 2.883 9.336 5.904 1.00 . A A . 25 CYS HB3 1 1 8 5577 1 1 25 CYS N N 5.531 8.259 7.775 1.00 . A A . 25 CYS N 1 1 8 5578 1 1 25 CYS O O 2.110 8.539 8.700 1.00 . A A . 25 CYS O 1 1 8 5579 1 1 25 CYS SG S 5.020 9.385 4.886 1.00 . A A . 25 CYS SG 1 1 8 5580 1 1 26 ASP C C 1.275 5.498 8.409 1.00 . A A . 26 ASP C 1 1 8 5581 1 1 26 ASP CA C 2.571 5.745 9.192 1.00 . A A . 26 ASP CA 1 1 8 5582 1 1 26 ASP CB C 2.222 6.177 10.638 1.00 . A A . 26 ASP CB 1 1 8 5583 1 1 26 ASP CG C 3.397 6.183 11.603 1.00 . A A . 26 ASP CG 1 1 8 5584 1 1 26 ASP H H 4.348 6.431 8.221 1.00 . A A . 26 ASP H 1 1 8 5585 1 1 26 ASP HA H 3.109 4.809 9.231 1.00 . A A . 26 ASP HA 1 1 8 5586 1 1 26 ASP HB2 H 1.780 7.161 10.618 1.00 . A A . 26 ASP HB2 1 1 8 5587 1 1 26 ASP HB3 H 1.479 5.491 11.024 1.00 . A A . 26 ASP HB3 1 1 8 5588 1 1 26 ASP N N 3.460 6.720 8.509 1.00 . A A . 26 ASP N 1 1 8 5589 1 1 26 ASP O O 0.316 4.907 8.942 1.00 . A A . 26 ASP O 1 1 8 5590 1 1 26 ASP OD1 O 4.202 7.148 11.589 1.00 . A A . 26 ASP OD1 1 1 8 5591 1 1 26 ASP OD2 O 3.487 5.247 12.422 1.00 . A A . 26 ASP OD2 1 1 8 5592 1 1 27 GLU C C -0.078 4.351 5.767 1.00 . A A . 27 GLU C 1 1 8 5593 1 1 27 GLU CA C 0.071 5.753 6.325 1.00 . A A . 27 GLU CA 1 1 8 5594 1 1 27 GLU CB C 0.083 6.764 5.190 1.00 . A A . 27 GLU CB 1 1 8 5595 1 1 27 GLU CD C 0.169 9.178 4.499 1.00 . A A . 27 GLU CD 1 1 8 5596 1 1 27 GLU CG C 0.130 8.207 5.649 1.00 . A A . 27 GLU CG 1 1 8 5597 1 1 27 GLU H H 2.071 6.261 6.744 1.00 . A A . 27 GLU H 1 1 8 5598 1 1 27 GLU HA H -0.790 5.945 6.949 1.00 . A A . 27 GLU HA 1 1 8 5599 1 1 27 GLU HB2 H 0.932 6.581 4.548 1.00 . A A . 27 GLU HB2 1 1 8 5600 1 1 27 GLU HB3 H -0.827 6.622 4.625 1.00 . A A . 27 GLU HB3 1 1 8 5601 1 1 27 GLU HG2 H -0.761 8.406 6.224 1.00 . A A . 27 GLU HG2 1 1 8 5602 1 1 27 GLU HG3 H 0.997 8.360 6.274 1.00 . A A . 27 GLU HG3 1 1 8 5603 1 1 27 GLU N N 1.264 5.879 7.147 1.00 . A A . 27 GLU N 1 1 8 5604 1 1 27 GLU O O 0.878 3.588 5.713 1.00 . A A . 27 GLU O 1 1 8 5605 1 1 27 GLU OE1 O 1.265 9.449 3.974 1.00 . A A . 27 GLU OE1 1 1 8 5606 1 1 27 GLU OE2 O -0.905 9.683 4.113 1.00 . A A . 27 GLU OE2 1 1 8 5607 1 1 28 TRP C C -1.993 2.896 3.304 1.00 . A A . 28 TRP C 1 1 8 5608 1 1 28 TRP CA C -1.615 2.752 4.763 1.00 . A A . 28 TRP CA 1 1 8 5609 1 1 28 TRP CB C -2.732 2.050 5.549 1.00 . A A . 28 TRP CB 1 1 8 5610 1 1 28 TRP CD1 C -2.372 2.393 8.068 1.00 . A A . 28 TRP CD1 1 1 8 5611 1 1 28 TRP CD2 C -1.752 0.383 7.295 1.00 . A A . 28 TRP CD2 1 1 8 5612 1 1 28 TRP CE2 C -1.496 0.432 8.675 1.00 . A A . 28 TRP CE2 1 1 8 5613 1 1 28 TRP CE3 C -1.439 -0.790 6.590 1.00 . A A . 28 TRP CE3 1 1 8 5614 1 1 28 TRP CG C -2.312 1.643 6.923 1.00 . A A . 28 TRP CG 1 1 8 5615 1 1 28 TRP CH2 C -0.644 -1.772 8.648 1.00 . A A . 28 TRP CH2 1 1 8 5616 1 1 28 TRP CZ2 C -0.939 -0.642 9.366 1.00 . A A . 28 TRP CZ2 1 1 8 5617 1 1 28 TRP CZ3 C -0.888 -1.851 7.274 1.00 . A A . 28 TRP CZ3 1 1 8 5618 1 1 28 TRP H H -1.961 4.747 5.375 1.00 . A A . 28 TRP H 1 1 8 5619 1 1 28 TRP HA H -0.715 2.155 4.819 1.00 . A A . 28 TRP HA 1 1 8 5620 1 1 28 TRP HB2 H -3.582 2.709 5.637 1.00 . A A . 28 TRP HB2 1 1 8 5621 1 1 28 TRP HB3 H -3.033 1.164 5.010 1.00 . A A . 28 TRP HB3 1 1 8 5622 1 1 28 TRP HD1 H -2.750 3.403 8.109 1.00 . A A . 28 TRP HD1 1 1 8 5623 1 1 28 TRP HE1 H -1.815 1.982 10.055 1.00 . A A . 28 TRP HE1 1 1 8 5624 1 1 28 TRP HE3 H -1.620 -0.874 5.530 1.00 . A A . 28 TRP HE3 1 1 8 5625 1 1 28 TRP HH2 H -0.211 -2.633 9.139 1.00 . A A . 28 TRP HH2 1 1 8 5626 1 1 28 TRP HZ2 H -0.745 -0.601 10.427 1.00 . A A . 28 TRP HZ2 1 1 8 5627 1 1 28 TRP HZ3 H -0.638 -2.754 6.736 1.00 . A A . 28 TRP HZ3 1 1 8 5628 1 1 28 TRP N N -1.282 4.046 5.336 1.00 . A A . 28 TRP N 1 1 8 5629 1 1 28 TRP NE1 N -1.884 1.668 9.128 1.00 . A A . 28 TRP NE1 1 1 8 5630 1 1 28 TRP O O -2.893 3.672 2.951 1.00 . A A . 28 TRP O 1 1 8 5631 1 1 29 PHE C C -1.960 0.857 0.559 1.00 . A A . 29 PHE C 1 1 8 5632 1 1 29 PHE CA C -1.436 2.218 1.043 1.00 . A A . 29 PHE CA 1 1 8 5633 1 1 29 PHE CB C -0.023 2.452 0.411 1.00 . A A . 29 PHE CB 1 1 8 5634 1 1 29 PHE CD1 C 1.309 3.547 2.254 1.00 . A A . 29 PHE CD1 1 1 8 5635 1 1 29 PHE CD2 C 1.008 4.772 0.241 1.00 . A A . 29 PHE CD2 1 1 8 5636 1 1 29 PHE CE1 C 2.041 4.579 2.775 1.00 . A A . 29 PHE CE1 1 1 8 5637 1 1 29 PHE CE2 C 1.742 5.811 0.766 1.00 . A A . 29 PHE CE2 1 1 8 5638 1 1 29 PHE CG C 0.773 3.626 0.980 1.00 . A A . 29 PHE CG 1 1 8 5639 1 1 29 PHE CZ C 2.261 5.711 2.034 1.00 . A A . 29 PHE CZ 1 1 8 5640 1 1 29 PHE H H -0.629 1.550 2.859 1.00 . A A . 29 PHE H 1 1 8 5641 1 1 29 PHE HA H -2.099 3.017 0.738 1.00 . A A . 29 PHE HA 1 1 8 5642 1 1 29 PHE HB2 H 0.579 1.565 0.535 1.00 . A A . 29 PHE HB2 1 1 8 5643 1 1 29 PHE HB3 H -0.161 2.629 -0.647 1.00 . A A . 29 PHE HB3 1 1 8 5644 1 1 29 PHE HD1 H 1.139 2.654 2.838 1.00 . A A . 29 PHE HD1 1 1 8 5645 1 1 29 PHE HD2 H 0.608 4.875 -0.756 1.00 . A A . 29 PHE HD2 1 1 8 5646 1 1 29 PHE HE1 H 2.445 4.494 3.775 1.00 . A A . 29 PHE HE1 1 1 8 5647 1 1 29 PHE HE2 H 1.921 6.704 0.184 1.00 . A A . 29 PHE HE2 1 1 8 5648 1 1 29 PHE HZ H 2.845 6.519 2.457 1.00 . A A . 29 PHE HZ 1 1 8 5649 1 1 29 PHE N N -1.299 2.165 2.479 1.00 . A A . 29 PHE N 1 1 8 5650 1 1 29 PHE O O -1.782 -0.161 1.234 1.00 . A A . 29 PHE O 1 1 8 5651 1 1 30 HIS C C -1.917 -0.931 -2.061 1.00 . A A . 30 HIS C 1 1 8 5652 1 1 30 HIS CA C -3.028 -0.435 -1.201 1.00 . A A . 30 HIS CA 1 1 8 5653 1 1 30 HIS CB C -4.255 -0.256 -2.119 1.00 . A A . 30 HIS CB 1 1 8 5654 1 1 30 HIS CD2 C -6.477 -0.898 -0.972 1.00 . A A . 30 HIS CD2 1 1 8 5655 1 1 30 HIS CE1 C -7.422 1.069 -1.011 1.00 . A A . 30 HIS CE1 1 1 8 5656 1 1 30 HIS CG C -5.584 -0.029 -1.497 1.00 . A A . 30 HIS CG 1 1 8 5657 1 1 30 HIS H H -2.710 1.687 -1.069 1.00 . A A . 30 HIS H 1 1 8 5658 1 1 30 HIS HA H -3.252 -1.149 -0.422 1.00 . A A . 30 HIS HA 1 1 8 5659 1 1 30 HIS HB2 H -4.066 0.685 -2.618 1.00 . A A . 30 HIS HB2 1 1 8 5660 1 1 30 HIS HB3 H -4.333 -0.987 -2.905 1.00 . A A . 30 HIS HB3 1 1 8 5661 1 1 30 HIS HD2 H -6.320 -1.954 -0.800 1.00 . A A . 30 HIS HD2 1 1 8 5662 1 1 30 HIS HE1 H -8.159 1.852 -0.914 1.00 . A A . 30 HIS HE1 1 1 8 5663 1 1 30 HIS HE2 H -8.507 -0.605 -0.706 1.00 . A A . 30 HIS HE2 1 1 8 5664 1 1 30 HIS N N -2.592 0.833 -0.600 1.00 . A A . 30 HIS N 1 1 8 5665 1 1 30 HIS ND1 N -6.194 1.199 -1.503 1.00 . A A . 30 HIS ND1 1 1 8 5666 1 1 30 HIS NE2 N -7.613 -0.190 -0.686 1.00 . A A . 30 HIS NE2 1 1 8 5667 1 1 30 HIS O O -1.307 -0.135 -2.770 1.00 . A A . 30 HIS O 1 1 8 5668 1 1 31 GLN C C -0.832 -2.494 -4.336 1.00 . A A . 31 GLN C 1 1 8 5669 1 1 31 GLN CA C -0.611 -2.784 -2.861 1.00 . A A . 31 GLN CA 1 1 8 5670 1 1 31 GLN CB C -0.388 -4.270 -2.595 1.00 . A A . 31 GLN CB 1 1 8 5671 1 1 31 GLN CD C 0.508 -6.031 -1.008 1.00 . A A . 31 GLN CD 1 1 8 5672 1 1 31 GLN CG C 0.272 -4.554 -1.258 1.00 . A A . 31 GLN CG 1 1 8 5673 1 1 31 GLN H H -2.162 -2.786 -1.404 1.00 . A A . 31 GLN H 1 1 8 5674 1 1 31 GLN HA H 0.278 -2.245 -2.579 1.00 . A A . 31 GLN HA 1 1 8 5675 1 1 31 GLN HB2 H -1.350 -4.770 -2.617 1.00 . A A . 31 GLN HB2 1 1 8 5676 1 1 31 GLN HB3 H 0.251 -4.659 -3.380 1.00 . A A . 31 GLN HB3 1 1 8 5677 1 1 31 GLN HE21 H -1.152 -6.129 -0.014 1.00 . A A . 31 GLN HE21 1 1 8 5678 1 1 31 GLN HE22 H -0.297 -7.617 -0.135 1.00 . A A . 31 GLN HE22 1 1 8 5679 1 1 31 GLN HG2 H 1.227 -4.053 -1.232 1.00 . A A . 31 GLN HG2 1 1 8 5680 1 1 31 GLN HG3 H -0.350 -4.162 -0.472 1.00 . A A . 31 GLN HG3 1 1 8 5681 1 1 31 GLN N N -1.657 -2.217 -2.025 1.00 . A A . 31 GLN N 1 1 8 5682 1 1 31 GLN NE2 N -0.393 -6.661 -0.324 1.00 . A A . 31 GLN NE2 1 1 8 5683 1 1 31 GLN O O 0.032 -1.982 -4.982 1.00 . A A . 31 GLN O 1 1 8 5684 1 1 31 GLN OE1 O 1.529 -6.573 -1.385 1.00 . A A . 31 GLN OE1 1 1 8 5685 1 1 32 VAL C C -2.281 -1.007 -6.631 1.00 . A A . 32 VAL C 1 1 8 5686 1 1 32 VAL CA C -2.295 -2.529 -6.257 1.00 . A A . 32 VAL CA 1 1 8 5687 1 1 32 VAL CB C -3.654 -3.148 -6.675 1.00 . A A . 32 VAL CB 1 1 8 5688 1 1 32 VAL CG1 C -4.774 -2.489 -5.922 1.00 . A A . 32 VAL CG1 1 1 8 5689 1 1 32 VAL CG2 C -3.870 -2.988 -8.152 1.00 . A A . 32 VAL CG2 1 1 8 5690 1 1 32 VAL H H -2.725 -3.117 -4.262 1.00 . A A . 32 VAL H 1 1 8 5691 1 1 32 VAL HA H -1.514 -3.025 -6.814 1.00 . A A . 32 VAL HA 1 1 8 5692 1 1 32 VAL HB H -3.662 -4.202 -6.441 1.00 . A A . 32 VAL HB 1 1 8 5693 1 1 32 VAL HG11 H -4.605 -2.639 -4.869 1.00 . A A . 32 VAL HG11 1 1 8 5694 1 1 32 VAL HG12 H -5.737 -2.867 -6.238 1.00 . A A . 32 VAL HG12 1 1 8 5695 1 1 32 VAL HG13 H -4.667 -1.435 -6.153 1.00 . A A . 32 VAL HG13 1 1 8 5696 1 1 32 VAL HG21 H -3.889 -1.916 -8.300 1.00 . A A . 32 VAL HG21 1 1 8 5697 1 1 32 VAL HG22 H -4.817 -3.415 -8.444 1.00 . A A . 32 VAL HG22 1 1 8 5698 1 1 32 VAL HG23 H -3.052 -3.437 -8.691 1.00 . A A . 32 VAL HG23 1 1 8 5699 1 1 32 VAL N N -2.022 -2.757 -4.839 1.00 . A A . 32 VAL N 1 1 8 5700 1 1 32 VAL O O -1.802 -0.623 -7.690 1.00 . A A . 32 VAL O 1 1 8 5701 1 1 33 CYS C C -1.560 1.989 -5.940 1.00 . A A . 33 CYS C 1 1 8 5702 1 1 33 CYS CA C -2.917 1.255 -6.025 1.00 . A A . 33 CYS CA 1 1 8 5703 1 1 33 CYS CB C -4.006 1.933 -5.144 1.00 . A A . 33 CYS CB 1 1 8 5704 1 1 33 CYS H H -3.045 -0.652 -4.931 1.00 . A A . 33 CYS H 1 1 8 5705 1 1 33 CYS HA H -3.210 1.352 -7.057 1.00 . A A . 33 CYS HA 1 1 8 5706 1 1 33 CYS HB2 H -4.383 2.813 -5.615 1.00 . A A . 33 CYS HB2 1 1 8 5707 1 1 33 CYS HB3 H -4.843 1.259 -5.041 1.00 . A A . 33 CYS HB3 1 1 8 5708 1 1 33 CYS N N -2.787 -0.170 -5.734 1.00 . A A . 33 CYS N 1 1 8 5709 1 1 33 CYS O O -1.373 3.025 -6.568 1.00 . A A . 33 CYS O 1 1 8 5710 1 1 33 CYS SG S -3.512 2.380 -3.494 1.00 . A A . 33 CYS SG 1 1 8 5711 1 1 34 VAL C C 1.749 1.173 -5.802 1.00 . A A . 34 VAL C 1 1 8 5712 1 1 34 VAL CA C 0.668 2.059 -5.073 1.00 . A A . 34 VAL CA 1 1 8 5713 1 1 34 VAL CB C 1.038 2.310 -3.596 1.00 . A A . 34 VAL CB 1 1 8 5714 1 1 34 VAL CG1 C 1.719 1.162 -2.926 1.00 . A A . 34 VAL CG1 1 1 8 5715 1 1 34 VAL CG2 C 1.716 3.621 -3.421 1.00 . A A . 34 VAL CG2 1 1 8 5716 1 1 34 VAL H H -0.769 0.694 -4.558 1.00 . A A . 34 VAL H 1 1 8 5717 1 1 34 VAL HA H 0.604 3.010 -5.584 1.00 . A A . 34 VAL HA 1 1 8 5718 1 1 34 VAL HB H 0.148 2.326 -2.993 1.00 . A A . 34 VAL HB 1 1 8 5719 1 1 34 VAL HG11 H 1.911 1.406 -1.892 1.00 . A A . 34 VAL HG11 1 1 8 5720 1 1 34 VAL HG12 H 2.661 0.998 -3.428 1.00 . A A . 34 VAL HG12 1 1 8 5721 1 1 34 VAL HG13 H 1.087 0.286 -2.980 1.00 . A A . 34 VAL HG13 1 1 8 5722 1 1 34 VAL HG21 H 1.016 4.339 -3.826 1.00 . A A . 34 VAL HG21 1 1 8 5723 1 1 34 VAL HG22 H 2.635 3.642 -3.982 1.00 . A A . 34 VAL HG22 1 1 8 5724 1 1 34 VAL HG23 H 1.869 3.794 -2.369 1.00 . A A . 34 VAL HG23 1 1 8 5725 1 1 34 VAL N N -0.616 1.454 -5.154 1.00 . A A . 34 VAL N 1 1 8 5726 1 1 34 VAL O O 2.958 1.443 -5.739 1.00 . A A . 34 VAL O 1 1 8 5727 1 1 35 GLY C C 3.095 -1.654 -6.493 1.00 . A A . 35 GLY C 1 1 8 5728 1 1 35 GLY CA C 2.143 -0.734 -7.298 1.00 . A A . 35 GLY CA 1 1 8 5729 1 1 35 GLY H H 0.288 0.106 -6.593 1.00 . A A . 35 GLY H 1 1 8 5730 1 1 35 GLY HA2 H 1.510 -1.374 -7.893 1.00 . A A . 35 GLY HA2 1 1 8 5731 1 1 35 GLY HA3 H 2.722 -0.128 -7.980 1.00 . A A . 35 GLY HA3 1 1 8 5732 1 1 35 GLY N N 1.269 0.161 -6.527 1.00 . A A . 35 GLY N 1 1 8 5733 1 1 35 GLY O O 4.245 -1.858 -6.896 1.00 . A A . 35 GLY O 1 1 8 5734 1 1 36 VAL C C 2.963 -4.567 -5.015 1.00 . A A . 36 VAL C 1 1 8 5735 1 1 36 VAL CA C 3.391 -3.163 -4.616 1.00 . A A . 36 VAL CA 1 1 8 5736 1 1 36 VAL CB C 3.111 -2.983 -3.091 1.00 . A A . 36 VAL CB 1 1 8 5737 1 1 36 VAL CG1 C 3.788 -4.056 -2.247 1.00 . A A . 36 VAL CG1 1 1 8 5738 1 1 36 VAL CG2 C 3.527 -1.620 -2.630 1.00 . A A . 36 VAL CG2 1 1 8 5739 1 1 36 VAL H H 1.744 -1.947 -5.072 1.00 . A A . 36 VAL H 1 1 8 5740 1 1 36 VAL HA H 4.450 -3.035 -4.795 1.00 . A A . 36 VAL HA 1 1 8 5741 1 1 36 VAL HB H 2.045 -3.076 -2.950 1.00 . A A . 36 VAL HB 1 1 8 5742 1 1 36 VAL HG11 H 4.860 -4.068 -2.380 1.00 . A A . 36 VAL HG11 1 1 8 5743 1 1 36 VAL HG12 H 3.398 -5.004 -2.583 1.00 . A A . 36 VAL HG12 1 1 8 5744 1 1 36 VAL HG13 H 3.528 -3.922 -1.207 1.00 . A A . 36 VAL HG13 1 1 8 5745 1 1 36 VAL HG21 H 3.365 -1.518 -1.568 1.00 . A A . 36 VAL HG21 1 1 8 5746 1 1 36 VAL HG22 H 2.952 -0.872 -3.156 1.00 . A A . 36 VAL HG22 1 1 8 5747 1 1 36 VAL HG23 H 4.575 -1.470 -2.844 1.00 . A A . 36 VAL HG23 1 1 8 5748 1 1 36 VAL N N 2.635 -2.196 -5.401 1.00 . A A . 36 VAL N 1 1 8 5749 1 1 36 VAL O O 1.795 -4.791 -5.334 1.00 . A A . 36 VAL O 1 1 8 5750 1 1 37 SER C C 3.428 -7.565 -3.942 1.00 . A A . 37 SER C 1 1 8 5751 1 1 37 SER CA C 3.588 -6.845 -5.284 1.00 . A A . 37 SER CA 1 1 8 5752 1 1 37 SER CB C 4.738 -7.431 -6.098 1.00 . A A . 37 SER CB 1 1 8 5753 1 1 37 SER H H 4.831 -5.395 -4.764 1.00 . A A . 37 SER H 1 1 8 5754 1 1 37 SER HA H 2.672 -6.902 -5.855 1.00 . A A . 37 SER HA 1 1 8 5755 1 1 37 SER HB2 H 4.572 -8.494 -6.214 1.00 . A A . 37 SER HB2 1 1 8 5756 1 1 37 SER HB3 H 4.761 -6.979 -7.080 1.00 . A A . 37 SER HB3 1 1 8 5757 1 1 37 SER HG H 6.690 -7.259 -6.095 1.00 . A A . 37 SER HG 1 1 8 5758 1 1 37 SER N N 3.885 -5.492 -5.002 1.00 . A A . 37 SER N 1 1 8 5759 1 1 37 SER O O 4.108 -7.206 -2.976 1.00 . A A . 37 SER O 1 1 8 5760 1 1 37 SER OG O 5.985 -7.203 -5.447 1.00 . A A . 37 SER OG 1 1 8 5761 1 1 38 PRO C C 3.527 -9.904 -1.952 1.00 . A A . 38 PRO C 1 1 8 5762 1 1 38 PRO CA C 2.266 -9.306 -2.588 1.00 . A A . 38 PRO CA 1 1 8 5763 1 1 38 PRO CB C 1.300 -10.423 -3.022 1.00 . A A . 38 PRO CB 1 1 8 5764 1 1 38 PRO CD C 1.778 -9.136 -4.977 1.00 . A A . 38 PRO CD 1 1 8 5765 1 1 38 PRO CG C 1.464 -10.521 -4.501 1.00 . A A . 38 PRO CG 1 1 8 5766 1 1 38 PRO HA H 1.777 -8.659 -1.873 1.00 . A A . 38 PRO HA 1 1 8 5767 1 1 38 PRO HB2 H 1.571 -11.344 -2.526 1.00 . A A . 38 PRO HB2 1 1 8 5768 1 1 38 PRO HB3 H 0.291 -10.140 -2.752 1.00 . A A . 38 PRO HB3 1 1 8 5769 1 1 38 PRO HD2 H 2.375 -9.167 -5.877 1.00 . A A . 38 PRO HD2 1 1 8 5770 1 1 38 PRO HD3 H 0.881 -8.555 -5.136 1.00 . A A . 38 PRO HD3 1 1 8 5771 1 1 38 PRO HG2 H 2.291 -11.179 -4.711 1.00 . A A . 38 PRO HG2 1 1 8 5772 1 1 38 PRO HG3 H 0.560 -10.880 -4.966 1.00 . A A . 38 PRO HG3 1 1 8 5773 1 1 38 PRO N N 2.555 -8.588 -3.859 1.00 . A A . 38 PRO N 1 1 8 5774 1 1 38 PRO O O 3.611 -10.087 -0.738 1.00 . A A . 38 PRO O 1 1 8 5775 1 1 39 GLU C C 6.628 -9.676 -1.645 1.00 . A A . 39 GLU C 1 1 8 5776 1 1 39 GLU CA C 5.759 -10.735 -2.383 1.00 . A A . 39 GLU CA 1 1 8 5777 1 1 39 GLU CB C 6.484 -11.301 -3.617 1.00 . A A . 39 GLU CB 1 1 8 5778 1 1 39 GLU CD C 8.377 -12.646 -4.561 1.00 . A A . 39 GLU CD 1 1 8 5779 1 1 39 GLU CG C 7.747 -12.083 -3.309 1.00 . A A . 39 GLU CG 1 1 8 5780 1 1 39 GLU H H 4.399 -9.903 -3.728 1.00 . A A . 39 GLU H 1 1 8 5781 1 1 39 GLU HA H 5.549 -11.545 -1.701 1.00 . A A . 39 GLU HA 1 1 8 5782 1 1 39 GLU HB2 H 5.809 -11.961 -4.146 1.00 . A A . 39 GLU HB2 1 1 8 5783 1 1 39 GLU HB3 H 6.743 -10.477 -4.268 1.00 . A A . 39 GLU HB3 1 1 8 5784 1 1 39 GLU HG2 H 8.439 -11.404 -2.836 1.00 . A A . 39 GLU HG2 1 1 8 5785 1 1 39 GLU HG3 H 7.519 -12.889 -2.627 1.00 . A A . 39 GLU HG3 1 1 8 5786 1 1 39 GLU N N 4.510 -10.161 -2.792 1.00 . A A . 39 GLU N 1 1 8 5787 1 1 39 GLU O O 7.405 -10.009 -0.754 1.00 . A A . 39 GLU O 1 1 8 5788 1 1 39 GLU OE1 O 7.706 -13.425 -5.264 1.00 . A A . 39 GLU OE1 1 1 8 5789 1 1 39 GLU OE2 O 9.548 -12.336 -4.848 1.00 . A A . 39 GLU OE2 1 1 8 5790 1 1 40 MET C C 6.837 -7.025 -0.007 1.00 . A A . 40 MET C 1 1 8 5791 1 1 40 MET CA C 7.272 -7.320 -1.430 1.00 . A A . 40 MET CA 1 1 8 5792 1 1 40 MET CB C 7.202 -6.024 -2.269 1.00 . A A . 40 MET CB 1 1 8 5793 1 1 40 MET CE C 6.956 -2.880 -3.178 1.00 . A A . 40 MET CE 1 1 8 5794 1 1 40 MET CG C 8.236 -4.982 -1.830 1.00 . A A . 40 MET CG 1 1 8 5795 1 1 40 MET H H 5.731 -8.179 -2.633 1.00 . A A . 40 MET H 1 1 8 5796 1 1 40 MET HA H 8.295 -7.671 -1.420 1.00 . A A . 40 MET HA 1 1 8 5797 1 1 40 MET HB2 H 7.157 -6.150 -3.335 1.00 . A A . 40 MET HB2 1 1 8 5798 1 1 40 MET HB3 H 6.242 -5.598 -2.014 1.00 . A A . 40 MET HB3 1 1 8 5799 1 1 40 MET HE1 H 6.598 -2.604 -2.196 1.00 . A A . 40 MET HE1 1 1 8 5800 1 1 40 MET HE2 H 6.273 -3.578 -3.634 1.00 . A A . 40 MET HE2 1 1 8 5801 1 1 40 MET HE3 H 7.037 -2.007 -3.806 1.00 . A A . 40 MET HE3 1 1 8 5802 1 1 40 MET HG2 H 7.845 -4.552 -0.919 1.00 . A A . 40 MET HG2 1 1 8 5803 1 1 40 MET HG3 H 9.168 -5.490 -1.618 1.00 . A A . 40 MET HG3 1 1 8 5804 1 1 40 MET N N 6.455 -8.395 -2.005 1.00 . A A . 40 MET N 1 1 8 5805 1 1 40 MET O O 7.653 -6.821 0.869 1.00 . A A . 40 MET O 1 1 8 5806 1 1 40 MET SD S 8.540 -3.638 -3.024 1.00 . A A . 40 MET SD 1 1 8 5807 1 1 41 ALA C C 5.468 -7.568 2.696 1.00 . A A . 41 ALA C 1 1 8 5808 1 1 41 ALA CA C 4.921 -6.716 1.503 1.00 . A A . 41 ALA CA 1 1 8 5809 1 1 41 ALA CB C 3.391 -6.826 1.399 1.00 . A A . 41 ALA CB 1 1 8 5810 1 1 41 ALA H H 4.947 -7.296 -0.544 1.00 . A A . 41 ALA H 1 1 8 5811 1 1 41 ALA HA H 5.163 -5.677 1.685 1.00 . A A . 41 ALA HA 1 1 8 5812 1 1 41 ALA HB1 H 2.923 -6.490 2.313 1.00 . A A . 41 ALA HB1 1 1 8 5813 1 1 41 ALA HB2 H 3.112 -7.853 1.216 1.00 . A A . 41 ALA HB2 1 1 8 5814 1 1 41 ALA HB3 H 3.026 -6.227 0.574 1.00 . A A . 41 ALA HB3 1 1 8 5815 1 1 41 ALA N N 5.531 -7.059 0.208 1.00 . A A . 41 ALA N 1 1 8 5816 1 1 41 ALA O O 5.780 -7.025 3.744 1.00 . A A . 41 ALA O 1 1 8 5817 1 1 42 GLU C C 7.586 -9.893 3.653 1.00 . A A . 42 GLU C 1 1 8 5818 1 1 42 GLU CA C 6.070 -9.751 3.606 1.00 . A A . 42 GLU CA 1 1 8 5819 1 1 42 GLU CB C 5.449 -11.149 3.565 1.00 . A A . 42 GLU CB 1 1 8 5820 1 1 42 GLU CD C 3.490 -12.624 3.973 1.00 . A A . 42 GLU CD 1 1 8 5821 1 1 42 GLU CG C 3.953 -11.210 3.724 1.00 . A A . 42 GLU CG 1 1 8 5822 1 1 42 GLU H H 5.280 -9.171 1.638 1.00 . A A . 42 GLU H 1 1 8 5823 1 1 42 GLU HA H 5.778 -9.287 4.538 1.00 . A A . 42 GLU HA 1 1 8 5824 1 1 42 GLU HB2 H 5.686 -11.618 2.623 1.00 . A A . 42 GLU HB2 1 1 8 5825 1 1 42 GLU HB3 H 5.897 -11.737 4.354 1.00 . A A . 42 GLU HB3 1 1 8 5826 1 1 42 GLU HG2 H 3.653 -10.604 4.567 1.00 . A A . 42 GLU HG2 1 1 8 5827 1 1 42 GLU HG3 H 3.483 -10.838 2.825 1.00 . A A . 42 GLU HG3 1 1 8 5828 1 1 42 GLU N N 5.584 -8.871 2.516 1.00 . A A . 42 GLU N 1 1 8 5829 1 1 42 GLU O O 8.130 -10.421 4.628 1.00 . A A . 42 GLU O 1 1 8 5830 1 1 42 GLU OE1 O 3.312 -13.405 3.018 1.00 . A A . 42 GLU OE1 1 1 8 5831 1 1 42 GLU OE2 O 3.309 -12.980 5.159 1.00 . A A . 42 GLU OE2 1 1 8 5832 1 1 43 ASN C C 10.564 -8.508 2.541 1.00 . A A . 43 ASN C 1 1 8 5833 1 1 43 ASN CA C 9.679 -9.737 2.555 1.00 . A A . 43 ASN CA 1 1 8 5834 1 1 43 ASN CB C 9.991 -10.652 1.376 1.00 . A A . 43 ASN CB 1 1 8 5835 1 1 43 ASN CG C 9.418 -12.057 1.548 1.00 . A A . 43 ASN CG 1 1 8 5836 1 1 43 ASN H H 7.840 -9.000 1.877 1.00 . A A . 43 ASN H 1 1 8 5837 1 1 43 ASN HA H 9.927 -10.295 3.447 1.00 . A A . 43 ASN HA 1 1 8 5838 1 1 43 ASN HB2 H 9.553 -10.194 0.501 1.00 . A A . 43 ASN HB2 1 1 8 5839 1 1 43 ASN HB3 H 11.058 -10.702 1.264 1.00 . A A . 43 ASN HB3 1 1 8 5840 1 1 43 ASN HD21 H 9.159 -12.252 -0.406 1.00 . A A . 43 ASN HD21 1 1 8 5841 1 1 43 ASN HD22 H 8.675 -13.590 0.587 1.00 . A A . 43 ASN HD22 1 1 8 5842 1 1 43 ASN N N 8.267 -9.476 2.618 1.00 . A A . 43 ASN N 1 1 8 5843 1 1 43 ASN ND2 N 9.052 -12.694 0.463 1.00 . A A . 43 ASN ND2 1 1 8 5844 1 1 43 ASN O O 11.747 -8.601 2.877 1.00 . A A . 43 ASN O 1 1 8 5845 1 1 43 ASN OD1 O 9.297 -12.561 2.657 1.00 . A A . 43 ASN OD1 1 1 8 5846 1 1 44 GLU C C 10.178 -4.954 2.703 1.00 . A A . 44 GLU C 1 1 8 5847 1 1 44 GLU CA C 10.866 -6.162 2.069 1.00 . A A . 44 GLU CA 1 1 8 5848 1 1 44 GLU CB C 11.238 -5.888 0.598 1.00 . A A . 44 GLU CB 1 1 8 5849 1 1 44 GLU CD C 12.277 -6.846 -1.511 1.00 . A A . 44 GLU CD 1 1 8 5850 1 1 44 GLU CG C 11.943 -7.069 -0.065 1.00 . A A . 44 GLU CG 1 1 8 5851 1 1 44 GLU H H 9.075 -7.273 1.960 1.00 . A A . 44 GLU H 1 1 8 5852 1 1 44 GLU HA H 11.769 -6.352 2.630 1.00 . A A . 44 GLU HA 1 1 8 5853 1 1 44 GLU HB2 H 10.336 -5.658 0.051 1.00 . A A . 44 GLU HB2 1 1 8 5854 1 1 44 GLU HB3 H 11.900 -5.033 0.561 1.00 . A A . 44 GLU HB3 1 1 8 5855 1 1 44 GLU HG2 H 12.869 -7.253 0.467 1.00 . A A . 44 GLU HG2 1 1 8 5856 1 1 44 GLU HG3 H 11.306 -7.939 0.029 1.00 . A A . 44 GLU HG3 1 1 8 5857 1 1 44 GLU N N 10.032 -7.358 2.168 1.00 . A A . 44 GLU N 1 1 8 5858 1 1 44 GLU O O 8.964 -4.972 2.947 1.00 . A A . 44 GLU O 1 1 8 5859 1 1 44 GLU OE1 O 11.390 -6.989 -2.369 1.00 . A A . 44 GLU OE1 1 1 8 5860 1 1 44 GLU OE2 O 13.447 -6.567 -1.809 1.00 . A A . 44 GLU OE2 1 1 8 5861 1 1 45 ASP C C 9.740 -1.786 2.679 1.00 . A A . 45 ASP C 1 1 8 5862 1 1 45 ASP CA C 10.433 -2.731 3.653 1.00 . A A . 45 ASP CA 1 1 8 5863 1 1 45 ASP CB C 11.579 -1.951 4.313 1.00 . A A . 45 ASP CB 1 1 8 5864 1 1 45 ASP CG C 12.426 -2.783 5.232 1.00 . A A . 45 ASP CG 1 1 8 5865 1 1 45 ASP H H 11.896 -3.929 2.714 1.00 . A A . 45 ASP H 1 1 8 5866 1 1 45 ASP HA H 9.753 -3.053 4.429 1.00 . A A . 45 ASP HA 1 1 8 5867 1 1 45 ASP HB2 H 12.222 -1.545 3.544 1.00 . A A . 45 ASP HB2 1 1 8 5868 1 1 45 ASP HB3 H 11.149 -1.140 4.881 1.00 . A A . 45 ASP HB3 1 1 8 5869 1 1 45 ASP N N 10.948 -3.912 2.967 1.00 . A A . 45 ASP N 1 1 8 5870 1 1 45 ASP O O 10.367 -1.307 1.715 1.00 . A A . 45 ASP O 1 1 8 5871 1 1 45 ASP OD1 O 12.100 -2.916 6.414 1.00 . A A . 45 ASP OD1 1 1 8 5872 1 1 45 ASP OD2 O 13.475 -3.296 4.777 1.00 . A A . 45 ASP OD2 1 1 8 5873 1 1 46 TYR C C 8.094 0.909 2.519 1.00 . A A . 46 TYR C 1 1 8 5874 1 1 46 TYR CA C 7.748 -0.544 2.105 1.00 . A A . 46 TYR CA 1 1 8 5875 1 1 46 TYR CB C 6.207 -0.764 2.082 1.00 . A A . 46 TYR CB 1 1 8 5876 1 1 46 TYR CD1 C 5.306 0.193 -0.116 1.00 . A A . 46 TYR CD1 1 1 8 5877 1 1 46 TYR CD2 C 4.996 1.457 1.872 1.00 . A A . 46 TYR CD2 1 1 8 5878 1 1 46 TYR CE1 C 4.680 1.198 -0.851 1.00 . A A . 46 TYR CE1 1 1 8 5879 1 1 46 TYR CE2 C 4.372 2.439 1.143 1.00 . A A . 46 TYR CE2 1 1 8 5880 1 1 46 TYR CG C 5.475 0.313 1.263 1.00 . A A . 46 TYR CG 1 1 8 5881 1 1 46 TYR CZ C 4.218 2.303 -0.205 1.00 . A A . 46 TYR CZ 1 1 8 5882 1 1 46 TYR H H 7.984 -2.048 3.581 1.00 . A A . 46 TYR H 1 1 8 5883 1 1 46 TYR HA H 8.128 -0.680 1.106 1.00 . A A . 46 TYR HA 1 1 8 5884 1 1 46 TYR HB2 H 5.986 -1.728 1.648 1.00 . A A . 46 TYR HB2 1 1 8 5885 1 1 46 TYR HB3 H 5.808 -0.729 3.087 1.00 . A A . 46 TYR HB3 1 1 8 5886 1 1 46 TYR HD1 H 5.667 -0.690 -0.619 1.00 . A A . 46 TYR HD1 1 1 8 5887 1 1 46 TYR HD2 H 5.116 1.564 2.941 1.00 . A A . 46 TYR HD2 1 1 8 5888 1 1 46 TYR HE1 H 4.530 1.127 -1.924 1.00 . A A . 46 TYR HE1 1 1 8 5889 1 1 46 TYR HE2 H 3.992 3.330 1.617 1.00 . A A . 46 TYR HE2 1 1 8 5890 1 1 46 TYR HH H 2.963 2.909 -1.494 1.00 . A A . 46 TYR HH 1 1 8 5891 1 1 46 TYR N N 8.453 -1.526 2.900 1.00 . A A . 46 TYR N 1 1 8 5892 1 1 46 TYR O O 7.794 1.368 3.636 1.00 . A A . 46 TYR O 1 1 8 5893 1 1 46 TYR OH O 3.624 3.302 -0.919 1.00 . A A . 46 TYR OH 1 1 8 5894 1 1 47 ILE C C 8.125 3.712 0.722 1.00 . A A . 47 ILE C 1 1 8 5895 1 1 47 ILE CA C 9.016 2.995 1.744 1.00 . A A . 47 ILE CA 1 1 8 5896 1 1 47 ILE CB C 10.524 3.299 1.465 1.00 . A A . 47 ILE CB 1 1 8 5897 1 1 47 ILE CD1 C 11.269 2.760 3.884 1.00 . A A . 47 ILE CD1 1 1 8 5898 1 1 47 ILE CG1 C 11.439 2.468 2.392 1.00 . A A . 47 ILE CG1 1 1 8 5899 1 1 47 ILE CG2 C 10.814 4.779 1.646 1.00 . A A . 47 ILE CG2 1 1 8 5900 1 1 47 ILE H H 8.981 1.028 0.851 1.00 . A A . 47 ILE H 1 1 8 5901 1 1 47 ILE HA H 8.750 3.293 2.747 1.00 . A A . 47 ILE HA 1 1 8 5902 1 1 47 ILE HB H 10.741 3.040 0.441 1.00 . A A . 47 ILE HB 1 1 8 5903 1 1 47 ILE HD11 H 11.489 3.798 4.087 1.00 . A A . 47 ILE HD11 1 1 8 5904 1 1 47 ILE HD12 H 11.940 2.133 4.458 1.00 . A A . 47 ILE HD12 1 1 8 5905 1 1 47 ILE HD13 H 10.251 2.552 4.178 1.00 . A A . 47 ILE HD13 1 1 8 5906 1 1 47 ILE HG12 H 11.250 1.416 2.234 1.00 . A A . 47 ILE HG12 1 1 8 5907 1 1 47 ILE HG13 H 12.468 2.665 2.132 1.00 . A A . 47 ILE HG13 1 1 8 5908 1 1 47 ILE HG21 H 11.857 4.978 1.455 1.00 . A A . 47 ILE HG21 1 1 8 5909 1 1 47 ILE HG22 H 10.545 5.084 2.654 1.00 . A A . 47 ILE HG22 1 1 8 5910 1 1 47 ILE HG23 H 10.209 5.314 0.928 1.00 . A A . 47 ILE HG23 1 1 8 5911 1 1 47 ILE N N 8.731 1.597 1.610 1.00 . A A . 47 ILE N 1 1 8 5912 1 1 47 ILE O O 7.890 3.173 -0.353 1.00 . A A . 47 ILE O 1 1 8 5913 1 1 48 CYS C C 7.427 6.656 -0.604 1.00 . A A . 48 CYS C 1 1 8 5914 1 1 48 CYS CA C 6.707 5.534 0.087 1.00 . A A . 48 CYS CA 1 1 8 5915 1 1 48 CYS CB C 5.472 6.139 0.768 1.00 . A A . 48 CYS CB 1 1 8 5916 1 1 48 CYS H H 7.782 5.445 1.817 1.00 . A A . 48 CYS H 1 1 8 5917 1 1 48 CYS HA H 6.387 4.793 -0.625 1.00 . A A . 48 CYS HA 1 1 8 5918 1 1 48 CYS HB2 H 4.725 6.309 0.005 1.00 . A A . 48 CYS HB2 1 1 8 5919 1 1 48 CYS HB3 H 5.075 5.438 1.481 1.00 . A A . 48 CYS HB3 1 1 8 5920 1 1 48 CYS N N 7.601 4.900 1.033 1.00 . A A . 48 CYS N 1 1 8 5921 1 1 48 CYS O O 8.526 7.028 -0.209 1.00 . A A . 48 CYS O 1 1 8 5922 1 1 48 CYS SG S 5.760 7.741 1.598 1.00 . A A . 48 CYS SG 1 1 8 5923 1 1 49 ILE C C 7.703 9.532 -1.458 1.00 . A A . 49 ILE C 1 1 8 5924 1 1 49 ILE CA C 7.275 8.348 -2.358 1.00 . A A . 49 ILE CA 1 1 8 5925 1 1 49 ILE CB C 6.224 8.793 -3.409 1.00 . A A . 49 ILE CB 1 1 8 5926 1 1 49 ILE CD1 C 5.849 10.377 -5.339 1.00 . A A . 49 ILE CD1 1 1 8 5927 1 1 49 ILE CG1 C 6.739 9.983 -4.196 1.00 . A A . 49 ILE CG1 1 1 8 5928 1 1 49 ILE CG2 C 4.872 9.092 -2.758 1.00 . A A . 49 ILE CG2 1 1 8 5929 1 1 49 ILE H H 5.922 6.813 -1.858 1.00 . A A . 49 ILE H 1 1 8 5930 1 1 49 ILE HA H 8.155 8.037 -2.899 1.00 . A A . 49 ILE HA 1 1 8 5931 1 1 49 ILE HB H 6.075 7.965 -4.087 1.00 . A A . 49 ILE HB 1 1 8 5932 1 1 49 ILE HD11 H 5.862 9.546 -6.028 1.00 . A A . 49 ILE HD11 1 1 8 5933 1 1 49 ILE HD12 H 6.242 11.251 -5.835 1.00 . A A . 49 ILE HD12 1 1 8 5934 1 1 49 ILE HD13 H 4.833 10.527 -4.999 1.00 . A A . 49 ILE HD13 1 1 8 5935 1 1 49 ILE HG12 H 6.825 10.815 -3.513 1.00 . A A . 49 ILE HG12 1 1 8 5936 1 1 49 ILE HG13 H 7.717 9.749 -4.585 1.00 . A A . 49 ILE HG13 1 1 8 5937 1 1 49 ILE HG21 H 4.993 9.887 -2.039 1.00 . A A . 49 ILE HG21 1 1 8 5938 1 1 49 ILE HG22 H 4.523 8.218 -2.227 1.00 . A A . 49 ILE HG22 1 1 8 5939 1 1 49 ILE HG23 H 4.156 9.389 -3.509 1.00 . A A . 49 ILE HG23 1 1 8 5940 1 1 49 ILE N N 6.777 7.218 -1.598 1.00 . A A . 49 ILE N 1 1 8 5941 1 1 49 ILE O O 8.715 10.170 -1.708 1.00 . A A . 49 ILE O 1 1 8 5942 1 1 50 ASN C C 8.399 10.494 1.496 1.00 . A A . 50 ASN C 1 1 8 5943 1 1 50 ASN CA C 7.267 10.875 0.543 1.00 . A A . 50 ASN CA 1 1 8 5944 1 1 50 ASN CB C 6.023 11.298 1.364 1.00 . A A . 50 ASN CB 1 1 8 5945 1 1 50 ASN CG C 4.854 11.759 0.507 1.00 . A A . 50 ASN CG 1 1 8 5946 1 1 50 ASN H H 6.204 9.171 -0.204 1.00 . A A . 50 ASN H 1 1 8 5947 1 1 50 ASN HA H 7.592 11.715 -0.054 1.00 . A A . 50 ASN HA 1 1 8 5948 1 1 50 ASN HB2 H 5.701 10.453 1.953 1.00 . A A . 50 ASN HB2 1 1 8 5949 1 1 50 ASN HB3 H 6.305 12.090 2.036 1.00 . A A . 50 ASN HB3 1 1 8 5950 1 1 50 ASN HD21 H 4.019 9.954 0.572 1.00 . A A . 50 ASN HD21 1 1 8 5951 1 1 50 ASN HD22 H 3.171 11.168 -0.315 1.00 . A A . 50 ASN HD22 1 1 8 5952 1 1 50 ASN N N 6.961 9.769 -0.378 1.00 . A A . 50 ASN N 1 1 8 5953 1 1 50 ASN ND2 N 3.931 10.868 0.226 1.00 . A A . 50 ASN ND2 1 1 8 5954 1 1 50 ASN O O 9.158 11.336 1.939 1.00 . A A . 50 ASN O 1 1 8 5955 1 1 50 ASN OD1 O 4.765 12.913 0.138 1.00 . A A . 50 ASN OD1 1 1 8 5956 1 1 51 CYS C C 10.889 8.591 1.928 1.00 . A A . 51 CYS C 1 1 8 5957 1 1 51 CYS CA C 9.553 8.690 2.669 1.00 . A A . 51 CYS CA 1 1 8 5958 1 1 51 CYS CB C 9.190 7.314 3.258 1.00 . A A . 51 CYS CB 1 1 8 5959 1 1 51 CYS H H 7.850 8.587 1.394 1.00 . A A . 51 CYS H 1 1 8 5960 1 1 51 CYS HA H 9.660 9.393 3.485 1.00 . A A . 51 CYS HA 1 1 8 5961 1 1 51 CYS HB2 H 8.787 6.713 2.459 1.00 . A A . 51 CYS HB2 1 1 8 5962 1 1 51 CYS HB3 H 10.107 6.870 3.615 1.00 . A A . 51 CYS HB3 1 1 8 5963 1 1 51 CYS N N 8.498 9.201 1.797 1.00 . A A . 51 CYS N 1 1 8 5964 1 1 51 CYS O O 11.943 8.773 2.514 1.00 . A A . 51 CYS O 1 1 8 5965 1 1 51 CYS SG S 7.977 7.284 4.602 1.00 . A A . 51 CYS SG 1 1 8 5966 1 1 52 ALA C C 12.695 9.496 -0.519 1.00 . A A . 52 ALA C 1 1 8 5967 1 1 52 ALA CA C 12.055 8.147 -0.143 1.00 . A A . 52 ALA CA 1 1 8 5968 1 1 52 ALA CB C 11.770 7.312 -1.380 1.00 . A A . 52 ALA CB 1 1 8 5969 1 1 52 ALA H H 9.931 8.293 0.241 1.00 . A A . 52 ALA H 1 1 8 5970 1 1 52 ALA HA H 12.737 7.598 0.487 1.00 . A A . 52 ALA HA 1 1 8 5971 1 1 52 ALA HB1 H 12.697 7.140 -1.911 1.00 . A A . 52 ALA HB1 1 1 8 5972 1 1 52 ALA HB2 H 11.077 7.842 -2.015 1.00 . A A . 52 ALA HB2 1 1 8 5973 1 1 52 ALA HB3 H 11.330 6.367 -1.085 1.00 . A A . 52 ALA HB3 1 1 8 5974 1 1 52 ALA N N 10.834 8.331 0.639 1.00 . A A . 52 ALA N 1 1 8 5975 2 2 1 ZN ZN ZN 5.836 7.536 3.874 1.00 . B A . 53 ZN ZN 1 1 8 5976 3 2 1 ZN ZN ZN -5.336 2.889 -2.163 1.00 . C A . 54 ZN ZN 1 1 9 5977 1 1 1 SER C C -11.519 5.485 1.375 1.00 . A A . 1 SER C 1 1 9 5978 1 1 1 SER CA C -12.605 5.350 2.468 1.00 . A A . 1 SER CA 1 1 9 5979 1 1 1 SER CB C -12.147 4.387 3.598 1.00 . A A . 1 SER CB 1 1 9 5980 1 1 1 SER HA H -12.776 6.333 2.889 1.00 . A A . 1 SER HA 1 1 9 5981 1 1 1 SER HB2 H -11.209 4.705 4.027 1.00 . A A . 1 SER HB2 1 1 9 5982 1 1 1 SER HB3 H -12.891 4.405 4.380 1.00 . A A . 1 SER HB3 1 1 9 5983 1 1 1 SER HG H -12.857 2.607 3.194 1.00 . A A . 1 SER HG 1 1 9 5984 1 1 1 SER N N -13.889 4.876 1.883 1.00 . A A . 1 SER N 1 1 9 5985 1 1 1 SER O O -11.537 4.759 0.363 1.00 . A A . 1 SER O 1 1 9 5986 1 1 1 SER OG O -12.007 3.054 3.130 1.00 . A A . 1 SER OG 1 1 9 5987 1 1 2 VAL C C -8.227 6.457 1.338 1.00 . A A . 2 VAL C 1 1 9 5988 1 1 2 VAL CA C -9.539 6.652 0.595 1.00 . A A . 2 VAL CA 1 1 9 5989 1 1 2 VAL CB C -9.586 8.102 0.015 1.00 . A A . 2 VAL CB 1 1 9 5990 1 1 2 VAL CG1 C -8.542 8.288 -1.098 1.00 . A A . 2 VAL CG1 1 1 9 5991 1 1 2 VAL CG2 C -10.995 8.453 -0.480 1.00 . A A . 2 VAL CG2 1 1 9 5992 1 1 2 VAL H H -10.623 6.994 2.350 1.00 . A A . 2 VAL H 1 1 9 5993 1 1 2 VAL HA H -9.618 5.930 -0.207 1.00 . A A . 2 VAL HA 1 1 9 5994 1 1 2 VAL HB H -9.325 8.774 0.816 1.00 . A A . 2 VAL HB 1 1 9 5995 1 1 2 VAL HG11 H -8.746 7.607 -1.911 1.00 . A A . 2 VAL HG11 1 1 9 5996 1 1 2 VAL HG12 H -7.552 8.073 -0.714 1.00 . A A . 2 VAL HG12 1 1 9 5997 1 1 2 VAL HG13 H -8.566 9.301 -1.466 1.00 . A A . 2 VAL HG13 1 1 9 5998 1 1 2 VAL HG21 H -11.698 8.375 0.339 1.00 . A A . 2 VAL HG21 1 1 9 5999 1 1 2 VAL HG22 H -11.282 7.756 -1.250 1.00 . A A . 2 VAL HG22 1 1 9 6000 1 1 2 VAL HG23 H -11.022 9.460 -0.869 1.00 . A A . 2 VAL HG23 1 1 9 6001 1 1 2 VAL N N -10.612 6.427 1.550 1.00 . A A . 2 VAL N 1 1 9 6002 1 1 2 VAL O O -8.119 6.853 2.497 1.00 . A A . 2 VAL O 1 1 9 6003 1 1 3 CYS C C -4.958 6.608 0.882 1.00 . A A . 3 CYS C 1 1 9 6004 1 1 3 CYS CA C -6.000 5.594 1.390 1.00 . A A . 3 CYS CA 1 1 9 6005 1 1 3 CYS CB C -5.514 4.135 1.165 1.00 . A A . 3 CYS CB 1 1 9 6006 1 1 3 CYS H H -7.359 5.501 -0.203 1.00 . A A . 3 CYS H 1 1 9 6007 1 1 3 CYS HA H -6.141 5.762 2.448 1.00 . A A . 3 CYS HA 1 1 9 6008 1 1 3 CYS HB2 H -5.057 3.771 2.071 1.00 . A A . 3 CYS HB2 1 1 9 6009 1 1 3 CYS HB3 H -6.364 3.513 0.933 1.00 . A A . 3 CYS HB3 1 1 9 6010 1 1 3 CYS N N -7.256 5.823 0.714 1.00 . A A . 3 CYS N 1 1 9 6011 1 1 3 CYS O O -5.281 7.505 0.098 1.00 . A A . 3 CYS O 1 1 9 6012 1 1 3 CYS SG S -4.288 3.909 -0.157 1.00 . A A . 3 CYS SG 1 1 9 6013 1 1 4 ALA C C -1.981 6.640 -0.332 1.00 . A A . 4 ALA C 1 1 9 6014 1 1 4 ALA CA C -2.663 7.302 0.850 1.00 . A A . 4 ALA CA 1 1 9 6015 1 1 4 ALA CB C -1.649 7.536 1.975 1.00 . A A . 4 ALA CB 1 1 9 6016 1 1 4 ALA H H -3.532 5.655 1.847 1.00 . A A . 4 ALA H 1 1 9 6017 1 1 4 ALA HA H -3.086 8.249 0.549 1.00 . A A . 4 ALA HA 1 1 9 6018 1 1 4 ALA HB1 H -2.147 7.987 2.822 1.00 . A A . 4 ALA HB1 1 1 9 6019 1 1 4 ALA HB2 H -0.862 8.192 1.627 1.00 . A A . 4 ALA HB2 1 1 9 6020 1 1 4 ALA HB3 H -1.207 6.600 2.278 1.00 . A A . 4 ALA HB3 1 1 9 6021 1 1 4 ALA N N -3.725 6.442 1.295 1.00 . A A . 4 ALA N 1 1 9 6022 1 1 4 ALA O O -1.572 5.517 -0.229 1.00 . A A . 4 ALA O 1 1 9 6023 1 1 5 ALA C C -1.320 7.908 -3.707 1.00 . A A . 5 ALA C 1 1 9 6024 1 1 5 ALA CA C -1.229 6.851 -2.653 1.00 . A A . 5 ALA CA 1 1 9 6025 1 1 5 ALA CB C -1.784 5.527 -3.211 1.00 . A A . 5 ALA CB 1 1 9 6026 1 1 5 ALA H H -2.542 8.093 -1.573 1.00 . A A . 5 ALA H 1 1 9 6027 1 1 5 ALA HA H -0.194 6.713 -2.379 1.00 . A A . 5 ALA HA 1 1 9 6028 1 1 5 ALA HB1 H -1.197 5.175 -4.051 1.00 . A A . 5 ALA HB1 1 1 9 6029 1 1 5 ALA HB2 H -2.804 5.655 -3.545 1.00 . A A . 5 ALA HB2 1 1 9 6030 1 1 5 ALA HB3 H -1.766 4.781 -2.430 1.00 . A A . 5 ALA HB3 1 1 9 6031 1 1 5 ALA N N -1.974 7.302 -1.472 1.00 . A A . 5 ALA N 1 1 9 6032 1 1 5 ALA O O -2.321 8.602 -3.768 1.00 . A A . 5 ALA O 1 1 9 6033 1 1 6 GLN C C -1.505 8.777 -6.539 1.00 . A A . 6 GLN C 1 1 9 6034 1 1 6 GLN CA C -0.248 9.002 -5.666 1.00 . A A . 6 GLN CA 1 1 9 6035 1 1 6 GLN CB C 1.007 8.712 -6.526 1.00 . A A . 6 GLN CB 1 1 9 6036 1 1 6 GLN CD C 2.275 9.192 -8.680 1.00 . A A . 6 GLN CD 1 1 9 6037 1 1 6 GLN CG C 1.198 9.651 -7.705 1.00 . A A . 6 GLN CG 1 1 9 6038 1 1 6 GLN H H 0.641 7.736 -4.275 1.00 . A A . 6 GLN H 1 1 9 6039 1 1 6 GLN HA H -0.201 10.021 -5.312 1.00 . A A . 6 GLN HA 1 1 9 6040 1 1 6 GLN HB2 H 1.883 8.786 -5.893 1.00 . A A . 6 GLN HB2 1 1 9 6041 1 1 6 GLN HB3 H 0.944 7.696 -6.894 1.00 . A A . 6 GLN HB3 1 1 9 6042 1 1 6 GLN HE21 H 3.660 10.238 -7.729 1.00 . A A . 6 GLN HE21 1 1 9 6043 1 1 6 GLN HE22 H 4.193 9.343 -9.098 1.00 . A A . 6 GLN HE22 1 1 9 6044 1 1 6 GLN HG2 H 0.272 9.751 -8.233 1.00 . A A . 6 GLN HG2 1 1 9 6045 1 1 6 GLN HG3 H 1.483 10.611 -7.308 1.00 . A A . 6 GLN HG3 1 1 9 6046 1 1 6 GLN N N -0.244 8.080 -4.504 1.00 . A A . 6 GLN N 1 1 9 6047 1 1 6 GLN NE2 N 3.489 9.635 -8.481 1.00 . A A . 6 GLN NE2 1 1 9 6048 1 1 6 GLN O O -2.100 9.725 -7.056 1.00 . A A . 6 GLN O 1 1 9 6049 1 1 6 GLN OE1 O 1.997 8.459 -9.622 1.00 . A A . 6 GLN OE1 1 1 9 6050 1 1 7 ASN C C -3.766 6.039 -6.684 1.00 . A A . 7 ASN C 1 1 9 6051 1 1 7 ASN CA C -3.050 7.140 -7.418 1.00 . A A . 7 ASN CA 1 1 9 6052 1 1 7 ASN CB C -2.685 6.685 -8.844 1.00 . A A . 7 ASN CB 1 1 9 6053 1 1 7 ASN CG C -3.897 6.260 -9.678 1.00 . A A . 7 ASN CG 1 1 9 6054 1 1 7 ASN H H -1.217 6.953 -6.225 1.00 . A A . 7 ASN H 1 1 9 6055 1 1 7 ASN HA H -3.703 7.999 -7.483 1.00 . A A . 7 ASN HA 1 1 9 6056 1 1 7 ASN HB2 H -2.207 7.498 -9.365 1.00 . A A . 7 ASN HB2 1 1 9 6057 1 1 7 ASN HB3 H -2.001 5.850 -8.795 1.00 . A A . 7 ASN HB3 1 1 9 6058 1 1 7 ASN HD21 H -2.762 5.042 -10.761 1.00 . A A . 7 ASN HD21 1 1 9 6059 1 1 7 ASN HD22 H -4.430 5.083 -11.193 1.00 . A A . 7 ASN HD22 1 1 9 6060 1 1 7 ASN N N -1.863 7.532 -6.682 1.00 . A A . 7 ASN N 1 1 9 6061 1 1 7 ASN ND2 N -3.676 5.373 -10.637 1.00 . A A . 7 ASN ND2 1 1 9 6062 1 1 7 ASN O O -3.360 4.883 -6.741 1.00 . A A . 7 ASN O 1 1 9 6063 1 1 7 ASN OD1 O -5.003 6.738 -9.480 1.00 . A A . 7 ASN OD1 1 1 9 6064 1 1 8 CYS C C -6.756 4.899 -6.017 1.00 . A A . 8 CYS C 1 1 9 6065 1 1 8 CYS CA C -5.512 5.327 -5.268 1.00 . A A . 8 CYS CA 1 1 9 6066 1 1 8 CYS CB C -5.842 5.647 -3.810 1.00 . A A . 8 CYS CB 1 1 9 6067 1 1 8 CYS H H -5.154 7.283 -5.930 1.00 . A A . 8 CYS H 1 1 9 6068 1 1 8 CYS HA H -4.828 4.499 -5.292 1.00 . A A . 8 CYS HA 1 1 9 6069 1 1 8 CYS HB2 H -4.956 5.911 -3.254 1.00 . A A . 8 CYS HB2 1 1 9 6070 1 1 8 CYS HB3 H -6.531 6.479 -3.782 1.00 . A A . 8 CYS HB3 1 1 9 6071 1 1 8 CYS N N -4.810 6.367 -5.963 1.00 . A A . 8 CYS N 1 1 9 6072 1 1 8 CYS O O -7.714 5.652 -6.147 1.00 . A A . 8 CYS O 1 1 9 6073 1 1 8 CYS SG S -6.667 4.257 -2.960 1.00 . A A . 8 CYS SG 1 1 9 6074 1 1 9 GLN C C -9.010 2.735 -6.321 1.00 . A A . 9 GLN C 1 1 9 6075 1 1 9 GLN CA C -7.805 3.016 -7.227 1.00 . A A . 9 GLN CA 1 1 9 6076 1 1 9 GLN CB C -7.268 1.685 -7.764 1.00 . A A . 9 GLN CB 1 1 9 6077 1 1 9 GLN CD C -5.515 0.495 -9.149 1.00 . A A . 9 GLN CD 1 1 9 6078 1 1 9 GLN CG C -6.042 1.824 -8.656 1.00 . A A . 9 GLN CG 1 1 9 6079 1 1 9 GLN H H -5.883 3.175 -6.357 1.00 . A A . 9 GLN H 1 1 9 6080 1 1 9 GLN HA H -8.089 3.628 -8.070 1.00 . A A . 9 GLN HA 1 1 9 6081 1 1 9 GLN HB2 H -6.976 1.100 -6.903 1.00 . A A . 9 GLN HB2 1 1 9 6082 1 1 9 GLN HB3 H -8.028 1.133 -8.295 1.00 . A A . 9 GLN HB3 1 1 9 6083 1 1 9 GLN HE21 H -3.665 1.204 -9.209 1.00 . A A . 9 GLN HE21 1 1 9 6084 1 1 9 GLN HE22 H -3.878 -0.423 -9.704 1.00 . A A . 9 GLN HE22 1 1 9 6085 1 1 9 GLN HG2 H -6.259 2.438 -9.513 1.00 . A A . 9 GLN HG2 1 1 9 6086 1 1 9 GLN HG3 H -5.260 2.298 -8.082 1.00 . A A . 9 GLN HG3 1 1 9 6087 1 1 9 GLN N N -6.718 3.666 -6.486 1.00 . A A . 9 GLN N 1 1 9 6088 1 1 9 GLN NE2 N -4.234 0.424 -9.372 1.00 . A A . 9 GLN NE2 1 1 9 6089 1 1 9 GLN O O -10.079 2.381 -6.795 1.00 . A A . 9 GLN O 1 1 9 6090 1 1 9 GLN OE1 O -6.265 -0.455 -9.328 1.00 . A A . 9 GLN OE1 1 1 9 6091 1 1 10 ARG C C -10.387 1.122 -4.166 1.00 . A A . 10 ARG C 1 1 9 6092 1 1 10 ARG CA C -9.794 2.541 -3.956 1.00 . A A . 10 ARG CA 1 1 9 6093 1 1 10 ARG CB C -10.930 3.567 -3.833 1.00 . A A . 10 ARG CB 1 1 9 6094 1 1 10 ARG CD C -11.710 5.878 -3.266 1.00 . A A . 10 ARG CD 1 1 9 6095 1 1 10 ARG CG C -10.502 4.971 -3.428 1.00 . A A . 10 ARG CG 1 1 9 6096 1 1 10 ARG CZ C -13.920 5.621 -2.108 1.00 . A A . 10 ARG CZ 1 1 9 6097 1 1 10 ARG H H -7.962 3.331 -4.742 1.00 . A A . 10 ARG H 1 1 9 6098 1 1 10 ARG HA H -9.255 2.507 -3.022 1.00 . A A . 10 ARG HA 1 1 9 6099 1 1 10 ARG HB2 H -11.430 3.630 -4.787 1.00 . A A . 10 ARG HB2 1 1 9 6100 1 1 10 ARG HB3 H -11.642 3.203 -3.106 1.00 . A A . 10 ARG HB3 1 1 9 6101 1 1 10 ARG HD2 H -11.365 6.880 -3.076 1.00 . A A . 10 ARG HD2 1 1 9 6102 1 1 10 ARG HD3 H -12.299 5.875 -4.169 1.00 . A A . 10 ARG HD3 1 1 9 6103 1 1 10 ARG HE H -12.113 5.024 -1.391 1.00 . A A . 10 ARG HE 1 1 9 6104 1 1 10 ARG HG2 H -9.991 4.931 -2.477 1.00 . A A . 10 ARG HG2 1 1 9 6105 1 1 10 ARG HG3 H -9.847 5.375 -4.182 1.00 . A A . 10 ARG HG3 1 1 9 6106 1 1 10 ARG HH11 H -14.096 6.547 -3.942 1.00 . A A . 10 ARG HH11 1 1 9 6107 1 1 10 ARG HH12 H -15.558 6.295 -3.133 1.00 . A A . 10 ARG HH12 1 1 9 6108 1 1 10 ARG HH21 H -14.161 4.794 -0.247 1.00 . A A . 10 ARG HH21 1 1 9 6109 1 1 10 ARG HH22 H -15.608 5.316 -0.938 1.00 . A A . 10 ARG HH22 1 1 9 6110 1 1 10 ARG N N -8.803 2.906 -4.998 1.00 . A A . 10 ARG N 1 1 9 6111 1 1 10 ARG NE N -12.585 5.450 -2.148 1.00 . A A . 10 ARG NE 1 1 9 6112 1 1 10 ARG NH1 N -14.558 6.200 -3.122 1.00 . A A . 10 ARG NH1 1 1 9 6113 1 1 10 ARG NH2 N -14.612 5.221 -1.034 1.00 . A A . 10 ARG NH2 1 1 9 6114 1 1 10 ARG O O -11.600 0.962 -4.247 1.00 . A A . 10 ARG O 1 1 9 6115 1 1 11 PRO C C -10.643 -1.811 -3.182 1.00 . A A . 11 PRO C 1 1 9 6116 1 1 11 PRO CA C -10.025 -1.287 -4.461 1.00 . A A . 11 PRO CA 1 1 9 6117 1 1 11 PRO CB C -8.755 -2.096 -4.812 1.00 . A A . 11 PRO CB 1 1 9 6118 1 1 11 PRO CD C -8.080 0.092 -4.236 1.00 . A A . 11 PRO CD 1 1 9 6119 1 1 11 PRO CG C -7.714 -1.076 -5.084 1.00 . A A . 11 PRO CG 1 1 9 6120 1 1 11 PRO HA H -10.739 -1.349 -5.268 1.00 . A A . 11 PRO HA 1 1 9 6121 1 1 11 PRO HB2 H -8.493 -2.699 -3.956 1.00 . A A . 11 PRO HB2 1 1 9 6122 1 1 11 PRO HB3 H -8.938 -2.721 -5.673 1.00 . A A . 11 PRO HB3 1 1 9 6123 1 1 11 PRO HD2 H -7.707 -0.057 -3.234 1.00 . A A . 11 PRO HD2 1 1 9 6124 1 1 11 PRO HD3 H -7.698 1.008 -4.658 1.00 . A A . 11 PRO HD3 1 1 9 6125 1 1 11 PRO HG2 H -6.741 -1.456 -4.801 1.00 . A A . 11 PRO HG2 1 1 9 6126 1 1 11 PRO HG3 H -7.731 -0.811 -6.133 1.00 . A A . 11 PRO HG3 1 1 9 6127 1 1 11 PRO N N -9.531 0.061 -4.272 1.00 . A A . 11 PRO N 1 1 9 6128 1 1 11 PRO O O -10.024 -1.733 -2.093 1.00 . A A . 11 PRO O 1 1 9 6129 1 1 12 CYS C C -12.634 -4.393 -2.287 1.00 . A A . 12 CYS C 1 1 9 6130 1 1 12 CYS CA C -12.538 -2.885 -2.187 1.00 . A A . 12 CYS CA 1 1 9 6131 1 1 12 CYS CB C -13.930 -2.247 -2.092 1.00 . A A . 12 CYS CB 1 1 9 6132 1 1 12 CYS H H -12.252 -2.413 -4.184 1.00 . A A . 12 CYS H 1 1 9 6133 1 1 12 CYS HA H -11.988 -2.630 -1.293 1.00 . A A . 12 CYS HA 1 1 9 6134 1 1 12 CYS HB2 H -14.476 -2.451 -3.001 1.00 . A A . 12 CYS HB2 1 1 9 6135 1 1 12 CYS HB3 H -14.449 -2.679 -1.251 1.00 . A A . 12 CYS HB3 1 1 9 6136 1 1 12 CYS HG H -13.752 0.109 -3.076 1.00 . A A . 12 CYS HG 1 1 9 6137 1 1 12 CYS N N -11.823 -2.356 -3.303 1.00 . A A . 12 CYS N 1 1 9 6138 1 1 12 CYS O O -13.345 -4.930 -3.140 1.00 . A A . 12 CYS O 1 1 9 6139 1 1 12 CYS SG S -13.901 -0.451 -1.877 1.00 . A A . 12 CYS SG 1 1 9 6140 1 1 13 LYS C C -11.620 -6.861 0.056 1.00 . A A . 13 LYS C 1 1 9 6141 1 1 13 LYS CA C -11.847 -6.492 -1.384 1.00 . A A . 13 LYS CA 1 1 9 6142 1 1 13 LYS CB C -10.741 -7.114 -2.265 1.00 . A A . 13 LYS CB 1 1 9 6143 1 1 13 LYS CD C -9.831 -7.638 -4.535 1.00 . A A . 13 LYS CD 1 1 9 6144 1 1 13 LYS CE C -10.095 -7.626 -6.038 1.00 . A A . 13 LYS CE 1 1 9 6145 1 1 13 LYS CG C -10.932 -6.934 -3.761 1.00 . A A . 13 LYS CG 1 1 9 6146 1 1 13 LYS H H -11.259 -4.577 -0.871 1.00 . A A . 13 LYS H 1 1 9 6147 1 1 13 LYS HA H -12.809 -6.855 -1.706 1.00 . A A . 13 LYS HA 1 1 9 6148 1 1 13 LYS HB2 H -9.805 -6.642 -2.002 1.00 . A A . 13 LYS HB2 1 1 9 6149 1 1 13 LYS HB3 H -10.667 -8.170 -2.052 1.00 . A A . 13 LYS HB3 1 1 9 6150 1 1 13 LYS HD2 H -8.899 -7.129 -4.340 1.00 . A A . 13 LYS HD2 1 1 9 6151 1 1 13 LYS HD3 H -9.757 -8.659 -4.193 1.00 . A A . 13 LYS HD3 1 1 9 6152 1 1 13 LYS HE2 H -9.316 -8.180 -6.541 1.00 . A A . 13 LYS HE2 1 1 9 6153 1 1 13 LYS HE3 H -11.048 -8.109 -6.205 1.00 . A A . 13 LYS HE3 1 1 9 6154 1 1 13 LYS HG2 H -11.906 -7.311 -4.035 1.00 . A A . 13 LYS HG2 1 1 9 6155 1 1 13 LYS HG3 H -10.902 -5.874 -3.985 1.00 . A A . 13 LYS HG3 1 1 9 6156 1 1 13 LYS HZ1 H -10.874 -5.671 -6.153 1.00 . A A . 13 LYS HZ1 1 1 9 6157 1 1 13 LYS HZ2 H -10.372 -6.338 -7.628 1.00 . A A . 13 LYS HZ2 1 1 9 6158 1 1 13 LYS HZ3 H -9.220 -5.794 -6.527 1.00 . A A . 13 LYS HZ3 1 1 9 6159 1 1 13 LYS N N -11.860 -5.057 -1.481 1.00 . A A . 13 LYS N 1 1 9 6160 1 1 13 LYS NZ N -10.147 -6.254 -6.615 1.00 . A A . 13 LYS NZ 1 1 9 6161 1 1 13 LYS O O -10.912 -6.164 0.756 1.00 . A A . 13 LYS O 1 1 9 6162 1 1 14 ASP C C -10.658 -8.953 1.973 1.00 . A A . 14 ASP C 1 1 9 6163 1 1 14 ASP CA C -12.034 -8.387 1.857 1.00 . A A . 14 ASP CA 1 1 9 6164 1 1 14 ASP CB C -13.089 -9.403 2.275 1.00 . A A . 14 ASP CB 1 1 9 6165 1 1 14 ASP CG C -14.435 -8.761 2.492 1.00 . A A . 14 ASP CG 1 1 9 6166 1 1 14 ASP H H -12.912 -8.347 -0.069 1.00 . A A . 14 ASP H 1 1 9 6167 1 1 14 ASP HA H -12.087 -7.534 2.515 1.00 . A A . 14 ASP HA 1 1 9 6168 1 1 14 ASP HB2 H -13.172 -10.112 1.469 1.00 . A A . 14 ASP HB2 1 1 9 6169 1 1 14 ASP HB3 H -12.782 -9.926 3.168 1.00 . A A . 14 ASP HB3 1 1 9 6170 1 1 14 ASP N N -12.257 -7.905 0.505 1.00 . A A . 14 ASP N 1 1 9 6171 1 1 14 ASP O O -9.881 -8.542 2.819 1.00 . A A . 14 ASP O 1 1 9 6172 1 1 14 ASP OD1 O -14.709 -8.301 3.614 1.00 . A A . 14 ASP OD1 1 1 9 6173 1 1 14 ASP OD2 O -15.230 -8.680 1.527 1.00 . A A . 14 ASP OD2 1 1 9 6174 1 1 15 LYS C C -8.095 -9.560 0.263 1.00 . A A . 15 LYS C 1 1 9 6175 1 1 15 LYS CA C -9.016 -10.422 1.101 1.00 . A A . 15 LYS CA 1 1 9 6176 1 1 15 LYS CB C -9.016 -11.847 0.575 1.00 . A A . 15 LYS CB 1 1 9 6177 1 1 15 LYS CD C -9.702 -14.229 0.796 1.00 . A A . 15 LYS CD 1 1 9 6178 1 1 15 LYS CE C -10.351 -15.295 1.664 1.00 . A A . 15 LYS CE 1 1 9 6179 1 1 15 LYS CG C -9.769 -12.849 1.439 1.00 . A A . 15 LYS CG 1 1 9 6180 1 1 15 LYS H H -10.943 -10.272 0.459 1.00 . A A . 15 LYS H 1 1 9 6181 1 1 15 LYS HA H -8.660 -10.433 2.117 1.00 . A A . 15 LYS HA 1 1 9 6182 1 1 15 LYS HB2 H -9.479 -11.831 -0.399 1.00 . A A . 15 LYS HB2 1 1 9 6183 1 1 15 LYS HB3 H -7.995 -12.176 0.464 1.00 . A A . 15 LYS HB3 1 1 9 6184 1 1 15 LYS HD2 H -10.191 -14.202 -0.166 1.00 . A A . 15 LYS HD2 1 1 9 6185 1 1 15 LYS HD3 H -8.661 -14.482 0.662 1.00 . A A . 15 LYS HD3 1 1 9 6186 1 1 15 LYS HE2 H -9.814 -15.353 2.602 1.00 . A A . 15 LYS HE2 1 1 9 6187 1 1 15 LYS HE3 H -11.374 -15.006 1.851 1.00 . A A . 15 LYS HE3 1 1 9 6188 1 1 15 LYS HG2 H -9.343 -12.874 2.432 1.00 . A A . 15 LYS HG2 1 1 9 6189 1 1 15 LYS HG3 H -10.803 -12.539 1.503 1.00 . A A . 15 LYS HG3 1 1 9 6190 1 1 15 LYS HZ1 H -9.378 -16.906 0.713 1.00 . A A . 15 LYS HZ1 1 1 9 6191 1 1 15 LYS HZ2 H -10.954 -16.661 0.181 1.00 . A A . 15 LYS HZ2 1 1 9 6192 1 1 15 LYS HZ3 H -10.695 -17.360 1.668 1.00 . A A . 15 LYS HZ3 1 1 9 6193 1 1 15 LYS N N -10.334 -9.882 1.115 1.00 . A A . 15 LYS N 1 1 9 6194 1 1 15 LYS NZ N -10.335 -16.635 1.017 1.00 . A A . 15 LYS NZ 1 1 9 6195 1 1 15 LYS O O -8.102 -9.645 -0.963 1.00 . A A . 15 LYS O 1 1 9 6196 1 1 16 VAL C C -5.523 -7.160 1.374 1.00 . A A . 16 VAL C 1 1 9 6197 1 1 16 VAL CA C -6.359 -7.852 0.310 1.00 . A A . 16 VAL CA 1 1 9 6198 1 1 16 VAL CB C -6.922 -6.816 -0.722 1.00 . A A . 16 VAL CB 1 1 9 6199 1 1 16 VAL CG1 C -7.948 -5.915 -0.080 1.00 . A A . 16 VAL CG1 1 1 9 6200 1 1 16 VAL CG2 C -5.785 -5.993 -1.331 1.00 . A A . 16 VAL CG2 1 1 9 6201 1 1 16 VAL H H -7.521 -8.562 1.891 1.00 . A A . 16 VAL H 1 1 9 6202 1 1 16 VAL HA H -5.693 -8.532 -0.208 1.00 . A A . 16 VAL HA 1 1 9 6203 1 1 16 VAL HB H -7.390 -7.384 -1.512 1.00 . A A . 16 VAL HB 1 1 9 6204 1 1 16 VAL HG11 H -7.479 -5.393 0.740 1.00 . A A . 16 VAL HG11 1 1 9 6205 1 1 16 VAL HG12 H -8.774 -6.517 0.271 1.00 . A A . 16 VAL HG12 1 1 9 6206 1 1 16 VAL HG13 H -8.294 -5.214 -0.818 1.00 . A A . 16 VAL HG13 1 1 9 6207 1 1 16 VAL HG21 H -5.068 -6.671 -1.772 1.00 . A A . 16 VAL HG21 1 1 9 6208 1 1 16 VAL HG22 H -5.307 -5.455 -0.525 1.00 . A A . 16 VAL HG22 1 1 9 6209 1 1 16 VAL HG23 H -6.152 -5.292 -2.066 1.00 . A A . 16 VAL HG23 1 1 9 6210 1 1 16 VAL N N -7.371 -8.682 0.927 1.00 . A A . 16 VAL N 1 1 9 6211 1 1 16 VAL O O -6.034 -6.403 2.200 1.00 . A A . 16 VAL O 1 1 9 6212 1 1 17 ASP C C -2.870 -5.498 1.907 1.00 . A A . 17 ASP C 1 1 9 6213 1 1 17 ASP CA C -3.337 -6.889 2.328 1.00 . A A . 17 ASP CA 1 1 9 6214 1 1 17 ASP CB C -2.158 -7.826 2.595 1.00 . A A . 17 ASP CB 1 1 9 6215 1 1 17 ASP CG C -2.602 -9.120 3.248 1.00 . A A . 17 ASP CG 1 1 9 6216 1 1 17 ASP H H -4.033 -8.230 0.809 1.00 . A A . 17 ASP H 1 1 9 6217 1 1 17 ASP HA H -3.880 -6.776 3.256 1.00 . A A . 17 ASP HA 1 1 9 6218 1 1 17 ASP HB2 H -1.692 -8.056 1.650 1.00 . A A . 17 ASP HB2 1 1 9 6219 1 1 17 ASP HB3 H -1.446 -7.330 3.237 1.00 . A A . 17 ASP HB3 1 1 9 6220 1 1 17 ASP N N -4.281 -7.487 1.393 1.00 . A A . 17 ASP N 1 1 9 6221 1 1 17 ASP O O -2.646 -5.212 0.705 1.00 . A A . 17 ASP O 1 1 9 6222 1 1 17 ASP OD1 O -2.649 -9.183 4.504 1.00 . A A . 17 ASP OD1 1 1 9 6223 1 1 17 ASP OD2 O -2.941 -10.077 2.514 1.00 . A A . 17 ASP OD2 1 1 9 6224 1 1 18 TRP C C -0.940 -3.084 3.291 1.00 . A A . 18 TRP C 1 1 9 6225 1 1 18 TRP CA C -2.351 -3.239 2.758 1.00 . A A . 18 TRP CA 1 1 9 6226 1 1 18 TRP CB C -3.297 -2.355 3.582 1.00 . A A . 18 TRP CB 1 1 9 6227 1 1 18 TRP CD1 C -5.540 -3.483 2.956 1.00 . A A . 18 TRP CD1 1 1 9 6228 1 1 18 TRP CD2 C -5.619 -1.252 2.985 1.00 . A A . 18 TRP CD2 1 1 9 6229 1 1 18 TRP CE2 C -6.894 -1.742 2.629 1.00 . A A . 18 TRP CE2 1 1 9 6230 1 1 18 TRP CE3 C -5.427 0.123 3.072 1.00 . A A . 18 TRP CE3 1 1 9 6231 1 1 18 TRP CG C -4.760 -2.385 3.167 1.00 . A A . 18 TRP CG 1 1 9 6232 1 1 18 TRP CH2 C -7.747 0.451 2.476 1.00 . A A . 18 TRP CH2 1 1 9 6233 1 1 18 TRP CZ2 C -7.968 -0.902 2.374 1.00 . A A . 18 TRP CZ2 1 1 9 6234 1 1 18 TRP CZ3 C -6.493 0.963 2.823 1.00 . A A . 18 TRP CZ3 1 1 9 6235 1 1 18 TRP H H -2.909 -4.968 3.806 1.00 . A A . 18 TRP H 1 1 9 6236 1 1 18 TRP HA H -2.405 -2.956 1.716 1.00 . A A . 18 TRP HA 1 1 9 6237 1 1 18 TRP HB2 H -3.270 -2.687 4.611 1.00 . A A . 18 TRP HB2 1 1 9 6238 1 1 18 TRP HB3 H -2.945 -1.337 3.509 1.00 . A A . 18 TRP HB3 1 1 9 6239 1 1 18 TRP HD1 H -5.189 -4.503 3.017 1.00 . A A . 18 TRP HD1 1 1 9 6240 1 1 18 TRP HE1 H -7.518 -3.757 2.397 1.00 . A A . 18 TRP HE1 1 1 9 6241 1 1 18 TRP HE3 H -4.463 0.526 3.340 1.00 . A A . 18 TRP HE3 1 1 9 6242 1 1 18 TRP HH2 H -8.560 1.138 2.292 1.00 . A A . 18 TRP HH2 1 1 9 6243 1 1 18 TRP HZ2 H -8.945 -1.278 2.104 1.00 . A A . 18 TRP HZ2 1 1 9 6244 1 1 18 TRP HZ3 H -6.354 2.033 2.894 1.00 . A A . 18 TRP HZ3 1 1 9 6245 1 1 18 TRP N N -2.745 -4.638 2.895 1.00 . A A . 18 TRP N 1 1 9 6246 1 1 18 TRP NE1 N -6.811 -3.110 2.606 1.00 . A A . 18 TRP NE1 1 1 9 6247 1 1 18 TRP O O -0.478 -3.929 4.045 1.00 . A A . 18 TRP O 1 1 9 6248 1 1 19 VAL C C 1.237 -0.416 4.040 1.00 . A A . 19 VAL C 1 1 9 6249 1 1 19 VAL CA C 1.123 -1.787 3.372 1.00 . A A . 19 VAL CA 1 1 9 6250 1 1 19 VAL CB C 2.167 -1.890 2.208 1.00 . A A . 19 VAL CB 1 1 9 6251 1 1 19 VAL CG1 C 2.254 -3.307 1.690 1.00 . A A . 19 VAL CG1 1 1 9 6252 1 1 19 VAL CG2 C 1.830 -0.932 1.063 1.00 . A A . 19 VAL CG2 1 1 9 6253 1 1 19 VAL H H -0.577 -1.261 2.385 1.00 . A A . 19 VAL H 1 1 9 6254 1 1 19 VAL HA H 1.350 -2.549 4.108 1.00 . A A . 19 VAL HA 1 1 9 6255 1 1 19 VAL HB H 3.132 -1.619 2.610 1.00 . A A . 19 VAL HB 1 1 9 6256 1 1 19 VAL HG11 H 1.291 -3.611 1.304 1.00 . A A . 19 VAL HG11 1 1 9 6257 1 1 19 VAL HG12 H 2.551 -3.963 2.495 1.00 . A A . 19 VAL HG12 1 1 9 6258 1 1 19 VAL HG13 H 2.985 -3.350 0.900 1.00 . A A . 19 VAL HG13 1 1 9 6259 1 1 19 VAL HG21 H 0.828 -1.124 0.709 1.00 . A A . 19 VAL HG21 1 1 9 6260 1 1 19 VAL HG22 H 2.531 -1.057 0.251 1.00 . A A . 19 VAL HG22 1 1 9 6261 1 1 19 VAL HG23 H 1.911 0.084 1.419 1.00 . A A . 19 VAL HG23 1 1 9 6262 1 1 19 VAL N N -0.249 -2.023 2.915 1.00 . A A . 19 VAL N 1 1 9 6263 1 1 19 VAL O O 0.626 0.549 3.588 1.00 . A A . 19 VAL O 1 1 9 6264 1 1 20 GLN C C 3.642 1.343 5.598 1.00 . A A . 20 GLN C 1 1 9 6265 1 1 20 GLN CA C 2.193 0.893 5.844 1.00 . A A . 20 GLN CA 1 1 9 6266 1 1 20 GLN CB C 1.920 0.703 7.357 1.00 . A A . 20 GLN CB 1 1 9 6267 1 1 20 GLN CD C 1.729 1.797 9.668 1.00 . A A . 20 GLN CD 1 1 9 6268 1 1 20 GLN CG C 2.024 1.986 8.179 1.00 . A A . 20 GLN CG 1 1 9 6269 1 1 20 GLN H H 2.327 -1.205 5.455 1.00 . A A . 20 GLN H 1 1 9 6270 1 1 20 GLN HA H 1.525 1.642 5.445 1.00 . A A . 20 GLN HA 1 1 9 6271 1 1 20 GLN HB2 H 0.933 0.293 7.512 1.00 . A A . 20 GLN HB2 1 1 9 6272 1 1 20 GLN HB3 H 2.640 -0.005 7.744 1.00 . A A . 20 GLN HB3 1 1 9 6273 1 1 20 GLN HE21 H 2.953 3.292 10.140 1.00 . A A . 20 GLN HE21 1 1 9 6274 1 1 20 GLN HE22 H 2.142 2.532 11.442 1.00 . A A . 20 GLN HE22 1 1 9 6275 1 1 20 GLN HG2 H 3.026 2.375 8.082 1.00 . A A . 20 GLN HG2 1 1 9 6276 1 1 20 GLN HG3 H 1.334 2.715 7.782 1.00 . A A . 20 GLN HG3 1 1 9 6277 1 1 20 GLN N N 1.956 -0.357 5.125 1.00 . A A . 20 GLN N 1 1 9 6278 1 1 20 GLN NE2 N 2.338 2.616 10.487 1.00 . A A . 20 GLN NE2 1 1 9 6279 1 1 20 GLN O O 4.546 0.516 5.549 1.00 . A A . 20 GLN O 1 1 9 6280 1 1 20 GLN OE1 O 0.952 0.930 10.072 1.00 . A A . 20 GLN OE1 1 1 9 6281 1 1 21 CYS C C 5.954 3.496 6.450 1.00 . A A . 21 CYS C 1 1 9 6282 1 1 21 CYS CA C 5.242 3.109 5.145 1.00 . A A . 21 CYS CA 1 1 9 6283 1 1 21 CYS CB C 5.302 4.280 4.118 1.00 . A A . 21 CYS CB 1 1 9 6284 1 1 21 CYS H H 3.108 3.254 5.391 1.00 . A A . 21 CYS H 1 1 9 6285 1 1 21 CYS HA H 5.801 2.278 4.743 1.00 . A A . 21 CYS HA 1 1 9 6286 1 1 21 CYS HB2 H 6.313 4.603 3.952 1.00 . A A . 21 CYS HB2 1 1 9 6287 1 1 21 CYS HB3 H 4.860 3.976 3.183 1.00 . A A . 21 CYS HB3 1 1 9 6288 1 1 21 CYS N N 3.870 2.641 5.385 1.00 . A A . 21 CYS N 1 1 9 6289 1 1 21 CYS O O 5.619 4.504 7.092 1.00 . A A . 21 CYS O 1 1 9 6290 1 1 21 CYS SG S 4.491 5.797 4.590 1.00 . A A . 21 CYS SG 1 1 9 6291 1 1 22 ASP C C 8.862 3.952 7.842 1.00 . A A . 22 ASP C 1 1 9 6292 1 1 22 ASP CA C 7.761 2.916 8.040 1.00 . A A . 22 ASP CA 1 1 9 6293 1 1 22 ASP CB C 8.382 1.586 8.491 1.00 . A A . 22 ASP CB 1 1 9 6294 1 1 22 ASP CG C 7.371 0.525 8.904 1.00 . A A . 22 ASP CG 1 1 9 6295 1 1 22 ASP H H 7.260 2.022 6.180 1.00 . A A . 22 ASP H 1 1 9 6296 1 1 22 ASP HA H 7.085 3.265 8.804 1.00 . A A . 22 ASP HA 1 1 9 6297 1 1 22 ASP HB2 H 8.994 1.193 7.690 1.00 . A A . 22 ASP HB2 1 1 9 6298 1 1 22 ASP HB3 H 9.027 1.796 9.330 1.00 . A A . 22 ASP HB3 1 1 9 6299 1 1 22 ASP N N 6.981 2.737 6.791 1.00 . A A . 22 ASP N 1 1 9 6300 1 1 22 ASP O O 9.867 3.947 8.537 1.00 . A A . 22 ASP O 1 1 9 6301 1 1 22 ASP OD1 O 6.891 -0.216 8.038 1.00 . A A . 22 ASP OD1 1 1 9 6302 1 1 22 ASP OD2 O 7.086 0.389 10.122 1.00 . A A . 22 ASP OD2 1 1 9 6303 1 1 23 GLY C C 9.296 7.170 7.436 1.00 . A A . 23 GLY C 1 1 9 6304 1 1 23 GLY CA C 9.609 5.891 6.670 1.00 . A A . 23 GLY CA 1 1 9 6305 1 1 23 GLY H H 7.762 4.895 6.482 1.00 . A A . 23 GLY H 1 1 9 6306 1 1 23 GLY HA2 H 10.578 5.530 6.990 1.00 . A A . 23 GLY HA2 1 1 9 6307 1 1 23 GLY HA3 H 9.627 6.107 5.608 1.00 . A A . 23 GLY HA3 1 1 9 6308 1 1 23 GLY N N 8.633 4.876 6.930 1.00 . A A . 23 GLY N 1 1 9 6309 1 1 23 GLY O O 10.181 8.008 7.632 1.00 . A A . 23 GLY O 1 1 9 6310 1 1 24 GLY C C 6.193 8.959 8.469 1.00 . A A . 24 GLY C 1 1 9 6311 1 1 24 GLY CA C 7.660 8.518 8.616 1.00 . A A . 24 GLY CA 1 1 9 6312 1 1 24 GLY H H 7.363 6.628 7.703 1.00 . A A . 24 GLY H 1 1 9 6313 1 1 24 GLY HA2 H 7.863 8.363 9.663 1.00 . A A . 24 GLY HA2 1 1 9 6314 1 1 24 GLY HA3 H 8.293 9.320 8.271 1.00 . A A . 24 GLY HA3 1 1 9 6315 1 1 24 GLY N N 8.030 7.321 7.871 1.00 . A A . 24 GLY N 1 1 9 6316 1 1 24 GLY O O 5.732 9.776 9.256 1.00 . A A . 24 GLY O 1 1 9 6317 1 1 25 CYS C C 3.095 8.023 8.123 1.00 . A A . 25 CYS C 1 1 9 6318 1 1 25 CYS CA C 4.047 8.894 7.303 1.00 . A A . 25 CYS CA 1 1 9 6319 1 1 25 CYS CB C 3.603 8.832 5.841 1.00 . A A . 25 CYS CB 1 1 9 6320 1 1 25 CYS H H 5.850 7.761 6.886 1.00 . A A . 25 CYS H 1 1 9 6321 1 1 25 CYS HA H 3.988 9.913 7.654 1.00 . A A . 25 CYS HA 1 1 9 6322 1 1 25 CYS HB2 H 3.382 7.809 5.582 1.00 . A A . 25 CYS HB2 1 1 9 6323 1 1 25 CYS HB3 H 2.701 9.414 5.718 1.00 . A A . 25 CYS HB3 1 1 9 6324 1 1 25 CYS N N 5.458 8.434 7.475 1.00 . A A . 25 CYS N 1 1 9 6325 1 1 25 CYS O O 2.043 8.483 8.564 1.00 . A A . 25 CYS O 1 1 9 6326 1 1 25 CYS SG S 4.810 9.449 4.662 1.00 . A A . 25 CYS SG 1 1 9 6327 1 1 26 ASP C C 1.316 5.503 8.390 1.00 . A A . 26 ASP C 1 1 9 6328 1 1 26 ASP CA C 2.687 5.733 9.033 1.00 . A A . 26 ASP CA 1 1 9 6329 1 1 26 ASP CB C 2.535 6.104 10.521 1.00 . A A . 26 ASP CB 1 1 9 6330 1 1 26 ASP CG C 3.837 6.039 11.298 1.00 . A A . 26 ASP CG 1 1 9 6331 1 1 26 ASP H H 4.385 6.484 8.002 1.00 . A A . 26 ASP H 1 1 9 6332 1 1 26 ASP HA H 3.225 4.801 8.969 1.00 . A A . 26 ASP HA 1 1 9 6333 1 1 26 ASP HB2 H 2.120 7.094 10.610 1.00 . A A . 26 ASP HB2 1 1 9 6334 1 1 26 ASP HB3 H 1.835 5.423 10.981 1.00 . A A . 26 ASP HB3 1 1 9 6335 1 1 26 ASP N N 3.492 6.744 8.308 1.00 . A A . 26 ASP N 1 1 9 6336 1 1 26 ASP O O 0.420 4.948 9.011 1.00 . A A . 26 ASP O 1 1 9 6337 1 1 26 ASP OD1 O 4.727 6.892 11.084 1.00 . A A . 26 ASP OD1 1 1 9 6338 1 1 26 ASP OD2 O 3.972 5.152 12.154 1.00 . A A . 26 ASP OD2 1 1 9 6339 1 1 27 GLU C C -0.207 4.377 5.763 1.00 . A A . 27 GLU C 1 1 9 6340 1 1 27 GLU CA C -0.087 5.728 6.448 1.00 . A A . 27 GLU CA 1 1 9 6341 1 1 27 GLU CB C -0.355 6.887 5.477 1.00 . A A . 27 GLU CB 1 1 9 6342 1 1 27 GLU CD C -0.944 9.344 5.303 1.00 . A A . 27 GLU CD 1 1 9 6343 1 1 27 GLU CG C -0.452 8.225 6.186 1.00 . A A . 27 GLU CG 1 1 9 6344 1 1 27 GLU H H 1.947 6.254 6.657 1.00 . A A . 27 GLU H 1 1 9 6345 1 1 27 GLU HA H -0.855 5.739 7.207 1.00 . A A . 27 GLU HA 1 1 9 6346 1 1 27 GLU HB2 H 0.472 6.944 4.786 1.00 . A A . 27 GLU HB2 1 1 9 6347 1 1 27 GLU HB3 H -1.264 6.717 4.924 1.00 . A A . 27 GLU HB3 1 1 9 6348 1 1 27 GLU HG2 H -1.126 8.135 7.025 1.00 . A A . 27 GLU HG2 1 1 9 6349 1 1 27 GLU HG3 H 0.531 8.484 6.556 1.00 . A A . 27 GLU HG3 1 1 9 6350 1 1 27 GLU N N 1.180 5.877 7.130 1.00 . A A . 27 GLU N 1 1 9 6351 1 1 27 GLU O O 0.788 3.667 5.592 1.00 . A A . 27 GLU O 1 1 9 6352 1 1 27 GLU OE1 O -0.154 9.887 4.518 1.00 . A A . 27 GLU OE1 1 1 9 6353 1 1 27 GLU OE2 O -2.158 9.703 5.421 1.00 . A A . 27 GLU OE2 1 1 9 6354 1 1 28 TRP C C -2.000 2.934 3.266 1.00 . A A . 28 TRP C 1 1 9 6355 1 1 28 TRP CA C -1.734 2.766 4.754 1.00 . A A . 28 TRP CA 1 1 9 6356 1 1 28 TRP CB C -2.910 2.091 5.449 1.00 . A A . 28 TRP CB 1 1 9 6357 1 1 28 TRP CD1 C -2.604 2.398 7.988 1.00 . A A . 28 TRP CD1 1 1 9 6358 1 1 28 TRP CD2 C -2.208 0.327 7.243 1.00 . A A . 28 TRP CD2 1 1 9 6359 1 1 28 TRP CE2 C -1.993 0.351 8.631 1.00 . A A . 28 TRP CE2 1 1 9 6360 1 1 28 TRP CE3 C -2.019 -0.868 6.553 1.00 . A A . 28 TRP CE3 1 1 9 6361 1 1 28 TRP CG C -2.589 1.646 6.846 1.00 . A A . 28 TRP CG 1 1 9 6362 1 1 28 TRP CH2 C -1.434 -1.944 8.640 1.00 . A A . 28 TRP CH2 1 1 9 6363 1 1 28 TRP CZ2 C -1.609 -0.787 9.346 1.00 . A A . 28 TRP CZ2 1 1 9 6364 1 1 28 TRP CZ3 C -1.640 -1.992 7.254 1.00 . A A . 28 TRP CZ3 1 1 9 6365 1 1 28 TRP H H -2.097 4.731 5.520 1.00 . A A . 28 TRP H 1 1 9 6366 1 1 28 TRP HA H -0.867 2.134 4.851 1.00 . A A . 28 TRP HA 1 1 9 6367 1 1 28 TRP HB2 H -3.742 2.777 5.497 1.00 . A A . 28 TRP HB2 1 1 9 6368 1 1 28 TRP HB3 H -3.193 1.216 4.879 1.00 . A A . 28 TRP HB3 1 1 9 6369 1 1 28 TRP HD1 H -2.852 3.447 8.025 1.00 . A A . 28 TRP HD1 1 1 9 6370 1 1 28 TRP HE1 H -2.156 1.952 9.981 1.00 . A A . 28 TRP HE1 1 1 9 6371 1 1 28 TRP HE3 H -2.173 -0.921 5.488 1.00 . A A . 28 TRP HE3 1 1 9 6372 1 1 28 TRP HH2 H -1.133 -2.838 9.169 1.00 . A A . 28 TRP HH2 1 1 9 6373 1 1 28 TRP HZ2 H -1.444 -0.776 10.414 1.00 . A A . 28 TRP HZ2 1 1 9 6374 1 1 28 TRP HZ3 H -1.496 -2.919 6.716 1.00 . A A . 28 TRP HZ3 1 1 9 6375 1 1 28 TRP N N -1.419 4.042 5.382 1.00 . A A . 28 TRP N 1 1 9 6376 1 1 28 TRP NE1 N -2.233 1.632 9.058 1.00 . A A . 28 TRP NE1 1 1 9 6377 1 1 28 TRP O O -2.817 3.765 2.853 1.00 . A A . 28 TRP O 1 1 9 6378 1 1 29 PHE C C -1.844 0.839 0.532 1.00 . A A . 29 PHE C 1 1 9 6379 1 1 29 PHE CA C -1.348 2.195 1.045 1.00 . A A . 29 PHE CA 1 1 9 6380 1 1 29 PHE CB C 0.091 2.437 0.490 1.00 . A A . 29 PHE CB 1 1 9 6381 1 1 29 PHE CD1 C 1.293 3.577 2.384 1.00 . A A . 29 PHE CD1 1 1 9 6382 1 1 29 PHE CD2 C 1.034 4.780 0.370 1.00 . A A . 29 PHE CD2 1 1 9 6383 1 1 29 PHE CE1 C 1.939 4.644 2.942 1.00 . A A . 29 PHE CE1 1 1 9 6384 1 1 29 PHE CE2 C 1.691 5.860 0.930 1.00 . A A . 29 PHE CE2 1 1 9 6385 1 1 29 PHE CG C 0.820 3.625 1.094 1.00 . A A . 29 PHE CG 1 1 9 6386 1 1 29 PHE CZ C 2.137 5.786 2.224 1.00 . A A . 29 PHE CZ 1 1 9 6387 1 1 29 PHE H H -0.679 1.502 2.902 1.00 . A A . 29 PHE H 1 1 9 6388 1 1 29 PHE HA H -1.991 2.996 0.717 1.00 . A A . 29 PHE HA 1 1 9 6389 1 1 29 PHE HB2 H 0.701 1.560 0.630 1.00 . A A . 29 PHE HB2 1 1 9 6390 1 1 29 PHE HB3 H -0.005 2.613 -0.571 1.00 . A A . 29 PHE HB3 1 1 9 6391 1 1 29 PHE HD1 H 1.133 2.684 2.966 1.00 . A A . 29 PHE HD1 1 1 9 6392 1 1 29 PHE HD2 H 0.682 4.838 -0.648 1.00 . A A . 29 PHE HD2 1 1 9 6393 1 1 29 PHE HE1 H 2.302 4.571 3.956 1.00 . A A . 29 PHE HE1 1 1 9 6394 1 1 29 PHE HE2 H 1.842 6.761 0.354 1.00 . A A . 29 PHE HE2 1 1 9 6395 1 1 29 PHE HZ H 2.654 6.612 2.695 1.00 . A A . 29 PHE HZ 1 1 9 6396 1 1 29 PHE N N -1.295 2.147 2.484 1.00 . A A . 29 PHE N 1 1 9 6397 1 1 29 PHE O O -1.697 -0.185 1.214 1.00 . A A . 29 PHE O 1 1 9 6398 1 1 30 HIS C C -1.698 -0.911 -2.154 1.00 . A A . 30 HIS C 1 1 9 6399 1 1 30 HIS CA C -2.828 -0.448 -1.292 1.00 . A A . 30 HIS CA 1 1 9 6400 1 1 30 HIS CB C -4.069 -0.306 -2.203 1.00 . A A . 30 HIS CB 1 1 9 6401 1 1 30 HIS CD2 C -6.291 -1.010 -1.083 1.00 . A A . 30 HIS CD2 1 1 9 6402 1 1 30 HIS CE1 C -7.194 0.975 -0.926 1.00 . A A . 30 HIS CE1 1 1 9 6403 1 1 30 HIS CG C -5.388 -0.110 -1.557 1.00 . A A . 30 HIS CG 1 1 9 6404 1 1 30 HIS H H -2.512 1.692 -1.099 1.00 . A A . 30 HIS H 1 1 9 6405 1 1 30 HIS HA H -3.010 -1.179 -0.520 1.00 . A A . 30 HIS HA 1 1 9 6406 1 1 30 HIS HB2 H -3.903 0.624 -2.728 1.00 . A A . 30 HIS HB2 1 1 9 6407 1 1 30 HIS HB3 H -4.142 -1.039 -2.986 1.00 . A A . 30 HIS HB3 1 1 9 6408 1 1 30 HIS HD2 H -6.144 -2.080 -1.025 1.00 . A A . 30 HIS HD2 1 1 9 6409 1 1 30 HIS HE1 H -7.900 1.766 -0.734 1.00 . A A . 30 HIS HE1 1 1 9 6410 1 1 30 HIS HE2 H -8.287 -0.719 -0.569 1.00 . A A . 30 HIS HE2 1 1 9 6411 1 1 30 HIS N N -2.424 0.819 -0.659 1.00 . A A . 30 HIS N 1 1 9 6412 1 1 30 HIS ND1 N -5.977 1.126 -1.446 1.00 . A A . 30 HIS ND1 1 1 9 6413 1 1 30 HIS NE2 N -7.400 -0.310 -0.705 1.00 . A A . 30 HIS NE2 1 1 9 6414 1 1 30 HIS O O -1.097 -0.101 -2.836 1.00 . A A . 30 HIS O 1 1 9 6415 1 1 31 GLN C C -0.519 -2.384 -4.448 1.00 . A A . 31 GLN C 1 1 9 6416 1 1 31 GLN CA C -0.348 -2.739 -2.972 1.00 . A A . 31 GLN CA 1 1 9 6417 1 1 31 GLN CB C -0.158 -4.235 -2.746 1.00 . A A . 31 GLN CB 1 1 9 6418 1 1 31 GLN CD C 0.589 -6.041 -1.147 1.00 . A A . 31 GLN CD 1 1 9 6419 1 1 31 GLN CG C 0.432 -4.562 -1.385 1.00 . A A . 31 GLN CG 1 1 9 6420 1 1 31 GLN H H -1.917 -2.803 -1.553 1.00 . A A . 31 GLN H 1 1 9 6421 1 1 31 GLN HA H 0.531 -2.216 -2.626 1.00 . A A . 31 GLN HA 1 1 9 6422 1 1 31 GLN HB2 H -1.115 -4.733 -2.824 1.00 . A A . 31 GLN HB2 1 1 9 6423 1 1 31 GLN HB3 H 0.511 -4.619 -3.500 1.00 . A A . 31 GLN HB3 1 1 9 6424 1 1 31 GLN HE21 H -1.145 -6.104 -0.234 1.00 . A A . 31 GLN HE21 1 1 9 6425 1 1 31 GLN HE22 H -0.282 -7.599 -0.356 1.00 . A A . 31 GLN HE22 1 1 9 6426 1 1 31 GLN HG2 H 1.409 -4.112 -1.323 1.00 . A A . 31 GLN HG2 1 1 9 6427 1 1 31 GLN HG3 H -0.200 -4.146 -0.621 1.00 . A A . 31 GLN HG3 1 1 9 6428 1 1 31 GLN N N -1.421 -2.195 -2.144 1.00 . A A . 31 GLN N 1 1 9 6429 1 1 31 GLN NE2 N -0.374 -6.638 -0.523 1.00 . A A . 31 GLN NE2 1 1 9 6430 1 1 31 GLN O O 0.361 -1.825 -5.042 1.00 . A A . 31 GLN O 1 1 9 6431 1 1 31 GLN OE1 O 1.588 -6.622 -1.487 1.00 . A A . 31 GLN OE1 1 1 9 6432 1 1 32 VAL C C -1.934 -0.811 -6.692 1.00 . A A . 32 VAL C 1 1 9 6433 1 1 32 VAL CA C -1.930 -2.352 -6.407 1.00 . A A . 32 VAL CA 1 1 9 6434 1 1 32 VAL CB C -3.275 -2.972 -6.871 1.00 . A A . 32 VAL CB 1 1 9 6435 1 1 32 VAL CG1 C -4.402 -2.412 -6.058 1.00 . A A . 32 VAL CG1 1 1 9 6436 1 1 32 VAL CG2 C -3.505 -2.699 -8.330 1.00 . A A . 32 VAL CG2 1 1 9 6437 1 1 32 VAL H H -2.383 -3.058 -4.462 1.00 . A A . 32 VAL H 1 1 9 6438 1 1 32 VAL HA H -1.136 -2.794 -6.980 1.00 . A A . 32 VAL HA 1 1 9 6439 1 1 32 VAL HB H -3.250 -4.040 -6.716 1.00 . A A . 32 VAL HB 1 1 9 6440 1 1 32 VAL HG11 H -4.360 -1.344 -6.223 1.00 . A A . 32 VAL HG11 1 1 9 6441 1 1 32 VAL HG12 H -4.201 -2.616 -5.016 1.00 . A A . 32 VAL HG12 1 1 9 6442 1 1 32 VAL HG13 H -5.348 -2.810 -6.394 1.00 . A A . 32 VAL HG13 1 1 9 6443 1 1 32 VAL HG21 H -2.708 -3.110 -8.927 1.00 . A A . 32 VAL HG21 1 1 9 6444 1 1 32 VAL HG22 H -3.507 -1.625 -8.416 1.00 . A A . 32 VAL HG22 1 1 9 6445 1 1 32 VAL HG23 H -4.461 -3.100 -8.635 1.00 . A A . 32 VAL HG23 1 1 9 6446 1 1 32 VAL N N -1.676 -2.653 -4.996 1.00 . A A . 32 VAL N 1 1 9 6447 1 1 32 VAL O O -1.442 -0.346 -7.713 1.00 . A A . 32 VAL O 1 1 9 6448 1 1 33 CYS C C -1.279 2.112 -5.848 1.00 . A A . 33 CYS C 1 1 9 6449 1 1 33 CYS CA C -2.633 1.386 -5.959 1.00 . A A . 33 CYS CA 1 1 9 6450 1 1 33 CYS CB C -3.744 2.004 -5.035 1.00 . A A . 33 CYS CB 1 1 9 6451 1 1 33 CYS H H -2.726 -0.589 -4.982 1.00 . A A . 33 CYS H 1 1 9 6452 1 1 33 CYS HA H -2.935 1.526 -6.989 1.00 . A A . 33 CYS HA 1 1 9 6453 1 1 33 CYS HB2 H -4.172 2.856 -5.513 1.00 . A A . 33 CYS HB2 1 1 9 6454 1 1 33 CYS HB3 H -4.543 1.281 -4.955 1.00 . A A . 33 CYS HB3 1 1 9 6455 1 1 33 CYS N N -2.476 -0.046 -5.754 1.00 . A A . 33 CYS N 1 1 9 6456 1 1 33 CYS O O -1.092 3.168 -6.429 1.00 . A A . 33 CYS O 1 1 9 6457 1 1 33 CYS SG S -3.270 2.446 -3.358 1.00 . A A . 33 CYS SG 1 1 9 6458 1 1 34 VAL C C 2.039 1.268 -5.708 1.00 . A A . 34 VAL C 1 1 9 6459 1 1 34 VAL CA C 0.948 2.134 -5.001 1.00 . A A . 34 VAL CA 1 1 9 6460 1 1 34 VAL CB C 1.271 2.370 -3.510 1.00 . A A . 34 VAL CB 1 1 9 6461 1 1 34 VAL CG1 C 1.848 1.184 -2.800 1.00 . A A . 34 VAL CG1 1 1 9 6462 1 1 34 VAL CG2 C 2.025 3.630 -3.318 1.00 . A A . 34 VAL CG2 1 1 9 6463 1 1 34 VAL H H -0.463 0.721 -4.598 1.00 . A A . 34 VAL H 1 1 9 6464 1 1 34 VAL HA H 0.909 3.095 -5.497 1.00 . A A . 34 VAL HA 1 1 9 6465 1 1 34 VAL HB H 0.354 2.453 -2.954 1.00 . A A . 34 VAL HB 1 1 9 6466 1 1 34 VAL HG11 H 1.211 0.318 -2.902 1.00 . A A . 34 VAL HG11 1 1 9 6467 1 1 34 VAL HG12 H 1.964 1.421 -1.752 1.00 . A A . 34 VAL HG12 1 1 9 6468 1 1 34 VAL HG13 H 2.816 0.981 -3.232 1.00 . A A . 34 VAL HG13 1 1 9 6469 1 1 34 VAL HG21 H 2.953 3.579 -3.865 1.00 . A A . 34 VAL HG21 1 1 9 6470 1 1 34 VAL HG22 H 2.174 3.765 -2.258 1.00 . A A . 34 VAL HG22 1 1 9 6471 1 1 34 VAL HG23 H 1.375 4.393 -3.721 1.00 . A A . 34 VAL HG23 1 1 9 6472 1 1 34 VAL N N -0.336 1.532 -5.124 1.00 . A A . 34 VAL N 1 1 9 6473 1 1 34 VAL O O 3.240 1.504 -5.566 1.00 . A A . 34 VAL O 1 1 9 6474 1 1 35 GLY C C 3.456 -1.499 -6.488 1.00 . A A . 35 GLY C 1 1 9 6475 1 1 35 GLY CA C 2.509 -0.567 -7.298 1.00 . A A . 35 GLY CA 1 1 9 6476 1 1 35 GLY H H 0.608 0.279 -6.627 1.00 . A A . 35 GLY H 1 1 9 6477 1 1 35 GLY HA2 H 1.916 -1.206 -7.936 1.00 . A A . 35 GLY HA2 1 1 9 6478 1 1 35 GLY HA3 H 3.107 0.077 -7.926 1.00 . A A . 35 GLY HA3 1 1 9 6479 1 1 35 GLY N N 1.587 0.305 -6.517 1.00 . A A . 35 GLY N 1 1 9 6480 1 1 35 GLY O O 4.620 -1.691 -6.870 1.00 . A A . 35 GLY O 1 1 9 6481 1 1 36 VAL C C 3.258 -4.460 -5.066 1.00 . A A . 36 VAL C 1 1 9 6482 1 1 36 VAL CA C 3.701 -3.057 -4.617 1.00 . A A . 36 VAL CA 1 1 9 6483 1 1 36 VAL CB C 3.332 -2.907 -3.113 1.00 . A A . 36 VAL CB 1 1 9 6484 1 1 36 VAL CG1 C 3.976 -3.972 -2.248 1.00 . A A . 36 VAL CG1 1 1 9 6485 1 1 36 VAL CG2 C 3.690 -1.548 -2.616 1.00 . A A . 36 VAL CG2 1 1 9 6486 1 1 36 VAL H H 2.080 -1.813 -5.078 1.00 . A A . 36 VAL H 1 1 9 6487 1 1 36 VAL HA H 4.772 -2.896 -4.736 1.00 . A A . 36 VAL HA 1 1 9 6488 1 1 36 VAL HB H 2.260 -3.015 -3.048 1.00 . A A . 36 VAL HB 1 1 9 6489 1 1 36 VAL HG11 H 5.052 -3.934 -2.344 1.00 . A A . 36 VAL HG11 1 1 9 6490 1 1 36 VAL HG12 H 3.632 -4.928 -2.615 1.00 . A A . 36 VAL HG12 1 1 9 6491 1 1 36 VAL HG13 H 3.678 -3.845 -1.217 1.00 . A A . 36 VAL HG13 1 1 9 6492 1 1 36 VAL HG21 H 3.134 -0.834 -3.205 1.00 . A A . 36 VAL HG21 1 1 9 6493 1 1 36 VAL HG22 H 4.748 -1.366 -2.724 1.00 . A A . 36 VAL HG22 1 1 9 6494 1 1 36 VAL HG23 H 3.394 -1.454 -1.582 1.00 . A A . 36 VAL HG23 1 1 9 6495 1 1 36 VAL N N 2.974 -2.064 -5.407 1.00 . A A . 36 VAL N 1 1 9 6496 1 1 36 VAL O O 2.098 -4.650 -5.468 1.00 . A A . 36 VAL O 1 1 9 6497 1 1 37 SER C C 3.548 -7.501 -3.971 1.00 . A A . 37 SER C 1 1 9 6498 1 1 37 SER CA C 3.764 -6.781 -5.311 1.00 . A A . 37 SER CA 1 1 9 6499 1 1 37 SER CB C 4.882 -7.443 -6.140 1.00 . A A . 37 SER CB 1 1 9 6500 1 1 37 SER H H 5.084 -5.349 -4.807 1.00 . A A . 37 SER H 1 1 9 6501 1 1 37 SER HA H 2.837 -6.785 -5.867 1.00 . A A . 37 SER HA 1 1 9 6502 1 1 37 SER HB2 H 4.663 -8.490 -6.278 1.00 . A A . 37 SER HB2 1 1 9 6503 1 1 37 SER HB3 H 4.948 -6.967 -7.107 1.00 . A A . 37 SER HB3 1 1 9 6504 1 1 37 SER HG H 6.732 -8.028 -5.796 1.00 . A A . 37 SER HG 1 1 9 6505 1 1 37 SER N N 4.129 -5.421 -5.029 1.00 . A A . 37 SER N 1 1 9 6506 1 1 37 SER O O 4.158 -7.120 -2.982 1.00 . A A . 37 SER O 1 1 9 6507 1 1 37 SER OG O 6.145 -7.331 -5.485 1.00 . A A . 37 SER OG 1 1 9 6508 1 1 38 PRO C C 3.656 -9.785 -1.938 1.00 . A A . 38 PRO C 1 1 9 6509 1 1 38 PRO CA C 2.396 -9.247 -2.647 1.00 . A A . 38 PRO CA 1 1 9 6510 1 1 38 PRO CB C 1.468 -10.392 -3.093 1.00 . A A . 38 PRO CB 1 1 9 6511 1 1 38 PRO CD C 1.923 -9.066 -5.024 1.00 . A A . 38 PRO CD 1 1 9 6512 1 1 38 PRO CG C 1.649 -10.464 -4.569 1.00 . A A . 38 PRO CG 1 1 9 6513 1 1 38 PRO HA H 1.866 -8.602 -1.960 1.00 . A A . 38 PRO HA 1 1 9 6514 1 1 38 PRO HB2 H 1.754 -11.306 -2.593 1.00 . A A . 38 PRO HB2 1 1 9 6515 1 1 38 PRO HB3 H 0.450 -10.135 -2.837 1.00 . A A . 38 PRO HB3 1 1 9 6516 1 1 38 PRO HD2 H 2.507 -9.071 -5.932 1.00 . A A . 38 PRO HD2 1 1 9 6517 1 1 38 PRO HD3 H 1.005 -8.515 -5.164 1.00 . A A . 38 PRO HD3 1 1 9 6518 1 1 38 PRO HG2 H 2.506 -11.079 -4.789 1.00 . A A . 38 PRO HG2 1 1 9 6519 1 1 38 PRO HG3 H 0.758 -10.849 -5.041 1.00 . A A . 38 PRO HG3 1 1 9 6520 1 1 38 PRO N N 2.692 -8.526 -3.907 1.00 . A A . 38 PRO N 1 1 9 6521 1 1 38 PRO O O 3.714 -9.848 -0.717 1.00 . A A . 38 PRO O 1 1 9 6522 1 1 39 GLU C C 6.708 -9.520 -1.533 1.00 . A A . 39 GLU C 1 1 9 6523 1 1 39 GLU CA C 5.926 -10.640 -2.246 1.00 . A A . 39 GLU CA 1 1 9 6524 1 1 39 GLU CB C 6.723 -11.119 -3.458 1.00 . A A . 39 GLU CB 1 1 9 6525 1 1 39 GLU CD C 6.783 -12.555 -5.551 1.00 . A A . 39 GLU CD 1 1 9 6526 1 1 39 GLU CG C 6.019 -12.185 -4.293 1.00 . A A . 39 GLU CG 1 1 9 6527 1 1 39 GLU H H 4.623 -10.072 -3.703 1.00 . A A . 39 GLU H 1 1 9 6528 1 1 39 GLU HA H 5.768 -11.471 -1.573 1.00 . A A . 39 GLU HA 1 1 9 6529 1 1 39 GLU HB2 H 6.945 -10.274 -4.100 1.00 . A A . 39 GLU HB2 1 1 9 6530 1 1 39 GLU HB3 H 7.645 -11.524 -3.084 1.00 . A A . 39 GLU HB3 1 1 9 6531 1 1 39 GLU HG2 H 5.904 -13.074 -3.688 1.00 . A A . 39 GLU HG2 1 1 9 6532 1 1 39 GLU HG3 H 5.038 -11.822 -4.565 1.00 . A A . 39 GLU HG3 1 1 9 6533 1 1 39 GLU N N 4.666 -10.136 -2.728 1.00 . A A . 39 GLU N 1 1 9 6534 1 1 39 GLU O O 7.426 -9.761 -0.561 1.00 . A A . 39 GLU O 1 1 9 6535 1 1 39 GLU OE1 O 6.625 -11.852 -6.596 1.00 . A A . 39 GLU OE1 1 1 9 6536 1 1 39 GLU OE2 O 7.522 -13.552 -5.527 1.00 . A A . 39 GLU OE2 1 1 9 6537 1 1 40 MET C C 6.782 -6.760 -0.130 1.00 . A A . 40 MET C 1 1 9 6538 1 1 40 MET CA C 7.232 -7.108 -1.535 1.00 . A A . 40 MET CA 1 1 9 6539 1 1 40 MET CB C 6.918 -5.938 -2.467 1.00 . A A . 40 MET CB 1 1 9 6540 1 1 40 MET CE C 7.839 -1.899 -2.854 1.00 . A A . 40 MET CE 1 1 9 6541 1 1 40 MET CG C 7.584 -4.603 -2.174 1.00 . A A . 40 MET CG 1 1 9 6542 1 1 40 MET H H 5.833 -8.185 -2.704 1.00 . A A . 40 MET H 1 1 9 6543 1 1 40 MET HA H 8.298 -7.285 -1.546 1.00 . A A . 40 MET HA 1 1 9 6544 1 1 40 MET HB2 H 7.086 -6.204 -3.492 1.00 . A A . 40 MET HB2 1 1 9 6545 1 1 40 MET HB3 H 5.852 -5.788 -2.368 1.00 . A A . 40 MET HB3 1 1 9 6546 1 1 40 MET HE1 H 7.463 -1.662 -1.869 1.00 . A A . 40 MET HE1 1 1 9 6547 1 1 40 MET HE2 H 7.526 -1.134 -3.549 1.00 . A A . 40 MET HE2 1 1 9 6548 1 1 40 MET HE3 H 8.914 -1.988 -2.853 1.00 . A A . 40 MET HE3 1 1 9 6549 1 1 40 MET HG2 H 7.305 -4.249 -1.188 1.00 . A A . 40 MET HG2 1 1 9 6550 1 1 40 MET HG3 H 8.652 -4.731 -2.233 1.00 . A A . 40 MET HG3 1 1 9 6551 1 1 40 MET N N 6.520 -8.303 -2.015 1.00 . A A . 40 MET N 1 1 9 6552 1 1 40 MET O O 7.605 -6.454 0.723 1.00 . A A . 40 MET O 1 1 9 6553 1 1 40 MET SD S 7.090 -3.395 -3.435 1.00 . A A . 40 MET SD 1 1 9 6554 1 1 41 ALA C C 5.427 -7.243 2.567 1.00 . A A . 41 ALA C 1 1 9 6555 1 1 41 ALA CA C 4.839 -6.483 1.379 1.00 . A A . 41 ALA CA 1 1 9 6556 1 1 41 ALA CB C 3.341 -6.719 1.281 1.00 . A A . 41 ALA CB 1 1 9 6557 1 1 41 ALA H H 4.851 -7.095 -0.628 1.00 . A A . 41 ALA H 1 1 9 6558 1 1 41 ALA HA H 4.987 -5.422 1.537 1.00 . A A . 41 ALA HA 1 1 9 6559 1 1 41 ALA HB1 H 2.917 -6.147 0.464 1.00 . A A . 41 ALA HB1 1 1 9 6560 1 1 41 ALA HB2 H 2.856 -6.417 2.195 1.00 . A A . 41 ALA HB2 1 1 9 6561 1 1 41 ALA HB3 H 3.164 -7.771 1.107 1.00 . A A . 41 ALA HB3 1 1 9 6562 1 1 41 ALA N N 5.464 -6.840 0.097 1.00 . A A . 41 ALA N 1 1 9 6563 1 1 41 ALA O O 5.594 -6.678 3.653 1.00 . A A . 41 ALA O 1 1 9 6564 1 1 42 GLU C C 7.856 -9.249 3.415 1.00 . A A . 42 GLU C 1 1 9 6565 1 1 42 GLU CA C 6.340 -9.263 3.443 1.00 . A A . 42 GLU CA 1 1 9 6566 1 1 42 GLU CB C 5.829 -10.698 3.557 1.00 . A A . 42 GLU CB 1 1 9 6567 1 1 42 GLU CD C 4.028 -12.259 4.283 1.00 . A A . 42 GLU CD 1 1 9 6568 1 1 42 GLU CG C 4.380 -10.822 3.989 1.00 . A A . 42 GLU CG 1 1 9 6569 1 1 42 GLU H H 5.462 -8.783 1.468 1.00 . A A . 42 GLU H 1 1 9 6570 1 1 42 GLU HA H 6.057 -8.749 4.351 1.00 . A A . 42 GLU HA 1 1 9 6571 1 1 42 GLU HB2 H 5.947 -11.195 2.603 1.00 . A A . 42 GLU HB2 1 1 9 6572 1 1 42 GLU HB3 H 6.440 -11.220 4.281 1.00 . A A . 42 GLU HB3 1 1 9 6573 1 1 42 GLU HG2 H 4.219 -10.241 4.888 1.00 . A A . 42 GLU HG2 1 1 9 6574 1 1 42 GLU HG3 H 3.725 -10.473 3.205 1.00 . A A . 42 GLU HG3 1 1 9 6575 1 1 42 GLU N N 5.731 -8.509 2.368 1.00 . A A . 42 GLU N 1 1 9 6576 1 1 42 GLU O O 8.484 -9.033 4.444 1.00 . A A . 42 GLU O 1 1 9 6577 1 1 42 GLU OE1 O 3.611 -12.978 3.358 1.00 . A A . 42 GLU OE1 1 1 9 6578 1 1 42 GLU OE2 O 4.217 -12.697 5.453 1.00 . A A . 42 GLU OE2 1 1 9 6579 1 1 43 ASN C C 10.693 -8.314 2.349 1.00 . A A . 43 ASN C 1 1 9 6580 1 1 43 ASN CA C 9.894 -9.612 2.169 1.00 . A A . 43 ASN CA 1 1 9 6581 1 1 43 ASN CB C 10.301 -10.300 0.857 1.00 . A A . 43 ASN CB 1 1 9 6582 1 1 43 ASN CG C 9.802 -11.733 0.750 1.00 . A A . 43 ASN CG 1 1 9 6583 1 1 43 ASN H H 7.981 -9.674 1.418 1.00 . A A . 43 ASN H 1 1 9 6584 1 1 43 ASN HA H 10.184 -10.281 2.967 1.00 . A A . 43 ASN HA 1 1 9 6585 1 1 43 ASN HB2 H 9.892 -9.739 0.028 1.00 . A A . 43 ASN HB2 1 1 9 6586 1 1 43 ASN HB3 H 11.378 -10.294 0.792 1.00 . A A . 43 ASN HB3 1 1 9 6587 1 1 43 ASN HD21 H 9.643 -11.552 -1.202 1.00 . A A . 43 ASN HD21 1 1 9 6588 1 1 43 ASN HD22 H 9.204 -13.097 -0.519 1.00 . A A . 43 ASN HD22 1 1 9 6589 1 1 43 ASN N N 8.441 -9.487 2.262 1.00 . A A . 43 ASN N 1 1 9 6590 1 1 43 ASN ND2 N 9.520 -12.172 -0.453 1.00 . A A . 43 ASN ND2 1 1 9 6591 1 1 43 ASN O O 11.757 -8.338 2.968 1.00 . A A . 43 ASN O 1 1 9 6592 1 1 43 ASN OD1 O 9.666 -12.433 1.735 1.00 . A A . 43 ASN OD1 1 1 9 6593 1 1 44 GLU C C 10.333 -4.810 2.504 1.00 . A A . 44 GLU C 1 1 9 6594 1 1 44 GLU CA C 11.038 -5.992 1.854 1.00 . A A . 44 GLU CA 1 1 9 6595 1 1 44 GLU CB C 11.497 -5.642 0.435 1.00 . A A . 44 GLU CB 1 1 9 6596 1 1 44 GLU CD C 12.767 -6.417 -1.624 1.00 . A A . 44 GLU CD 1 1 9 6597 1 1 44 GLU CG C 12.203 -6.793 -0.277 1.00 . A A . 44 GLU CG 1 1 9 6598 1 1 44 GLU H H 9.285 -7.117 1.509 1.00 . A A . 44 GLU H 1 1 9 6599 1 1 44 GLU HA H 11.914 -6.210 2.447 1.00 . A A . 44 GLU HA 1 1 9 6600 1 1 44 GLU HB2 H 10.645 -5.329 -0.149 1.00 . A A . 44 GLU HB2 1 1 9 6601 1 1 44 GLU HB3 H 12.185 -4.815 0.503 1.00 . A A . 44 GLU HB3 1 1 9 6602 1 1 44 GLU HG2 H 13.014 -7.151 0.341 1.00 . A A . 44 GLU HG2 1 1 9 6603 1 1 44 GLU HG3 H 11.467 -7.577 -0.416 1.00 . A A . 44 GLU HG3 1 1 9 6604 1 1 44 GLU N N 10.207 -7.189 1.845 1.00 . A A . 44 GLU N 1 1 9 6605 1 1 44 GLU O O 9.114 -4.791 2.629 1.00 . A A . 44 GLU O 1 1 9 6606 1 1 44 GLU OE1 O 12.023 -6.397 -2.612 1.00 . A A . 44 GLU OE1 1 1 9 6607 1 1 44 GLU OE2 O 13.996 -6.172 -1.712 1.00 . A A . 44 GLU OE2 1 1 9 6608 1 1 45 ASP C C 9.952 -1.696 2.624 1.00 . A A . 45 ASP C 1 1 9 6609 1 1 45 ASP CA C 10.582 -2.648 3.600 1.00 . A A . 45 ASP CA 1 1 9 6610 1 1 45 ASP CB C 11.684 -1.898 4.361 1.00 . A A . 45 ASP CB 1 1 9 6611 1 1 45 ASP CG C 12.393 -2.730 5.402 1.00 . A A . 45 ASP CG 1 1 9 6612 1 1 45 ASP H H 12.077 -3.882 2.751 1.00 . A A . 45 ASP H 1 1 9 6613 1 1 45 ASP HA H 9.845 -2.989 4.312 1.00 . A A . 45 ASP HA 1 1 9 6614 1 1 45 ASP HB2 H 12.426 -1.567 3.644 1.00 . A A . 45 ASP HB2 1 1 9 6615 1 1 45 ASP HB3 H 11.246 -1.030 4.837 1.00 . A A . 45 ASP HB3 1 1 9 6616 1 1 45 ASP N N 11.112 -3.822 2.913 1.00 . A A . 45 ASP N 1 1 9 6617 1 1 45 ASP O O 10.616 -1.151 1.744 1.00 . A A . 45 ASP O 1 1 9 6618 1 1 45 ASP OD1 O 11.939 -2.780 6.562 1.00 . A A . 45 ASP OD1 1 1 9 6619 1 1 45 ASP OD2 O 13.436 -3.327 5.078 1.00 . A A . 45 ASP OD2 1 1 9 6620 1 1 46 TYR C C 8.240 0.889 2.353 1.00 . A A . 46 TYR C 1 1 9 6621 1 1 46 TYR CA C 7.951 -0.576 1.959 1.00 . A A . 46 TYR CA 1 1 9 6622 1 1 46 TYR CB C 6.440 -0.868 1.979 1.00 . A A . 46 TYR CB 1 1 9 6623 1 1 46 TYR CD1 C 5.504 0.210 -0.107 1.00 . A A . 46 TYR CD1 1 1 9 6624 1 1 46 TYR CD2 C 5.035 1.200 2.002 1.00 . A A . 46 TYR CD2 1 1 9 6625 1 1 46 TYR CE1 C 4.797 1.216 -0.731 1.00 . A A . 46 TYR CE1 1 1 9 6626 1 1 46 TYR CE2 C 4.320 2.181 1.379 1.00 . A A . 46 TYR CE2 1 1 9 6627 1 1 46 TYR CG C 5.635 0.192 1.277 1.00 . A A . 46 TYR CG 1 1 9 6628 1 1 46 TYR CZ C 4.217 2.193 0.029 1.00 . A A . 46 TYR CZ 1 1 9 6629 1 1 46 TYR H H 8.199 -2.088 3.393 1.00 . A A . 46 TYR H 1 1 9 6630 1 1 46 TYR HA H 8.296 -0.705 0.942 1.00 . A A . 46 TYR HA 1 1 9 6631 1 1 46 TYR HB2 H 6.274 -1.809 1.483 1.00 . A A . 46 TYR HB2 1 1 9 6632 1 1 46 TYR HB3 H 6.100 -0.934 3.001 1.00 . A A . 46 TYR HB3 1 1 9 6633 1 1 46 TYR HD1 H 5.970 -0.576 -0.684 1.00 . A A . 46 TYR HD1 1 1 9 6634 1 1 46 TYR HD2 H 5.109 1.212 3.079 1.00 . A A . 46 TYR HD2 1 1 9 6635 1 1 46 TYR HE1 H 4.667 1.260 -1.805 1.00 . A A . 46 TYR HE1 1 1 9 6636 1 1 46 TYR HE2 H 3.849 2.963 1.956 1.00 . A A . 46 TYR HE2 1 1 9 6637 1 1 46 TYR HH H 2.925 2.787 -1.191 1.00 . A A . 46 TYR HH 1 1 9 6638 1 1 46 TYR N N 8.669 -1.514 2.756 1.00 . A A . 46 TYR N 1 1 9 6639 1 1 46 TYR O O 7.980 1.325 3.478 1.00 . A A . 46 TYR O 1 1 9 6640 1 1 46 TYR OH O 3.532 3.194 -0.571 1.00 . A A . 46 TYR OH 1 1 9 6641 1 1 47 ILE C C 8.073 3.718 0.521 1.00 . A A . 47 ILE C 1 1 9 6642 1 1 47 ILE CA C 9.003 3.039 1.538 1.00 . A A . 47 ILE CA 1 1 9 6643 1 1 47 ILE CB C 10.497 3.403 1.251 1.00 . A A . 47 ILE CB 1 1 9 6644 1 1 47 ILE CD1 C 11.228 2.832 3.667 1.00 . A A . 47 ILE CD1 1 1 9 6645 1 1 47 ILE CG1 C 11.456 2.611 2.174 1.00 . A A . 47 ILE CG1 1 1 9 6646 1 1 47 ILE CG2 C 10.727 4.890 1.428 1.00 . A A . 47 ILE CG2 1 1 9 6647 1 1 47 ILE H H 9.014 1.085 0.619 1.00 . A A . 47 ILE H 1 1 9 6648 1 1 47 ILE HA H 8.723 3.341 2.539 1.00 . A A . 47 ILE HA 1 1 9 6649 1 1 47 ILE HB H 10.706 3.146 0.225 1.00 . A A . 47 ILE HB 1 1 9 6650 1 1 47 ILE HD11 H 11.952 2.260 4.228 1.00 . A A . 47 ILE HD11 1 1 9 6651 1 1 47 ILE HD12 H 10.229 2.517 3.934 1.00 . A A . 47 ILE HD12 1 1 9 6652 1 1 47 ILE HD13 H 11.346 3.883 3.894 1.00 . A A . 47 ILE HD13 1 1 9 6653 1 1 47 ILE HG12 H 11.340 1.556 1.984 1.00 . A A . 47 ILE HG12 1 1 9 6654 1 1 47 ILE HG13 H 12.473 2.905 1.953 1.00 . A A . 47 ILE HG13 1 1 9 6655 1 1 47 ILE HG21 H 11.763 5.131 1.241 1.00 . A A . 47 ILE HG21 1 1 9 6656 1 1 47 ILE HG22 H 10.447 5.162 2.437 1.00 . A A . 47 ILE HG22 1 1 9 6657 1 1 47 ILE HG23 H 10.093 5.415 0.729 1.00 . A A . 47 ILE HG23 1 1 9 6658 1 1 47 ILE N N 8.782 1.616 1.407 1.00 . A A . 47 ILE N 1 1 9 6659 1 1 47 ILE O O 7.924 3.211 -0.586 1.00 . A A . 47 ILE O 1 1 9 6660 1 1 48 CYS C C 7.091 6.559 -0.810 1.00 . A A . 48 CYS C 1 1 9 6661 1 1 48 CYS CA C 6.444 5.426 -0.023 1.00 . A A . 48 CYS CA 1 1 9 6662 1 1 48 CYS CB C 5.253 6.012 0.750 1.00 . A A . 48 CYS CB 1 1 9 6663 1 1 48 CYS H H 7.602 5.333 1.699 1.00 . A A . 48 CYS H 1 1 9 6664 1 1 48 CYS HA H 6.090 4.666 -0.707 1.00 . A A . 48 CYS HA 1 1 9 6665 1 1 48 CYS HB2 H 4.409 6.104 0.082 1.00 . A A . 48 CYS HB2 1 1 9 6666 1 1 48 CYS HB3 H 4.979 5.347 1.553 1.00 . A A . 48 CYS HB3 1 1 9 6667 1 1 48 CYS N N 7.429 4.835 0.881 1.00 . A A . 48 CYS N 1 1 9 6668 1 1 48 CYS O O 8.243 6.893 -0.568 1.00 . A A . 48 CYS O 1 1 9 6669 1 1 48 CYS SG S 5.558 7.651 1.468 1.00 . A A . 48 CYS SG 1 1 9 6670 1 1 49 ILE C C 7.272 9.494 -1.677 1.00 . A A . 49 ILE C 1 1 9 6671 1 1 49 ILE CA C 6.743 8.282 -2.518 1.00 . A A . 49 ILE CA 1 1 9 6672 1 1 49 ILE CB C 5.590 8.712 -3.473 1.00 . A A . 49 ILE CB 1 1 9 6673 1 1 49 ILE CD1 C 5.051 10.168 -5.457 1.00 . A A . 49 ILE CD1 1 1 9 6674 1 1 49 ILE CG1 C 6.034 9.848 -4.366 1.00 . A A . 49 ILE CG1 1 1 9 6675 1 1 49 ILE CG2 C 4.321 9.088 -2.696 1.00 . A A . 49 ILE CG2 1 1 9 6676 1 1 49 ILE H H 5.413 6.809 -1.797 1.00 . A A . 49 ILE H 1 1 9 6677 1 1 49 ILE HA H 7.558 7.939 -3.141 1.00 . A A . 49 ILE HA 1 1 9 6678 1 1 49 ILE HB H 5.328 7.867 -4.092 1.00 . A A . 49 ILE HB 1 1 9 6679 1 1 49 ILE HD11 H 4.091 10.401 -5.025 1.00 . A A . 49 ILE HD11 1 1 9 6680 1 1 49 ILE HD12 H 4.954 9.282 -6.066 1.00 . A A . 49 ILE HD12 1 1 9 6681 1 1 49 ILE HD13 H 5.410 10.991 -6.060 1.00 . A A . 49 ILE HD13 1 1 9 6682 1 1 49 ILE HG12 H 6.159 10.716 -3.740 1.00 . A A . 49 ILE HG12 1 1 9 6683 1 1 49 ILE HG13 H 6.977 9.583 -4.818 1.00 . A A . 49 ILE HG13 1 1 9 6684 1 1 49 ILE HG21 H 3.977 8.247 -2.108 1.00 . A A . 49 ILE HG21 1 1 9 6685 1 1 49 ILE HG22 H 3.546 9.363 -3.396 1.00 . A A . 49 ILE HG22 1 1 9 6686 1 1 49 ILE HG23 H 4.534 9.920 -2.042 1.00 . A A . 49 ILE HG23 1 1 9 6687 1 1 49 ILE N N 6.315 7.170 -1.693 1.00 . A A . 49 ILE N 1 1 9 6688 1 1 49 ILE O O 8.254 10.121 -2.041 1.00 . A A . 49 ILE O 1 1 9 6689 1 1 50 ASN C C 8.192 10.497 1.219 1.00 . A A . 50 ASN C 1 1 9 6690 1 1 50 ASN CA C 7.044 10.889 0.324 1.00 . A A . 50 ASN CA 1 1 9 6691 1 1 50 ASN CB C 5.870 11.397 1.167 1.00 . A A . 50 ASN CB 1 1 9 6692 1 1 50 ASN CG C 4.753 11.973 0.330 1.00 . A A . 50 ASN CG 1 1 9 6693 1 1 50 ASN H H 5.895 9.188 -0.266 1.00 . A A . 50 ASN H 1 1 9 6694 1 1 50 ASN HA H 7.378 11.682 -0.328 1.00 . A A . 50 ASN HA 1 1 9 6695 1 1 50 ASN HB2 H 5.485 10.567 1.737 1.00 . A A . 50 ASN HB2 1 1 9 6696 1 1 50 ASN HB3 H 6.219 12.168 1.841 1.00 . A A . 50 ASN HB3 1 1 9 6697 1 1 50 ASN HD21 H 5.528 13.789 0.467 1.00 . A A . 50 ASN HD21 1 1 9 6698 1 1 50 ASN HD22 H 4.078 13.645 -0.443 1.00 . A A . 50 ASN HD22 1 1 9 6699 1 1 50 ASN N N 6.643 9.764 -0.537 1.00 . A A . 50 ASN N 1 1 9 6700 1 1 50 ASN ND2 N 4.794 13.257 0.096 1.00 . A A . 50 ASN ND2 1 1 9 6701 1 1 50 ASN O O 8.998 11.324 1.614 1.00 . A A . 50 ASN O 1 1 9 6702 1 1 50 ASN OD1 O 3.846 11.259 -0.095 1.00 . A A . 50 ASN OD1 1 1 9 6703 1 1 51 CYS C C 10.642 8.587 1.488 1.00 . A A . 51 CYS C 1 1 9 6704 1 1 51 CYS CA C 9.365 8.721 2.336 1.00 . A A . 51 CYS CA 1 1 9 6705 1 1 51 CYS CB C 9.017 7.382 3.001 1.00 . A A . 51 CYS CB 1 1 9 6706 1 1 51 CYS H H 7.568 8.628 1.192 1.00 . A A . 51 CYS H 1 1 9 6707 1 1 51 CYS HA H 9.550 9.454 3.106 1.00 . A A . 51 CYS HA 1 1 9 6708 1 1 51 CYS HB2 H 8.577 6.734 2.257 1.00 . A A . 51 CYS HB2 1 1 9 6709 1 1 51 CYS HB3 H 9.941 6.942 3.345 1.00 . A A . 51 CYS HB3 1 1 9 6710 1 1 51 CYS N N 8.270 9.219 1.535 1.00 . A A . 51 CYS N 1 1 9 6711 1 1 51 CYS O O 11.756 8.649 1.998 1.00 . A A . 51 CYS O 1 1 9 6712 1 1 51 CYS SG S 7.864 7.451 4.409 1.00 . A A . 51 CYS SG 1 1 9 6713 1 1 52 ALA C C 12.068 9.588 -1.299 1.00 . A A . 52 ALA C 1 1 9 6714 1 1 52 ALA CA C 11.579 8.251 -0.733 1.00 . A A . 52 ALA CA 1 1 9 6715 1 1 52 ALA CB C 11.195 7.310 -1.862 1.00 . A A . 52 ALA CB 1 1 9 6716 1 1 52 ALA H H 9.539 8.456 -0.149 1.00 . A A . 52 ALA H 1 1 9 6717 1 1 52 ALA HA H 12.378 7.793 -0.165 1.00 . A A . 52 ALA HA 1 1 9 6718 1 1 52 ALA HB1 H 12.052 7.180 -2.507 1.00 . A A . 52 ALA HB1 1 1 9 6719 1 1 52 ALA HB2 H 10.380 7.737 -2.429 1.00 . A A . 52 ALA HB2 1 1 9 6720 1 1 52 ALA HB3 H 10.885 6.363 -1.443 1.00 . A A . 52 ALA HB3 1 1 9 6721 1 1 52 ALA N N 10.458 8.427 0.188 1.00 . A A . 52 ALA N 1 1 9 6722 2 2 1 ZN ZN ZN 5.689 7.579 3.747 1.00 . B A . 53 ZN ZN 1 1 9 6723 3 2 1 ZN ZN ZN -5.115 2.856 -1.980 1.00 . C A . 54 ZN ZN 1 1 10 6724 1 1 1 SER C C -11.337 5.817 1.594 1.00 . A A . 1 SER C 1 1 10 6725 1 1 1 SER CA C -12.363 5.933 2.743 1.00 . A A . 1 SER CA 1 1 10 6726 1 1 1 SER CB C -11.693 5.636 4.097 1.00 . A A . 1 SER CB 1 1 10 6727 1 1 1 SER HA H -12.745 6.942 2.749 1.00 . A A . 1 SER HA 1 1 10 6728 1 1 1 SER HB2 H -11.344 4.616 4.107 1.00 . A A . 1 SER HB2 1 1 10 6729 1 1 1 SER HB3 H -10.857 6.308 4.230 1.00 . A A . 1 SER HB3 1 1 10 6730 1 1 1 SER HG H -13.055 4.960 5.289 1.00 . A A . 1 SER HG 1 1 10 6731 1 1 1 SER N N -13.518 5.021 2.530 1.00 . A A . 1 SER N 1 1 10 6732 1 1 1 SER O O -11.362 4.862 0.798 1.00 . A A . 1 SER O 1 1 10 6733 1 1 1 SER OG O -12.604 5.803 5.178 1.00 . A A . 1 SER OG 1 1 10 6734 1 1 2 VAL C C -8.099 6.626 1.210 1.00 . A A . 2 VAL C 1 1 10 6735 1 1 2 VAL CA C -9.418 6.783 0.492 1.00 . A A . 2 VAL CA 1 1 10 6736 1 1 2 VAL CB C -9.415 8.100 -0.358 1.00 . A A . 2 VAL CB 1 1 10 6737 1 1 2 VAL CG1 C -8.333 8.065 -1.437 1.00 . A A . 2 VAL CG1 1 1 10 6738 1 1 2 VAL CG2 C -10.780 8.340 -0.996 1.00 . A A . 2 VAL CG2 1 1 10 6739 1 1 2 VAL H H -10.468 7.542 2.120 1.00 . A A . 2 VAL H 1 1 10 6740 1 1 2 VAL HA H -9.570 5.929 -0.150 1.00 . A A . 2 VAL HA 1 1 10 6741 1 1 2 VAL HB H -9.206 8.924 0.306 1.00 . A A . 2 VAL HB 1 1 10 6742 1 1 2 VAL HG11 H -7.367 7.964 -0.968 1.00 . A A . 2 VAL HG11 1 1 10 6743 1 1 2 VAL HG12 H -8.371 8.971 -2.026 1.00 . A A . 2 VAL HG12 1 1 10 6744 1 1 2 VAL HG13 H -8.500 7.221 -2.091 1.00 . A A . 2 VAL HG13 1 1 10 6745 1 1 2 VAL HG21 H -11.517 8.378 -0.210 1.00 . A A . 2 VAL HG21 1 1 10 6746 1 1 2 VAL HG22 H -11.014 7.525 -1.667 1.00 . A A . 2 VAL HG22 1 1 10 6747 1 1 2 VAL HG23 H -10.782 9.280 -1.531 1.00 . A A . 2 VAL HG23 1 1 10 6748 1 1 2 VAL N N -10.459 6.792 1.494 1.00 . A A . 2 VAL N 1 1 10 6749 1 1 2 VAL O O -7.881 7.256 2.261 1.00 . A A . 2 VAL O 1 1 10 6750 1 1 3 CYS C C -4.942 6.556 0.847 1.00 . A A . 3 CYS C 1 1 10 6751 1 1 3 CYS CA C -5.979 5.544 1.358 1.00 . A A . 3 CYS CA 1 1 10 6752 1 1 3 CYS CB C -5.488 4.094 1.093 1.00 . A A . 3 CYS CB 1 1 10 6753 1 1 3 CYS H H -7.419 5.315 -0.144 1.00 . A A . 3 CYS H 1 1 10 6754 1 1 3 CYS HA H -6.133 5.677 2.420 1.00 . A A . 3 CYS HA 1 1 10 6755 1 1 3 CYS HB2 H -5.007 3.713 1.978 1.00 . A A . 3 CYS HB2 1 1 10 6756 1 1 3 CYS HB3 H -6.341 3.472 0.867 1.00 . A A . 3 CYS HB3 1 1 10 6757 1 1 3 CYS N N -7.232 5.779 0.691 1.00 . A A . 3 CYS N 1 1 10 6758 1 1 3 CYS O O -5.276 7.441 0.053 1.00 . A A . 3 CYS O 1 1 10 6759 1 1 3 CYS SG S -4.311 3.912 -0.277 1.00 . A A . 3 CYS SG 1 1 10 6760 1 1 4 ALA C C -2.037 6.613 -0.412 1.00 . A A . 4 ALA C 1 1 10 6761 1 1 4 ALA CA C -2.660 7.264 0.820 1.00 . A A . 4 ALA CA 1 1 10 6762 1 1 4 ALA CB C -1.614 7.431 1.933 1.00 . A A . 4 ALA CB 1 1 10 6763 1 1 4 ALA H H -3.517 5.636 1.845 1.00 . A A . 4 ALA H 1 1 10 6764 1 1 4 ALA HA H -3.077 8.228 0.563 1.00 . A A . 4 ALA HA 1 1 10 6765 1 1 4 ALA HB1 H -0.778 8.023 1.590 1.00 . A A . 4 ALA HB1 1 1 10 6766 1 1 4 ALA HB2 H -1.256 6.463 2.255 1.00 . A A . 4 ALA HB2 1 1 10 6767 1 1 4 ALA HB3 H -2.065 7.918 2.785 1.00 . A A . 4 ALA HB3 1 1 10 6768 1 1 4 ALA N N -3.713 6.407 1.272 1.00 . A A . 4 ALA N 1 1 10 6769 1 1 4 ALA O O -1.612 5.488 -0.347 1.00 . A A . 4 ALA O 1 1 10 6770 1 1 5 ALA C C -1.601 7.903 -3.831 1.00 . A A . 5 ALA C 1 1 10 6771 1 1 5 ALA CA C -1.435 6.851 -2.780 1.00 . A A . 5 ALA CA 1 1 10 6772 1 1 5 ALA CB C -2.018 5.526 -3.305 1.00 . A A . 5 ALA CB 1 1 10 6773 1 1 5 ALA H H -2.644 8.094 -1.583 1.00 . A A . 5 ALA H 1 1 10 6774 1 1 5 ALA HA H -0.383 6.708 -2.572 1.00 . A A . 5 ALA HA 1 1 10 6775 1 1 5 ALA HB1 H -1.478 5.152 -4.163 1.00 . A A . 5 ALA HB1 1 1 10 6776 1 1 5 ALA HB2 H -3.042 5.660 -3.613 1.00 . A A . 5 ALA HB2 1 1 10 6777 1 1 5 ALA HB3 H -1.991 4.784 -2.526 1.00 . A A . 5 ALA HB3 1 1 10 6778 1 1 5 ALA N N -2.086 7.293 -1.546 1.00 . A A . 5 ALA N 1 1 10 6779 1 1 5 ALA O O -2.650 8.550 -3.890 1.00 . A A . 5 ALA O 1 1 10 6780 1 1 6 GLN C C -1.811 8.847 -6.643 1.00 . A A . 6 GLN C 1 1 10 6781 1 1 6 GLN CA C -0.544 9.045 -5.798 1.00 . A A . 6 GLN CA 1 1 10 6782 1 1 6 GLN CB C 0.670 8.696 -6.690 1.00 . A A . 6 GLN CB 1 1 10 6783 1 1 6 GLN CD C 3.112 8.088 -6.860 1.00 . A A . 6 GLN CD 1 1 10 6784 1 1 6 GLN CG C 2.015 8.702 -5.990 1.00 . A A . 6 GLN CG 1 1 10 6785 1 1 6 GLN H H 0.341 7.738 -4.419 1.00 . A A . 6 GLN H 1 1 10 6786 1 1 6 GLN HA H -0.453 10.062 -5.453 1.00 . A A . 6 GLN HA 1 1 10 6787 1 1 6 GLN HB2 H 0.555 7.701 -7.095 1.00 . A A . 6 GLN HB2 1 1 10 6788 1 1 6 GLN HB3 H 0.715 9.402 -7.507 1.00 . A A . 6 GLN HB3 1 1 10 6789 1 1 6 GLN HE21 H 2.759 6.270 -6.123 1.00 . A A . 6 GLN HE21 1 1 10 6790 1 1 6 GLN HE22 H 4.019 6.410 -7.301 1.00 . A A . 6 GLN HE22 1 1 10 6791 1 1 6 GLN HG2 H 2.288 9.719 -5.753 1.00 . A A . 6 GLN HG2 1 1 10 6792 1 1 6 GLN HG3 H 1.946 8.132 -5.075 1.00 . A A . 6 GLN HG3 1 1 10 6793 1 1 6 GLN N N -0.539 8.098 -4.646 1.00 . A A . 6 GLN N 1 1 10 6794 1 1 6 GLN NE2 N 3.310 6.791 -6.741 1.00 . A A . 6 GLN NE2 1 1 10 6795 1 1 6 GLN O O -2.476 9.800 -7.032 1.00 . A A . 6 GLN O 1 1 10 6796 1 1 6 GLN OE1 O 3.771 8.767 -7.622 1.00 . A A . 6 GLN OE1 1 1 10 6797 1 1 7 ASN C C -3.969 6.072 -6.869 1.00 . A A . 7 ASN C 1 1 10 6798 1 1 7 ASN CA C -3.318 7.212 -7.586 1.00 . A A . 7 ASN CA 1 1 10 6799 1 1 7 ASN CB C -3.038 6.799 -9.063 1.00 . A A . 7 ASN CB 1 1 10 6800 1 1 7 ASN CG C -2.556 7.924 -9.965 1.00 . A A . 7 ASN CG 1 1 10 6801 1 1 7 ASN H H -1.426 7.008 -6.529 1.00 . A A . 7 ASN H 1 1 10 6802 1 1 7 ASN HA H -3.986 8.063 -7.587 1.00 . A A . 7 ASN HA 1 1 10 6803 1 1 7 ASN HB2 H -2.287 6.028 -9.057 1.00 . A A . 7 ASN HB2 1 1 10 6804 1 1 7 ASN HB3 H -3.941 6.384 -9.485 1.00 . A A . 7 ASN HB3 1 1 10 6805 1 1 7 ASN HD21 H -1.511 6.645 -11.085 1.00 . A A . 7 ASN HD21 1 1 10 6806 1 1 7 ASN HD22 H -1.439 8.300 -11.549 1.00 . A A . 7 ASN HD22 1 1 10 6807 1 1 7 ASN N N -2.119 7.602 -6.878 1.00 . A A . 7 ASN N 1 1 10 6808 1 1 7 ASN ND2 N -1.761 7.588 -10.959 1.00 . A A . 7 ASN ND2 1 1 10 6809 1 1 7 ASN O O -3.570 4.920 -7.030 1.00 . A A . 7 ASN O 1 1 10 6810 1 1 7 ASN OD1 O -2.905 9.081 -9.777 1.00 . A A . 7 ASN OD1 1 1 10 6811 1 1 8 CYS C C -6.826 4.879 -6.115 1.00 . A A . 8 CYS C 1 1 10 6812 1 1 8 CYS CA C -5.596 5.311 -5.353 1.00 . A A . 8 CYS CA 1 1 10 6813 1 1 8 CYS CB C -5.950 5.635 -3.894 1.00 . A A . 8 CYS CB 1 1 10 6814 1 1 8 CYS H H -5.232 7.280 -5.874 1.00 . A A . 8 CYS H 1 1 10 6815 1 1 8 CYS HA H -4.890 4.496 -5.359 1.00 . A A . 8 CYS HA 1 1 10 6816 1 1 8 CYS HB2 H -5.057 5.905 -3.353 1.00 . A A . 8 CYS HB2 1 1 10 6817 1 1 8 CYS HB3 H -6.651 6.457 -3.870 1.00 . A A . 8 CYS HB3 1 1 10 6818 1 1 8 CYS N N -4.929 6.363 -6.033 1.00 . A A . 8 CYS N 1 1 10 6819 1 1 8 CYS O O -7.770 5.631 -6.273 1.00 . A A . 8 CYS O 1 1 10 6820 1 1 8 CYS SG S -6.749 4.231 -3.033 1.00 . A A . 8 CYS SG 1 1 10 6821 1 1 9 GLN C C -9.049 2.682 -6.346 1.00 . A A . 9 GLN C 1 1 10 6822 1 1 9 GLN CA C -7.885 2.999 -7.300 1.00 . A A . 9 GLN CA 1 1 10 6823 1 1 9 GLN CB C -7.361 1.690 -7.906 1.00 . A A . 9 GLN CB 1 1 10 6824 1 1 9 GLN CD C -5.672 0.546 -9.415 1.00 . A A . 9 GLN CD 1 1 10 6825 1 1 9 GLN CG C -6.161 1.858 -8.834 1.00 . A A . 9 GLN CG 1 1 10 6826 1 1 9 GLN H H -5.955 3.144 -6.437 1.00 . A A . 9 GLN H 1 1 10 6827 1 1 9 GLN HA H -8.214 3.641 -8.103 1.00 . A A . 9 GLN HA 1 1 10 6828 1 1 9 GLN HB2 H -7.055 1.052 -7.091 1.00 . A A . 9 GLN HB2 1 1 10 6829 1 1 9 GLN HB3 H -8.147 1.195 -8.453 1.00 . A A . 9 GLN HB3 1 1 10 6830 1 1 9 GLN HE21 H -3.818 1.241 -9.509 1.00 . A A . 9 GLN HE21 1 1 10 6831 1 1 9 GLN HE22 H -4.076 -0.367 -10.082 1.00 . A A . 9 GLN HE22 1 1 10 6832 1 1 9 GLN HG2 H -6.411 2.530 -9.644 1.00 . A A . 9 GLN HG2 1 1 10 6833 1 1 9 GLN HG3 H -5.364 2.287 -8.247 1.00 . A A . 9 GLN HG3 1 1 10 6834 1 1 9 GLN N N -6.785 3.642 -6.570 1.00 . A A . 9 GLN N 1 1 10 6835 1 1 9 GLN NE2 N -4.396 0.471 -9.683 1.00 . A A . 9 GLN NE2 1 1 10 6836 1 1 9 GLN O O -10.125 2.285 -6.766 1.00 . A A . 9 GLN O 1 1 10 6837 1 1 9 GLN OE1 O -6.443 -0.396 -9.601 1.00 . A A . 9 GLN OE1 1 1 10 6838 1 1 10 ARG C C -10.329 1.171 -4.061 1.00 . A A . 10 ARG C 1 1 10 6839 1 1 10 ARG CA C -9.677 2.589 -3.942 1.00 . A A . 10 ARG CA 1 1 10 6840 1 1 10 ARG CB C -10.742 3.713 -3.821 1.00 . A A . 10 ARG CB 1 1 10 6841 1 1 10 ARG CD C -12.633 4.774 -2.519 1.00 . A A . 10 ARG CD 1 1 10 6842 1 1 10 ARG CG C -11.580 3.671 -2.542 1.00 . A A . 10 ARG CG 1 1 10 6843 1 1 10 ARG CZ C -14.643 5.219 -1.077 1.00 . A A . 10 ARG CZ 1 1 10 6844 1 1 10 ARG H H -7.899 3.278 -4.859 1.00 . A A . 10 ARG H 1 1 10 6845 1 1 10 ARG HA H -9.071 2.589 -3.047 1.00 . A A . 10 ARG HA 1 1 10 6846 1 1 10 ARG HB2 H -10.227 4.663 -3.854 1.00 . A A . 10 ARG HB2 1 1 10 6847 1 1 10 ARG HB3 H -11.408 3.664 -4.670 1.00 . A A . 10 ARG HB3 1 1 10 6848 1 1 10 ARG HD2 H -12.150 5.735 -2.636 1.00 . A A . 10 ARG HD2 1 1 10 6849 1 1 10 ARG HD3 H -13.323 4.611 -3.334 1.00 . A A . 10 ARG HD3 1 1 10 6850 1 1 10 ARG HE H -12.881 4.385 -0.492 1.00 . A A . 10 ARG HE 1 1 10 6851 1 1 10 ARG HG2 H -12.091 2.722 -2.489 1.00 . A A . 10 ARG HG2 1 1 10 6852 1 1 10 ARG HG3 H -10.931 3.785 -1.686 1.00 . A A . 10 ARG HG3 1 1 10 6853 1 1 10 ARG HH11 H -14.930 5.877 -3.020 1.00 . A A . 10 ARG HH11 1 1 10 6854 1 1 10 ARG HH12 H -16.252 6.111 -2.008 1.00 . A A . 10 ARG HH12 1 1 10 6855 1 1 10 ARG HH21 H -14.753 4.757 0.931 1.00 . A A . 10 ARG HH21 1 1 10 6856 1 1 10 ARG HH22 H -16.149 5.477 0.285 1.00 . A A . 10 ARG HH22 1 1 10 6857 1 1 10 ARG N N -8.770 2.872 -5.054 1.00 . A A . 10 ARG N 1 1 10 6858 1 1 10 ARG NE N -13.384 4.768 -1.250 1.00 . A A . 10 ARG NE 1 1 10 6859 1 1 10 ARG NH1 N -15.311 5.773 -2.095 1.00 . A A . 10 ARG NH1 1 1 10 6860 1 1 10 ARG NH2 N -15.213 5.147 0.127 1.00 . A A . 10 ARG NH2 1 1 10 6861 1 1 10 ARG O O -11.543 1.036 -3.993 1.00 . A A . 10 ARG O 1 1 10 6862 1 1 11 PRO C C -10.582 -1.734 -2.983 1.00 . A A . 11 PRO C 1 1 10 6863 1 1 11 PRO CA C -10.056 -1.275 -4.335 1.00 . A A . 11 PRO CA 1 1 10 6864 1 1 11 PRO CB C -8.840 -2.132 -4.770 1.00 . A A . 11 PRO CB 1 1 10 6865 1 1 11 PRO CD C -8.049 0.064 -4.346 1.00 . A A . 11 PRO CD 1 1 10 6866 1 1 11 PRO CG C -7.797 -1.143 -5.183 1.00 . A A . 11 PRO CG 1 1 10 6867 1 1 11 PRO HA H -10.837 -1.330 -5.083 1.00 . A A . 11 PRO HA 1 1 10 6868 1 1 11 PRO HB2 H -8.502 -2.713 -3.923 1.00 . A A . 11 PRO HB2 1 1 10 6869 1 1 11 PRO HB3 H -9.115 -2.778 -5.590 1.00 . A A . 11 PRO HB3 1 1 10 6870 1 1 11 PRO HD2 H -7.588 -0.050 -3.374 1.00 . A A . 11 PRO HD2 1 1 10 6871 1 1 11 PRO HD3 H -7.691 0.962 -4.826 1.00 . A A . 11 PRO HD3 1 1 10 6872 1 1 11 PRO HG2 H -6.810 -1.527 -4.974 1.00 . A A . 11 PRO HG2 1 1 10 6873 1 1 11 PRO HG3 H -7.879 -0.893 -6.231 1.00 . A A . 11 PRO HG3 1 1 10 6874 1 1 11 PRO N N -9.511 0.074 -4.237 1.00 . A A . 11 PRO N 1 1 10 6875 1 1 11 PRO O O -9.892 -1.580 -1.942 1.00 . A A . 11 PRO O 1 1 10 6876 1 1 12 CYS C C -12.715 -4.213 -1.865 1.00 . A A . 12 CYS C 1 1 10 6877 1 1 12 CYS CA C -12.436 -2.726 -1.794 1.00 . A A . 12 CYS CA 1 1 10 6878 1 1 12 CYS CB C -13.747 -1.947 -1.580 1.00 . A A . 12 CYS CB 1 1 10 6879 1 1 12 CYS H H -12.251 -2.406 -3.841 1.00 . A A . 12 CYS H 1 1 10 6880 1 1 12 CYS HA H -11.784 -2.529 -0.960 1.00 . A A . 12 CYS HA 1 1 10 6881 1 1 12 CYS HB2 H -13.521 -0.900 -1.457 1.00 . A A . 12 CYS HB2 1 1 10 6882 1 1 12 CYS HB3 H -14.380 -2.083 -2.443 1.00 . A A . 12 CYS HB3 1 1 10 6883 1 1 12 CYS HG H -15.936 -2.661 -0.515 1.00 . A A . 12 CYS HG 1 1 10 6884 1 1 12 CYS N N -11.780 -2.281 -2.991 1.00 . A A . 12 CYS N 1 1 10 6885 1 1 12 CYS O O -13.587 -4.656 -2.619 1.00 . A A . 12 CYS O 1 1 10 6886 1 1 12 CYS SG S -14.693 -2.437 -0.111 1.00 . A A . 12 CYS SG 1 1 10 6887 1 1 13 LYS C C -11.669 -6.809 0.352 1.00 . A A . 13 LYS C 1 1 10 6888 1 1 13 LYS CA C -12.114 -6.407 -1.023 1.00 . A A . 13 LYS CA 1 1 10 6889 1 1 13 LYS CB C -11.242 -7.182 -2.059 1.00 . A A . 13 LYS CB 1 1 10 6890 1 1 13 LYS CD C -10.652 -7.748 -4.427 1.00 . A A . 13 LYS CD 1 1 10 6891 1 1 13 LYS CE C -10.818 -7.382 -5.899 1.00 . A A . 13 LYS CE 1 1 10 6892 1 1 13 LYS CG C -11.492 -6.856 -3.525 1.00 . A A . 13 LYS CG 1 1 10 6893 1 1 13 LYS H H -11.237 -4.586 -0.565 1.00 . A A . 13 LYS H 1 1 10 6894 1 1 13 LYS HA H -13.151 -6.674 -1.154 1.00 . A A . 13 LYS HA 1 1 10 6895 1 1 13 LYS HB2 H -10.201 -6.975 -1.847 1.00 . A A . 13 LYS HB2 1 1 10 6896 1 1 13 LYS HB3 H -11.412 -8.240 -1.910 1.00 . A A . 13 LYS HB3 1 1 10 6897 1 1 13 LYS HD2 H -9.609 -7.665 -4.158 1.00 . A A . 13 LYS HD2 1 1 10 6898 1 1 13 LYS HD3 H -10.967 -8.769 -4.279 1.00 . A A . 13 LYS HD3 1 1 10 6899 1 1 13 LYS HE2 H -11.867 -7.389 -6.159 1.00 . A A . 13 LYS HE2 1 1 10 6900 1 1 13 LYS HE3 H -10.429 -6.385 -6.042 1.00 . A A . 13 LYS HE3 1 1 10 6901 1 1 13 LYS HG2 H -12.543 -6.994 -3.748 1.00 . A A . 13 LYS HG2 1 1 10 6902 1 1 13 LYS HG3 H -11.237 -5.820 -3.703 1.00 . A A . 13 LYS HG3 1 1 10 6903 1 1 13 LYS HZ1 H -10.480 -9.274 -6.675 1.00 . A A . 13 LYS HZ1 1 1 10 6904 1 1 13 LYS HZ2 H -9.058 -8.369 -6.582 1.00 . A A . 13 LYS HZ2 1 1 10 6905 1 1 13 LYS HZ3 H -10.197 -8.077 -7.795 1.00 . A A . 13 LYS HZ3 1 1 10 6906 1 1 13 LYS N N -11.951 -4.973 -1.118 1.00 . A A . 13 LYS N 1 1 10 6907 1 1 13 LYS NZ N -10.077 -8.321 -6.790 1.00 . A A . 13 LYS NZ 1 1 10 6908 1 1 13 LYS O O -11.018 -6.019 1.043 1.00 . A A . 13 LYS O 1 1 10 6909 1 1 14 ASP C C -10.186 -9.148 1.815 1.00 . A A . 14 ASP C 1 1 10 6910 1 1 14 ASP CA C -11.543 -8.503 2.020 1.00 . A A . 14 ASP CA 1 1 10 6911 1 1 14 ASP CB C -12.546 -9.452 2.668 1.00 . A A . 14 ASP CB 1 1 10 6912 1 1 14 ASP CG C -13.796 -8.722 3.151 1.00 . A A . 14 ASP CG 1 1 10 6913 1 1 14 ASP H H -12.674 -8.494 0.243 1.00 . A A . 14 ASP H 1 1 10 6914 1 1 14 ASP HA H -11.386 -7.657 2.671 1.00 . A A . 14 ASP HA 1 1 10 6915 1 1 14 ASP HB2 H -12.848 -10.184 1.934 1.00 . A A . 14 ASP HB2 1 1 10 6916 1 1 14 ASP HB3 H -12.101 -9.946 3.520 1.00 . A A . 14 ASP HB3 1 1 10 6917 1 1 14 ASP N N -12.033 -7.976 0.766 1.00 . A A . 14 ASP N 1 1 10 6918 1 1 14 ASP O O -9.213 -8.793 2.492 1.00 . A A . 14 ASP O 1 1 10 6919 1 1 14 ASP OD1 O -14.709 -8.472 2.331 1.00 . A A . 14 ASP OD1 1 1 10 6920 1 1 14 ASP OD2 O -13.868 -8.372 4.362 1.00 . A A . 14 ASP OD2 1 1 10 6921 1 1 15 LYS C C -7.960 -9.651 -0.259 1.00 . A A . 15 LYS C 1 1 10 6922 1 1 15 LYS CA C -8.826 -10.684 0.505 1.00 . A A . 15 LYS CA 1 1 10 6923 1 1 15 LYS CB C -9.008 -11.949 -0.391 1.00 . A A . 15 LYS CB 1 1 10 6924 1 1 15 LYS CD C -9.848 -14.292 -0.790 1.00 . A A . 15 LYS CD 1 1 10 6925 1 1 15 LYS CE C -10.613 -15.509 -0.248 1.00 . A A . 15 LYS CE 1 1 10 6926 1 1 15 LYS CG C -9.763 -13.132 0.221 1.00 . A A . 15 LYS CG 1 1 10 6927 1 1 15 LYS H H -10.870 -10.572 0.495 1.00 . A A . 15 LYS H 1 1 10 6928 1 1 15 LYS HA H -8.315 -10.981 1.410 1.00 . A A . 15 LYS HA 1 1 10 6929 1 1 15 LYS HB2 H -9.534 -11.691 -1.296 1.00 . A A . 15 LYS HB2 1 1 10 6930 1 1 15 LYS HB3 H -8.023 -12.294 -0.665 1.00 . A A . 15 LYS HB3 1 1 10 6931 1 1 15 LYS HD2 H -10.347 -13.954 -1.686 1.00 . A A . 15 LYS HD2 1 1 10 6932 1 1 15 LYS HD3 H -8.842 -14.599 -1.039 1.00 . A A . 15 LYS HD3 1 1 10 6933 1 1 15 LYS HE2 H -10.069 -15.905 0.599 1.00 . A A . 15 LYS HE2 1 1 10 6934 1 1 15 LYS HE3 H -11.600 -15.192 0.055 1.00 . A A . 15 LYS HE3 1 1 10 6935 1 1 15 LYS HG2 H -9.239 -13.475 1.101 1.00 . A A . 15 LYS HG2 1 1 10 6936 1 1 15 LYS HG3 H -10.764 -12.819 0.471 1.00 . A A . 15 LYS HG3 1 1 10 6937 1 1 15 LYS HZ1 H -9.778 -16.874 -1.606 1.00 . A A . 15 LYS HZ1 1 1 10 6938 1 1 15 LYS HZ2 H -11.247 -16.268 -2.114 1.00 . A A . 15 LYS HZ2 1 1 10 6939 1 1 15 LYS HZ3 H -11.188 -17.450 -0.924 1.00 . A A . 15 LYS HZ3 1 1 10 6940 1 1 15 LYS N N -10.106 -10.113 0.893 1.00 . A A . 15 LYS N 1 1 10 6941 1 1 15 LYS NZ N -10.722 -16.590 -1.275 1.00 . A A . 15 LYS NZ 1 1 10 6942 1 1 15 LYS O O -7.997 -9.600 -1.486 1.00 . A A . 15 LYS O 1 1 10 6943 1 1 16 VAL C C -5.557 -7.104 1.052 1.00 . A A . 16 VAL C 1 1 10 6944 1 1 16 VAL CA C -6.325 -7.825 -0.072 1.00 . A A . 16 VAL CA 1 1 10 6945 1 1 16 VAL CB C -6.992 -6.784 -1.041 1.00 . A A . 16 VAL CB 1 1 10 6946 1 1 16 VAL CG1 C -8.076 -5.993 -0.344 1.00 . A A . 16 VAL CG1 1 1 10 6947 1 1 16 VAL CG2 C -5.933 -5.852 -1.633 1.00 . A A . 16 VAL CG2 1 1 10 6948 1 1 16 VAL H H -7.413 -8.805 1.456 1.00 . A A . 16 VAL H 1 1 10 6949 1 1 16 VAL HA H -5.600 -8.407 -0.630 1.00 . A A . 16 VAL HA 1 1 10 6950 1 1 16 VAL HB H -7.446 -7.331 -1.854 1.00 . A A . 16 VAL HB 1 1 10 6951 1 1 16 VAL HG11 H -8.841 -6.664 0.014 1.00 . A A . 16 VAL HG11 1 1 10 6952 1 1 16 VAL HG12 H -8.497 -5.253 -1.007 1.00 . A A . 16 VAL HG12 1 1 10 6953 1 1 16 VAL HG13 H -7.586 -5.534 0.504 1.00 . A A . 16 VAL HG13 1 1 10 6954 1 1 16 VAL HG21 H -6.390 -5.164 -2.330 1.00 . A A . 16 VAL HG21 1 1 10 6955 1 1 16 VAL HG22 H -5.178 -6.434 -2.146 1.00 . A A . 16 VAL HG22 1 1 10 6956 1 1 16 VAL HG23 H -5.466 -5.300 -0.831 1.00 . A A . 16 VAL HG23 1 1 10 6957 1 1 16 VAL N N -7.267 -8.799 0.485 1.00 . A A . 16 VAL N 1 1 10 6958 1 1 16 VAL O O -6.095 -6.286 1.784 1.00 . A A . 16 VAL O 1 1 10 6959 1 1 17 ASP C C -2.947 -5.497 1.789 1.00 . A A . 17 ASP C 1 1 10 6960 1 1 17 ASP CA C -3.446 -6.880 2.199 1.00 . A A . 17 ASP CA 1 1 10 6961 1 1 17 ASP CB C -2.289 -7.815 2.563 1.00 . A A . 17 ASP CB 1 1 10 6962 1 1 17 ASP CG C -2.773 -9.089 3.205 1.00 . A A . 17 ASP CG 1 1 10 6963 1 1 17 ASP H H -4.075 -8.288 0.709 1.00 . A A . 17 ASP H 1 1 10 6964 1 1 17 ASP HA H -4.057 -6.746 3.081 1.00 . A A . 17 ASP HA 1 1 10 6965 1 1 17 ASP HB2 H -1.743 -8.073 1.666 1.00 . A A . 17 ASP HB2 1 1 10 6966 1 1 17 ASP HB3 H -1.635 -7.307 3.255 1.00 . A A . 17 ASP HB3 1 1 10 6967 1 1 17 ASP N N -4.335 -7.491 1.212 1.00 . A A . 17 ASP N 1 1 10 6968 1 1 17 ASP O O -2.776 -5.192 0.588 1.00 . A A . 17 ASP O 1 1 10 6969 1 1 17 ASP OD1 O -2.910 -9.122 4.452 1.00 . A A . 17 ASP OD1 1 1 10 6970 1 1 17 ASP OD2 O -3.056 -10.062 2.472 1.00 . A A . 17 ASP OD2 1 1 10 6971 1 1 18 TRP C C -0.892 -3.105 3.197 1.00 . A A . 18 TRP C 1 1 10 6972 1 1 18 TRP CA C -2.310 -3.284 2.680 1.00 . A A . 18 TRP CA 1 1 10 6973 1 1 18 TRP CB C -3.249 -2.406 3.521 1.00 . A A . 18 TRP CB 1 1 10 6974 1 1 18 TRP CD1 C -5.489 -3.514 2.888 1.00 . A A . 18 TRP CD1 1 1 10 6975 1 1 18 TRP CD2 C -5.544 -1.284 2.952 1.00 . A A . 18 TRP CD2 1 1 10 6976 1 1 18 TRP CE2 C -6.821 -1.758 2.598 1.00 . A A . 18 TRP CE2 1 1 10 6977 1 1 18 TRP CE3 C -5.332 0.087 3.059 1.00 . A A . 18 TRP CE3 1 1 10 6978 1 1 18 TRP CG C -4.702 -2.422 3.114 1.00 . A A . 18 TRP CG 1 1 10 6979 1 1 18 TRP CH2 C -7.655 0.452 2.481 1.00 . A A . 18 TRP CH2 1 1 10 6980 1 1 18 TRP CZ2 C -7.892 -0.897 2.360 1.00 . A A . 18 TRP CZ2 1 1 10 6981 1 1 18 TRP CZ3 C -6.388 0.940 2.833 1.00 . A A . 18 TRP CZ3 1 1 10 6982 1 1 18 TRP H H -2.783 -5.049 3.709 1.00 . A A . 18 TRP H 1 1 10 6983 1 1 18 TRP HA H -2.391 -2.991 1.644 1.00 . A A . 18 TRP HA 1 1 10 6984 1 1 18 TRP HB2 H -3.191 -2.726 4.551 1.00 . A A . 18 TRP HB2 1 1 10 6985 1 1 18 TRP HB3 H -2.902 -1.385 3.468 1.00 . A A . 18 TRP HB3 1 1 10 6986 1 1 18 TRP HD1 H -5.136 -4.535 2.938 1.00 . A A . 18 TRP HD1 1 1 10 6987 1 1 18 TRP HE1 H -7.465 -3.766 2.324 1.00 . A A . 18 TRP HE1 1 1 10 6988 1 1 18 TRP HE3 H -4.360 0.477 3.327 1.00 . A A . 18 TRP HE3 1 1 10 6989 1 1 18 TRP HH2 H -8.454 1.163 2.310 1.00 . A A . 18 TRP HH2 1 1 10 6990 1 1 18 TRP HZ2 H -8.879 -1.250 2.092 1.00 . A A . 18 TRP HZ2 1 1 10 6991 1 1 18 TRP HZ3 H -6.235 2.008 2.914 1.00 . A A . 18 TRP HZ3 1 1 10 6992 1 1 18 TRP N N -2.707 -4.684 2.800 1.00 . A A . 18 TRP N 1 1 10 6993 1 1 18 TRP NE1 N -6.752 -3.124 2.544 1.00 . A A . 18 TRP NE1 1 1 10 6994 1 1 18 TRP O O -0.388 -3.945 3.943 1.00 . A A . 18 TRP O 1 1 10 6995 1 1 19 VAL C C 1.176 -0.383 3.935 1.00 . A A . 19 VAL C 1 1 10 6996 1 1 19 VAL CA C 1.105 -1.751 3.245 1.00 . A A . 19 VAL CA 1 1 10 6997 1 1 19 VAL CB C 2.140 -1.782 2.064 1.00 . A A . 19 VAL CB 1 1 10 6998 1 1 19 VAL CG1 C 2.308 -3.171 1.502 1.00 . A A . 19 VAL CG1 1 1 10 6999 1 1 19 VAL CG2 C 1.739 -0.822 0.950 1.00 . A A . 19 VAL CG2 1 1 10 7000 1 1 19 VAL H H -0.588 -1.263 2.297 1.00 . A A . 19 VAL H 1 1 10 7001 1 1 19 VAL HA H 1.373 -2.515 3.959 1.00 . A A . 19 VAL HA 1 1 10 7002 1 1 19 VAL HB H 3.098 -1.465 2.447 1.00 . A A . 19 VAL HB 1 1 10 7003 1 1 19 VAL HG11 H 3.045 -3.096 0.712 1.00 . A A . 19 VAL HG11 1 1 10 7004 1 1 19 VAL HG12 H 1.359 -3.516 1.113 1.00 . A A . 19 VAL HG12 1 1 10 7005 1 1 19 VAL HG13 H 2.667 -3.834 2.275 1.00 . A A . 19 VAL HG13 1 1 10 7006 1 1 19 VAL HG21 H 0.770 -1.100 0.566 1.00 . A A . 19 VAL HG21 1 1 10 7007 1 1 19 VAL HG22 H 2.479 -0.856 0.167 1.00 . A A . 19 VAL HG22 1 1 10 7008 1 1 19 VAL HG23 H 1.709 0.176 1.361 1.00 . A A . 19 VAL HG23 1 1 10 7009 1 1 19 VAL N N -0.243 -2.024 2.815 1.00 . A A . 19 VAL N 1 1 10 7010 1 1 19 VAL O O 0.552 0.575 3.492 1.00 . A A . 19 VAL O 1 1 10 7011 1 1 20 GLN C C 3.547 1.384 5.453 1.00 . A A . 20 GLN C 1 1 10 7012 1 1 20 GLN CA C 2.120 0.917 5.747 1.00 . A A . 20 GLN CA 1 1 10 7013 1 1 20 GLN CB C 1.915 0.695 7.258 1.00 . A A . 20 GLN CB 1 1 10 7014 1 1 20 GLN CD C 1.879 1.704 9.592 1.00 . A A . 20 GLN CD 1 1 10 7015 1 1 20 GLN CG C 2.122 1.941 8.111 1.00 . A A . 20 GLN CG 1 1 10 7016 1 1 20 GLN H H 2.256 -1.169 5.354 1.00 . A A . 20 GLN H 1 1 10 7017 1 1 20 GLN HA H 1.430 1.667 5.390 1.00 . A A . 20 GLN HA 1 1 10 7018 1 1 20 GLN HB2 H 0.907 0.347 7.421 1.00 . A A . 20 GLN HB2 1 1 10 7019 1 1 20 GLN HB3 H 2.592 -0.069 7.605 1.00 . A A . 20 GLN HB3 1 1 10 7020 1 1 20 GLN HE21 H 3.213 3.092 10.080 1.00 . A A . 20 GLN HE21 1 1 10 7021 1 1 20 GLN HE22 H 2.433 2.316 11.386 1.00 . A A . 20 GLN HE22 1 1 10 7022 1 1 20 GLN HG2 H 3.141 2.277 7.993 1.00 . A A . 20 GLN HG2 1 1 10 7023 1 1 20 GLN HG3 H 1.455 2.719 7.768 1.00 . A A . 20 GLN HG3 1 1 10 7024 1 1 20 GLN N N 1.884 -0.326 5.022 1.00 . A A . 20 GLN N 1 1 10 7025 1 1 20 GLN NE2 N 2.573 2.437 10.428 1.00 . A A . 20 GLN NE2 1 1 10 7026 1 1 20 GLN O O 4.450 0.562 5.363 1.00 . A A . 20 GLN O 1 1 10 7027 1 1 20 GLN OE1 O 1.067 0.862 9.979 1.00 . A A . 20 GLN OE1 1 1 10 7028 1 1 21 CYS C C 5.791 3.523 6.285 1.00 . A A . 21 CYS C 1 1 10 7029 1 1 21 CYS CA C 5.105 3.139 4.989 1.00 . A A . 21 CYS CA 1 1 10 7030 1 1 21 CYS CB C 5.191 4.266 3.917 1.00 . A A . 21 CYS CB 1 1 10 7031 1 1 21 CYS H H 2.992 3.298 5.282 1.00 . A A . 21 CYS H 1 1 10 7032 1 1 21 CYS HA H 5.635 2.269 4.624 1.00 . A A . 21 CYS HA 1 1 10 7033 1 1 21 CYS HB2 H 6.206 4.504 3.638 1.00 . A A . 21 CYS HB2 1 1 10 7034 1 1 21 CYS HB3 H 4.672 3.904 3.042 1.00 . A A . 21 CYS HB3 1 1 10 7035 1 1 21 CYS N N 3.754 2.676 5.242 1.00 . A A . 21 CYS N 1 1 10 7036 1 1 21 CYS O O 5.555 4.600 6.852 1.00 . A A . 21 CYS O 1 1 10 7037 1 1 21 CYS SG S 4.434 5.836 4.358 1.00 . A A . 21 CYS SG 1 1 10 7038 1 1 22 ASP C C 8.604 3.717 7.850 1.00 . A A . 22 ASP C 1 1 10 7039 1 1 22 ASP CA C 7.382 2.810 8.010 1.00 . A A . 22 ASP CA 1 1 10 7040 1 1 22 ASP CB C 7.819 1.431 8.557 1.00 . A A . 22 ASP CB 1 1 10 7041 1 1 22 ASP CG C 6.655 0.541 9.003 1.00 . A A . 22 ASP CG 1 1 10 7042 1 1 22 ASP H H 6.834 1.878 6.154 1.00 . A A . 22 ASP H 1 1 10 7043 1 1 22 ASP HA H 6.712 3.268 8.722 1.00 . A A . 22 ASP HA 1 1 10 7044 1 1 22 ASP HB2 H 8.380 0.915 7.794 1.00 . A A . 22 ASP HB2 1 1 10 7045 1 1 22 ASP HB3 H 8.470 1.590 9.405 1.00 . A A . 22 ASP HB3 1 1 10 7046 1 1 22 ASP N N 6.658 2.657 6.728 1.00 . A A . 22 ASP N 1 1 10 7047 1 1 22 ASP O O 9.502 3.730 8.678 1.00 . A A . 22 ASP O 1 1 10 7048 1 1 22 ASP OD1 O 5.959 -0.038 8.144 1.00 . A A . 22 ASP OD1 1 1 10 7049 1 1 22 ASP OD2 O 6.434 0.411 10.241 1.00 . A A . 22 ASP OD2 1 1 10 7050 1 1 23 GLY C C 9.470 6.784 7.161 1.00 . A A . 23 GLY C 1 1 10 7051 1 1 23 GLY CA C 9.689 5.415 6.545 1.00 . A A . 23 GLY CA 1 1 10 7052 1 1 23 GLY H H 7.787 4.556 6.249 1.00 . A A . 23 GLY H 1 1 10 7053 1 1 23 GLY HA2 H 10.595 4.981 6.946 1.00 . A A . 23 GLY HA2 1 1 10 7054 1 1 23 GLY HA3 H 9.807 5.526 5.475 1.00 . A A . 23 GLY HA3 1 1 10 7055 1 1 23 GLY N N 8.588 4.534 6.806 1.00 . A A . 23 GLY N 1 1 10 7056 1 1 23 GLY O O 10.372 7.605 7.161 1.00 . A A . 23 GLY O 1 1 10 7057 1 1 24 GLY C C 6.570 8.820 8.267 1.00 . A A . 24 GLY C 1 1 10 7058 1 1 24 GLY CA C 8.030 8.331 8.298 1.00 . A A . 24 GLY CA 1 1 10 7059 1 1 24 GLY H H 7.551 6.367 7.699 1.00 . A A . 24 GLY H 1 1 10 7060 1 1 24 GLY HA2 H 8.347 8.288 9.329 1.00 . A A . 24 GLY HA2 1 1 10 7061 1 1 24 GLY HA3 H 8.641 9.049 7.769 1.00 . A A . 24 GLY HA3 1 1 10 7062 1 1 24 GLY N N 8.265 7.036 7.692 1.00 . A A . 24 GLY N 1 1 10 7063 1 1 24 GLY O O 6.184 9.637 9.105 1.00 . A A . 24 GLY O 1 1 10 7064 1 1 25 CYS C C 3.443 7.976 8.098 1.00 . A A . 25 CYS C 1 1 10 7065 1 1 25 CYS CA C 4.359 8.849 7.251 1.00 . A A . 25 CYS CA 1 1 10 7066 1 1 25 CYS CB C 3.822 8.841 5.816 1.00 . A A . 25 CYS CB 1 1 10 7067 1 1 25 CYS H H 6.044 7.623 6.730 1.00 . A A . 25 CYS H 1 1 10 7068 1 1 25 CYS HA H 4.366 9.860 7.626 1.00 . A A . 25 CYS HA 1 1 10 7069 1 1 25 CYS HB2 H 3.559 7.829 5.549 1.00 . A A . 25 CYS HB2 1 1 10 7070 1 1 25 CYS HB3 H 2.938 9.458 5.777 1.00 . A A . 25 CYS HB3 1 1 10 7071 1 1 25 CYS N N 5.742 8.331 7.327 1.00 . A A . 25 CYS N 1 1 10 7072 1 1 25 CYS O O 2.445 8.439 8.624 1.00 . A A . 25 CYS O 1 1 10 7073 1 1 25 CYS SG S 4.971 9.444 4.568 1.00 . A A . 25 CYS SG 1 1 10 7074 1 1 26 ASP C C 1.611 5.520 8.357 1.00 . A A . 26 ASP C 1 1 10 7075 1 1 26 ASP CA C 3.034 5.662 8.926 1.00 . A A . 26 ASP CA 1 1 10 7076 1 1 26 ASP CB C 3.012 5.924 10.454 1.00 . A A . 26 ASP CB 1 1 10 7077 1 1 26 ASP CG C 4.403 5.823 11.081 1.00 . A A . 26 ASP CG 1 1 10 7078 1 1 26 ASP H H 4.688 6.438 7.844 1.00 . A A . 26 ASP H 1 1 10 7079 1 1 26 ASP HA H 3.532 4.719 8.739 1.00 . A A . 26 ASP HA 1 1 10 7080 1 1 26 ASP HB2 H 2.585 6.889 10.665 1.00 . A A . 26 ASP HB2 1 1 10 7081 1 1 26 ASP HB3 H 2.378 5.178 10.912 1.00 . A A . 26 ASP HB3 1 1 10 7082 1 1 26 ASP N N 3.817 6.692 8.206 1.00 . A A . 26 ASP N 1 1 10 7083 1 1 26 ASP O O 0.695 5.055 9.030 1.00 . A A . 26 ASP O 1 1 10 7084 1 1 26 ASP OD1 O 4.805 4.698 11.469 1.00 . A A . 26 ASP OD1 1 1 10 7085 1 1 26 ASP OD2 O 5.105 6.854 11.177 1.00 . A A . 26 ASP OD2 1 1 10 7086 1 1 27 GLU C C -0.013 4.466 5.684 1.00 . A A . 27 GLU C 1 1 10 7087 1 1 27 GLU CA C 0.174 5.776 6.422 1.00 . A A . 27 GLU CA 1 1 10 7088 1 1 27 GLU CB C -0.083 6.974 5.521 1.00 . A A . 27 GLU CB 1 1 10 7089 1 1 27 GLU CD C -0.745 9.416 5.445 1.00 . A A . 27 GLU CD 1 1 10 7090 1 1 27 GLU CG C -0.203 8.284 6.292 1.00 . A A . 27 GLU CG 1 1 10 7091 1 1 27 GLU H H 2.246 6.145 6.586 1.00 . A A . 27 GLU H 1 1 10 7092 1 1 27 GLU HA H -0.571 5.780 7.203 1.00 . A A . 27 GLU HA 1 1 10 7093 1 1 27 GLU HB2 H 0.760 7.071 4.849 1.00 . A A . 27 GLU HB2 1 1 10 7094 1 1 27 GLU HB3 H -0.973 6.829 4.928 1.00 . A A . 27 GLU HB3 1 1 10 7095 1 1 27 GLU HG2 H -0.861 8.143 7.132 1.00 . A A . 27 GLU HG2 1 1 10 7096 1 1 27 GLU HG3 H 0.774 8.568 6.654 1.00 . A A . 27 GLU HG3 1 1 10 7097 1 1 27 GLU N N 1.459 5.857 7.086 1.00 . A A . 27 GLU N 1 1 10 7098 1 1 27 GLU O O 0.953 3.721 5.465 1.00 . A A . 27 GLU O 1 1 10 7099 1 1 27 GLU OE1 O 0.041 10.109 4.792 1.00 . A A . 27 GLU OE1 1 1 10 7100 1 1 27 GLU OE2 O -1.994 9.626 5.444 1.00 . A A . 27 GLU OE2 1 1 10 7101 1 1 28 TRP C C -1.916 3.103 3.157 1.00 . A A . 28 TRP C 1 1 10 7102 1 1 28 TRP CA C -1.632 2.942 4.643 1.00 . A A . 28 TRP CA 1 1 10 7103 1 1 28 TRP CB C -2.831 2.323 5.357 1.00 . A A . 28 TRP CB 1 1 10 7104 1 1 28 TRP CD1 C -2.472 2.656 7.868 1.00 . A A . 28 TRP CD1 1 1 10 7105 1 1 28 TRP CD2 C -2.236 0.546 7.168 1.00 . A A . 28 TRP CD2 1 1 10 7106 1 1 28 TRP CE2 C -2.009 0.583 8.553 1.00 . A A . 28 TRP CE2 1 1 10 7107 1 1 28 TRP CE3 C -2.148 -0.681 6.501 1.00 . A A . 28 TRP CE3 1 1 10 7108 1 1 28 TRP CG C -2.526 1.883 6.749 1.00 . A A . 28 TRP CG 1 1 10 7109 1 1 28 TRP CH2 C -1.614 -1.738 8.614 1.00 . A A . 28 TRP CH2 1 1 10 7110 1 1 28 TRP CZ2 C -1.686 -0.550 9.285 1.00 . A A . 28 TRP CZ2 1 1 10 7111 1 1 28 TRP CZ3 C -1.841 -1.809 7.228 1.00 . A A . 28 TRP CZ3 1 1 10 7112 1 1 28 TRP H H -1.906 4.927 5.394 1.00 . A A . 28 TRP H 1 1 10 7113 1 1 28 TRP HA H -0.793 2.273 4.737 1.00 . A A . 28 TRP HA 1 1 10 7114 1 1 28 TRP HB2 H -3.631 3.047 5.398 1.00 . A A . 28 TRP HB2 1 1 10 7115 1 1 28 TRP HB3 H -3.161 1.459 4.799 1.00 . A A . 28 TRP HB3 1 1 10 7116 1 1 28 TRP HD1 H -2.646 3.723 7.883 1.00 . A A . 28 TRP HD1 1 1 10 7117 1 1 28 TRP HE1 H -2.039 2.214 9.867 1.00 . A A . 28 TRP HE1 1 1 10 7118 1 1 28 TRP HE3 H -2.319 -0.754 5.436 1.00 . A A . 28 TRP HE3 1 1 10 7119 1 1 28 TRP HH2 H -1.363 -2.647 9.143 1.00 . A A . 28 TRP HH2 1 1 10 7120 1 1 28 TRP HZ2 H -1.515 -0.515 10.351 1.00 . A A . 28 TRP HZ2 1 1 10 7121 1 1 28 TRP HZ3 H -1.777 -2.765 6.727 1.00 . A A . 28 TRP HZ3 1 1 10 7122 1 1 28 TRP N N -1.249 4.210 5.280 1.00 . A A . 28 TRP N 1 1 10 7123 1 1 28 TRP NE1 N -2.146 1.882 8.952 1.00 . A A . 28 TRP NE1 1 1 10 7124 1 1 28 TRP O O -2.683 3.986 2.746 1.00 . A A . 28 TRP O 1 1 10 7125 1 1 29 PHE C C -1.873 0.869 0.439 1.00 . A A . 29 PHE C 1 1 10 7126 1 1 29 PHE CA C -1.372 2.249 0.913 1.00 . A A . 29 PHE CA 1 1 10 7127 1 1 29 PHE CB C 0.049 2.479 0.314 1.00 . A A . 29 PHE CB 1 1 10 7128 1 1 29 PHE CD1 C 1.278 3.680 2.151 1.00 . A A . 29 PHE CD1 1 1 10 7129 1 1 29 PHE CD2 C 1.055 4.807 0.073 1.00 . A A . 29 PHE CD2 1 1 10 7130 1 1 29 PHE CE1 C 1.949 4.740 2.657 1.00 . A A . 29 PHE CE1 1 1 10 7131 1 1 29 PHE CE2 C 1.736 5.885 0.588 1.00 . A A . 29 PHE CE2 1 1 10 7132 1 1 29 PHE CG C 0.814 3.682 0.855 1.00 . A A . 29 PHE CG 1 1 10 7133 1 1 29 PHE CZ C 2.184 5.848 1.887 1.00 . A A . 29 PHE CZ 1 1 10 7134 1 1 29 PHE H H -0.685 1.577 2.786 1.00 . A A . 29 PHE H 1 1 10 7135 1 1 29 PHE HA H -2.026 3.035 0.572 1.00 . A A . 29 PHE HA 1 1 10 7136 1 1 29 PHE HB2 H 0.657 1.607 0.493 1.00 . A A . 29 PHE HB2 1 1 10 7137 1 1 29 PHE HB3 H -0.066 2.606 -0.751 1.00 . A A . 29 PHE HB3 1 1 10 7138 1 1 29 PHE HD1 H 1.097 2.817 2.774 1.00 . A A . 29 PHE HD1 1 1 10 7139 1 1 29 PHE HD2 H 0.704 4.842 -0.946 1.00 . A A . 29 PHE HD2 1 1 10 7140 1 1 29 PHE HE1 H 2.303 4.713 3.677 1.00 . A A . 29 PHE HE1 1 1 10 7141 1 1 29 PHE HE2 H 1.916 6.759 -0.023 1.00 . A A . 29 PHE HE2 1 1 10 7142 1 1 29 PHE HZ H 2.717 6.680 2.326 1.00 . A A . 29 PHE HZ 1 1 10 7143 1 1 29 PHE N N -1.282 2.243 2.371 1.00 . A A . 29 PHE N 1 1 10 7144 1 1 29 PHE O O -1.748 -0.139 1.152 1.00 . A A . 29 PHE O 1 1 10 7145 1 1 30 HIS C C -1.771 -0.930 -2.251 1.00 . A A . 30 HIS C 1 1 10 7146 1 1 30 HIS CA C -2.871 -0.452 -1.361 1.00 . A A . 30 HIS CA 1 1 10 7147 1 1 30 HIS CB C -4.131 -0.314 -2.250 1.00 . A A . 30 HIS CB 1 1 10 7148 1 1 30 HIS CD2 C -6.317 -0.994 -1.084 1.00 . A A . 30 HIS CD2 1 1 10 7149 1 1 30 HIS CE1 C -7.233 0.986 -0.953 1.00 . A A . 30 HIS CE1 1 1 10 7150 1 1 30 HIS CG C -5.434 -0.106 -1.585 1.00 . A A . 30 HIS CG 1 1 10 7151 1 1 30 HIS H H -2.551 1.685 -1.203 1.00 . A A . 30 HIS H 1 1 10 7152 1 1 30 HIS HA H -3.056 -1.175 -0.578 1.00 . A A . 30 HIS HA 1 1 10 7153 1 1 30 HIS HB2 H -3.974 0.594 -2.815 1.00 . A A . 30 HIS HB2 1 1 10 7154 1 1 30 HIS HB3 H -4.229 -1.088 -2.993 1.00 . A A . 30 HIS HB3 1 1 10 7155 1 1 30 HIS HD2 H -6.169 -2.061 -0.998 1.00 . A A . 30 HIS HD2 1 1 10 7156 1 1 30 HIS HE1 H -7.934 1.780 -0.759 1.00 . A A . 30 HIS HE1 1 1 10 7157 1 1 30 HIS HE2 H -8.317 -0.709 -0.600 1.00 . A A . 30 HIS HE2 1 1 10 7158 1 1 30 HIS N N -2.452 0.825 -0.746 1.00 . A A . 30 HIS N 1 1 10 7159 1 1 30 HIS ND1 N -6.025 1.128 -1.492 1.00 . A A . 30 HIS ND1 1 1 10 7160 1 1 30 HIS NE2 N -7.429 -0.292 -0.709 1.00 . A A . 30 HIS NE2 1 1 10 7161 1 1 30 HIS O O -1.174 -0.130 -2.956 1.00 . A A . 30 HIS O 1 1 10 7162 1 1 31 GLN C C -0.656 -2.488 -4.581 1.00 . A A . 31 GLN C 1 1 10 7163 1 1 31 GLN CA C -0.480 -2.794 -3.088 1.00 . A A . 31 GLN CA 1 1 10 7164 1 1 31 GLN CB C -0.271 -4.281 -2.843 1.00 . A A . 31 GLN CB 1 1 10 7165 1 1 31 GLN CD C 0.449 -6.084 -1.248 1.00 . A A . 31 GLN CD 1 1 10 7166 1 1 31 GLN CG C 0.301 -4.605 -1.480 1.00 . A A . 31 GLN CG 1 1 10 7167 1 1 31 GLN H H -2.093 -2.779 -1.673 1.00 . A A . 31 GLN H 1 1 10 7168 1 1 31 GLN HA H 0.403 -2.269 -2.760 1.00 . A A . 31 GLN HA 1 1 10 7169 1 1 31 GLN HB2 H -1.199 -4.817 -2.972 1.00 . A A . 31 GLN HB2 1 1 10 7170 1 1 31 GLN HB3 H 0.438 -4.616 -3.586 1.00 . A A . 31 GLN HB3 1 1 10 7171 1 1 31 GLN HE21 H -1.296 -6.135 -0.381 1.00 . A A . 31 GLN HE21 1 1 10 7172 1 1 31 GLN HE22 H -0.486 -7.645 -0.485 1.00 . A A . 31 GLN HE22 1 1 10 7173 1 1 31 GLN HG2 H 1.278 -4.149 -1.409 1.00 . A A . 31 GLN HG2 1 1 10 7174 1 1 31 GLN HG3 H -0.329 -4.183 -0.713 1.00 . A A . 31 GLN HG3 1 1 10 7175 1 1 31 GLN N N -1.536 -2.225 -2.260 1.00 . A A . 31 GLN N 1 1 10 7176 1 1 31 GLN NE2 N -0.534 -6.684 -0.653 1.00 . A A . 31 GLN NE2 1 1 10 7177 1 1 31 GLN O O 0.264 -2.107 -5.227 1.00 . A A . 31 GLN O 1 1 10 7178 1 1 31 GLN OE1 O 1.457 -6.664 -1.574 1.00 . A A . 31 GLN OE1 1 1 10 7179 1 1 32 VAL C C -2.021 -0.803 -6.799 1.00 . A A . 32 VAL C 1 1 10 7180 1 1 32 VAL CA C -2.019 -2.326 -6.529 1.00 . A A . 32 VAL CA 1 1 10 7181 1 1 32 VAL CB C -3.321 -2.959 -7.080 1.00 . A A . 32 VAL CB 1 1 10 7182 1 1 32 VAL CG1 C -4.507 -2.399 -6.352 1.00 . A A . 32 VAL CG1 1 1 10 7183 1 1 32 VAL CG2 C -3.454 -2.694 -8.553 1.00 . A A . 32 VAL CG2 1 1 10 7184 1 1 32 VAL H H -2.609 -2.902 -4.572 1.00 . A A . 32 VAL H 1 1 10 7185 1 1 32 VAL HA H -1.176 -2.764 -7.044 1.00 . A A . 32 VAL HA 1 1 10 7186 1 1 32 VAL HB H -3.282 -4.028 -6.921 1.00 . A A . 32 VAL HB 1 1 10 7187 1 1 32 VAL HG11 H -5.427 -2.795 -6.755 1.00 . A A . 32 VAL HG11 1 1 10 7188 1 1 32 VAL HG12 H -4.438 -1.331 -6.509 1.00 . A A . 32 VAL HG12 1 1 10 7189 1 1 32 VAL HG13 H -4.393 -2.619 -5.301 1.00 . A A . 32 VAL HG13 1 1 10 7190 1 1 32 VAL HG21 H -4.398 -3.062 -8.928 1.00 . A A . 32 VAL HG21 1 1 10 7191 1 1 32 VAL HG22 H -2.619 -3.133 -9.077 1.00 . A A . 32 VAL HG22 1 1 10 7192 1 1 32 VAL HG23 H -3.416 -1.615 -8.631 1.00 . A A . 32 VAL HG23 1 1 10 7193 1 1 32 VAL N N -1.844 -2.612 -5.107 1.00 . A A . 32 VAL N 1 1 10 7194 1 1 32 VAL O O -1.470 -0.331 -7.781 1.00 . A A . 32 VAL O 1 1 10 7195 1 1 33 CYS C C -1.480 2.144 -5.981 1.00 . A A . 33 CYS C 1 1 10 7196 1 1 33 CYS CA C -2.812 1.373 -6.083 1.00 . A A . 33 CYS CA 1 1 10 7197 1 1 33 CYS CB C -3.908 1.947 -5.138 1.00 . A A . 33 CYS CB 1 1 10 7198 1 1 33 CYS H H -2.934 -0.571 -5.124 1.00 . A A . 33 CYS H 1 1 10 7199 1 1 33 CYS HA H -3.140 1.521 -7.103 1.00 . A A . 33 CYS HA 1 1 10 7200 1 1 33 CYS HB2 H -4.410 2.769 -5.598 1.00 . A A . 33 CYS HB2 1 1 10 7201 1 1 33 CYS HB3 H -4.665 1.186 -5.031 1.00 . A A . 33 CYS HB3 1 1 10 7202 1 1 33 CYS N N -2.624 -0.061 -5.890 1.00 . A A . 33 CYS N 1 1 10 7203 1 1 33 CYS O O -1.281 3.142 -6.669 1.00 . A A . 33 CYS O 1 1 10 7204 1 1 33 CYS SG S -3.383 2.414 -3.481 1.00 . A A . 33 CYS SG 1 1 10 7205 1 1 34 VAL C C 1.820 1.492 -5.702 1.00 . A A . 34 VAL C 1 1 10 7206 1 1 34 VAL CA C 0.699 2.325 -5.013 1.00 . A A . 34 VAL CA 1 1 10 7207 1 1 34 VAL CB C 1.037 2.557 -3.531 1.00 . A A . 34 VAL CB 1 1 10 7208 1 1 34 VAL CG1 C 1.677 1.365 -2.858 1.00 . A A . 34 VAL CG1 1 1 10 7209 1 1 34 VAL CG2 C 1.775 3.836 -3.352 1.00 . A A . 34 VAL CG2 1 1 10 7210 1 1 34 VAL H H -0.698 0.921 -4.531 1.00 . A A . 34 VAL H 1 1 10 7211 1 1 34 VAL HA H 0.618 3.282 -5.508 1.00 . A A . 34 VAL HA 1 1 10 7212 1 1 34 VAL HB H 0.124 2.621 -2.965 1.00 . A A . 34 VAL HB 1 1 10 7213 1 1 34 VAL HG11 H 2.629 1.198 -3.335 1.00 . A A . 34 VAL HG11 1 1 10 7214 1 1 34 VAL HG12 H 1.076 0.478 -3.003 1.00 . A A . 34 VAL HG12 1 1 10 7215 1 1 34 VAL HG13 H 1.834 1.555 -1.807 1.00 . A A . 34 VAL HG13 1 1 10 7216 1 1 34 VAL HG21 H 1.120 4.632 -3.670 1.00 . A A . 34 VAL HG21 1 1 10 7217 1 1 34 VAL HG22 H 2.652 3.803 -3.978 1.00 . A A . 34 VAL HG22 1 1 10 7218 1 1 34 VAL HG23 H 2.055 3.933 -2.315 1.00 . A A . 34 VAL HG23 1 1 10 7219 1 1 34 VAL N N -0.567 1.675 -5.140 1.00 . A A . 34 VAL N 1 1 10 7220 1 1 34 VAL O O 3.018 1.799 -5.573 1.00 . A A . 34 VAL O 1 1 10 7221 1 1 35 GLY C C 3.349 -1.157 -6.288 1.00 . A A . 35 GLY C 1 1 10 7222 1 1 35 GLY CA C 2.337 -0.390 -7.176 1.00 . A A . 35 GLY CA 1 1 10 7223 1 1 35 GLY H H 0.427 0.491 -6.654 1.00 . A A . 35 GLY H 1 1 10 7224 1 1 35 GLY HA2 H 1.755 -1.122 -7.717 1.00 . A A . 35 GLY HA2 1 1 10 7225 1 1 35 GLY HA3 H 2.888 0.195 -7.901 1.00 . A A . 35 GLY HA3 1 1 10 7226 1 1 35 GLY N N 1.396 0.501 -6.482 1.00 . A A . 35 GLY N 1 1 10 7227 1 1 35 GLY O O 4.554 -0.935 -6.380 1.00 . A A . 35 GLY O 1 1 10 7228 1 1 36 VAL C C 3.358 -4.370 -5.093 1.00 . A A . 36 VAL C 1 1 10 7229 1 1 36 VAL CA C 3.645 -2.938 -4.640 1.00 . A A . 36 VAL CA 1 1 10 7230 1 1 36 VAL CB C 3.238 -2.783 -3.126 1.00 . A A . 36 VAL CB 1 1 10 7231 1 1 36 VAL CG1 C 3.908 -3.822 -2.214 1.00 . A A . 36 VAL CG1 1 1 10 7232 1 1 36 VAL CG2 C 3.527 -1.390 -2.635 1.00 . A A . 36 VAL CG2 1 1 10 7233 1 1 36 VAL H H 1.889 -2.210 -5.361 1.00 . A A . 36 VAL H 1 1 10 7234 1 1 36 VAL HA H 4.691 -2.694 -4.762 1.00 . A A . 36 VAL HA 1 1 10 7235 1 1 36 VAL HB H 2.171 -2.933 -3.075 1.00 . A A . 36 VAL HB 1 1 10 7236 1 1 36 VAL HG11 H 3.635 -3.681 -1.177 1.00 . A A . 36 VAL HG11 1 1 10 7237 1 1 36 VAL HG12 H 4.982 -3.848 -2.337 1.00 . A A . 36 VAL HG12 1 1 10 7238 1 1 36 VAL HG13 H 3.518 -4.779 -2.524 1.00 . A A . 36 VAL HG13 1 1 10 7239 1 1 36 VAL HG21 H 2.936 -0.682 -3.198 1.00 . A A . 36 VAL HG21 1 1 10 7240 1 1 36 VAL HG22 H 4.573 -1.161 -2.755 1.00 . A A . 36 VAL HG22 1 1 10 7241 1 1 36 VAL HG23 H 3.246 -1.304 -1.597 1.00 . A A . 36 VAL HG23 1 1 10 7242 1 1 36 VAL N N 2.853 -2.055 -5.468 1.00 . A A . 36 VAL N 1 1 10 7243 1 1 36 VAL O O 2.253 -4.656 -5.568 1.00 . A A . 36 VAL O 1 1 10 7244 1 1 37 SER C C 3.752 -7.355 -4.004 1.00 . A A . 37 SER C 1 1 10 7245 1 1 37 SER CA C 4.088 -6.621 -5.304 1.00 . A A . 37 SER CA 1 1 10 7246 1 1 37 SER CB C 5.339 -7.186 -5.968 1.00 . A A . 37 SER CB 1 1 10 7247 1 1 37 SER H H 5.237 -5.169 -4.648 1.00 . A A . 37 SER H 1 1 10 7248 1 1 37 SER HA H 3.250 -6.675 -5.990 1.00 . A A . 37 SER HA 1 1 10 7249 1 1 37 SER HB2 H 5.204 -8.251 -6.087 1.00 . A A . 37 SER HB2 1 1 10 7250 1 1 37 SER HB3 H 5.486 -6.719 -6.934 1.00 . A A . 37 SER HB3 1 1 10 7251 1 1 37 SER HG H 7.273 -7.203 -5.643 1.00 . A A . 37 SER HG 1 1 10 7252 1 1 37 SER N N 4.317 -5.260 -4.978 1.00 . A A . 37 SER N 1 1 10 7253 1 1 37 SER O O 4.276 -6.986 -2.934 1.00 . A A . 37 SER O 1 1 10 7254 1 1 37 SER OG O 6.480 -6.959 -5.151 1.00 . A A . 37 SER OG 1 1 10 7255 1 1 38 PRO C C 3.639 -9.694 -2.038 1.00 . A A . 38 PRO C 1 1 10 7256 1 1 38 PRO CA C 2.456 -9.138 -2.847 1.00 . A A . 38 PRO CA 1 1 10 7257 1 1 38 PRO CB C 1.612 -10.294 -3.430 1.00 . A A . 38 PRO CB 1 1 10 7258 1 1 38 PRO CD C 2.294 -8.953 -5.284 1.00 . A A . 38 PRO CD 1 1 10 7259 1 1 38 PRO CG C 1.998 -10.363 -4.873 1.00 . A A . 38 PRO CG 1 1 10 7260 1 1 38 PRO HA H 1.845 -8.514 -2.206 1.00 . A A . 38 PRO HA 1 1 10 7261 1 1 38 PRO HB2 H 1.850 -11.212 -2.917 1.00 . A A . 38 PRO HB2 1 1 10 7262 1 1 38 PRO HB3 H 0.562 -10.075 -3.317 1.00 . A A . 38 PRO HB3 1 1 10 7263 1 1 38 PRO HD2 H 2.986 -8.936 -6.114 1.00 . A A . 38 PRO HD2 1 1 10 7264 1 1 38 PRO HD3 H 1.396 -8.417 -5.548 1.00 . A A . 38 PRO HD3 1 1 10 7265 1 1 38 PRO HG2 H 2.893 -10.961 -4.965 1.00 . A A . 38 PRO HG2 1 1 10 7266 1 1 38 PRO HG3 H 1.197 -10.776 -5.470 1.00 . A A . 38 PRO HG3 1 1 10 7267 1 1 38 PRO N N 2.901 -8.398 -4.059 1.00 . A A . 38 PRO N 1 1 10 7268 1 1 38 PRO O O 3.565 -9.862 -0.837 1.00 . A A . 38 PRO O 1 1 10 7269 1 1 39 GLU C C 6.683 -9.447 -1.318 1.00 . A A . 39 GLU C 1 1 10 7270 1 1 39 GLU CA C 5.921 -10.493 -2.143 1.00 . A A . 39 GLU CA 1 1 10 7271 1 1 39 GLU CB C 6.798 -11.056 -3.243 1.00 . A A . 39 GLU CB 1 1 10 7272 1 1 39 GLU CD C 8.864 -12.240 -3.915 1.00 . A A . 39 GLU CD 1 1 10 7273 1 1 39 GLU CG C 8.094 -11.671 -2.771 1.00 . A A . 39 GLU CG 1 1 10 7274 1 1 39 GLU H H 4.729 -9.694 -3.672 1.00 . A A . 39 GLU H 1 1 10 7275 1 1 39 GLU HA H 5.636 -11.301 -1.487 1.00 . A A . 39 GLU HA 1 1 10 7276 1 1 39 GLU HB2 H 6.248 -11.817 -3.775 1.00 . A A . 39 GLU HB2 1 1 10 7277 1 1 39 GLU HB3 H 7.045 -10.261 -3.931 1.00 . A A . 39 GLU HB3 1 1 10 7278 1 1 39 GLU HG2 H 8.695 -10.905 -2.302 1.00 . A A . 39 GLU HG2 1 1 10 7279 1 1 39 GLU HG3 H 7.879 -12.452 -2.060 1.00 . A A . 39 GLU HG3 1 1 10 7280 1 1 39 GLU N N 4.721 -9.945 -2.727 1.00 . A A . 39 GLU N 1 1 10 7281 1 1 39 GLU O O 7.355 -9.785 -0.340 1.00 . A A . 39 GLU O 1 1 10 7282 1 1 39 GLU OE1 O 8.626 -13.418 -4.264 1.00 . A A . 39 GLU OE1 1 1 10 7283 1 1 39 GLU OE2 O 9.681 -11.521 -4.501 1.00 . A A . 39 GLU OE2 1 1 10 7284 1 1 40 MET C C 6.707 -6.900 0.348 1.00 . A A . 40 MET C 1 1 10 7285 1 1 40 MET CA C 7.287 -7.123 -1.020 1.00 . A A . 40 MET CA 1 1 10 7286 1 1 40 MET CB C 7.294 -5.799 -1.829 1.00 . A A . 40 MET CB 1 1 10 7287 1 1 40 MET CE C 7.139 -2.696 -2.878 1.00 . A A . 40 MET CE 1 1 10 7288 1 1 40 MET CG C 8.191 -4.722 -1.207 1.00 . A A . 40 MET CG 1 1 10 7289 1 1 40 MET H H 5.916 -7.931 -2.404 1.00 . A A . 40 MET H 1 1 10 7290 1 1 40 MET HA H 8.303 -7.474 -0.908 1.00 . A A . 40 MET HA 1 1 10 7291 1 1 40 MET HB2 H 7.432 -5.907 -2.891 1.00 . A A . 40 MET HB2 1 1 10 7292 1 1 40 MET HB3 H 6.282 -5.440 -1.709 1.00 . A A . 40 MET HB3 1 1 10 7293 1 1 40 MET HE1 H 6.609 -3.456 -3.436 1.00 . A A . 40 MET HE1 1 1 10 7294 1 1 40 MET HE2 H 7.329 -1.856 -3.533 1.00 . A A . 40 MET HE2 1 1 10 7295 1 1 40 MET HE3 H 6.568 -2.368 -2.021 1.00 . A A . 40 MET HE3 1 1 10 7296 1 1 40 MET HG2 H 7.611 -4.271 -0.417 1.00 . A A . 40 MET HG2 1 1 10 7297 1 1 40 MET HG3 H 9.071 -5.187 -0.793 1.00 . A A . 40 MET HG3 1 1 10 7298 1 1 40 MET N N 6.551 -8.168 -1.693 1.00 . A A . 40 MET N 1 1 10 7299 1 1 40 MET O O 7.430 -6.726 1.323 1.00 . A A . 40 MET O 1 1 10 7300 1 1 40 MET SD S 8.693 -3.395 -2.351 1.00 . A A . 40 MET SD 1 1 10 7301 1 1 41 ALA C C 5.015 -7.656 2.800 1.00 . A A . 41 ALA C 1 1 10 7302 1 1 41 ALA CA C 4.624 -6.722 1.608 1.00 . A A . 41 ALA CA 1 1 10 7303 1 1 41 ALA CB C 3.125 -6.812 1.273 1.00 . A A . 41 ALA CB 1 1 10 7304 1 1 41 ALA H H 4.902 -7.182 -0.415 1.00 . A A . 41 ALA H 1 1 10 7305 1 1 41 ALA HA H 4.832 -5.696 1.867 1.00 . A A . 41 ALA HA 1 1 10 7306 1 1 41 ALA HB1 H 2.893 -6.113 0.474 1.00 . A A . 41 ALA HB1 1 1 10 7307 1 1 41 ALA HB2 H 2.519 -6.585 2.137 1.00 . A A . 41 ALA HB2 1 1 10 7308 1 1 41 ALA HB3 H 2.883 -7.810 0.937 1.00 . A A . 41 ALA HB3 1 1 10 7309 1 1 41 ALA N N 5.395 -6.969 0.405 1.00 . A A . 41 ALA N 1 1 10 7310 1 1 41 ALA O O 4.911 -7.261 3.948 1.00 . A A . 41 ALA O 1 1 10 7311 1 1 42 GLU C C 7.374 -9.821 3.846 1.00 . A A . 42 GLU C 1 1 10 7312 1 1 42 GLU CA C 5.868 -9.834 3.563 1.00 . A A . 42 GLU CA 1 1 10 7313 1 1 42 GLU CB C 5.416 -11.281 3.292 1.00 . A A . 42 GLU CB 1 1 10 7314 1 1 42 GLU CD C 3.598 -12.964 3.274 1.00 . A A . 42 GLU CD 1 1 10 7315 1 1 42 GLU CG C 3.923 -11.501 3.268 1.00 . A A . 42 GLU CG 1 1 10 7316 1 1 42 GLU H H 5.487 -9.096 1.545 1.00 . A A . 42 GLU H 1 1 10 7317 1 1 42 GLU HA H 5.394 -9.503 4.476 1.00 . A A . 42 GLU HA 1 1 10 7318 1 1 42 GLU HB2 H 5.795 -11.638 2.345 1.00 . A A . 42 GLU HB2 1 1 10 7319 1 1 42 GLU HB3 H 5.806 -11.915 4.075 1.00 . A A . 42 GLU HB3 1 1 10 7320 1 1 42 GLU HG2 H 3.454 -11.033 4.121 1.00 . A A . 42 GLU HG2 1 1 10 7321 1 1 42 GLU HG3 H 3.530 -11.082 2.354 1.00 . A A . 42 GLU HG3 1 1 10 7322 1 1 42 GLU N N 5.461 -8.885 2.501 1.00 . A A . 42 GLU N 1 1 10 7323 1 1 42 GLU O O 7.838 -10.371 4.854 1.00 . A A . 42 GLU O 1 1 10 7324 1 1 42 GLU OE1 O 3.590 -13.579 4.377 1.00 . A A . 42 GLU OE1 1 1 10 7325 1 1 42 GLU OE2 O 3.386 -13.539 2.202 1.00 . A A . 42 GLU OE2 1 1 10 7326 1 1 43 ASN C C 10.333 -8.014 3.344 1.00 . A A . 43 ASN C 1 1 10 7327 1 1 43 ASN CA C 9.576 -9.315 3.103 1.00 . A A . 43 ASN CA 1 1 10 7328 1 1 43 ASN CB C 10.164 -10.071 1.915 1.00 . A A . 43 ASN CB 1 1 10 7329 1 1 43 ASN CG C 9.790 -11.544 1.895 1.00 . A A . 43 ASN CG 1 1 10 7330 1 1 43 ASN H H 7.751 -8.681 2.253 1.00 . A A . 43 ASN H 1 1 10 7331 1 1 43 ASN HA H 9.747 -9.940 3.967 1.00 . A A . 43 ASN HA 1 1 10 7332 1 1 43 ASN HB2 H 9.780 -9.606 1.017 1.00 . A A . 43 ASN HB2 1 1 10 7333 1 1 43 ASN HB3 H 11.230 -9.961 1.947 1.00 . A A . 43 ASN HB3 1 1 10 7334 1 1 43 ASN HD21 H 9.898 -11.572 -0.080 1.00 . A A . 43 ASN HD21 1 1 10 7335 1 1 43 ASN HD22 H 9.465 -13.066 0.684 1.00 . A A . 43 ASN HD22 1 1 10 7336 1 1 43 ASN N N 8.142 -9.209 2.978 1.00 . A A . 43 ASN N 1 1 10 7337 1 1 43 ASN ND2 N 9.717 -12.119 0.715 1.00 . A A . 43 ASN ND2 1 1 10 7338 1 1 43 ASN O O 11.331 -8.021 4.083 1.00 . A A . 43 ASN O 1 1 10 7339 1 1 43 ASN OD1 O 9.587 -12.168 2.935 1.00 . A A . 43 ASN OD1 1 1 10 7340 1 1 44 GLU C C 9.800 -4.492 3.249 1.00 . A A . 44 GLU C 1 1 10 7341 1 1 44 GLU CA C 10.682 -5.669 2.837 1.00 . A A . 44 GLU CA 1 1 10 7342 1 1 44 GLU CB C 11.394 -5.394 1.488 1.00 . A A . 44 GLU CB 1 1 10 7343 1 1 44 GLU CD C 13.081 -6.290 -0.205 1.00 . A A . 44 GLU CD 1 1 10 7344 1 1 44 GLU CG C 12.260 -6.567 1.023 1.00 . A A . 44 GLU CG 1 1 10 7345 1 1 44 GLU H H 9.029 -6.856 2.296 1.00 . A A . 44 GLU H 1 1 10 7346 1 1 44 GLU HA H 11.433 -5.823 3.600 1.00 . A A . 44 GLU HA 1 1 10 7347 1 1 44 GLU HB2 H 10.654 -5.201 0.725 1.00 . A A . 44 GLU HB2 1 1 10 7348 1 1 44 GLU HB3 H 12.029 -4.523 1.574 1.00 . A A . 44 GLU HB3 1 1 10 7349 1 1 44 GLU HG2 H 12.938 -6.843 1.818 1.00 . A A . 44 GLU HG2 1 1 10 7350 1 1 44 GLU HG3 H 11.611 -7.404 0.815 1.00 . A A . 44 GLU HG3 1 1 10 7351 1 1 44 GLU N N 9.899 -6.909 2.754 1.00 . A A . 44 GLU N 1 1 10 7352 1 1 44 GLU O O 8.593 -4.500 3.005 1.00 . A A . 44 GLU O 1 1 10 7353 1 1 44 GLU OE1 O 12.538 -6.313 -1.328 1.00 . A A . 44 GLU OE1 1 1 10 7354 1 1 44 GLU OE2 O 14.314 -6.097 -0.057 1.00 . A A . 44 GLU OE2 1 1 10 7355 1 1 45 ASP C C 9.207 -1.445 3.248 1.00 . A A . 45 ASP C 1 1 10 7356 1 1 45 ASP CA C 9.682 -2.325 4.391 1.00 . A A . 45 ASP CA 1 1 10 7357 1 1 45 ASP CB C 10.569 -1.473 5.312 1.00 . A A . 45 ASP CB 1 1 10 7358 1 1 45 ASP CG C 11.159 -2.232 6.475 1.00 . A A . 45 ASP CG 1 1 10 7359 1 1 45 ASP H H 11.382 -3.498 4.001 1.00 . A A . 45 ASP H 1 1 10 7360 1 1 45 ASP HA H 8.838 -2.688 4.956 1.00 . A A . 45 ASP HA 1 1 10 7361 1 1 45 ASP HB2 H 11.383 -1.047 4.745 1.00 . A A . 45 ASP HB2 1 1 10 7362 1 1 45 ASP HB3 H 9.958 -0.668 5.696 1.00 . A A . 45 ASP HB3 1 1 10 7363 1 1 45 ASP N N 10.410 -3.488 3.875 1.00 . A A . 45 ASP N 1 1 10 7364 1 1 45 ASP O O 10.008 -1.048 2.373 1.00 . A A . 45 ASP O 1 1 10 7365 1 1 45 ASP OD1 O 10.518 -2.311 7.520 1.00 . A A . 45 ASP OD1 1 1 10 7366 1 1 45 ASP OD2 O 12.306 -2.746 6.337 1.00 . A A . 45 ASP OD2 1 1 10 7367 1 1 46 TYR C C 7.757 1.210 2.452 1.00 . A A . 46 TYR C 1 1 10 7368 1 1 46 TYR CA C 7.424 -0.268 2.207 1.00 . A A . 46 TYR CA 1 1 10 7369 1 1 46 TYR CB C 5.932 -0.463 1.899 1.00 . A A . 46 TYR CB 1 1 10 7370 1 1 46 TYR CD1 C 6.052 0.327 -0.488 1.00 . A A . 46 TYR CD1 1 1 10 7371 1 1 46 TYR CD2 C 4.557 1.466 0.975 1.00 . A A . 46 TYR CD2 1 1 10 7372 1 1 46 TYR CE1 C 5.707 1.175 -1.516 1.00 . A A . 46 TYR CE1 1 1 10 7373 1 1 46 TYR CE2 C 4.213 2.333 -0.059 1.00 . A A . 46 TYR CE2 1 1 10 7374 1 1 46 TYR CG C 5.488 0.451 0.772 1.00 . A A . 46 TYR CG 1 1 10 7375 1 1 46 TYR CZ C 4.796 2.174 -1.296 1.00 . A A . 46 TYR CZ 1 1 10 7376 1 1 46 TYR H H 7.356 -1.585 3.890 1.00 . A A . 46 TYR H 1 1 10 7377 1 1 46 TYR HA H 7.980 -0.532 1.320 1.00 . A A . 46 TYR HA 1 1 10 7378 1 1 46 TYR HB2 H 5.721 -1.490 1.634 1.00 . A A . 46 TYR HB2 1 1 10 7379 1 1 46 TYR HB3 H 5.351 -0.197 2.770 1.00 . A A . 46 TYR HB3 1 1 10 7380 1 1 46 TYR HD1 H 6.766 -0.466 -0.653 1.00 . A A . 46 TYR HD1 1 1 10 7381 1 1 46 TYR HD2 H 4.120 1.561 1.959 1.00 . A A . 46 TYR HD2 1 1 10 7382 1 1 46 TYR HE1 H 6.159 1.062 -2.487 1.00 . A A . 46 TYR HE1 1 1 10 7383 1 1 46 TYR HE2 H 3.483 3.121 0.087 1.00 . A A . 46 TYR HE2 1 1 10 7384 1 1 46 TYR HH H 4.357 2.515 -3.127 1.00 . A A . 46 TYR HH 1 1 10 7385 1 1 46 TYR N N 7.925 -1.142 3.226 1.00 . A A . 46 TYR N 1 1 10 7386 1 1 46 TYR O O 7.256 1.846 3.375 1.00 . A A . 46 TYR O 1 1 10 7387 1 1 46 TYR OH O 4.487 3.036 -2.324 1.00 . A A . 46 TYR OH 1 1 10 7388 1 1 47 ILE C C 8.061 3.783 0.529 1.00 . A A . 47 ILE C 1 1 10 7389 1 1 47 ILE CA C 8.954 3.129 1.600 1.00 . A A . 47 ILE CA 1 1 10 7390 1 1 47 ILE CB C 10.458 3.330 1.233 1.00 . A A . 47 ILE CB 1 1 10 7391 1 1 47 ILE CD1 C 11.239 2.951 3.673 1.00 . A A . 47 ILE CD1 1 1 10 7392 1 1 47 ILE CG1 C 11.374 2.546 2.209 1.00 . A A . 47 ILE CG1 1 1 10 7393 1 1 47 ILE CG2 C 10.822 4.812 1.233 1.00 . A A . 47 ILE CG2 1 1 10 7394 1 1 47 ILE H H 8.989 1.049 1.019 1.00 . A A . 47 ILE H 1 1 10 7395 1 1 47 ILE HA H 8.747 3.547 2.577 1.00 . A A . 47 ILE HA 1 1 10 7396 1 1 47 ILE HB H 10.618 2.958 0.232 1.00 . A A . 47 ILE HB 1 1 10 7397 1 1 47 ILE HD11 H 11.940 2.403 4.286 1.00 . A A . 47 ILE HD11 1 1 10 7398 1 1 47 ILE HD12 H 10.234 2.740 4.007 1.00 . A A . 47 ILE HD12 1 1 10 7399 1 1 47 ILE HD13 H 11.411 4.012 3.767 1.00 . A A . 47 ILE HD13 1 1 10 7400 1 1 47 ILE HG12 H 11.132 1.494 2.159 1.00 . A A . 47 ILE HG12 1 1 10 7401 1 1 47 ILE HG13 H 12.398 2.686 1.903 1.00 . A A . 47 ILE HG13 1 1 10 7402 1 1 47 ILE HG21 H 10.586 5.188 2.220 1.00 . A A . 47 ILE HG21 1 1 10 7403 1 1 47 ILE HG22 H 10.265 5.344 0.474 1.00 . A A . 47 ILE HG22 1 1 10 7404 1 1 47 ILE HG23 H 11.878 4.941 1.047 1.00 . A A . 47 ILE HG23 1 1 10 7405 1 1 47 ILE N N 8.614 1.722 1.621 1.00 . A A . 47 ILE N 1 1 10 7406 1 1 47 ILE O O 7.930 3.240 -0.548 1.00 . A A . 47 ILE O 1 1 10 7407 1 1 48 CYS C C 7.225 6.625 -0.929 1.00 . A A . 48 CYS C 1 1 10 7408 1 1 48 CYS CA C 6.526 5.498 -0.167 1.00 . A A . 48 CYS CA 1 1 10 7409 1 1 48 CYS CB C 5.311 6.103 0.540 1.00 . A A . 48 CYS CB 1 1 10 7410 1 1 48 CYS H H 7.610 5.501 1.579 1.00 . A A . 48 CYS H 1 1 10 7411 1 1 48 CYS HA H 6.202 4.720 -0.842 1.00 . A A . 48 CYS HA 1 1 10 7412 1 1 48 CYS HB2 H 4.522 6.235 -0.188 1.00 . A A . 48 CYS HB2 1 1 10 7413 1 1 48 CYS HB3 H 4.978 5.414 1.303 1.00 . A A . 48 CYS HB3 1 1 10 7414 1 1 48 CYS N N 7.453 4.932 0.802 1.00 . A A . 48 CYS N 1 1 10 7415 1 1 48 CYS O O 8.371 6.953 -0.635 1.00 . A A . 48 CYS O 1 1 10 7416 1 1 48 CYS SG S 5.627 7.719 1.322 1.00 . A A . 48 CYS SG 1 1 10 7417 1 1 49 ILE C C 7.497 9.527 -1.735 1.00 . A A . 49 ILE C 1 1 10 7418 1 1 49 ILE CA C 6.974 8.368 -2.631 1.00 . A A . 49 ILE CA 1 1 10 7419 1 1 49 ILE CB C 5.854 8.866 -3.600 1.00 . A A . 49 ILE CB 1 1 10 7420 1 1 49 ILE CD1 C 5.360 10.559 -5.392 1.00 . A A . 49 ILE CD1 1 1 10 7421 1 1 49 ILE CG1 C 6.324 10.088 -4.357 1.00 . A A . 49 ILE CG1 1 1 10 7422 1 1 49 ILE CG2 C 4.551 9.155 -2.850 1.00 . A A . 49 ILE CG2 1 1 10 7423 1 1 49 ILE H H 5.601 6.888 -2.001 1.00 . A A . 49 ILE H 1 1 10 7424 1 1 49 ILE HA H 7.803 8.041 -3.242 1.00 . A A . 49 ILE HA 1 1 10 7425 1 1 49 ILE HB H 5.661 8.070 -4.312 1.00 . A A . 49 ILE HB 1 1 10 7426 1 1 49 ILE HD11 H 5.260 9.762 -6.114 1.00 . A A . 49 ILE HD11 1 1 10 7427 1 1 49 ILE HD12 H 5.715 11.453 -5.878 1.00 . A A . 49 ILE HD12 1 1 10 7428 1 1 49 ILE HD13 H 4.400 10.723 -4.929 1.00 . A A . 49 ILE HD13 1 1 10 7429 1 1 49 ILE HG12 H 6.470 10.874 -3.633 1.00 . A A . 49 ILE HG12 1 1 10 7430 1 1 49 ILE HG13 H 7.266 9.846 -4.819 1.00 . A A . 49 ILE HG13 1 1 10 7431 1 1 49 ILE HG21 H 4.723 9.900 -2.090 1.00 . A A . 49 ILE HG21 1 1 10 7432 1 1 49 ILE HG22 H 4.183 8.258 -2.381 1.00 . A A . 49 ILE HG22 1 1 10 7433 1 1 49 ILE HG23 H 3.806 9.529 -3.534 1.00 . A A . 49 ILE HG23 1 1 10 7434 1 1 49 ILE N N 6.500 7.240 -1.846 1.00 . A A . 49 ILE N 1 1 10 7435 1 1 49 ILE O O 8.564 10.085 -1.989 1.00 . A A . 49 ILE O 1 1 10 7436 1 1 50 ASN C C 8.264 10.516 1.170 1.00 . A A . 50 ASN C 1 1 10 7437 1 1 50 ASN CA C 7.129 10.922 0.246 1.00 . A A . 50 ASN CA 1 1 10 7438 1 1 50 ASN CB C 5.919 11.384 1.083 1.00 . A A . 50 ASN CB 1 1 10 7439 1 1 50 ASN CG C 4.782 11.896 0.226 1.00 . A A . 50 ASN CG 1 1 10 7440 1 1 50 ASN H H 5.969 9.297 -0.469 1.00 . A A . 50 ASN H 1 1 10 7441 1 1 50 ASN HA H 7.472 11.754 -0.353 1.00 . A A . 50 ASN HA 1 1 10 7442 1 1 50 ASN HB2 H 5.562 10.564 1.685 1.00 . A A . 50 ASN HB2 1 1 10 7443 1 1 50 ASN HB3 H 6.228 12.182 1.744 1.00 . A A . 50 ASN HB3 1 1 10 7444 1 1 50 ASN HD21 H 5.483 13.742 0.328 1.00 . A A . 50 ASN HD21 1 1 10 7445 1 1 50 ASN HD22 H 4.036 13.512 -0.593 1.00 . A A . 50 ASN HD22 1 1 10 7446 1 1 50 ASN N N 6.770 9.829 -0.661 1.00 . A A . 50 ASN N 1 1 10 7447 1 1 50 ASN ND2 N 4.770 13.177 -0.036 1.00 . A A . 50 ASN ND2 1 1 10 7448 1 1 50 ASN O O 9.035 11.347 1.606 1.00 . A A . 50 ASN O 1 1 10 7449 1 1 50 ASN OD1 O 3.924 11.136 -0.192 1.00 . A A . 50 ASN OD1 1 1 10 7450 1 1 51 CYS C C 10.748 8.618 1.533 1.00 . A A . 51 CYS C 1 1 10 7451 1 1 51 CYS CA C 9.430 8.708 2.311 1.00 . A A . 51 CYS CA 1 1 10 7452 1 1 51 CYS CB C 9.091 7.326 2.905 1.00 . A A . 51 CYS CB 1 1 10 7453 1 1 51 CYS H H 7.677 8.628 1.075 1.00 . A A . 51 CYS H 1 1 10 7454 1 1 51 CYS HA H 9.559 9.414 3.118 1.00 . A A . 51 CYS HA 1 1 10 7455 1 1 51 CYS HB2 H 8.707 6.699 2.116 1.00 . A A . 51 CYS HB2 1 1 10 7456 1 1 51 CYS HB3 H 10.023 6.891 3.239 1.00 . A A . 51 CYS HB3 1 1 10 7457 1 1 51 CYS N N 8.356 9.220 1.461 1.00 . A A . 51 CYS N 1 1 10 7458 1 1 51 CYS O O 11.823 8.685 2.106 1.00 . A A . 51 CYS O 1 1 10 7459 1 1 51 CYS SG S 7.892 7.263 4.271 1.00 . A A . 51 CYS SG 1 1 10 7460 1 1 52 ALA C C 12.394 9.707 -0.992 1.00 . A A . 52 ALA C 1 1 10 7461 1 1 52 ALA CA C 11.836 8.333 -0.601 1.00 . A A . 52 ALA CA 1 1 10 7462 1 1 52 ALA CB C 11.529 7.497 -1.836 1.00 . A A . 52 ALA CB 1 1 10 7463 1 1 52 ALA H H 9.750 8.492 -0.169 1.00 . A A . 52 ALA H 1 1 10 7464 1 1 52 ALA HA H 12.562 7.796 -0.003 1.00 . A A . 52 ALA HA 1 1 10 7465 1 1 52 ALA HB1 H 11.177 6.530 -1.508 1.00 . A A . 52 ALA HB1 1 1 10 7466 1 1 52 ALA HB2 H 12.421 7.372 -2.433 1.00 . A A . 52 ALA HB2 1 1 10 7467 1 1 52 ALA HB3 H 10.769 7.980 -2.432 1.00 . A A . 52 ALA HB3 1 1 10 7468 1 1 52 ALA N N 10.651 8.469 0.226 1.00 . A A . 52 ALA N 1 1 10 7469 2 2 1 ZN ZN ZN 5.749 7.559 3.587 1.00 . B A . 53 ZN ZN 1 1 10 7470 3 2 1 ZN ZN ZN -5.180 2.853 -2.068 1.00 . C A . 54 ZN ZN 1 1 11 7471 1 1 1 SER C C -11.620 6.221 2.055 1.00 . A A . 1 SER C 1 1 11 7472 1 1 1 SER CA C -12.431 6.469 3.360 1.00 . A A . 1 SER CA 1 1 11 7473 1 1 1 SER CB C -13.864 6.986 3.058 1.00 . A A . 1 SER CB 1 1 11 7474 1 1 1 SER HA H -12.464 5.545 3.923 1.00 . A A . 1 SER HA 1 1 11 7475 1 1 1 SER HB2 H -14.322 7.294 3.985 1.00 . A A . 1 SER HB2 1 1 11 7476 1 1 1 SER HB3 H -13.804 7.838 2.397 1.00 . A A . 1 SER HB3 1 1 11 7477 1 1 1 SER HG H -15.414 5.851 3.072 1.00 . A A . 1 SER HG 1 1 11 7478 1 1 1 SER N N -11.710 7.491 4.169 1.00 . A A . 1 SER N 1 1 11 7479 1 1 1 SER O O -12.025 5.452 1.149 1.00 . A A . 1 SER O 1 1 11 7480 1 1 1 SER OG O -14.698 5.995 2.442 1.00 . A A . 1 SER OG 1 1 11 7481 1 1 2 VAL C C -8.157 6.590 1.508 1.00 . A A . 2 VAL C 1 1 11 7482 1 1 2 VAL CA C -9.537 6.784 0.881 1.00 . A A . 2 VAL CA 1 1 11 7483 1 1 2 VAL CB C -9.525 8.075 -0.010 1.00 . A A . 2 VAL CB 1 1 11 7484 1 1 2 VAL CG1 C -8.603 7.908 -1.216 1.00 . A A . 2 VAL CG1 1 1 11 7485 1 1 2 VAL CG2 C -10.934 8.451 -0.474 1.00 . A A . 2 VAL CG2 1 1 11 7486 1 1 2 VAL H H -10.243 7.503 2.714 1.00 . A A . 2 VAL H 1 1 11 7487 1 1 2 VAL HA H -9.788 5.918 0.284 1.00 . A A . 2 VAL HA 1 1 11 7488 1 1 2 VAL HB H -9.133 8.883 0.591 1.00 . A A . 2 VAL HB 1 1 11 7489 1 1 2 VAL HG11 H -7.599 7.704 -0.876 1.00 . A A . 2 VAL HG11 1 1 11 7490 1 1 2 VAL HG12 H -8.607 8.823 -1.788 1.00 . A A . 2 VAL HG12 1 1 11 7491 1 1 2 VAL HG13 H -8.949 7.094 -1.838 1.00 . A A . 2 VAL HG13 1 1 11 7492 1 1 2 VAL HG21 H -11.320 7.628 -1.057 1.00 . A A . 2 VAL HG21 1 1 11 7493 1 1 2 VAL HG22 H -10.893 9.342 -1.088 1.00 . A A . 2 VAL HG22 1 1 11 7494 1 1 2 VAL HG23 H -11.570 8.630 0.382 1.00 . A A . 2 VAL HG23 1 1 11 7495 1 1 2 VAL N N -10.478 6.900 1.976 1.00 . A A . 2 VAL N 1 1 11 7496 1 1 2 VAL O O -7.870 7.192 2.558 1.00 . A A . 2 VAL O 1 1 11 7497 1 1 3 CYS C C -4.998 6.542 0.974 1.00 . A A . 3 CYS C 1 1 11 7498 1 1 3 CYS CA C -6.008 5.486 1.512 1.00 . A A . 3 CYS CA 1 1 11 7499 1 1 3 CYS CB C -5.517 4.064 1.142 1.00 . A A . 3 CYS CB 1 1 11 7500 1 1 3 CYS H H -7.564 5.238 0.129 1.00 . A A . 3 CYS H 1 1 11 7501 1 1 3 CYS HA H -6.087 5.577 2.586 1.00 . A A . 3 CYS HA 1 1 11 7502 1 1 3 CYS HB2 H -4.964 3.653 1.976 1.00 . A A . 3 CYS HB2 1 1 11 7503 1 1 3 CYS HB3 H -6.368 3.433 0.924 1.00 . A A . 3 CYS HB3 1 1 11 7504 1 1 3 CYS N N -7.327 5.732 0.935 1.00 . A A . 3 CYS N 1 1 11 7505 1 1 3 CYS O O -5.386 7.480 0.272 1.00 . A A . 3 CYS O 1 1 11 7506 1 1 3 CYS SG S -4.397 4.006 -0.282 1.00 . A A . 3 CYS SG 1 1 11 7507 1 1 4 ALA C C -2.051 6.578 -0.419 1.00 . A A . 4 ALA C 1 1 11 7508 1 1 4 ALA CA C -2.696 7.234 0.800 1.00 . A A . 4 ALA CA 1 1 11 7509 1 1 4 ALA CB C -1.639 7.449 1.872 1.00 . A A . 4 ALA CB 1 1 11 7510 1 1 4 ALA H H -3.486 5.574 1.817 1.00 . A A . 4 ALA H 1 1 11 7511 1 1 4 ALA HA H -3.128 8.182 0.526 1.00 . A A . 4 ALA HA 1 1 11 7512 1 1 4 ALA HB1 H -0.845 8.071 1.482 1.00 . A A . 4 ALA HB1 1 1 11 7513 1 1 4 ALA HB2 H -1.221 6.493 2.160 1.00 . A A . 4 ALA HB2 1 1 11 7514 1 1 4 ALA HB3 H -2.077 7.925 2.738 1.00 . A A . 4 ALA HB3 1 1 11 7515 1 1 4 ALA N N -3.733 6.365 1.291 1.00 . A A . 4 ALA N 1 1 11 7516 1 1 4 ALA O O -1.669 5.434 -0.352 1.00 . A A . 4 ALA O 1 1 11 7517 1 1 5 ALA C C -1.383 7.932 -3.786 1.00 . A A . 5 ALA C 1 1 11 7518 1 1 5 ALA CA C -1.328 6.836 -2.752 1.00 . A A . 5 ALA CA 1 1 11 7519 1 1 5 ALA CB C -1.908 5.532 -3.361 1.00 . A A . 5 ALA CB 1 1 11 7520 1 1 5 ALA H H -2.611 8.065 -1.619 1.00 . A A . 5 ALA H 1 1 11 7521 1 1 5 ALA HA H -0.297 6.667 -2.475 1.00 . A A . 5 ALA HA 1 1 11 7522 1 1 5 ALA HB1 H -1.323 5.199 -4.208 1.00 . A A . 5 ALA HB1 1 1 11 7523 1 1 5 ALA HB2 H -2.910 5.715 -3.716 1.00 . A A . 5 ALA HB2 1 1 11 7524 1 1 5 ALA HB3 H -1.937 4.744 -2.624 1.00 . A A . 5 ALA HB3 1 1 11 7525 1 1 5 ALA N N -2.051 7.266 -1.549 1.00 . A A . 5 ALA N 1 1 11 7526 1 1 5 ALA O O -2.392 8.620 -3.892 1.00 . A A . 5 ALA O 1 1 11 7527 1 1 6 GLN C C -1.377 8.867 -6.646 1.00 . A A . 6 GLN C 1 1 11 7528 1 1 6 GLN CA C -0.176 9.069 -5.674 1.00 . A A . 6 GLN CA 1 1 11 7529 1 1 6 GLN CB C 1.170 8.791 -6.411 1.00 . A A . 6 GLN CB 1 1 11 7530 1 1 6 GLN CD C 2.756 9.363 -8.302 1.00 . A A . 6 GLN CD 1 1 11 7531 1 1 6 GLN CG C 1.548 9.788 -7.505 1.00 . A A . 6 GLN CG 1 1 11 7532 1 1 6 GLN H H 0.609 7.775 -4.249 1.00 . A A . 6 GLN H 1 1 11 7533 1 1 6 GLN HA H -0.164 10.081 -5.293 1.00 . A A . 6 GLN HA 1 1 11 7534 1 1 6 GLN HB2 H 1.972 8.798 -5.686 1.00 . A A . 6 GLN HB2 1 1 11 7535 1 1 6 GLN HB3 H 1.120 7.805 -6.851 1.00 . A A . 6 GLN HB3 1 1 11 7536 1 1 6 GLN HE21 H 1.613 8.404 -9.606 1.00 . A A . 6 GLN HE21 1 1 11 7537 1 1 6 GLN HE22 H 3.317 8.374 -9.898 1.00 . A A . 6 GLN HE22 1 1 11 7538 1 1 6 GLN HG2 H 0.731 9.933 -8.182 1.00 . A A . 6 GLN HG2 1 1 11 7539 1 1 6 GLN HG3 H 1.782 10.734 -7.041 1.00 . A A . 6 GLN HG3 1 1 11 7540 1 1 6 GLN N N -0.264 8.126 -4.519 1.00 . A A . 6 GLN N 1 1 11 7541 1 1 6 GLN NE2 N 2.535 8.638 -9.370 1.00 . A A . 6 GLN NE2 1 1 11 7542 1 1 6 GLN O O -1.789 9.779 -7.350 1.00 . A A . 6 GLN O 1 1 11 7543 1 1 6 GLN OE1 O 3.862 9.685 -7.964 1.00 . A A . 6 GLN OE1 1 1 11 7544 1 1 7 ASN C C -3.773 6.122 -6.770 1.00 . A A . 7 ASN C 1 1 11 7545 1 1 7 ASN CA C -3.088 7.305 -7.415 1.00 . A A . 7 ASN CA 1 1 11 7546 1 1 7 ASN CB C -2.789 7.005 -8.896 1.00 . A A . 7 ASN CB 1 1 11 7547 1 1 7 ASN CG C -4.060 6.686 -9.694 1.00 . A A . 7 ASN CG 1 1 11 7548 1 1 7 ASN H H -1.317 7.092 -6.102 1.00 . A A . 7 ASN H 1 1 11 7549 1 1 7 ASN HA H -3.752 8.156 -7.354 1.00 . A A . 7 ASN HA 1 1 11 7550 1 1 7 ASN HB2 H -2.322 7.876 -9.328 1.00 . A A . 7 ASN HB2 1 1 11 7551 1 1 7 ASN HB3 H -2.114 6.166 -8.965 1.00 . A A . 7 ASN HB3 1 1 11 7552 1 1 7 ASN HD21 H -3.045 5.539 -10.937 1.00 . A A . 7 ASN HD21 1 1 11 7553 1 1 7 ASN HD22 H -4.731 5.670 -11.248 1.00 . A A . 7 ASN HD22 1 1 11 7554 1 1 7 ASN N N -1.885 7.653 -6.665 1.00 . A A . 7 ASN N 1 1 11 7555 1 1 7 ASN ND2 N -3.932 5.890 -10.723 1.00 . A A . 7 ASN ND2 1 1 11 7556 1 1 7 ASN O O -3.303 4.991 -6.876 1.00 . A A . 7 ASN O 1 1 11 7557 1 1 7 ASN OD1 O -5.146 7.171 -9.377 1.00 . A A . 7 ASN OD1 1 1 11 7558 1 1 8 CYS C C -6.765 4.885 -6.236 1.00 . A A . 8 CYS C 1 1 11 7559 1 1 8 CYS CA C -5.537 5.304 -5.447 1.00 . A A . 8 CYS CA 1 1 11 7560 1 1 8 CYS CB C -5.877 5.583 -3.982 1.00 . A A . 8 CYS CB 1 1 11 7561 1 1 8 CYS H H -5.209 7.278 -6.015 1.00 . A A . 8 CYS H 1 1 11 7562 1 1 8 CYS HA H -4.828 4.495 -5.482 1.00 . A A . 8 CYS HA 1 1 11 7563 1 1 8 CYS HB2 H -4.975 5.775 -3.424 1.00 . A A . 8 CYS HB2 1 1 11 7564 1 1 8 CYS HB3 H -6.530 6.441 -3.920 1.00 . A A . 8 CYS HB3 1 1 11 7565 1 1 8 CYS N N -4.854 6.368 -6.076 1.00 . A A . 8 CYS N 1 1 11 7566 1 1 8 CYS O O -7.649 5.683 -6.523 1.00 . A A . 8 CYS O 1 1 11 7567 1 1 8 CYS SG S -6.717 4.192 -3.164 1.00 . A A . 8 CYS SG 1 1 11 7568 1 1 9 GLN C C -9.080 2.738 -6.358 1.00 . A A . 9 GLN C 1 1 11 7569 1 1 9 GLN CA C -7.887 2.971 -7.300 1.00 . A A . 9 GLN CA 1 1 11 7570 1 1 9 GLN CB C -7.378 1.616 -7.815 1.00 . A A . 9 GLN CB 1 1 11 7571 1 1 9 GLN CD C -5.600 0.351 -9.104 1.00 . A A . 9 GLN CD 1 1 11 7572 1 1 9 GLN CG C -6.127 1.712 -8.683 1.00 . A A . 9 GLN CG 1 1 11 7573 1 1 9 GLN H H -5.983 3.113 -6.336 1.00 . A A . 9 GLN H 1 1 11 7574 1 1 9 GLN HA H -8.178 3.580 -8.144 1.00 . A A . 9 GLN HA 1 1 11 7575 1 1 9 GLN HB2 H -7.101 1.027 -6.953 1.00 . A A . 9 GLN HB2 1 1 11 7576 1 1 9 GLN HB3 H -8.143 1.085 -8.362 1.00 . A A . 9 GLN HB3 1 1 11 7577 1 1 9 GLN HE21 H -3.771 1.050 -9.111 1.00 . A A . 9 GLN HE21 1 1 11 7578 1 1 9 GLN HE22 H -3.928 -0.607 -9.543 1.00 . A A . 9 GLN HE22 1 1 11 7579 1 1 9 GLN HG2 H -6.343 2.292 -9.567 1.00 . A A . 9 GLN HG2 1 1 11 7580 1 1 9 GLN HG3 H -5.362 2.228 -8.123 1.00 . A A . 9 GLN HG3 1 1 11 7581 1 1 9 GLN N N -6.786 3.615 -6.573 1.00 . A A . 9 GLN N 1 1 11 7582 1 1 9 GLN NE2 N -4.308 0.252 -9.266 1.00 . A A . 9 GLN NE2 1 1 11 7583 1 1 9 GLN O O -10.152 2.334 -6.782 1.00 . A A . 9 GLN O 1 1 11 7584 1 1 9 GLN OE1 O -6.355 -0.612 -9.261 1.00 . A A . 9 GLN OE1 1 1 11 7585 1 1 10 ARG C C -10.428 1.365 -3.996 1.00 . A A . 10 ARG C 1 1 11 7586 1 1 10 ARG CA C -9.775 2.796 -3.959 1.00 . A A . 10 ARG CA 1 1 11 7587 1 1 10 ARG CB C -10.830 3.927 -3.941 1.00 . A A . 10 ARG CB 1 1 11 7588 1 1 10 ARG CD C -12.669 5.138 -2.714 1.00 . A A . 10 ARG CD 1 1 11 7589 1 1 10 ARG CG C -11.659 4.005 -2.655 1.00 . A A . 10 ARG CG 1 1 11 7590 1 1 10 ARG CZ C -14.744 5.475 -1.372 1.00 . A A . 10 ARG CZ 1 1 11 7591 1 1 10 ARG H H -7.980 3.431 -4.872 1.00 . A A . 10 ARG H 1 1 11 7592 1 1 10 ARG HA H -9.189 2.847 -3.053 1.00 . A A . 10 ARG HA 1 1 11 7593 1 1 10 ARG HB2 H -10.328 4.874 -4.072 1.00 . A A . 10 ARG HB2 1 1 11 7594 1 1 10 ARG HB3 H -11.505 3.775 -4.769 1.00 . A A . 10 ARG HB3 1 1 11 7595 1 1 10 ARG HD2 H -12.141 6.063 -2.898 1.00 . A A . 10 ARG HD2 1 1 11 7596 1 1 10 ARG HD3 H -13.353 4.956 -3.528 1.00 . A A . 10 ARG HD3 1 1 11 7597 1 1 10 ARG HE H -12.876 5.229 -0.634 1.00 . A A . 10 ARG HE 1 1 11 7598 1 1 10 ARG HG2 H -12.191 3.077 -2.510 1.00 . A A . 10 ARG HG2 1 1 11 7599 1 1 10 ARG HG3 H -10.994 4.173 -1.821 1.00 . A A . 10 ARG HG3 1 1 11 7600 1 1 10 ARG HH11 H -15.133 5.399 -3.388 1.00 . A A . 10 ARG HH11 1 1 11 7601 1 1 10 ARG HH12 H -16.484 5.656 -2.424 1.00 . A A . 10 ARG HH12 1 1 11 7602 1 1 10 ARG HH21 H -14.818 5.649 0.688 1.00 . A A . 10 ARG HH21 1 1 11 7603 1 1 10 ARG HH22 H -16.305 5.787 -0.107 1.00 . A A . 10 ARG HH22 1 1 11 7604 1 1 10 ARG N N -8.838 3.009 -5.075 1.00 . A A . 10 ARG N 1 1 11 7605 1 1 10 ARG NE N -13.422 5.270 -1.456 1.00 . A A . 10 ARG NE 1 1 11 7606 1 1 10 ARG NH1 N -15.494 5.507 -2.462 1.00 . A A . 10 ARG NH1 1 1 11 7607 1 1 10 ARG NH2 N -15.313 5.645 -0.191 1.00 . A A . 10 ARG NH2 1 1 11 7608 1 1 10 ARG O O -11.631 1.225 -3.830 1.00 . A A . 10 ARG O 1 1 11 7609 1 1 11 PRO C C -10.524 -1.643 -2.886 1.00 . A A . 11 PRO C 1 1 11 7610 1 1 11 PRO CA C -10.137 -1.095 -4.252 1.00 . A A . 11 PRO CA 1 1 11 7611 1 1 11 PRO CB C -8.944 -1.906 -4.802 1.00 . A A . 11 PRO CB 1 1 11 7612 1 1 11 PRO CD C -8.156 0.259 -4.255 1.00 . A A . 11 PRO CD 1 1 11 7613 1 1 11 PRO CG C -7.908 -0.900 -5.150 1.00 . A A . 11 PRO CG 1 1 11 7614 1 1 11 PRO HA H -10.969 -1.169 -4.932 1.00 . A A . 11 PRO HA 1 1 11 7615 1 1 11 PRO HB2 H -8.583 -2.548 -4.012 1.00 . A A . 11 PRO HB2 1 1 11 7616 1 1 11 PRO HB3 H -9.251 -2.487 -5.659 1.00 . A A . 11 PRO HB3 1 1 11 7617 1 1 11 PRO HD2 H -7.702 0.094 -3.287 1.00 . A A . 11 PRO HD2 1 1 11 7618 1 1 11 PRO HD3 H -7.803 1.180 -4.696 1.00 . A A . 11 PRO HD3 1 1 11 7619 1 1 11 PRO HG2 H -6.918 -1.302 -4.988 1.00 . A A . 11 PRO HG2 1 1 11 7620 1 1 11 PRO HG3 H -8.020 -0.606 -6.182 1.00 . A A . 11 PRO HG3 1 1 11 7621 1 1 11 PRO N N -9.609 0.268 -4.162 1.00 . A A . 11 PRO N 1 1 11 7622 1 1 11 PRO O O -9.813 -1.407 -1.876 1.00 . A A . 11 PRO O 1 1 11 7623 1 1 12 CYS C C -12.473 -4.397 -1.807 1.00 . A A . 12 CYS C 1 1 11 7624 1 1 12 CYS CA C -12.083 -2.932 -1.623 1.00 . A A . 12 CYS CA 1 1 11 7625 1 1 12 CYS CB C -13.272 -2.116 -1.087 1.00 . A A . 12 CYS CB 1 1 11 7626 1 1 12 CYS H H -12.120 -2.551 -3.663 1.00 . A A . 12 CYS H 1 1 11 7627 1 1 12 CYS HA H -11.279 -2.873 -0.904 1.00 . A A . 12 CYS HA 1 1 11 7628 1 1 12 CYS HB2 H -12.953 -1.096 -0.949 1.00 . A A . 12 CYS HB2 1 1 11 7629 1 1 12 CYS HB3 H -14.073 -2.141 -1.810 1.00 . A A . 12 CYS HB3 1 1 11 7630 1 1 12 CYS HG H -15.149 -3.153 0.295 1.00 . A A . 12 CYS HG 1 1 11 7631 1 1 12 CYS N N -11.607 -2.373 -2.846 1.00 . A A . 12 CYS N 1 1 11 7632 1 1 12 CYS O O -13.358 -4.722 -2.596 1.00 . A A . 12 CYS O 1 1 11 7633 1 1 12 CYS SG S -13.927 -2.700 0.497 1.00 . A A . 12 CYS SG 1 1 11 7634 1 1 13 LYS C C -11.866 -7.141 0.340 1.00 . A A . 13 LYS C 1 1 11 7635 1 1 13 LYS CA C -12.054 -6.675 -1.072 1.00 . A A . 13 LYS CA 1 1 11 7636 1 1 13 LYS CB C -11.111 -7.497 -1.974 1.00 . A A . 13 LYS CB 1 1 11 7637 1 1 13 LYS CD C -10.278 -8.207 -4.224 1.00 . A A . 13 LYS CD 1 1 11 7638 1 1 13 LYS CE C -10.465 -8.154 -5.742 1.00 . A A . 13 LYS CE 1 1 11 7639 1 1 13 LYS CG C -11.256 -7.289 -3.471 1.00 . A A . 13 LYS CG 1 1 11 7640 1 1 13 LYS H H -11.016 -4.960 -0.565 1.00 . A A . 13 LYS H 1 1 11 7641 1 1 13 LYS HA H -13.075 -6.832 -1.377 1.00 . A A . 13 LYS HA 1 1 11 7642 1 1 13 LYS HB2 H -10.089 -7.278 -1.709 1.00 . A A . 13 LYS HB2 1 1 11 7643 1 1 13 LYS HB3 H -11.298 -8.541 -1.767 1.00 . A A . 13 LYS HB3 1 1 11 7644 1 1 13 LYS HD2 H -9.268 -7.904 -3.988 1.00 . A A . 13 LYS HD2 1 1 11 7645 1 1 13 LYS HD3 H -10.435 -9.222 -3.891 1.00 . A A . 13 LYS HD3 1 1 11 7646 1 1 13 LYS HE2 H -11.454 -8.511 -5.985 1.00 . A A . 13 LYS HE2 1 1 11 7647 1 1 13 LYS HE3 H -10.348 -7.139 -6.085 1.00 . A A . 13 LYS HE3 1 1 11 7648 1 1 13 LYS HG2 H -12.283 -7.493 -3.736 1.00 . A A . 13 LYS HG2 1 1 11 7649 1 1 13 LYS HG3 H -11.029 -6.255 -3.697 1.00 . A A . 13 LYS HG3 1 1 11 7650 1 1 13 LYS HZ1 H -9.520 -9.996 -6.102 1.00 . A A . 13 LYS HZ1 1 1 11 7651 1 1 13 LYS HZ2 H -8.498 -8.676 -6.325 1.00 . A A . 13 LYS HZ2 1 1 11 7652 1 1 13 LYS HZ3 H -9.653 -9.045 -7.473 1.00 . A A . 13 LYS HZ3 1 1 11 7653 1 1 13 LYS N N -11.769 -5.259 -1.115 1.00 . A A . 13 LYS N 1 1 11 7654 1 1 13 LYS NZ N -9.473 -9.017 -6.452 1.00 . A A . 13 LYS NZ 1 1 11 7655 1 1 13 LYS O O -11.151 -6.496 1.112 1.00 . A A . 13 LYS O 1 1 11 7656 1 1 14 ASP C C -10.981 -9.653 2.003 1.00 . A A . 14 ASP C 1 1 11 7657 1 1 14 ASP CA C -12.280 -8.853 2.014 1.00 . A A . 14 ASP CA 1 1 11 7658 1 1 14 ASP CB C -13.449 -9.782 2.413 1.00 . A A . 14 ASP CB 1 1 11 7659 1 1 14 ASP CG C -14.792 -9.088 2.454 1.00 . A A . 14 ASP CG 1 1 11 7660 1 1 14 ASP H H -13.102 -8.689 0.064 1.00 . A A . 14 ASP H 1 1 11 7661 1 1 14 ASP HA H -12.191 -8.046 2.726 1.00 . A A . 14 ASP HA 1 1 11 7662 1 1 14 ASP HB2 H -13.517 -10.592 1.703 1.00 . A A . 14 ASP HB2 1 1 11 7663 1 1 14 ASP HB3 H -13.257 -10.204 3.390 1.00 . A A . 14 ASP HB3 1 1 11 7664 1 1 14 ASP N N -12.479 -8.256 0.686 1.00 . A A . 14 ASP N 1 1 11 7665 1 1 14 ASP O O -10.546 -10.213 3.017 1.00 . A A . 14 ASP O 1 1 11 7666 1 1 14 ASP OD1 O -15.105 -8.432 3.465 1.00 . A A . 14 ASP OD1 1 1 11 7667 1 1 14 ASP OD2 O -15.548 -9.209 1.473 1.00 . A A . 14 ASP OD2 1 1 11 7668 1 1 15 LYS C C -8.144 -9.467 -0.072 1.00 . A A . 15 LYS C 1 1 11 7669 1 1 15 LYS CA C -9.141 -10.401 0.598 1.00 . A A . 15 LYS CA 1 1 11 7670 1 1 15 LYS CB C -9.366 -11.629 -0.306 1.00 . A A . 15 LYS CB 1 1 11 7671 1 1 15 LYS CD C -10.475 -13.825 -0.730 1.00 . A A . 15 LYS CD 1 1 11 7672 1 1 15 LYS CE C -11.480 -14.851 -0.254 1.00 . A A . 15 LYS CE 1 1 11 7673 1 1 15 LYS CG C -10.385 -12.633 0.208 1.00 . A A . 15 LYS CG 1 1 11 7674 1 1 15 LYS H H -10.765 -9.169 0.102 1.00 . A A . 15 LYS H 1 1 11 7675 1 1 15 LYS HA H -8.747 -10.728 1.549 1.00 . A A . 15 LYS HA 1 1 11 7676 1 1 15 LYS HB2 H -9.708 -11.269 -1.265 1.00 . A A . 15 LYS HB2 1 1 11 7677 1 1 15 LYS HB3 H -8.418 -12.132 -0.442 1.00 . A A . 15 LYS HB3 1 1 11 7678 1 1 15 LYS HD2 H -10.793 -13.466 -1.699 1.00 . A A . 15 LYS HD2 1 1 11 7679 1 1 15 LYS HD3 H -9.501 -14.281 -0.816 1.00 . A A . 15 LYS HD3 1 1 11 7680 1 1 15 LYS HE2 H -11.268 -15.101 0.775 1.00 . A A . 15 LYS HE2 1 1 11 7681 1 1 15 LYS HE3 H -12.466 -14.419 -0.306 1.00 . A A . 15 LYS HE3 1 1 11 7682 1 1 15 LYS HG2 H -10.083 -12.963 1.191 1.00 . A A . 15 LYS HG2 1 1 11 7683 1 1 15 LYS HG3 H -11.349 -12.148 0.270 1.00 . A A . 15 LYS HG3 1 1 11 7684 1 1 15 LYS HZ1 H -12.131 -16.770 -0.721 1.00 . A A . 15 LYS HZ1 1 1 11 7685 1 1 15 LYS HZ2 H -10.497 -16.511 -1.027 1.00 . A A . 15 LYS HZ2 1 1 11 7686 1 1 15 LYS HZ3 H -11.665 -15.883 -2.084 1.00 . A A . 15 LYS HZ3 1 1 11 7687 1 1 15 LYS N N -10.367 -9.692 0.830 1.00 . A A . 15 LYS N 1 1 11 7688 1 1 15 LYS NZ N -11.441 -16.082 -1.087 1.00 . A A . 15 LYS NZ 1 1 11 7689 1 1 15 LYS O O -8.093 -9.384 -1.299 1.00 . A A . 15 LYS O 1 1 11 7690 1 1 16 VAL C C -5.677 -7.119 1.417 1.00 . A A . 16 VAL C 1 1 11 7691 1 1 16 VAL CA C -6.401 -7.789 0.252 1.00 . A A . 16 VAL CA 1 1 11 7692 1 1 16 VAL CB C -6.921 -6.718 -0.768 1.00 . A A . 16 VAL CB 1 1 11 7693 1 1 16 VAL CG1 C -8.040 -5.888 -0.171 1.00 . A A . 16 VAL CG1 1 1 11 7694 1 1 16 VAL CG2 C -5.768 -5.825 -1.229 1.00 . A A . 16 VAL CG2 1 1 11 7695 1 1 16 VAL H H -7.587 -8.737 1.701 1.00 . A A . 16 VAL H 1 1 11 7696 1 1 16 VAL HA H -5.674 -8.415 -0.245 1.00 . A A . 16 VAL HA 1 1 11 7697 1 1 16 VAL HB H -7.320 -7.228 -1.633 1.00 . A A . 16 VAL HB 1 1 11 7698 1 1 16 VAL HG11 H -7.645 -5.446 0.732 1.00 . A A . 16 VAL HG11 1 1 11 7699 1 1 16 VAL HG12 H -8.895 -6.517 0.044 1.00 . A A . 16 VAL HG12 1 1 11 7700 1 1 16 VAL HG13 H -8.325 -5.112 -0.862 1.00 . A A . 16 VAL HG13 1 1 11 7701 1 1 16 VAL HG21 H -6.116 -5.124 -1.974 1.00 . A A . 16 VAL HG21 1 1 11 7702 1 1 16 VAL HG22 H -4.969 -6.427 -1.644 1.00 . A A . 16 VAL HG22 1 1 11 7703 1 1 16 VAL HG23 H -5.391 -5.287 -0.373 1.00 . A A . 16 VAL HG23 1 1 11 7704 1 1 16 VAL N N -7.431 -8.704 0.733 1.00 . A A . 16 VAL N 1 1 11 7705 1 1 16 VAL O O -6.258 -6.379 2.205 1.00 . A A . 16 VAL O 1 1 11 7706 1 1 17 ASP C C -3.113 -5.494 2.176 1.00 . A A . 17 ASP C 1 1 11 7707 1 1 17 ASP CA C -3.555 -6.923 2.546 1.00 . A A . 17 ASP CA 1 1 11 7708 1 1 17 ASP CB C -2.354 -7.849 2.762 1.00 . A A . 17 ASP CB 1 1 11 7709 1 1 17 ASP CG C -2.802 -9.251 3.170 1.00 . A A . 17 ASP CG 1 1 11 7710 1 1 17 ASP H H -4.189 -8.260 1.027 1.00 . A A . 17 ASP H 1 1 11 7711 1 1 17 ASP HA H -4.114 -6.867 3.470 1.00 . A A . 17 ASP HA 1 1 11 7712 1 1 17 ASP HB2 H -1.769 -7.910 1.851 1.00 . A A . 17 ASP HB2 1 1 11 7713 1 1 17 ASP HB3 H -1.733 -7.452 3.551 1.00 . A A . 17 ASP HB3 1 1 11 7714 1 1 17 ASP N N -4.457 -7.486 1.556 1.00 . A A . 17 ASP N 1 1 11 7715 1 1 17 ASP O O -3.195 -5.068 1.001 1.00 . A A . 17 ASP O 1 1 11 7716 1 1 17 ASP OD1 O -2.957 -9.520 4.391 1.00 . A A . 17 ASP OD1 1 1 11 7717 1 1 17 ASP OD2 O -3.041 -10.079 2.261 1.00 . A A . 17 ASP OD2 1 1 11 7718 1 1 18 TRP C C -0.893 -3.128 3.556 1.00 . A A . 18 TRP C 1 1 11 7719 1 1 18 TRP CA C -2.308 -3.345 3.069 1.00 . A A . 18 TRP CA 1 1 11 7720 1 1 18 TRP CB C -3.260 -2.485 3.922 1.00 . A A . 18 TRP CB 1 1 11 7721 1 1 18 TRP CD1 C -5.501 -3.577 3.306 1.00 . A A . 18 TRP CD1 1 1 11 7722 1 1 18 TRP CD2 C -5.508 -1.352 3.209 1.00 . A A . 18 TRP CD2 1 1 11 7723 1 1 18 TRP CE2 C -6.785 -1.823 2.849 1.00 . A A . 18 TRP CE2 1 1 11 7724 1 1 18 TRP CE3 C -5.275 0.026 3.232 1.00 . A A . 18 TRP CE3 1 1 11 7725 1 1 18 TRP CG C -4.696 -2.494 3.479 1.00 . A A . 18 TRP CG 1 1 11 7726 1 1 18 TRP CH2 C -7.565 0.374 2.547 1.00 . A A . 18 TRP CH2 1 1 11 7727 1 1 18 TRP CZ2 C -7.819 -0.969 2.510 1.00 . A A . 18 TRP CZ2 1 1 11 7728 1 1 18 TRP CZ3 C -6.302 0.870 2.902 1.00 . A A . 18 TRP CZ3 1 1 11 7729 1 1 18 TRP H H -2.530 -5.199 4.045 1.00 . A A . 18 TRP H 1 1 11 7730 1 1 18 TRP HA H -2.391 -3.030 2.038 1.00 . A A . 18 TRP HA 1 1 11 7731 1 1 18 TRP HB2 H -3.223 -2.843 4.939 1.00 . A A . 18 TRP HB2 1 1 11 7732 1 1 18 TRP HB3 H -2.910 -1.464 3.909 1.00 . A A . 18 TRP HB3 1 1 11 7733 1 1 18 TRP HD1 H -5.172 -4.597 3.440 1.00 . A A . 18 TRP HD1 1 1 11 7734 1 1 18 TRP HE1 H -7.464 -3.833 2.706 1.00 . A A . 18 TRP HE1 1 1 11 7735 1 1 18 TRP HE3 H -4.314 0.431 3.506 1.00 . A A . 18 TRP HE3 1 1 11 7736 1 1 18 TRP HH2 H -8.344 1.077 2.291 1.00 . A A . 18 TRP HH2 1 1 11 7737 1 1 18 TRP HZ2 H -8.795 -1.338 2.236 1.00 . A A . 18 TRP HZ2 1 1 11 7738 1 1 18 TRP HZ3 H -6.138 1.938 2.915 1.00 . A A . 18 TRP HZ3 1 1 11 7739 1 1 18 TRP N N -2.662 -4.761 3.181 1.00 . A A . 18 TRP N 1 1 11 7740 1 1 18 TRP NE1 N -6.743 -3.195 2.901 1.00 . A A . 18 TRP NE1 1 1 11 7741 1 1 18 TRP O O -0.369 -3.948 4.323 1.00 . A A . 18 TRP O 1 1 11 7742 1 1 19 VAL C C 1.219 -0.352 4.113 1.00 . A A . 19 VAL C 1 1 11 7743 1 1 19 VAL CA C 1.100 -1.765 3.539 1.00 . A A . 19 VAL CA 1 1 11 7744 1 1 19 VAL CB C 2.110 -1.944 2.347 1.00 . A A . 19 VAL CB 1 1 11 7745 1 1 19 VAL CG1 C 2.151 -3.398 1.893 1.00 . A A . 19 VAL CG1 1 1 11 7746 1 1 19 VAL CG2 C 1.757 -1.032 1.171 1.00 . A A . 19 VAL CG2 1 1 11 7747 1 1 19 VAL H H -0.638 -1.279 2.648 1.00 . A A . 19 VAL H 1 1 11 7748 1 1 19 VAL HA H 1.351 -2.473 4.317 1.00 . A A . 19 VAL HA 1 1 11 7749 1 1 19 VAL HB H 3.103 -1.703 2.691 1.00 . A A . 19 VAL HB 1 1 11 7750 1 1 19 VAL HG11 H 2.457 -4.029 2.716 1.00 . A A . 19 VAL HG11 1 1 11 7751 1 1 19 VAL HG12 H 2.850 -3.492 1.077 1.00 . A A . 19 VAL HG12 1 1 11 7752 1 1 19 VAL HG13 H 1.164 -3.687 1.561 1.00 . A A . 19 VAL HG13 1 1 11 7753 1 1 19 VAL HG21 H 0.754 -1.248 0.829 1.00 . A A . 19 VAL HG21 1 1 11 7754 1 1 19 VAL HG22 H 2.466 -1.205 0.376 1.00 . A A . 19 VAL HG22 1 1 11 7755 1 1 19 VAL HG23 H 1.822 -0.001 1.495 1.00 . A A . 19 VAL HG23 1 1 11 7756 1 1 19 VAL N N -0.271 -2.036 3.153 1.00 . A A . 19 VAL N 1 1 11 7757 1 1 19 VAL O O 0.615 0.588 3.601 1.00 . A A . 19 VAL O 1 1 11 7758 1 1 20 GLN C C 3.605 1.514 5.454 1.00 . A A . 20 GLN C 1 1 11 7759 1 1 20 GLN CA C 2.198 1.040 5.833 1.00 . A A . 20 GLN CA 1 1 11 7760 1 1 20 GLN CB C 2.080 0.891 7.359 1.00 . A A . 20 GLN CB 1 1 11 7761 1 1 20 GLN CD C 2.146 2.030 9.639 1.00 . A A . 20 GLN CD 1 1 11 7762 1 1 20 GLN CG C 2.247 2.199 8.135 1.00 . A A . 20 GLN CG 1 1 11 7763 1 1 20 GLN H H 2.304 -1.072 5.558 1.00 . A A . 20 GLN H 1 1 11 7764 1 1 20 GLN HA H 1.467 1.749 5.480 1.00 . A A . 20 GLN HA 1 1 11 7765 1 1 20 GLN HB2 H 1.109 0.479 7.598 1.00 . A A . 20 GLN HB2 1 1 11 7766 1 1 20 GLN HB3 H 2.842 0.202 7.696 1.00 . A A . 20 GLN HB3 1 1 11 7767 1 1 20 GLN HE21 H 3.368 3.545 9.897 1.00 . A A . 20 GLN HE21 1 1 11 7768 1 1 20 GLN HE22 H 2.802 2.836 11.338 1.00 . A A . 20 GLN HE22 1 1 11 7769 1 1 20 GLN HG2 H 3.205 2.631 7.898 1.00 . A A . 20 GLN HG2 1 1 11 7770 1 1 20 GLN HG3 H 1.469 2.873 7.811 1.00 . A A . 20 GLN HG3 1 1 11 7771 1 1 20 GLN N N 1.942 -0.237 5.187 1.00 . A A . 20 GLN N 1 1 11 7772 1 1 20 GLN NE2 N 2.833 2.873 10.361 1.00 . A A . 20 GLN NE2 1 1 11 7773 1 1 20 GLN O O 4.506 0.697 5.333 1.00 . A A . 20 GLN O 1 1 11 7774 1 1 20 GLN OE1 O 1.456 1.151 10.135 1.00 . A A . 20 GLN OE1 1 1 11 7775 1 1 21 CYS C C 5.827 3.655 6.213 1.00 . A A . 21 CYS C 1 1 11 7776 1 1 21 CYS CA C 5.131 3.275 4.917 1.00 . A A . 21 CYS CA 1 1 11 7777 1 1 21 CYS CB C 5.193 4.399 3.849 1.00 . A A . 21 CYS CB 1 1 11 7778 1 1 21 CYS H H 3.013 3.409 5.196 1.00 . A A . 21 CYS H 1 1 11 7779 1 1 21 CYS HA H 5.669 2.409 4.563 1.00 . A A . 21 CYS HA 1 1 11 7780 1 1 21 CYS HB2 H 6.203 4.643 3.564 1.00 . A A . 21 CYS HB2 1 1 11 7781 1 1 21 CYS HB3 H 4.685 4.043 2.966 1.00 . A A . 21 CYS HB3 1 1 11 7782 1 1 21 CYS N N 3.787 2.803 5.192 1.00 . A A . 21 CYS N 1 1 11 7783 1 1 21 CYS O O 5.595 4.735 6.794 1.00 . A A . 21 CYS O 1 1 11 7784 1 1 21 CYS SG S 4.439 5.960 4.282 1.00 . A A . 21 CYS SG 1 1 11 7785 1 1 22 ASP C C 8.613 3.825 7.803 1.00 . A A . 22 ASP C 1 1 11 7786 1 1 22 ASP CA C 7.419 2.895 7.928 1.00 . A A . 22 ASP CA 1 1 11 7787 1 1 22 ASP CB C 7.880 1.513 8.404 1.00 . A A . 22 ASP CB 1 1 11 7788 1 1 22 ASP CG C 6.728 0.588 8.725 1.00 . A A . 22 ASP CG 1 1 11 7789 1 1 22 ASP H H 6.890 2.007 6.063 1.00 . A A . 22 ASP H 1 1 11 7790 1 1 22 ASP HA H 6.726 3.299 8.651 1.00 . A A . 22 ASP HA 1 1 11 7791 1 1 22 ASP HB2 H 8.473 1.056 7.624 1.00 . A A . 22 ASP HB2 1 1 11 7792 1 1 22 ASP HB3 H 8.486 1.630 9.291 1.00 . A A . 22 ASP HB3 1 1 11 7793 1 1 22 ASP N N 6.702 2.777 6.644 1.00 . A A . 22 ASP N 1 1 11 7794 1 1 22 ASP O O 9.523 3.812 8.622 1.00 . A A . 22 ASP O 1 1 11 7795 1 1 22 ASP OD1 O 6.269 -0.127 7.830 1.00 . A A . 22 ASP OD1 1 1 11 7796 1 1 22 ASP OD2 O 6.282 0.568 9.887 1.00 . A A . 22 ASP OD2 1 1 11 7797 1 1 23 GLY C C 9.379 6.932 7.235 1.00 . A A . 23 GLY C 1 1 11 7798 1 1 23 GLY CA C 9.636 5.587 6.578 1.00 . A A . 23 GLY CA 1 1 11 7799 1 1 23 GLY H H 7.757 4.685 6.267 1.00 . A A . 23 GLY H 1 1 11 7800 1 1 23 GLY HA2 H 10.545 5.166 6.991 1.00 . A A . 23 GLY HA2 1 1 11 7801 1 1 23 GLY HA3 H 9.771 5.743 5.517 1.00 . A A . 23 GLY HA3 1 1 11 7802 1 1 23 GLY N N 8.570 4.673 6.807 1.00 . A A . 23 GLY N 1 1 11 7803 1 1 23 GLY O O 10.288 7.749 7.339 1.00 . A A . 23 GLY O 1 1 11 7804 1 1 24 GLY C C 6.460 9.007 8.206 1.00 . A A . 24 GLY C 1 1 11 7805 1 1 24 GLY CA C 7.883 8.445 8.348 1.00 . A A . 24 GLY CA 1 1 11 7806 1 1 24 GLY H H 7.443 6.500 7.598 1.00 . A A . 24 GLY H 1 1 11 7807 1 1 24 GLY HA2 H 8.104 8.317 9.398 1.00 . A A . 24 GLY HA2 1 1 11 7808 1 1 24 GLY HA3 H 8.588 9.165 7.957 1.00 . A A . 24 GLY HA3 1 1 11 7809 1 1 24 GLY N N 8.140 7.179 7.685 1.00 . A A . 24 GLY N 1 1 11 7810 1 1 24 GLY O O 6.094 9.903 8.946 1.00 . A A . 24 GLY O 1 1 11 7811 1 1 25 CYS C C 3.313 8.277 7.976 1.00 . A A . 25 CYS C 1 1 11 7812 1 1 25 CYS CA C 4.290 9.076 7.106 1.00 . A A . 25 CYS CA 1 1 11 7813 1 1 25 CYS CB C 3.800 9.017 5.652 1.00 . A A . 25 CYS CB 1 1 11 7814 1 1 25 CYS H H 5.977 7.799 6.672 1.00 . A A . 25 CYS H 1 1 11 7815 1 1 25 CYS HA H 4.317 10.104 7.441 1.00 . A A . 25 CYS HA 1 1 11 7816 1 1 25 CYS HB2 H 3.562 7.992 5.411 1.00 . A A . 25 CYS HB2 1 1 11 7817 1 1 25 CYS HB3 H 2.912 9.626 5.559 1.00 . A A . 25 CYS HB3 1 1 11 7818 1 1 25 CYS N N 5.660 8.514 7.255 1.00 . A A . 25 CYS N 1 1 11 7819 1 1 25 CYS O O 2.335 8.821 8.489 1.00 . A A . 25 CYS O 1 1 11 7820 1 1 25 CYS SG S 4.982 9.572 4.418 1.00 . A A . 25 CYS SG 1 1 11 7821 1 1 26 ASP C C 1.401 5.839 8.249 1.00 . A A . 26 ASP C 1 1 11 7822 1 1 26 ASP CA C 2.776 6.008 8.891 1.00 . A A . 26 ASP CA 1 1 11 7823 1 1 26 ASP CB C 2.638 6.369 10.386 1.00 . A A . 26 ASP CB 1 1 11 7824 1 1 26 ASP CG C 3.911 6.188 11.174 1.00 . A A . 26 ASP CG 1 1 11 7825 1 1 26 ASP H H 4.513 6.686 7.841 1.00 . A A . 26 ASP H 1 1 11 7826 1 1 26 ASP HA H 3.276 5.055 8.811 1.00 . A A . 26 ASP HA 1 1 11 7827 1 1 26 ASP HB2 H 2.308 7.389 10.489 1.00 . A A . 26 ASP HB2 1 1 11 7828 1 1 26 ASP HB3 H 1.882 5.722 10.815 1.00 . A A . 26 ASP HB3 1 1 11 7829 1 1 26 ASP N N 3.632 6.973 8.156 1.00 . A A . 26 ASP N 1 1 11 7830 1 1 26 ASP O O 0.457 5.375 8.887 1.00 . A A . 26 ASP O 1 1 11 7831 1 1 26 ASP OD1 O 4.816 7.026 11.073 1.00 . A A . 26 ASP OD1 1 1 11 7832 1 1 26 ASP OD2 O 4.000 5.213 11.937 1.00 . A A . 26 ASP OD2 1 1 11 7833 1 1 27 GLU C C -0.075 4.657 5.633 1.00 . A A . 27 GLU C 1 1 11 7834 1 1 27 GLU CA C 0.080 6.048 6.237 1.00 . A A . 27 GLU CA 1 1 11 7835 1 1 27 GLU CB C -0.034 7.135 5.157 1.00 . A A . 27 GLU CB 1 1 11 7836 1 1 27 GLU CD C -0.260 9.607 4.624 1.00 . A A . 27 GLU CD 1 1 11 7837 1 1 27 GLU CG C -0.077 8.554 5.709 1.00 . A A . 27 GLU CG 1 1 11 7838 1 1 27 GLU H H 2.131 6.453 6.516 1.00 . A A . 27 GLU H 1 1 11 7839 1 1 27 GLU HA H -0.717 6.187 6.954 1.00 . A A . 27 GLU HA 1 1 11 7840 1 1 27 GLU HB2 H 0.822 7.062 4.499 1.00 . A A . 27 GLU HB2 1 1 11 7841 1 1 27 GLU HB3 H -0.934 6.955 4.589 1.00 . A A . 27 GLU HB3 1 1 11 7842 1 1 27 GLU HG2 H -0.911 8.614 6.390 1.00 . A A . 27 GLU HG2 1 1 11 7843 1 1 27 GLU HG3 H 0.848 8.749 6.235 1.00 . A A . 27 GLU HG3 1 1 11 7844 1 1 27 GLU N N 1.316 6.157 6.969 1.00 . A A . 27 GLU N 1 1 11 7845 1 1 27 GLU O O 0.906 3.916 5.486 1.00 . A A . 27 GLU O 1 1 11 7846 1 1 27 GLU OE1 O -1.432 9.861 4.217 1.00 . A A . 27 GLU OE1 1 1 11 7847 1 1 27 GLU OE2 O 0.742 10.181 4.177 1.00 . A A . 27 GLU OE2 1 1 11 7848 1 1 28 TRP C C -1.964 3.083 3.257 1.00 . A A . 28 TRP C 1 1 11 7849 1 1 28 TRP CA C -1.632 3.006 4.738 1.00 . A A . 28 TRP CA 1 1 11 7850 1 1 28 TRP CB C -2.780 2.367 5.520 1.00 . A A . 28 TRP CB 1 1 11 7851 1 1 28 TRP CD1 C -2.394 2.847 8.013 1.00 . A A . 28 TRP CD1 1 1 11 7852 1 1 28 TRP CD2 C -2.005 0.726 7.406 1.00 . A A . 28 TRP CD2 1 1 11 7853 1 1 28 TRP CE2 C -1.755 0.848 8.784 1.00 . A A . 28 TRP CE2 1 1 11 7854 1 1 28 TRP CE3 C -1.831 -0.527 6.799 1.00 . A A . 28 TRP CE3 1 1 11 7855 1 1 28 TRP CG C -2.412 2.015 6.928 1.00 . A A . 28 TRP CG 1 1 11 7856 1 1 28 TRP CH2 C -1.179 -1.434 8.944 1.00 . A A . 28 TRP CH2 1 1 11 7857 1 1 28 TRP CZ2 C -1.341 -0.226 9.564 1.00 . A A . 28 TRP CZ2 1 1 11 7858 1 1 28 TRP CZ3 C -1.414 -1.588 7.575 1.00 . A A . 28 TRP CZ3 1 1 11 7859 1 1 28 TRP H H -1.973 5.026 5.370 1.00 . A A . 28 TRP H 1 1 11 7860 1 1 28 TRP HA H -0.753 2.391 4.864 1.00 . A A . 28 TRP HA 1 1 11 7861 1 1 28 TRP HB2 H -3.614 3.055 5.550 1.00 . A A . 28 TRP HB2 1 1 11 7862 1 1 28 TRP HB3 H -3.088 1.462 5.018 1.00 . A A . 28 TRP HB3 1 1 11 7863 1 1 28 TRP HD1 H -2.649 3.896 7.981 1.00 . A A . 28 TRP HD1 1 1 11 7864 1 1 28 TRP HE1 H -1.890 2.535 10.025 1.00 . A A . 28 TRP HE1 1 1 11 7865 1 1 28 TRP HE3 H -2.015 -0.653 5.742 1.00 . A A . 28 TRP HE3 1 1 11 7866 1 1 28 TRP HH2 H -0.861 -2.296 9.511 1.00 . A A . 28 TRP HH2 1 1 11 7867 1 1 28 TRP HZ2 H -1.153 -0.116 10.623 1.00 . A A . 28 TRP HZ2 1 1 11 7868 1 1 28 TRP HZ3 H -1.264 -2.560 7.128 1.00 . A A . 28 TRP HZ3 1 1 11 7869 1 1 28 TRP N N -1.298 4.318 5.278 1.00 . A A . 28 TRP N 1 1 11 7870 1 1 28 TRP NE1 N -1.991 2.153 9.128 1.00 . A A . 28 TRP NE1 1 1 11 7871 1 1 28 TRP O O -2.803 3.896 2.830 1.00 . A A . 28 TRP O 1 1 11 7872 1 1 29 PHE C C -1.962 0.862 0.610 1.00 . A A . 29 PHE C 1 1 11 7873 1 1 29 PHE CA C -1.428 2.229 1.054 1.00 . A A . 29 PHE CA 1 1 11 7874 1 1 29 PHE CB C -0.017 2.438 0.402 1.00 . A A . 29 PHE CB 1 1 11 7875 1 1 29 PHE CD1 C 1.221 3.780 2.139 1.00 . A A . 29 PHE CD1 1 1 11 7876 1 1 29 PHE CD2 C 0.999 4.723 -0.022 1.00 . A A . 29 PHE CD2 1 1 11 7877 1 1 29 PHE CE1 C 1.921 4.873 2.555 1.00 . A A . 29 PHE CE1 1 1 11 7878 1 1 29 PHE CE2 C 1.712 5.834 0.390 1.00 . A A . 29 PHE CE2 1 1 11 7879 1 1 29 PHE CG C 0.747 3.681 0.854 1.00 . A A . 29 PHE CG 1 1 11 7880 1 1 29 PHE CZ C 2.162 5.908 1.691 1.00 . A A . 29 PHE CZ 1 1 11 7881 1 1 29 PHE H H -0.689 1.608 2.917 1.00 . A A . 29 PHE H 1 1 11 7882 1 1 29 PHE HA H -2.082 3.023 0.730 1.00 . A A . 29 PHE HA 1 1 11 7883 1 1 29 PHE HB2 H 0.611 1.584 0.588 1.00 . A A . 29 PHE HB2 1 1 11 7884 1 1 29 PHE HB3 H -0.160 2.521 -0.666 1.00 . A A . 29 PHE HB3 1 1 11 7885 1 1 29 PHE HD1 H 1.025 2.976 2.831 1.00 . A A . 29 PHE HD1 1 1 11 7886 1 1 29 PHE HD2 H 0.636 4.679 -1.043 1.00 . A A . 29 PHE HD2 1 1 11 7887 1 1 29 PHE HE1 H 2.283 4.927 3.574 1.00 . A A . 29 PHE HE1 1 1 11 7888 1 1 29 PHE HE2 H 1.891 6.639 -0.307 1.00 . A A . 29 PHE HE2 1 1 11 7889 1 1 29 PHE HZ H 2.728 6.752 2.057 1.00 . A A . 29 PHE HZ 1 1 11 7890 1 1 29 PHE N N -1.302 2.250 2.493 1.00 . A A . 29 PHE N 1 1 11 7891 1 1 29 PHE O O -1.875 -0.127 1.351 1.00 . A A . 29 PHE O 1 1 11 7892 1 1 30 HIS C C -1.851 -1.005 -2.041 1.00 . A A . 30 HIS C 1 1 11 7893 1 1 30 HIS CA C -2.958 -0.472 -1.180 1.00 . A A . 30 HIS CA 1 1 11 7894 1 1 30 HIS CB C -4.200 -0.307 -2.085 1.00 . A A . 30 HIS CB 1 1 11 7895 1 1 30 HIS CD2 C -6.433 -0.918 -0.928 1.00 . A A . 30 HIS CD2 1 1 11 7896 1 1 30 HIS CE1 C -7.321 1.079 -0.896 1.00 . A A . 30 HIS CE1 1 1 11 7897 1 1 30 HIS CG C -5.521 -0.061 -1.449 1.00 . A A . 30 HIS CG 1 1 11 7898 1 1 30 HIS H H -2.550 1.653 -1.088 1.00 . A A . 30 HIS H 1 1 11 7899 1 1 30 HIS HA H -3.173 -1.165 -0.376 1.00 . A A . 30 HIS HA 1 1 11 7900 1 1 30 HIS HB2 H -4.000 0.624 -2.595 1.00 . A A . 30 HIS HB2 1 1 11 7901 1 1 30 HIS HB3 H -4.307 -1.037 -2.875 1.00 . A A . 30 HIS HB3 1 1 11 7902 1 1 30 HIS HD2 H -6.311 -1.986 -0.805 1.00 . A A . 30 HIS HD2 1 1 11 7903 1 1 30 HIS HE1 H -8.019 1.890 -0.758 1.00 . A A . 30 HIS HE1 1 1 11 7904 1 1 30 HIS HE2 H -8.449 -0.571 -0.514 1.00 . A A . 30 HIS HE2 1 1 11 7905 1 1 30 HIS N N -2.510 0.805 -0.592 1.00 . A A . 30 HIS N 1 1 11 7906 1 1 30 HIS ND1 N -6.097 1.181 -1.411 1.00 . A A . 30 HIS ND1 1 1 11 7907 1 1 30 HIS NE2 N -7.546 -0.184 -0.605 1.00 . A A . 30 HIS NE2 1 1 11 7908 1 1 30 HIS O O -1.274 -0.256 -2.825 1.00 . A A . 30 HIS O 1 1 11 7909 1 1 31 GLN C C -0.743 -2.720 -4.234 1.00 . A A . 31 GLN C 1 1 11 7910 1 1 31 GLN CA C -0.533 -2.922 -2.726 1.00 . A A . 31 GLN CA 1 1 11 7911 1 1 31 GLN CB C -0.403 -4.400 -2.363 1.00 . A A . 31 GLN CB 1 1 11 7912 1 1 31 GLN CD C 0.013 -6.020 -0.436 1.00 . A A . 31 GLN CD 1 1 11 7913 1 1 31 GLN CG C 0.202 -4.619 -0.979 1.00 . A A . 31 GLN CG 1 1 11 7914 1 1 31 GLN H H -2.044 -2.788 -1.233 1.00 . A A . 31 GLN H 1 1 11 7915 1 1 31 GLN HA H 0.389 -2.430 -2.457 1.00 . A A . 31 GLN HA 1 1 11 7916 1 1 31 GLN HB2 H -1.375 -4.866 -2.390 1.00 . A A . 31 GLN HB2 1 1 11 7917 1 1 31 GLN HB3 H 0.242 -4.865 -3.090 1.00 . A A . 31 GLN HB3 1 1 11 7918 1 1 31 GLN HE21 H -0.046 -6.811 -2.256 1.00 . A A . 31 GLN HE21 1 1 11 7919 1 1 31 GLN HE22 H -0.223 -7.882 -0.901 1.00 . A A . 31 GLN HE22 1 1 11 7920 1 1 31 GLN HG2 H 1.265 -4.449 -1.073 1.00 . A A . 31 GLN HG2 1 1 11 7921 1 1 31 GLN HG3 H -0.179 -3.896 -0.278 1.00 . A A . 31 GLN HG3 1 1 11 7922 1 1 31 GLN N N -1.566 -2.274 -1.919 1.00 . A A . 31 GLN N 1 1 11 7923 1 1 31 GLN NE2 N -0.091 -6.997 -1.300 1.00 . A A . 31 GLN NE2 1 1 11 7924 1 1 31 GLN O O 0.197 -2.513 -4.955 1.00 . A A . 31 GLN O 1 1 11 7925 1 1 31 GLN OE1 O -0.057 -6.213 0.764 1.00 . A A . 31 GLN OE1 1 1 11 7926 1 1 32 VAL C C -2.141 -1.019 -6.478 1.00 . A A . 32 VAL C 1 1 11 7927 1 1 32 VAL CA C -2.231 -2.530 -6.104 1.00 . A A . 32 VAL CA 1 1 11 7928 1 1 32 VAL CB C -3.612 -3.102 -6.545 1.00 . A A . 32 VAL CB 1 1 11 7929 1 1 32 VAL CG1 C -4.715 -2.425 -5.790 1.00 . A A . 32 VAL CG1 1 1 11 7930 1 1 32 VAL CG2 C -3.812 -2.893 -8.021 1.00 . A A . 32 VAL CG2 1 1 11 7931 1 1 32 VAL H H -2.701 -2.939 -4.063 1.00 . A A . 32 VAL H 1 1 11 7932 1 1 32 VAL HA H -1.458 -3.050 -6.644 1.00 . A A . 32 VAL HA 1 1 11 7933 1 1 32 VAL HB H -3.643 -4.166 -6.341 1.00 . A A . 32 VAL HB 1 1 11 7934 1 1 32 VAL HG11 H -4.605 -1.377 -6.032 1.00 . A A . 32 VAL HG11 1 1 11 7935 1 1 32 VAL HG12 H -4.526 -2.558 -4.735 1.00 . A A . 32 VAL HG12 1 1 11 7936 1 1 32 VAL HG13 H -5.685 -2.780 -6.093 1.00 . A A . 32 VAL HG13 1 1 11 7937 1 1 32 VAL HG21 H -4.796 -3.232 -8.309 1.00 . A A . 32 VAL HG21 1 1 11 7938 1 1 32 VAL HG22 H -3.044 -3.410 -8.581 1.00 . A A . 32 VAL HG22 1 1 11 7939 1 1 32 VAL HG23 H -3.739 -1.830 -8.186 1.00 . A A . 32 VAL HG23 1 1 11 7940 1 1 32 VAL N N -1.970 -2.751 -4.686 1.00 . A A . 32 VAL N 1 1 11 7941 1 1 32 VAL O O -1.568 -0.650 -7.490 1.00 . A A . 32 VAL O 1 1 11 7942 1 1 33 CYS C C -1.464 1.948 -5.868 1.00 . A A . 33 CYS C 1 1 11 7943 1 1 33 CYS CA C -2.817 1.240 -5.919 1.00 . A A . 33 CYS CA 1 1 11 7944 1 1 33 CYS CB C -3.873 1.931 -5.024 1.00 . A A . 33 CYS CB 1 1 11 7945 1 1 33 CYS H H -3.008 -0.629 -4.824 1.00 . A A . 33 CYS H 1 1 11 7946 1 1 33 CYS HA H -3.131 1.345 -6.947 1.00 . A A . 33 CYS HA 1 1 11 7947 1 1 33 CYS HB2 H -4.234 2.818 -5.494 1.00 . A A . 33 CYS HB2 1 1 11 7948 1 1 33 CYS HB3 H -4.718 1.264 -4.943 1.00 . A A . 33 CYS HB3 1 1 11 7949 1 1 33 CYS N N -2.697 -0.170 -5.621 1.00 . A A . 33 CYS N 1 1 11 7950 1 1 33 CYS O O -1.231 2.892 -6.611 1.00 . A A . 33 CYS O 1 1 11 7951 1 1 33 CYS SG S -3.372 2.348 -3.356 1.00 . A A . 33 CYS SG 1 1 11 7952 1 1 34 VAL C C 1.789 1.230 -5.659 1.00 . A A . 34 VAL C 1 1 11 7953 1 1 34 VAL CA C 0.711 2.091 -4.934 1.00 . A A . 34 VAL CA 1 1 11 7954 1 1 34 VAL CB C 1.095 2.327 -3.469 1.00 . A A . 34 VAL CB 1 1 11 7955 1 1 34 VAL CG1 C 1.730 1.134 -2.802 1.00 . A A . 34 VAL CG1 1 1 11 7956 1 1 34 VAL CG2 C 1.867 3.582 -3.350 1.00 . A A . 34 VAL CG2 1 1 11 7957 1 1 34 VAL H H -0.724 0.730 -4.411 1.00 . A A . 34 VAL H 1 1 11 7958 1 1 34 VAL HA H 0.647 3.044 -5.436 1.00 . A A . 34 VAL HA 1 1 11 7959 1 1 34 VAL HB H 0.227 2.416 -2.847 1.00 . A A . 34 VAL HB 1 1 11 7960 1 1 34 VAL HG11 H 1.098 0.258 -2.874 1.00 . A A . 34 VAL HG11 1 1 11 7961 1 1 34 VAL HG12 H 1.924 1.364 -1.764 1.00 . A A . 34 VAL HG12 1 1 11 7962 1 1 34 VAL HG13 H 2.676 0.941 -3.287 1.00 . A A . 34 VAL HG13 1 1 11 7963 1 1 34 VAL HG21 H 2.760 3.497 -3.949 1.00 . A A . 34 VAL HG21 1 1 11 7964 1 1 34 VAL HG22 H 2.098 3.753 -2.315 1.00 . A A . 34 VAL HG22 1 1 11 7965 1 1 34 VAL HG23 H 1.211 4.361 -3.713 1.00 . A A . 34 VAL HG23 1 1 11 7966 1 1 34 VAL N N -0.563 1.476 -5.024 1.00 . A A . 34 VAL N 1 1 11 7967 1 1 34 VAL O O 2.990 1.515 -5.597 1.00 . A A . 34 VAL O 1 1 11 7968 1 1 35 GLY C C 3.248 -1.445 -6.290 1.00 . A A . 35 GLY C 1 1 11 7969 1 1 35 GLY CA C 2.217 -0.674 -7.140 1.00 . A A . 35 GLY CA 1 1 11 7970 1 1 35 GLY H H 0.341 0.213 -6.538 1.00 . A A . 35 GLY H 1 1 11 7971 1 1 35 GLY HA2 H 1.618 -1.405 -7.656 1.00 . A A . 35 GLY HA2 1 1 11 7972 1 1 35 GLY HA3 H 2.741 -0.094 -7.885 1.00 . A A . 35 GLY HA3 1 1 11 7973 1 1 35 GLY N N 1.316 0.231 -6.406 1.00 . A A . 35 GLY N 1 1 11 7974 1 1 35 GLY O O 4.455 -1.317 -6.498 1.00 . A A . 35 GLY O 1 1 11 7975 1 1 36 VAL C C 3.353 -4.535 -5.041 1.00 . A A . 36 VAL C 1 1 11 7976 1 1 36 VAL CA C 3.597 -3.114 -4.569 1.00 . A A . 36 VAL CA 1 1 11 7977 1 1 36 VAL CB C 3.217 -3.009 -3.059 1.00 . A A . 36 VAL CB 1 1 11 7978 1 1 36 VAL CG1 C 3.932 -4.048 -2.199 1.00 . A A . 36 VAL CG1 1 1 11 7979 1 1 36 VAL CG2 C 3.511 -1.641 -2.535 1.00 . A A . 36 VAL CG2 1 1 11 7980 1 1 36 VAL H H 1.813 -2.316 -5.174 1.00 . A A . 36 VAL H 1 1 11 7981 1 1 36 VAL HA H 4.635 -2.838 -4.702 1.00 . A A . 36 VAL HA 1 1 11 7982 1 1 36 VAL HB H 2.152 -3.162 -2.987 1.00 . A A . 36 VAL HB 1 1 11 7983 1 1 36 VAL HG11 H 3.685 -3.866 -1.160 1.00 . A A . 36 VAL HG11 1 1 11 7984 1 1 36 VAL HG12 H 5.002 -4.040 -2.373 1.00 . A A . 36 VAL HG12 1 1 11 7985 1 1 36 VAL HG13 H 3.552 -5.023 -2.471 1.00 . A A . 36 VAL HG13 1 1 11 7986 1 1 36 VAL HG21 H 2.876 -0.936 -3.051 1.00 . A A . 36 VAL HG21 1 1 11 7987 1 1 36 VAL HG22 H 4.551 -1.391 -2.685 1.00 . A A . 36 VAL HG22 1 1 11 7988 1 1 36 VAL HG23 H 3.296 -1.631 -1.475 1.00 . A A . 36 VAL HG23 1 1 11 7989 1 1 36 VAL N N 2.772 -2.240 -5.373 1.00 . A A . 36 VAL N 1 1 11 7990 1 1 36 VAL O O 2.237 -4.868 -5.464 1.00 . A A . 36 VAL O 1 1 11 7991 1 1 37 SER C C 4.057 -7.548 -4.098 1.00 . A A . 37 SER C 1 1 11 7992 1 1 37 SER CA C 4.227 -6.714 -5.375 1.00 . A A . 37 SER CA 1 1 11 7993 1 1 37 SER CB C 5.506 -7.118 -6.110 1.00 . A A . 37 SER CB 1 1 11 7994 1 1 37 SER H H 5.266 -5.235 -4.654 1.00 . A A . 37 SER H 1 1 11 7995 1 1 37 SER HA H 3.382 -6.811 -6.043 1.00 . A A . 37 SER HA 1 1 11 7996 1 1 37 SER HB2 H 5.499 -8.183 -6.294 1.00 . A A . 37 SER HB2 1 1 11 7997 1 1 37 SER HB3 H 5.576 -6.574 -7.039 1.00 . A A . 37 SER HB3 1 1 11 7998 1 1 37 SER HG H 7.416 -6.735 -5.880 1.00 . A A . 37 SER HG 1 1 11 7999 1 1 37 SER N N 4.355 -5.360 -4.990 1.00 . A A . 37 SER N 1 1 11 8000 1 1 37 SER O O 4.461 -7.104 -3.015 1.00 . A A . 37 SER O 1 1 11 8001 1 1 37 SER OG O 6.648 -6.805 -5.305 1.00 . A A . 37 SER OG 1 1 11 8002 1 1 38 PRO C C 4.667 -10.001 -2.414 1.00 . A A . 38 PRO C 1 1 11 8003 1 1 38 PRO CA C 3.302 -9.641 -3.020 1.00 . A A . 38 PRO CA 1 1 11 8004 1 1 38 PRO CB C 2.626 -10.890 -3.603 1.00 . A A . 38 PRO CB 1 1 11 8005 1 1 38 PRO CD C 2.849 -9.328 -5.392 1.00 . A A . 38 PRO CD 1 1 11 8006 1 1 38 PRO CG C 2.819 -10.787 -5.076 1.00 . A A . 38 PRO CG 1 1 11 8007 1 1 38 PRO HA H 2.679 -9.202 -2.256 1.00 . A A . 38 PRO HA 1 1 11 8008 1 1 38 PRO HB2 H 3.088 -11.775 -3.193 1.00 . A A . 38 PRO HB2 1 1 11 8009 1 1 38 PRO HB3 H 1.578 -10.890 -3.343 1.00 . A A . 38 PRO HB3 1 1 11 8010 1 1 38 PRO HD2 H 3.465 -9.151 -6.262 1.00 . A A . 38 PRO HD2 1 1 11 8011 1 1 38 PRO HD3 H 1.851 -8.948 -5.547 1.00 . A A . 38 PRO HD3 1 1 11 8012 1 1 38 PRO HG2 H 3.773 -11.236 -5.301 1.00 . A A . 38 PRO HG2 1 1 11 8013 1 1 38 PRO HG3 H 2.019 -11.288 -5.601 1.00 . A A . 38 PRO HG3 1 1 11 8014 1 1 38 PRO N N 3.451 -8.747 -4.182 1.00 . A A . 38 PRO N 1 1 11 8015 1 1 38 PRO O O 4.785 -10.229 -1.210 1.00 . A A . 38 PRO O 1 1 11 8016 1 1 39 GLU C C 7.597 -9.216 -1.894 1.00 . A A . 39 GLU C 1 1 11 8017 1 1 39 GLU CA C 7.041 -10.297 -2.833 1.00 . A A . 39 GLU CA 1 1 11 8018 1 1 39 GLU CB C 7.946 -10.484 -4.079 1.00 . A A . 39 GLU CB 1 1 11 8019 1 1 39 GLU CD C 10.208 -11.173 -5.041 1.00 . A A . 39 GLU CD 1 1 11 8020 1 1 39 GLU CG C 9.380 -10.935 -3.778 1.00 . A A . 39 GLU CG 1 1 11 8021 1 1 39 GLU H H 5.603 -9.627 -4.166 1.00 . A A . 39 GLU H 1 1 11 8022 1 1 39 GLU HA H 7.001 -11.228 -2.292 1.00 . A A . 39 GLU HA 1 1 11 8023 1 1 39 GLU HB2 H 7.490 -11.214 -4.733 1.00 . A A . 39 GLU HB2 1 1 11 8024 1 1 39 GLU HB3 H 7.992 -9.541 -4.607 1.00 . A A . 39 GLU HB3 1 1 11 8025 1 1 39 GLU HG2 H 9.849 -10.176 -3.173 1.00 . A A . 39 GLU HG2 1 1 11 8026 1 1 39 GLU HG3 H 9.328 -11.856 -3.221 1.00 . A A . 39 GLU HG3 1 1 11 8027 1 1 39 GLU N N 5.711 -9.950 -3.249 1.00 . A A . 39 GLU N 1 1 11 8028 1 1 39 GLU O O 8.327 -9.515 -0.958 1.00 . A A . 39 GLU O 1 1 11 8029 1 1 39 GLU OE1 O 10.801 -10.202 -5.566 1.00 . A A . 39 GLU OE1 1 1 11 8030 1 1 39 GLU OE2 O 10.266 -12.337 -5.513 1.00 . A A . 39 GLU OE2 1 1 11 8031 1 1 40 MET C C 7.045 -6.820 0.025 1.00 . A A . 40 MET C 1 1 11 8032 1 1 40 MET CA C 7.721 -6.862 -1.330 1.00 . A A . 40 MET CA 1 1 11 8033 1 1 40 MET CB C 7.589 -5.501 -2.034 1.00 . A A . 40 MET CB 1 1 11 8034 1 1 40 MET CE C 7.023 -2.386 -2.799 1.00 . A A . 40 MET CE 1 1 11 8035 1 1 40 MET CG C 8.304 -4.380 -1.286 1.00 . A A . 40 MET CG 1 1 11 8036 1 1 40 MET H H 6.595 -7.767 -2.869 1.00 . A A . 40 MET H 1 1 11 8037 1 1 40 MET HA H 8.769 -7.054 -1.159 1.00 . A A . 40 MET HA 1 1 11 8038 1 1 40 MET HB2 H 7.772 -5.492 -3.094 1.00 . A A . 40 MET HB2 1 1 11 8039 1 1 40 MET HB3 H 6.536 -5.274 -1.948 1.00 . A A . 40 MET HB3 1 1 11 8040 1 1 40 MET HE1 H 6.420 -2.165 -1.932 1.00 . A A . 40 MET HE1 1 1 11 8041 1 1 40 MET HE2 H 6.561 -3.174 -3.373 1.00 . A A . 40 MET HE2 1 1 11 8042 1 1 40 MET HE3 H 7.097 -1.502 -3.419 1.00 . A A . 40 MET HE3 1 1 11 8043 1 1 40 MET HG2 H 7.657 -4.095 -0.470 1.00 . A A . 40 MET HG2 1 1 11 8044 1 1 40 MET HG3 H 9.228 -4.770 -0.887 1.00 . A A . 40 MET HG3 1 1 11 8045 1 1 40 MET N N 7.225 -7.956 -2.143 1.00 . A A . 40 MET N 1 1 11 8046 1 1 40 MET O O 7.706 -6.708 1.044 1.00 . A A . 40 MET O 1 1 11 8047 1 1 40 MET SD S 8.648 -2.909 -2.291 1.00 . A A . 40 MET SD 1 1 11 8048 1 1 41 ALA C C 5.282 -7.821 2.313 1.00 . A A . 41 ALA C 1 1 11 8049 1 1 41 ALA CA C 4.913 -6.798 1.242 1.00 . A A . 41 ALA CA 1 1 11 8050 1 1 41 ALA CB C 3.429 -6.886 0.907 1.00 . A A . 41 ALA CB 1 1 11 8051 1 1 41 ALA H H 5.280 -7.096 -0.832 1.00 . A A . 41 ALA H 1 1 11 8052 1 1 41 ALA HA H 5.101 -5.819 1.659 1.00 . A A . 41 ALA HA 1 1 11 8053 1 1 41 ALA HB1 H 3.196 -6.166 0.138 1.00 . A A . 41 ALA HB1 1 1 11 8054 1 1 41 ALA HB2 H 2.842 -6.660 1.787 1.00 . A A . 41 ALA HB2 1 1 11 8055 1 1 41 ALA HB3 H 3.185 -7.879 0.559 1.00 . A A . 41 ALA HB3 1 1 11 8056 1 1 41 ALA N N 5.727 -6.924 0.022 1.00 . A A . 41 ALA N 1 1 11 8057 1 1 41 ALA O O 5.428 -7.477 3.486 1.00 . A A . 41 ALA O 1 1 11 8058 1 1 42 GLU C C 7.224 -10.143 3.275 1.00 . A A . 42 GLU C 1 1 11 8059 1 1 42 GLU CA C 5.750 -10.116 2.854 1.00 . A A . 42 GLU CA 1 1 11 8060 1 1 42 GLU CB C 5.340 -11.475 2.280 1.00 . A A . 42 GLU CB 1 1 11 8061 1 1 42 GLU CD C 3.481 -12.954 1.409 1.00 . A A . 42 GLU CD 1 1 11 8062 1 1 42 GLU CG C 3.859 -11.586 1.956 1.00 . A A . 42 GLU CG 1 1 11 8063 1 1 42 GLU H H 5.325 -9.242 0.955 1.00 . A A . 42 GLU H 1 1 11 8064 1 1 42 GLU HA H 5.152 -9.942 3.737 1.00 . A A . 42 GLU HA 1 1 11 8065 1 1 42 GLU HB2 H 5.905 -11.652 1.379 1.00 . A A . 42 GLU HB2 1 1 11 8066 1 1 42 GLU HB3 H 5.583 -12.243 3.001 1.00 . A A . 42 GLU HB3 1 1 11 8067 1 1 42 GLU HG2 H 3.296 -11.411 2.862 1.00 . A A . 42 GLU HG2 1 1 11 8068 1 1 42 GLU HG3 H 3.614 -10.837 1.217 1.00 . A A . 42 GLU HG3 1 1 11 8069 1 1 42 GLU N N 5.448 -9.054 1.909 1.00 . A A . 42 GLU N 1 1 11 8070 1 1 42 GLU O O 7.561 -10.713 4.307 1.00 . A A . 42 GLU O 1 1 11 8071 1 1 42 GLU OE1 O 3.529 -13.146 0.175 1.00 . A A . 42 GLU OE1 1 1 11 8072 1 1 42 GLU OE2 O 3.135 -13.844 2.213 1.00 . A A . 42 GLU OE2 1 1 11 8073 1 1 43 ASN C C 10.245 -8.337 3.165 1.00 . A A . 43 ASN C 1 1 11 8074 1 1 43 ASN CA C 9.520 -9.626 2.780 1.00 . A A . 43 ASN CA 1 1 11 8075 1 1 43 ASN CB C 10.240 -10.294 1.616 1.00 . A A . 43 ASN CB 1 1 11 8076 1 1 43 ASN CG C 9.950 -11.782 1.490 1.00 . A A . 43 ASN CG 1 1 11 8077 1 1 43 ASN H H 7.781 -8.996 1.740 1.00 . A A . 43 ASN H 1 1 11 8078 1 1 43 ASN HA H 9.593 -10.309 3.612 1.00 . A A . 43 ASN HA 1 1 11 8079 1 1 43 ASN HB2 H 9.914 -9.813 0.707 1.00 . A A . 43 ASN HB2 1 1 11 8080 1 1 43 ASN HB3 H 11.299 -10.149 1.741 1.00 . A A . 43 ASN HB3 1 1 11 8081 1 1 43 ASN HD21 H 10.135 -11.677 -0.478 1.00 . A A . 43 ASN HD21 1 1 11 8082 1 1 43 ASN HD22 H 9.778 -13.238 0.195 1.00 . A A . 43 ASN HD22 1 1 11 8083 1 1 43 ASN N N 8.097 -9.513 2.505 1.00 . A A . 43 ASN N 1 1 11 8084 1 1 43 ASN ND2 N 9.953 -12.278 0.277 1.00 . A A . 43 ASN ND2 1 1 11 8085 1 1 43 ASN O O 11.207 -8.399 3.935 1.00 . A A . 43 ASN O 1 1 11 8086 1 1 43 ASN OD1 O 9.714 -12.474 2.482 1.00 . A A . 43 ASN OD1 1 1 11 8087 1 1 44 GLU C C 9.813 -4.784 3.422 1.00 . A A . 44 GLU C 1 1 11 8088 1 1 44 GLU CA C 10.630 -5.974 2.916 1.00 . A A . 44 GLU CA 1 1 11 8089 1 1 44 GLU CB C 11.449 -5.587 1.677 1.00 . A A . 44 GLU CB 1 1 11 8090 1 1 44 GLU CD C 13.326 -6.234 0.109 1.00 . A A . 44 GLU CD 1 1 11 8091 1 1 44 GLU CG C 12.414 -6.677 1.218 1.00 . A A . 44 GLU CG 1 1 11 8092 1 1 44 GLU H H 8.976 -7.106 2.191 1.00 . A A . 44 GLU H 1 1 11 8093 1 1 44 GLU HA H 11.327 -6.229 3.705 1.00 . A A . 44 GLU HA 1 1 11 8094 1 1 44 GLU HB2 H 10.766 -5.367 0.869 1.00 . A A . 44 GLU HB2 1 1 11 8095 1 1 44 GLU HB3 H 12.017 -4.698 1.914 1.00 . A A . 44 GLU HB3 1 1 11 8096 1 1 44 GLU HG2 H 13.023 -6.957 2.067 1.00 . A A . 44 GLU HG2 1 1 11 8097 1 1 44 GLU HG3 H 11.836 -7.531 0.892 1.00 . A A . 44 GLU HG3 1 1 11 8098 1 1 44 GLU N N 9.830 -7.184 2.676 1.00 . A A . 44 GLU N 1 1 11 8099 1 1 44 GLU O O 8.577 -4.776 3.371 1.00 . A A . 44 GLU O 1 1 11 8100 1 1 44 GLU OE1 O 12.901 -6.224 -1.051 1.00 . A A . 44 GLU OE1 1 1 11 8101 1 1 44 GLU OE2 O 14.510 -5.916 0.411 1.00 . A A . 44 GLU OE2 1 1 11 8102 1 1 45 ASP C C 9.459 -1.655 3.400 1.00 . A A . 45 ASP C 1 1 11 8103 1 1 45 ASP CA C 9.977 -2.585 4.491 1.00 . A A . 45 ASP CA 1 1 11 8104 1 1 45 ASP CB C 11.081 -1.844 5.288 1.00 . A A . 45 ASP CB 1 1 11 8105 1 1 45 ASP CG C 11.748 -2.694 6.362 1.00 . A A . 45 ASP CG 1 1 11 8106 1 1 45 ASP H H 11.506 -3.886 3.873 1.00 . A A . 45 ASP H 1 1 11 8107 1 1 45 ASP HA H 9.181 -2.844 5.171 1.00 . A A . 45 ASP HA 1 1 11 8108 1 1 45 ASP HB2 H 11.837 -1.518 4.591 1.00 . A A . 45 ASP HB2 1 1 11 8109 1 1 45 ASP HB3 H 10.659 -0.967 5.752 1.00 . A A . 45 ASP HB3 1 1 11 8110 1 1 45 ASP N N 10.531 -3.799 3.905 1.00 . A A . 45 ASP N 1 1 11 8111 1 1 45 ASP O O 10.228 -1.194 2.543 1.00 . A A . 45 ASP O 1 1 11 8112 1 1 45 ASP OD1 O 12.668 -3.481 6.010 1.00 . A A . 45 ASP OD1 1 1 11 8113 1 1 45 ASP OD2 O 11.382 -2.590 7.552 1.00 . A A . 45 ASP OD2 1 1 11 8114 1 1 46 TYR C C 7.881 1.009 2.718 1.00 . A A . 46 TYR C 1 1 11 8115 1 1 46 TYR CA C 7.560 -0.491 2.456 1.00 . A A . 46 TYR CA 1 1 11 8116 1 1 46 TYR CB C 6.028 -0.727 2.315 1.00 . A A . 46 TYR CB 1 1 11 8117 1 1 46 TYR CD1 C 5.361 0.184 0.049 1.00 . A A . 46 TYR CD1 1 1 11 8118 1 1 46 TYR CD2 C 4.722 1.378 1.977 1.00 . A A . 46 TYR CD2 1 1 11 8119 1 1 46 TYR CE1 C 4.778 1.160 -0.747 1.00 . A A . 46 TYR CE1 1 1 11 8120 1 1 46 TYR CE2 C 4.131 2.331 1.195 1.00 . A A . 46 TYR CE2 1 1 11 8121 1 1 46 TYR CG C 5.352 0.293 1.427 1.00 . A A . 46 TYR CG 1 1 11 8122 1 1 46 TYR CZ C 4.165 2.219 -0.148 1.00 . A A . 46 TYR CZ 1 1 11 8123 1 1 46 TYR H H 7.635 -1.855 4.099 1.00 . A A . 46 TYR H 1 1 11 8124 1 1 46 TYR HA H 8.015 -0.745 1.510 1.00 . A A . 46 TYR HA 1 1 11 8125 1 1 46 TYR HB2 H 5.850 -1.689 1.858 1.00 . A A . 46 TYR HB2 1 1 11 8126 1 1 46 TYR HB3 H 5.554 -0.686 3.284 1.00 . A A . 46 TYR HB3 1 1 11 8127 1 1 46 TYR HD1 H 5.855 -0.663 -0.399 1.00 . A A . 46 TYR HD1 1 1 11 8128 1 1 46 TYR HD2 H 4.684 1.472 3.050 1.00 . A A . 46 TYR HD2 1 1 11 8129 1 1 46 TYR HE1 H 4.745 1.111 -1.830 1.00 . A A . 46 TYR HE1 1 1 11 8130 1 1 46 TYR HE2 H 3.630 3.191 1.611 1.00 . A A . 46 TYR HE2 1 1 11 8131 1 1 46 TYR HH H 3.133 2.715 -1.597 1.00 . A A . 46 TYR HH 1 1 11 8132 1 1 46 TYR N N 8.165 -1.391 3.419 1.00 . A A . 46 TYR N 1 1 11 8133 1 1 46 TYR O O 7.531 1.587 3.756 1.00 . A A . 46 TYR O 1 1 11 8134 1 1 46 TYR OH O 3.608 3.184 -0.907 1.00 . A A . 46 TYR OH 1 1 11 8135 1 1 47 ILE C C 7.972 3.631 0.664 1.00 . A A . 47 ILE C 1 1 11 8136 1 1 47 ILE CA C 8.874 3.008 1.741 1.00 . A A . 47 ILE CA 1 1 11 8137 1 1 47 ILE CB C 10.387 3.228 1.376 1.00 . A A . 47 ILE CB 1 1 11 8138 1 1 47 ILE CD1 C 11.145 2.879 3.819 1.00 . A A . 47 ILE CD1 1 1 11 8139 1 1 47 ILE CG1 C 11.300 2.469 2.362 1.00 . A A . 47 ILE CG1 1 1 11 8140 1 1 47 ILE CG2 C 10.755 4.712 1.329 1.00 . A A . 47 ILE CG2 1 1 11 8141 1 1 47 ILE H H 8.835 0.969 1.063 1.00 . A A . 47 ILE H 1 1 11 8142 1 1 47 ILE HA H 8.648 3.437 2.706 1.00 . A A . 47 ILE HA 1 1 11 8143 1 1 47 ILE HB H 10.538 2.830 0.382 1.00 . A A . 47 ILE HB 1 1 11 8144 1 1 47 ILE HD11 H 11.348 3.932 3.935 1.00 . A A . 47 ILE HD11 1 1 11 8145 1 1 47 ILE HD12 H 11.838 2.312 4.423 1.00 . A A . 47 ILE HD12 1 1 11 8146 1 1 47 ILE HD13 H 10.141 2.670 4.152 1.00 . A A . 47 ILE HD13 1 1 11 8147 1 1 47 ILE HG12 H 11.094 1.409 2.292 1.00 . A A . 47 ILE HG12 1 1 11 8148 1 1 47 ILE HG13 H 12.328 2.640 2.075 1.00 . A A . 47 ILE HG13 1 1 11 8149 1 1 47 ILE HG21 H 10.167 5.200 0.569 1.00 . A A . 47 ILE HG21 1 1 11 8150 1 1 47 ILE HG22 H 11.804 4.851 1.100 1.00 . A A . 47 ILE HG22 1 1 11 8151 1 1 47 ILE HG23 H 10.512 5.138 2.291 1.00 . A A . 47 ILE HG23 1 1 11 8152 1 1 47 ILE N N 8.558 1.593 1.763 1.00 . A A . 47 ILE N 1 1 11 8153 1 1 47 ILE O O 7.637 2.962 -0.297 1.00 . A A . 47 ILE O 1 1 11 8154 1 1 48 CYS C C 7.399 6.557 -0.922 1.00 . A A . 48 CYS C 1 1 11 8155 1 1 48 CYS CA C 6.653 5.469 -0.172 1.00 . A A . 48 CYS CA 1 1 11 8156 1 1 48 CYS CB C 5.426 6.114 0.495 1.00 . A A . 48 CYS CB 1 1 11 8157 1 1 48 CYS H H 7.822 5.495 1.524 1.00 . A A . 48 CYS H 1 1 11 8158 1 1 48 CYS HA H 6.332 4.697 -0.855 1.00 . A A . 48 CYS HA 1 1 11 8159 1 1 48 CYS HB2 H 4.670 6.254 -0.259 1.00 . A A . 48 CYS HB2 1 1 11 8160 1 1 48 CYS HB3 H 5.055 5.464 1.266 1.00 . A A . 48 CYS HB3 1 1 11 8161 1 1 48 CYS N N 7.550 4.882 0.818 1.00 . A A . 48 CYS N 1 1 11 8162 1 1 48 CYS O O 8.528 6.871 -0.581 1.00 . A A . 48 CYS O 1 1 11 8163 1 1 48 CYS SG S 5.746 7.746 1.238 1.00 . A A . 48 CYS SG 1 1 11 8164 1 1 49 ILE C C 7.721 9.451 -1.810 1.00 . A A . 49 ILE C 1 1 11 8165 1 1 49 ILE CA C 7.254 8.253 -2.693 1.00 . A A . 49 ILE CA 1 1 11 8166 1 1 49 ILE CB C 6.206 8.696 -3.751 1.00 . A A . 49 ILE CB 1 1 11 8167 1 1 49 ILE CD1 C 5.849 10.217 -5.730 1.00 . A A . 49 ILE CD1 1 1 11 8168 1 1 49 ILE CG1 C 6.715 9.870 -4.552 1.00 . A A . 49 ILE CG1 1 1 11 8169 1 1 49 ILE CG2 C 4.844 9.003 -3.117 1.00 . A A . 49 ILE CG2 1 1 11 8170 1 1 49 ILE H H 5.841 6.794 -2.099 1.00 . A A . 49 ILE H 1 1 11 8171 1 1 49 ILE HA H 8.128 7.910 -3.230 1.00 . A A . 49 ILE HA 1 1 11 8172 1 1 49 ILE HB H 6.065 7.857 -4.414 1.00 . A A . 49 ILE HB 1 1 11 8173 1 1 49 ILE HD11 H 4.816 10.348 -5.440 1.00 . A A . 49 ILE HD11 1 1 11 8174 1 1 49 ILE HD12 H 5.903 9.368 -6.395 1.00 . A A . 49 ILE HD12 1 1 11 8175 1 1 49 ILE HD13 H 6.208 11.100 -6.235 1.00 . A A . 49 ILE HD13 1 1 11 8176 1 1 49 ILE HG12 H 6.767 10.715 -3.885 1.00 . A A . 49 ILE HG12 1 1 11 8177 1 1 49 ILE HG13 H 7.707 9.635 -4.906 1.00 . A A . 49 ILE HG13 1 1 11 8178 1 1 49 ILE HG21 H 4.475 8.112 -2.632 1.00 . A A . 49 ILE HG21 1 1 11 8179 1 1 49 ILE HG22 H 4.142 9.311 -3.881 1.00 . A A . 49 ILE HG22 1 1 11 8180 1 1 49 ILE HG23 H 4.960 9.794 -2.389 1.00 . A A . 49 ILE HG23 1 1 11 8181 1 1 49 ILE N N 6.730 7.151 -1.899 1.00 . A A . 49 ILE N 1 1 11 8182 1 1 49 ILE O O 8.794 10.025 -2.034 1.00 . A A . 49 ILE O 1 1 11 8183 1 1 50 ASN C C 8.395 10.514 1.073 1.00 . A A . 50 ASN C 1 1 11 8184 1 1 50 ASN CA C 7.271 10.892 0.115 1.00 . A A . 50 ASN CA 1 1 11 8185 1 1 50 ASN CB C 6.032 11.380 0.894 1.00 . A A . 50 ASN CB 1 1 11 8186 1 1 50 ASN CG C 4.943 11.929 -0.005 1.00 . A A . 50 ASN CG 1 1 11 8187 1 1 50 ASN H H 6.148 9.239 -0.602 1.00 . A A . 50 ASN H 1 1 11 8188 1 1 50 ASN HA H 7.626 11.693 -0.516 1.00 . A A . 50 ASN HA 1 1 11 8189 1 1 50 ASN HB2 H 5.617 10.560 1.462 1.00 . A A . 50 ASN HB2 1 1 11 8190 1 1 50 ASN HB3 H 6.332 12.154 1.584 1.00 . A A . 50 ASN HB3 1 1 11 8191 1 1 50 ASN HD21 H 5.679 13.770 0.133 1.00 . A A . 50 ASN HD21 1 1 11 8192 1 1 50 ASN HD22 H 4.272 13.598 -0.822 1.00 . A A . 50 ASN HD22 1 1 11 8193 1 1 50 ASN N N 6.950 9.773 -0.780 1.00 . A A . 50 ASN N 1 1 11 8194 1 1 50 ASN ND2 N 4.974 13.213 -0.255 1.00 . A A . 50 ASN ND2 1 1 11 8195 1 1 50 ASN O O 9.212 11.346 1.448 1.00 . A A . 50 ASN O 1 1 11 8196 1 1 50 ASN OD1 O 4.074 11.198 -0.470 1.00 . A A . 50 ASN OD1 1 1 11 8197 1 1 51 CYS C C 10.805 8.595 1.522 1.00 . A A . 51 CYS C 1 1 11 8198 1 1 51 CYS CA C 9.504 8.737 2.312 1.00 . A A . 51 CYS CA 1 1 11 8199 1 1 51 CYS CB C 9.146 7.376 2.951 1.00 . A A . 51 CYS CB 1 1 11 8200 1 1 51 CYS H H 7.741 8.640 1.126 1.00 . A A . 51 CYS H 1 1 11 8201 1 1 51 CYS HA H 9.667 9.463 3.096 1.00 . A A . 51 CYS HA 1 1 11 8202 1 1 51 CYS HB2 H 8.762 6.724 2.185 1.00 . A A . 51 CYS HB2 1 1 11 8203 1 1 51 CYS HB3 H 10.055 6.939 3.341 1.00 . A A . 51 CYS HB3 1 1 11 8204 1 1 51 CYS N N 8.440 9.241 1.454 1.00 . A A . 51 CYS N 1 1 11 8205 1 1 51 CYS O O 11.895 8.640 2.080 1.00 . A A . 51 CYS O 1 1 11 8206 1 1 51 CYS SG S 7.913 7.377 4.285 1.00 . A A . 51 CYS SG 1 1 11 8207 1 1 52 ALA C C 12.364 9.588 -1.181 1.00 . A A . 52 ALA C 1 1 11 8208 1 1 52 ALA CA C 11.842 8.241 -0.654 1.00 . A A . 52 ALA CA 1 1 11 8209 1 1 52 ALA CB C 11.497 7.327 -1.818 1.00 . A A . 52 ALA CB 1 1 11 8210 1 1 52 ALA H H 9.779 8.443 -0.178 1.00 . A A . 52 ALA H 1 1 11 8211 1 1 52 ALA HA H 12.573 7.733 -0.034 1.00 . A A . 52 ALA HA 1 1 11 8212 1 1 52 ALA HB1 H 12.370 7.155 -2.430 1.00 . A A . 52 ALA HB1 1 1 11 8213 1 1 52 ALA HB2 H 10.720 7.792 -2.408 1.00 . A A . 52 ALA HB2 1 1 11 8214 1 1 52 ALA HB3 H 11.146 6.384 -1.422 1.00 . A A . 52 ALA HB3 1 1 11 8215 1 1 52 ALA N N 10.678 8.422 0.213 1.00 . A A . 52 ALA N 1 1 11 8216 2 2 1 ZN ZN ZN 5.778 7.653 3.517 1.00 . B A . 53 ZN ZN 1 1 11 8217 3 2 1 ZN ZN ZN -5.212 2.862 -2.037 1.00 . C A . 54 ZN ZN 1 1 12 8218 1 1 1 SER C C -11.297 5.686 1.739 1.00 . A A . 1 SER C 1 1 12 8219 1 1 1 SER CA C -12.254 5.760 2.956 1.00 . A A . 1 SER CA 1 1 12 8220 1 1 1 SER CB C -12.467 4.357 3.579 1.00 . A A . 1 SER CB 1 1 12 8221 1 1 1 SER HA H -11.811 6.418 3.688 1.00 . A A . 1 SER HA 1 1 12 8222 1 1 1 SER HB2 H -13.200 4.426 4.369 1.00 . A A . 1 SER HB2 1 1 12 8223 1 1 1 SER HB3 H -12.838 3.702 2.803 1.00 . A A . 1 SER HB3 1 1 12 8224 1 1 1 SER HG H -11.371 3.730 5.067 1.00 . A A . 1 SER HG 1 1 12 8225 1 1 1 SER N N -13.556 6.342 2.559 1.00 . A A . 1 SER N 1 1 12 8226 1 1 1 SER O O -11.422 4.807 0.860 1.00 . A A . 1 SER O 1 1 12 8227 1 1 1 SER OG O -11.260 3.808 4.113 1.00 . A A . 1 SER OG 1 1 12 8228 1 1 2 VAL C C -8.050 6.569 1.255 1.00 . A A . 2 VAL C 1 1 12 8229 1 1 2 VAL CA C -9.407 6.678 0.603 1.00 . A A . 2 VAL CA 1 1 12 8230 1 1 2 VAL CB C -9.513 8.008 -0.218 1.00 . A A . 2 VAL CB 1 1 12 8231 1 1 2 VAL CG1 C -8.502 8.049 -1.356 1.00 . A A . 2 VAL CG1 1 1 12 8232 1 1 2 VAL CG2 C -10.929 8.215 -0.757 1.00 . A A . 2 VAL CG2 1 1 12 8233 1 1 2 VAL H H -10.319 7.321 2.353 1.00 . A A . 2 VAL H 1 1 12 8234 1 1 2 VAL HA H -9.565 5.827 -0.044 1.00 . A A . 2 VAL HA 1 1 12 8235 1 1 2 VAL HB H -9.286 8.819 0.455 1.00 . A A . 2 VAL HB 1 1 12 8236 1 1 2 VAL HG11 H -7.512 7.993 -0.931 1.00 . A A . 2 VAL HG11 1 1 12 8237 1 1 2 VAL HG12 H -8.612 8.963 -1.918 1.00 . A A . 2 VAL HG12 1 1 12 8238 1 1 2 VAL HG13 H -8.655 7.203 -2.012 1.00 . A A . 2 VAL HG13 1 1 12 8239 1 1 2 VAL HG21 H -11.629 8.205 0.066 1.00 . A A . 2 VAL HG21 1 1 12 8240 1 1 2 VAL HG22 H -11.166 7.407 -1.434 1.00 . A A . 2 VAL HG22 1 1 12 8241 1 1 2 VAL HG23 H -10.989 9.154 -1.286 1.00 . A A . 2 VAL HG23 1 1 12 8242 1 1 2 VAL N N -10.385 6.626 1.661 1.00 . A A . 2 VAL N 1 1 12 8243 1 1 2 VAL O O -7.842 7.147 2.310 1.00 . A A . 2 VAL O 1 1 12 8244 1 1 3 CYS C C -4.832 6.640 0.724 1.00 . A A . 3 CYS C 1 1 12 8245 1 1 3 CYS CA C -5.858 5.627 1.292 1.00 . A A . 3 CYS CA 1 1 12 8246 1 1 3 CYS CB C -5.377 4.183 1.058 1.00 . A A . 3 CYS CB 1 1 12 8247 1 1 3 CYS H H -7.309 5.401 -0.199 1.00 . A A . 3 CYS H 1 1 12 8248 1 1 3 CYS HA H -5.978 5.798 2.353 1.00 . A A . 3 CYS HA 1 1 12 8249 1 1 3 CYS HB2 H -4.876 3.820 1.942 1.00 . A A . 3 CYS HB2 1 1 12 8250 1 1 3 CYS HB3 H -6.245 3.573 0.860 1.00 . A A . 3 CYS HB3 1 1 12 8251 1 1 3 CYS N N -7.144 5.830 0.665 1.00 . A A . 3 CYS N 1 1 12 8252 1 1 3 CYS O O -5.189 7.540 -0.055 1.00 . A A . 3 CYS O 1 1 12 8253 1 1 3 CYS SG S -4.229 3.984 -0.325 1.00 . A A . 3 CYS SG 1 1 12 8254 1 1 4 ALA C C -1.908 6.685 -0.639 1.00 . A A . 4 ALA C 1 1 12 8255 1 1 4 ALA CA C -2.513 7.312 0.616 1.00 . A A . 4 ALA CA 1 1 12 8256 1 1 4 ALA CB C -1.437 7.470 1.683 1.00 . A A . 4 ALA CB 1 1 12 8257 1 1 4 ALA H H -3.377 5.685 1.654 1.00 . A A . 4 ALA H 1 1 12 8258 1 1 4 ALA HA H -2.925 8.283 0.379 1.00 . A A . 4 ALA HA 1 1 12 8259 1 1 4 ALA HB1 H -1.027 6.499 1.923 1.00 . A A . 4 ALA HB1 1 1 12 8260 1 1 4 ALA HB2 H -1.853 7.922 2.572 1.00 . A A . 4 ALA HB2 1 1 12 8261 1 1 4 ALA HB3 H -0.648 8.098 1.293 1.00 . A A . 4 ALA HB3 1 1 12 8262 1 1 4 ALA N N -3.581 6.468 1.095 1.00 . A A . 4 ALA N 1 1 12 8263 1 1 4 ALA O O -1.521 5.535 -0.621 1.00 . A A . 4 ALA O 1 1 12 8264 1 1 5 ALA C C -1.524 8.183 -3.969 1.00 . A A . 5 ALA C 1 1 12 8265 1 1 5 ALA CA C -1.290 7.064 -2.996 1.00 . A A . 5 ALA CA 1 1 12 8266 1 1 5 ALA CB C -1.836 5.743 -3.594 1.00 . A A . 5 ALA CB 1 1 12 8267 1 1 5 ALA H H -2.518 8.213 -1.748 1.00 . A A . 5 ALA H 1 1 12 8268 1 1 5 ALA HA H -0.229 6.966 -2.818 1.00 . A A . 5 ALA HA 1 1 12 8269 1 1 5 ALA HB1 H -1.684 4.913 -2.918 1.00 . A A . 5 ALA HB1 1 1 12 8270 1 1 5 ALA HB2 H -1.330 5.505 -4.520 1.00 . A A . 5 ALA HB2 1 1 12 8271 1 1 5 ALA HB3 H -2.892 5.846 -3.794 1.00 . A A . 5 ALA HB3 1 1 12 8272 1 1 5 ALA N N -1.953 7.416 -1.737 1.00 . A A . 5 ALA N 1 1 12 8273 1 1 5 ALA O O -2.560 8.840 -3.896 1.00 . A A . 5 ALA O 1 1 12 8274 1 1 6 GLN C C -1.981 9.221 -6.704 1.00 . A A . 6 GLN C 1 1 12 8275 1 1 6 GLN CA C -0.661 9.418 -5.934 1.00 . A A . 6 GLN CA 1 1 12 8276 1 1 6 GLN CB C 0.530 9.231 -6.893 1.00 . A A . 6 GLN CB 1 1 12 8277 1 1 6 GLN CD C 3.009 9.046 -7.212 1.00 . A A . 6 GLN CD 1 1 12 8278 1 1 6 GLN CG C 1.892 9.535 -6.309 1.00 . A A . 6 GLN CG 1 1 12 8279 1 1 6 GLN H H 0.360 8.088 -4.703 1.00 . A A . 6 GLN H 1 1 12 8280 1 1 6 GLN HA H -0.622 10.413 -5.517 1.00 . A A . 6 GLN HA 1 1 12 8281 1 1 6 GLN HB2 H 0.592 8.198 -7.189 1.00 . A A . 6 GLN HB2 1 1 12 8282 1 1 6 GLN HB3 H 0.401 9.836 -7.775 1.00 . A A . 6 GLN HB3 1 1 12 8283 1 1 6 GLN HE21 H 2.994 10.735 -8.212 1.00 . A A . 6 GLN HE21 1 1 12 8284 1 1 6 GLN HE22 H 4.144 9.560 -8.742 1.00 . A A . 6 GLN HE22 1 1 12 8285 1 1 6 GLN HG2 H 1.989 10.599 -6.162 1.00 . A A . 6 GLN HG2 1 1 12 8286 1 1 6 GLN HG3 H 1.980 9.037 -5.355 1.00 . A A . 6 GLN HG3 1 1 12 8287 1 1 6 GLN N N -0.541 8.433 -4.836 1.00 . A A . 6 GLN N 1 1 12 8288 1 1 6 GLN NE2 N 3.424 9.855 -8.143 1.00 . A A . 6 GLN NE2 1 1 12 8289 1 1 6 GLN O O -2.667 10.179 -7.037 1.00 . A A . 6 GLN O 1 1 12 8290 1 1 6 GLN OE1 O 3.472 7.922 -7.069 1.00 . A A . 6 GLN OE1 1 1 12 8291 1 1 7 ASN C C -4.143 6.408 -6.938 1.00 . A A . 7 ASN C 1 1 12 8292 1 1 7 ASN CA C -3.587 7.655 -7.567 1.00 . A A . 7 ASN CA 1 1 12 8293 1 1 7 ASN CB C -3.504 7.525 -9.095 1.00 . A A . 7 ASN CB 1 1 12 8294 1 1 7 ASN CG C -4.871 7.296 -9.756 1.00 . A A . 7 ASN CG 1 1 12 8295 1 1 7 ASN H H -1.583 7.383 -6.703 1.00 . A A . 7 ASN H 1 1 12 8296 1 1 7 ASN HA H -4.259 8.461 -7.320 1.00 . A A . 7 ASN HA 1 1 12 8297 1 1 7 ASN HB2 H -3.085 8.431 -9.516 1.00 . A A . 7 ASN HB2 1 1 12 8298 1 1 7 ASN HB3 H -2.871 6.683 -9.327 1.00 . A A . 7 ASN HB3 1 1 12 8299 1 1 7 ASN HD21 H -4.649 5.321 -9.685 1.00 . A A . 7 ASN HD21 1 1 12 8300 1 1 7 ASN HD22 H -6.113 5.909 -10.389 1.00 . A A . 7 ASN HD22 1 1 12 8301 1 1 7 ASN N N -2.308 7.982 -6.968 1.00 . A A . 7 ASN N 1 1 12 8302 1 1 7 ASN ND2 N -5.244 6.052 -9.957 1.00 . A A . 7 ASN ND2 1 1 12 8303 1 1 7 ASN O O -3.717 5.291 -7.259 1.00 . A A . 7 ASN O 1 1 12 8304 1 1 7 ASN OD1 O -5.575 8.238 -10.094 1.00 . A A . 7 ASN OD1 1 1 12 8305 1 1 8 CYS C C -6.881 4.994 -6.117 1.00 . A A . 8 CYS C 1 1 12 8306 1 1 8 CYS CA C -5.639 5.440 -5.386 1.00 . A A . 8 CYS CA 1 1 12 8307 1 1 8 CYS CB C -5.916 5.641 -3.888 1.00 . A A . 8 CYS CB 1 1 12 8308 1 1 8 CYS H H -5.381 7.469 -5.771 1.00 . A A . 8 CYS H 1 1 12 8309 1 1 8 CYS HA H -4.898 4.667 -5.498 1.00 . A A . 8 CYS HA 1 1 12 8310 1 1 8 CYS HB2 H -4.979 5.829 -3.385 1.00 . A A . 8 CYS HB2 1 1 12 8311 1 1 8 CYS HB3 H -6.588 6.479 -3.754 1.00 . A A . 8 CYS HB3 1 1 12 8312 1 1 8 CYS N N -5.062 6.574 -6.014 1.00 . A A . 8 CYS N 1 1 12 8313 1 1 8 CYS O O -7.847 5.734 -6.250 1.00 . A A . 8 CYS O 1 1 12 8314 1 1 8 CYS SG S -6.683 4.187 -3.095 1.00 . A A . 8 CYS SG 1 1 12 8315 1 1 9 GLN C C -9.108 2.804 -6.378 1.00 . A A . 9 GLN C 1 1 12 8316 1 1 9 GLN CA C -7.922 3.116 -7.314 1.00 . A A . 9 GLN CA 1 1 12 8317 1 1 9 GLN CB C -7.375 1.806 -7.896 1.00 . A A . 9 GLN CB 1 1 12 8318 1 1 9 GLN CD C -5.588 0.678 -9.288 1.00 . A A . 9 GLN CD 1 1 12 8319 1 1 9 GLN CG C -6.142 1.987 -8.777 1.00 . A A . 9 GLN CG 1 1 12 8320 1 1 9 GLN H H -6.004 3.267 -6.447 1.00 . A A . 9 GLN H 1 1 12 8321 1 1 9 GLN HA H -8.237 3.749 -8.131 1.00 . A A . 9 GLN HA 1 1 12 8322 1 1 9 GLN HB2 H -7.102 1.161 -7.073 1.00 . A A . 9 GLN HB2 1 1 12 8323 1 1 9 GLN HB3 H -8.135 1.304 -8.470 1.00 . A A . 9 GLN HB3 1 1 12 8324 1 1 9 GLN HE21 H -3.738 1.408 -9.282 1.00 . A A . 9 GLN HE21 1 1 12 8325 1 1 9 GLN HE22 H -3.906 -0.203 -9.832 1.00 . A A . 9 GLN HE22 1 1 12 8326 1 1 9 GLN HG2 H -6.399 2.605 -9.622 1.00 . A A . 9 GLN HG2 1 1 12 8327 1 1 9 GLN HG3 H -5.377 2.480 -8.194 1.00 . A A . 9 GLN HG3 1 1 12 8328 1 1 9 GLN N N -6.833 3.765 -6.576 1.00 . A A . 9 GLN N 1 1 12 8329 1 1 9 GLN NE2 N -4.291 0.624 -9.477 1.00 . A A . 9 GLN NE2 1 1 12 8330 1 1 9 GLN O O -10.170 2.409 -6.826 1.00 . A A . 9 GLN O 1 1 12 8331 1 1 9 GLN OE1 O -6.318 -0.289 -9.493 1.00 . A A . 9 GLN OE1 1 1 12 8332 1 1 10 ARG C C -10.368 1.264 -4.084 1.00 . A A . 10 ARG C 1 1 12 8333 1 1 10 ARG CA C -9.792 2.707 -3.977 1.00 . A A . 10 ARG CA 1 1 12 8334 1 1 10 ARG CB C -10.905 3.775 -3.880 1.00 . A A . 10 ARG CB 1 1 12 8335 1 1 10 ARG CD C -12.804 4.774 -2.532 1.00 . A A . 10 ARG CD 1 1 12 8336 1 1 10 ARG CG C -11.720 3.703 -2.591 1.00 . A A . 10 ARG CG 1 1 12 8337 1 1 10 ARG CZ C -14.660 5.371 -0.963 1.00 . A A . 10 ARG CZ 1 1 12 8338 1 1 10 ARG H H -8.011 3.429 -4.856 1.00 . A A . 10 ARG H 1 1 12 8339 1 1 10 ARG HA H -9.211 2.727 -3.063 1.00 . A A . 10 ARG HA 1 1 12 8340 1 1 10 ARG HB2 H -10.445 4.747 -3.956 1.00 . A A . 10 ARG HB2 1 1 12 8341 1 1 10 ARG HB3 H -11.570 3.639 -4.722 1.00 . A A . 10 ARG HB3 1 1 12 8342 1 1 10 ARG HD2 H -12.361 5.749 -2.688 1.00 . A A . 10 ARG HD2 1 1 12 8343 1 1 10 ARG HD3 H -13.526 4.578 -3.312 1.00 . A A . 10 ARG HD3 1 1 12 8344 1 1 10 ARG HE H -13.022 4.274 -0.517 1.00 . A A . 10 ARG HE 1 1 12 8345 1 1 10 ARG HG2 H -12.182 2.728 -2.534 1.00 . A A . 10 ARG HG2 1 1 12 8346 1 1 10 ARG HG3 H -11.054 3.827 -1.746 1.00 . A A . 10 ARG HG3 1 1 12 8347 1 1 10 ARG HH11 H -14.959 6.131 -2.847 1.00 . A A . 10 ARG HH11 1 1 12 8348 1 1 10 ARG HH12 H -16.183 6.483 -1.713 1.00 . A A . 10 ARG HH12 1 1 12 8349 1 1 10 ARG HH21 H -14.761 4.818 1.028 1.00 . A A . 10 ARG HH21 1 1 12 8350 1 1 10 ARG HH22 H -16.039 5.776 0.471 1.00 . A A . 10 ARG HH22 1 1 12 8351 1 1 10 ARG N N -8.867 3.013 -5.075 1.00 . A A . 10 ARG N 1 1 12 8352 1 1 10 ARG NE N -13.496 4.761 -1.229 1.00 . A A . 10 ARG NE 1 1 12 8353 1 1 10 ARG NH1 N -15.301 6.041 -1.911 1.00 . A A . 10 ARG NH1 1 1 12 8354 1 1 10 ARG NH2 N -15.180 5.306 0.258 1.00 . A A . 10 ARG NH2 1 1 12 8355 1 1 10 ARG O O -11.579 1.067 -4.077 1.00 . A A . 10 ARG O 1 1 12 8356 1 1 11 PRO C C -10.443 -1.668 -2.947 1.00 . A A . 11 PRO C 1 1 12 8357 1 1 11 PRO CA C -9.936 -1.170 -4.283 1.00 . A A . 11 PRO CA 1 1 12 8358 1 1 11 PRO CB C -8.673 -1.958 -4.680 1.00 . A A . 11 PRO CB 1 1 12 8359 1 1 11 PRO CD C -8.022 0.280 -4.226 1.00 . A A . 11 PRO CD 1 1 12 8360 1 1 11 PRO CG C -7.666 -0.924 -5.026 1.00 . A A . 11 PRO CG 1 1 12 8361 1 1 11 PRO HA H -10.700 -1.303 -5.037 1.00 . A A . 11 PRO HA 1 1 12 8362 1 1 11 PRO HB2 H -8.347 -2.571 -3.850 1.00 . A A . 11 PRO HB2 1 1 12 8363 1 1 11 PRO HB3 H -8.895 -2.584 -5.533 1.00 . A A . 11 PRO HB3 1 1 12 8364 1 1 11 PRO HD2 H -7.590 0.234 -3.238 1.00 . A A . 11 PRO HD2 1 1 12 8365 1 1 11 PRO HD3 H -7.703 1.174 -4.739 1.00 . A A . 11 PRO HD3 1 1 12 8366 1 1 11 PRO HG2 H -6.681 -1.278 -4.756 1.00 . A A . 11 PRO HG2 1 1 12 8367 1 1 11 PRO HG3 H -7.698 -0.699 -6.083 1.00 . A A . 11 PRO HG3 1 1 12 8368 1 1 11 PRO N N -9.481 0.210 -4.188 1.00 . A A . 11 PRO N 1 1 12 8369 1 1 11 PRO O O -9.756 -1.514 -1.902 1.00 . A A . 11 PRO O 1 1 12 8370 1 1 12 CYS C C -12.528 -4.271 -1.962 1.00 . A A . 12 CYS C 1 1 12 8371 1 1 12 CYS CA C -12.200 -2.794 -1.778 1.00 . A A . 12 CYS CA 1 1 12 8372 1 1 12 CYS CB C -13.474 -1.995 -1.431 1.00 . A A . 12 CYS CB 1 1 12 8373 1 1 12 CYS H H -12.095 -2.393 -3.802 1.00 . A A . 12 CYS H 1 1 12 8374 1 1 12 CYS HA H -11.495 -2.677 -0.969 1.00 . A A . 12 CYS HA 1 1 12 8375 1 1 12 CYS HB2 H -13.213 -0.954 -1.347 1.00 . A A . 12 CYS HB2 1 1 12 8376 1 1 12 CYS HB3 H -14.199 -2.112 -2.222 1.00 . A A . 12 CYS HB3 1 1 12 8377 1 1 12 CYS HG H -13.522 -3.357 0.745 1.00 . A A . 12 CYS HG 1 1 12 8378 1 1 12 CYS N N -11.600 -2.275 -2.966 1.00 . A A . 12 CYS N 1 1 12 8379 1 1 12 CYS O O -13.381 -4.624 -2.757 1.00 . A A . 12 CYS O 1 1 12 8380 1 1 12 CYS SG S -14.280 -2.470 0.121 1.00 . A A . 12 CYS SG 1 1 12 8381 1 1 13 LYS C C -11.899 -6.973 0.193 1.00 . A A . 13 LYS C 1 1 12 8382 1 1 13 LYS CA C -12.055 -6.535 -1.226 1.00 . A A . 13 LYS CA 1 1 12 8383 1 1 13 LYS CB C -11.107 -7.351 -2.130 1.00 . A A . 13 LYS CB 1 1 12 8384 1 1 13 LYS CD C -10.346 -8.021 -4.408 1.00 . A A . 13 LYS CD 1 1 12 8385 1 1 13 LYS CE C -10.379 -7.727 -5.901 1.00 . A A . 13 LYS CE 1 1 12 8386 1 1 13 LYS CG C -11.182 -7.039 -3.619 1.00 . A A . 13 LYS CG 1 1 12 8387 1 1 13 LYS H H -11.055 -4.787 -0.712 1.00 . A A . 13 LYS H 1 1 12 8388 1 1 13 LYS HA H -13.076 -6.705 -1.511 1.00 . A A . 13 LYS HA 1 1 12 8389 1 1 13 LYS HB2 H -10.095 -7.148 -1.816 1.00 . A A . 13 LYS HB2 1 1 12 8390 1 1 13 LYS HB3 H -11.327 -8.399 -1.982 1.00 . A A . 13 LYS HB3 1 1 12 8391 1 1 13 LYS HD2 H -9.324 -7.974 -4.059 1.00 . A A . 13 LYS HD2 1 1 12 8392 1 1 13 LYS HD3 H -10.729 -9.018 -4.241 1.00 . A A . 13 LYS HD3 1 1 12 8393 1 1 13 LYS HE2 H -11.401 -7.630 -6.238 1.00 . A A . 13 LYS HE2 1 1 12 8394 1 1 13 LYS HE3 H -9.861 -6.797 -6.080 1.00 . A A . 13 LYS HE3 1 1 12 8395 1 1 13 LYS HG2 H -12.208 -7.109 -3.946 1.00 . A A . 13 LYS HG2 1 1 12 8396 1 1 13 LYS HG3 H -10.818 -6.039 -3.801 1.00 . A A . 13 LYS HG3 1 1 12 8397 1 1 13 LYS HZ1 H -10.229 -9.699 -6.534 1.00 . A A . 13 LYS HZ1 1 1 12 8398 1 1 13 LYS HZ2 H -8.723 -8.945 -6.378 1.00 . A A . 13 LYS HZ2 1 1 12 8399 1 1 13 LYS HZ3 H -9.710 -8.596 -7.698 1.00 . A A . 13 LYS HZ3 1 1 12 8400 1 1 13 LYS N N -11.799 -5.110 -1.264 1.00 . A A . 13 LYS N 1 1 12 8401 1 1 13 LYS NZ N -9.710 -8.805 -6.679 1.00 . A A . 13 LYS NZ 1 1 12 8402 1 1 13 LYS O O -11.236 -6.281 0.968 1.00 . A A . 13 LYS O 1 1 12 8403 1 1 14 ASP C C -11.035 -9.087 2.197 1.00 . A A . 14 ASP C 1 1 12 8404 1 1 14 ASP CA C -12.436 -8.590 1.912 1.00 . A A . 14 ASP CA 1 1 12 8405 1 1 14 ASP CB C -13.449 -9.719 2.137 1.00 . A A . 14 ASP CB 1 1 12 8406 1 1 14 ASP CG C -14.881 -9.281 1.889 1.00 . A A . 14 ASP CG 1 1 12 8407 1 1 14 ASP H H -13.071 -8.543 -0.114 1.00 . A A . 14 ASP H 1 1 12 8408 1 1 14 ASP HA H -12.660 -7.782 2.592 1.00 . A A . 14 ASP HA 1 1 12 8409 1 1 14 ASP HB2 H -13.228 -10.527 1.453 1.00 . A A . 14 ASP HB2 1 1 12 8410 1 1 14 ASP HB3 H -13.366 -10.065 3.155 1.00 . A A . 14 ASP HB3 1 1 12 8411 1 1 14 ASP N N -12.521 -8.073 0.549 1.00 . A A . 14 ASP N 1 1 12 8412 1 1 14 ASP O O -10.416 -8.731 3.199 1.00 . A A . 14 ASP O 1 1 12 8413 1 1 14 ASP OD1 O -15.530 -8.742 2.806 1.00 . A A . 14 ASP OD1 1 1 12 8414 1 1 14 ASP OD2 O -15.356 -9.487 0.769 1.00 . A A . 14 ASP OD2 1 1 12 8415 1 1 15 LYS C C -8.207 -9.716 0.569 1.00 . A A . 15 LYS C 1 1 12 8416 1 1 15 LYS CA C -9.192 -10.436 1.491 1.00 . A A . 15 LYS CA 1 1 12 8417 1 1 15 LYS CB C -9.223 -11.952 1.238 1.00 . A A . 15 LYS CB 1 1 12 8418 1 1 15 LYS CD C -8.201 -14.218 1.268 1.00 . A A . 15 LYS CD 1 1 12 8419 1 1 15 LYS CE C -6.970 -15.090 1.469 1.00 . A A . 15 LYS CE 1 1 12 8420 1 1 15 LYS CG C -7.925 -12.724 1.462 1.00 . A A . 15 LYS CG 1 1 12 8421 1 1 15 LYS H H -10.991 -10.243 0.534 1.00 . A A . 15 LYS H 1 1 12 8422 1 1 15 LYS HA H -8.895 -10.258 2.511 1.00 . A A . 15 LYS HA 1 1 12 8423 1 1 15 LYS HB2 H -9.965 -12.363 1.905 1.00 . A A . 15 LYS HB2 1 1 12 8424 1 1 15 LYS HB3 H -9.552 -12.129 0.225 1.00 . A A . 15 LYS HB3 1 1 12 8425 1 1 15 LYS HD2 H -8.948 -14.512 1.988 1.00 . A A . 15 LYS HD2 1 1 12 8426 1 1 15 LYS HD3 H -8.588 -14.370 0.272 1.00 . A A . 15 LYS HD3 1 1 12 8427 1 1 15 LYS HE2 H -6.215 -14.811 0.749 1.00 . A A . 15 LYS HE2 1 1 12 8428 1 1 15 LYS HE3 H -6.575 -14.922 2.461 1.00 . A A . 15 LYS HE3 1 1 12 8429 1 1 15 LYS HG2 H -7.177 -12.389 0.753 1.00 . A A . 15 LYS HG2 1 1 12 8430 1 1 15 LYS HG3 H -7.591 -12.554 2.477 1.00 . A A . 15 LYS HG3 1 1 12 8431 1 1 15 LYS HZ1 H -7.928 -16.856 2.065 1.00 . A A . 15 LYS HZ1 1 1 12 8432 1 1 15 LYS HZ2 H -6.414 -17.095 1.402 1.00 . A A . 15 LYS HZ2 1 1 12 8433 1 1 15 LYS HZ3 H -7.742 -16.761 0.403 1.00 . A A . 15 LYS HZ3 1 1 12 8434 1 1 15 LYS N N -10.519 -9.907 1.322 1.00 . A A . 15 LYS N 1 1 12 8435 1 1 15 LYS NZ N -7.288 -16.541 1.311 1.00 . A A . 15 LYS NZ 1 1 12 8436 1 1 15 LYS O O -8.074 -10.050 -0.608 1.00 . A A . 15 LYS O 1 1 12 8437 1 1 16 VAL C C -5.647 -7.185 1.381 1.00 . A A . 16 VAL C 1 1 12 8438 1 1 16 VAL CA C -6.575 -7.907 0.396 1.00 . A A . 16 VAL CA 1 1 12 8439 1 1 16 VAL CB C -7.178 -6.895 -0.652 1.00 . A A . 16 VAL CB 1 1 12 8440 1 1 16 VAL CG1 C -8.162 -5.947 0.003 1.00 . A A . 16 VAL CG1 1 1 12 8441 1 1 16 VAL CG2 C -6.060 -6.099 -1.324 1.00 . A A . 16 VAL CG2 1 1 12 8442 1 1 16 VAL H H -7.809 -8.396 2.017 1.00 . A A . 16 VAL H 1 1 12 8443 1 1 16 VAL HA H -5.974 -8.632 -0.136 1.00 . A A . 16 VAL HA 1 1 12 8444 1 1 16 VAL HB H -7.698 -7.460 -1.409 1.00 . A A . 16 VAL HB 1 1 12 8445 1 1 16 VAL HG11 H -8.979 -6.513 0.428 1.00 . A A . 16 VAL HG11 1 1 12 8446 1 1 16 VAL HG12 H -8.531 -5.242 -0.730 1.00 . A A . 16 VAL HG12 1 1 12 8447 1 1 16 VAL HG13 H -7.631 -5.431 0.790 1.00 . A A . 16 VAL HG13 1 1 12 8448 1 1 16 VAL HG21 H -5.618 -5.497 -0.543 1.00 . A A . 16 VAL HG21 1 1 12 8449 1 1 16 VAL HG22 H -6.460 -5.445 -2.085 1.00 . A A . 16 VAL HG22 1 1 12 8450 1 1 16 VAL HG23 H -5.309 -6.761 -1.734 1.00 . A A . 16 VAL HG23 1 1 12 8451 1 1 16 VAL N N -7.588 -8.676 1.104 1.00 . A A . 16 VAL N 1 1 12 8452 1 1 16 VAL O O -6.098 -6.492 2.296 1.00 . A A . 16 VAL O 1 1 12 8453 1 1 17 ASP C C -3.113 -5.355 1.724 1.00 . A A . 17 ASP C 1 1 12 8454 1 1 17 ASP CA C -3.318 -6.837 2.034 1.00 . A A . 17 ASP CA 1 1 12 8455 1 1 17 ASP CB C -2.011 -7.574 1.822 1.00 . A A . 17 ASP CB 1 1 12 8456 1 1 17 ASP CG C -2.143 -9.034 2.082 1.00 . A A . 17 ASP CG 1 1 12 8457 1 1 17 ASP H H -4.191 -8.200 0.632 1.00 . A A . 17 ASP H 1 1 12 8458 1 1 17 ASP HA H -3.593 -6.938 3.073 1.00 . A A . 17 ASP HA 1 1 12 8459 1 1 17 ASP HB2 H -1.708 -7.450 0.790 1.00 . A A . 17 ASP HB2 1 1 12 8460 1 1 17 ASP HB3 H -1.252 -7.166 2.475 1.00 . A A . 17 ASP HB3 1 1 12 8461 1 1 17 ASP N N -4.382 -7.453 1.234 1.00 . A A . 17 ASP N 1 1 12 8462 1 1 17 ASP O O -3.433 -4.862 0.624 1.00 . A A . 17 ASP O 1 1 12 8463 1 1 17 ASP OD1 O -2.496 -9.760 1.125 1.00 . A A . 17 ASP OD1 1 1 12 8464 1 1 17 ASP OD2 O -1.937 -9.460 3.214 1.00 . A A . 17 ASP OD2 1 1 12 8465 1 1 18 TRP C C -0.833 -3.046 3.132 1.00 . A A . 18 TRP C 1 1 12 8466 1 1 18 TRP CA C -2.259 -3.248 2.668 1.00 . A A . 18 TRP CA 1 1 12 8467 1 1 18 TRP CB C -3.200 -2.512 3.641 1.00 . A A . 18 TRP CB 1 1 12 8468 1 1 18 TRP CD1 C -5.484 -3.572 3.104 1.00 . A A . 18 TRP CD1 1 1 12 8469 1 1 18 TRP CD2 C -5.478 -1.344 3.084 1.00 . A A . 18 TRP CD2 1 1 12 8470 1 1 18 TRP CE2 C -6.783 -1.786 2.783 1.00 . A A . 18 TRP CE2 1 1 12 8471 1 1 18 TRP CE3 C -5.225 0.034 3.136 1.00 . A A . 18 TRP CE3 1 1 12 8472 1 1 18 TRP CG C -4.664 -2.501 3.269 1.00 . A A . 18 TRP CG 1 1 12 8473 1 1 18 TRP CH2 C -7.551 0.441 2.607 1.00 . A A . 18 TRP CH2 1 1 12 8474 1 1 18 TRP CZ2 C -7.828 -0.903 2.543 1.00 . A A . 18 TRP CZ2 1 1 12 8475 1 1 18 TRP CZ3 C -6.261 0.907 2.899 1.00 . A A . 18 TRP CZ3 1 1 12 8476 1 1 18 TRP H H -2.228 -5.161 3.483 1.00 . A A . 18 TRP H 1 1 12 8477 1 1 18 TRP HA H -2.384 -2.855 1.671 1.00 . A A . 18 TRP HA 1 1 12 8478 1 1 18 TRP HB2 H -3.137 -2.993 4.607 1.00 . A A . 18 TRP HB2 1 1 12 8479 1 1 18 TRP HB3 H -2.864 -1.489 3.734 1.00 . A A . 18 TRP HB3 1 1 12 8480 1 1 18 TRP HD1 H -5.167 -4.599 3.179 1.00 . A A . 18 TRP HD1 1 1 12 8481 1 1 18 TRP HE1 H -7.493 -3.780 2.606 1.00 . A A . 18 TRP HE1 1 1 12 8482 1 1 18 TRP HE3 H -4.235 0.405 3.358 1.00 . A A . 18 TRP HE3 1 1 12 8483 1 1 18 TRP HH2 H -8.338 1.157 2.423 1.00 . A A . 18 TRP HH2 1 1 12 8484 1 1 18 TRP HZ2 H -8.828 -1.244 2.319 1.00 . A A . 18 TRP HZ2 1 1 12 8485 1 1 18 TRP HZ3 H -6.073 1.969 2.935 1.00 . A A . 18 TRP HZ3 1 1 12 8486 1 1 18 TRP N N -2.535 -4.676 2.688 1.00 . A A . 18 TRP N 1 1 12 8487 1 1 18 TRP NE1 N -6.754 -3.159 2.783 1.00 . A A . 18 TRP NE1 1 1 12 8488 1 1 18 TRP O O -0.276 -3.928 3.787 1.00 . A A . 18 TRP O 1 1 12 8489 1 1 19 VAL C C 1.225 -0.263 3.860 1.00 . A A . 19 VAL C 1 1 12 8490 1 1 19 VAL CA C 1.124 -1.643 3.225 1.00 . A A . 19 VAL CA 1 1 12 8491 1 1 19 VAL CB C 2.159 -1.758 2.050 1.00 . A A . 19 VAL CB 1 1 12 8492 1 1 19 VAL CG1 C 2.287 -3.183 1.560 1.00 . A A . 19 VAL CG1 1 1 12 8493 1 1 19 VAL CG2 C 1.787 -0.850 0.885 1.00 . A A . 19 VAL CG2 1 1 12 8494 1 1 19 VAL H H -0.622 -1.141 2.347 1.00 . A A . 19 VAL H 1 1 12 8495 1 1 19 VAL HA H 1.384 -2.369 3.985 1.00 . A A . 19 VAL HA 1 1 12 8496 1 1 19 VAL HB H 3.126 -1.442 2.422 1.00 . A A . 19 VAL HB 1 1 12 8497 1 1 19 VAL HG11 H 1.325 -3.549 1.235 1.00 . A A . 19 VAL HG11 1 1 12 8498 1 1 19 VAL HG12 H 2.669 -3.799 2.360 1.00 . A A . 19 VAL HG12 1 1 12 8499 1 1 19 VAL HG13 H 2.983 -3.191 0.732 1.00 . A A . 19 VAL HG13 1 1 12 8500 1 1 19 VAL HG21 H 2.521 -0.960 0.100 1.00 . A A . 19 VAL HG21 1 1 12 8501 1 1 19 VAL HG22 H 1.794 0.171 1.231 1.00 . A A . 19 VAL HG22 1 1 12 8502 1 1 19 VAL HG23 H 0.808 -1.112 0.511 1.00 . A A . 19 VAL HG23 1 1 12 8503 1 1 19 VAL N N -0.236 -1.916 2.816 1.00 . A A . 19 VAL N 1 1 12 8504 1 1 19 VAL O O 0.695 0.713 3.338 1.00 . A A . 19 VAL O 1 1 12 8505 1 1 20 GLN C C 3.532 1.429 5.373 1.00 . A A . 20 GLN C 1 1 12 8506 1 1 20 GLN CA C 2.110 1.032 5.674 1.00 . A A . 20 GLN CA 1 1 12 8507 1 1 20 GLN CB C 1.884 0.888 7.207 1.00 . A A . 20 GLN CB 1 1 12 8508 1 1 20 GLN CD C 1.988 2.012 9.494 1.00 . A A . 20 GLN CD 1 1 12 8509 1 1 20 GLN CG C 2.242 2.138 8.001 1.00 . A A . 20 GLN CG 1 1 12 8510 1 1 20 GLN H H 2.139 -1.046 5.409 1.00 . A A . 20 GLN H 1 1 12 8511 1 1 20 GLN HA H 1.444 1.784 5.280 1.00 . A A . 20 GLN HA 1 1 12 8512 1 1 20 GLN HB2 H 0.834 0.687 7.378 1.00 . A A . 20 GLN HB2 1 1 12 8513 1 1 20 GLN HB3 H 2.484 0.062 7.564 1.00 . A A . 20 GLN HB3 1 1 12 8514 1 1 20 GLN HE21 H 3.501 3.228 9.880 1.00 . A A . 20 GLN HE21 1 1 12 8515 1 1 20 GLN HE22 H 2.659 2.652 11.244 1.00 . A A . 20 GLN HE22 1 1 12 8516 1 1 20 GLN HG2 H 3.297 2.321 7.858 1.00 . A A . 20 GLN HG2 1 1 12 8517 1 1 20 GLN HG3 H 1.687 2.983 7.619 1.00 . A A . 20 GLN HG3 1 1 12 8518 1 1 20 GLN N N 1.843 -0.214 4.994 1.00 . A A . 20 GLN N 1 1 12 8519 1 1 20 GLN NE2 N 2.786 2.690 10.275 1.00 . A A . 20 GLN NE2 1 1 12 8520 1 1 20 GLN O O 4.404 0.569 5.308 1.00 . A A . 20 GLN O 1 1 12 8521 1 1 20 GLN OE1 O 1.082 1.301 9.936 1.00 . A A . 20 GLN OE1 1 1 12 8522 1 1 21 CYS C C 5.817 3.439 6.208 1.00 . A A . 21 CYS C 1 1 12 8523 1 1 21 CYS CA C 5.140 3.099 4.888 1.00 . A A . 21 CYS CA 1 1 12 8524 1 1 21 CYS CB C 5.272 4.240 3.852 1.00 . A A . 21 CYS CB 1 1 12 8525 1 1 21 CYS H H 3.027 3.334 5.103 1.00 . A A . 21 CYS H 1 1 12 8526 1 1 21 CYS HA H 5.641 2.219 4.505 1.00 . A A . 21 CYS HA 1 1 12 8527 1 1 21 CYS HB2 H 6.302 4.455 3.625 1.00 . A A . 21 CYS HB2 1 1 12 8528 1 1 21 CYS HB3 H 4.791 3.924 2.940 1.00 . A A . 21 CYS HB3 1 1 12 8529 1 1 21 CYS N N 3.779 2.700 5.118 1.00 . A A . 21 CYS N 1 1 12 8530 1 1 21 CYS O O 5.551 4.494 6.824 1.00 . A A . 21 CYS O 1 1 12 8531 1 1 21 CYS SG S 4.543 5.820 4.304 1.00 . A A . 21 CYS SG 1 1 12 8532 1 1 22 ASP C C 8.620 3.626 7.773 1.00 . A A . 22 ASP C 1 1 12 8533 1 1 22 ASP CA C 7.438 2.701 7.901 1.00 . A A . 22 ASP CA 1 1 12 8534 1 1 22 ASP CB C 7.887 1.331 8.427 1.00 . A A . 22 ASP CB 1 1 12 8535 1 1 22 ASP CG C 6.732 0.485 8.923 1.00 . A A . 22 ASP CG 1 1 12 8536 1 1 22 ASP H H 6.924 1.811 6.032 1.00 . A A . 22 ASP H 1 1 12 8537 1 1 22 ASP HA H 6.747 3.135 8.608 1.00 . A A . 22 ASP HA 1 1 12 8538 1 1 22 ASP HB2 H 8.374 0.801 7.621 1.00 . A A . 22 ASP HB2 1 1 12 8539 1 1 22 ASP HB3 H 8.590 1.478 9.235 1.00 . A A . 22 ASP HB3 1 1 12 8540 1 1 22 ASP N N 6.718 2.569 6.622 1.00 . A A . 22 ASP N 1 1 12 8541 1 1 22 ASP O O 9.546 3.599 8.574 1.00 . A A . 22 ASP O 1 1 12 8542 1 1 22 ASP OD1 O 6.354 0.636 10.101 1.00 . A A . 22 ASP OD1 1 1 12 8543 1 1 22 ASP OD2 O 6.198 -0.328 8.150 1.00 . A A . 22 ASP OD2 1 1 12 8544 1 1 23 GLY C C 9.331 6.734 7.322 1.00 . A A . 23 GLY C 1 1 12 8545 1 1 23 GLY CA C 9.594 5.429 6.583 1.00 . A A . 23 GLY CA 1 1 12 8546 1 1 23 GLY H H 7.727 4.515 6.266 1.00 . A A . 23 GLY H 1 1 12 8547 1 1 23 GLY HA2 H 10.518 4.994 6.935 1.00 . A A . 23 GLY HA2 1 1 12 8548 1 1 23 GLY HA3 H 9.669 5.625 5.523 1.00 . A A . 23 GLY HA3 1 1 12 8549 1 1 23 GLY N N 8.548 4.497 6.796 1.00 . A A . 23 GLY N 1 1 12 8550 1 1 23 GLY O O 10.197 7.587 7.392 1.00 . A A . 23 GLY O 1 1 12 8551 1 1 24 GLY C C 6.440 8.698 8.420 1.00 . A A . 24 GLY C 1 1 12 8552 1 1 24 GLY CA C 7.835 8.088 8.631 1.00 . A A . 24 GLY CA 1 1 12 8553 1 1 24 GLY H H 7.422 6.206 7.787 1.00 . A A . 24 GLY H 1 1 12 8554 1 1 24 GLY HA2 H 7.916 7.840 9.681 1.00 . A A . 24 GLY HA2 1 1 12 8555 1 1 24 GLY HA3 H 8.582 8.830 8.382 1.00 . A A . 24 GLY HA3 1 1 12 8556 1 1 24 GLY N N 8.115 6.891 7.868 1.00 . A A . 24 GLY N 1 1 12 8557 1 1 24 GLY O O 6.030 9.544 9.206 1.00 . A A . 24 GLY O 1 1 12 8558 1 1 25 CYS C C 3.334 8.127 7.963 1.00 . A A . 25 CYS C 1 1 12 8559 1 1 25 CYS CA C 4.358 8.910 7.165 1.00 . A A . 25 CYS CA 1 1 12 8560 1 1 25 CYS CB C 3.926 8.875 5.690 1.00 . A A . 25 CYS CB 1 1 12 8561 1 1 25 CYS H H 6.041 7.603 6.780 1.00 . A A . 25 CYS H 1 1 12 8562 1 1 25 CYS HA H 4.386 9.930 7.520 1.00 . A A . 25 CYS HA 1 1 12 8563 1 1 25 CYS HB2 H 3.662 7.858 5.427 1.00 . A A . 25 CYS HB2 1 1 12 8564 1 1 25 CYS HB3 H 3.040 9.485 5.562 1.00 . A A . 25 CYS HB3 1 1 12 8565 1 1 25 CYS N N 5.703 8.295 7.377 1.00 . A A . 25 CYS N 1 1 12 8566 1 1 25 CYS O O 2.312 8.656 8.371 1.00 . A A . 25 CYS O 1 1 12 8567 1 1 25 CYS SG S 5.154 9.425 4.504 1.00 . A A . 25 CYS SG 1 1 12 8568 1 1 26 ASP C C 1.420 5.724 8.173 1.00 . A A . 26 ASP C 1 1 12 8569 1 1 26 ASP CA C 2.773 5.870 8.859 1.00 . A A . 26 ASP CA 1 1 12 8570 1 1 26 ASP CB C 2.573 6.228 10.350 1.00 . A A . 26 ASP CB 1 1 12 8571 1 1 26 ASP CG C 3.862 6.258 11.143 1.00 . A A . 26 ASP CG 1 1 12 8572 1 1 26 ASP H H 4.521 6.525 7.864 1.00 . A A . 26 ASP H 1 1 12 8573 1 1 26 ASP HA H 3.288 4.923 8.801 1.00 . A A . 26 ASP HA 1 1 12 8574 1 1 26 ASP HB2 H 2.085 7.184 10.448 1.00 . A A . 26 ASP HB2 1 1 12 8575 1 1 26 ASP HB3 H 1.926 5.486 10.797 1.00 . A A . 26 ASP HB3 1 1 12 8576 1 1 26 ASP N N 3.643 6.833 8.162 1.00 . A A . 26 ASP N 1 1 12 8577 1 1 26 ASP O O 0.448 5.252 8.775 1.00 . A A . 26 ASP O 1 1 12 8578 1 1 26 ASP OD1 O 4.338 5.189 11.543 1.00 . A A . 26 ASP OD1 1 1 12 8579 1 1 26 ASP OD2 O 4.383 7.353 11.386 1.00 . A A . 26 ASP OD2 1 1 12 8580 1 1 27 GLU C C -0.033 4.616 5.508 1.00 . A A . 27 GLU C 1 1 12 8581 1 1 27 GLU CA C 0.124 5.980 6.156 1.00 . A A . 27 GLU CA 1 1 12 8582 1 1 27 GLU CB C -0.044 7.101 5.127 1.00 . A A . 27 GLU CB 1 1 12 8583 1 1 27 GLU CD C -0.501 9.551 4.717 1.00 . A A . 27 GLU CD 1 1 12 8584 1 1 27 GLU CG C -0.128 8.494 5.739 1.00 . A A . 27 GLU CG 1 1 12 8585 1 1 27 GLU H H 2.174 6.399 6.451 1.00 . A A . 27 GLU H 1 1 12 8586 1 1 27 GLU HA H -0.661 6.073 6.893 1.00 . A A . 27 GLU HA 1 1 12 8587 1 1 27 GLU HB2 H 0.797 7.075 4.449 1.00 . A A . 27 GLU HB2 1 1 12 8588 1 1 27 GLU HB3 H -0.938 6.923 4.550 1.00 . A A . 27 GLU HB3 1 1 12 8589 1 1 27 GLU HG2 H -0.877 8.488 6.520 1.00 . A A . 27 GLU HG2 1 1 12 8590 1 1 27 GLU HG3 H 0.841 8.733 6.162 1.00 . A A . 27 GLU HG3 1 1 12 8591 1 1 27 GLU N N 1.362 6.080 6.895 1.00 . A A . 27 GLU N 1 1 12 8592 1 1 27 GLU O O 0.941 3.855 5.376 1.00 . A A . 27 GLU O 1 1 12 8593 1 1 27 GLU OE1 O 0.396 10.090 4.043 1.00 . A A . 27 GLU OE1 1 1 12 8594 1 1 27 GLU OE2 O -1.720 9.849 4.578 1.00 . A A . 27 GLU OE2 1 1 12 8595 1 1 28 TRP C C -1.888 3.174 3.060 1.00 . A A . 28 TRP C 1 1 12 8596 1 1 28 TRP CA C -1.630 3.062 4.547 1.00 . A A . 28 TRP CA 1 1 12 8597 1 1 28 TRP CB C -2.857 2.523 5.285 1.00 . A A . 28 TRP CB 1 1 12 8598 1 1 28 TRP CD1 C -2.275 3.018 7.742 1.00 . A A . 28 TRP CD1 1 1 12 8599 1 1 28 TRP CD2 C -2.536 0.849 7.276 1.00 . A A . 28 TRP CD2 1 1 12 8600 1 1 28 TRP CE2 C -2.219 0.982 8.642 1.00 . A A . 28 TRP CE2 1 1 12 8601 1 1 28 TRP CE3 C -2.751 -0.431 6.754 1.00 . A A . 28 TRP CE3 1 1 12 8602 1 1 28 TRP CG C -2.564 2.163 6.717 1.00 . A A . 28 TRP CG 1 1 12 8603 1 1 28 TRP CH2 C -2.316 -1.351 8.956 1.00 . A A . 28 TRP CH2 1 1 12 8604 1 1 28 TRP CZ2 C -2.096 -0.118 9.489 1.00 . A A . 28 TRP CZ2 1 1 12 8605 1 1 28 TRP CZ3 C -2.642 -1.517 7.599 1.00 . A A . 28 TRP CZ3 1 1 12 8606 1 1 28 TRP H H -1.903 5.059 5.187 1.00 . A A . 28 TRP H 1 1 12 8607 1 1 28 TRP HA H -0.816 2.370 4.693 1.00 . A A . 28 TRP HA 1 1 12 8608 1 1 28 TRP HB2 H -3.624 3.286 5.282 1.00 . A A . 28 TRP HB2 1 1 12 8609 1 1 28 TRP HB3 H -3.231 1.651 4.776 1.00 . A A . 28 TRP HB3 1 1 12 8610 1 1 28 TRP HD1 H -2.217 4.090 7.635 1.00 . A A . 28 TRP HD1 1 1 12 8611 1 1 28 TRP HE1 H -1.818 2.710 9.762 1.00 . A A . 28 TRP HE1 1 1 12 8612 1 1 28 TRP HE3 H -3.003 -0.584 5.715 1.00 . A A . 28 TRP HE3 1 1 12 8613 1 1 28 TRP HH2 H -2.229 -2.218 9.593 1.00 . A A . 28 TRP HH2 1 1 12 8614 1 1 28 TRP HZ2 H -1.851 -0.017 10.538 1.00 . A A . 28 TRP HZ2 1 1 12 8615 1 1 28 TRP HZ3 H -2.800 -2.514 7.215 1.00 . A A . 28 TRP HZ3 1 1 12 8616 1 1 28 TRP N N -1.247 4.334 5.108 1.00 . A A . 28 TRP N 1 1 12 8617 1 1 28 TRP NE1 N -2.053 2.319 8.893 1.00 . A A . 28 TRP NE1 1 1 12 8618 1 1 28 TRP O O -2.631 4.050 2.610 1.00 . A A . 28 TRP O 1 1 12 8619 1 1 29 PHE C C -1.857 0.889 0.432 1.00 . A A . 29 PHE C 1 1 12 8620 1 1 29 PHE CA C -1.334 2.263 0.871 1.00 . A A . 29 PHE CA 1 1 12 8621 1 1 29 PHE CB C 0.088 2.459 0.261 1.00 . A A . 29 PHE CB 1 1 12 8622 1 1 29 PHE CD1 C 1.390 3.654 2.055 1.00 . A A . 29 PHE CD1 1 1 12 8623 1 1 29 PHE CD2 C 1.085 4.778 -0.014 1.00 . A A . 29 PHE CD2 1 1 12 8624 1 1 29 PHE CE1 C 2.095 4.718 2.531 1.00 . A A . 29 PHE CE1 1 1 12 8625 1 1 29 PHE CE2 C 1.800 5.854 0.465 1.00 . A A . 29 PHE CE2 1 1 12 8626 1 1 29 PHE CG C 0.861 3.663 0.780 1.00 . A A . 29 PHE CG 1 1 12 8627 1 1 29 PHE CZ C 2.306 5.821 1.746 1.00 . A A . 29 PHE CZ 1 1 12 8628 1 1 29 PHE H H -0.665 1.646 2.767 1.00 . A A . 29 PHE H 1 1 12 8629 1 1 29 PHE HA H -1.982 3.051 0.512 1.00 . A A . 29 PHE HA 1 1 12 8630 1 1 29 PHE HB2 H 0.682 1.583 0.454 1.00 . A A . 29 PHE HB2 1 1 12 8631 1 1 29 PHE HB3 H -0.022 2.571 -0.808 1.00 . A A . 29 PHE HB3 1 1 12 8632 1 1 29 PHE HD1 H 1.221 2.788 2.684 1.00 . A A . 29 PHE HD1 1 1 12 8633 1 1 29 PHE HD2 H 0.694 4.839 -1.020 1.00 . A A . 29 PHE HD2 1 1 12 8634 1 1 29 PHE HE1 H 2.494 4.702 3.536 1.00 . A A . 29 PHE HE1 1 1 12 8635 1 1 29 PHE HE2 H 1.954 6.710 -0.173 1.00 . A A . 29 PHE HE2 1 1 12 8636 1 1 29 PHE HZ H 2.878 6.633 2.167 1.00 . A A . 29 PHE HZ 1 1 12 8637 1 1 29 PHE N N -1.252 2.294 2.314 1.00 . A A . 29 PHE N 1 1 12 8638 1 1 29 PHE O O -1.777 -0.091 1.181 1.00 . A A . 29 PHE O 1 1 12 8639 1 1 30 HIS C C -1.738 -0.900 -2.274 1.00 . A A . 30 HIS C 1 1 12 8640 1 1 30 HIS CA C -2.825 -0.441 -1.367 1.00 . A A . 30 HIS CA 1 1 12 8641 1 1 30 HIS CB C -4.083 -0.268 -2.227 1.00 . A A . 30 HIS CB 1 1 12 8642 1 1 30 HIS CD2 C -6.221 -0.951 -0.976 1.00 . A A . 30 HIS CD2 1 1 12 8643 1 1 30 HIS CE1 C -7.124 1.035 -0.827 1.00 . A A . 30 HIS CE1 1 1 12 8644 1 1 30 HIS CG C -5.362 -0.065 -1.528 1.00 . A A . 30 HIS CG 1 1 12 8645 1 1 30 HIS H H -2.458 1.682 -1.240 1.00 . A A . 30 HIS H 1 1 12 8646 1 1 30 HIS HA H -3.014 -1.159 -0.585 1.00 . A A . 30 HIS HA 1 1 12 8647 1 1 30 HIS HB2 H -3.900 0.681 -2.716 1.00 . A A . 30 HIS HB2 1 1 12 8648 1 1 30 HIS HB3 H -4.205 -0.954 -3.051 1.00 . A A . 30 HIS HB3 1 1 12 8649 1 1 30 HIS HD2 H -6.074 -2.019 -0.891 1.00 . A A . 30 HIS HD2 1 1 12 8650 1 1 30 HIS HE1 H -7.809 1.842 -0.608 1.00 . A A . 30 HIS HE1 1 1 12 8651 1 1 30 HIS HE2 H -8.200 -0.646 -0.415 1.00 . A A . 30 HIS HE2 1 1 12 8652 1 1 30 HIS N N -2.396 0.828 -0.761 1.00 . A A . 30 HIS N 1 1 12 8653 1 1 30 HIS ND1 N -5.940 1.163 -1.426 1.00 . A A . 30 HIS ND1 1 1 12 8654 1 1 30 HIS NE2 N -7.311 -0.241 -0.550 1.00 . A A . 30 HIS NE2 1 1 12 8655 1 1 30 HIS O O -1.172 -0.079 -2.989 1.00 . A A . 30 HIS O 1 1 12 8656 1 1 31 GLN C C -0.655 -2.400 -4.623 1.00 . A A . 31 GLN C 1 1 12 8657 1 1 31 GLN CA C -0.431 -2.732 -3.148 1.00 . A A . 31 GLN CA 1 1 12 8658 1 1 31 GLN CB C -0.213 -4.222 -2.945 1.00 . A A . 31 GLN CB 1 1 12 8659 1 1 31 GLN CD C 0.535 -6.071 -1.431 1.00 . A A . 31 GLN CD 1 1 12 8660 1 1 31 GLN CG C 0.371 -4.583 -1.590 1.00 . A A . 31 GLN CG 1 1 12 8661 1 1 31 GLN H H -1.989 -2.759 -1.684 1.00 . A A . 31 GLN H 1 1 12 8662 1 1 31 GLN HA H 0.470 -2.216 -2.850 1.00 . A A . 31 GLN HA 1 1 12 8663 1 1 31 GLN HB2 H -1.136 -4.763 -3.087 1.00 . A A . 31 GLN HB2 1 1 12 8664 1 1 31 GLN HB3 H 0.489 -4.541 -3.698 1.00 . A A . 31 GLN HB3 1 1 12 8665 1 1 31 GLN HE21 H -1.233 -6.213 -0.587 1.00 . A A . 31 GLN HE21 1 1 12 8666 1 1 31 GLN HE22 H -0.413 -7.687 -0.749 1.00 . A A . 31 GLN HE22 1 1 12 8667 1 1 31 GLN HG2 H 1.341 -4.115 -1.504 1.00 . A A . 31 GLN HG2 1 1 12 8668 1 1 31 GLN HG3 H -0.255 -4.205 -0.802 1.00 . A A . 31 GLN HG3 1 1 12 8669 1 1 31 GLN N N -1.470 -2.194 -2.287 1.00 . A A . 31 GLN N 1 1 12 8670 1 1 31 GLN NE2 N -0.453 -6.717 -0.874 1.00 . A A . 31 GLN NE2 1 1 12 8671 1 1 31 GLN O O 0.235 -1.954 -5.276 1.00 . A A . 31 GLN O 1 1 12 8672 1 1 31 GLN OE1 O 1.552 -6.623 -1.779 1.00 . A A . 31 GLN OE1 1 1 12 8673 1 1 32 VAL C C -2.070 -0.743 -6.821 1.00 . A A . 32 VAL C 1 1 12 8674 1 1 32 VAL CA C -2.107 -2.264 -6.531 1.00 . A A . 32 VAL CA 1 1 12 8675 1 1 32 VAL CB C -3.462 -2.852 -6.996 1.00 . A A . 32 VAL CB 1 1 12 8676 1 1 32 VAL CG1 C -4.587 -2.255 -6.197 1.00 . A A . 32 VAL CG1 1 1 12 8677 1 1 32 VAL CG2 C -3.679 -2.580 -8.467 1.00 . A A . 32 VAL CG2 1 1 12 8678 1 1 32 VAL H H -2.588 -2.883 -4.560 1.00 . A A . 32 VAL H 1 1 12 8679 1 1 32 VAL HA H -1.323 -2.722 -7.115 1.00 . A A . 32 VAL HA 1 1 12 8680 1 1 32 VAL HB H -3.437 -3.917 -6.841 1.00 . A A . 32 VAL HB 1 1 12 8681 1 1 32 VAL HG11 H -4.447 -2.495 -5.154 1.00 . A A . 32 VAL HG11 1 1 12 8682 1 1 32 VAL HG12 H -5.554 -2.568 -6.559 1.00 . A A . 32 VAL HG12 1 1 12 8683 1 1 32 VAL HG13 H -4.445 -1.191 -6.322 1.00 . A A . 32 VAL HG13 1 1 12 8684 1 1 32 VAL HG21 H -2.879 -2.998 -9.057 1.00 . A A . 32 VAL HG21 1 1 12 8685 1 1 32 VAL HG22 H -3.667 -1.503 -8.551 1.00 . A A . 32 VAL HG22 1 1 12 8686 1 1 32 VAL HG23 H -4.631 -2.979 -8.784 1.00 . A A . 32 VAL HG23 1 1 12 8687 1 1 32 VAL N N -1.853 -2.562 -5.119 1.00 . A A . 32 VAL N 1 1 12 8688 1 1 32 VAL O O -1.525 -0.302 -7.830 1.00 . A A . 32 VAL O 1 1 12 8689 1 1 33 CYS C C -1.410 2.182 -6.048 1.00 . A A . 33 CYS C 1 1 12 8690 1 1 33 CYS CA C -2.769 1.456 -6.115 1.00 . A A . 33 CYS CA 1 1 12 8691 1 1 33 CYS CB C -3.825 2.089 -5.152 1.00 . A A . 33 CYS CB 1 1 12 8692 1 1 33 CYS H H -2.937 -0.474 -5.136 1.00 . A A . 33 CYS H 1 1 12 8693 1 1 33 CYS HA H -3.117 1.601 -7.127 1.00 . A A . 33 CYS HA 1 1 12 8694 1 1 33 CYS HB2 H -4.210 2.999 -5.559 1.00 . A A . 33 CYS HB2 1 1 12 8695 1 1 33 CYS HB3 H -4.669 1.420 -5.087 1.00 . A A . 33 CYS HB3 1 1 12 8696 1 1 33 CYS N N -2.629 0.035 -5.909 1.00 . A A . 33 CYS N 1 1 12 8697 1 1 33 CYS O O -1.185 3.145 -6.772 1.00 . A A . 33 CYS O 1 1 12 8698 1 1 33 CYS SG S -3.296 2.417 -3.474 1.00 . A A . 33 CYS SG 1 1 12 8699 1 1 34 VAL C C 1.866 1.471 -5.820 1.00 . A A . 34 VAL C 1 1 12 8700 1 1 34 VAL CA C 0.775 2.320 -5.086 1.00 . A A . 34 VAL CA 1 1 12 8701 1 1 34 VAL CB C 1.134 2.528 -3.596 1.00 . A A . 34 VAL CB 1 1 12 8702 1 1 34 VAL CG1 C 1.741 1.322 -2.932 1.00 . A A . 34 VAL CG1 1 1 12 8703 1 1 34 VAL CG2 C 1.901 3.785 -3.403 1.00 . A A . 34 VAL CG2 1 1 12 8704 1 1 34 VAL H H -0.643 0.940 -4.608 1.00 . A A . 34 VAL H 1 1 12 8705 1 1 34 VAL HA H 0.714 3.288 -5.568 1.00 . A A . 34 VAL HA 1 1 12 8706 1 1 34 VAL HB H 0.238 2.598 -3.004 1.00 . A A . 34 VAL HB 1 1 12 8707 1 1 34 VAL HG11 H 1.091 0.461 -3.005 1.00 . A A . 34 VAL HG11 1 1 12 8708 1 1 34 VAL HG12 H 1.922 1.546 -1.890 1.00 . A A . 34 VAL HG12 1 1 12 8709 1 1 34 VAL HG13 H 2.673 1.129 -3.436 1.00 . A A . 34 VAL HG13 1 1 12 8710 1 1 34 VAL HG21 H 2.158 3.869 -2.358 1.00 . A A . 34 VAL HG21 1 1 12 8711 1 1 34 VAL HG22 H 1.248 4.594 -3.698 1.00 . A A . 34 VAL HG22 1 1 12 8712 1 1 34 VAL HG23 H 2.782 3.733 -4.027 1.00 . A A . 34 VAL HG23 1 1 12 8713 1 1 34 VAL N N -0.501 1.701 -5.204 1.00 . A A . 34 VAL N 1 1 12 8714 1 1 34 VAL O O 3.063 1.770 -5.755 1.00 . A A . 34 VAL O 1 1 12 8715 1 1 35 GLY C C 3.314 -1.233 -6.491 1.00 . A A . 35 GLY C 1 1 12 8716 1 1 35 GLY CA C 2.298 -0.413 -7.329 1.00 . A A . 35 GLY CA 1 1 12 8717 1 1 35 GLY H H 0.424 0.464 -6.702 1.00 . A A . 35 GLY H 1 1 12 8718 1 1 35 GLY HA2 H 1.688 -1.117 -7.877 1.00 . A A . 35 GLY HA2 1 1 12 8719 1 1 35 GLY HA3 H 2.838 0.175 -8.058 1.00 . A A . 35 GLY HA3 1 1 12 8720 1 1 35 GLY N N 1.400 0.478 -6.582 1.00 . A A . 35 GLY N 1 1 12 8721 1 1 35 GLY O O 4.525 -1.127 -6.691 1.00 . A A . 35 GLY O 1 1 12 8722 1 1 36 VAL C C 3.211 -4.380 -5.198 1.00 . A A . 36 VAL C 1 1 12 8723 1 1 36 VAL CA C 3.606 -2.966 -4.804 1.00 . A A . 36 VAL CA 1 1 12 8724 1 1 36 VAL CB C 3.300 -2.773 -3.276 1.00 . A A . 36 VAL CB 1 1 12 8725 1 1 36 VAL CG1 C 3.969 -3.841 -2.399 1.00 . A A . 36 VAL CG1 1 1 12 8726 1 1 36 VAL CG2 C 3.692 -1.396 -2.812 1.00 . A A . 36 VAL CG2 1 1 12 8727 1 1 36 VAL H H 1.850 -2.148 -5.428 1.00 . A A . 36 VAL H 1 1 12 8728 1 1 36 VAL HA H 4.661 -2.795 -4.984 1.00 . A A . 36 VAL HA 1 1 12 8729 1 1 36 VAL HB H 2.233 -2.880 -3.152 1.00 . A A . 36 VAL HB 1 1 12 8730 1 1 36 VAL HG11 H 5.037 -3.897 -2.574 1.00 . A A . 36 VAL HG11 1 1 12 8731 1 1 36 VAL HG12 H 3.510 -4.788 -2.648 1.00 . A A . 36 VAL HG12 1 1 12 8732 1 1 36 VAL HG13 H 3.764 -3.613 -1.364 1.00 . A A . 36 VAL HG13 1 1 12 8733 1 1 36 VAL HG21 H 4.742 -1.210 -2.980 1.00 . A A . 36 VAL HG21 1 1 12 8734 1 1 36 VAL HG22 H 3.477 -1.297 -1.759 1.00 . A A . 36 VAL HG22 1 1 12 8735 1 1 36 VAL HG23 H 3.091 -0.669 -3.336 1.00 . A A . 36 VAL HG23 1 1 12 8736 1 1 36 VAL N N 2.815 -2.059 -5.608 1.00 . A A . 36 VAL N 1 1 12 8737 1 1 36 VAL O O 2.051 -4.611 -5.574 1.00 . A A . 36 VAL O 1 1 12 8738 1 1 37 SER C C 3.652 -7.415 -4.098 1.00 . A A . 37 SER C 1 1 12 8739 1 1 37 SER CA C 3.836 -6.667 -5.421 1.00 . A A . 37 SER CA 1 1 12 8740 1 1 37 SER CB C 4.982 -7.256 -6.231 1.00 . A A . 37 SER CB 1 1 12 8741 1 1 37 SER H H 5.070 -5.237 -4.851 1.00 . A A . 37 SER H 1 1 12 8742 1 1 37 SER HA H 2.927 -6.704 -6.002 1.00 . A A . 37 SER HA 1 1 12 8743 1 1 37 SER HB2 H 4.841 -8.326 -6.303 1.00 . A A . 37 SER HB2 1 1 12 8744 1 1 37 SER HB3 H 5.004 -6.820 -7.221 1.00 . A A . 37 SER HB3 1 1 12 8745 1 1 37 SER HG H 6.892 -6.791 -6.248 1.00 . A A . 37 SER HG 1 1 12 8746 1 1 37 SER N N 4.131 -5.308 -5.130 1.00 . A A . 37 SER N 1 1 12 8747 1 1 37 SER O O 4.279 -7.033 -3.095 1.00 . A A . 37 SER O 1 1 12 8748 1 1 37 SER OG O 6.223 -7.006 -5.584 1.00 . A A . 37 SER OG 1 1 12 8749 1 1 38 PRO C C 3.794 -9.757 -2.147 1.00 . A A . 38 PRO C 1 1 12 8750 1 1 38 PRO CA C 2.523 -9.249 -2.817 1.00 . A A . 38 PRO CA 1 1 12 8751 1 1 38 PRO CB C 1.690 -10.429 -3.319 1.00 . A A . 38 PRO CB 1 1 12 8752 1 1 38 PRO CD C 2.047 -9.018 -5.205 1.00 . A A . 38 PRO CD 1 1 12 8753 1 1 38 PRO CG C 1.031 -9.902 -4.538 1.00 . A A . 38 PRO CG 1 1 12 8754 1 1 38 PRO HA H 1.937 -8.660 -2.127 1.00 . A A . 38 PRO HA 1 1 12 8755 1 1 38 PRO HB2 H 2.337 -11.267 -3.537 1.00 . A A . 38 PRO HB2 1 1 12 8756 1 1 38 PRO HB3 H 0.968 -10.704 -2.564 1.00 . A A . 38 PRO HB3 1 1 12 8757 1 1 38 PRO HD2 H 2.682 -9.589 -5.867 1.00 . A A . 38 PRO HD2 1 1 12 8758 1 1 38 PRO HD3 H 1.544 -8.234 -5.751 1.00 . A A . 38 PRO HD3 1 1 12 8759 1 1 38 PRO HG2 H 0.771 -10.708 -5.201 1.00 . A A . 38 PRO HG2 1 1 12 8760 1 1 38 PRO HG3 H 0.161 -9.325 -4.264 1.00 . A A . 38 PRO HG3 1 1 12 8761 1 1 38 PRO N N 2.803 -8.478 -4.061 1.00 . A A . 38 PRO N 1 1 12 8762 1 1 38 PRO O O 3.880 -9.856 -0.926 1.00 . A A . 38 PRO O 1 1 12 8763 1 1 39 GLU C C 6.828 -9.485 -1.700 1.00 . A A . 39 GLU C 1 1 12 8764 1 1 39 GLU CA C 6.050 -10.536 -2.520 1.00 . A A . 39 GLU CA 1 1 12 8765 1 1 39 GLU CB C 6.865 -10.946 -3.745 1.00 . A A . 39 GLU CB 1 1 12 8766 1 1 39 GLU CD C 7.049 -12.384 -5.837 1.00 . A A . 39 GLU CD 1 1 12 8767 1 1 39 GLU CG C 6.239 -12.058 -4.591 1.00 . A A . 39 GLU CG 1 1 12 8768 1 1 39 GLU H H 4.770 -9.827 -3.917 1.00 . A A . 39 GLU H 1 1 12 8769 1 1 39 GLU HA H 5.874 -11.415 -1.917 1.00 . A A . 39 GLU HA 1 1 12 8770 1 1 39 GLU HB2 H 7.003 -10.075 -4.371 1.00 . A A . 39 GLU HB2 1 1 12 8771 1 1 39 GLU HB3 H 7.825 -11.267 -3.389 1.00 . A A . 39 GLU HB3 1 1 12 8772 1 1 39 GLU HG2 H 6.193 -12.950 -3.986 1.00 . A A . 39 GLU HG2 1 1 12 8773 1 1 39 GLU HG3 H 5.241 -11.764 -4.887 1.00 . A A . 39 GLU HG3 1 1 12 8774 1 1 39 GLU N N 4.801 -10.018 -2.961 1.00 . A A . 39 GLU N 1 1 12 8775 1 1 39 GLU O O 7.574 -9.828 -0.786 1.00 . A A . 39 GLU O 1 1 12 8776 1 1 39 GLU OE1 O 8.101 -13.014 -5.720 1.00 . A A . 39 GLU OE1 1 1 12 8777 1 1 39 GLU OE2 O 6.621 -12.031 -6.953 1.00 . A A . 39 GLU OE2 1 1 12 8778 1 1 40 MET C C 6.788 -6.915 0.020 1.00 . A A . 40 MET C 1 1 12 8779 1 1 40 MET CA C 7.369 -7.148 -1.365 1.00 . A A . 40 MET CA 1 1 12 8780 1 1 40 MET CB C 7.374 -5.829 -2.182 1.00 . A A . 40 MET CB 1 1 12 8781 1 1 40 MET CE C 7.204 -2.735 -3.202 1.00 . A A . 40 MET CE 1 1 12 8782 1 1 40 MET CG C 8.286 -4.766 -1.580 1.00 . A A . 40 MET CG 1 1 12 8783 1 1 40 MET H H 5.983 -7.989 -2.729 1.00 . A A . 40 MET H 1 1 12 8784 1 1 40 MET HA H 8.384 -7.497 -1.250 1.00 . A A . 40 MET HA 1 1 12 8785 1 1 40 MET HB2 H 7.491 -5.924 -3.248 1.00 . A A . 40 MET HB2 1 1 12 8786 1 1 40 MET HB3 H 6.373 -5.440 -2.073 1.00 . A A . 40 MET HB3 1 1 12 8787 1 1 40 MET HE1 H 6.626 -3.495 -3.707 1.00 . A A . 40 MET HE1 1 1 12 8788 1 1 40 MET HE2 H 7.367 -1.910 -3.883 1.00 . A A . 40 MET HE2 1 1 12 8789 1 1 40 MET HE3 H 6.662 -2.390 -2.333 1.00 . A A . 40 MET HE3 1 1 12 8790 1 1 40 MET HG2 H 7.716 -4.328 -0.773 1.00 . A A . 40 MET HG2 1 1 12 8791 1 1 40 MET HG3 H 9.172 -5.249 -1.186 1.00 . A A . 40 MET HG3 1 1 12 8792 1 1 40 MET N N 6.646 -8.210 -2.039 1.00 . A A . 40 MET N 1 1 12 8793 1 1 40 MET O O 7.502 -6.781 0.985 1.00 . A A . 40 MET O 1 1 12 8794 1 1 40 MET SD S 8.769 -3.436 -2.727 1.00 . A A . 40 MET SD 1 1 12 8795 1 1 41 ALA C C 5.078 -7.561 2.501 1.00 . A A . 41 ALA C 1 1 12 8796 1 1 41 ALA CA C 4.716 -6.638 1.328 1.00 . A A . 41 ALA CA 1 1 12 8797 1 1 41 ALA CB C 3.218 -6.696 1.055 1.00 . A A . 41 ALA CB 1 1 12 8798 1 1 41 ALA H H 4.958 -7.117 -0.734 1.00 . A A . 41 ALA H 1 1 12 8799 1 1 41 ALA HA H 4.951 -5.624 1.617 1.00 . A A . 41 ALA HA 1 1 12 8800 1 1 41 ALA HB1 H 2.931 -7.707 0.817 1.00 . A A . 41 ALA HB1 1 1 12 8801 1 1 41 ALA HB2 H 2.979 -6.055 0.220 1.00 . A A . 41 ALA HB2 1 1 12 8802 1 1 41 ALA HB3 H 2.652 -6.359 1.911 1.00 . A A . 41 ALA HB3 1 1 12 8803 1 1 41 ALA N N 5.464 -6.927 0.086 1.00 . A A . 41 ALA N 1 1 12 8804 1 1 41 ALA O O 5.181 -7.109 3.643 1.00 . A A . 41 ALA O 1 1 12 8805 1 1 42 GLU C C 7.096 -9.887 3.574 1.00 . A A . 42 GLU C 1 1 12 8806 1 1 42 GLU CA C 5.590 -9.789 3.297 1.00 . A A . 42 GLU CA 1 1 12 8807 1 1 42 GLU CB C 5.022 -11.196 3.077 1.00 . A A . 42 GLU CB 1 1 12 8808 1 1 42 GLU CD C 3.039 -12.707 3.107 1.00 . A A . 42 GLU CD 1 1 12 8809 1 1 42 GLU CG C 3.516 -11.278 2.976 1.00 . A A . 42 GLU CG 1 1 12 8810 1 1 42 GLU H H 5.069 -9.071 1.287 1.00 . A A . 42 GLU H 1 1 12 8811 1 1 42 GLU HA H 5.149 -9.396 4.202 1.00 . A A . 42 GLU HA 1 1 12 8812 1 1 42 GLU HB2 H 5.428 -11.611 2.163 1.00 . A A . 42 GLU HB2 1 1 12 8813 1 1 42 GLU HB3 H 5.330 -11.805 3.920 1.00 . A A . 42 GLU HB3 1 1 12 8814 1 1 42 GLU HG2 H 3.072 -10.697 3.768 1.00 . A A . 42 GLU HG2 1 1 12 8815 1 1 42 GLU HG3 H 3.197 -10.889 2.022 1.00 . A A . 42 GLU HG3 1 1 12 8816 1 1 42 GLU N N 5.246 -8.842 2.224 1.00 . A A . 42 GLU N 1 1 12 8817 1 1 42 GLU O O 7.498 -10.433 4.600 1.00 . A A . 42 GLU O 1 1 12 8818 1 1 42 GLU OE1 O 3.040 -13.460 2.101 1.00 . A A . 42 GLU OE1 1 1 12 8819 1 1 42 GLU OE2 O 2.670 -13.105 4.243 1.00 . A A . 42 GLU OE2 1 1 12 8820 1 1 43 ASN C C 10.167 -8.259 3.110 1.00 . A A . 43 ASN C 1 1 12 8821 1 1 43 ASN CA C 9.376 -9.535 2.832 1.00 . A A . 43 ASN CA 1 1 12 8822 1 1 43 ASN CB C 9.958 -10.254 1.635 1.00 . A A . 43 ASN CB 1 1 12 8823 1 1 43 ASN CG C 9.611 -11.737 1.594 1.00 . A A . 43 ASN CG 1 1 12 8824 1 1 43 ASN H H 7.593 -8.877 1.908 1.00 . A A . 43 ASN H 1 1 12 8825 1 1 43 ASN HA H 9.537 -10.175 3.687 1.00 . A A . 43 ASN HA 1 1 12 8826 1 1 43 ASN HB2 H 9.560 -9.773 0.753 1.00 . A A . 43 ASN HB2 1 1 12 8827 1 1 43 ASN HB3 H 11.026 -10.123 1.638 1.00 . A A . 43 ASN HB3 1 1 12 8828 1 1 43 ASN HD21 H 9.688 -11.752 -0.386 1.00 . A A . 43 ASN HD21 1 1 12 8829 1 1 43 ASN HD22 H 9.305 -13.249 0.401 1.00 . A A . 43 ASN HD22 1 1 12 8830 1 1 43 ASN N N 7.928 -9.370 2.683 1.00 . A A . 43 ASN N 1 1 12 8831 1 1 43 ASN ND2 N 9.528 -12.296 0.412 1.00 . A A . 43 ASN ND2 1 1 12 8832 1 1 43 ASN O O 11.155 -8.302 3.847 1.00 . A A . 43 ASN O 1 1 12 8833 1 1 43 ASN OD1 O 9.433 -12.379 2.624 1.00 . A A . 43 ASN OD1 1 1 12 8834 1 1 44 GLU C C 9.695 -4.758 3.181 1.00 . A A . 44 GLU C 1 1 12 8835 1 1 44 GLU CA C 10.554 -5.922 2.708 1.00 . A A . 44 GLU CA 1 1 12 8836 1 1 44 GLU CB C 11.309 -5.591 1.399 1.00 . A A . 44 GLU CB 1 1 12 8837 1 1 44 GLU CD C 13.075 -6.382 -0.287 1.00 . A A . 44 GLU CD 1 1 12 8838 1 1 44 GLU CG C 12.280 -6.703 0.961 1.00 . A A . 44 GLU CG 1 1 12 8839 1 1 44 GLU H H 8.903 -7.054 2.094 1.00 . A A . 44 GLU H 1 1 12 8840 1 1 44 GLU HA H 11.281 -6.112 3.486 1.00 . A A . 44 GLU HA 1 1 12 8841 1 1 44 GLU HB2 H 10.581 -5.448 0.612 1.00 . A A . 44 GLU HB2 1 1 12 8842 1 1 44 GLU HB3 H 11.867 -4.675 1.534 1.00 . A A . 44 GLU HB3 1 1 12 8843 1 1 44 GLU HG2 H 12.973 -6.897 1.761 1.00 . A A . 44 GLU HG2 1 1 12 8844 1 1 44 GLU HG3 H 11.698 -7.596 0.785 1.00 . A A . 44 GLU HG3 1 1 12 8845 1 1 44 GLU N N 9.761 -7.134 2.564 1.00 . A A . 44 GLU N 1 1 12 8846 1 1 44 GLU O O 8.520 -4.649 2.821 1.00 . A A . 44 GLU O 1 1 12 8847 1 1 44 GLU OE1 O 14.160 -5.775 -0.167 1.00 . A A . 44 GLU OE1 1 1 12 8848 1 1 44 GLU OE2 O 12.646 -6.778 -1.394 1.00 . A A . 44 GLU OE2 1 1 12 8849 1 1 45 ASP C C 9.355 -1.698 3.521 1.00 . A A . 45 ASP C 1 1 12 8850 1 1 45 ASP CA C 9.624 -2.771 4.595 1.00 . A A . 45 ASP CA 1 1 12 8851 1 1 45 ASP CB C 10.495 -2.195 5.726 1.00 . A A . 45 ASP CB 1 1 12 8852 1 1 45 ASP CG C 10.879 -3.248 6.771 1.00 . A A . 45 ASP CG 1 1 12 8853 1 1 45 ASP H H 11.224 -4.088 4.250 1.00 . A A . 45 ASP H 1 1 12 8854 1 1 45 ASP HA H 8.687 -3.117 5.006 1.00 . A A . 45 ASP HA 1 1 12 8855 1 1 45 ASP HB2 H 11.407 -1.790 5.305 1.00 . A A . 45 ASP HB2 1 1 12 8856 1 1 45 ASP HB3 H 9.941 -1.409 6.214 1.00 . A A . 45 ASP HB3 1 1 12 8857 1 1 45 ASP N N 10.290 -3.920 4.004 1.00 . A A . 45 ASP N 1 1 12 8858 1 1 45 ASP O O 10.276 -1.136 2.931 1.00 . A A . 45 ASP O 1 1 12 8859 1 1 45 ASP OD1 O 11.935 -3.899 6.594 1.00 . A A . 45 ASP OD1 1 1 12 8860 1 1 45 ASP OD2 O 10.132 -3.445 7.754 1.00 . A A . 45 ASP OD2 1 1 12 8861 1 1 46 TYR C C 7.973 0.980 2.557 1.00 . A A . 46 TYR C 1 1 12 8862 1 1 46 TYR CA C 7.672 -0.507 2.242 1.00 . A A . 46 TYR CA 1 1 12 8863 1 1 46 TYR CB C 6.189 -0.710 1.850 1.00 . A A . 46 TYR CB 1 1 12 8864 1 1 46 TYR CD1 C 6.293 0.154 -0.530 1.00 . A A . 46 TYR CD1 1 1 12 8865 1 1 46 TYR CD2 C 4.753 1.184 0.967 1.00 . A A . 46 TYR CD2 1 1 12 8866 1 1 46 TYR CE1 C 5.910 1.010 -1.535 1.00 . A A . 46 TYR CE1 1 1 12 8867 1 1 46 TYR CE2 C 4.354 2.049 -0.048 1.00 . A A . 46 TYR CE2 1 1 12 8868 1 1 46 TYR CG C 5.724 0.223 0.743 1.00 . A A . 46 TYR CG 1 1 12 8869 1 1 46 TYR CZ C 4.939 1.950 -1.289 1.00 . A A . 46 TYR CZ 1 1 12 8870 1 1 46 TYR H H 7.444 -1.960 3.784 1.00 . A A . 46 TYR H 1 1 12 8871 1 1 46 TYR HA H 8.268 -0.761 1.375 1.00 . A A . 46 TYR HA 1 1 12 8872 1 1 46 TYR HB2 H 6.026 -1.723 1.514 1.00 . A A . 46 TYR HB2 1 1 12 8873 1 1 46 TYR HB3 H 5.568 -0.511 2.713 1.00 . A A . 46 TYR HB3 1 1 12 8874 1 1 46 TYR HD1 H 7.051 -0.590 -0.733 1.00 . A A . 46 TYR HD1 1 1 12 8875 1 1 46 TYR HD2 H 4.302 1.237 1.943 1.00 . A A . 46 TYR HD2 1 1 12 8876 1 1 46 TYR HE1 H 6.359 0.935 -2.516 1.00 . A A . 46 TYR HE1 1 1 12 8877 1 1 46 TYR HE2 H 3.586 2.795 0.108 1.00 . A A . 46 TYR HE2 1 1 12 8878 1 1 46 TYR HH H 4.457 3.700 -1.923 1.00 . A A . 46 TYR HH 1 1 12 8879 1 1 46 TYR N N 8.089 -1.441 3.267 1.00 . A A . 46 TYR N 1 1 12 8880 1 1 46 TYR O O 7.505 1.557 3.553 1.00 . A A . 46 TYR O 1 1 12 8881 1 1 46 TYR OH O 4.576 2.819 -2.283 1.00 . A A . 46 TYR OH 1 1 12 8882 1 1 47 ILE C C 8.196 3.630 0.601 1.00 . A A . 47 ILE C 1 1 12 8883 1 1 47 ILE CA C 9.056 2.982 1.698 1.00 . A A . 47 ILE CA 1 1 12 8884 1 1 47 ILE CB C 10.572 3.234 1.401 1.00 . A A . 47 ILE CB 1 1 12 8885 1 1 47 ILE CD1 C 11.269 2.958 3.879 1.00 . A A . 47 ILE CD1 1 1 12 8886 1 1 47 ILE CG1 C 11.470 2.519 2.435 1.00 . A A . 47 ILE CG1 1 1 12 8887 1 1 47 ILE CG2 C 10.883 4.725 1.356 1.00 . A A . 47 ILE CG2 1 1 12 8888 1 1 47 ILE H H 9.109 0.933 1.021 1.00 . A A . 47 ILE H 1 1 12 8889 1 1 47 ILE HA H 8.790 3.379 2.667 1.00 . A A . 47 ILE HA 1 1 12 8890 1 1 47 ILE HB H 10.790 2.840 0.421 1.00 . A A . 47 ILE HB 1 1 12 8891 1 1 47 ILE HD11 H 11.453 4.020 3.975 1.00 . A A . 47 ILE HD11 1 1 12 8892 1 1 47 ILE HD12 H 11.949 2.411 4.517 1.00 . A A . 47 ILE HD12 1 1 12 8893 1 1 47 ILE HD13 H 10.256 2.731 4.171 1.00 . A A . 47 ILE HD13 1 1 12 8894 1 1 47 ILE HG12 H 11.284 1.460 2.388 1.00 . A A . 47 ILE HG12 1 1 12 8895 1 1 47 ILE HG13 H 12.502 2.693 2.179 1.00 . A A . 47 ILE HG13 1 1 12 8896 1 1 47 ILE HG21 H 10.353 5.215 0.549 1.00 . A A . 47 ILE HG21 1 1 12 8897 1 1 47 ILE HG22 H 11.947 4.878 1.229 1.00 . A A . 47 ILE HG22 1 1 12 8898 1 1 47 ILE HG23 H 10.548 5.140 2.301 1.00 . A A . 47 ILE HG23 1 1 12 8899 1 1 47 ILE N N 8.758 1.566 1.679 1.00 . A A . 47 ILE N 1 1 12 8900 1 1 47 ILE O O 8.054 3.062 -0.460 1.00 . A A . 47 ILE O 1 1 12 8901 1 1 48 CYS C C 7.493 6.509 -0.897 1.00 . A A . 48 CYS C 1 1 12 8902 1 1 48 CYS CA C 6.751 5.408 -0.148 1.00 . A A . 48 CYS CA 1 1 12 8903 1 1 48 CYS CB C 5.523 6.051 0.507 1.00 . A A . 48 CYS CB 1 1 12 8904 1 1 48 CYS H H 7.781 5.361 1.632 1.00 . A A . 48 CYS H 1 1 12 8905 1 1 48 CYS HA H 6.428 4.642 -0.834 1.00 . A A . 48 CYS HA 1 1 12 8906 1 1 48 CYS HB2 H 4.788 6.231 -0.264 1.00 . A A . 48 CYS HB2 1 1 12 8907 1 1 48 CYS HB3 H 5.105 5.384 1.242 1.00 . A A . 48 CYS HB3 1 1 12 8908 1 1 48 CYS N N 7.624 4.812 0.844 1.00 . A A . 48 CYS N 1 1 12 8909 1 1 48 CYS O O 8.630 6.824 -0.571 1.00 . A A . 48 CYS O 1 1 12 8910 1 1 48 CYS SG S 5.857 7.655 1.294 1.00 . A A . 48 CYS SG 1 1 12 8911 1 1 49 ILE C C 7.794 9.422 -1.751 1.00 . A A . 49 ILE C 1 1 12 8912 1 1 49 ILE CA C 7.327 8.229 -2.647 1.00 . A A . 49 ILE CA 1 1 12 8913 1 1 49 ILE CB C 6.258 8.692 -3.674 1.00 . A A . 49 ILE CB 1 1 12 8914 1 1 49 ILE CD1 C 5.852 10.278 -5.590 1.00 . A A . 49 ILE CD1 1 1 12 8915 1 1 49 ILE CG1 C 6.781 9.860 -4.490 1.00 . A A . 49 ILE CG1 1 1 12 8916 1 1 49 ILE CG2 C 4.928 9.044 -2.995 1.00 . A A . 49 ILE CG2 1 1 12 8917 1 1 49 ILE H H 5.913 6.776 -2.061 1.00 . A A . 49 ILE H 1 1 12 8918 1 1 49 ILE HA H 8.189 7.891 -3.205 1.00 . A A . 49 ILE HA 1 1 12 8919 1 1 49 ILE HB H 6.064 7.866 -4.347 1.00 . A A . 49 ILE HB 1 1 12 8920 1 1 49 ILE HD11 H 4.886 10.521 -5.173 1.00 . A A . 49 ILE HD11 1 1 12 8921 1 1 49 ILE HD12 H 5.743 9.423 -6.242 1.00 . A A . 49 ILE HD12 1 1 12 8922 1 1 49 ILE HD13 H 6.257 11.127 -6.120 1.00 . A A . 49 ILE HD13 1 1 12 8923 1 1 49 ILE HG12 H 6.929 10.692 -3.817 1.00 . A A . 49 ILE HG12 1 1 12 8924 1 1 49 ILE HG13 H 7.727 9.577 -4.929 1.00 . A A . 49 ILE HG13 1 1 12 8925 1 1 49 ILE HG21 H 5.078 9.856 -2.297 1.00 . A A . 49 ILE HG21 1 1 12 8926 1 1 49 ILE HG22 H 4.531 8.185 -2.477 1.00 . A A . 49 ILE HG22 1 1 12 8927 1 1 49 ILE HG23 H 4.215 9.348 -3.744 1.00 . A A . 49 ILE HG23 1 1 12 8928 1 1 49 ILE N N 6.807 7.117 -1.859 1.00 . A A . 49 ILE N 1 1 12 8929 1 1 49 ILE O O 8.833 10.020 -1.995 1.00 . A A . 49 ILE O 1 1 12 8930 1 1 50 ASN C C 8.535 10.439 1.126 1.00 . A A . 50 ASN C 1 1 12 8931 1 1 50 ASN CA C 7.369 10.814 0.235 1.00 . A A . 50 ASN CA 1 1 12 8932 1 1 50 ASN CB C 6.161 11.170 1.110 1.00 . A A . 50 ASN CB 1 1 12 8933 1 1 50 ASN CG C 4.989 11.696 0.315 1.00 . A A . 50 ASN CG 1 1 12 8934 1 1 50 ASN H H 6.238 9.161 -0.528 1.00 . A A . 50 ASN H 1 1 12 8935 1 1 50 ASN HA H 7.641 11.676 -0.353 1.00 . A A . 50 ASN HA 1 1 12 8936 1 1 50 ASN HB2 H 5.846 10.281 1.633 1.00 . A A . 50 ASN HB2 1 1 12 8937 1 1 50 ASN HB3 H 6.467 11.922 1.821 1.00 . A A . 50 ASN HB3 1 1 12 8938 1 1 50 ASN HD21 H 5.560 13.558 0.632 1.00 . A A . 50 ASN HD21 1 1 12 8939 1 1 50 ASN HD22 H 4.117 13.348 -0.287 1.00 . A A . 50 ASN HD22 1 1 12 8940 1 1 50 ASN N N 7.037 9.710 -0.689 1.00 . A A . 50 ASN N 1 1 12 8941 1 1 50 ASN ND2 N 4.883 12.988 0.209 1.00 . A A . 50 ASN ND2 1 1 12 8942 1 1 50 ASN O O 9.400 11.253 1.411 1.00 . A A . 50 ASN O 1 1 12 8943 1 1 50 ASN OD1 O 4.156 10.922 -0.173 1.00 . A A . 50 ASN OD1 1 1 12 8944 1 1 51 CYS C C 10.940 8.579 1.595 1.00 . A A . 51 CYS C 1 1 12 8945 1 1 51 CYS CA C 9.628 8.676 2.386 1.00 . A A . 51 CYS CA 1 1 12 8946 1 1 51 CYS CB C 9.284 7.292 2.968 1.00 . A A . 51 CYS CB 1 1 12 8947 1 1 51 CYS H H 7.827 8.598 1.264 1.00 . A A . 51 CYS H 1 1 12 8948 1 1 51 CYS HA H 9.764 9.371 3.202 1.00 . A A . 51 CYS HA 1 1 12 8949 1 1 51 CYS HB2 H 8.925 6.653 2.176 1.00 . A A . 51 CYS HB2 1 1 12 8950 1 1 51 CYS HB3 H 10.207 6.871 3.340 1.00 . A A . 51 CYS HB3 1 1 12 8951 1 1 51 CYS N N 8.556 9.185 1.550 1.00 . A A . 51 CYS N 1 1 12 8952 1 1 51 CYS O O 12.016 8.673 2.148 1.00 . A A . 51 CYS O 1 1 12 8953 1 1 51 CYS SG S 8.046 7.221 4.303 1.00 . A A . 51 CYS SG 1 1 12 8954 1 1 52 ALA C C 12.596 9.604 -0.952 1.00 . A A . 52 ALA C 1 1 12 8955 1 1 52 ALA CA C 11.993 8.245 -0.547 1.00 . A A . 52 ALA CA 1 1 12 8956 1 1 52 ALA CB C 11.639 7.422 -1.775 1.00 . A A . 52 ALA CB 1 1 12 8957 1 1 52 ALA H H 9.922 8.430 -0.087 1.00 . A A . 52 ALA H 1 1 12 8958 1 1 52 ALA HA H 12.706 7.678 0.044 1.00 . A A . 52 ALA HA 1 1 12 8959 1 1 52 ALA HB1 H 11.177 6.500 -1.439 1.00 . A A . 52 ALA HB1 1 1 12 8960 1 1 52 ALA HB2 H 12.527 7.209 -2.353 1.00 . A A . 52 ALA HB2 1 1 12 8961 1 1 52 ALA HB3 H 10.942 7.983 -2.387 1.00 . A A . 52 ALA HB3 1 1 12 8962 1 1 52 ALA N N 10.823 8.408 0.301 1.00 . A A . 52 ALA N 1 1 12 8963 2 2 1 ZN ZN ZN 5.911 7.518 3.567 1.00 . B A . 53 ZN ZN 1 1 12 8964 3 2 1 ZN ZN ZN -5.098 2.871 -2.071 1.00 . C A . 54 ZN ZN 1 1 13 8965 1 1 1 SER C C -11.460 6.154 1.740 1.00 . A A . 1 SER C 1 1 13 8966 1 1 1 SER CA C -12.476 6.188 2.901 1.00 . A A . 1 SER CA 1 1 13 8967 1 1 1 SER CB C -12.055 5.237 4.044 1.00 . A A . 1 SER CB 1 1 13 8968 1 1 1 SER HA H -12.527 7.204 3.266 1.00 . A A . 1 SER HA 1 1 13 8969 1 1 1 SER HB2 H -12.781 5.317 4.837 1.00 . A A . 1 SER HB2 1 1 13 8970 1 1 1 SER HB3 H -12.021 4.220 3.682 1.00 . A A . 1 SER HB3 1 1 13 8971 1 1 1 SER HG H -10.735 5.277 5.491 1.00 . A A . 1 SER HG 1 1 13 8972 1 1 1 SER N N -13.839 5.838 2.407 1.00 . A A . 1 SER N 1 1 13 8973 1 1 1 SER O O -11.623 5.387 0.774 1.00 . A A . 1 SER O 1 1 13 8974 1 1 1 SER OG O -10.773 5.581 4.581 1.00 . A A . 1 SER OG 1 1 13 8975 1 1 2 VAL C C -8.066 6.838 1.472 1.00 . A A . 2 VAL C 1 1 13 8976 1 1 2 VAL CA C -9.416 7.102 0.816 1.00 . A A . 2 VAL CA 1 1 13 8977 1 1 2 VAL CB C -9.404 8.540 0.194 1.00 . A A . 2 VAL CB 1 1 13 8978 1 1 2 VAL CG1 C -8.426 8.645 -0.973 1.00 . A A . 2 VAL CG1 1 1 13 8979 1 1 2 VAL CG2 C -10.807 8.975 -0.225 1.00 . A A . 2 VAL CG2 1 1 13 8980 1 1 2 VAL H H -10.317 7.534 2.641 1.00 . A A . 2 VAL H 1 1 13 8981 1 1 2 VAL HA H -9.621 6.375 0.044 1.00 . A A . 2 VAL HA 1 1 13 8982 1 1 2 VAL HB H -9.053 9.218 0.957 1.00 . A A . 2 VAL HB 1 1 13 8983 1 1 2 VAL HG11 H -7.424 8.431 -0.627 1.00 . A A . 2 VAL HG11 1 1 13 8984 1 1 2 VAL HG12 H -8.472 9.642 -1.385 1.00 . A A . 2 VAL HG12 1 1 13 8985 1 1 2 VAL HG13 H -8.701 7.932 -1.736 1.00 . A A . 2 VAL HG13 1 1 13 8986 1 1 2 VAL HG21 H -11.442 9.001 0.647 1.00 . A A . 2 VAL HG21 1 1 13 8987 1 1 2 VAL HG22 H -11.214 8.275 -0.939 1.00 . A A . 2 VAL HG22 1 1 13 8988 1 1 2 VAL HG23 H -10.786 9.957 -0.677 1.00 . A A . 2 VAL HG23 1 1 13 8989 1 1 2 VAL N N -10.433 6.983 1.837 1.00 . A A . 2 VAL N 1 1 13 8990 1 1 2 VAL O O -7.771 7.403 2.535 1.00 . A A . 2 VAL O 1 1 13 8991 1 1 3 CYS C C -4.928 6.638 0.928 1.00 . A A . 3 CYS C 1 1 13 8992 1 1 3 CYS CA C -5.976 5.664 1.483 1.00 . A A . 3 CYS CA 1 1 13 8993 1 1 3 CYS CB C -5.559 4.188 1.197 1.00 . A A . 3 CYS CB 1 1 13 8994 1 1 3 CYS H H -7.499 5.536 0.046 1.00 . A A . 3 CYS H 1 1 13 8995 1 1 3 CYS HA H -6.061 5.821 2.549 1.00 . A A . 3 CYS HA 1 1 13 8996 1 1 3 CYS HB2 H -5.124 3.756 2.084 1.00 . A A . 3 CYS HB2 1 1 13 8997 1 1 3 CYS HB3 H -6.433 3.611 0.934 1.00 . A A . 3 CYS HB3 1 1 13 8998 1 1 3 CYS N N -7.259 5.976 0.883 1.00 . A A . 3 CYS N 1 1 13 8999 1 1 3 CYS O O -5.259 7.551 0.153 1.00 . A A . 3 CYS O 1 1 13 9000 1 1 3 CYS SG S -4.347 3.969 -0.129 1.00 . A A . 3 CYS SG 1 1 13 9001 1 1 4 ALA C C -1.983 6.616 -0.398 1.00 . A A . 4 ALA C 1 1 13 9002 1 1 4 ALA CA C -2.626 7.278 0.806 1.00 . A A . 4 ALA CA 1 1 13 9003 1 1 4 ALA CB C -1.594 7.478 1.895 1.00 . A A . 4 ALA CB 1 1 13 9004 1 1 4 ALA H H -3.479 5.658 1.849 1.00 . A A . 4 ALA H 1 1 13 9005 1 1 4 ALA HA H -3.029 8.243 0.529 1.00 . A A . 4 ALA HA 1 1 13 9006 1 1 4 ALA HB1 H -1.214 6.513 2.201 1.00 . A A . 4 ALA HB1 1 1 13 9007 1 1 4 ALA HB2 H -2.042 7.978 2.741 1.00 . A A . 4 ALA HB2 1 1 13 9008 1 1 4 ALA HB3 H -0.778 8.071 1.507 1.00 . A A . 4 ALA HB3 1 1 13 9009 1 1 4 ALA N N -3.685 6.440 1.290 1.00 . A A . 4 ALA N 1 1 13 9010 1 1 4 ALA O O -1.610 5.468 -0.336 1.00 . A A . 4 ALA O 1 1 13 9011 1 1 5 ALA C C -1.379 8.005 -3.732 1.00 . A A . 5 ALA C 1 1 13 9012 1 1 5 ALA CA C -1.246 6.906 -2.710 1.00 . A A . 5 ALA CA 1 1 13 9013 1 1 5 ALA CB C -1.795 5.593 -3.306 1.00 . A A . 5 ALA CB 1 1 13 9014 1 1 5 ALA H H -2.516 8.116 -1.556 1.00 . A A . 5 ALA H 1 1 13 9015 1 1 5 ALA HA H -0.200 6.778 -2.462 1.00 . A A . 5 ALA HA 1 1 13 9016 1 1 5 ALA HB1 H -1.231 5.293 -4.178 1.00 . A A . 5 ALA HB1 1 1 13 9017 1 1 5 ALA HB2 H -2.823 5.721 -3.604 1.00 . A A . 5 ALA HB2 1 1 13 9018 1 1 5 ALA HB3 H -1.744 4.807 -2.570 1.00 . A A . 5 ALA HB3 1 1 13 9019 1 1 5 ALA N N -1.963 7.312 -1.502 1.00 . A A . 5 ALA N 1 1 13 9020 1 1 5 ALA O O -2.336 8.788 -3.676 1.00 . A A . 5 ALA O 1 1 13 9021 1 1 6 GLN C C -1.756 8.934 -6.524 1.00 . A A . 6 GLN C 1 1 13 9022 1 1 6 GLN CA C -0.412 9.047 -5.767 1.00 . A A . 6 GLN CA 1 1 13 9023 1 1 6 GLN CB C 0.729 8.643 -6.725 1.00 . A A . 6 GLN CB 1 1 13 9024 1 1 6 GLN CD C 3.138 8.069 -7.063 1.00 . A A . 6 GLN CD 1 1 13 9025 1 1 6 GLN CG C 2.110 8.648 -6.110 1.00 . A A . 6 GLN CG 1 1 13 9026 1 1 6 GLN H H 0.503 7.734 -4.449 1.00 . A A . 6 GLN H 1 1 13 9027 1 1 6 GLN HA H -0.243 10.057 -5.427 1.00 . A A . 6 GLN HA 1 1 13 9028 1 1 6 GLN HB2 H 0.579 7.638 -7.086 1.00 . A A . 6 GLN HB2 1 1 13 9029 1 1 6 GLN HB3 H 0.739 9.328 -7.560 1.00 . A A . 6 GLN HB3 1 1 13 9030 1 1 6 GLN HE21 H 2.826 6.222 -6.360 1.00 . A A . 6 GLN HE21 1 1 13 9031 1 1 6 GLN HE22 H 3.991 6.371 -7.615 1.00 . A A . 6 GLN HE22 1 1 13 9032 1 1 6 GLN HG2 H 2.383 9.664 -5.866 1.00 . A A . 6 GLN HG2 1 1 13 9033 1 1 6 GLN HG3 H 2.101 8.041 -5.214 1.00 . A A . 6 GLN HG3 1 1 13 9034 1 1 6 GLN N N -0.376 8.121 -4.612 1.00 . A A . 6 GLN N 1 1 13 9035 1 1 6 GLN NE2 N 3.333 6.764 -6.999 1.00 . A A . 6 GLN NE2 1 1 13 9036 1 1 6 GLN O O -2.351 9.933 -6.913 1.00 . A A . 6 GLN O 1 1 13 9037 1 1 6 GLN OE1 O 3.732 8.775 -7.852 1.00 . A A . 6 GLN OE1 1 1 13 9038 1 1 7 ASN C C -4.125 6.258 -6.637 1.00 . A A . 7 ASN C 1 1 13 9039 1 1 7 ASN CA C -3.472 7.425 -7.330 1.00 . A A . 7 ASN CA 1 1 13 9040 1 1 7 ASN CB C -3.316 7.142 -8.832 1.00 . A A . 7 ASN CB 1 1 13 9041 1 1 7 ASN CG C -4.642 6.853 -9.527 1.00 . A A . 7 ASN CG 1 1 13 9042 1 1 7 ASN H H -1.508 7.105 -6.364 1.00 . A A . 7 ASN H 1 1 13 9043 1 1 7 ASN HA H -4.086 8.305 -7.197 1.00 . A A . 7 ASN HA 1 1 13 9044 1 1 7 ASN HB2 H -2.878 8.002 -9.312 1.00 . A A . 7 ASN HB2 1 1 13 9045 1 1 7 ASN HB3 H -2.672 6.282 -8.944 1.00 . A A . 7 ASN HB3 1 1 13 9046 1 1 7 ASN HD21 H -3.725 5.729 -10.871 1.00 . A A . 7 ASN HD21 1 1 13 9047 1 1 7 ASN HD22 H -5.435 5.891 -11.055 1.00 . A A . 7 ASN HD22 1 1 13 9048 1 1 7 ASN N N -2.190 7.716 -6.704 1.00 . A A . 7 ASN N 1 1 13 9049 1 1 7 ASN ND2 N -4.597 6.079 -10.588 1.00 . A A . 7 ASN ND2 1 1 13 9050 1 1 7 ASN O O -3.682 5.119 -6.770 1.00 . A A . 7 ASN O 1 1 13 9051 1 1 7 ASN OD1 O -5.689 7.342 -9.125 1.00 . A A . 7 ASN OD1 1 1 13 9052 1 1 8 CYS C C -7.084 5.032 -5.888 1.00 . A A . 8 CYS C 1 1 13 9053 1 1 8 CYS CA C -5.810 5.462 -5.191 1.00 . A A . 8 CYS CA 1 1 13 9054 1 1 8 CYS CB C -6.062 5.760 -3.715 1.00 . A A . 8 CYS CB 1 1 13 9055 1 1 8 CYS H H -5.510 7.432 -5.798 1.00 . A A . 8 CYS H 1 1 13 9056 1 1 8 CYS HA H -5.127 4.634 -5.246 1.00 . A A . 8 CYS HA 1 1 13 9057 1 1 8 CYS HB2 H -5.135 6.005 -3.215 1.00 . A A . 8 CYS HB2 1 1 13 9058 1 1 8 CYS HB3 H -6.738 6.598 -3.635 1.00 . A A . 8 CYS HB3 1 1 13 9059 1 1 8 CYS N N -5.158 6.519 -5.880 1.00 . A A . 8 CYS N 1 1 13 9060 1 1 8 CYS O O -8.040 5.786 -5.997 1.00 . A A . 8 CYS O 1 1 13 9061 1 1 8 CYS SG S -6.827 4.352 -2.845 1.00 . A A . 8 CYS SG 1 1 13 9062 1 1 9 GLN C C -9.316 2.781 -6.010 1.00 . A A . 9 GLN C 1 1 13 9063 1 1 9 GLN CA C -8.194 3.131 -7.021 1.00 . A A . 9 GLN CA 1 1 13 9064 1 1 9 GLN CB C -7.655 1.823 -7.628 1.00 . A A . 9 GLN CB 1 1 13 9065 1 1 9 GLN CD C -5.902 0.694 -9.079 1.00 . A A . 9 GLN CD 1 1 13 9066 1 1 9 GLN CG C -6.448 2.005 -8.544 1.00 . A A . 9 GLN CG 1 1 13 9067 1 1 9 GLN H H -6.240 3.294 -6.197 1.00 . A A . 9 GLN H 1 1 13 9068 1 1 9 GLN HA H -8.556 3.766 -7.816 1.00 . A A . 9 GLN HA 1 1 13 9069 1 1 9 GLN HB2 H -7.345 1.195 -6.804 1.00 . A A . 9 GLN HB2 1 1 13 9070 1 1 9 GLN HB3 H -8.431 1.306 -8.171 1.00 . A A . 9 GLN HB3 1 1 13 9071 1 1 9 GLN HE21 H -4.074 1.446 -9.119 1.00 . A A . 9 GLN HE21 1 1 13 9072 1 1 9 GLN HE22 H -4.243 -0.184 -9.659 1.00 . A A . 9 GLN HE22 1 1 13 9073 1 1 9 GLN HG2 H -6.707 2.631 -9.383 1.00 . A A . 9 GLN HG2 1 1 13 9074 1 1 9 GLN HG3 H -5.668 2.488 -7.973 1.00 . A A . 9 GLN HG3 1 1 13 9075 1 1 9 GLN N N -7.072 3.789 -6.327 1.00 . A A . 9 GLN N 1 1 13 9076 1 1 9 GLN NE2 N -4.615 0.650 -9.306 1.00 . A A . 9 GLN NE2 1 1 13 9077 1 1 9 GLN O O -10.420 2.423 -6.382 1.00 . A A . 9 GLN O 1 1 13 9078 1 1 9 GLN OE1 O -6.626 -0.269 -9.270 1.00 . A A . 9 GLN OE1 1 1 13 9079 1 1 10 ARG C C -10.424 1.119 -3.665 1.00 . A A . 10 ARG C 1 1 13 9080 1 1 10 ARG CA C -9.803 2.540 -3.581 1.00 . A A . 10 ARG CA 1 1 13 9081 1 1 10 ARG CB C -10.880 3.585 -3.263 1.00 . A A . 10 ARG CB 1 1 13 9082 1 1 10 ARG CD C -11.361 5.908 -2.396 1.00 . A A . 10 ARG CD 1 1 13 9083 1 1 10 ARG CG C -10.345 5.006 -3.079 1.00 . A A . 10 ARG CG 1 1 13 9084 1 1 10 ARG CZ C -13.839 5.719 -2.453 1.00 . A A . 10 ARG CZ 1 1 13 9085 1 1 10 ARG H H -8.096 3.322 -4.579 1.00 . A A . 10 ARG H 1 1 13 9086 1 1 10 ARG HA H -9.114 2.516 -2.752 1.00 . A A . 10 ARG HA 1 1 13 9087 1 1 10 ARG HB2 H -11.584 3.605 -4.079 1.00 . A A . 10 ARG HB2 1 1 13 9088 1 1 10 ARG HB3 H -11.389 3.295 -2.354 1.00 . A A . 10 ARG HB3 1 1 13 9089 1 1 10 ARG HD2 H -11.514 5.565 -1.388 1.00 . A A . 10 ARG HD2 1 1 13 9090 1 1 10 ARG HD3 H -10.939 6.899 -2.380 1.00 . A A . 10 ARG HD3 1 1 13 9091 1 1 10 ARG HE H -12.634 6.247 -4.011 1.00 . A A . 10 ARG HE 1 1 13 9092 1 1 10 ARG HG2 H -9.452 4.971 -2.472 1.00 . A A . 10 ARG HG2 1 1 13 9093 1 1 10 ARG HG3 H -10.105 5.422 -4.047 1.00 . A A . 10 ARG HG3 1 1 13 9094 1 1 10 ARG HH11 H -13.031 5.077 -0.662 1.00 . A A . 10 ARG HH11 1 1 13 9095 1 1 10 ARG HH12 H -14.726 5.039 -0.732 1.00 . A A . 10 ARG HH12 1 1 13 9096 1 1 10 ARG HH21 H -15.021 6.256 -4.037 1.00 . A A . 10 ARG HH21 1 1 13 9097 1 1 10 ARG HH22 H -15.863 5.761 -2.645 1.00 . A A . 10 ARG HH22 1 1 13 9098 1 1 10 ARG N N -8.968 2.909 -4.739 1.00 . A A . 10 ARG N 1 1 13 9099 1 1 10 ARG NE N -12.663 5.963 -3.069 1.00 . A A . 10 ARG NE 1 1 13 9100 1 1 10 ARG NH1 N -13.863 5.254 -1.199 1.00 . A A . 10 ARG NH1 1 1 13 9101 1 1 10 ARG NH2 N -14.976 5.922 -3.091 1.00 . A A . 10 ARG NH2 1 1 13 9102 1 1 10 ARG O O -11.624 0.962 -3.523 1.00 . A A . 10 ARG O 1 1 13 9103 1 1 11 PRO C C -10.392 -1.865 -2.545 1.00 . A A . 11 PRO C 1 1 13 9104 1 1 11 PRO CA C -10.124 -1.310 -3.948 1.00 . A A . 11 PRO CA 1 1 13 9105 1 1 11 PRO CB C -8.974 -2.092 -4.601 1.00 . A A . 11 PRO CB 1 1 13 9106 1 1 11 PRO CD C -8.178 0.083 -4.130 1.00 . A A . 11 PRO CD 1 1 13 9107 1 1 11 PRO CG C -8.016 -1.051 -5.063 1.00 . A A . 11 PRO CG 1 1 13 9108 1 1 11 PRO HA H -11.013 -1.372 -4.557 1.00 . A A . 11 PRO HA 1 1 13 9109 1 1 11 PRO HB2 H -8.518 -2.714 -3.844 1.00 . A A . 11 PRO HB2 1 1 13 9110 1 1 11 PRO HB3 H -9.339 -2.693 -5.422 1.00 . A A . 11 PRO HB3 1 1 13 9111 1 1 11 PRO HD2 H -7.619 -0.073 -3.217 1.00 . A A . 11 PRO HD2 1 1 13 9112 1 1 11 PRO HD3 H -7.878 1.011 -4.591 1.00 . A A . 11 PRO HD3 1 1 13 9113 1 1 11 PRO HG2 H -7.011 -1.433 -4.991 1.00 . A A . 11 PRO HG2 1 1 13 9114 1 1 11 PRO HG3 H -8.240 -0.755 -6.077 1.00 . A A . 11 PRO HG3 1 1 13 9115 1 1 11 PRO N N -9.610 0.060 -3.888 1.00 . A A . 11 PRO N 1 1 13 9116 1 1 11 PRO O O -9.592 -1.642 -1.618 1.00 . A A . 11 PRO O 1 1 13 9117 1 1 12 CYS C C -12.254 -4.635 -1.291 1.00 . A A . 12 CYS C 1 1 13 9118 1 1 12 CYS CA C -11.861 -3.165 -1.112 1.00 . A A . 12 CYS CA 1 1 13 9119 1 1 12 CYS CB C -13.028 -2.359 -0.506 1.00 . A A . 12 CYS CB 1 1 13 9120 1 1 12 CYS H H -12.090 -2.732 -3.150 1.00 . A A . 12 CYS H 1 1 13 9121 1 1 12 CYS HA H -11.014 -3.102 -0.447 1.00 . A A . 12 CYS HA 1 1 13 9122 1 1 12 CYS HB2 H -12.731 -1.327 -0.402 1.00 . A A . 12 CYS HB2 1 1 13 9123 1 1 12 CYS HB3 H -13.867 -2.411 -1.184 1.00 . A A . 12 CYS HB3 1 1 13 9124 1 1 12 CYS HG H -14.060 -4.143 0.971 1.00 . A A . 12 CYS HG 1 1 13 9125 1 1 12 CYS N N -11.487 -2.587 -2.393 1.00 . A A . 12 CYS N 1 1 13 9126 1 1 12 CYS O O -13.210 -4.935 -1.991 1.00 . A A . 12 CYS O 1 1 13 9127 1 1 12 CYS SG S -13.575 -2.918 1.121 1.00 . A A . 12 CYS SG 1 1 13 9128 1 1 13 LYS C C -11.255 -7.667 0.516 1.00 . A A . 13 LYS C 1 1 13 9129 1 1 13 LYS CA C -11.745 -6.990 -0.762 1.00 . A A . 13 LYS CA 1 1 13 9130 1 1 13 LYS CB C -10.998 -7.642 -1.950 1.00 . A A . 13 LYS CB 1 1 13 9131 1 1 13 LYS CD C -10.568 -7.850 -4.405 1.00 . A A . 13 LYS CD 1 1 13 9132 1 1 13 LYS CE C -10.858 -7.299 -5.790 1.00 . A A . 13 LYS CE 1 1 13 9133 1 1 13 LYS CG C -11.314 -7.085 -3.328 1.00 . A A . 13 LYS CG 1 1 13 9134 1 1 13 LYS H H -10.714 -5.264 -0.146 1.00 . A A . 13 LYS H 1 1 13 9135 1 1 13 LYS HA H -12.808 -7.158 -0.874 1.00 . A A . 13 LYS HA 1 1 13 9136 1 1 13 LYS HB2 H -9.935 -7.540 -1.791 1.00 . A A . 13 LYS HB2 1 1 13 9137 1 1 13 LYS HB3 H -11.234 -8.697 -1.952 1.00 . A A . 13 LYS HB3 1 1 13 9138 1 1 13 LYS HD2 H -9.511 -7.756 -4.211 1.00 . A A . 13 LYS HD2 1 1 13 9139 1 1 13 LYS HD3 H -10.866 -8.887 -4.354 1.00 . A A . 13 LYS HD3 1 1 13 9140 1 1 13 LYS HE2 H -11.924 -7.340 -5.958 1.00 . A A . 13 LYS HE2 1 1 13 9141 1 1 13 LYS HE3 H -10.522 -6.273 -5.851 1.00 . A A . 13 LYS HE3 1 1 13 9142 1 1 13 LYS HG2 H -12.376 -7.183 -3.492 1.00 . A A . 13 LYS HG2 1 1 13 9143 1 1 13 LYS HG3 H -11.029 -6.043 -3.359 1.00 . A A . 13 LYS HG3 1 1 13 9144 1 1 13 LYS HZ1 H -9.154 -8.160 -6.664 1.00 . A A . 13 LYS HZ1 1 1 13 9145 1 1 13 LYS HZ2 H -10.334 -7.729 -7.800 1.00 . A A . 13 LYS HZ2 1 1 13 9146 1 1 13 LYS HZ3 H -10.574 -9.053 -6.845 1.00 . A A . 13 LYS HZ3 1 1 13 9147 1 1 13 LYS N N -11.482 -5.545 -0.686 1.00 . A A . 13 LYS N 1 1 13 9148 1 1 13 LYS NZ N -10.180 -8.089 -6.833 1.00 . A A . 13 LYS NZ 1 1 13 9149 1 1 13 LYS O O -10.370 -7.136 1.188 1.00 . A A . 13 LYS O 1 1 13 9150 1 1 14 ASP C C -10.003 -10.206 1.855 1.00 . A A . 14 ASP C 1 1 13 9151 1 1 14 ASP CA C -11.406 -9.639 2.016 1.00 . A A . 14 ASP CA 1 1 13 9152 1 1 14 ASP CB C -12.350 -10.847 2.207 1.00 . A A . 14 ASP CB 1 1 13 9153 1 1 14 ASP CG C -13.773 -10.481 2.463 1.00 . A A . 14 ASP CG 1 1 13 9154 1 1 14 ASP H H -12.564 -9.190 0.303 1.00 . A A . 14 ASP H 1 1 13 9155 1 1 14 ASP HA H -11.465 -9.023 2.902 1.00 . A A . 14 ASP HA 1 1 13 9156 1 1 14 ASP HB2 H -12.331 -11.456 1.317 1.00 . A A . 14 ASP HB2 1 1 13 9157 1 1 14 ASP HB3 H -12.005 -11.451 3.029 1.00 . A A . 14 ASP HB3 1 1 13 9158 1 1 14 ASP N N -11.813 -8.836 0.832 1.00 . A A . 14 ASP N 1 1 13 9159 1 1 14 ASP O O -9.386 -10.642 2.817 1.00 . A A . 14 ASP O 1 1 13 9160 1 1 14 ASP OD1 O -14.479 -10.153 1.496 1.00 . A A . 14 ASP OD1 1 1 13 9161 1 1 14 ASP OD2 O -14.205 -10.548 3.629 1.00 . A A . 14 ASP OD2 1 1 13 9162 1 1 15 LYS C C -7.162 -9.911 -0.123 1.00 . A A . 15 LYS C 1 1 13 9163 1 1 15 LYS CA C -8.264 -10.873 0.325 1.00 . A A . 15 LYS CA 1 1 13 9164 1 1 15 LYS CB C -8.540 -11.936 -0.759 1.00 . A A . 15 LYS CB 1 1 13 9165 1 1 15 LYS CD C -9.840 -14.005 -1.426 1.00 . A A . 15 LYS CD 1 1 13 9166 1 1 15 LYS CE C -10.860 -15.047 -0.972 1.00 . A A . 15 LYS CE 1 1 13 9167 1 1 15 LYS CG C -9.543 -13.007 -0.317 1.00 . A A . 15 LYS CG 1 1 13 9168 1 1 15 LYS H H -9.956 -9.672 -0.058 1.00 . A A . 15 LYS H 1 1 13 9169 1 1 15 LYS HA H -7.940 -11.388 1.216 1.00 . A A . 15 LYS HA 1 1 13 9170 1 1 15 LYS HB2 H -8.943 -11.438 -1.628 1.00 . A A . 15 LYS HB2 1 1 13 9171 1 1 15 LYS HB3 H -7.616 -12.424 -1.040 1.00 . A A . 15 LYS HB3 1 1 13 9172 1 1 15 LYS HD2 H -10.227 -13.474 -2.284 1.00 . A A . 15 LYS HD2 1 1 13 9173 1 1 15 LYS HD3 H -8.922 -14.503 -1.705 1.00 . A A . 15 LYS HD3 1 1 13 9174 1 1 15 LYS HE2 H -10.477 -15.561 -0.105 1.00 . A A . 15 LYS HE2 1 1 13 9175 1 1 15 LYS HE3 H -11.771 -14.545 -0.689 1.00 . A A . 15 LYS HE3 1 1 13 9176 1 1 15 LYS HG2 H -9.144 -13.540 0.534 1.00 . A A . 15 LYS HG2 1 1 13 9177 1 1 15 LYS HG3 H -10.457 -12.516 -0.024 1.00 . A A . 15 LYS HG3 1 1 13 9178 1 1 15 LYS HZ1 H -11.585 -15.571 -2.862 1.00 . A A . 15 LYS HZ1 1 1 13 9179 1 1 15 LYS HZ2 H -11.844 -16.746 -1.696 1.00 . A A . 15 LYS HZ2 1 1 13 9180 1 1 15 LYS HZ3 H -10.309 -16.540 -2.338 1.00 . A A . 15 LYS HZ3 1 1 13 9181 1 1 15 LYS N N -9.502 -10.188 0.638 1.00 . A A . 15 LYS N 1 1 13 9182 1 1 15 LYS NZ N -11.162 -16.034 -2.031 1.00 . A A . 15 LYS NZ 1 1 13 9183 1 1 15 LYS O O -6.171 -10.331 -0.724 1.00 . A A . 15 LYS O 1 1 13 9184 1 1 16 VAL C C -5.577 -7.043 0.994 1.00 . A A . 16 VAL C 1 1 13 9185 1 1 16 VAL CA C -6.296 -7.670 -0.211 1.00 . A A . 16 VAL CA 1 1 13 9186 1 1 16 VAL CB C -6.825 -6.573 -1.186 1.00 . A A . 16 VAL CB 1 1 13 9187 1 1 16 VAL CG1 C -7.946 -5.784 -0.546 1.00 . A A . 16 VAL CG1 1 1 13 9188 1 1 16 VAL CG2 C -5.693 -5.639 -1.610 1.00 . A A . 16 VAL CG2 1 1 13 9189 1 1 16 VAL H H -8.083 -8.330 0.703 1.00 . A A . 16 VAL H 1 1 13 9190 1 1 16 VAL HA H -5.547 -8.251 -0.731 1.00 . A A . 16 VAL HA 1 1 13 9191 1 1 16 VAL HB H -7.222 -7.055 -2.064 1.00 . A A . 16 VAL HB 1 1 13 9192 1 1 16 VAL HG11 H -8.746 -6.461 -0.289 1.00 . A A . 16 VAL HG11 1 1 13 9193 1 1 16 VAL HG12 H -8.301 -5.022 -1.222 1.00 . A A . 16 VAL HG12 1 1 13 9194 1 1 16 VAL HG13 H -7.534 -5.347 0.353 1.00 . A A . 16 VAL HG13 1 1 13 9195 1 1 16 VAL HG21 H -5.361 -5.111 -0.726 1.00 . A A . 16 VAL HG21 1 1 13 9196 1 1 16 VAL HG22 H -6.058 -4.911 -2.319 1.00 . A A . 16 VAL HG22 1 1 13 9197 1 1 16 VAL HG23 H -4.859 -6.202 -2.005 1.00 . A A . 16 VAL HG23 1 1 13 9198 1 1 16 VAL N N -7.306 -8.635 0.186 1.00 . A A . 16 VAL N 1 1 13 9199 1 1 16 VAL O O -6.141 -6.275 1.753 1.00 . A A . 16 VAL O 1 1 13 9200 1 1 17 ASP C C -2.973 -5.495 1.856 1.00 . A A . 17 ASP C 1 1 13 9201 1 1 17 ASP CA C -3.487 -6.916 2.212 1.00 . A A . 17 ASP CA 1 1 13 9202 1 1 17 ASP CB C -2.344 -7.902 2.491 1.00 . A A . 17 ASP CB 1 1 13 9203 1 1 17 ASP CG C -1.418 -7.447 3.594 1.00 . A A . 17 ASP CG 1 1 13 9204 1 1 17 ASP H H -4.140 -8.244 0.653 1.00 . A A . 17 ASP H 1 1 13 9205 1 1 17 ASP HA H -4.091 -6.825 3.099 1.00 . A A . 17 ASP HA 1 1 13 9206 1 1 17 ASP HB2 H -2.777 -8.853 2.779 1.00 . A A . 17 ASP HB2 1 1 13 9207 1 1 17 ASP HB3 H -1.771 -8.040 1.588 1.00 . A A . 17 ASP HB3 1 1 13 9208 1 1 17 ASP N N -4.373 -7.462 1.182 1.00 . A A . 17 ASP N 1 1 13 9209 1 1 17 ASP O O -2.797 -5.150 0.656 1.00 . A A . 17 ASP O 1 1 13 9210 1 1 17 ASP OD1 O -1.848 -7.443 4.776 1.00 . A A . 17 ASP OD1 1 1 13 9211 1 1 17 ASP OD2 O -0.282 -7.123 3.305 1.00 . A A . 17 ASP OD2 1 1 13 9212 1 1 18 TRP C C -0.968 -3.070 3.294 1.00 . A A . 18 TRP C 1 1 13 9213 1 1 18 TRP CA C -2.385 -3.283 2.787 1.00 . A A . 18 TRP CA 1 1 13 9214 1 1 18 TRP CB C -3.341 -2.442 3.637 1.00 . A A . 18 TRP CB 1 1 13 9215 1 1 18 TRP CD1 C -5.564 -3.530 2.951 1.00 . A A . 18 TRP CD1 1 1 13 9216 1 1 18 TRP CD2 C -5.600 -1.303 2.994 1.00 . A A . 18 TRP CD2 1 1 13 9217 1 1 18 TRP CE2 C -6.879 -1.768 2.614 1.00 . A A . 18 TRP CE2 1 1 13 9218 1 1 18 TRP CE3 C -5.381 0.073 3.100 1.00 . A A . 18 TRP CE3 1 1 13 9219 1 1 18 TRP CG C -4.775 -2.450 3.189 1.00 . A A . 18 TRP CG 1 1 13 9220 1 1 18 TRP CH2 C -7.694 0.451 2.461 1.00 . A A . 18 TRP CH2 1 1 13 9221 1 1 18 TRP CZ2 C -7.942 -0.895 2.342 1.00 . A A . 18 TRP CZ2 1 1 13 9222 1 1 18 TRP CZ3 C -6.421 0.933 2.833 1.00 . A A . 18 TRP CZ3 1 1 13 9223 1 1 18 TRP H H -2.782 -5.092 3.789 1.00 . A A . 18 TRP H 1 1 13 9224 1 1 18 TRP HA H -2.470 -2.964 1.758 1.00 . A A . 18 TRP HA 1 1 13 9225 1 1 18 TRP HB2 H -3.320 -2.808 4.652 1.00 . A A . 18 TRP HB2 1 1 13 9226 1 1 18 TRP HB3 H -3.002 -1.417 3.616 1.00 . A A . 18 TRP HB3 1 1 13 9227 1 1 18 TRP HD1 H -5.217 -4.550 3.019 1.00 . A A . 18 TRP HD1 1 1 13 9228 1 1 18 TRP HE1 H -7.532 -3.766 2.349 1.00 . A A . 18 TRP HE1 1 1 13 9229 1 1 18 TRP HE3 H -4.415 0.471 3.384 1.00 . A A . 18 TRP HE3 1 1 13 9230 1 1 18 TRP HH2 H -8.481 1.163 2.256 1.00 . A A . 18 TRP HH2 1 1 13 9231 1 1 18 TRP HZ2 H -8.928 -1.235 2.058 1.00 . A A . 18 TRP HZ2 1 1 13 9232 1 1 18 TRP HZ3 H -6.244 1.996 2.914 1.00 . A A . 18 TRP HZ3 1 1 13 9233 1 1 18 TRP N N -2.752 -4.695 2.893 1.00 . A A . 18 TRP N 1 1 13 9234 1 1 18 TRP NE1 N -6.817 -3.133 2.581 1.00 . A A . 18 TRP NE1 1 1 13 9235 1 1 18 TRP O O -0.465 -3.869 4.073 1.00 . A A . 18 TRP O 1 1 13 9236 1 1 19 VAL C C 1.165 -0.346 3.907 1.00 . A A . 19 VAL C 1 1 13 9237 1 1 19 VAL CA C 1.034 -1.720 3.262 1.00 . A A . 19 VAL CA 1 1 13 9238 1 1 19 VAL CB C 2.011 -1.829 2.035 1.00 . A A . 19 VAL CB 1 1 13 9239 1 1 19 VAL CG1 C 2.111 -3.258 1.544 1.00 . A A . 19 VAL CG1 1 1 13 9240 1 1 19 VAL CG2 C 1.539 -0.931 0.887 1.00 . A A . 19 VAL CG2 1 1 13 9241 1 1 19 VAL H H -0.712 -1.222 2.388 1.00 . A A . 19 VAL H 1 1 13 9242 1 1 19 VAL HA H 1.320 -2.469 3.987 1.00 . A A . 19 VAL HA 1 1 13 9243 1 1 19 VAL HB H 2.994 -1.496 2.338 1.00 . A A . 19 VAL HB 1 1 13 9244 1 1 19 VAL HG11 H 2.463 -3.918 2.326 1.00 . A A . 19 VAL HG11 1 1 13 9245 1 1 19 VAL HG12 H 2.800 -3.276 0.715 1.00 . A A . 19 VAL HG12 1 1 13 9246 1 1 19 VAL HG13 H 1.143 -3.586 1.195 1.00 . A A . 19 VAL HG13 1 1 13 9247 1 1 19 VAL HG21 H 1.516 0.094 1.228 1.00 . A A . 19 VAL HG21 1 1 13 9248 1 1 19 VAL HG22 H 0.546 -1.230 0.580 1.00 . A A . 19 VAL HG22 1 1 13 9249 1 1 19 VAL HG23 H 2.223 -1.016 0.056 1.00 . A A . 19 VAL HG23 1 1 13 9250 1 1 19 VAL N N -0.336 -1.982 2.889 1.00 . A A . 19 VAL N 1 1 13 9251 1 1 19 VAL O O 0.618 0.635 3.409 1.00 . A A . 19 VAL O 1 1 13 9252 1 1 20 GLN C C 3.542 1.369 5.339 1.00 . A A . 20 GLN C 1 1 13 9253 1 1 20 GLN CA C 2.120 0.952 5.699 1.00 . A A . 20 GLN CA 1 1 13 9254 1 1 20 GLN CB C 1.972 0.789 7.230 1.00 . A A . 20 GLN CB 1 1 13 9255 1 1 20 GLN CD C 2.063 1.923 9.504 1.00 . A A . 20 GLN CD 1 1 13 9256 1 1 20 GLN CG C 2.208 2.079 8.004 1.00 . A A . 20 GLN CG 1 1 13 9257 1 1 20 GLN H H 2.170 -1.138 5.392 1.00 . A A . 20 GLN H 1 1 13 9258 1 1 20 GLN HA H 1.429 1.699 5.341 1.00 . A A . 20 GLN HA 1 1 13 9259 1 1 20 GLN HB2 H 0.966 0.450 7.427 1.00 . A A . 20 GLN HB2 1 1 13 9260 1 1 20 GLN HB3 H 2.677 0.044 7.568 1.00 . A A . 20 GLN HB3 1 1 13 9261 1 1 20 GLN HE21 H 3.426 3.317 9.789 1.00 . A A . 20 GLN HE21 1 1 13 9262 1 1 20 GLN HE22 H 2.751 2.667 11.213 1.00 . A A . 20 GLN HE22 1 1 13 9263 1 1 20 GLN HG2 H 3.194 2.448 7.777 1.00 . A A . 20 GLN HG2 1 1 13 9264 1 1 20 GLN HG3 H 1.490 2.815 7.673 1.00 . A A . 20 GLN HG3 1 1 13 9265 1 1 20 GLN N N 1.838 -0.299 5.015 1.00 . A A . 20 GLN N 1 1 13 9266 1 1 20 GLN NE2 N 2.818 2.697 10.239 1.00 . A A . 20 GLN NE2 1 1 13 9267 1 1 20 GLN O O 4.408 0.522 5.242 1.00 . A A . 20 GLN O 1 1 13 9268 1 1 20 GLN OE1 O 1.298 1.103 9.992 1.00 . A A . 20 GLN OE1 1 1 13 9269 1 1 21 CYS C C 5.995 3.281 5.971 1.00 . A A . 21 CYS C 1 1 13 9270 1 1 21 CYS CA C 5.115 3.053 4.727 1.00 . A A . 21 CYS CA 1 1 13 9271 1 1 21 CYS CB C 5.133 4.256 3.753 1.00 . A A . 21 CYS CB 1 1 13 9272 1 1 21 CYS H H 3.031 3.286 5.153 1.00 . A A . 21 CYS H 1 1 13 9273 1 1 21 CYS HA H 5.538 2.198 4.222 1.00 . A A . 21 CYS HA 1 1 13 9274 1 1 21 CYS HB2 H 6.108 4.499 3.368 1.00 . A A . 21 CYS HB2 1 1 13 9275 1 1 21 CYS HB3 H 4.500 4.008 2.916 1.00 . A A . 21 CYS HB3 1 1 13 9276 1 1 21 CYS N N 3.775 2.649 5.088 1.00 . A A . 21 CYS N 1 1 13 9277 1 1 21 CYS O O 5.843 4.287 6.705 1.00 . A A . 21 CYS O 1 1 13 9278 1 1 21 CYS SG S 4.535 5.813 4.377 1.00 . A A . 21 CYS SG 1 1 13 9279 1 1 22 ASP C C 8.949 3.391 7.244 1.00 . A A . 22 ASP C 1 1 13 9280 1 1 22 ASP CA C 7.845 2.346 7.350 1.00 . A A . 22 ASP CA 1 1 13 9281 1 1 22 ASP CB C 8.492 0.952 7.518 1.00 . A A . 22 ASP CB 1 1 13 9282 1 1 22 ASP CG C 7.494 -0.156 7.789 1.00 . A A . 22 ASP CG 1 1 13 9283 1 1 22 ASP H H 7.048 1.638 5.517 1.00 . A A . 22 ASP H 1 1 13 9284 1 1 22 ASP HA H 7.251 2.553 8.230 1.00 . A A . 22 ASP HA 1 1 13 9285 1 1 22 ASP HB2 H 9.028 0.707 6.613 1.00 . A A . 22 ASP HB2 1 1 13 9286 1 1 22 ASP HB3 H 9.201 0.994 8.331 1.00 . A A . 22 ASP HB3 1 1 13 9287 1 1 22 ASP N N 6.941 2.366 6.175 1.00 . A A . 22 ASP N 1 1 13 9288 1 1 22 ASP O O 9.936 3.339 7.965 1.00 . A A . 22 ASP O 1 1 13 9289 1 1 22 ASP OD1 O 7.123 -0.368 8.982 1.00 . A A . 22 ASP OD1 1 1 13 9290 1 1 22 ASP OD2 O 7.075 -0.817 6.819 1.00 . A A . 22 ASP OD2 1 1 13 9291 1 1 23 GLY C C 9.511 6.592 7.128 1.00 . A A . 23 GLY C 1 1 13 9292 1 1 23 GLY CA C 9.751 5.392 6.223 1.00 . A A . 23 GLY CA 1 1 13 9293 1 1 23 GLY H H 7.886 4.409 5.947 1.00 . A A . 23 GLY H 1 1 13 9294 1 1 23 GLY HA2 H 10.730 4.979 6.424 1.00 . A A . 23 GLY HA2 1 1 13 9295 1 1 23 GLY HA3 H 9.724 5.719 5.194 1.00 . A A . 23 GLY HA3 1 1 13 9296 1 1 23 GLY N N 8.752 4.374 6.398 1.00 . A A . 23 GLY N 1 1 13 9297 1 1 23 GLY O O 10.422 7.377 7.359 1.00 . A A . 23 GLY O 1 1 13 9298 1 1 24 GLY C C 6.640 8.532 8.387 1.00 . A A . 24 GLY C 1 1 13 9299 1 1 24 GLY CA C 8.018 7.851 8.542 1.00 . A A . 24 GLY CA 1 1 13 9300 1 1 24 GLY H H 7.604 6.061 7.440 1.00 . A A . 24 GLY H 1 1 13 9301 1 1 24 GLY HA2 H 8.100 7.495 9.558 1.00 . A A . 24 GLY HA2 1 1 13 9302 1 1 24 GLY HA3 H 8.780 8.602 8.388 1.00 . A A . 24 GLY HA3 1 1 13 9303 1 1 24 GLY N N 8.284 6.737 7.642 1.00 . A A . 24 GLY N 1 1 13 9304 1 1 24 GLY O O 6.299 9.401 9.191 1.00 . A A . 24 GLY O 1 1 13 9305 1 1 25 CYS C C 3.473 8.104 8.017 1.00 . A A . 25 CYS C 1 1 13 9306 1 1 25 CYS CA C 4.528 8.849 7.211 1.00 . A A . 25 CYS CA 1 1 13 9307 1 1 25 CYS CB C 4.064 8.873 5.750 1.00 . A A . 25 CYS CB 1 1 13 9308 1 1 25 CYS H H 6.133 7.469 6.760 1.00 . A A . 25 CYS H 1 1 13 9309 1 1 25 CYS HA H 4.620 9.860 7.583 1.00 . A A . 25 CYS HA 1 1 13 9310 1 1 25 CYS HB2 H 3.742 7.878 5.475 1.00 . A A . 25 CYS HB2 1 1 13 9311 1 1 25 CYS HB3 H 3.220 9.542 5.667 1.00 . A A . 25 CYS HB3 1 1 13 9312 1 1 25 CYS N N 5.844 8.169 7.374 1.00 . A A . 25 CYS N 1 1 13 9313 1 1 25 CYS O O 2.465 8.673 8.414 1.00 . A A . 25 CYS O 1 1 13 9314 1 1 25 CYS SG S 5.300 9.385 4.552 1.00 . A A . 25 CYS SG 1 1 13 9315 1 1 26 ASP C C 1.475 5.722 8.228 1.00 . A A . 26 ASP C 1 1 13 9316 1 1 26 ASP CA C 2.823 5.867 8.933 1.00 . A A . 26 ASP CA 1 1 13 9317 1 1 26 ASP CB C 2.629 6.206 10.438 1.00 . A A . 26 ASP CB 1 1 13 9318 1 1 26 ASP CG C 3.850 5.913 11.293 1.00 . A A . 26 ASP CG 1 1 13 9319 1 1 26 ASP H H 4.622 6.478 7.970 1.00 . A A . 26 ASP H 1 1 13 9320 1 1 26 ASP HA H 3.309 4.906 8.865 1.00 . A A . 26 ASP HA 1 1 13 9321 1 1 26 ASP HB2 H 2.367 7.245 10.551 1.00 . A A . 26 ASP HB2 1 1 13 9322 1 1 26 ASP HB3 H 1.805 5.609 10.803 1.00 . A A . 26 ASP HB3 1 1 13 9323 1 1 26 ASP N N 3.741 6.800 8.242 1.00 . A A . 26 ASP N 1 1 13 9324 1 1 26 ASP O O 0.515 5.213 8.810 1.00 . A A . 26 ASP O 1 1 13 9325 1 1 26 ASP OD1 O 4.784 6.709 11.302 1.00 . A A . 26 ASP OD1 1 1 13 9326 1 1 26 ASP OD2 O 3.861 4.857 11.982 1.00 . A A . 26 ASP OD2 1 1 13 9327 1 1 27 GLU C C 0.011 4.628 5.589 1.00 . A A . 27 GLU C 1 1 13 9328 1 1 27 GLU CA C 0.188 6.020 6.208 1.00 . A A . 27 GLU CA 1 1 13 9329 1 1 27 GLU CB C 0.114 7.102 5.127 1.00 . A A . 27 GLU CB 1 1 13 9330 1 1 27 GLU CD C -0.007 9.556 4.592 1.00 . A A . 27 GLU CD 1 1 13 9331 1 1 27 GLU CG C 0.182 8.515 5.665 1.00 . A A . 27 GLU CG 1 1 13 9332 1 1 27 GLU H H 2.226 6.438 6.520 1.00 . A A . 27 GLU H 1 1 13 9333 1 1 27 GLU HA H -0.618 6.175 6.908 1.00 . A A . 27 GLU HA 1 1 13 9334 1 1 27 GLU HB2 H 0.940 6.965 4.447 1.00 . A A . 27 GLU HB2 1 1 13 9335 1 1 27 GLU HB3 H -0.810 6.996 4.577 1.00 . A A . 27 GLU HB3 1 1 13 9336 1 1 27 GLU HG2 H -0.596 8.644 6.403 1.00 . A A . 27 GLU HG2 1 1 13 9337 1 1 27 GLU HG3 H 1.143 8.652 6.136 1.00 . A A . 27 GLU HG3 1 1 13 9338 1 1 27 GLU N N 1.420 6.105 6.958 1.00 . A A . 27 GLU N 1 1 13 9339 1 1 27 GLU O O 0.980 3.872 5.419 1.00 . A A . 27 GLU O 1 1 13 9340 1 1 27 GLU OE1 O 0.986 9.904 3.908 1.00 . A A . 27 GLU OE1 1 1 13 9341 1 1 27 GLU OE2 O -1.167 10.033 4.426 1.00 . A A . 27 GLU OE2 1 1 13 9342 1 1 28 TRP C C -1.904 3.163 3.206 1.00 . A A . 28 TRP C 1 1 13 9343 1 1 28 TRP CA C -1.586 3.022 4.678 1.00 . A A . 28 TRP CA 1 1 13 9344 1 1 28 TRP CB C -2.752 2.383 5.431 1.00 . A A . 28 TRP CB 1 1 13 9345 1 1 28 TRP CD1 C -2.284 2.772 7.929 1.00 . A A . 28 TRP CD1 1 1 13 9346 1 1 28 TRP CD2 C -2.104 0.643 7.273 1.00 . A A . 28 TRP CD2 1 1 13 9347 1 1 28 TRP CE2 C -1.814 0.706 8.641 1.00 . A A . 28 TRP CE2 1 1 13 9348 1 1 28 TRP CE3 C -2.055 -0.605 6.632 1.00 . A A . 28 TRP CE3 1 1 13 9349 1 1 28 TRP CG C -2.394 1.971 6.829 1.00 . A A . 28 TRP CG 1 1 13 9350 1 1 28 TRP CH2 C -1.446 -1.631 8.736 1.00 . A A . 28 TRP CH2 1 1 13 9351 1 1 28 TRP CZ2 C -1.484 -0.428 9.389 1.00 . A A . 28 TRP CZ2 1 1 13 9352 1 1 28 TRP CZ3 C -1.730 -1.724 7.370 1.00 . A A . 28 TRP CZ3 1 1 13 9353 1 1 28 TRP H H -1.878 5.021 5.405 1.00 . A A . 28 TRP H 1 1 13 9354 1 1 28 TRP HA H -0.721 2.385 4.770 1.00 . A A . 28 TRP HA 1 1 13 9355 1 1 28 TRP HB2 H -3.589 3.066 5.479 1.00 . A A . 28 TRP HB2 1 1 13 9356 1 1 28 TRP HB3 H -3.067 1.507 4.889 1.00 . A A . 28 TRP HB3 1 1 13 9357 1 1 28 TRP HD1 H -2.446 3.841 7.912 1.00 . A A . 28 TRP HD1 1 1 13 9358 1 1 28 TRP HE1 H -1.778 2.363 9.924 1.00 . A A . 28 TRP HE1 1 1 13 9359 1 1 28 TRP HE3 H -2.271 -0.697 5.579 1.00 . A A . 28 TRP HE3 1 1 13 9360 1 1 28 TRP HH2 H -1.196 -2.528 9.285 1.00 . A A . 28 TRP HH2 1 1 13 9361 1 1 28 TRP HZ2 H -1.261 -0.373 10.445 1.00 . A A . 28 TRP HZ2 1 1 13 9362 1 1 28 TRP HZ3 H -1.691 -2.689 6.886 1.00 . A A . 28 TRP HZ3 1 1 13 9363 1 1 28 TRP N N -1.219 4.311 5.262 1.00 . A A . 28 TRP N 1 1 13 9364 1 1 28 TRP NE1 N -1.927 2.017 9.020 1.00 . A A . 28 TRP NE1 1 1 13 9365 1 1 28 TRP O O -2.736 3.989 2.808 1.00 . A A . 28 TRP O 1 1 13 9366 1 1 29 PHE C C -1.862 1.004 0.506 1.00 . A A . 29 PHE C 1 1 13 9367 1 1 29 PHE CA C -1.340 2.376 0.978 1.00 . A A . 29 PHE CA 1 1 13 9368 1 1 29 PHE CB C 0.075 2.619 0.345 1.00 . A A . 29 PHE CB 1 1 13 9369 1 1 29 PHE CD1 C 1.233 3.983 2.131 1.00 . A A . 29 PHE CD1 1 1 13 9370 1 1 29 PHE CD2 C 1.135 4.893 -0.061 1.00 . A A . 29 PHE CD2 1 1 13 9371 1 1 29 PHE CE1 C 1.930 5.079 2.555 1.00 . A A . 29 PHE CE1 1 1 13 9372 1 1 29 PHE CE2 C 1.828 6.002 0.366 1.00 . A A . 29 PHE CE2 1 1 13 9373 1 1 29 PHE CG C 0.824 3.863 0.818 1.00 . A A . 29 PHE CG 1 1 13 9374 1 1 29 PHE CZ C 2.219 6.096 1.683 1.00 . A A . 29 PHE CZ 1 1 13 9375 1 1 29 PHE H H -0.608 1.711 2.814 1.00 . A A . 29 PHE H 1 1 13 9376 1 1 29 PHE HA H -2.003 3.167 0.670 1.00 . A A . 29 PHE HA 1 1 13 9377 1 1 29 PHE HB2 H 0.730 1.783 0.530 1.00 . A A . 29 PHE HB2 1 1 13 9378 1 1 29 PHE HB3 H -0.044 2.705 -0.724 1.00 . A A . 29 PHE HB3 1 1 13 9379 1 1 29 PHE HD1 H 0.998 3.187 2.823 1.00 . A A . 29 PHE HD1 1 1 13 9380 1 1 29 PHE HD2 H 0.823 4.838 -1.095 1.00 . A A . 29 PHE HD2 1 1 13 9381 1 1 29 PHE HE1 H 2.236 5.153 3.589 1.00 . A A . 29 PHE HE1 1 1 13 9382 1 1 29 PHE HE2 H 2.051 6.795 -0.335 1.00 . A A . 29 PHE HE2 1 1 13 9383 1 1 29 PHE HZ H 2.773 6.948 2.047 1.00 . A A . 29 PHE HZ 1 1 13 9384 1 1 29 PHE N N -1.232 2.360 2.415 1.00 . A A . 29 PHE N 1 1 13 9385 1 1 29 PHE O O -1.776 0.006 1.236 1.00 . A A . 29 PHE O 1 1 13 9386 1 1 30 HIS C C -1.783 -0.817 -2.225 1.00 . A A . 30 HIS C 1 1 13 9387 1 1 30 HIS CA C -2.854 -0.312 -1.312 1.00 . A A . 30 HIS CA 1 1 13 9388 1 1 30 HIS CB C -4.112 -0.141 -2.177 1.00 . A A . 30 HIS CB 1 1 13 9389 1 1 30 HIS CD2 C -6.282 -0.895 -1.026 1.00 . A A . 30 HIS CD2 1 1 13 9390 1 1 30 HIS CE1 C -7.253 1.053 -0.895 1.00 . A A . 30 HIS CE1 1 1 13 9391 1 1 30 HIS CG C -5.416 0.019 -1.508 1.00 . A A . 30 HIS CG 1 1 13 9392 1 1 30 HIS H H -2.489 1.818 -1.162 1.00 . A A . 30 HIS H 1 1 13 9393 1 1 30 HIS HA H -3.051 -1.030 -0.530 1.00 . A A . 30 HIS HA 1 1 13 9394 1 1 30 HIS HB2 H -3.952 0.826 -2.633 1.00 . A A . 30 HIS HB2 1 1 13 9395 1 1 30 HIS HB3 H -4.203 -0.829 -3.004 1.00 . A A . 30 HIS HB3 1 1 13 9396 1 1 30 HIS HD2 H -6.100 -1.958 -0.957 1.00 . A A . 30 HIS HD2 1 1 13 9397 1 1 30 HIS HE1 H -7.989 1.826 -0.718 1.00 . A A . 30 HIS HE1 1 1 13 9398 1 1 30 HIS HE2 H -8.309 -0.662 -0.624 1.00 . A A . 30 HIS HE2 1 1 13 9399 1 1 30 HIS N N -2.415 0.960 -0.691 1.00 . A A . 30 HIS N 1 1 13 9400 1 1 30 HIS ND1 N -6.040 1.230 -1.407 1.00 . A A . 30 HIS ND1 1 1 13 9401 1 1 30 HIS NE2 N -7.417 -0.229 -0.661 1.00 . A A . 30 HIS NE2 1 1 13 9402 1 1 30 HIS O O -1.255 -0.052 -3.013 1.00 . A A . 30 HIS O 1 1 13 9403 1 1 31 GLN C C -0.794 -2.455 -4.526 1.00 . A A . 31 GLN C 1 1 13 9404 1 1 31 GLN CA C -0.505 -2.712 -3.044 1.00 . A A . 31 GLN CA 1 1 13 9405 1 1 31 GLN CB C -0.318 -4.199 -2.766 1.00 . A A . 31 GLN CB 1 1 13 9406 1 1 31 GLN CD C 0.533 -5.990 -1.207 1.00 . A A . 31 GLN CD 1 1 13 9407 1 1 31 GLN CG C 0.353 -4.506 -1.435 1.00 . A A . 31 GLN CG 1 1 13 9408 1 1 31 GLN H H -1.965 -2.640 -1.482 1.00 . A A . 31 GLN H 1 1 13 9409 1 1 31 GLN HA H 0.420 -2.204 -2.811 1.00 . A A . 31 GLN HA 1 1 13 9410 1 1 31 GLN HB2 H -1.270 -4.713 -2.792 1.00 . A A . 31 GLN HB2 1 1 13 9411 1 1 31 GLN HB3 H 0.322 -4.587 -3.543 1.00 . A A . 31 GLN HB3 1 1 13 9412 1 1 31 GLN HE21 H -1.151 -6.075 -0.192 1.00 . A A . 31 GLN HE21 1 1 13 9413 1 1 31 GLN HE22 H -0.298 -7.558 -0.349 1.00 . A A . 31 GLN HE22 1 1 13 9414 1 1 31 GLN HG2 H 1.334 -4.054 -1.442 1.00 . A A . 31 GLN HG2 1 1 13 9415 1 1 31 GLN HG3 H -0.230 -4.098 -0.625 1.00 . A A . 31 GLN HG3 1 1 13 9416 1 1 31 GLN N N -1.504 -2.102 -2.160 1.00 . A A . 31 GLN N 1 1 13 9417 1 1 31 GLN NE2 N -0.394 -6.601 -0.523 1.00 . A A . 31 GLN NE2 1 1 13 9418 1 1 31 GLN O O 0.086 -2.168 -5.271 1.00 . A A . 31 GLN O 1 1 13 9419 1 1 31 GLN OE1 O 1.523 -6.560 -1.607 1.00 . A A . 31 GLN OE1 1 1 13 9420 1 1 32 VAL C C -2.329 -0.725 -6.662 1.00 . A A . 32 VAL C 1 1 13 9421 1 1 32 VAL CA C -2.367 -2.251 -6.327 1.00 . A A . 32 VAL CA 1 1 13 9422 1 1 32 VAL CB C -3.755 -2.831 -6.700 1.00 . A A . 32 VAL CB 1 1 13 9423 1 1 32 VAL CG1 C -4.820 -2.178 -5.878 1.00 . A A . 32 VAL CG1 1 1 13 9424 1 1 32 VAL CG2 C -4.045 -2.618 -8.161 1.00 . A A . 32 VAL CG2 1 1 13 9425 1 1 32 VAL H H -2.740 -2.761 -4.291 1.00 . A A . 32 VAL H 1 1 13 9426 1 1 32 VAL HA H -1.621 -2.743 -6.930 1.00 . A A . 32 VAL HA 1 1 13 9427 1 1 32 VAL HB H -3.748 -3.892 -6.500 1.00 . A A . 32 VAL HB 1 1 13 9428 1 1 32 VAL HG11 H -4.720 -1.121 -6.091 1.00 . A A . 32 VAL HG11 1 1 13 9429 1 1 32 VAL HG12 H -4.621 -2.367 -4.837 1.00 . A A . 32 VAL HG12 1 1 13 9430 1 1 32 VAL HG13 H -5.795 -2.523 -6.178 1.00 . A A . 32 VAL HG13 1 1 13 9431 1 1 32 VAL HG21 H -5.046 -2.940 -8.410 1.00 . A A . 32 VAL HG21 1 1 13 9432 1 1 32 VAL HG22 H -3.310 -3.124 -8.765 1.00 . A A . 32 VAL HG22 1 1 13 9433 1 1 32 VAL HG23 H -3.965 -1.550 -8.300 1.00 . A A . 32 VAL HG23 1 1 13 9434 1 1 32 VAL N N -2.041 -2.515 -4.925 1.00 . A A . 32 VAL N 1 1 13 9435 1 1 32 VAL O O -1.865 -0.322 -7.717 1.00 . A A . 32 VAL O 1 1 13 9436 1 1 33 CYS C C -1.558 2.236 -5.953 1.00 . A A . 33 CYS C 1 1 13 9437 1 1 33 CYS CA C -2.928 1.517 -5.994 1.00 . A A . 33 CYS CA 1 1 13 9438 1 1 33 CYS CB C -3.976 2.193 -5.056 1.00 . A A . 33 CYS CB 1 1 13 9439 1 1 33 CYS H H -3.047 -0.401 -4.938 1.00 . A A . 33 CYS H 1 1 13 9440 1 1 33 CYS HA H -3.271 1.637 -7.014 1.00 . A A . 33 CYS HA 1 1 13 9441 1 1 33 CYS HB2 H -4.284 3.101 -5.524 1.00 . A A . 33 CYS HB2 1 1 13 9442 1 1 33 CYS HB3 H -4.849 1.557 -4.988 1.00 . A A . 33 CYS HB3 1 1 13 9443 1 1 33 CYS N N -2.801 0.089 -5.741 1.00 . A A . 33 CYS N 1 1 13 9444 1 1 33 CYS O O -1.359 3.232 -6.637 1.00 . A A . 33 CYS O 1 1 13 9445 1 1 33 CYS SG S -3.431 2.599 -3.392 1.00 . A A . 33 CYS SG 1 1 13 9446 1 1 34 VAL C C 1.714 1.465 -5.901 1.00 . A A . 34 VAL C 1 1 13 9447 1 1 34 VAL CA C 0.683 2.329 -5.107 1.00 . A A . 34 VAL CA 1 1 13 9448 1 1 34 VAL CB C 1.145 2.473 -3.646 1.00 . A A . 34 VAL CB 1 1 13 9449 1 1 34 VAL CG1 C 1.758 1.215 -3.087 1.00 . A A . 34 VAL CG1 1 1 13 9450 1 1 34 VAL CG2 C 1.992 3.676 -3.492 1.00 . A A . 34 VAL CG2 1 1 13 9451 1 1 34 VAL H H -0.743 0.968 -4.553 1.00 . A A . 34 VAL H 1 1 13 9452 1 1 34 VAL HA H 0.618 3.310 -5.560 1.00 . A A . 34 VAL HA 1 1 13 9453 1 1 34 VAL HB H 0.325 2.562 -2.952 1.00 . A A . 34 VAL HB 1 1 13 9454 1 1 34 VAL HG11 H 1.045 0.403 -3.146 1.00 . A A . 34 VAL HG11 1 1 13 9455 1 1 34 VAL HG12 H 2.050 1.377 -2.061 1.00 . A A . 34 VAL HG12 1 1 13 9456 1 1 34 VAL HG13 H 2.625 0.981 -3.687 1.00 . A A . 34 VAL HG13 1 1 13 9457 1 1 34 VAL HG21 H 2.829 3.596 -4.166 1.00 . A A . 34 VAL HG21 1 1 13 9458 1 1 34 VAL HG22 H 2.311 3.742 -2.466 1.00 . A A . 34 VAL HG22 1 1 13 9459 1 1 34 VAL HG23 H 1.346 4.505 -3.741 1.00 . A A . 34 VAL HG23 1 1 13 9460 1 1 34 VAL N N -0.611 1.725 -5.163 1.00 . A A . 34 VAL N 1 1 13 9461 1 1 34 VAL O O 2.899 1.809 -6.017 1.00 . A A . 34 VAL O 1 1 13 9462 1 1 35 GLY C C 3.138 -1.273 -6.324 1.00 . A A . 35 GLY C 1 1 13 9463 1 1 35 GLY CA C 2.083 -0.545 -7.195 1.00 . A A . 35 GLY CA 1 1 13 9464 1 1 35 GLY H H 0.236 0.382 -6.530 1.00 . A A . 35 GLY H 1 1 13 9465 1 1 35 GLY HA2 H 1.450 -1.294 -7.652 1.00 . A A . 35 GLY HA2 1 1 13 9466 1 1 35 GLY HA3 H 2.591 -0.003 -7.980 1.00 . A A . 35 GLY HA3 1 1 13 9467 1 1 35 GLY N N 1.218 0.401 -6.490 1.00 . A A . 35 GLY N 1 1 13 9468 1 1 35 GLY O O 4.334 -0.970 -6.387 1.00 . A A . 35 GLY O 1 1 13 9469 1 1 36 VAL C C 3.121 -4.515 -5.049 1.00 . A A . 36 VAL C 1 1 13 9470 1 1 36 VAL CA C 3.514 -3.093 -4.722 1.00 . A A . 36 VAL CA 1 1 13 9471 1 1 36 VAL CB C 3.234 -2.866 -3.190 1.00 . A A . 36 VAL CB 1 1 13 9472 1 1 36 VAL CG1 C 3.930 -3.900 -2.309 1.00 . A A . 36 VAL CG1 1 1 13 9473 1 1 36 VAL CG2 C 3.629 -1.481 -2.763 1.00 . A A . 36 VAL CG2 1 1 13 9474 1 1 36 VAL H H 1.732 -2.459 -5.465 1.00 . A A . 36 VAL H 1 1 13 9475 1 1 36 VAL HA H 4.562 -2.934 -4.935 1.00 . A A . 36 VAL HA 1 1 13 9476 1 1 36 VAL HB H 2.170 -2.975 -3.047 1.00 . A A . 36 VAL HB 1 1 13 9477 1 1 36 VAL HG11 H 5.000 -3.909 -2.489 1.00 . A A . 36 VAL HG11 1 1 13 9478 1 1 36 VAL HG12 H 3.530 -4.865 -2.583 1.00 . A A . 36 VAL HG12 1 1 13 9479 1 1 36 VAL HG13 H 3.720 -3.711 -1.266 1.00 . A A . 36 VAL HG13 1 1 13 9480 1 1 36 VAL HG21 H 4.659 -1.282 -3.016 1.00 . A A . 36 VAL HG21 1 1 13 9481 1 1 36 VAL HG22 H 3.472 -1.372 -1.702 1.00 . A A . 36 VAL HG22 1 1 13 9482 1 1 36 VAL HG23 H 2.972 -0.797 -3.279 1.00 . A A . 36 VAL HG23 1 1 13 9483 1 1 36 VAL N N 2.688 -2.232 -5.546 1.00 . A A . 36 VAL N 1 1 13 9484 1 1 36 VAL O O 1.959 -4.770 -5.372 1.00 . A A . 36 VAL O 1 1 13 9485 1 1 37 SER C C 3.577 -7.495 -3.855 1.00 . A A . 37 SER C 1 1 13 9486 1 1 37 SER CA C 3.731 -6.804 -5.215 1.00 . A A . 37 SER CA 1 1 13 9487 1 1 37 SER CB C 4.870 -7.417 -6.014 1.00 . A A . 37 SER CB 1 1 13 9488 1 1 37 SER H H 4.992 -5.357 -4.742 1.00 . A A . 37 SER H 1 1 13 9489 1 1 37 SER HA H 2.813 -6.872 -5.781 1.00 . A A . 37 SER HA 1 1 13 9490 1 1 37 SER HB2 H 4.682 -8.473 -6.138 1.00 . A A . 37 SER HB2 1 1 13 9491 1 1 37 SER HB3 H 4.913 -6.948 -6.985 1.00 . A A . 37 SER HB3 1 1 13 9492 1 1 37 SER HG H 6.818 -7.333 -5.993 1.00 . A A . 37 SER HG 1 1 13 9493 1 1 37 SER N N 4.041 -5.437 -4.980 1.00 . A A . 37 SER N 1 1 13 9494 1 1 37 SER O O 4.221 -7.074 -2.886 1.00 . A A . 37 SER O 1 1 13 9495 1 1 37 SER OG O 6.115 -7.213 -5.345 1.00 . A A . 37 SER OG 1 1 13 9496 1 1 38 PRO C C 3.788 -9.753 -1.801 1.00 . A A . 38 PRO C 1 1 13 9497 1 1 38 PRO CA C 2.494 -9.255 -2.461 1.00 . A A . 38 PRO CA 1 1 13 9498 1 1 38 PRO CB C 1.602 -10.439 -2.859 1.00 . A A . 38 PRO CB 1 1 13 9499 1 1 38 PRO CD C 1.989 -9.161 -4.832 1.00 . A A . 38 PRO CD 1 1 13 9500 1 1 38 PRO CG C 1.783 -10.556 -4.331 1.00 . A A . 38 PRO CG 1 1 13 9501 1 1 38 PRO HA H 1.956 -8.599 -1.791 1.00 . A A . 38 PRO HA 1 1 13 9502 1 1 38 PRO HB2 H 1.921 -11.333 -2.345 1.00 . A A . 38 PRO HB2 1 1 13 9503 1 1 38 PRO HB3 H 0.576 -10.211 -2.610 1.00 . A A . 38 PRO HB3 1 1 13 9504 1 1 38 PRO HD2 H 2.550 -9.156 -5.753 1.00 . A A . 38 PRO HD2 1 1 13 9505 1 1 38 PRO HD3 H 1.043 -8.659 -4.963 1.00 . A A . 38 PRO HD3 1 1 13 9506 1 1 38 PRO HG2 H 2.667 -11.144 -4.523 1.00 . A A . 38 PRO HG2 1 1 13 9507 1 1 38 PRO HG3 H 0.904 -10.999 -4.771 1.00 . A A . 38 PRO HG3 1 1 13 9508 1 1 38 PRO N N 2.749 -8.558 -3.747 1.00 . A A . 38 PRO N 1 1 13 9509 1 1 38 PRO O O 3.874 -9.907 -0.588 1.00 . A A . 38 PRO O 1 1 13 9510 1 1 39 GLU C C 6.856 -9.348 -1.432 1.00 . A A . 39 GLU C 1 1 13 9511 1 1 39 GLU CA C 6.088 -10.445 -2.189 1.00 . A A . 39 GLU CA 1 1 13 9512 1 1 39 GLU CB C 6.886 -10.913 -3.408 1.00 . A A . 39 GLU CB 1 1 13 9513 1 1 39 GLU CD C 8.939 -12.004 -4.350 1.00 . A A . 39 GLU CD 1 1 13 9514 1 1 39 GLU CG C 8.199 -11.591 -3.093 1.00 . A A . 39 GLU CG 1 1 13 9515 1 1 39 GLU H H 4.713 -9.684 -3.561 1.00 . A A . 39 GLU H 1 1 13 9516 1 1 39 GLU HA H 5.925 -11.289 -1.530 1.00 . A A . 39 GLU HA 1 1 13 9517 1 1 39 GLU HB2 H 6.290 -11.595 -3.995 1.00 . A A . 39 GLU HB2 1 1 13 9518 1 1 39 GLU HB3 H 7.098 -10.044 -4.013 1.00 . A A . 39 GLU HB3 1 1 13 9519 1 1 39 GLU HG2 H 8.809 -10.893 -2.540 1.00 . A A . 39 GLU HG2 1 1 13 9520 1 1 39 GLU HG3 H 8.022 -12.459 -2.474 1.00 . A A . 39 GLU HG3 1 1 13 9521 1 1 39 GLU N N 4.808 -9.946 -2.624 1.00 . A A . 39 GLU N 1 1 13 9522 1 1 39 GLU O O 7.593 -9.631 -0.498 1.00 . A A . 39 GLU O 1 1 13 9523 1 1 39 GLU OE1 O 8.646 -13.089 -4.893 1.00 . A A . 39 GLU OE1 1 1 13 9524 1 1 39 GLU OE2 O 9.813 -11.244 -4.808 1.00 . A A . 39 GLU OE2 1 1 13 9525 1 1 40 MET C C 6.843 -6.722 0.152 1.00 . A A . 40 MET C 1 1 13 9526 1 1 40 MET CA C 7.390 -6.994 -1.226 1.00 . A A . 40 MET CA 1 1 13 9527 1 1 40 MET CB C 7.350 -5.711 -2.094 1.00 . A A . 40 MET CB 1 1 13 9528 1 1 40 MET CE C 7.049 -2.691 -3.245 1.00 . A A . 40 MET CE 1 1 13 9529 1 1 40 MET CG C 8.238 -4.584 -1.549 1.00 . A A . 40 MET CG 1 1 13 9530 1 1 40 MET H H 5.987 -7.896 -2.520 1.00 . A A . 40 MET H 1 1 13 9531 1 1 40 MET HA H 8.415 -7.319 -1.119 1.00 . A A . 40 MET HA 1 1 13 9532 1 1 40 MET HB2 H 7.471 -5.872 -3.151 1.00 . A A . 40 MET HB2 1 1 13 9533 1 1 40 MET HB3 H 6.336 -5.355 -1.999 1.00 . A A . 40 MET HB3 1 1 13 9534 1 1 40 MET HE1 H 6.526 -3.507 -3.722 1.00 . A A . 40 MET HE1 1 1 13 9535 1 1 40 MET HE2 H 7.142 -1.873 -3.943 1.00 . A A . 40 MET HE2 1 1 13 9536 1 1 40 MET HE3 H 6.510 -2.359 -2.370 1.00 . A A . 40 MET HE3 1 1 13 9537 1 1 40 MET HG2 H 7.681 -4.126 -0.743 1.00 . A A . 40 MET HG2 1 1 13 9538 1 1 40 MET HG3 H 9.153 -5.012 -1.165 1.00 . A A . 40 MET HG3 1 1 13 9539 1 1 40 MET N N 6.660 -8.089 -1.834 1.00 . A A . 40 MET N 1 1 13 9540 1 1 40 MET O O 7.592 -6.506 1.089 1.00 . A A . 40 MET O 1 1 13 9541 1 1 40 MET SD S 8.644 -3.281 -2.763 1.00 . A A . 40 MET SD 1 1 13 9542 1 1 41 ALA C C 5.261 -7.480 2.622 1.00 . A A . 41 ALA C 1 1 13 9543 1 1 41 ALA CA C 4.823 -6.519 1.514 1.00 . A A . 41 ALA CA 1 1 13 9544 1 1 41 ALA CB C 3.315 -6.630 1.310 1.00 . A A . 41 ALA CB 1 1 13 9545 1 1 41 ALA H H 4.996 -6.958 -0.547 1.00 . A A . 41 ALA H 1 1 13 9546 1 1 41 ALA HA H 5.044 -5.503 1.807 1.00 . A A . 41 ALA HA 1 1 13 9547 1 1 41 ALA HB1 H 3.051 -7.640 1.028 1.00 . A A . 41 ALA HB1 1 1 13 9548 1 1 41 ALA HB2 H 2.989 -5.954 0.532 1.00 . A A . 41 ALA HB2 1 1 13 9549 1 1 41 ALA HB3 H 2.817 -6.386 2.239 1.00 . A A . 41 ALA HB3 1 1 13 9550 1 1 41 ALA N N 5.525 -6.769 0.256 1.00 . A A . 41 ALA N 1 1 13 9551 1 1 41 ALA O O 5.454 -7.076 3.768 1.00 . A A . 41 ALA O 1 1 13 9552 1 1 42 GLU C C 7.248 -9.882 3.501 1.00 . A A . 42 GLU C 1 1 13 9553 1 1 42 GLU CA C 5.755 -9.772 3.243 1.00 . A A . 42 GLU CA 1 1 13 9554 1 1 42 GLU CB C 5.175 -11.121 2.831 1.00 . A A . 42 GLU CB 1 1 13 9555 1 1 42 GLU CD C 3.063 -12.441 2.388 1.00 . A A . 42 GLU CD 1 1 13 9556 1 1 42 GLU CG C 3.648 -11.139 2.850 1.00 . A A . 42 GLU CG 1 1 13 9557 1 1 42 GLU H H 5.203 -8.951 1.334 1.00 . A A . 42 GLU H 1 1 13 9558 1 1 42 GLU HA H 5.291 -9.496 4.178 1.00 . A A . 42 GLU HA 1 1 13 9559 1 1 42 GLU HB2 H 5.539 -11.365 1.844 1.00 . A A . 42 GLU HB2 1 1 13 9560 1 1 42 GLU HB3 H 5.531 -11.875 3.517 1.00 . A A . 42 GLU HB3 1 1 13 9561 1 1 42 GLU HG2 H 3.342 -11.004 3.877 1.00 . A A . 42 GLU HG2 1 1 13 9562 1 1 42 GLU HG3 H 3.250 -10.330 2.256 1.00 . A A . 42 GLU HG3 1 1 13 9563 1 1 42 GLU N N 5.397 -8.745 2.273 1.00 . A A . 42 GLU N 1 1 13 9564 1 1 42 GLU O O 7.660 -10.380 4.549 1.00 . A A . 42 GLU O 1 1 13 9565 1 1 42 GLU OE1 O 2.996 -13.391 3.197 1.00 . A A . 42 GLU OE1 1 1 13 9566 1 1 42 GLU OE2 O 2.655 -12.551 1.206 1.00 . A A . 42 GLU OE2 1 1 13 9567 1 1 43 ASN C C 10.290 -8.315 3.019 1.00 . A A . 43 ASN C 1 1 13 9568 1 1 43 ASN CA C 9.489 -9.589 2.722 1.00 . A A . 43 ASN CA 1 1 13 9569 1 1 43 ASN CB C 10.064 -10.312 1.509 1.00 . A A . 43 ASN CB 1 1 13 9570 1 1 43 ASN CG C 9.617 -11.772 1.404 1.00 . A A . 43 ASN CG 1 1 13 9571 1 1 43 ASN H H 7.725 -8.947 1.788 1.00 . A A . 43 ASN H 1 1 13 9572 1 1 43 ASN HA H 9.624 -10.246 3.569 1.00 . A A . 43 ASN HA 1 1 13 9573 1 1 43 ASN HB2 H 9.780 -9.777 0.614 1.00 . A A . 43 ASN HB2 1 1 13 9574 1 1 43 ASN HB3 H 11.137 -10.275 1.612 1.00 . A A . 43 ASN HB3 1 1 13 9575 1 1 43 ASN HD21 H 9.575 -11.643 -0.555 1.00 . A A . 43 ASN HD21 1 1 13 9576 1 1 43 ASN HD22 H 9.132 -13.174 0.115 1.00 . A A . 43 ASN HD22 1 1 13 9577 1 1 43 ASN N N 8.061 -9.408 2.582 1.00 . A A . 43 ASN N 1 1 13 9578 1 1 43 ASN ND2 N 9.424 -12.246 0.202 1.00 . A A . 43 ASN ND2 1 1 13 9579 1 1 43 ASN O O 11.336 -8.402 3.639 1.00 . A A . 43 ASN O 1 1 13 9580 1 1 43 ASN OD1 O 9.421 -12.455 2.403 1.00 . A A . 43 ASN OD1 1 1 13 9581 1 1 44 GLU C C 9.877 -4.783 3.367 1.00 . A A . 44 GLU C 1 1 13 9582 1 1 44 GLU CA C 10.665 -5.941 2.775 1.00 . A A . 44 GLU CA 1 1 13 9583 1 1 44 GLU CB C 11.299 -5.533 1.442 1.00 . A A . 44 GLU CB 1 1 13 9584 1 1 44 GLU CD C 12.695 -6.275 -0.520 1.00 . A A . 44 GLU CD 1 1 13 9585 1 1 44 GLU CG C 12.129 -6.635 0.809 1.00 . A A . 44 GLU CG 1 1 13 9586 1 1 44 GLU H H 8.926 -7.058 2.229 1.00 . A A . 44 GLU H 1 1 13 9587 1 1 44 GLU HA H 11.460 -6.194 3.466 1.00 . A A . 44 GLU HA 1 1 13 9588 1 1 44 GLU HB2 H 10.532 -5.209 0.760 1.00 . A A . 44 GLU HB2 1 1 13 9589 1 1 44 GLU HB3 H 11.959 -4.699 1.636 1.00 . A A . 44 GLU HB3 1 1 13 9590 1 1 44 GLU HG2 H 12.964 -6.829 1.465 1.00 . A A . 44 GLU HG2 1 1 13 9591 1 1 44 GLU HG3 H 11.538 -7.533 0.717 1.00 . A A . 44 GLU HG3 1 1 13 9592 1 1 44 GLU N N 9.830 -7.146 2.605 1.00 . A A . 44 GLU N 1 1 13 9593 1 1 44 GLU O O 8.645 -4.822 3.407 1.00 . A A . 44 GLU O 1 1 13 9594 1 1 44 GLU OE1 O 12.009 -6.451 -1.536 1.00 . A A . 44 GLU OE1 1 1 13 9595 1 1 44 GLU OE2 O 13.872 -5.829 -0.573 1.00 . A A . 44 GLU OE2 1 1 13 9596 1 1 45 ASP C C 9.491 -1.619 3.346 1.00 . A A . 45 ASP C 1 1 13 9597 1 1 45 ASP CA C 9.978 -2.576 4.448 1.00 . A A . 45 ASP CA 1 1 13 9598 1 1 45 ASP CB C 10.978 -1.794 5.360 1.00 . A A . 45 ASP CB 1 1 13 9599 1 1 45 ASP CG C 11.705 -2.611 6.433 1.00 . A A . 45 ASP CG 1 1 13 9600 1 1 45 ASP H H 11.571 -3.774 3.732 1.00 . A A . 45 ASP H 1 1 13 9601 1 1 45 ASP HA H 9.139 -2.918 5.040 1.00 . A A . 45 ASP HA 1 1 13 9602 1 1 45 ASP HB2 H 11.745 -1.367 4.732 1.00 . A A . 45 ASP HB2 1 1 13 9603 1 1 45 ASP HB3 H 10.440 -0.991 5.838 1.00 . A A . 45 ASP HB3 1 1 13 9604 1 1 45 ASP N N 10.596 -3.756 3.823 1.00 . A A . 45 ASP N 1 1 13 9605 1 1 45 ASP O O 10.305 -1.091 2.564 1.00 . A A . 45 ASP O 1 1 13 9606 1 1 45 ASP OD1 O 11.070 -3.077 7.400 1.00 . A A . 45 ASP OD1 1 1 13 9607 1 1 45 ASP OD2 O 12.949 -2.732 6.331 1.00 . A A . 45 ASP OD2 1 1 13 9608 1 1 46 TYR C C 7.905 0.974 2.495 1.00 . A A . 46 TYR C 1 1 13 9609 1 1 46 TYR CA C 7.590 -0.536 2.277 1.00 . A A . 46 TYR CA 1 1 13 9610 1 1 46 TYR CB C 6.069 -0.797 2.107 1.00 . A A . 46 TYR CB 1 1 13 9611 1 1 46 TYR CD1 C 5.653 0.359 -0.112 1.00 . A A . 46 TYR CD1 1 1 13 9612 1 1 46 TYR CD2 C 4.441 1.092 1.797 1.00 . A A . 46 TYR CD2 1 1 13 9613 1 1 46 TYR CE1 C 5.004 1.328 -0.866 1.00 . A A . 46 TYR CE1 1 1 13 9614 1 1 46 TYR CE2 C 3.818 2.043 1.046 1.00 . A A . 46 TYR CE2 1 1 13 9615 1 1 46 TYR CG C 5.365 0.222 1.239 1.00 . A A . 46 TYR CG 1 1 13 9616 1 1 46 TYR CZ C 4.101 2.155 -0.264 1.00 . A A . 46 TYR CZ 1 1 13 9617 1 1 46 TYR H H 7.641 -1.920 3.908 1.00 . A A . 46 TYR H 1 1 13 9618 1 1 46 TYR HA H 8.069 -0.798 1.340 1.00 . A A . 46 TYR HA 1 1 13 9619 1 1 46 TYR HB2 H 5.914 -1.747 1.621 1.00 . A A . 46 TYR HB2 1 1 13 9620 1 1 46 TYR HB3 H 5.601 -0.801 3.080 1.00 . A A . 46 TYR HB3 1 1 13 9621 1 1 46 TYR HD1 H 6.364 -0.308 -0.574 1.00 . A A . 46 TYR HD1 1 1 13 9622 1 1 46 TYR HD2 H 4.205 0.994 2.846 1.00 . A A . 46 TYR HD2 1 1 13 9623 1 1 46 TYR HE1 H 5.175 1.460 -1.926 1.00 . A A . 46 TYR HE1 1 1 13 9624 1 1 46 TYR HE2 H 3.088 2.725 1.461 1.00 . A A . 46 TYR HE2 1 1 13 9625 1 1 46 TYR HH H 3.356 3.889 -0.413 1.00 . A A . 46 TYR HH 1 1 13 9626 1 1 46 TYR N N 8.192 -1.418 3.270 1.00 . A A . 46 TYR N 1 1 13 9627 1 1 46 TYR O O 7.475 1.605 3.459 1.00 . A A . 46 TYR O 1 1 13 9628 1 1 46 TYR OH O 3.504 3.128 -0.975 1.00 . A A . 46 TYR OH 1 1 13 9629 1 1 47 ILE C C 8.072 3.576 0.478 1.00 . A A . 47 ILE C 1 1 13 9630 1 1 47 ILE CA C 8.985 2.922 1.519 1.00 . A A . 47 ILE CA 1 1 13 9631 1 1 47 ILE CB C 10.476 3.133 1.110 1.00 . A A . 47 ILE CB 1 1 13 9632 1 1 47 ILE CD1 C 11.290 2.892 3.532 1.00 . A A . 47 ILE CD1 1 1 13 9633 1 1 47 ILE CG1 C 11.417 2.420 2.092 1.00 . A A . 47 ILE CG1 1 1 13 9634 1 1 47 ILE CG2 C 10.819 4.616 1.010 1.00 . A A . 47 ILE CG2 1 1 13 9635 1 1 47 ILE H H 8.945 0.862 0.891 1.00 . A A . 47 ILE H 1 1 13 9636 1 1 47 ILE HA H 8.803 3.353 2.493 1.00 . A A . 47 ILE HA 1 1 13 9637 1 1 47 ILE HB H 10.610 2.696 0.130 1.00 . A A . 47 ILE HB 1 1 13 9638 1 1 47 ILE HD11 H 10.294 2.680 3.897 1.00 . A A . 47 ILE HD11 1 1 13 9639 1 1 47 ILE HD12 H 11.480 3.956 3.571 1.00 . A A . 47 ILE HD12 1 1 13 9640 1 1 47 ILE HD13 H 12.021 2.370 4.131 1.00 . A A . 47 ILE HD13 1 1 13 9641 1 1 47 ILE HG12 H 11.192 1.367 2.069 1.00 . A A . 47 ILE HG12 1 1 13 9642 1 1 47 ILE HG13 H 12.439 2.557 1.783 1.00 . A A . 47 ILE HG13 1 1 13 9643 1 1 47 ILE HG21 H 11.861 4.755 0.754 1.00 . A A . 47 ILE HG21 1 1 13 9644 1 1 47 ILE HG22 H 10.582 5.081 1.958 1.00 . A A . 47 ILE HG22 1 1 13 9645 1 1 47 ILE HG23 H 10.200 5.056 0.240 1.00 . A A . 47 ILE HG23 1 1 13 9646 1 1 47 ILE N N 8.652 1.514 1.561 1.00 . A A . 47 ILE N 1 1 13 9647 1 1 47 ILE O O 7.816 2.979 -0.565 1.00 . A A . 47 ILE O 1 1 13 9648 1 1 48 CYS C C 7.374 6.534 -0.916 1.00 . A A . 48 CYS C 1 1 13 9649 1 1 48 CYS CA C 6.664 5.392 -0.206 1.00 . A A . 48 CYS CA 1 1 13 9650 1 1 48 CYS CB C 5.433 5.975 0.505 1.00 . A A . 48 CYS CB 1 1 13 9651 1 1 48 CYS H H 7.797 5.347 1.498 1.00 . A A . 48 CYS H 1 1 13 9652 1 1 48 CYS HA H 6.347 4.652 -0.923 1.00 . A A . 48 CYS HA 1 1 13 9653 1 1 48 CYS HB2 H 4.643 6.083 -0.222 1.00 . A A . 48 CYS HB2 1 1 13 9654 1 1 48 CYS HB3 H 5.117 5.280 1.266 1.00 . A A . 48 CYS HB3 1 1 13 9655 1 1 48 CYS N N 7.571 4.783 0.736 1.00 . A A . 48 CYS N 1 1 13 9656 1 1 48 CYS O O 8.511 6.855 -0.598 1.00 . A A . 48 CYS O 1 1 13 9657 1 1 48 CYS SG S 5.708 7.607 1.284 1.00 . A A . 48 CYS SG 1 1 13 9658 1 1 49 ILE C C 7.609 9.470 -1.666 1.00 . A A . 49 ILE C 1 1 13 9659 1 1 49 ILE CA C 7.135 8.313 -2.590 1.00 . A A . 49 ILE CA 1 1 13 9660 1 1 49 ILE CB C 6.030 8.790 -3.564 1.00 . A A . 49 ILE CB 1 1 13 9661 1 1 49 ILE CD1 C 5.535 10.362 -5.466 1.00 . A A . 49 ILE CD1 1 1 13 9662 1 1 49 ILE CG1 C 6.510 9.967 -4.391 1.00 . A A . 49 ILE CG1 1 1 13 9663 1 1 49 ILE CG2 C 4.738 9.128 -2.828 1.00 . A A . 49 ILE CG2 1 1 13 9664 1 1 49 ILE H H 5.772 6.809 -2.026 1.00 . A A . 49 ILE H 1 1 13 9665 1 1 49 ILE HA H 7.983 8.010 -3.189 1.00 . A A . 49 ILE HA 1 1 13 9666 1 1 49 ILE HB H 5.816 7.970 -4.232 1.00 . A A . 49 ILE HB 1 1 13 9667 1 1 49 ILE HD11 H 5.387 9.514 -6.119 1.00 . A A . 49 ILE HD11 1 1 13 9668 1 1 49 ILE HD12 H 5.913 11.202 -6.028 1.00 . A A . 49 ILE HD12 1 1 13 9669 1 1 49 ILE HD13 H 4.596 10.603 -4.991 1.00 . A A . 49 ILE HD13 1 1 13 9670 1 1 49 ILE HG12 H 6.638 10.797 -3.712 1.00 . A A . 49 ILE HG12 1 1 13 9671 1 1 49 ILE HG13 H 7.456 9.722 -4.852 1.00 . A A . 49 ILE HG13 1 1 13 9672 1 1 49 ILE HG21 H 4.393 8.247 -2.309 1.00 . A A . 49 ILE HG21 1 1 13 9673 1 1 49 ILE HG22 H 3.997 9.455 -3.541 1.00 . A A . 49 ILE HG22 1 1 13 9674 1 1 49 ILE HG23 H 4.944 9.909 -2.112 1.00 . A A . 49 ILE HG23 1 1 13 9675 1 1 49 ILE N N 6.661 7.163 -1.834 1.00 . A A . 49 ILE N 1 1 13 9676 1 1 49 ILE O O 8.652 10.049 -1.897 1.00 . A A . 49 ILE O 1 1 13 9677 1 1 50 ASN C C 8.364 10.417 1.256 1.00 . A A . 50 ASN C 1 1 13 9678 1 1 50 ASN CA C 7.222 10.846 0.340 1.00 . A A . 50 ASN CA 1 1 13 9679 1 1 50 ASN CB C 6.028 11.317 1.209 1.00 . A A . 50 ASN CB 1 1 13 9680 1 1 50 ASN CG C 4.812 11.779 0.419 1.00 . A A . 50 ASN CG 1 1 13 9681 1 1 50 ASN H H 6.069 9.201 -0.395 1.00 . A A . 50 ASN H 1 1 13 9682 1 1 50 ASN HA H 7.569 11.668 -0.267 1.00 . A A . 50 ASN HA 1 1 13 9683 1 1 50 ASN HB2 H 5.709 10.498 1.832 1.00 . A A . 50 ASN HB2 1 1 13 9684 1 1 50 ASN HB3 H 6.354 12.128 1.841 1.00 . A A . 50 ASN HB3 1 1 13 9685 1 1 50 ASN HD21 H 3.903 10.032 0.689 1.00 . A A . 50 ASN HD21 1 1 13 9686 1 1 50 ASN HD22 H 3.047 11.248 -0.192 1.00 . A A . 50 ASN HD22 1 1 13 9687 1 1 50 ASN N N 6.860 9.747 -0.582 1.00 . A A . 50 ASN N 1 1 13 9688 1 1 50 ASN ND2 N 3.833 10.923 0.288 1.00 . A A . 50 ASN ND2 1 1 13 9689 1 1 50 ASN O O 9.110 11.235 1.760 1.00 . A A . 50 ASN O 1 1 13 9690 1 1 50 ASN OD1 O 4.730 12.919 -0.006 1.00 . A A . 50 ASN OD1 1 1 13 9691 1 1 51 CYS C C 10.864 8.514 1.501 1.00 . A A . 51 CYS C 1 1 13 9692 1 1 51 CYS CA C 9.558 8.564 2.281 1.00 . A A . 51 CYS CA 1 1 13 9693 1 1 51 CYS CB C 9.234 7.160 2.788 1.00 . A A . 51 CYS CB 1 1 13 9694 1 1 51 CYS H H 7.823 8.534 1.029 1.00 . A A . 51 CYS H 1 1 13 9695 1 1 51 CYS HA H 9.680 9.218 3.132 1.00 . A A . 51 CYS HA 1 1 13 9696 1 1 51 CYS HB2 H 8.864 6.568 1.964 1.00 . A A . 51 CYS HB2 1 1 13 9697 1 1 51 CYS HB3 H 10.164 6.722 3.125 1.00 . A A . 51 CYS HB3 1 1 13 9698 1 1 51 CYS N N 8.479 9.114 1.468 1.00 . A A . 51 CYS N 1 1 13 9699 1 1 51 CYS O O 11.939 8.564 2.068 1.00 . A A . 51 CYS O 1 1 13 9700 1 1 51 CYS SG S 8.048 7.030 4.155 1.00 . A A . 51 CYS SG 1 1 13 9701 1 1 52 ALA C C 12.558 9.649 -0.960 1.00 . A A . 52 ALA C 1 1 13 9702 1 1 52 ALA CA C 11.934 8.288 -0.632 1.00 . A A . 52 ALA CA 1 1 13 9703 1 1 52 ALA CB C 11.584 7.529 -1.896 1.00 . A A . 52 ALA CB 1 1 13 9704 1 1 52 ALA H H 9.854 8.458 -0.163 1.00 . A A . 52 ALA H 1 1 13 9705 1 1 52 ALA HA H 12.642 7.694 -0.071 1.00 . A A . 52 ALA HA 1 1 13 9706 1 1 52 ALA HB1 H 11.182 6.569 -1.594 1.00 . A A . 52 ALA HB1 1 1 13 9707 1 1 52 ALA HB2 H 12.472 7.381 -2.495 1.00 . A A . 52 ALA HB2 1 1 13 9708 1 1 52 ALA HB3 H 10.847 8.084 -2.457 1.00 . A A . 52 ALA HB3 1 1 13 9709 1 1 52 ALA N N 10.757 8.417 0.214 1.00 . A A . 52 ALA N 1 1 13 9710 2 2 1 ZN ZN ZN 5.909 7.459 3.554 1.00 . B A . 53 ZN ZN 1 1 13 9711 3 2 1 ZN ZN ZN -5.221 2.969 -1.947 1.00 . C A . 54 ZN ZN 1 1 14 9712 1 1 1 SER C C -11.571 5.826 1.687 1.00 . A A . 1 SER C 1 1 14 9713 1 1 1 SER CA C -12.578 5.791 2.863 1.00 . A A . 1 SER CA 1 1 14 9714 1 1 1 SER CB C -13.912 6.499 2.491 1.00 . A A . 1 SER CB 1 1 14 9715 1 1 1 SER HA H -12.776 4.752 3.096 1.00 . A A . 1 SER HA 1 1 14 9716 1 1 1 SER HB2 H -14.319 6.080 1.582 1.00 . A A . 1 SER HB2 1 1 14 9717 1 1 1 SER HB3 H -14.623 6.345 3.290 1.00 . A A . 1 SER HB3 1 1 14 9718 1 1 1 SER HG H -14.470 8.345 2.757 1.00 . A A . 1 SER HG 1 1 14 9719 1 1 1 SER N N -11.991 6.408 4.088 1.00 . A A . 1 SER N 1 1 14 9720 1 1 1 SER O O -11.693 5.080 0.710 1.00 . A A . 1 SER O 1 1 14 9721 1 1 1 SER OG O -13.734 7.912 2.318 1.00 . A A . 1 SER OG 1 1 14 9722 1 1 2 VAL C C -8.227 6.597 1.485 1.00 . A A . 2 VAL C 1 1 14 9723 1 1 2 VAL CA C -9.557 6.815 0.796 1.00 . A A . 2 VAL CA 1 1 14 9724 1 1 2 VAL CB C -9.560 8.233 0.138 1.00 . A A . 2 VAL CB 1 1 14 9725 1 1 2 VAL CG1 C -8.624 8.275 -1.063 1.00 . A A . 2 VAL CG1 1 1 14 9726 1 1 2 VAL CG2 C -10.968 8.668 -0.268 1.00 . A A . 2 VAL CG2 1 1 14 9727 1 1 2 VAL H H -10.519 7.238 2.611 1.00 . A A . 2 VAL H 1 1 14 9728 1 1 2 VAL HA H -9.722 6.057 0.045 1.00 . A A . 2 VAL HA 1 1 14 9729 1 1 2 VAL HB H -9.174 8.933 0.865 1.00 . A A . 2 VAL HB 1 1 14 9730 1 1 2 VAL HG11 H -7.628 8.009 -0.748 1.00 . A A . 2 VAL HG11 1 1 14 9731 1 1 2 VAL HG12 H -8.622 9.269 -1.481 1.00 . A A . 2 VAL HG12 1 1 14 9732 1 1 2 VAL HG13 H -8.967 7.571 -1.808 1.00 . A A . 2 VAL HG13 1 1 14 9733 1 1 2 VAL HG21 H -11.595 8.705 0.614 1.00 . A A . 2 VAL HG21 1 1 14 9734 1 1 2 VAL HG22 H -11.380 7.967 -0.978 1.00 . A A . 2 VAL HG22 1 1 14 9735 1 1 2 VAL HG23 H -10.929 9.651 -0.718 1.00 . A A . 2 VAL HG23 1 1 14 9736 1 1 2 VAL N N -10.579 6.684 1.803 1.00 . A A . 2 VAL N 1 1 14 9737 1 1 2 VAL O O -8.010 7.120 2.584 1.00 . A A . 2 VAL O 1 1 14 9738 1 1 3 CYS C C -5.046 6.557 1.014 1.00 . A A . 3 CYS C 1 1 14 9739 1 1 3 CYS CA C -6.081 5.541 1.532 1.00 . A A . 3 CYS CA 1 1 14 9740 1 1 3 CYS CB C -5.613 4.078 1.238 1.00 . A A . 3 CYS CB 1 1 14 9741 1 1 3 CYS H H -7.534 5.393 0.032 1.00 . A A . 3 CYS H 1 1 14 9742 1 1 3 CYS HA H -6.207 5.676 2.597 1.00 . A A . 3 CYS HA 1 1 14 9743 1 1 3 CYS HB2 H -5.207 3.648 2.139 1.00 . A A . 3 CYS HB2 1 1 14 9744 1 1 3 CYS HB3 H -6.474 3.490 0.968 1.00 . A A . 3 CYS HB3 1 1 14 9745 1 1 3 CYS N N -7.352 5.811 0.894 1.00 . A A . 3 CYS N 1 1 14 9746 1 1 3 CYS O O -5.391 7.482 0.258 1.00 . A A . 3 CYS O 1 1 14 9747 1 1 3 CYS SG S -4.389 3.907 -0.092 1.00 . A A . 3 CYS SG 1 1 14 9748 1 1 4 ALA C C -2.102 6.591 -0.300 1.00 . A A . 4 ALA C 1 1 14 9749 1 1 4 ALA CA C -2.744 7.236 0.916 1.00 . A A . 4 ALA CA 1 1 14 9750 1 1 4 ALA CB C -1.702 7.437 2.013 1.00 . A A . 4 ALA CB 1 1 14 9751 1 1 4 ALA H H -3.580 5.607 1.953 1.00 . A A . 4 ALA H 1 1 14 9752 1 1 4 ALA HA H -3.169 8.193 0.654 1.00 . A A . 4 ALA HA 1 1 14 9753 1 1 4 ALA HB1 H -0.901 8.056 1.635 1.00 . A A . 4 ALA HB1 1 1 14 9754 1 1 4 ALA HB2 H -1.290 6.480 2.300 1.00 . A A . 4 ALA HB2 1 1 14 9755 1 1 4 ALA HB3 H -2.155 7.907 2.874 1.00 . A A . 4 ALA HB3 1 1 14 9756 1 1 4 ALA N N -3.797 6.381 1.389 1.00 . A A . 4 ALA N 1 1 14 9757 1 1 4 ALA O O -1.678 5.463 -0.233 1.00 . A A . 4 ALA O 1 1 14 9758 1 1 5 ALA C C -1.700 7.914 -3.699 1.00 . A A . 5 ALA C 1 1 14 9759 1 1 5 ALA CA C -1.461 6.861 -2.656 1.00 . A A . 5 ALA CA 1 1 14 9760 1 1 5 ALA CB C -1.969 5.511 -3.179 1.00 . A A . 5 ALA CB 1 1 14 9761 1 1 5 ALA H H -2.727 8.057 -1.470 1.00 . A A . 5 ALA H 1 1 14 9762 1 1 5 ALA HA H -0.402 6.791 -2.442 1.00 . A A . 5 ALA HA 1 1 14 9763 1 1 5 ALA HB1 H -3.027 5.577 -3.385 1.00 . A A . 5 ALA HB1 1 1 14 9764 1 1 5 ALA HB2 H -1.840 4.766 -2.411 1.00 . A A . 5 ALA HB2 1 1 14 9765 1 1 5 ALA HB3 H -1.450 5.194 -4.072 1.00 . A A . 5 ALA HB3 1 1 14 9766 1 1 5 ALA N N -2.149 7.271 -1.420 1.00 . A A . 5 ALA N 1 1 14 9767 1 1 5 ALA O O -2.788 8.497 -3.738 1.00 . A A . 5 ALA O 1 1 14 9768 1 1 6 GLN C C -2.011 8.985 -6.455 1.00 . A A . 6 GLN C 1 1 14 9769 1 1 6 GLN CA C -0.743 9.188 -5.617 1.00 . A A . 6 GLN CA 1 1 14 9770 1 1 6 GLN CB C 0.453 8.942 -6.565 1.00 . A A . 6 GLN CB 1 1 14 9771 1 1 6 GLN CD C 2.880 8.530 -6.929 1.00 . A A . 6 GLN CD 1 1 14 9772 1 1 6 GLN CG C 1.811 8.941 -5.925 1.00 . A A . 6 GLN CG 1 1 14 9773 1 1 6 GLN H H 0.234 7.850 -4.345 1.00 . A A . 6 GLN H 1 1 14 9774 1 1 6 GLN HA H -0.676 10.192 -5.228 1.00 . A A . 6 GLN HA 1 1 14 9775 1 1 6 GLN HB2 H 0.357 7.977 -7.033 1.00 . A A . 6 GLN HB2 1 1 14 9776 1 1 6 GLN HB3 H 0.452 9.702 -7.336 1.00 . A A . 6 GLN HB3 1 1 14 9777 1 1 6 GLN HE21 H 2.629 6.601 -6.485 1.00 . A A . 6 GLN HE21 1 1 14 9778 1 1 6 GLN HE22 H 3.809 6.971 -7.691 1.00 . A A . 6 GLN HE22 1 1 14 9779 1 1 6 GLN HG2 H 2.027 9.929 -5.547 1.00 . A A . 6 GLN HG2 1 1 14 9780 1 1 6 GLN HG3 H 1.826 8.224 -5.112 1.00 . A A . 6 GLN HG3 1 1 14 9781 1 1 6 GLN N N -0.668 8.189 -4.518 1.00 . A A . 6 GLN N 1 1 14 9782 1 1 6 GLN NE2 N 3.124 7.237 -7.040 1.00 . A A . 6 GLN NE2 1 1 14 9783 1 1 6 GLN O O -2.725 9.923 -6.756 1.00 . A A . 6 GLN O 1 1 14 9784 1 1 6 GLN OE1 O 3.452 9.356 -7.611 1.00 . A A . 6 GLN OE1 1 1 14 9785 1 1 7 ASN C C -4.087 6.200 -6.769 1.00 . A A . 7 ASN C 1 1 14 9786 1 1 7 ASN CA C -3.446 7.348 -7.494 1.00 . A A . 7 ASN CA 1 1 14 9787 1 1 7 ASN CB C -3.128 6.947 -8.963 1.00 . A A . 7 ASN CB 1 1 14 9788 1 1 7 ASN CG C -2.674 8.107 -9.855 1.00 . A A . 7 ASN CG 1 1 14 9789 1 1 7 ASN H H -1.537 7.167 -6.474 1.00 . A A . 7 ASN H 1 1 14 9790 1 1 7 ASN HA H -4.125 8.184 -7.493 1.00 . A A . 7 ASN HA 1 1 14 9791 1 1 7 ASN HB2 H -2.338 6.215 -8.947 1.00 . A A . 7 ASN HB2 1 1 14 9792 1 1 7 ASN HB3 H -4.003 6.498 -9.406 1.00 . A A . 7 ASN HB3 1 1 14 9793 1 1 7 ASN HD21 H -1.531 6.883 -10.939 1.00 . A A . 7 ASN HD21 1 1 14 9794 1 1 7 ASN HD22 H -1.532 8.553 -11.394 1.00 . A A . 7 ASN HD22 1 1 14 9795 1 1 7 ASN N N -2.267 7.748 -6.773 1.00 . A A . 7 ASN N 1 1 14 9796 1 1 7 ASN ND2 N -1.829 7.814 -10.823 1.00 . A A . 7 ASN ND2 1 1 14 9797 1 1 7 ASN O O -3.674 5.058 -6.927 1.00 . A A . 7 ASN O 1 1 14 9798 1 1 7 ASN OD1 O -3.088 9.252 -9.682 1.00 . A A . 7 ASN OD1 1 1 14 9799 1 1 8 CYS C C -6.907 4.936 -5.927 1.00 . A A . 8 CYS C 1 1 14 9800 1 1 8 CYS CA C -5.678 5.417 -5.212 1.00 . A A . 8 CYS CA 1 1 14 9801 1 1 8 CYS CB C -5.985 5.732 -3.746 1.00 . A A . 8 CYS CB 1 1 14 9802 1 1 8 CYS H H -5.397 7.389 -5.768 1.00 . A A . 8 CYS H 1 1 14 9803 1 1 8 CYS HA H -4.946 4.627 -5.234 1.00 . A A . 8 CYS HA 1 1 14 9804 1 1 8 CYS HB2 H -5.069 5.961 -3.220 1.00 . A A . 8 CYS HB2 1 1 14 9805 1 1 8 CYS HB3 H -6.657 6.575 -3.696 1.00 . A A . 8 CYS HB3 1 1 14 9806 1 1 8 CYS N N -5.056 6.479 -5.919 1.00 . A A . 8 CYS N 1 1 14 9807 1 1 8 CYS O O -7.844 5.699 -6.193 1.00 . A A . 8 CYS O 1 1 14 9808 1 1 8 CYS SG S -6.789 4.322 -2.894 1.00 . A A . 8 CYS SG 1 1 14 9809 1 1 9 GLN C C -9.123 2.636 -6.008 1.00 . A A . 9 GLN C 1 1 14 9810 1 1 9 GLN CA C -7.965 2.991 -6.946 1.00 . A A . 9 GLN CA 1 1 14 9811 1 1 9 GLN CB C -7.396 1.712 -7.552 1.00 . A A . 9 GLN CB 1 1 14 9812 1 1 9 GLN CD C -5.574 0.648 -8.928 1.00 . A A . 9 GLN CD 1 1 14 9813 1 1 9 GLN CG C -6.179 1.936 -8.424 1.00 . A A . 9 GLN CG 1 1 14 9814 1 1 9 GLN H H -6.089 3.179 -5.949 1.00 . A A . 9 GLN H 1 1 14 9815 1 1 9 GLN HA H -8.308 3.632 -7.743 1.00 . A A . 9 GLN HA 1 1 14 9816 1 1 9 GLN HB2 H -7.116 1.055 -6.740 1.00 . A A . 9 GLN HB2 1 1 14 9817 1 1 9 GLN HB3 H -8.161 1.230 -8.139 1.00 . A A . 9 GLN HB3 1 1 14 9818 1 1 9 GLN HE21 H -3.773 1.469 -8.898 1.00 . A A . 9 GLN HE21 1 1 14 9819 1 1 9 GLN HE22 H -3.849 -0.167 -9.428 1.00 . A A . 9 GLN HE22 1 1 14 9820 1 1 9 GLN HG2 H -6.445 2.536 -9.284 1.00 . A A . 9 GLN HG2 1 1 14 9821 1 1 9 GLN HG3 H -5.424 2.437 -7.835 1.00 . A A . 9 GLN HG3 1 1 14 9822 1 1 9 GLN N N -6.896 3.667 -6.218 1.00 . A A . 9 GLN N 1 1 14 9823 1 1 9 GLN NE2 N -4.276 0.651 -9.099 1.00 . A A . 9 GLN NE2 1 1 14 9824 1 1 9 GLN O O -10.193 2.272 -6.454 1.00 . A A . 9 GLN O 1 1 14 9825 1 1 9 GLN OE1 O -6.257 -0.340 -9.131 1.00 . A A . 9 GLN OE1 1 1 14 9826 1 1 10 ARG C C -10.435 0.941 -3.763 1.00 . A A . 10 ARG C 1 1 14 9827 1 1 10 ARG CA C -9.858 2.393 -3.655 1.00 . A A . 10 ARG CA 1 1 14 9828 1 1 10 ARG CB C -10.967 3.442 -3.616 1.00 . A A . 10 ARG CB 1 1 14 9829 1 1 10 ARG CD C -11.526 5.866 -3.174 1.00 . A A . 10 ARG CD 1 1 14 9830 1 1 10 ARG CG C -10.549 4.732 -2.932 1.00 . A A . 10 ARG CG 1 1 14 9831 1 1 10 ARG CZ C -11.903 7.574 -4.943 1.00 . A A . 10 ARG CZ 1 1 14 9832 1 1 10 ARG H H -8.033 3.188 -4.437 1.00 . A A . 10 ARG H 1 1 14 9833 1 1 10 ARG HA H -9.329 2.451 -2.717 1.00 . A A . 10 ARG HA 1 1 14 9834 1 1 10 ARG HB2 H -11.269 3.664 -4.629 1.00 . A A . 10 ARG HB2 1 1 14 9835 1 1 10 ARG HB3 H -11.809 3.030 -3.086 1.00 . A A . 10 ARG HB3 1 1 14 9836 1 1 10 ARG HD2 H -12.540 5.535 -2.994 1.00 . A A . 10 ARG HD2 1 1 14 9837 1 1 10 ARG HD3 H -11.291 6.664 -2.492 1.00 . A A . 10 ARG HD3 1 1 14 9838 1 1 10 ARG HE H -10.889 5.814 -5.141 1.00 . A A . 10 ARG HE 1 1 14 9839 1 1 10 ARG HG2 H -10.478 4.557 -1.869 1.00 . A A . 10 ARG HG2 1 1 14 9840 1 1 10 ARG HG3 H -9.577 5.016 -3.309 1.00 . A A . 10 ARG HG3 1 1 14 9841 1 1 10 ARG HH11 H -13.109 7.894 -3.303 1.00 . A A . 10 ARG HH11 1 1 14 9842 1 1 10 ARG HH12 H -13.165 9.130 -4.473 1.00 . A A . 10 ARG HH12 1 1 14 9843 1 1 10 ARG HH21 H -10.951 7.562 -6.768 1.00 . A A . 10 ARG HH21 1 1 14 9844 1 1 10 ARG HH22 H -11.884 8.952 -6.457 1.00 . A A . 10 ARG HH22 1 1 14 9845 1 1 10 ARG N N -8.875 2.766 -4.697 1.00 . A A . 10 ARG N 1 1 14 9846 1 1 10 ARG NE N -11.423 6.383 -4.540 1.00 . A A . 10 ARG NE 1 1 14 9847 1 1 10 ARG NH1 N -12.793 8.245 -4.183 1.00 . A A . 10 ARG NH1 1 1 14 9848 1 1 10 ARG NH2 N -11.563 8.051 -6.141 1.00 . A A . 10 ARG NH2 1 1 14 9849 1 1 10 ARG O O -11.619 0.736 -3.541 1.00 . A A . 10 ARG O 1 1 14 9850 1 1 11 PRO C C -10.330 -2.050 -2.697 1.00 . A A . 11 PRO C 1 1 14 9851 1 1 11 PRO CA C -10.092 -1.488 -4.106 1.00 . A A . 11 PRO CA 1 1 14 9852 1 1 11 PRO CB C -8.930 -2.250 -4.765 1.00 . A A . 11 PRO CB 1 1 14 9853 1 1 11 PRO CD C -8.161 -0.062 -4.301 1.00 . A A . 11 PRO CD 1 1 14 9854 1 1 11 PRO CG C -7.989 -1.195 -5.238 1.00 . A A . 11 PRO CG 1 1 14 9855 1 1 11 PRO HA H -10.981 -1.556 -4.714 1.00 . A A . 11 PRO HA 1 1 14 9856 1 1 11 PRO HB2 H -8.454 -2.847 -4.002 1.00 . A A . 11 PRO HB2 1 1 14 9857 1 1 11 PRO HB3 H -9.287 -2.862 -5.579 1.00 . A A . 11 PRO HB3 1 1 14 9858 1 1 11 PRO HD2 H -7.578 -0.223 -3.404 1.00 . A A . 11 PRO HD2 1 1 14 9859 1 1 11 PRO HD3 H -7.876 0.873 -4.761 1.00 . A A . 11 PRO HD3 1 1 14 9860 1 1 11 PRO HG2 H -6.978 -1.562 -5.165 1.00 . A A . 11 PRO HG2 1 1 14 9861 1 1 11 PRO HG3 H -8.211 -0.899 -6.250 1.00 . A A . 11 PRO HG3 1 1 14 9862 1 1 11 PRO N N -9.598 -0.108 -4.035 1.00 . A A . 11 PRO N 1 1 14 9863 1 1 11 PRO O O -9.559 -1.755 -1.761 1.00 . A A . 11 PRO O 1 1 14 9864 1 1 12 CYS C C -12.073 -4.887 -1.427 1.00 . A A . 12 CYS C 1 1 14 9865 1 1 12 CYS CA C -11.686 -3.420 -1.262 1.00 . A A . 12 CYS CA 1 1 14 9866 1 1 12 CYS CB C -12.830 -2.620 -0.608 1.00 . A A . 12 CYS CB 1 1 14 9867 1 1 12 CYS H H -11.933 -3.054 -3.306 1.00 . A A . 12 CYS H 1 1 14 9868 1 1 12 CYS HA H -10.816 -3.357 -0.631 1.00 . A A . 12 CYS HA 1 1 14 9869 1 1 12 CYS HB2 H -12.500 -1.598 -0.473 1.00 . A A . 12 CYS HB2 1 1 14 9870 1 1 12 CYS HB3 H -13.690 -2.624 -1.260 1.00 . A A . 12 CYS HB3 1 1 14 9871 1 1 12 CYS HG H -14.302 -2.409 1.435 1.00 . A A . 12 CYS HG 1 1 14 9872 1 1 12 CYS N N -11.352 -2.844 -2.545 1.00 . A A . 12 CYS N 1 1 14 9873 1 1 12 CYS O O -13.064 -5.197 -2.063 1.00 . A A . 12 CYS O 1 1 14 9874 1 1 12 CYS SG S -13.332 -3.214 1.020 1.00 . A A . 12 CYS SG 1 1 14 9875 1 1 13 LYS C C -11.054 -7.829 0.392 1.00 . A A . 13 LYS C 1 1 14 9876 1 1 13 LYS CA C -11.506 -7.217 -0.915 1.00 . A A . 13 LYS CA 1 1 14 9877 1 1 13 LYS CB C -10.745 -7.924 -2.060 1.00 . A A . 13 LYS CB 1 1 14 9878 1 1 13 LYS CD C -10.353 -8.325 -4.507 1.00 . A A . 13 LYS CD 1 1 14 9879 1 1 13 LYS CE C -10.714 -7.929 -5.933 1.00 . A A . 13 LYS CE 1 1 14 9880 1 1 13 LYS CG C -11.102 -7.486 -3.472 1.00 . A A . 13 LYS CG 1 1 14 9881 1 1 13 LYS H H -10.441 -5.478 -0.424 1.00 . A A . 13 LYS H 1 1 14 9882 1 1 13 LYS HA H -12.565 -7.389 -1.035 1.00 . A A . 13 LYS HA 1 1 14 9883 1 1 13 LYS HB2 H -9.688 -7.750 -1.933 1.00 . A A . 13 LYS HB2 1 1 14 9884 1 1 13 LYS HB3 H -10.914 -8.989 -1.980 1.00 . A A . 13 LYS HB3 1 1 14 9885 1 1 13 LYS HD2 H -9.298 -8.160 -4.366 1.00 . A A . 13 LYS HD2 1 1 14 9886 1 1 13 LYS HD3 H -10.593 -9.366 -4.346 1.00 . A A . 13 LYS HD3 1 1 14 9887 1 1 13 LYS HE2 H -11.783 -8.031 -6.045 1.00 . A A . 13 LYS HE2 1 1 14 9888 1 1 13 LYS HE3 H -10.435 -6.898 -6.098 1.00 . A A . 13 LYS HE3 1 1 14 9889 1 1 13 LYS HG2 H -12.164 -7.632 -3.590 1.00 . A A . 13 LYS HG2 1 1 14 9890 1 1 13 LYS HG3 H -10.853 -6.440 -3.590 1.00 . A A . 13 LYS HG3 1 1 14 9891 1 1 13 LYS HZ1 H -10.303 -9.778 -6.771 1.00 . A A . 13 LYS HZ1 1 1 14 9892 1 1 13 LYS HZ2 H -9.000 -8.721 -6.869 1.00 . A A . 13 LYS HZ2 1 1 14 9893 1 1 13 LYS HZ3 H -10.323 -8.541 -7.909 1.00 . A A . 13 LYS HZ3 1 1 14 9894 1 1 13 LYS N N -11.250 -5.779 -0.885 1.00 . A A . 13 LYS N 1 1 14 9895 1 1 13 LYS NZ N -10.037 -8.787 -6.941 1.00 . A A . 13 LYS NZ 1 1 14 9896 1 1 13 LYS O O -10.127 -7.319 1.021 1.00 . A A . 13 LYS O 1 1 14 9897 1 1 14 ASP C C -9.981 -10.327 1.945 1.00 . A A . 14 ASP C 1 1 14 9898 1 1 14 ASP CA C -11.333 -9.644 2.026 1.00 . A A . 14 ASP CA 1 1 14 9899 1 1 14 ASP CB C -12.381 -10.699 2.361 1.00 . A A . 14 ASP CB 1 1 14 9900 1 1 14 ASP CG C -13.683 -10.135 2.810 1.00 . A A . 14 ASP CG 1 1 14 9901 1 1 14 ASP H H -12.462 -9.247 0.276 1.00 . A A . 14 ASP H 1 1 14 9902 1 1 14 ASP HA H -11.321 -8.925 2.832 1.00 . A A . 14 ASP HA 1 1 14 9903 1 1 14 ASP HB2 H -12.570 -11.313 1.493 1.00 . A A . 14 ASP HB2 1 1 14 9904 1 1 14 ASP HB3 H -12.003 -11.343 3.139 1.00 . A A . 14 ASP HB3 1 1 14 9905 1 1 14 ASP N N -11.691 -8.917 0.790 1.00 . A A . 14 ASP N 1 1 14 9906 1 1 14 ASP O O -9.518 -10.904 2.922 1.00 . A A . 14 ASP O 1 1 14 9907 1 1 14 ASP OD1 O -14.471 -9.719 1.954 1.00 . A A . 14 ASP OD1 1 1 14 9908 1 1 14 ASP OD2 O -13.929 -10.118 4.034 1.00 . A A . 14 ASP OD2 1 1 14 9909 1 1 15 LYS C C -6.972 -9.999 0.168 1.00 . A A . 15 LYS C 1 1 14 9910 1 1 15 LYS CA C -8.085 -10.956 0.580 1.00 . A A . 15 LYS CA 1 1 14 9911 1 1 15 LYS CB C -8.252 -12.073 -0.471 1.00 . A A . 15 LYS CB 1 1 14 9912 1 1 15 LYS CD C -9.369 -14.221 -1.141 1.00 . A A . 15 LYS CD 1 1 14 9913 1 1 15 LYS CE C -10.287 -15.357 -0.714 1.00 . A A . 15 LYS CE 1 1 14 9914 1 1 15 LYS CG C -9.191 -13.200 -0.037 1.00 . A A . 15 LYS CG 1 1 14 9915 1 1 15 LYS H H -9.760 -9.770 0.053 1.00 . A A . 15 LYS H 1 1 14 9916 1 1 15 LYS HA H -7.816 -11.425 1.515 1.00 . A A . 15 LYS HA 1 1 14 9917 1 1 15 LYS HB2 H -8.645 -11.634 -1.375 1.00 . A A . 15 LYS HB2 1 1 14 9918 1 1 15 LYS HB3 H -7.285 -12.499 -0.695 1.00 . A A . 15 LYS HB3 1 1 14 9919 1 1 15 LYS HD2 H -9.785 -13.732 -2.011 1.00 . A A . 15 LYS HD2 1 1 14 9920 1 1 15 LYS HD3 H -8.398 -14.624 -1.395 1.00 . A A . 15 LYS HD3 1 1 14 9921 1 1 15 LYS HE2 H -9.820 -15.881 0.104 1.00 . A A . 15 LYS HE2 1 1 14 9922 1 1 15 LYS HE3 H -11.234 -14.950 -0.402 1.00 . A A . 15 LYS HE3 1 1 14 9923 1 1 15 LYS HG2 H -8.783 -13.691 0.836 1.00 . A A . 15 LYS HG2 1 1 14 9924 1 1 15 LYS HG3 H -10.156 -12.791 0.224 1.00 . A A . 15 LYS HG3 1 1 14 9925 1 1 15 LYS HZ1 H -11.108 -17.115 -1.495 1.00 . A A . 15 LYS HZ1 1 1 14 9926 1 1 15 LYS HZ2 H -9.590 -16.725 -2.110 1.00 . A A . 15 LYS HZ2 1 1 14 9927 1 1 15 LYS HZ3 H -10.936 -15.871 -2.632 1.00 . A A . 15 LYS HZ3 1 1 14 9928 1 1 15 LYS N N -9.352 -10.278 0.785 1.00 . A A . 15 LYS N 1 1 14 9929 1 1 15 LYS NZ N -10.504 -16.326 -1.806 1.00 . A A . 15 LYS NZ 1 1 14 9930 1 1 15 LYS O O -5.884 -10.437 -0.183 1.00 . A A . 15 LYS O 1 1 14 9931 1 1 16 VAL C C -5.511 -7.091 1.003 1.00 . A A . 16 VAL C 1 1 14 9932 1 1 16 VAL CA C -6.208 -7.747 -0.193 1.00 . A A . 16 VAL CA 1 1 14 9933 1 1 16 VAL CB C -6.730 -6.681 -1.208 1.00 . A A . 16 VAL CB 1 1 14 9934 1 1 16 VAL CG1 C -7.876 -5.895 -0.635 1.00 . A A . 16 VAL CG1 1 1 14 9935 1 1 16 VAL CG2 C -5.609 -5.736 -1.623 1.00 . A A . 16 VAL CG2 1 1 14 9936 1 1 16 VAL H H -8.082 -8.378 0.568 1.00 . A A . 16 VAL H 1 1 14 9937 1 1 16 VAL HA H -5.451 -8.340 -0.680 1.00 . A A . 16 VAL HA 1 1 14 9938 1 1 16 VAL HB H -7.090 -7.184 -2.091 1.00 . A A . 16 VAL HB 1 1 14 9939 1 1 16 VAL HG11 H -7.496 -5.415 0.256 1.00 . A A . 16 VAL HG11 1 1 14 9940 1 1 16 VAL HG12 H -8.680 -6.569 -0.372 1.00 . A A . 16 VAL HG12 1 1 14 9941 1 1 16 VAL HG13 H -8.214 -5.151 -1.339 1.00 . A A . 16 VAL HG13 1 1 14 9942 1 1 16 VAL HG21 H -5.294 -5.192 -0.746 1.00 . A A . 16 VAL HG21 1 1 14 9943 1 1 16 VAL HG22 H -5.987 -5.026 -2.345 1.00 . A A . 16 VAL HG22 1 1 14 9944 1 1 16 VAL HG23 H -4.775 -6.294 -2.024 1.00 . A A . 16 VAL HG23 1 1 14 9945 1 1 16 VAL N N -7.224 -8.705 0.224 1.00 . A A . 16 VAL N 1 1 14 9946 1 1 16 VAL O O -6.093 -6.314 1.736 1.00 . A A . 16 VAL O 1 1 14 9947 1 1 17 ASP C C -2.926 -5.520 1.874 1.00 . A A . 17 ASP C 1 1 14 9948 1 1 17 ASP CA C -3.436 -6.931 2.251 1.00 . A A . 17 ASP CA 1 1 14 9949 1 1 17 ASP CB C -2.289 -7.903 2.543 1.00 . A A . 17 ASP CB 1 1 14 9950 1 1 17 ASP CG C -1.420 -7.470 3.702 1.00 . A A . 17 ASP CG 1 1 14 9951 1 1 17 ASP H H -4.052 -8.262 0.674 1.00 . A A . 17 ASP H 1 1 14 9952 1 1 17 ASP HA H -4.042 -6.828 3.139 1.00 . A A . 17 ASP HA 1 1 14 9953 1 1 17 ASP HB2 H -2.703 -8.877 2.765 1.00 . A A . 17 ASP HB2 1 1 14 9954 1 1 17 ASP HB3 H -1.678 -7.976 1.657 1.00 . A A . 17 ASP HB3 1 1 14 9955 1 1 17 ASP N N -4.304 -7.489 1.206 1.00 . A A . 17 ASP N 1 1 14 9956 1 1 17 ASP O O -2.702 -5.212 0.672 1.00 . A A . 17 ASP O 1 1 14 9957 1 1 17 ASP OD1 O -1.845 -7.641 4.888 1.00 . A A . 17 ASP OD1 1 1 14 9958 1 1 17 ASP OD2 O -0.326 -6.982 3.459 1.00 . A A . 17 ASP OD2 1 1 14 9959 1 1 18 TRP C C -0.982 -3.051 3.304 1.00 . A A . 18 TRP C 1 1 14 9960 1 1 18 TRP CA C -2.390 -3.270 2.764 1.00 . A A . 18 TRP CA 1 1 14 9961 1 1 18 TRP CB C -3.373 -2.410 3.580 1.00 . A A . 18 TRP CB 1 1 14 9962 1 1 18 TRP CD1 C -5.563 -3.584 2.914 1.00 . A A . 18 TRP CD1 1 1 14 9963 1 1 18 TRP CD2 C -5.689 -1.360 2.932 1.00 . A A . 18 TRP CD2 1 1 14 9964 1 1 18 TRP CE2 C -6.949 -1.881 2.557 1.00 . A A . 18 TRP CE2 1 1 14 9965 1 1 18 TRP CE3 C -5.528 0.024 3.024 1.00 . A A . 18 TRP CE3 1 1 14 9966 1 1 18 TRP CG C -4.814 -2.473 3.135 1.00 . A A . 18 TRP CG 1 1 14 9967 1 1 18 TRP CH2 C -7.858 0.298 2.380 1.00 . A A . 18 TRP CH2 1 1 14 9968 1 1 18 TRP CZ2 C -8.048 -1.058 2.275 1.00 . A A . 18 TRP CZ2 1 1 14 9969 1 1 18 TRP CZ3 C -6.608 0.837 2.748 1.00 . A A . 18 TRP CZ3 1 1 14 9970 1 1 18 TRP H H -2.825 -5.057 3.802 1.00 . A A . 18 TRP H 1 1 14 9971 1 1 18 TRP HA H -2.439 -2.972 1.729 1.00 . A A . 18 TRP HA 1 1 14 9972 1 1 18 TRP HB2 H -3.342 -2.739 4.609 1.00 . A A . 18 TRP HB2 1 1 14 9973 1 1 18 TRP HB3 H -3.061 -1.376 3.522 1.00 . A A . 18 TRP HB3 1 1 14 9974 1 1 18 TRP HD1 H -5.177 -4.590 2.994 1.00 . A A . 18 TRP HD1 1 1 14 9975 1 1 18 TRP HE1 H -7.522 -3.900 2.313 1.00 . A A . 18 TRP HE1 1 1 14 9976 1 1 18 TRP HE3 H -4.579 0.460 3.304 1.00 . A A . 18 TRP HE3 1 1 14 9977 1 1 18 TRP HH2 H -8.673 0.977 2.174 1.00 . A A . 18 TRP HH2 1 1 14 9978 1 1 18 TRP HZ2 H -9.019 -1.441 1.991 1.00 . A A . 18 TRP HZ2 1 1 14 9979 1 1 18 TRP HZ3 H -6.487 1.909 2.815 1.00 . A A . 18 TRP HZ3 1 1 14 9980 1 1 18 TRP N N -2.755 -4.684 2.896 1.00 . A A . 18 TRP N 1 1 14 9981 1 1 18 TRP NE1 N -6.831 -3.240 2.536 1.00 . A A . 18 TRP NE1 1 1 14 9982 1 1 18 TRP O O -0.503 -3.830 4.113 1.00 . A A . 18 TRP O 1 1 14 9983 1 1 19 VAL C C 1.141 -0.366 3.997 1.00 . A A . 19 VAL C 1 1 14 9984 1 1 19 VAL CA C 1.026 -1.728 3.321 1.00 . A A . 19 VAL CA 1 1 14 9985 1 1 19 VAL CB C 2.044 -1.839 2.129 1.00 . A A . 19 VAL CB 1 1 14 9986 1 1 19 VAL CG1 C 2.127 -3.275 1.624 1.00 . A A . 19 VAL CG1 1 1 14 9987 1 1 19 VAL CG2 C 1.634 -0.913 0.979 1.00 . A A . 19 VAL CG2 1 1 14 9988 1 1 19 VAL H H -0.699 -1.232 2.376 1.00 . A A . 19 VAL H 1 1 14 9989 1 1 19 VAL HA H 1.280 -2.478 4.054 1.00 . A A . 19 VAL HA 1 1 14 9990 1 1 19 VAL HB H 3.020 -1.533 2.481 1.00 . A A . 19 VAL HB 1 1 14 9991 1 1 19 VAL HG11 H 2.449 -3.949 2.407 1.00 . A A . 19 VAL HG11 1 1 14 9992 1 1 19 VAL HG12 H 2.825 -3.306 0.802 1.00 . A A . 19 VAL HG12 1 1 14 9993 1 1 19 VAL HG13 H 1.154 -3.580 1.263 1.00 . A A . 19 VAL HG13 1 1 14 9994 1 1 19 VAL HG21 H 2.357 -0.987 0.180 1.00 . A A . 19 VAL HG21 1 1 14 9995 1 1 19 VAL HG22 H 1.608 0.102 1.350 1.00 . A A . 19 VAL HG22 1 1 14 9996 1 1 19 VAL HG23 H 0.651 -1.183 0.618 1.00 . A A . 19 VAL HG23 1 1 14 9997 1 1 19 VAL N N -0.333 -1.978 2.901 1.00 . A A . 19 VAL N 1 1 14 9998 1 1 19 VAL O O 0.604 0.625 3.502 1.00 . A A . 19 VAL O 1 1 14 9999 1 1 20 GLN C C 3.454 1.340 5.589 1.00 . A A . 20 GLN C 1 1 14 10000 1 1 20 GLN CA C 2.024 0.895 5.860 1.00 . A A . 20 GLN CA 1 1 14 10001 1 1 20 GLN CB C 1.799 0.688 7.378 1.00 . A A . 20 GLN CB 1 1 14 10002 1 1 20 GLN CD C 1.730 1.774 9.685 1.00 . A A . 20 GLN CD 1 1 14 10003 1 1 20 GLN CG C 1.935 1.975 8.198 1.00 . A A . 20 GLN CG 1 1 14 10004 1 1 20 GLN H H 2.151 -1.176 5.484 1.00 . A A . 20 GLN H 1 1 14 10005 1 1 20 GLN HA H 1.346 1.645 5.487 1.00 . A A . 20 GLN HA 1 1 14 10006 1 1 20 GLN HB2 H 0.805 0.284 7.518 1.00 . A A . 20 GLN HB2 1 1 14 10007 1 1 20 GLN HB3 H 2.528 -0.031 7.731 1.00 . A A . 20 GLN HB3 1 1 14 10008 1 1 20 GLN HE21 H 2.994 3.246 10.075 1.00 . A A . 20 GLN HE21 1 1 14 10009 1 1 20 GLN HE22 H 2.290 2.506 11.443 1.00 . A A . 20 GLN HE22 1 1 14 10010 1 1 20 GLN HG2 H 2.929 2.367 8.047 1.00 . A A . 20 GLN HG2 1 1 14 10011 1 1 20 GLN HG3 H 1.226 2.709 7.851 1.00 . A A . 20 GLN HG3 1 1 14 10012 1 1 20 GLN N N 1.791 -0.340 5.126 1.00 . A A . 20 GLN N 1 1 14 10013 1 1 20 GLN NE2 N 2.398 2.581 10.477 1.00 . A A . 20 GLN NE2 1 1 14 10014 1 1 20 GLN O O 4.350 0.509 5.514 1.00 . A A . 20 GLN O 1 1 14 10015 1 1 20 GLN OE1 O 0.990 0.907 10.117 1.00 . A A . 20 GLN OE1 1 1 14 10016 1 1 21 CYS C C 5.714 3.449 6.444 1.00 . A A . 21 CYS C 1 1 14 10017 1 1 21 CYS CA C 5.012 3.080 5.137 1.00 . A A . 21 CYS CA 1 1 14 10018 1 1 21 CYS CB C 5.061 4.222 4.103 1.00 . A A . 21 CYS CB 1 1 14 10019 1 1 21 CYS H H 2.909 3.246 5.422 1.00 . A A . 21 CYS H 1 1 14 10020 1 1 21 CYS HA H 5.548 2.231 4.739 1.00 . A A . 21 CYS HA 1 1 14 10021 1 1 21 CYS HB2 H 6.058 4.512 3.824 1.00 . A A . 21 CYS HB2 1 1 14 10022 1 1 21 CYS HB3 H 4.553 3.894 3.212 1.00 . A A . 21 CYS HB3 1 1 14 10023 1 1 21 CYS N N 3.673 2.629 5.389 1.00 . A A . 21 CYS N 1 1 14 10024 1 1 21 CYS O O 5.431 4.503 7.063 1.00 . A A . 21 CYS O 1 1 14 10025 1 1 21 CYS SG S 4.302 5.757 4.576 1.00 . A A . 21 CYS SG 1 1 14 10026 1 1 22 ASP C C 8.583 3.666 7.936 1.00 . A A . 22 ASP C 1 1 14 10027 1 1 22 ASP CA C 7.388 2.768 8.114 1.00 . A A . 22 ASP CA 1 1 14 10028 1 1 22 ASP CB C 7.835 1.414 8.678 1.00 . A A . 22 ASP CB 1 1 14 10029 1 1 22 ASP CG C 6.683 0.553 9.114 1.00 . A A . 22 ASP CG 1 1 14 10030 1 1 22 ASP H H 6.895 1.849 6.263 1.00 . A A . 22 ASP H 1 1 14 10031 1 1 22 ASP HA H 6.713 3.233 8.818 1.00 . A A . 22 ASP HA 1 1 14 10032 1 1 22 ASP HB2 H 8.403 0.874 7.934 1.00 . A A . 22 ASP HB2 1 1 14 10033 1 1 22 ASP HB3 H 8.471 1.594 9.533 1.00 . A A . 22 ASP HB3 1 1 14 10034 1 1 22 ASP N N 6.658 2.606 6.845 1.00 . A A . 22 ASP N 1 1 14 10035 1 1 22 ASP O O 9.520 3.652 8.730 1.00 . A A . 22 ASP O 1 1 14 10036 1 1 22 ASP OD1 O 6.118 -0.165 8.271 1.00 . A A . 22 ASP OD1 1 1 14 10037 1 1 22 ASP OD2 O 6.330 0.582 10.316 1.00 . A A . 22 ASP OD2 1 1 14 10038 1 1 23 GLY C C 9.320 6.740 7.421 1.00 . A A . 23 GLY C 1 1 14 10039 1 1 23 GLY CA C 9.567 5.437 6.675 1.00 . A A . 23 GLY CA 1 1 14 10040 1 1 23 GLY H H 7.695 4.498 6.397 1.00 . A A . 23 GLY H 1 1 14 10041 1 1 23 GLY HA2 H 10.514 5.010 6.978 1.00 . A A . 23 GLY HA2 1 1 14 10042 1 1 23 GLY HA3 H 9.602 5.642 5.615 1.00 . A A . 23 GLY HA3 1 1 14 10043 1 1 23 GLY N N 8.515 4.504 6.926 1.00 . A A . 23 GLY N 1 1 14 10044 1 1 23 GLY O O 10.212 7.560 7.546 1.00 . A A . 23 GLY O 1 1 14 10045 1 1 24 GLY C C 6.400 8.713 8.528 1.00 . A A . 24 GLY C 1 1 14 10046 1 1 24 GLY CA C 7.814 8.117 8.681 1.00 . A A . 24 GLY CA 1 1 14 10047 1 1 24 GLY H H 7.411 6.230 7.788 1.00 . A A . 24 GLY H 1 1 14 10048 1 1 24 GLY HA2 H 7.968 7.900 9.729 1.00 . A A . 24 GLY HA2 1 1 14 10049 1 1 24 GLY HA3 H 8.532 8.869 8.382 1.00 . A A . 24 GLY HA3 1 1 14 10050 1 1 24 GLY N N 8.088 6.925 7.921 1.00 . A A . 24 GLY N 1 1 14 10051 1 1 24 GLY O O 6.064 9.640 9.255 1.00 . A A . 24 GLY O 1 1 14 10052 1 1 25 CYS C C 3.200 8.045 8.283 1.00 . A A . 25 CYS C 1 1 14 10053 1 1 25 CYS CA C 4.210 8.826 7.442 1.00 . A A . 25 CYS CA 1 1 14 10054 1 1 25 CYS CB C 3.729 8.796 5.984 1.00 . A A . 25 CYS CB 1 1 14 10055 1 1 25 CYS H H 5.877 7.523 6.989 1.00 . A A . 25 CYS H 1 1 14 10056 1 1 25 CYS HA H 4.250 9.848 7.790 1.00 . A A . 25 CYS HA 1 1 14 10057 1 1 25 CYS HB2 H 3.462 7.778 5.736 1.00 . A A . 25 CYS HB2 1 1 14 10058 1 1 25 CYS HB3 H 2.846 9.415 5.896 1.00 . A A . 25 CYS HB3 1 1 14 10059 1 1 25 CYS N N 5.575 8.230 7.588 1.00 . A A . 25 CYS N 1 1 14 10060 1 1 25 CYS O O 2.208 8.584 8.741 1.00 . A A . 25 CYS O 1 1 14 10061 1 1 25 CYS SG S 4.929 9.347 4.761 1.00 . A A . 25 CYS SG 1 1 14 10062 1 1 26 ASP C C 1.289 5.599 8.469 1.00 . A A . 26 ASP C 1 1 14 10063 1 1 26 ASP CA C 2.634 5.774 9.173 1.00 . A A . 26 ASP CA 1 1 14 10064 1 1 26 ASP CB C 2.409 6.143 10.668 1.00 . A A . 26 ASP CB 1 1 14 10065 1 1 26 ASP CG C 3.687 6.231 11.467 1.00 . A A . 26 ASP CG 1 1 14 10066 1 1 26 ASP H H 4.375 6.452 8.157 1.00 . A A . 26 ASP H 1 1 14 10067 1 1 26 ASP HA H 3.147 4.826 9.124 1.00 . A A . 26 ASP HA 1 1 14 10068 1 1 26 ASP HB2 H 1.883 7.080 10.744 1.00 . A A . 26 ASP HB2 1 1 14 10069 1 1 26 ASP HB3 H 1.792 5.365 11.091 1.00 . A A . 26 ASP HB3 1 1 14 10070 1 1 26 ASP N N 3.498 6.748 8.468 1.00 . A A . 26 ASP N 1 1 14 10071 1 1 26 ASP O O 0.343 5.053 9.045 1.00 . A A . 26 ASP O 1 1 14 10072 1 1 26 ASP OD1 O 4.253 5.179 11.800 1.00 . A A . 26 ASP OD1 1 1 14 10073 1 1 26 ASP OD2 O 4.135 7.362 11.769 1.00 . A A . 26 ASP OD2 1 1 14 10074 1 1 27 GLU C C -0.134 4.576 5.743 1.00 . A A . 27 GLU C 1 1 14 10075 1 1 27 GLU CA C 0.005 5.935 6.451 1.00 . A A . 27 GLU CA 1 1 14 10076 1 1 27 GLU CB C -0.110 7.116 5.472 1.00 . A A . 27 GLU CB 1 1 14 10077 1 1 27 GLU CD C -0.334 9.642 5.233 1.00 . A A . 27 GLU CD 1 1 14 10078 1 1 27 GLU CG C -0.180 8.465 6.173 1.00 . A A . 27 GLU CG 1 1 14 10079 1 1 27 GLU H H 2.030 6.376 6.804 1.00 . A A . 27 GLU H 1 1 14 10080 1 1 27 GLU HA H -0.801 6.002 7.167 1.00 . A A . 27 GLU HA 1 1 14 10081 1 1 27 GLU HB2 H 0.760 7.114 4.833 1.00 . A A . 27 GLU HB2 1 1 14 10082 1 1 27 GLU HB3 H -0.989 6.999 4.859 1.00 . A A . 27 GLU HB3 1 1 14 10083 1 1 27 GLU HG2 H -1.039 8.445 6.828 1.00 . A A . 27 GLU HG2 1 1 14 10084 1 1 27 GLU HG3 H 0.708 8.587 6.774 1.00 . A A . 27 GLU HG3 1 1 14 10085 1 1 27 GLU N N 1.226 6.012 7.219 1.00 . A A . 27 GLU N 1 1 14 10086 1 1 27 GLU O O 0.851 3.837 5.571 1.00 . A A . 27 GLU O 1 1 14 10087 1 1 27 GLU OE1 O -1.490 10.010 4.934 1.00 . A A . 27 GLU OE1 1 1 14 10088 1 1 27 GLU OE2 O 0.697 10.213 4.804 1.00 . A A . 27 GLU OE2 1 1 14 10089 1 1 28 TRP C C -1.955 3.129 3.235 1.00 . A A . 28 TRP C 1 1 14 10090 1 1 28 TRP CA C -1.690 2.981 4.712 1.00 . A A . 28 TRP CA 1 1 14 10091 1 1 28 TRP CB C -2.885 2.328 5.396 1.00 . A A . 28 TRP CB 1 1 14 10092 1 1 28 TRP CD1 C -2.635 2.715 7.920 1.00 . A A . 28 TRP CD1 1 1 14 10093 1 1 28 TRP CD2 C -2.290 0.608 7.258 1.00 . A A . 28 TRP CD2 1 1 14 10094 1 1 28 TRP CE2 C -2.109 0.668 8.643 1.00 . A A . 28 TRP CE2 1 1 14 10095 1 1 28 TRP CE3 C -2.125 -0.622 6.610 1.00 . A A . 28 TRP CE3 1 1 14 10096 1 1 28 TRP CG C -2.616 1.922 6.807 1.00 . A A . 28 TRP CG 1 1 14 10097 1 1 28 TRP CH2 C -1.625 -1.650 8.742 1.00 . A A . 28 TRP CH2 1 1 14 10098 1 1 28 TRP CZ2 C -1.783 -0.459 9.403 1.00 . A A . 28 TRP CZ2 1 1 14 10099 1 1 28 TRP CZ3 C -1.798 -1.735 7.358 1.00 . A A . 28 TRP CZ3 1 1 14 10100 1 1 28 TRP H H -2.030 4.964 5.460 1.00 . A A . 28 TRP H 1 1 14 10101 1 1 28 TRP HA H -0.832 2.335 4.832 1.00 . A A . 28 TRP HA 1 1 14 10102 1 1 28 TRP HB2 H -3.731 3.002 5.392 1.00 . A A . 28 TRP HB2 1 1 14 10103 1 1 28 TRP HB3 H -3.156 1.449 4.833 1.00 . A A . 28 TRP HB3 1 1 14 10104 1 1 28 TRP HD1 H -2.853 3.773 7.904 1.00 . A A . 28 TRP HD1 1 1 14 10105 1 1 28 TRP HE1 H -2.263 2.291 9.950 1.00 . A A . 28 TRP HE1 1 1 14 10106 1 1 28 TRP HE3 H -2.251 -0.709 5.542 1.00 . A A . 28 TRP HE3 1 1 14 10107 1 1 28 TRP HH2 H -1.373 -2.542 9.300 1.00 . A A . 28 TRP HH2 1 1 14 10108 1 1 28 TRP HZ2 H -1.645 -0.408 10.473 1.00 . A A . 28 TRP HZ2 1 1 14 10109 1 1 28 TRP HZ3 H -1.669 -2.687 6.861 1.00 . A A . 28 TRP HZ3 1 1 14 10110 1 1 28 TRP N N -1.355 4.264 5.342 1.00 . A A . 28 TRP N 1 1 14 10111 1 1 28 TRP NE1 N -2.323 1.962 9.027 1.00 . A A . 28 TRP NE1 1 1 14 10112 1 1 28 TRP O O -2.762 3.968 2.813 1.00 . A A . 28 TRP O 1 1 14 10113 1 1 29 PHE C C -1.859 0.964 0.557 1.00 . A A . 29 PHE C 1 1 14 10114 1 1 29 PHE CA C -1.360 2.333 1.026 1.00 . A A . 29 PHE CA 1 1 14 10115 1 1 29 PHE CB C 0.055 2.584 0.412 1.00 . A A . 29 PHE CB 1 1 14 10116 1 1 29 PHE CD1 C 1.226 3.846 2.241 1.00 . A A . 29 PHE CD1 1 1 14 10117 1 1 29 PHE CD2 C 1.059 4.896 0.120 1.00 . A A . 29 PHE CD2 1 1 14 10118 1 1 29 PHE CE1 C 1.899 4.921 2.723 1.00 . A A . 29 PHE CE1 1 1 14 10119 1 1 29 PHE CE2 C 1.732 5.992 0.610 1.00 . A A . 29 PHE CE2 1 1 14 10120 1 1 29 PHE CG C 0.796 3.803 0.935 1.00 . A A . 29 PHE CG 1 1 14 10121 1 1 29 PHE CZ C 2.153 5.998 1.921 1.00 . A A . 29 PHE CZ 1 1 14 10122 1 1 29 PHE H H -0.649 1.684 2.883 1.00 . A A . 29 PHE H 1 1 14 10123 1 1 29 PHE HA H -2.028 3.118 0.699 1.00 . A A . 29 PHE HA 1 1 14 10124 1 1 29 PHE HB2 H 0.706 1.738 0.575 1.00 . A A . 29 PHE HB2 1 1 14 10125 1 1 29 PHE HB3 H -0.062 2.713 -0.653 1.00 . A A . 29 PHE HB3 1 1 14 10126 1 1 29 PHE HD1 H 1.025 3.001 2.883 1.00 . A A . 29 PHE HD1 1 1 14 10127 1 1 29 PHE HD2 H 0.723 4.903 -0.906 1.00 . A A . 29 PHE HD2 1 1 14 10128 1 1 29 PHE HE1 H 2.227 4.932 3.754 1.00 . A A . 29 PHE HE1 1 1 14 10129 1 1 29 PHE HE2 H 1.930 6.837 -0.033 1.00 . A A . 29 PHE HE2 1 1 14 10130 1 1 29 PHE HZ H 2.688 6.833 2.345 1.00 . A A . 29 PHE HZ 1 1 14 10131 1 1 29 PHE N N -1.275 2.320 2.464 1.00 . A A . 29 PHE N 1 1 14 10132 1 1 29 PHE O O -1.700 -0.042 1.257 1.00 . A A . 29 PHE O 1 1 14 10133 1 1 30 HIS C C -1.772 -0.844 -2.054 1.00 . A A . 30 HIS C 1 1 14 10134 1 1 30 HIS CA C -2.876 -0.359 -1.202 1.00 . A A . 30 HIS CA 1 1 14 10135 1 1 30 HIS CB C -4.098 -0.221 -2.116 1.00 . A A . 30 HIS CB 1 1 14 10136 1 1 30 HIS CD2 C -6.317 -0.966 -1.070 1.00 . A A . 30 HIS CD2 1 1 14 10137 1 1 30 HIS CE1 C -7.301 0.979 -0.999 1.00 . A A . 30 HIS CE1 1 1 14 10138 1 1 30 HIS CG C -5.428 -0.052 -1.506 1.00 . A A . 30 HIS CG 1 1 14 10139 1 1 30 HIS H H -2.579 1.778 -1.065 1.00 . A A . 30 HIS H 1 1 14 10140 1 1 30 HIS HA H -3.082 -1.078 -0.423 1.00 . A A . 30 HIS HA 1 1 14 10141 1 1 30 HIS HB2 H -3.938 0.724 -2.614 1.00 . A A . 30 HIS HB2 1 1 14 10142 1 1 30 HIS HB3 H -4.151 -0.962 -2.900 1.00 . A A . 30 HIS HB3 1 1 14 10143 1 1 30 HIS HD2 H -6.138 -2.027 -0.979 1.00 . A A . 30 HIS HD2 1 1 14 10144 1 1 30 HIS HE1 H -8.064 1.736 -0.882 1.00 . A A . 30 HIS HE1 1 1 14 10145 1 1 30 HIS HE2 H -8.355 -0.747 -0.773 1.00 . A A . 30 HIS HE2 1 1 14 10146 1 1 30 HIS N N -2.463 0.919 -0.604 1.00 . A A . 30 HIS N 1 1 14 10147 1 1 30 HIS ND1 N -6.065 1.164 -1.445 1.00 . A A . 30 HIS ND1 1 1 14 10148 1 1 30 HIS NE2 N -7.469 -0.303 -0.769 1.00 . A A . 30 HIS NE2 1 1 14 10149 1 1 30 HIS O O -1.171 -0.053 -2.760 1.00 . A A . 30 HIS O 1 1 14 10150 1 1 31 GLN C C -0.714 -2.362 -4.342 1.00 . A A . 31 GLN C 1 1 14 10151 1 1 31 GLN CA C -0.489 -2.707 -2.879 1.00 . A A . 31 GLN CA 1 1 14 10152 1 1 31 GLN CB C -0.333 -4.207 -2.679 1.00 . A A . 31 GLN CB 1 1 14 10153 1 1 31 GLN CD C 0.508 -6.066 -1.194 1.00 . A A . 31 GLN CD 1 1 14 10154 1 1 31 GLN CG C 0.320 -4.573 -1.362 1.00 . A A . 31 GLN CG 1 1 14 10155 1 1 31 GLN H H -2.019 -2.691 -1.393 1.00 . A A . 31 GLN H 1 1 14 10156 1 1 31 GLN HA H 0.430 -2.225 -2.582 1.00 . A A . 31 GLN HA 1 1 14 10157 1 1 31 GLN HB2 H -1.312 -4.661 -2.717 1.00 . A A . 31 GLN HB2 1 1 14 10158 1 1 31 GLN HB3 H 0.285 -4.594 -3.475 1.00 . A A . 31 GLN HB3 1 1 14 10159 1 1 31 GLN HE21 H -1.182 -6.207 -0.204 1.00 . A A . 31 GLN HE21 1 1 14 10160 1 1 31 GLN HE22 H -0.294 -7.671 -0.431 1.00 . A A . 31 GLN HE22 1 1 14 10161 1 1 31 GLN HG2 H 1.295 -4.105 -1.336 1.00 . A A . 31 GLN HG2 1 1 14 10162 1 1 31 GLN HG3 H -0.282 -4.199 -0.550 1.00 . A A . 31 GLN HG3 1 1 14 10163 1 1 31 GLN N N -1.517 -2.131 -2.023 1.00 . A A . 31 GLN N 1 1 14 10164 1 1 31 GLN NE2 N -0.417 -6.710 -0.555 1.00 . A A . 31 GLN NE2 1 1 14 10165 1 1 31 GLN O O 0.142 -1.812 -4.963 1.00 . A A . 31 GLN O 1 1 14 10166 1 1 31 GLN OE1 O 1.510 -6.617 -1.610 1.00 . A A . 31 GLN OE1 1 1 14 10167 1 1 32 VAL C C -2.171 -0.809 -6.571 1.00 . A A . 32 VAL C 1 1 14 10168 1 1 32 VAL CA C -2.182 -2.328 -6.254 1.00 . A A . 32 VAL CA 1 1 14 10169 1 1 32 VAL CB C -3.537 -2.944 -6.687 1.00 . A A . 32 VAL CB 1 1 14 10170 1 1 32 VAL CG1 C -4.657 -2.344 -5.893 1.00 . A A . 32 VAL CG1 1 1 14 10171 1 1 32 VAL CG2 C -3.781 -2.722 -8.157 1.00 . A A . 32 VAL CG2 1 1 14 10172 1 1 32 VAL H H -2.630 -2.946 -4.295 1.00 . A A . 32 VAL H 1 1 14 10173 1 1 32 VAL HA H -1.403 -2.781 -6.841 1.00 . A A . 32 VAL HA 1 1 14 10174 1 1 32 VAL HB H -3.517 -4.006 -6.496 1.00 . A A . 32 VAL HB 1 1 14 10175 1 1 32 VAL HG11 H -5.599 -2.752 -6.224 1.00 . A A . 32 VAL HG11 1 1 14 10176 1 1 32 VAL HG12 H -4.595 -1.280 -6.084 1.00 . A A . 32 VAL HG12 1 1 14 10177 1 1 32 VAL HG13 H -4.485 -2.526 -4.843 1.00 . A A . 32 VAL HG13 1 1 14 10178 1 1 32 VAL HG21 H -2.959 -3.126 -8.729 1.00 . A A . 32 VAL HG21 1 1 14 10179 1 1 32 VAL HG22 H -3.812 -1.647 -8.277 1.00 . A A . 32 VAL HG22 1 1 14 10180 1 1 32 VAL HG23 H -4.713 -3.175 -8.465 1.00 . A A . 32 VAL HG23 1 1 14 10181 1 1 32 VAL N N -1.904 -2.598 -4.848 1.00 . A A . 32 VAL N 1 1 14 10182 1 1 32 VAL O O -1.658 -0.381 -7.594 1.00 . A A . 32 VAL O 1 1 14 10183 1 1 33 CYS C C -1.491 2.115 -5.843 1.00 . A A . 33 CYS C 1 1 14 10184 1 1 33 CYS CA C -2.850 1.397 -5.914 1.00 . A A . 33 CYS CA 1 1 14 10185 1 1 33 CYS CB C -3.927 2.055 -4.996 1.00 . A A . 33 CYS CB 1 1 14 10186 1 1 33 CYS H H -2.986 -0.527 -4.886 1.00 . A A . 33 CYS H 1 1 14 10187 1 1 33 CYS HA H -3.156 1.524 -6.940 1.00 . A A . 33 CYS HA 1 1 14 10188 1 1 33 CYS HB2 H -4.330 2.928 -5.466 1.00 . A A . 33 CYS HB2 1 1 14 10189 1 1 33 CYS HB3 H -4.738 1.348 -4.899 1.00 . A A . 33 CYS HB3 1 1 14 10190 1 1 33 CYS N N -2.709 -0.022 -5.670 1.00 . A A . 33 CYS N 1 1 14 10191 1 1 33 CYS O O -1.320 3.171 -6.440 1.00 . A A . 33 CYS O 1 1 14 10192 1 1 33 CYS SG S -3.406 2.523 -3.342 1.00 . A A . 33 CYS SG 1 1 14 10193 1 1 34 VAL C C 1.830 1.247 -5.806 1.00 . A A . 34 VAL C 1 1 14 10194 1 1 34 VAL CA C 0.772 2.144 -5.058 1.00 . A A . 34 VAL CA 1 1 14 10195 1 1 34 VAL CB C 1.176 2.394 -3.588 1.00 . A A . 34 VAL CB 1 1 14 10196 1 1 34 VAL CG1 C 1.851 1.228 -2.916 1.00 . A A . 34 VAL CG1 1 1 14 10197 1 1 34 VAL CG2 C 1.879 3.688 -3.439 1.00 . A A . 34 VAL CG2 1 1 14 10198 1 1 34 VAL H H -0.647 0.777 -4.519 1.00 . A A . 34 VAL H 1 1 14 10199 1 1 34 VAL HA H 0.713 3.095 -5.571 1.00 . A A . 34 VAL HA 1 1 14 10200 1 1 34 VAL HB H 0.302 2.431 -2.964 1.00 . A A . 34 VAL HB 1 1 14 10201 1 1 34 VAL HG11 H 2.048 1.469 -1.882 1.00 . A A . 34 VAL HG11 1 1 14 10202 1 1 34 VAL HG12 H 2.788 1.054 -3.421 1.00 . A A . 34 VAL HG12 1 1 14 10203 1 1 34 VAL HG13 H 1.232 0.344 -2.985 1.00 . A A . 34 VAL HG13 1 1 14 10204 1 1 34 VAL HG21 H 2.759 3.682 -4.055 1.00 . A A . 34 VAL HG21 1 1 14 10205 1 1 34 VAL HG22 H 2.116 3.838 -2.398 1.00 . A A . 34 VAL HG22 1 1 14 10206 1 1 34 VAL HG23 H 1.165 4.434 -3.761 1.00 . A A . 34 VAL HG23 1 1 14 10207 1 1 34 VAL N N -0.522 1.550 -5.109 1.00 . A A . 34 VAL N 1 1 14 10208 1 1 34 VAL O O 3.039 1.497 -5.754 1.00 . A A . 34 VAL O 1 1 14 10209 1 1 35 GLY C C 3.140 -1.581 -6.543 1.00 . A A . 35 GLY C 1 1 14 10210 1 1 35 GLY CA C 2.188 -0.649 -7.328 1.00 . A A . 35 GLY CA 1 1 14 10211 1 1 35 GLY H H 0.351 0.230 -6.627 1.00 . A A . 35 GLY H 1 1 14 10212 1 1 35 GLY HA2 H 1.548 -1.275 -7.932 1.00 . A A . 35 GLY HA2 1 1 14 10213 1 1 35 GLY HA3 H 2.776 -0.041 -7.999 1.00 . A A . 35 GLY HA3 1 1 14 10214 1 1 35 GLY N N 1.330 0.261 -6.543 1.00 . A A . 35 GLY N 1 1 14 10215 1 1 35 GLY O O 4.279 -1.796 -6.966 1.00 . A A . 35 GLY O 1 1 14 10216 1 1 36 VAL C C 3.096 -4.498 -5.129 1.00 . A A . 36 VAL C 1 1 14 10217 1 1 36 VAL CA C 3.470 -3.094 -4.691 1.00 . A A . 36 VAL CA 1 1 14 10218 1 1 36 VAL CB C 3.189 -2.953 -3.162 1.00 . A A . 36 VAL CB 1 1 14 10219 1 1 36 VAL CG1 C 3.860 -4.050 -2.332 1.00 . A A . 36 VAL CG1 1 1 14 10220 1 1 36 VAL CG2 C 3.609 -1.592 -2.683 1.00 . A A . 36 VAL CG2 1 1 14 10221 1 1 36 VAL H H 1.807 -1.908 -5.092 1.00 . A A . 36 VAL H 1 1 14 10222 1 1 36 VAL HA H 4.525 -2.933 -4.870 1.00 . A A . 36 VAL HA 1 1 14 10223 1 1 36 VAL HB H 2.122 -3.039 -3.025 1.00 . A A . 36 VAL HB 1 1 14 10224 1 1 36 VAL HG11 H 4.937 -4.061 -2.464 1.00 . A A . 36 VAL HG11 1 1 14 10225 1 1 36 VAL HG12 H 3.475 -4.997 -2.683 1.00 . A A . 36 VAL HG12 1 1 14 10226 1 1 36 VAL HG13 H 3.602 -3.933 -1.290 1.00 . A A . 36 VAL HG13 1 1 14 10227 1 1 36 VAL HG21 H 3.041 -0.840 -3.215 1.00 . A A . 36 VAL HG21 1 1 14 10228 1 1 36 VAL HG22 H 4.659 -1.437 -2.866 1.00 . A A . 36 VAL HG22 1 1 14 10229 1 1 36 VAL HG23 H 3.424 -1.518 -1.623 1.00 . A A . 36 VAL HG23 1 1 14 10230 1 1 36 VAL N N 2.696 -2.133 -5.447 1.00 . A A . 36 VAL N 1 1 14 10231 1 1 36 VAL O O 1.947 -4.742 -5.522 1.00 . A A . 36 VAL O 1 1 14 10232 1 1 37 SER C C 3.594 -7.500 -4.056 1.00 . A A . 37 SER C 1 1 14 10233 1 1 37 SER CA C 3.756 -6.762 -5.386 1.00 . A A . 37 SER CA 1 1 14 10234 1 1 37 SER CB C 4.907 -7.334 -6.200 1.00 . A A . 37 SER CB 1 1 14 10235 1 1 37 SER H H 4.978 -5.317 -4.825 1.00 . A A . 37 SER H 1 1 14 10236 1 1 37 SER HA H 2.844 -6.797 -5.967 1.00 . A A . 37 SER HA 1 1 14 10237 1 1 37 SER HB2 H 4.727 -8.392 -6.328 1.00 . A A . 37 SER HB2 1 1 14 10238 1 1 37 SER HB3 H 4.921 -6.854 -7.165 1.00 . A A . 37 SER HB3 1 1 14 10239 1 1 37 SER HG H 6.855 -7.158 -6.188 1.00 . A A . 37 SER HG 1 1 14 10240 1 1 37 SER N N 4.033 -5.408 -5.087 1.00 . A A . 37 SER N 1 1 14 10241 1 1 37 SER O O 4.247 -7.132 -3.076 1.00 . A A . 37 SER O 1 1 14 10242 1 1 37 SER OG O 6.152 -7.114 -5.532 1.00 . A A . 37 SER OG 1 1 14 10243 1 1 38 PRO C C 3.672 -9.742 -1.976 1.00 . A A . 38 PRO C 1 1 14 10244 1 1 38 PRO CA C 2.426 -9.254 -2.739 1.00 . A A . 38 PRO CA 1 1 14 10245 1 1 38 PRO CB C 1.588 -10.431 -3.210 1.00 . A A . 38 PRO CB 1 1 14 10246 1 1 38 PRO CD C 1.964 -9.066 -5.122 1.00 . A A . 38 PRO CD 1 1 14 10247 1 1 38 PRO CG C 0.951 -9.944 -4.459 1.00 . A A . 38 PRO CG 1 1 14 10248 1 1 38 PRO HA H 1.832 -8.641 -2.077 1.00 . A A . 38 PRO HA 1 1 14 10249 1 1 38 PRO HB2 H 2.228 -11.284 -3.371 1.00 . A A . 38 PRO HB2 1 1 14 10250 1 1 38 PRO HB3 H 0.846 -10.662 -2.459 1.00 . A A . 38 PRO HB3 1 1 14 10251 1 1 38 PRO HD2 H 2.584 -9.643 -5.789 1.00 . A A . 38 PRO HD2 1 1 14 10252 1 1 38 PRO HD3 H 1.476 -8.272 -5.666 1.00 . A A . 38 PRO HD3 1 1 14 10253 1 1 38 PRO HG2 H 0.726 -10.786 -5.094 1.00 . A A . 38 PRO HG2 1 1 14 10254 1 1 38 PRO HG3 H 0.062 -9.381 -4.223 1.00 . A A . 38 PRO HG3 1 1 14 10255 1 1 38 PRO N N 2.731 -8.530 -3.990 1.00 . A A . 38 PRO N 1 1 14 10256 1 1 38 PRO O O 3.682 -9.780 -0.750 1.00 . A A . 38 PRO O 1 1 14 10257 1 1 39 GLU C C 6.756 -9.487 -1.439 1.00 . A A . 39 GLU C 1 1 14 10258 1 1 39 GLU CA C 5.935 -10.580 -2.142 1.00 . A A . 39 GLU CA 1 1 14 10259 1 1 39 GLU CB C 6.748 -11.249 -3.212 1.00 . A A . 39 GLU CB 1 1 14 10260 1 1 39 GLU CD C 7.010 -13.188 -4.778 1.00 . A A . 39 GLU CD 1 1 14 10261 1 1 39 GLU CG C 6.095 -12.480 -3.813 1.00 . A A . 39 GLU CG 1 1 14 10262 1 1 39 GLU H H 4.750 -9.984 -3.685 1.00 . A A . 39 GLU H 1 1 14 10263 1 1 39 GLU HA H 5.679 -11.332 -1.406 1.00 . A A . 39 GLU HA 1 1 14 10264 1 1 39 GLU HB2 H 6.909 -10.545 -4.014 1.00 . A A . 39 GLU HB2 1 1 14 10265 1 1 39 GLU HB3 H 7.694 -11.519 -2.794 1.00 . A A . 39 GLU HB3 1 1 14 10266 1 1 39 GLU HG2 H 5.830 -13.158 -3.013 1.00 . A A . 39 GLU HG2 1 1 14 10267 1 1 39 GLU HG3 H 5.191 -12.189 -4.329 1.00 . A A . 39 GLU HG3 1 1 14 10268 1 1 39 GLU N N 4.722 -10.079 -2.713 1.00 . A A . 39 GLU N 1 1 14 10269 1 1 39 GLU O O 7.526 -9.775 -0.528 1.00 . A A . 39 GLU O 1 1 14 10270 1 1 39 GLU OE1 O 7.096 -12.775 -5.938 1.00 . A A . 39 GLU OE1 1 1 14 10271 1 1 39 GLU OE2 O 7.655 -14.179 -4.384 1.00 . A A . 39 GLU OE2 1 1 14 10272 1 1 40 MET C C 6.806 -6.839 0.107 1.00 . A A . 40 MET C 1 1 14 10273 1 1 40 MET CA C 7.344 -7.144 -1.269 1.00 . A A . 40 MET CA 1 1 14 10274 1 1 40 MET CB C 7.306 -5.874 -2.144 1.00 . A A . 40 MET CB 1 1 14 10275 1 1 40 MET CE C 7.006 -2.866 -3.247 1.00 . A A . 40 MET CE 1 1 14 10276 1 1 40 MET CG C 8.223 -4.766 -1.619 1.00 . A A . 40 MET CG 1 1 14 10277 1 1 40 MET H H 5.933 -8.077 -2.565 1.00 . A A . 40 MET H 1 1 14 10278 1 1 40 MET HA H 8.369 -7.465 -1.151 1.00 . A A . 40 MET HA 1 1 14 10279 1 1 40 MET HB2 H 7.389 -6.033 -3.202 1.00 . A A . 40 MET HB2 1 1 14 10280 1 1 40 MET HB3 H 6.303 -5.496 -2.016 1.00 . A A . 40 MET HB3 1 1 14 10281 1 1 40 MET HE1 H 6.500 -2.525 -2.357 1.00 . A A . 40 MET HE1 1 1 14 10282 1 1 40 MET HE2 H 6.447 -3.677 -3.692 1.00 . A A . 40 MET HE2 1 1 14 10283 1 1 40 MET HE3 H 7.096 -2.053 -3.951 1.00 . A A . 40 MET HE3 1 1 14 10284 1 1 40 MET HG2 H 7.700 -4.316 -0.785 1.00 . A A . 40 MET HG2 1 1 14 10285 1 1 40 MET HG3 H 9.145 -5.212 -1.277 1.00 . A A . 40 MET HG3 1 1 14 10286 1 1 40 MET N N 6.590 -8.247 -1.861 1.00 . A A . 40 MET N 1 1 14 10287 1 1 40 MET O O 7.556 -6.573 1.023 1.00 . A A . 40 MET O 1 1 14 10288 1 1 40 MET SD S 8.607 -3.458 -2.814 1.00 . A A . 40 MET SD 1 1 14 10289 1 1 41 ALA C C 5.308 -7.467 2.671 1.00 . A A . 41 ALA C 1 1 14 10290 1 1 41 ALA CA C 4.795 -6.624 1.478 1.00 . A A . 41 ALA CA 1 1 14 10291 1 1 41 ALA CB C 3.287 -6.819 1.284 1.00 . A A . 41 ALA CB 1 1 14 10292 1 1 41 ALA H H 4.962 -7.165 -0.555 1.00 . A A . 41 ALA H 1 1 14 10293 1 1 41 ALA HA H 4.966 -5.578 1.703 1.00 . A A . 41 ALA HA 1 1 14 10294 1 1 41 ALA HB1 H 3.054 -7.850 1.060 1.00 . A A . 41 ALA HB1 1 1 14 10295 1 1 41 ALA HB2 H 2.955 -6.214 0.453 1.00 . A A . 41 ALA HB2 1 1 14 10296 1 1 41 ALA HB3 H 2.760 -6.517 2.177 1.00 . A A . 41 ALA HB3 1 1 14 10297 1 1 41 ALA N N 5.494 -6.927 0.234 1.00 . A A . 41 ALA N 1 1 14 10298 1 1 41 ALA O O 5.522 -6.938 3.747 1.00 . A A . 41 ALA O 1 1 14 10299 1 1 42 GLU C C 7.507 -9.806 3.633 1.00 . A A . 42 GLU C 1 1 14 10300 1 1 42 GLU CA C 5.987 -9.670 3.528 1.00 . A A . 42 GLU CA 1 1 14 10301 1 1 42 GLU CB C 5.365 -11.052 3.466 1.00 . A A . 42 GLU CB 1 1 14 10302 1 1 42 GLU CD C 3.396 -12.547 3.793 1.00 . A A . 42 GLU CD 1 1 14 10303 1 1 42 GLU CG C 3.861 -11.121 3.741 1.00 . A A . 42 GLU CG 1 1 14 10304 1 1 42 GLU H H 5.292 -9.042 1.547 1.00 . A A . 42 GLU H 1 1 14 10305 1 1 42 GLU HA H 5.666 -9.211 4.455 1.00 . A A . 42 GLU HA 1 1 14 10306 1 1 42 GLU HB2 H 5.569 -11.447 2.482 1.00 . A A . 42 GLU HB2 1 1 14 10307 1 1 42 GLU HB3 H 5.877 -11.675 4.189 1.00 . A A . 42 GLU HB3 1 1 14 10308 1 1 42 GLU HG2 H 3.638 -10.670 4.696 1.00 . A A . 42 GLU HG2 1 1 14 10309 1 1 42 GLU HG3 H 3.296 -10.612 2.977 1.00 . A A . 42 GLU HG3 1 1 14 10310 1 1 42 GLU N N 5.514 -8.764 2.457 1.00 . A A . 42 GLU N 1 1 14 10311 1 1 42 GLU O O 8.004 -10.401 4.596 1.00 . A A . 42 GLU O 1 1 14 10312 1 1 42 GLU OE1 O 3.549 -13.200 4.856 1.00 . A A . 42 GLU OE1 1 1 14 10313 1 1 42 GLU OE2 O 2.922 -13.063 2.778 1.00 . A A . 42 GLU OE2 1 1 14 10314 1 1 43 ASN C C 10.482 -8.217 2.816 1.00 . A A . 43 ASN C 1 1 14 10315 1 1 43 ASN CA C 9.689 -9.509 2.667 1.00 . A A . 43 ASN CA 1 1 14 10316 1 1 43 ASN CB C 10.179 -10.262 1.436 1.00 . A A . 43 ASN CB 1 1 14 10317 1 1 43 ASN CG C 9.781 -11.733 1.413 1.00 . A A . 43 ASN CG 1 1 14 10318 1 1 43 ASN H H 7.848 -8.850 1.898 1.00 . A A . 43 ASN H 1 1 14 10319 1 1 43 ASN HA H 9.910 -10.123 3.528 1.00 . A A . 43 ASN HA 1 1 14 10320 1 1 43 ASN HB2 H 9.785 -9.761 0.567 1.00 . A A . 43 ASN HB2 1 1 14 10321 1 1 43 ASN HB3 H 11.251 -10.172 1.425 1.00 . A A . 43 ASN HB3 1 1 14 10322 1 1 43 ASN HD21 H 9.784 -11.728 -0.548 1.00 . A A . 43 ASN HD21 1 1 14 10323 1 1 43 ASN HD22 H 9.380 -13.227 0.230 1.00 . A A . 43 ASN HD22 1 1 14 10324 1 1 43 ASN N N 8.245 -9.332 2.648 1.00 . A A . 43 ASN N 1 1 14 10325 1 1 43 ASN ND2 N 9.633 -12.281 0.245 1.00 . A A . 43 ASN ND2 1 1 14 10326 1 1 43 ASN O O 11.601 -8.237 3.334 1.00 . A A . 43 ASN O 1 1 14 10327 1 1 43 ASN OD1 O 9.638 -12.374 2.441 1.00 . A A . 43 ASN OD1 1 1 14 10328 1 1 44 GLU C C 9.867 -4.783 3.084 1.00 . A A . 44 GLU C 1 1 14 10329 1 1 44 GLU CA C 10.678 -5.869 2.404 1.00 . A A . 44 GLU CA 1 1 14 10330 1 1 44 GLU CB C 11.046 -5.451 0.976 1.00 . A A . 44 GLU CB 1 1 14 10331 1 1 44 GLU CD C 12.148 -6.096 -1.218 1.00 . A A . 44 GLU CD 1 1 14 10332 1 1 44 GLU CG C 11.939 -6.447 0.238 1.00 . A A . 44 GLU CG 1 1 14 10333 1 1 44 GLU H H 9.006 -7.069 2.071 1.00 . A A . 44 GLU H 1 1 14 10334 1 1 44 GLU HA H 11.587 -6.020 2.967 1.00 . A A . 44 GLU HA 1 1 14 10335 1 1 44 GLU HB2 H 10.130 -5.327 0.427 1.00 . A A . 44 GLU HB2 1 1 14 10336 1 1 44 GLU HB3 H 11.556 -4.501 1.011 1.00 . A A . 44 GLU HB3 1 1 14 10337 1 1 44 GLU HG2 H 12.901 -6.484 0.733 1.00 . A A . 44 GLU HG2 1 1 14 10338 1 1 44 GLU HG3 H 11.490 -7.428 0.299 1.00 . A A . 44 GLU HG3 1 1 14 10339 1 1 44 GLU N N 9.938 -7.113 2.387 1.00 . A A . 44 GLU N 1 1 14 10340 1 1 44 GLU O O 8.638 -4.812 3.079 1.00 . A A . 44 GLU O 1 1 14 10341 1 1 44 GLU OE1 O 13.053 -5.281 -1.526 1.00 . A A . 44 GLU OE1 1 1 14 10342 1 1 44 GLU OE2 O 11.406 -6.639 -2.061 1.00 . A A . 44 GLU OE2 1 1 14 10343 1 1 45 ASP C C 9.447 -1.698 3.377 1.00 . A A . 45 ASP C 1 1 14 10344 1 1 45 ASP CA C 9.921 -2.752 4.383 1.00 . A A . 45 ASP CA 1 1 14 10345 1 1 45 ASP CB C 10.916 -2.120 5.378 1.00 . A A . 45 ASP CB 1 1 14 10346 1 1 45 ASP CG C 11.469 -3.122 6.387 1.00 . A A . 45 ASP CG 1 1 14 10347 1 1 45 ASP H H 11.531 -3.890 3.652 1.00 . A A . 45 ASP H 1 1 14 10348 1 1 45 ASP HA H 9.074 -3.145 4.929 1.00 . A A . 45 ASP HA 1 1 14 10349 1 1 45 ASP HB2 H 11.748 -1.708 4.824 1.00 . A A . 45 ASP HB2 1 1 14 10350 1 1 45 ASP HB3 H 10.417 -1.327 5.912 1.00 . A A . 45 ASP HB3 1 1 14 10351 1 1 45 ASP N N 10.554 -3.853 3.676 1.00 . A A . 45 ASP N 1 1 14 10352 1 1 45 ASP O O 10.261 -1.103 2.660 1.00 . A A . 45 ASP O 1 1 14 10353 1 1 45 ASP OD1 O 12.490 -3.794 6.080 1.00 . A A . 45 ASP OD1 1 1 14 10354 1 1 45 ASP OD2 O 10.902 -3.252 7.482 1.00 . A A . 45 ASP OD2 1 1 14 10355 1 1 46 TYR C C 7.870 0.946 2.700 1.00 . A A . 46 TYR C 1 1 14 10356 1 1 46 TYR CA C 7.542 -0.539 2.381 1.00 . A A . 46 TYR CA 1 1 14 10357 1 1 46 TYR CB C 6.004 -0.750 2.217 1.00 . A A . 46 TYR CB 1 1 14 10358 1 1 46 TYR CD1 C 5.415 0.237 -0.050 1.00 . A A . 46 TYR CD1 1 1 14 10359 1 1 46 TYR CD2 C 4.679 1.378 1.901 1.00 . A A . 46 TYR CD2 1 1 14 10360 1 1 46 TYR CE1 C 4.826 1.234 -0.828 1.00 . A A . 46 TYR CE1 1 1 14 10361 1 1 46 TYR CE2 C 4.115 2.356 1.122 1.00 . A A . 46 TYR CE2 1 1 14 10362 1 1 46 TYR CG C 5.345 0.295 1.333 1.00 . A A . 46 TYR CG 1 1 14 10363 1 1 46 TYR CZ C 4.184 2.272 -0.224 1.00 . A A . 46 TYR CZ 1 1 14 10364 1 1 46 TYR H H 7.561 -2.054 3.863 1.00 . A A . 46 TYR H 1 1 14 10365 1 1 46 TYR HA H 7.993 -0.740 1.413 1.00 . A A . 46 TYR HA 1 1 14 10366 1 1 46 TYR HB2 H 5.812 -1.708 1.759 1.00 . A A . 46 TYR HB2 1 1 14 10367 1 1 46 TYR HB3 H 5.527 -0.714 3.187 1.00 . A A . 46 TYR HB3 1 1 14 10368 1 1 46 TYR HD1 H 5.917 -0.588 -0.528 1.00 . A A . 46 TYR HD1 1 1 14 10369 1 1 46 TYR HD2 H 4.605 1.444 2.976 1.00 . A A . 46 TYR HD2 1 1 14 10370 1 1 46 TYR HE1 H 4.829 1.218 -1.908 1.00 . A A . 46 TYR HE1 1 1 14 10371 1 1 46 TYR HE2 H 3.596 3.197 1.563 1.00 . A A . 46 TYR HE2 1 1 14 10372 1 1 46 TYR HH H 3.200 2.822 -1.704 1.00 . A A . 46 TYR HH 1 1 14 10373 1 1 46 TYR N N 8.139 -1.500 3.302 1.00 . A A . 46 TYR N 1 1 14 10374 1 1 46 TYR O O 7.482 1.513 3.732 1.00 . A A . 46 TYR O 1 1 14 10375 1 1 46 TYR OH O 3.647 3.263 -0.976 1.00 . A A . 46 TYR OH 1 1 14 10376 1 1 47 ILE C C 7.966 3.575 0.730 1.00 . A A . 47 ILE C 1 1 14 10377 1 1 47 ILE CA C 8.875 2.941 1.785 1.00 . A A . 47 ILE CA 1 1 14 10378 1 1 47 ILE CB C 10.364 3.214 1.416 1.00 . A A . 47 ILE CB 1 1 14 10379 1 1 47 ILE CD1 C 11.134 2.904 3.846 1.00 . A A . 47 ILE CD1 1 1 14 10380 1 1 47 ILE CG1 C 11.310 2.493 2.398 1.00 . A A . 47 ILE CG1 1 1 14 10381 1 1 47 ILE CG2 C 10.656 4.714 1.382 1.00 . A A . 47 ILE CG2 1 1 14 10382 1 1 47 ILE H H 8.891 0.913 1.093 1.00 . A A . 47 ILE H 1 1 14 10383 1 1 47 ILE HA H 8.650 3.349 2.759 1.00 . A A . 47 ILE HA 1 1 14 10384 1 1 47 ILE HB H 10.538 2.816 0.423 1.00 . A A . 47 ILE HB 1 1 14 10385 1 1 47 ILE HD11 H 11.307 3.965 3.947 1.00 . A A . 47 ILE HD11 1 1 14 10386 1 1 47 ILE HD12 H 11.839 2.355 4.455 1.00 . A A . 47 ILE HD12 1 1 14 10387 1 1 47 ILE HD13 H 10.122 2.679 4.150 1.00 . A A . 47 ILE HD13 1 1 14 10388 1 1 47 ILE HG12 H 11.137 1.430 2.342 1.00 . A A . 47 ILE HG12 1 1 14 10389 1 1 47 ILE HG13 H 12.332 2.686 2.116 1.00 . A A . 47 ILE HG13 1 1 14 10390 1 1 47 ILE HG21 H 10.397 5.112 2.357 1.00 . A A . 47 ILE HG21 1 1 14 10391 1 1 47 ILE HG22 H 10.043 5.186 0.622 1.00 . A A . 47 ILE HG22 1 1 14 10392 1 1 47 ILE HG23 H 11.699 4.901 1.174 1.00 . A A . 47 ILE HG23 1 1 14 10393 1 1 47 ILE N N 8.586 1.536 1.783 1.00 . A A . 47 ILE N 1 1 14 10394 1 1 47 ILE O O 7.736 2.959 -0.308 1.00 . A A . 47 ILE O 1 1 14 10395 1 1 48 CYS C C 7.198 6.502 -0.699 1.00 . A A . 48 CYS C 1 1 14 10396 1 1 48 CYS CA C 6.508 5.357 0.026 1.00 . A A . 48 CYS CA 1 1 14 10397 1 1 48 CYS CB C 5.271 5.923 0.736 1.00 . A A . 48 CYS CB 1 1 14 10398 1 1 48 CYS H H 7.629 5.342 1.742 1.00 . A A . 48 CYS H 1 1 14 10399 1 1 48 CYS HA H 6.205 4.607 -0.685 1.00 . A A . 48 CYS HA 1 1 14 10400 1 1 48 CYS HB2 H 4.473 6.026 0.013 1.00 . A A . 48 CYS HB2 1 1 14 10401 1 1 48 CYS HB3 H 4.961 5.224 1.496 1.00 . A A . 48 CYS HB3 1 1 14 10402 1 1 48 CYS N N 7.429 4.767 0.980 1.00 . A A . 48 CYS N 1 1 14 10403 1 1 48 CYS O O 8.343 6.830 -0.399 1.00 . A A . 48 CYS O 1 1 14 10404 1 1 48 CYS SG S 5.536 7.556 1.517 1.00 . A A . 48 CYS SG 1 1 14 10405 1 1 49 ILE C C 7.391 9.437 -1.441 1.00 . A A . 49 ILE C 1 1 14 10406 1 1 49 ILE CA C 6.941 8.275 -2.366 1.00 . A A . 49 ILE CA 1 1 14 10407 1 1 49 ILE CB C 5.860 8.746 -3.372 1.00 . A A . 49 ILE CB 1 1 14 10408 1 1 49 ILE CD1 C 5.414 10.367 -5.243 1.00 . A A . 49 ILE CD1 1 1 14 10409 1 1 49 ILE CG1 C 6.341 9.958 -4.138 1.00 . A A . 49 ILE CG1 1 1 14 10410 1 1 49 ILE CG2 C 4.529 9.022 -2.687 1.00 . A A . 49 ILE CG2 1 1 14 10411 1 1 49 ILE H H 5.588 6.753 -1.800 1.00 . A A . 49 ILE H 1 1 14 10412 1 1 49 ILE HA H 7.807 7.973 -2.941 1.00 . A A . 49 ILE HA 1 1 14 10413 1 1 49 ILE HB H 5.701 7.941 -4.072 1.00 . A A . 49 ILE HB 1 1 14 10414 1 1 49 ILE HD11 H 5.828 11.208 -5.777 1.00 . A A . 49 ILE HD11 1 1 14 10415 1 1 49 ILE HD12 H 4.450 10.608 -4.828 1.00 . A A . 49 ILE HD12 1 1 14 10416 1 1 49 ILE HD13 H 5.313 9.517 -5.903 1.00 . A A . 49 ILE HD13 1 1 14 10417 1 1 49 ILE HG12 H 6.434 10.766 -3.431 1.00 . A A . 49 ILE HG12 1 1 14 10418 1 1 49 ILE HG13 H 7.308 9.732 -4.559 1.00 . A A . 49 ILE HG13 1 1 14 10419 1 1 49 ILE HG21 H 3.817 9.367 -3.422 1.00 . A A . 49 ILE HG21 1 1 14 10420 1 1 49 ILE HG22 H 4.686 9.778 -1.935 1.00 . A A . 49 ILE HG22 1 1 14 10421 1 1 49 ILE HG23 H 4.180 8.110 -2.228 1.00 . A A . 49 ILE HG23 1 1 14 10422 1 1 49 ILE N N 6.474 7.123 -1.615 1.00 . A A . 49 ILE N 1 1 14 10423 1 1 49 ILE O O 8.445 10.018 -1.650 1.00 . A A . 49 ILE O 1 1 14 10424 1 1 50 ASN C C 8.032 10.433 1.494 1.00 . A A . 50 ASN C 1 1 14 10425 1 1 50 ASN CA C 6.901 10.813 0.545 1.00 . A A . 50 ASN CA 1 1 14 10426 1 1 50 ASN CB C 5.651 11.213 1.360 1.00 . A A . 50 ASN CB 1 1 14 10427 1 1 50 ASN CG C 4.527 11.765 0.498 1.00 . A A . 50 ASN CG 1 1 14 10428 1 1 50 ASN H H 5.823 9.142 -0.250 1.00 . A A . 50 ASN H 1 1 14 10429 1 1 50 ASN HA H 7.224 11.657 -0.046 1.00 . A A . 50 ASN HA 1 1 14 10430 1 1 50 ASN HB2 H 5.277 10.350 1.885 1.00 . A A . 50 ASN HB2 1 1 14 10431 1 1 50 ASN HB3 H 5.940 11.970 2.071 1.00 . A A . 50 ASN HB3 1 1 14 10432 1 1 50 ASN HD21 H 5.173 13.626 0.778 1.00 . A A . 50 ASN HD21 1 1 14 10433 1 1 50 ASN HD22 H 3.765 13.454 -0.198 1.00 . A A . 50 ASN HD22 1 1 14 10434 1 1 50 ASN N N 6.608 9.711 -0.396 1.00 . A A . 50 ASN N 1 1 14 10435 1 1 50 ASN ND2 N 4.489 13.078 0.342 1.00 . A A . 50 ASN ND2 1 1 14 10436 1 1 50 ASN O O 8.762 11.282 1.975 1.00 . A A . 50 ASN O 1 1 14 10437 1 1 50 ASN OD1 O 3.690 11.020 -0.001 1.00 . A A . 50 ASN OD1 1 1 14 10438 1 1 51 CYS C C 10.569 8.609 1.819 1.00 . A A . 51 CYS C 1 1 14 10439 1 1 51 CYS CA C 9.260 8.633 2.594 1.00 . A A . 51 CYS CA 1 1 14 10440 1 1 51 CYS CB C 8.981 7.223 3.140 1.00 . A A . 51 CYS CB 1 1 14 10441 1 1 51 CYS H H 7.510 8.533 1.346 1.00 . A A . 51 CYS H 1 1 14 10442 1 1 51 CYS HA H 9.353 9.316 3.426 1.00 . A A . 51 CYS HA 1 1 14 10443 1 1 51 CYS HB2 H 8.643 6.597 2.328 1.00 . A A . 51 CYS HB2 1 1 14 10444 1 1 51 CYS HB3 H 9.923 6.831 3.501 1.00 . A A . 51 CYS HB3 1 1 14 10445 1 1 51 CYS N N 8.167 9.134 1.758 1.00 . A A . 51 CYS N 1 1 14 10446 1 1 51 CYS O O 11.641 8.685 2.382 1.00 . A A . 51 CYS O 1 1 14 10447 1 1 51 CYS SG S 7.773 7.085 4.488 1.00 . A A . 51 CYS SG 1 1 14 10448 1 1 52 ALA C C 12.223 9.791 -0.656 1.00 . A A . 52 ALA C 1 1 14 10449 1 1 52 ALA CA C 11.650 8.408 -0.309 1.00 . A A . 52 ALA CA 1 1 14 10450 1 1 52 ALA CB C 11.316 7.624 -1.567 1.00 . A A . 52 ALA CB 1 1 14 10451 1 1 52 ALA H H 9.565 8.537 0.151 1.00 . A A . 52 ALA H 1 1 14 10452 1 1 52 ALA HA H 12.386 7.844 0.254 1.00 . A A . 52 ALA HA 1 1 14 10453 1 1 52 ALA HB1 H 10.566 8.156 -2.137 1.00 . A A . 52 ALA HB1 1 1 14 10454 1 1 52 ALA HB2 H 10.923 6.660 -1.268 1.00 . A A . 52 ALA HB2 1 1 14 10455 1 1 52 ALA HB3 H 12.221 7.480 -2.139 1.00 . A A . 52 ALA HB3 1 1 14 10456 1 1 52 ALA N N 10.467 8.510 0.534 1.00 . A A . 52 ALA N 1 1 14 10457 2 2 1 ZN ZN ZN 5.639 7.437 3.793 1.00 . B A . 53 ZN ZN 1 1 14 10458 3 2 1 ZN ZN ZN -5.220 2.912 -1.944 1.00 . C A . 54 ZN ZN 1 1 15 10459 1 1 1 SER C C -11.372 5.386 1.269 1.00 . A A . 1 SER C 1 1 15 10460 1 1 1 SER CA C -12.406 5.316 2.422 1.00 . A A . 1 SER CA 1 1 15 10461 1 1 1 SER CB C -13.736 5.958 2.001 1.00 . A A . 1 SER CB 1 1 15 10462 1 1 1 SER HA H -12.570 4.283 2.692 1.00 . A A . 1 SER HA 1 1 15 10463 1 1 1 SER HB2 H -13.568 6.995 1.735 1.00 . A A . 1 SER HB2 1 1 15 10464 1 1 1 SER HB3 H -14.134 5.425 1.148 1.00 . A A . 1 SER HB3 1 1 15 10465 1 1 1 SER HG H -14.238 6.168 3.879 1.00 . A A . 1 SER HG 1 1 15 10466 1 1 1 SER N N -11.891 6.028 3.624 1.00 . A A . 1 SER N 1 1 15 10467 1 1 1 SER O O -11.459 4.647 0.264 1.00 . A A . 1 SER O 1 1 15 10468 1 1 1 SER OG O -14.684 5.900 3.070 1.00 . A A . 1 SER OG 1 1 15 10469 1 1 2 VAL C C -8.053 6.431 1.223 1.00 . A A . 2 VAL C 1 1 15 10470 1 1 2 VAL CA C -9.359 6.483 0.453 1.00 . A A . 2 VAL CA 1 1 15 10471 1 1 2 VAL CB C -9.507 7.872 -0.245 1.00 . A A . 2 VAL CB 1 1 15 10472 1 1 2 VAL CG1 C -8.451 8.056 -1.322 1.00 . A A . 2 VAL CG1 1 1 15 10473 1 1 2 VAL CG2 C -10.899 8.051 -0.839 1.00 . A A . 2 VAL CG2 1 1 15 10474 1 1 2 VAL H H -10.393 6.806 2.250 1.00 . A A . 2 VAL H 1 1 15 10475 1 1 2 VAL HA H -9.380 5.688 -0.279 1.00 . A A . 2 VAL HA 1 1 15 10476 1 1 2 VAL HB H -9.354 8.637 0.508 1.00 . A A . 2 VAL HB 1 1 15 10477 1 1 2 VAL HG11 H -8.585 9.019 -1.791 1.00 . A A . 2 VAL HG11 1 1 15 10478 1 1 2 VAL HG12 H -8.596 7.287 -2.066 1.00 . A A . 2 VAL HG12 1 1 15 10479 1 1 2 VAL HG13 H -7.464 7.982 -0.888 1.00 . A A . 2 VAL HG13 1 1 15 10480 1 1 2 VAL HG21 H -11.629 7.956 -0.048 1.00 . A A . 2 VAL HG21 1 1 15 10481 1 1 2 VAL HG22 H -11.075 7.296 -1.590 1.00 . A A . 2 VAL HG22 1 1 15 10482 1 1 2 VAL HG23 H -10.968 9.026 -1.300 1.00 . A A . 2 VAL HG23 1 1 15 10483 1 1 2 VAL N N -10.413 6.275 1.425 1.00 . A A . 2 VAL N 1 1 15 10484 1 1 2 VAL O O -7.980 6.961 2.336 1.00 . A A . 2 VAL O 1 1 15 10485 1 1 3 CYS C C -4.789 6.650 0.922 1.00 . A A . 3 CYS C 1 1 15 10486 1 1 3 CYS CA C -5.817 5.636 1.428 1.00 . A A . 3 CYS CA 1 1 15 10487 1 1 3 CYS CB C -5.263 4.192 1.330 1.00 . A A . 3 CYS CB 1 1 15 10488 1 1 3 CYS H H -7.089 5.391 -0.218 1.00 . A A . 3 CYS H 1 1 15 10489 1 1 3 CYS HA H -6.042 5.858 2.460 1.00 . A A . 3 CYS HA 1 1 15 10490 1 1 3 CYS HB2 H -4.750 3.936 2.245 1.00 . A A . 3 CYS HB2 1 1 15 10491 1 1 3 CYS HB3 H -6.096 3.521 1.182 1.00 . A A . 3 CYS HB3 1 1 15 10492 1 1 3 CYS N N -7.047 5.774 0.683 1.00 . A A . 3 CYS N 1 1 15 10493 1 1 3 CYS O O -5.109 7.507 0.090 1.00 . A A . 3 CYS O 1 1 15 10494 1 1 3 CYS SG S -4.059 3.875 0.021 1.00 . A A . 3 CYS SG 1 1 15 10495 1 1 4 ALA C C -1.871 6.783 -0.212 1.00 . A A . 4 ALA C 1 1 15 10496 1 1 4 ALA CA C -2.530 7.400 0.995 1.00 . A A . 4 ALA CA 1 1 15 10497 1 1 4 ALA CB C -1.503 7.551 2.118 1.00 . A A . 4 ALA CB 1 1 15 10498 1 1 4 ALA H H -3.433 5.758 1.978 1.00 . A A . 4 ALA H 1 1 15 10499 1 1 4 ALA HA H -2.942 8.372 0.757 1.00 . A A . 4 ALA HA 1 1 15 10500 1 1 4 ALA HB1 H -1.124 6.581 2.410 1.00 . A A . 4 ALA HB1 1 1 15 10501 1 1 4 ALA HB2 H -1.961 8.019 2.974 1.00 . A A . 4 ALA HB2 1 1 15 10502 1 1 4 ALA HB3 H -0.675 8.165 1.791 1.00 . A A . 4 ALA HB3 1 1 15 10503 1 1 4 ALA N N -3.585 6.536 1.400 1.00 . A A . 4 ALA N 1 1 15 10504 1 1 4 ALA O O -1.500 5.645 -0.166 1.00 . A A . 4 ALA O 1 1 15 10505 1 1 5 ALA C C -1.163 8.215 -3.506 1.00 . A A . 5 ALA C 1 1 15 10506 1 1 5 ALA CA C -1.104 7.105 -2.514 1.00 . A A . 5 ALA CA 1 1 15 10507 1 1 5 ALA CB C -1.676 5.815 -3.153 1.00 . A A . 5 ALA CB 1 1 15 10508 1 1 5 ALA H H -2.394 8.313 -1.363 1.00 . A A . 5 ALA H 1 1 15 10509 1 1 5 ALA HA H -0.075 6.932 -2.234 1.00 . A A . 5 ALA HA 1 1 15 10510 1 1 5 ALA HB1 H -2.687 5.977 -3.496 1.00 . A A . 5 ALA HB1 1 1 15 10511 1 1 5 ALA HB2 H -1.689 5.022 -2.423 1.00 . A A . 5 ALA HB2 1 1 15 10512 1 1 5 ALA HB3 H -1.063 5.498 -3.986 1.00 . A A . 5 ALA HB3 1 1 15 10513 1 1 5 ALA N N -1.843 7.506 -1.313 1.00 . A A . 5 ALA N 1 1 15 10514 1 1 5 ALA O O -2.152 8.946 -3.537 1.00 . A A . 5 ALA O 1 1 15 10515 1 1 6 GLN C C -1.280 9.204 -6.282 1.00 . A A . 6 GLN C 1 1 15 10516 1 1 6 GLN CA C -0.024 9.371 -5.401 1.00 . A A . 6 GLN CA 1 1 15 10517 1 1 6 GLN CB C 1.248 9.066 -6.236 1.00 . A A . 6 GLN CB 1 1 15 10518 1 1 6 GLN CD C 2.705 9.565 -8.253 1.00 . A A . 6 GLN CD 1 1 15 10519 1 1 6 GLN CG C 1.548 10.027 -7.388 1.00 . A A . 6 GLN CG 1 1 15 10520 1 1 6 GLN H H 0.791 8.017 -4.039 1.00 . A A . 6 GLN H 1 1 15 10521 1 1 6 GLN HA H 0.039 10.368 -5.002 1.00 . A A . 6 GLN HA 1 1 15 10522 1 1 6 GLN HB2 H 2.089 9.067 -5.561 1.00 . A A . 6 GLN HB2 1 1 15 10523 1 1 6 GLN HB3 H 1.162 8.069 -6.641 1.00 . A A . 6 GLN HB3 1 1 15 10524 1 1 6 GLN HE21 H 3.993 10.586 -7.176 1.00 . A A . 6 GLN HE21 1 1 15 10525 1 1 6 GLN HE22 H 4.645 9.701 -8.508 1.00 . A A . 6 GLN HE22 1 1 15 10526 1 1 6 GLN HG2 H 0.690 10.125 -8.024 1.00 . A A . 6 GLN HG2 1 1 15 10527 1 1 6 GLN HG3 H 1.795 10.996 -6.983 1.00 . A A . 6 GLN HG3 1 1 15 10528 1 1 6 GLN N N -0.074 8.396 -4.277 1.00 . A A . 6 GLN N 1 1 15 10529 1 1 6 GLN NE2 N 3.892 9.991 -7.947 1.00 . A A . 6 GLN NE2 1 1 15 10530 1 1 6 GLN O O -1.886 10.180 -6.712 1.00 . A A . 6 GLN O 1 1 15 10531 1 1 6 GLN OE1 O 2.517 8.832 -9.219 1.00 . A A . 6 GLN OE1 1 1 15 10532 1 1 7 ASN C C -3.540 6.504 -6.505 1.00 . A A . 7 ASN C 1 1 15 10533 1 1 7 ASN CA C -2.836 7.646 -7.220 1.00 . A A . 7 ASN CA 1 1 15 10534 1 1 7 ASN CB C -2.539 7.298 -8.684 1.00 . A A . 7 ASN CB 1 1 15 10535 1 1 7 ASN CG C -3.805 6.991 -9.501 1.00 . A A . 7 ASN CG 1 1 15 10536 1 1 7 ASN H H -0.961 7.359 -6.158 1.00 . A A . 7 ASN H 1 1 15 10537 1 1 7 ASN HA H -3.469 8.522 -7.179 1.00 . A A . 7 ASN HA 1 1 15 10538 1 1 7 ASN HB2 H -2.021 8.128 -9.137 1.00 . A A . 7 ASN HB2 1 1 15 10539 1 1 7 ASN HB3 H -1.899 6.428 -8.699 1.00 . A A . 7 ASN HB3 1 1 15 10540 1 1 7 ASN HD21 H -2.771 5.809 -10.699 1.00 . A A . 7 ASN HD21 1 1 15 10541 1 1 7 ASN HD22 H -4.456 5.986 -11.053 1.00 . A A . 7 ASN HD22 1 1 15 10542 1 1 7 ASN N N -1.631 7.977 -6.515 1.00 . A A . 7 ASN N 1 1 15 10543 1 1 7 ASN ND2 N -3.663 6.178 -10.515 1.00 . A A . 7 ASN ND2 1 1 15 10544 1 1 7 ASN O O -3.181 5.352 -6.653 1.00 . A A . 7 ASN O 1 1 15 10545 1 1 7 ASN OD1 O -4.887 7.501 -9.225 1.00 . A A . 7 ASN OD1 1 1 15 10546 1 1 8 CYS C C -6.465 5.391 -5.761 1.00 . A A . 8 CYS C 1 1 15 10547 1 1 8 CYS CA C -5.215 5.807 -4.989 1.00 . A A . 8 CYS CA 1 1 15 10548 1 1 8 CYS CB C -5.541 6.200 -3.529 1.00 . A A . 8 CYS CB 1 1 15 10549 1 1 8 CYS H H -4.836 7.751 -5.600 1.00 . A A . 8 CYS H 1 1 15 10550 1 1 8 CYS HA H -4.533 4.972 -4.976 1.00 . A A . 8 CYS HA 1 1 15 10551 1 1 8 CYS HB2 H -4.623 6.387 -2.991 1.00 . A A . 8 CYS HB2 1 1 15 10552 1 1 8 CYS HB3 H -6.151 7.093 -3.529 1.00 . A A . 8 CYS HB3 1 1 15 10553 1 1 8 CYS N N -4.519 6.828 -5.693 1.00 . A A . 8 CYS N 1 1 15 10554 1 1 8 CYS O O -6.996 6.145 -6.588 1.00 . A A . 8 CYS O 1 1 15 10555 1 1 8 CYS SG S -6.431 4.908 -2.580 1.00 . A A . 8 CYS SG 1 1 15 10556 1 1 9 GLN C C -9.093 3.305 -5.091 1.00 . A A . 9 GLN C 1 1 15 10557 1 1 9 GLN CA C -8.037 3.604 -6.135 1.00 . A A . 9 GLN CA 1 1 15 10558 1 1 9 GLN CB C -7.600 2.300 -6.816 1.00 . A A . 9 GLN CB 1 1 15 10559 1 1 9 GLN CD C -6.073 1.193 -8.512 1.00 . A A . 9 GLN CD 1 1 15 10560 1 1 9 GLN CG C -6.501 2.489 -7.857 1.00 . A A . 9 GLN CG 1 1 15 10561 1 1 9 GLN H H -6.422 3.762 -4.771 1.00 . A A . 9 GLN H 1 1 15 10562 1 1 9 GLN HA H -8.435 4.275 -6.882 1.00 . A A . 9 GLN HA 1 1 15 10563 1 1 9 GLN HB2 H -7.246 1.610 -6.063 1.00 . A A . 9 GLN HB2 1 1 15 10564 1 1 9 GLN HB3 H -8.460 1.871 -7.303 1.00 . A A . 9 GLN HB3 1 1 15 10565 1 1 9 GLN HE21 H -4.240 1.896 -8.780 1.00 . A A . 9 GLN HE21 1 1 15 10566 1 1 9 GLN HE22 H -4.541 0.305 -9.357 1.00 . A A . 9 GLN HE22 1 1 15 10567 1 1 9 GLN HG2 H -6.830 3.169 -8.630 1.00 . A A . 9 GLN HG2 1 1 15 10568 1 1 9 GLN HG3 H -5.638 2.910 -7.361 1.00 . A A . 9 GLN HG3 1 1 15 10569 1 1 9 GLN N N -6.908 4.202 -5.490 1.00 . A A . 9 GLN N 1 1 15 10570 1 1 9 GLN NE2 N -4.830 1.127 -8.915 1.00 . A A . 9 GLN NE2 1 1 15 10571 1 1 9 GLN O O -8.841 3.423 -3.887 1.00 . A A . 9 GLN O 1 1 15 10572 1 1 9 GLN OE1 O -6.850 0.259 -8.648 1.00 . A A . 9 GLN OE1 1 1 15 10573 1 1 10 ARG C C -11.747 1.038 -4.767 1.00 . A A . 10 ARG C 1 1 15 10574 1 1 10 ARG CA C -11.377 2.550 -4.660 1.00 . A A . 10 ARG CA 1 1 15 10575 1 1 10 ARG CB C -12.572 3.422 -5.079 1.00 . A A . 10 ARG CB 1 1 15 10576 1 1 10 ARG CD C -12.677 5.274 -3.364 1.00 . A A . 10 ARG CD 1 1 15 10577 1 1 10 ARG CG C -12.383 4.920 -4.815 1.00 . A A . 10 ARG CG 1 1 15 10578 1 1 10 ARG CZ C -14.677 4.574 -1.985 1.00 . A A . 10 ARG CZ 1 1 15 10579 1 1 10 ARG H H -10.379 2.782 -6.498 1.00 . A A . 10 ARG H 1 1 15 10580 1 1 10 ARG HA H -11.111 2.798 -3.642 1.00 . A A . 10 ARG HA 1 1 15 10581 1 1 10 ARG HB2 H -12.745 3.292 -6.136 1.00 . A A . 10 ARG HB2 1 1 15 10582 1 1 10 ARG HB3 H -13.450 3.094 -4.541 1.00 . A A . 10 ARG HB3 1 1 15 10583 1 1 10 ARG HD2 H -12.049 4.717 -2.687 1.00 . A A . 10 ARG HD2 1 1 15 10584 1 1 10 ARG HD3 H -12.486 6.327 -3.228 1.00 . A A . 10 ARG HD3 1 1 15 10585 1 1 10 ARG HE H -14.696 5.334 -3.846 1.00 . A A . 10 ARG HE 1 1 15 10586 1 1 10 ARG HG2 H -11.372 5.207 -5.060 1.00 . A A . 10 ARG HG2 1 1 15 10587 1 1 10 ARG HG3 H -13.059 5.469 -5.454 1.00 . A A . 10 ARG HG3 1 1 15 10588 1 1 10 ARG HH11 H -12.929 4.266 -0.950 1.00 . A A . 10 ARG HH11 1 1 15 10589 1 1 10 ARG HH12 H -14.375 3.831 -0.124 1.00 . A A . 10 ARG HH12 1 1 15 10590 1 1 10 ARG HH21 H -16.586 4.721 -2.685 1.00 . A A . 10 ARG HH21 1 1 15 10591 1 1 10 ARG HH22 H -16.452 4.087 -1.105 1.00 . A A . 10 ARG HH22 1 1 15 10592 1 1 10 ARG N N -10.245 2.880 -5.535 1.00 . A A . 10 ARG N 1 1 15 10593 1 1 10 ARG NE N -14.114 5.060 -3.098 1.00 . A A . 10 ARG NE 1 1 15 10594 1 1 10 ARG NH1 N -13.934 4.193 -0.949 1.00 . A A . 10 ARG NH1 1 1 15 10595 1 1 10 ARG NH2 N -15.994 4.448 -1.921 1.00 . A A . 10 ARG NH2 1 1 15 10596 1 1 10 ARG O O -12.839 0.690 -5.219 1.00 . A A . 10 ARG O 1 1 15 10597 1 1 11 PRO C C -11.688 -1.845 -3.135 1.00 . A A . 11 PRO C 1 1 15 10598 1 1 11 PRO CA C -11.052 -1.320 -4.429 1.00 . A A . 11 PRO CA 1 1 15 10599 1 1 11 PRO CB C -9.616 -1.890 -4.550 1.00 . A A . 11 PRO CB 1 1 15 10600 1 1 11 PRO CD C -9.489 0.383 -3.915 1.00 . A A . 11 PRO CD 1 1 15 10601 1 1 11 PRO CG C -8.724 -0.700 -4.595 1.00 . A A . 11 PRO CG 1 1 15 10602 1 1 11 PRO HA H -11.630 -1.624 -5.292 1.00 . A A . 11 PRO HA 1 1 15 10603 1 1 11 PRO HB2 H -9.419 -2.462 -3.655 1.00 . A A . 11 PRO HB2 1 1 15 10604 1 1 11 PRO HB3 H -9.530 -2.502 -5.433 1.00 . A A . 11 PRO HB3 1 1 15 10605 1 1 11 PRO HD2 H -9.423 0.314 -2.842 1.00 . A A . 11 PRO HD2 1 1 15 10606 1 1 11 PRO HD3 H -9.165 1.360 -4.244 1.00 . A A . 11 PRO HD3 1 1 15 10607 1 1 11 PRO HG2 H -7.791 -0.896 -4.086 1.00 . A A . 11 PRO HG2 1 1 15 10608 1 1 11 PRO HG3 H -8.535 -0.432 -5.625 1.00 . A A . 11 PRO HG3 1 1 15 10609 1 1 11 PRO N N -10.822 0.120 -4.382 1.00 . A A . 11 PRO N 1 1 15 10610 1 1 11 PRO O O -11.386 -1.370 -2.024 1.00 . A A . 11 PRO O 1 1 15 10611 1 1 12 CYS C C -13.052 -4.937 -2.199 1.00 . A A . 12 CYS C 1 1 15 10612 1 1 12 CYS CA C -13.195 -3.424 -2.143 1.00 . A A . 12 CYS CA 1 1 15 10613 1 1 12 CYS CB C -14.679 -3.019 -2.113 1.00 . A A . 12 CYS CB 1 1 15 10614 1 1 12 CYS H H -12.734 -3.188 -4.166 1.00 . A A . 12 CYS H 1 1 15 10615 1 1 12 CYS HA H -12.718 -3.073 -1.241 1.00 . A A . 12 CYS HA 1 1 15 10616 1 1 12 CYS HB2 H -14.750 -1.942 -2.108 1.00 . A A . 12 CYS HB2 1 1 15 10617 1 1 12 CYS HB3 H -15.161 -3.422 -2.993 1.00 . A A . 12 CYS HB3 1 1 15 10618 1 1 12 CYS HG H -16.058 -2.536 -0.033 1.00 . A A . 12 CYS HG 1 1 15 10619 1 1 12 CYS N N -12.530 -2.828 -3.276 1.00 . A A . 12 CYS N 1 1 15 10620 1 1 12 CYS O O -13.628 -5.592 -3.069 1.00 . A A . 12 CYS O 1 1 15 10621 1 1 12 CYS SG S -15.594 -3.603 -0.670 1.00 . A A . 12 CYS SG 1 1 15 10622 1 1 13 LYS C C -11.559 -7.146 0.275 1.00 . A A . 13 LYS C 1 1 15 10623 1 1 13 LYS CA C -11.983 -6.898 -1.140 1.00 . A A . 13 LYS CA 1 1 15 10624 1 1 13 LYS CB C -10.864 -7.458 -2.044 1.00 . A A . 13 LYS CB 1 1 15 10625 1 1 13 LYS CD C -10.005 -8.277 -4.227 1.00 . A A . 13 LYS CD 1 1 15 10626 1 1 13 LYS CE C -10.197 -8.423 -5.737 1.00 . A A . 13 LYS CE 1 1 15 10627 1 1 13 LYS CG C -11.109 -7.466 -3.537 1.00 . A A . 13 LYS CG 1 1 15 10628 1 1 13 LYS H H -11.718 -4.897 -0.693 1.00 . A A . 13 LYS H 1 1 15 10629 1 1 13 LYS HA H -12.898 -7.433 -1.329 1.00 . A A . 13 LYS HA 1 1 15 10630 1 1 13 LYS HB2 H -9.971 -6.872 -1.886 1.00 . A A . 13 LYS HB2 1 1 15 10631 1 1 13 LYS HB3 H -10.665 -8.471 -1.724 1.00 . A A . 13 LYS HB3 1 1 15 10632 1 1 13 LYS HD2 H -9.054 -7.792 -4.061 1.00 . A A . 13 LYS HD2 1 1 15 10633 1 1 13 LYS HD3 H -9.986 -9.259 -3.778 1.00 . A A . 13 LYS HD3 1 1 15 10634 1 1 13 LYS HE2 H -9.427 -9.083 -6.107 1.00 . A A . 13 LYS HE2 1 1 15 10635 1 1 13 LYS HE3 H -11.155 -8.878 -5.933 1.00 . A A . 13 LYS HE3 1 1 15 10636 1 1 13 LYS HG2 H -12.089 -7.879 -3.710 1.00 . A A . 13 LYS HG2 1 1 15 10637 1 1 13 LYS HG3 H -11.086 -6.449 -3.896 1.00 . A A . 13 LYS HG3 1 1 15 10638 1 1 13 LYS HZ1 H -10.875 -6.476 -6.179 1.00 . A A . 13 LYS HZ1 1 1 15 10639 1 1 13 LYS HZ2 H -10.175 -7.304 -7.489 1.00 . A A . 13 LYS HZ2 1 1 15 10640 1 1 13 LYS HZ3 H -9.181 -6.696 -6.286 1.00 . A A . 13 LYS HZ3 1 1 15 10641 1 1 13 LYS N N -12.218 -5.469 -1.311 1.00 . A A . 13 LYS N 1 1 15 10642 1 1 13 LYS NZ N -10.114 -7.124 -6.462 1.00 . A A . 13 LYS NZ 1 1 15 10643 1 1 13 LYS O O -11.048 -6.232 0.935 1.00 . A A . 13 LYS O 1 1 15 10644 1 1 14 ASP C C -9.839 -9.273 1.838 1.00 . A A . 14 ASP C 1 1 15 10645 1 1 14 ASP CA C -11.244 -8.758 2.042 1.00 . A A . 14 ASP CA 1 1 15 10646 1 1 14 ASP CB C -12.111 -9.841 2.721 1.00 . A A . 14 ASP CB 1 1 15 10647 1 1 14 ASP CG C -13.483 -9.339 3.144 1.00 . A A . 14 ASP CG 1 1 15 10648 1 1 14 ASP H H -12.271 -8.992 0.191 1.00 . A A . 14 ASP H 1 1 15 10649 1 1 14 ASP HA H -11.212 -7.872 2.661 1.00 . A A . 14 ASP HA 1 1 15 10650 1 1 14 ASP HB2 H -12.245 -10.665 2.036 1.00 . A A . 14 ASP HB2 1 1 15 10651 1 1 14 ASP HB3 H -11.607 -10.224 3.598 1.00 . A A . 14 ASP HB3 1 1 15 10652 1 1 14 ASP N N -11.761 -8.359 0.740 1.00 . A A . 14 ASP N 1 1 15 10653 1 1 14 ASP O O -8.903 -8.866 2.527 1.00 . A A . 14 ASP O 1 1 15 10654 1 1 14 ASP OD1 O -14.425 -9.417 2.324 1.00 . A A . 14 ASP OD1 1 1 15 10655 1 1 14 ASP OD2 O -13.630 -8.902 4.325 1.00 . A A . 14 ASP OD2 1 1 15 10656 1 1 15 LYS C C -7.617 -9.728 -0.323 1.00 . A A . 15 LYS C 1 1 15 10657 1 1 15 LYS CA C -8.429 -10.753 0.476 1.00 . A A . 15 LYS CA 1 1 15 10658 1 1 15 LYS CB C -8.665 -12.024 -0.374 1.00 . A A . 15 LYS CB 1 1 15 10659 1 1 15 LYS CD C -9.878 -14.221 -0.627 1.00 . A A . 15 LYS CD 1 1 15 10660 1 1 15 LYS CE C -10.704 -15.276 0.084 1.00 . A A . 15 LYS CE 1 1 15 10661 1 1 15 LYS CG C -9.478 -13.105 0.334 1.00 . A A . 15 LYS CG 1 1 15 10662 1 1 15 LYS H H -10.468 -10.634 0.448 1.00 . A A . 15 LYS H 1 1 15 10663 1 1 15 LYS HA H -7.876 -11.032 1.360 1.00 . A A . 15 LYS HA 1 1 15 10664 1 1 15 LYS HB2 H -9.199 -11.753 -1.274 1.00 . A A . 15 LYS HB2 1 1 15 10665 1 1 15 LYS HB3 H -7.703 -12.437 -0.650 1.00 . A A . 15 LYS HB3 1 1 15 10666 1 1 15 LYS HD2 H -10.463 -13.808 -1.436 1.00 . A A . 15 LYS HD2 1 1 15 10667 1 1 15 LYS HD3 H -8.983 -14.679 -1.019 1.00 . A A . 15 LYS HD3 1 1 15 10668 1 1 15 LYS HE2 H -10.087 -15.782 0.814 1.00 . A A . 15 LYS HE2 1 1 15 10669 1 1 15 LYS HE3 H -11.538 -14.803 0.585 1.00 . A A . 15 LYS HE3 1 1 15 10670 1 1 15 LYS HG2 H -8.886 -13.523 1.133 1.00 . A A . 15 LYS HG2 1 1 15 10671 1 1 15 LYS HG3 H -10.367 -12.644 0.735 1.00 . A A . 15 LYS HG3 1 1 15 10672 1 1 15 LYS HZ1 H -10.477 -16.804 -1.347 1.00 . A A . 15 LYS HZ1 1 1 15 10673 1 1 15 LYS HZ2 H -11.847 -15.836 -1.550 1.00 . A A . 15 LYS HZ2 1 1 15 10674 1 1 15 LYS HZ3 H -11.814 -16.988 -0.333 1.00 . A A . 15 LYS HZ3 1 1 15 10675 1 1 15 LYS N N -9.708 -10.200 0.883 1.00 . A A . 15 LYS N 1 1 15 10676 1 1 15 LYS NZ N -11.232 -16.298 -0.847 1.00 . A A . 15 LYS NZ 1 1 15 10677 1 1 15 LYS O O -7.633 -9.735 -1.567 1.00 . A A . 15 LYS O 1 1 15 10678 1 1 16 VAL C C -5.287 -7.141 0.914 1.00 . A A . 16 VAL C 1 1 15 10679 1 1 16 VAL CA C -6.122 -7.806 -0.174 1.00 . A A . 16 VAL CA 1 1 15 10680 1 1 16 VAL CB C -6.860 -6.736 -1.045 1.00 . A A . 16 VAL CB 1 1 15 10681 1 1 16 VAL CG1 C -7.946 -6.039 -0.251 1.00 . A A . 16 VAL CG1 1 1 15 10682 1 1 16 VAL CG2 C -5.854 -5.726 -1.610 1.00 . A A . 16 VAL CG2 1 1 15 10683 1 1 16 VAL H H -7.130 -8.810 1.372 1.00 . A A . 16 VAL H 1 1 15 10684 1 1 16 VAL HA H -5.435 -8.352 -0.803 1.00 . A A . 16 VAL HA 1 1 15 10685 1 1 16 VAL HB H -7.332 -7.242 -1.871 1.00 . A A . 16 VAL HB 1 1 15 10686 1 1 16 VAL HG11 H -8.709 -6.762 0.004 1.00 . A A . 16 VAL HG11 1 1 15 10687 1 1 16 VAL HG12 H -8.383 -5.223 -0.808 1.00 . A A . 16 VAL HG12 1 1 15 10688 1 1 16 VAL HG13 H -7.483 -5.694 0.662 1.00 . A A . 16 VAL HG13 1 1 15 10689 1 1 16 VAL HG21 H -5.067 -6.263 -2.127 1.00 . A A . 16 VAL HG21 1 1 15 10690 1 1 16 VAL HG22 H -5.409 -5.190 -0.782 1.00 . A A . 16 VAL HG22 1 1 15 10691 1 1 16 VAL HG23 H -6.342 -5.037 -2.283 1.00 . A A . 16 VAL HG23 1 1 15 10692 1 1 16 VAL N N -6.992 -8.815 0.396 1.00 . A A . 16 VAL N 1 1 15 10693 1 1 16 VAL O O -5.768 -6.348 1.708 1.00 . A A . 16 VAL O 1 1 15 10694 1 1 17 ASP C C -2.692 -5.576 1.598 1.00 . A A . 17 ASP C 1 1 15 10695 1 1 17 ASP CA C -3.086 -7.043 1.908 1.00 . A A . 17 ASP CA 1 1 15 10696 1 1 17 ASP CB C -1.856 -7.962 1.915 1.00 . A A . 17 ASP CB 1 1 15 10697 1 1 17 ASP CG C -2.186 -9.388 2.351 1.00 . A A . 17 ASP CG 1 1 15 10698 1 1 17 ASP H H -3.881 -8.320 0.399 1.00 . A A . 17 ASP H 1 1 15 10699 1 1 17 ASP HA H -3.540 -7.070 2.888 1.00 . A A . 17 ASP HA 1 1 15 10700 1 1 17 ASP HB2 H -1.466 -8.009 0.908 1.00 . A A . 17 ASP HB2 1 1 15 10701 1 1 17 ASP HB3 H -1.108 -7.564 2.583 1.00 . A A . 17 ASP HB3 1 1 15 10702 1 1 17 ASP N N -4.077 -7.557 0.975 1.00 . A A . 17 ASP N 1 1 15 10703 1 1 17 ASP O O -2.487 -5.197 0.426 1.00 . A A . 17 ASP O 1 1 15 10704 1 1 17 ASP OD1 O -2.595 -10.199 1.487 1.00 . A A . 17 ASP OD1 1 1 15 10705 1 1 17 ASP OD2 O -2.049 -9.705 3.550 1.00 . A A . 17 ASP OD2 1 1 15 10706 1 1 18 TRP C C -0.807 -3.140 3.071 1.00 . A A . 18 TRP C 1 1 15 10707 1 1 18 TRP CA C -2.243 -3.337 2.602 1.00 . A A . 18 TRP CA 1 1 15 10708 1 1 18 TRP CB C -3.184 -2.521 3.520 1.00 . A A . 18 TRP CB 1 1 15 10709 1 1 18 TRP CD1 C -5.452 -3.597 2.960 1.00 . A A . 18 TRP CD1 1 1 15 10710 1 1 18 TRP CD2 C -5.453 -1.366 2.874 1.00 . A A . 18 TRP CD2 1 1 15 10711 1 1 18 TRP CE2 C -6.740 -1.827 2.544 1.00 . A A . 18 TRP CE2 1 1 15 10712 1 1 18 TRP CE3 C -5.212 0.010 2.891 1.00 . A A . 18 TRP CE3 1 1 15 10713 1 1 18 TRP CG C -4.637 -2.517 3.115 1.00 . A A . 18 TRP CG 1 1 15 10714 1 1 18 TRP CH2 C -7.516 0.380 2.268 1.00 . A A . 18 TRP CH2 1 1 15 10715 1 1 18 TRP CZ2 C -7.782 -0.964 2.243 1.00 . A A . 18 TRP CZ2 1 1 15 10716 1 1 18 TRP CZ3 C -6.247 0.869 2.592 1.00 . A A . 18 TRP CZ3 1 1 15 10717 1 1 18 TRP H H -2.691 -5.191 3.539 1.00 . A A . 18 TRP H 1 1 15 10718 1 1 18 TRP HA H -2.334 -2.991 1.583 1.00 . A A . 18 TRP HA 1 1 15 10719 1 1 18 TRP HB2 H -3.119 -2.926 4.518 1.00 . A A . 18 TRP HB2 1 1 15 10720 1 1 18 TRP HB3 H -2.827 -1.500 3.535 1.00 . A A . 18 TRP HB3 1 1 15 10721 1 1 18 TRP HD1 H -5.131 -4.621 3.077 1.00 . A A . 18 TRP HD1 1 1 15 10722 1 1 18 TRP HE1 H -7.443 -3.822 2.418 1.00 . A A . 18 TRP HE1 1 1 15 10723 1 1 18 TRP HE3 H -4.238 0.404 3.139 1.00 . A A . 18 TRP HE3 1 1 15 10724 1 1 18 TRP HH2 H -8.293 1.097 2.036 1.00 . A A . 18 TRP HH2 1 1 15 10725 1 1 18 TRP HZ2 H -8.767 -1.325 1.997 1.00 . A A . 18 TRP HZ2 1 1 15 10726 1 1 18 TRP HZ3 H -6.080 1.935 2.597 1.00 . A A . 18 TRP HZ3 1 1 15 10727 1 1 18 TRP N N -2.573 -4.779 2.657 1.00 . A A . 18 TRP N 1 1 15 10728 1 1 18 TRP NE1 N -6.709 -3.199 2.594 1.00 . A A . 18 TRP NE1 1 1 15 10729 1 1 18 TRP O O -0.265 -4.008 3.744 1.00 . A A . 18 TRP O 1 1 15 10730 1 1 19 VAL C C 1.327 -0.414 3.825 1.00 . A A . 19 VAL C 1 1 15 10731 1 1 19 VAL CA C 1.194 -1.772 3.127 1.00 . A A . 19 VAL CA 1 1 15 10732 1 1 19 VAL CB C 2.190 -1.847 1.919 1.00 . A A . 19 VAL CB 1 1 15 10733 1 1 19 VAL CG1 C 2.263 -3.259 1.381 1.00 . A A . 19 VAL CG1 1 1 15 10734 1 1 19 VAL CG2 C 1.785 -0.891 0.798 1.00 . A A . 19 VAL CG2 1 1 15 10735 1 1 19 VAL H H -0.556 -1.229 2.277 1.00 . A A . 19 VAL H 1 1 15 10736 1 1 19 VAL HA H 1.464 -2.531 3.844 1.00 . A A . 19 VAL HA 1 1 15 10737 1 1 19 VAL HB H 3.176 -1.570 2.266 1.00 . A A . 19 VAL HB 1 1 15 10738 1 1 19 VAL HG11 H 2.609 -3.936 2.147 1.00 . A A . 19 VAL HG11 1 1 15 10739 1 1 19 VAL HG12 H 2.960 -3.279 0.559 1.00 . A A . 19 VAL HG12 1 1 15 10740 1 1 19 VAL HG13 H 1.292 -3.576 1.034 1.00 . A A . 19 VAL HG13 1 1 15 10741 1 1 19 VAL HG21 H 2.489 -0.959 -0.021 1.00 . A A . 19 VAL HG21 1 1 15 10742 1 1 19 VAL HG22 H 1.788 0.118 1.184 1.00 . A A . 19 VAL HG22 1 1 15 10743 1 1 19 VAL HG23 H 0.794 -1.140 0.450 1.00 . A A . 19 VAL HG23 1 1 15 10744 1 1 19 VAL N N -0.190 -2.021 2.734 1.00 . A A . 19 VAL N 1 1 15 10745 1 1 19 VAL O O 0.782 0.588 3.372 1.00 . A A . 19 VAL O 1 1 15 10746 1 1 20 GLN C C 3.705 1.263 5.360 1.00 . A A . 20 GLN C 1 1 15 10747 1 1 20 GLN CA C 2.291 0.819 5.665 1.00 . A A . 20 GLN CA 1 1 15 10748 1 1 20 GLN CB C 2.100 0.638 7.179 1.00 . A A . 20 GLN CB 1 1 15 10749 1 1 20 GLN CD C 2.195 1.742 9.501 1.00 . A A . 20 GLN CD 1 1 15 10750 1 1 20 GLN CG C 2.395 1.902 7.992 1.00 . A A . 20 GLN CG 1 1 15 10751 1 1 20 GLN H H 2.334 -1.265 5.291 1.00 . A A . 20 GLN H 1 1 15 10752 1 1 20 GLN HA H 1.609 1.572 5.304 1.00 . A A . 20 GLN HA 1 1 15 10753 1 1 20 GLN HB2 H 1.071 0.363 7.358 1.00 . A A . 20 GLN HB2 1 1 15 10754 1 1 20 GLN HB3 H 2.761 -0.147 7.516 1.00 . A A . 20 GLN HB3 1 1 15 10755 1 1 20 GLN HE21 H 3.614 3.085 9.889 1.00 . A A . 20 GLN HE21 1 1 15 10756 1 1 20 GLN HE22 H 2.835 2.432 11.257 1.00 . A A . 20 GLN HE22 1 1 15 10757 1 1 20 GLN HG2 H 3.424 2.172 7.809 1.00 . A A . 20 GLN HG2 1 1 15 10758 1 1 20 GLN HG3 H 1.746 2.686 7.630 1.00 . A A . 20 GLN HG3 1 1 15 10759 1 1 20 GLN N N 2.013 -0.409 4.943 1.00 . A A . 20 GLN N 1 1 15 10760 1 1 20 GLN NE2 N 2.955 2.481 10.286 1.00 . A A . 20 GLN NE2 1 1 15 10761 1 1 20 GLN O O 4.601 0.430 5.244 1.00 . A A . 20 GLN O 1 1 15 10762 1 1 20 GLN OE1 O 1.369 0.961 9.954 1.00 . A A . 20 GLN OE1 1 1 15 10763 1 1 21 CYS C C 5.987 3.308 6.222 1.00 . A A . 21 CYS C 1 1 15 10764 1 1 21 CYS CA C 5.254 3.013 4.907 1.00 . A A . 21 CYS CA 1 1 15 10765 1 1 21 CYS CB C 5.295 4.198 3.916 1.00 . A A . 21 CYS CB 1 1 15 10766 1 1 21 CYS H H 3.155 3.180 5.213 1.00 . A A . 21 CYS H 1 1 15 10767 1 1 21 CYS HA H 5.772 2.171 4.468 1.00 . A A . 21 CYS HA 1 1 15 10768 1 1 21 CYS HB2 H 6.289 4.480 3.613 1.00 . A A . 21 CYS HB2 1 1 15 10769 1 1 21 CYS HB3 H 4.753 3.902 3.031 1.00 . A A . 21 CYS HB3 1 1 15 10770 1 1 21 CYS N N 3.914 2.554 5.166 1.00 . A A . 21 CYS N 1 1 15 10771 1 1 21 CYS O O 5.795 4.372 6.861 1.00 . A A . 21 CYS O 1 1 15 10772 1 1 21 CYS SG S 4.559 5.725 4.460 1.00 . A A . 21 CYS SG 1 1 15 10773 1 1 22 ASP C C 8.824 3.318 7.762 1.00 . A A . 22 ASP C 1 1 15 10774 1 1 22 ASP CA C 7.599 2.412 7.866 1.00 . A A . 22 ASP CA 1 1 15 10775 1 1 22 ASP CB C 8.015 0.980 8.276 1.00 . A A . 22 ASP CB 1 1 15 10776 1 1 22 ASP CG C 6.870 0.126 8.835 1.00 . A A . 22 ASP CG 1 1 15 10777 1 1 22 ASP H H 7.012 1.644 5.968 1.00 . A A . 22 ASP H 1 1 15 10778 1 1 22 ASP HA H 6.936 2.809 8.624 1.00 . A A . 22 ASP HA 1 1 15 10779 1 1 22 ASP HB2 H 8.409 0.460 7.416 1.00 . A A . 22 ASP HB2 1 1 15 10780 1 1 22 ASP HB3 H 8.779 1.054 9.036 1.00 . A A . 22 ASP HB3 1 1 15 10781 1 1 22 ASP N N 6.848 2.384 6.594 1.00 . A A . 22 ASP N 1 1 15 10782 1 1 22 ASP O O 9.774 3.197 8.526 1.00 . A A . 22 ASP O 1 1 15 10783 1 1 22 ASP OD1 O 5.818 0.028 8.188 1.00 . A A . 22 ASP OD1 1 1 15 10784 1 1 22 ASP OD2 O 7.032 -0.454 9.957 1.00 . A A . 22 ASP OD2 1 1 15 10785 1 1 23 GLY C C 9.557 6.463 7.503 1.00 . A A . 23 GLY C 1 1 15 10786 1 1 23 GLY CA C 9.817 5.212 6.671 1.00 . A A . 23 GLY CA 1 1 15 10787 1 1 23 GLY H H 7.934 4.325 6.320 1.00 . A A . 23 GLY H 1 1 15 10788 1 1 23 GLY HA2 H 10.739 4.748 6.990 1.00 . A A . 23 GLY HA2 1 1 15 10789 1 1 23 GLY HA3 H 9.889 5.493 5.625 1.00 . A A . 23 GLY HA3 1 1 15 10790 1 1 23 GLY N N 8.753 4.262 6.847 1.00 . A A . 23 GLY N 1 1 15 10791 1 1 23 GLY O O 10.471 7.239 7.765 1.00 . A A . 23 GLY O 1 1 15 10792 1 1 24 GLY C C 6.587 8.426 8.591 1.00 . A A . 24 GLY C 1 1 15 10793 1 1 24 GLY CA C 7.982 7.804 8.751 1.00 . A A . 24 GLY CA 1 1 15 10794 1 1 24 GLY H H 7.609 5.986 7.687 1.00 . A A . 24 GLY H 1 1 15 10795 1 1 24 GLY HA2 H 8.121 7.510 9.780 1.00 . A A . 24 GLY HA2 1 1 15 10796 1 1 24 GLY HA3 H 8.724 8.561 8.538 1.00 . A A . 24 GLY HA3 1 1 15 10797 1 1 24 GLY N N 8.287 6.653 7.924 1.00 . A A . 24 GLY N 1 1 15 10798 1 1 24 GLY O O 6.220 9.271 9.383 1.00 . A A . 24 GLY O 1 1 15 10799 1 1 25 CYS C C 3.442 7.877 8.246 1.00 . A A . 25 CYS C 1 1 15 10800 1 1 25 CYS CA C 4.462 8.672 7.447 1.00 . A A . 25 CYS CA 1 1 15 10801 1 1 25 CYS CB C 3.985 8.721 5.996 1.00 . A A . 25 CYS CB 1 1 15 10802 1 1 25 CYS H H 6.105 7.367 6.948 1.00 . A A . 25 CYS H 1 1 15 10803 1 1 25 CYS HA H 4.511 9.674 7.850 1.00 . A A . 25 CYS HA 1 1 15 10804 1 1 25 CYS HB2 H 3.689 7.730 5.681 1.00 . A A . 25 CYS HB2 1 1 15 10805 1 1 25 CYS HB3 H 3.119 9.369 5.941 1.00 . A A . 25 CYS HB3 1 1 15 10806 1 1 25 CYS N N 5.805 8.045 7.582 1.00 . A A . 25 CYS N 1 1 15 10807 1 1 25 CYS O O 2.443 8.416 8.686 1.00 . A A . 25 CYS O 1 1 15 10808 1 1 25 CYS SG S 5.179 9.312 4.798 1.00 . A A . 25 CYS SG 1 1 15 10809 1 1 26 ASP C C 1.481 5.474 8.394 1.00 . A A . 26 ASP C 1 1 15 10810 1 1 26 ASP CA C 2.818 5.613 9.105 1.00 . A A . 26 ASP CA 1 1 15 10811 1 1 26 ASP CB C 2.589 5.983 10.578 1.00 . A A . 26 ASP CB 1 1 15 10812 1 1 26 ASP CG C 3.836 5.945 11.405 1.00 . A A . 26 ASP CG 1 1 15 10813 1 1 26 ASP H H 4.611 6.271 8.137 1.00 . A A . 26 ASP H 1 1 15 10814 1 1 26 ASP HA H 3.298 4.647 9.064 1.00 . A A . 26 ASP HA 1 1 15 10815 1 1 26 ASP HB2 H 2.198 6.984 10.629 1.00 . A A . 26 ASP HB2 1 1 15 10816 1 1 26 ASP HB3 H 1.863 5.310 11.007 1.00 . A A . 26 ASP HB3 1 1 15 10817 1 1 26 ASP N N 3.726 6.574 8.423 1.00 . A A . 26 ASP N 1 1 15 10818 1 1 26 ASP O O 0.503 4.989 8.971 1.00 . A A . 26 ASP O 1 1 15 10819 1 1 26 ASP OD1 O 4.182 4.876 11.911 1.00 . A A . 26 ASP OD1 1 1 15 10820 1 1 26 ASP OD2 O 4.467 6.994 11.592 1.00 . A A . 26 ASP OD2 1 1 15 10821 1 1 27 GLU C C 0.114 4.458 5.664 1.00 . A A . 27 GLU C 1 1 15 10822 1 1 27 GLU CA C 0.239 5.786 6.378 1.00 . A A . 27 GLU CA 1 1 15 10823 1 1 27 GLU CB C 0.179 6.940 5.400 1.00 . A A . 27 GLU CB 1 1 15 10824 1 1 27 GLU CD C 0.074 9.461 5.156 1.00 . A A . 27 GLU CD 1 1 15 10825 1 1 27 GLU CG C 0.251 8.291 6.089 1.00 . A A . 27 GLU CG 1 1 15 10826 1 1 27 GLU H H 2.274 6.156 6.721 1.00 . A A . 27 GLU H 1 1 15 10827 1 1 27 GLU HA H -0.581 5.884 7.077 1.00 . A A . 27 GLU HA 1 1 15 10828 1 1 27 GLU HB2 H 0.993 6.840 4.697 1.00 . A A . 27 GLU HB2 1 1 15 10829 1 1 27 GLU HB3 H -0.749 6.884 4.849 1.00 . A A . 27 GLU HB3 1 1 15 10830 1 1 27 GLU HG2 H -0.544 8.329 6.812 1.00 . A A . 27 GLU HG2 1 1 15 10831 1 1 27 GLU HG3 H 1.194 8.386 6.606 1.00 . A A . 27 GLU HG3 1 1 15 10832 1 1 27 GLU N N 1.451 5.840 7.141 1.00 . A A . 27 GLU N 1 1 15 10833 1 1 27 GLU O O 1.111 3.770 5.437 1.00 . A A . 27 GLU O 1 1 15 10834 1 1 27 GLU OE1 O 1.075 9.966 4.583 1.00 . A A . 27 GLU OE1 1 1 15 10835 1 1 27 GLU OE2 O -1.083 9.905 4.995 1.00 . A A . 27 GLU OE2 1 1 15 10836 1 1 28 TRP C C -1.741 3.057 3.217 1.00 . A A . 28 TRP C 1 1 15 10837 1 1 28 TRP CA C -1.395 2.849 4.669 1.00 . A A . 28 TRP CA 1 1 15 10838 1 1 28 TRP CB C -2.511 2.107 5.393 1.00 . A A . 28 TRP CB 1 1 15 10839 1 1 28 TRP CD1 C -2.068 2.399 7.913 1.00 . A A . 28 TRP CD1 1 1 15 10840 1 1 28 TRP CD2 C -1.797 0.310 7.157 1.00 . A A . 28 TRP CD2 1 1 15 10841 1 1 28 TRP CE2 C -1.522 0.325 8.528 1.00 . A A . 28 TRP CE2 1 1 15 10842 1 1 28 TRP CE3 C -1.688 -0.898 6.458 1.00 . A A . 28 TRP CE3 1 1 15 10843 1 1 28 TRP CG C -2.136 1.645 6.773 1.00 . A A . 28 TRP CG 1 1 15 10844 1 1 28 TRP CH2 C -1.067 -1.985 8.516 1.00 . A A . 28 TRP CH2 1 1 15 10845 1 1 28 TRP CZ2 C -1.165 -0.820 9.225 1.00 . A A . 28 TRP CZ2 1 1 15 10846 1 1 28 TRP CZ3 C -1.330 -2.028 7.148 1.00 . A A . 28 TRP CZ3 1 1 15 10847 1 1 28 TRP H H -1.774 4.797 5.508 1.00 . A A . 28 TRP H 1 1 15 10848 1 1 28 TRP HA H -0.497 2.253 4.711 1.00 . A A . 28 TRP HA 1 1 15 10849 1 1 28 TRP HB2 H -3.375 2.747 5.482 1.00 . A A . 28 TRP HB2 1 1 15 10850 1 1 28 TRP HB3 H -2.783 1.236 4.817 1.00 . A A . 28 TRP HB3 1 1 15 10851 1 1 28 TRP HD1 H -2.266 3.459 7.957 1.00 . A A . 28 TRP HD1 1 1 15 10852 1 1 28 TRP HE1 H -1.563 1.915 9.889 1.00 . A A . 28 TRP HE1 1 1 15 10853 1 1 28 TRP HE3 H -1.885 -0.945 5.401 1.00 . A A . 28 TRP HE3 1 1 15 10854 1 1 28 TRP HH2 H -0.785 -2.899 9.017 1.00 . A A . 28 TRP HH2 1 1 15 10855 1 1 28 TRP HZ2 H -0.961 -0.797 10.285 1.00 . A A . 28 TRP HZ2 1 1 15 10856 1 1 28 TRP HZ3 H -1.241 -2.961 6.612 1.00 . A A . 28 TRP HZ3 1 1 15 10857 1 1 28 TRP N N -1.101 4.113 5.317 1.00 . A A . 28 TRP N 1 1 15 10858 1 1 28 TRP NE1 N -1.691 1.610 8.966 1.00 . A A . 28 TRP NE1 1 1 15 10859 1 1 28 TRP O O -2.538 3.946 2.875 1.00 . A A . 28 TRP O 1 1 15 10860 1 1 29 PHE C C -1.826 0.975 0.431 1.00 . A A . 29 PHE C 1 1 15 10861 1 1 29 PHE CA C -1.274 2.320 0.951 1.00 . A A . 29 PHE CA 1 1 15 10862 1 1 29 PHE CB C 0.122 2.577 0.297 1.00 . A A . 29 PHE CB 1 1 15 10863 1 1 29 PHE CD1 C 1.351 3.832 2.110 1.00 . A A . 29 PHE CD1 1 1 15 10864 1 1 29 PHE CD2 C 1.160 4.877 -0.010 1.00 . A A . 29 PHE CD2 1 1 15 10865 1 1 29 PHE CE1 C 2.053 4.896 2.579 1.00 . A A . 29 PHE CE1 1 1 15 10866 1 1 29 PHE CE2 C 1.868 5.959 0.470 1.00 . A A . 29 PHE CE2 1 1 15 10867 1 1 29 PHE CG C 0.893 3.791 0.809 1.00 . A A . 29 PHE CG 1 1 15 10868 1 1 29 PHE CZ C 2.311 5.961 1.776 1.00 . A A . 29 PHE CZ 1 1 15 10869 1 1 29 PHE H H -0.520 1.567 2.744 1.00 . A A . 29 PHE H 1 1 15 10870 1 1 29 PHE HA H -1.940 3.128 0.692 1.00 . A A . 29 PHE HA 1 1 15 10871 1 1 29 PHE HB2 H 0.755 1.717 0.447 1.00 . A A . 29 PHE HB2 1 1 15 10872 1 1 29 PHE HB3 H -0.021 2.714 -0.764 1.00 . A A . 29 PHE HB3 1 1 15 10873 1 1 29 PHE HD1 H 1.161 3.004 2.772 1.00 . A A . 29 PHE HD1 1 1 15 10874 1 1 29 PHE HD2 H 0.811 4.888 -1.031 1.00 . A A . 29 PHE HD2 1 1 15 10875 1 1 29 PHE HE1 H 2.401 4.903 3.601 1.00 . A A . 29 PHE HE1 1 1 15 10876 1 1 29 PHE HE2 H 2.072 6.799 -0.180 1.00 . A A . 29 PHE HE2 1 1 15 10877 1 1 29 PHE HZ H 2.866 6.787 2.193 1.00 . A A . 29 PHE HZ 1 1 15 10878 1 1 29 PHE N N -1.130 2.250 2.380 1.00 . A A . 29 PHE N 1 1 15 10879 1 1 29 PHE O O -1.737 -0.065 1.109 1.00 . A A . 29 PHE O 1 1 15 10880 1 1 30 HIS C C -1.799 -0.770 -2.301 1.00 . A A . 30 HIS C 1 1 15 10881 1 1 30 HIS CA C -2.886 -0.238 -1.409 1.00 . A A . 30 HIS CA 1 1 15 10882 1 1 30 HIS CB C -4.101 0.036 -2.333 1.00 . A A . 30 HIS CB 1 1 15 10883 1 1 30 HIS CD2 C -6.415 -0.624 -1.369 1.00 . A A . 30 HIS CD2 1 1 15 10884 1 1 30 HIS CE1 C -7.245 1.389 -1.141 1.00 . A A . 30 HIS CE1 1 1 15 10885 1 1 30 HIS CG C -5.446 0.258 -1.724 1.00 . A A . 30 HIS CG 1 1 15 10886 1 1 30 HIS H H -2.425 1.878 -1.187 1.00 . A A . 30 HIS H 1 1 15 10887 1 1 30 HIS HA H -3.154 -0.959 -0.652 1.00 . A A . 30 HIS HA 1 1 15 10888 1 1 30 HIS HB2 H -3.848 0.990 -2.773 1.00 . A A . 30 HIS HB2 1 1 15 10889 1 1 30 HIS HB3 H -4.183 -0.643 -3.169 1.00 . A A . 30 HIS HB3 1 1 15 10890 1 1 30 HIS HD2 H -6.328 -1.702 -1.365 1.00 . A A . 30 HIS HD2 1 1 15 10891 1 1 30 HIS HE1 H -7.950 2.185 -0.952 1.00 . A A . 30 HIS HE1 1 1 15 10892 1 1 30 HIS HE2 H -8.277 -0.264 -0.497 1.00 . A A . 30 HIS HE2 1 1 15 10893 1 1 30 HIS N N -2.395 0.997 -0.752 1.00 . A A . 30 HIS N 1 1 15 10894 1 1 30 HIS ND1 N -5.990 1.512 -1.569 1.00 . A A . 30 HIS ND1 1 1 15 10895 1 1 30 HIS NE2 N -7.521 0.098 -1.015 1.00 . A A . 30 HIS NE2 1 1 15 10896 1 1 30 HIS O O -1.225 -0.011 -3.058 1.00 . A A . 30 HIS O 1 1 15 10897 1 1 31 GLN C C -0.849 -2.394 -4.641 1.00 . A A . 31 GLN C 1 1 15 10898 1 1 31 GLN CA C -0.533 -2.661 -3.159 1.00 . A A . 31 GLN CA 1 1 15 10899 1 1 31 GLN CB C -0.334 -4.169 -2.932 1.00 . A A . 31 GLN CB 1 1 15 10900 1 1 31 GLN CD C 0.503 -6.055 -1.486 1.00 . A A . 31 GLN CD 1 1 15 10901 1 1 31 GLN CG C 0.290 -4.558 -1.593 1.00 . A A . 31 GLN CG 1 1 15 10902 1 1 31 GLN H H -1.993 -2.617 -1.588 1.00 . A A . 31 GLN H 1 1 15 10903 1 1 31 GLN HA H 0.389 -2.148 -2.934 1.00 . A A . 31 GLN HA 1 1 15 10904 1 1 31 GLN HB2 H -1.283 -4.673 -3.010 1.00 . A A . 31 GLN HB2 1 1 15 10905 1 1 31 GLN HB3 H 0.310 -4.535 -3.715 1.00 . A A . 31 GLN HB3 1 1 15 10906 1 1 31 GLN HE21 H -1.227 -6.268 -0.588 1.00 . A A . 31 GLN HE21 1 1 15 10907 1 1 31 GLN HE22 H -0.343 -7.728 -0.847 1.00 . A A . 31 GLN HE22 1 1 15 10908 1 1 31 GLN HG2 H 1.250 -4.072 -1.495 1.00 . A A . 31 GLN HG2 1 1 15 10909 1 1 31 GLN HG3 H -0.349 -4.246 -0.783 1.00 . A A . 31 GLN HG3 1 1 15 10910 1 1 31 GLN N N -1.537 -2.069 -2.257 1.00 . A A . 31 GLN N 1 1 15 10911 1 1 31 GLN NE2 N -0.444 -6.756 -0.921 1.00 . A A . 31 GLN NE2 1 1 15 10912 1 1 31 GLN O O 0.032 -2.250 -5.438 1.00 . A A . 31 GLN O 1 1 15 10913 1 1 31 GLN OE1 O 1.529 -6.564 -1.881 1.00 . A A . 31 GLN OE1 1 1 15 10914 1 1 32 VAL C C -2.346 -0.515 -6.677 1.00 . A A . 32 VAL C 1 1 15 10915 1 1 32 VAL CA C -2.485 -2.030 -6.356 1.00 . A A . 32 VAL CA 1 1 15 10916 1 1 32 VAL CB C -3.924 -2.524 -6.668 1.00 . A A . 32 VAL CB 1 1 15 10917 1 1 32 VAL CG1 C -4.895 -1.873 -5.738 1.00 . A A . 32 VAL CG1 1 1 15 10918 1 1 32 VAL CG2 C -4.295 -2.219 -8.104 1.00 . A A . 32 VAL CG2 1 1 15 10919 1 1 32 VAL H H -2.789 -2.518 -4.313 1.00 . A A . 32 VAL H 1 1 15 10920 1 1 32 VAL HA H -1.794 -2.557 -6.994 1.00 . A A . 32 VAL HA 1 1 15 10921 1 1 32 VAL HB H -3.986 -3.591 -6.515 1.00 . A A . 32 VAL HB 1 1 15 10922 1 1 32 VAL HG11 H -5.904 -2.202 -5.929 1.00 . A A . 32 VAL HG11 1 1 15 10923 1 1 32 VAL HG12 H -4.765 -0.815 -5.905 1.00 . A A . 32 VAL HG12 1 1 15 10924 1 1 32 VAL HG13 H -4.590 -2.093 -4.729 1.00 . A A . 32 VAL HG13 1 1 15 10925 1 1 32 VAL HG21 H -3.591 -2.693 -8.772 1.00 . A A . 32 VAL HG21 1 1 15 10926 1 1 32 VAL HG22 H -4.226 -1.147 -8.216 1.00 . A A . 32 VAL HG22 1 1 15 10927 1 1 32 VAL HG23 H -5.309 -2.527 -8.314 1.00 . A A . 32 VAL HG23 1 1 15 10928 1 1 32 VAL N N -2.105 -2.333 -4.984 1.00 . A A . 32 VAL N 1 1 15 10929 1 1 32 VAL O O -1.861 -0.134 -7.719 1.00 . A A . 32 VAL O 1 1 15 10930 1 1 33 CYS C C -1.401 2.376 -5.935 1.00 . A A . 33 CYS C 1 1 15 10931 1 1 33 CYS CA C -2.797 1.745 -5.976 1.00 . A A . 33 CYS CA 1 1 15 10932 1 1 33 CYS CB C -3.807 2.457 -5.039 1.00 . A A . 33 CYS CB 1 1 15 10933 1 1 33 CYS H H -3.021 -0.184 -4.948 1.00 . A A . 33 CYS H 1 1 15 10934 1 1 33 CYS HA H -3.111 1.919 -6.995 1.00 . A A . 33 CYS HA 1 1 15 10935 1 1 33 CYS HB2 H -4.145 3.338 -5.544 1.00 . A A . 33 CYS HB2 1 1 15 10936 1 1 33 CYS HB3 H -4.657 1.796 -4.966 1.00 . A A . 33 CYS HB3 1 1 15 10937 1 1 33 CYS N N -2.753 0.309 -5.744 1.00 . A A . 33 CYS N 1 1 15 10938 1 1 33 CYS O O -1.143 3.358 -6.615 1.00 . A A . 33 CYS O 1 1 15 10939 1 1 33 CYS SG S -3.242 2.858 -3.372 1.00 . A A . 33 CYS SG 1 1 15 10940 1 1 34 VAL C C 1.820 1.422 -5.864 1.00 . A A . 34 VAL C 1 1 15 10941 1 1 34 VAL CA C 0.824 2.325 -5.091 1.00 . A A . 34 VAL CA 1 1 15 10942 1 1 34 VAL CB C 1.267 2.475 -3.629 1.00 . A A . 34 VAL CB 1 1 15 10943 1 1 34 VAL CG1 C 1.890 1.237 -3.055 1.00 . A A . 34 VAL CG1 1 1 15 10944 1 1 34 VAL CG2 C 2.077 3.703 -3.465 1.00 . A A . 34 VAL CG2 1 1 15 10945 1 1 34 VAL H H -0.678 1.019 -4.595 1.00 . A A . 34 VAL H 1 1 15 10946 1 1 34 VAL HA H 0.810 3.305 -5.550 1.00 . A A . 34 VAL HA 1 1 15 10947 1 1 34 VAL HB H 0.426 2.545 -2.967 1.00 . A A . 34 VAL HB 1 1 15 10948 1 1 34 VAL HG11 H 2.757 1.025 -3.660 1.00 . A A . 34 VAL HG11 1 1 15 10949 1 1 34 VAL HG12 H 1.196 0.411 -3.115 1.00 . A A . 34 VAL HG12 1 1 15 10950 1 1 34 VAL HG13 H 2.203 1.426 -2.036 1.00 . A A . 34 VAL HG13 1 1 15 10951 1 1 34 VAL HG21 H 2.949 3.652 -4.102 1.00 . A A . 34 VAL HG21 1 1 15 10952 1 1 34 VAL HG22 H 2.351 3.801 -2.427 1.00 . A A . 34 VAL HG22 1 1 15 10953 1 1 34 VAL HG23 H 1.419 4.505 -3.759 1.00 . A A . 34 VAL HG23 1 1 15 10954 1 1 34 VAL N N -0.494 1.792 -5.167 1.00 . A A . 34 VAL N 1 1 15 10955 1 1 34 VAL O O 3.014 1.716 -5.950 1.00 . A A . 34 VAL O 1 1 15 10956 1 1 35 GLY C C 3.158 -1.383 -6.340 1.00 . A A . 35 GLY C 1 1 15 10957 1 1 35 GLY CA C 2.115 -0.616 -7.202 1.00 . A A . 35 GLY CA 1 1 15 10958 1 1 35 GLY H H 0.302 0.390 -6.578 1.00 . A A . 35 GLY H 1 1 15 10959 1 1 35 GLY HA2 H 1.451 -1.344 -7.647 1.00 . A A . 35 GLY HA2 1 1 15 10960 1 1 35 GLY HA3 H 2.630 -0.104 -8.002 1.00 . A A . 35 GLY HA3 1 1 15 10961 1 1 35 GLY N N 1.282 0.375 -6.493 1.00 . A A . 35 GLY N 1 1 15 10962 1 1 35 GLY O O 4.363 -1.162 -6.467 1.00 . A A . 35 GLY O 1 1 15 10963 1 1 36 VAL C C 3.174 -4.618 -5.049 1.00 . A A . 36 VAL C 1 1 15 10964 1 1 36 VAL CA C 3.512 -3.172 -4.688 1.00 . A A . 36 VAL CA 1 1 15 10965 1 1 36 VAL CB C 3.236 -2.937 -3.155 1.00 . A A . 36 VAL CB 1 1 15 10966 1 1 36 VAL CG1 C 3.907 -3.974 -2.263 1.00 . A A . 36 VAL CG1 1 1 15 10967 1 1 36 VAL CG2 C 3.670 -1.558 -2.744 1.00 . A A . 36 VAL CG2 1 1 15 10968 1 1 36 VAL H H 1.723 -2.449 -5.403 1.00 . A A . 36 VAL H 1 1 15 10969 1 1 36 VAL HA H 4.552 -2.969 -4.897 1.00 . A A . 36 VAL HA 1 1 15 10970 1 1 36 VAL HB H 2.170 -2.995 -3.003 1.00 . A A . 36 VAL HB 1 1 15 10971 1 1 36 VAL HG11 H 3.422 -4.916 -2.471 1.00 . A A . 36 VAL HG11 1 1 15 10972 1 1 36 VAL HG12 H 3.735 -3.718 -1.229 1.00 . A A . 36 VAL HG12 1 1 15 10973 1 1 36 VAL HG13 H 4.961 -4.071 -2.481 1.00 . A A . 36 VAL HG13 1 1 15 10974 1 1 36 VAL HG21 H 4.708 -1.390 -2.994 1.00 . A A . 36 VAL HG21 1 1 15 10975 1 1 36 VAL HG22 H 3.525 -1.427 -1.681 1.00 . A A . 36 VAL HG22 1 1 15 10976 1 1 36 VAL HG23 H 3.040 -0.853 -3.268 1.00 . A A . 36 VAL HG23 1 1 15 10977 1 1 36 VAL N N 2.686 -2.294 -5.507 1.00 . A A . 36 VAL N 1 1 15 10978 1 1 36 VAL O O 2.030 -4.906 -5.443 1.00 . A A . 36 VAL O 1 1 15 10979 1 1 37 SER C C 3.721 -7.587 -3.891 1.00 . A A . 37 SER C 1 1 15 10980 1 1 37 SER CA C 3.891 -6.890 -5.225 1.00 . A A . 37 SER CA 1 1 15 10981 1 1 37 SER CB C 5.084 -7.451 -5.991 1.00 . A A . 37 SER CB 1 1 15 10982 1 1 37 SER H H 5.065 -5.430 -4.658 1.00 . A A . 37 SER H 1 1 15 10983 1 1 37 SER HA H 2.991 -7.006 -5.805 1.00 . A A . 37 SER HA 1 1 15 10984 1 1 37 SER HB2 H 4.946 -8.514 -6.125 1.00 . A A . 37 SER HB2 1 1 15 10985 1 1 37 SER HB3 H 5.159 -6.983 -6.963 1.00 . A A . 37 SER HB3 1 1 15 10986 1 1 37 SER HG H 7.037 -7.501 -5.809 1.00 . A A . 37 SER HG 1 1 15 10987 1 1 37 SER N N 4.132 -5.517 -4.954 1.00 . A A . 37 SER N 1 1 15 10988 1 1 37 SER O O 4.311 -7.140 -2.896 1.00 . A A . 37 SER O 1 1 15 10989 1 1 37 SER OG O 6.285 -7.206 -5.273 1.00 . A A . 37 SER OG 1 1 15 10990 1 1 38 PRO C C 3.909 -9.738 -1.808 1.00 . A A . 38 PRO C 1 1 15 10991 1 1 38 PRO CA C 2.639 -9.412 -2.587 1.00 . A A . 38 PRO CA 1 1 15 10992 1 1 38 PRO CB C 1.956 -10.709 -3.068 1.00 . A A . 38 PRO CB 1 1 15 10993 1 1 38 PRO CD C 2.256 -9.324 -4.975 1.00 . A A . 38 PRO CD 1 1 15 10994 1 1 38 PRO CG C 2.229 -10.753 -4.539 1.00 . A A . 38 PRO CG 1 1 15 10995 1 1 38 PRO HA H 1.962 -8.847 -1.962 1.00 . A A . 38 PRO HA 1 1 15 10996 1 1 38 PRO HB2 H 2.383 -11.557 -2.552 1.00 . A A . 38 PRO HB2 1 1 15 10997 1 1 38 PRO HB3 H 0.894 -10.641 -2.873 1.00 . A A . 38 PRO HB3 1 1 15 10998 1 1 38 PRO HD2 H 2.818 -9.239 -5.892 1.00 . A A . 38 PRO HD2 1 1 15 10999 1 1 38 PRO HD3 H 1.265 -8.921 -5.119 1.00 . A A . 38 PRO HD3 1 1 15 11000 1 1 38 PRO HG2 H 3.206 -11.182 -4.706 1.00 . A A . 38 PRO HG2 1 1 15 11001 1 1 38 PRO HG3 H 1.463 -11.304 -5.064 1.00 . A A . 38 PRO HG3 1 1 15 11002 1 1 38 PRO N N 2.926 -8.687 -3.838 1.00 . A A . 38 PRO N 1 1 15 11003 1 1 38 PRO O O 3.972 -9.555 -0.592 1.00 . A A . 38 PRO O 1 1 15 11004 1 1 39 GLU C C 6.829 -9.376 -1.181 1.00 . A A . 39 GLU C 1 1 15 11005 1 1 39 GLU CA C 6.173 -10.536 -1.929 1.00 . A A . 39 GLU CA 1 1 15 11006 1 1 39 GLU CB C 7.128 -11.068 -2.961 1.00 . A A . 39 GLU CB 1 1 15 11007 1 1 39 GLU CD C 7.744 -12.856 -4.593 1.00 . A A . 39 GLU CD 1 1 15 11008 1 1 39 GLU CG C 6.650 -12.283 -3.718 1.00 . A A . 39 GLU CG 1 1 15 11009 1 1 39 GLU H H 4.915 -10.330 -3.492 1.00 . A A . 39 GLU H 1 1 15 11010 1 1 39 GLU HA H 5.979 -11.327 -1.221 1.00 . A A . 39 GLU HA 1 1 15 11011 1 1 39 GLU HB2 H 7.345 -10.275 -3.662 1.00 . A A . 39 GLU HB2 1 1 15 11012 1 1 39 GLU HB3 H 8.024 -11.315 -2.419 1.00 . A A . 39 GLU HB3 1 1 15 11013 1 1 39 GLU HG2 H 6.356 -13.022 -2.991 1.00 . A A . 39 GLU HG2 1 1 15 11014 1 1 39 GLU HG3 H 5.805 -12.012 -4.335 1.00 . A A . 39 GLU HG3 1 1 15 11015 1 1 39 GLU N N 4.935 -10.177 -2.525 1.00 . A A . 39 GLU N 1 1 15 11016 1 1 39 GLU O O 7.436 -9.589 -0.139 1.00 . A A . 39 GLU O 1 1 15 11017 1 1 39 GLU OE1 O 8.035 -12.275 -5.656 1.00 . A A . 39 GLU OE1 1 1 15 11018 1 1 39 GLU OE2 O 8.330 -13.876 -4.205 1.00 . A A . 39 GLU OE2 1 1 15 11019 1 1 40 MET C C 6.737 -6.717 0.286 1.00 . A A . 40 MET C 1 1 15 11020 1 1 40 MET CA C 7.347 -7.018 -1.062 1.00 . A A . 40 MET CA 1 1 15 11021 1 1 40 MET CB C 7.342 -5.760 -1.958 1.00 . A A . 40 MET CB 1 1 15 11022 1 1 40 MET CE C 7.081 -2.543 -2.814 1.00 . A A . 40 MET CE 1 1 15 11023 1 1 40 MET CG C 8.275 -4.675 -1.418 1.00 . A A . 40 MET CG 1 1 15 11024 1 1 40 MET H H 6.099 -7.998 -2.459 1.00 . A A . 40 MET H 1 1 15 11025 1 1 40 MET HA H 8.372 -7.305 -0.883 1.00 . A A . 40 MET HA 1 1 15 11026 1 1 40 MET HB2 H 7.490 -5.963 -3.006 1.00 . A A . 40 MET HB2 1 1 15 11027 1 1 40 MET HB3 H 6.342 -5.364 -1.866 1.00 . A A . 40 MET HB3 1 1 15 11028 1 1 40 MET HE1 H 6.457 -3.239 -3.353 1.00 . A A . 40 MET HE1 1 1 15 11029 1 1 40 MET HE2 H 7.205 -1.653 -3.414 1.00 . A A . 40 MET HE2 1 1 15 11030 1 1 40 MET HE3 H 6.644 -2.273 -1.863 1.00 . A A . 40 MET HE3 1 1 15 11031 1 1 40 MET HG2 H 7.728 -4.246 -0.596 1.00 . A A . 40 MET HG2 1 1 15 11032 1 1 40 MET HG3 H 9.188 -5.130 -1.066 1.00 . A A . 40 MET HG3 1 1 15 11033 1 1 40 MET N N 6.683 -8.148 -1.682 1.00 . A A . 40 MET N 1 1 15 11034 1 1 40 MET O O 7.453 -6.482 1.253 1.00 . A A . 40 MET O 1 1 15 11035 1 1 40 MET SD S 8.656 -3.319 -2.574 1.00 . A A . 40 MET SD 1 1 15 11036 1 1 41 ALA C C 5.046 -7.445 2.709 1.00 . A A . 41 ALA C 1 1 15 11037 1 1 41 ALA CA C 4.656 -6.484 1.572 1.00 . A A . 41 ALA CA 1 1 15 11038 1 1 41 ALA CB C 3.152 -6.615 1.276 1.00 . A A . 41 ALA CB 1 1 15 11039 1 1 41 ALA H H 4.899 -6.946 -0.472 1.00 . A A . 41 ALA H 1 1 15 11040 1 1 41 ALA HA H 4.842 -5.471 1.893 1.00 . A A . 41 ALA HA 1 1 15 11041 1 1 41 ALA HB1 H 2.855 -5.924 0.498 1.00 . A A . 41 ALA HB1 1 1 15 11042 1 1 41 ALA HB2 H 2.572 -6.403 2.161 1.00 . A A . 41 ALA HB2 1 1 15 11043 1 1 41 ALA HB3 H 2.919 -7.616 0.947 1.00 . A A . 41 ALA HB3 1 1 15 11044 1 1 41 ALA N N 5.411 -6.751 0.340 1.00 . A A . 41 ALA N 1 1 15 11045 1 1 41 ALA O O 5.316 -7.018 3.823 1.00 . A A . 41 ALA O 1 1 15 11046 1 1 42 GLU C C 6.852 -9.891 3.744 1.00 . A A . 42 GLU C 1 1 15 11047 1 1 42 GLU CA C 5.360 -9.764 3.386 1.00 . A A . 42 GLU CA 1 1 15 11048 1 1 42 GLU CB C 4.851 -11.113 2.881 1.00 . A A . 42 GLU CB 1 1 15 11049 1 1 42 GLU CD C 2.945 -12.488 2.060 1.00 . A A . 42 GLU CD 1 1 15 11050 1 1 42 GLU CG C 3.370 -11.139 2.564 1.00 . A A . 42 GLU CG 1 1 15 11051 1 1 42 GLU H H 4.864 -8.920 1.462 1.00 . A A . 42 GLU H 1 1 15 11052 1 1 42 GLU HA H 4.814 -9.529 4.290 1.00 . A A . 42 GLU HA 1 1 15 11053 1 1 42 GLU HB2 H 5.399 -11.384 1.990 1.00 . A A . 42 GLU HB2 1 1 15 11054 1 1 42 GLU HB3 H 5.050 -11.854 3.642 1.00 . A A . 42 GLU HB3 1 1 15 11055 1 1 42 GLU HG2 H 2.814 -10.912 3.462 1.00 . A A . 42 GLU HG2 1 1 15 11056 1 1 42 GLU HG3 H 3.153 -10.399 1.805 1.00 . A A . 42 GLU HG3 1 1 15 11057 1 1 42 GLU N N 5.083 -8.718 2.396 1.00 . A A . 42 GLU N 1 1 15 11058 1 1 42 GLU O O 7.203 -10.572 4.716 1.00 . A A . 42 GLU O 1 1 15 11059 1 1 42 GLU OE1 O 3.143 -12.762 0.881 1.00 . A A . 42 GLU OE1 1 1 15 11060 1 1 42 GLU OE2 O 2.406 -13.306 2.860 1.00 . A A . 42 GLU OE2 1 1 15 11061 1 1 43 ASN C C 10.015 -8.295 3.447 1.00 . A A . 43 ASN C 1 1 15 11062 1 1 43 ASN CA C 9.145 -9.518 3.167 1.00 . A A . 43 ASN CA 1 1 15 11063 1 1 43 ASN CB C 9.728 -10.302 2.000 1.00 . A A . 43 ASN CB 1 1 15 11064 1 1 43 ASN CG C 9.226 -11.712 1.909 1.00 . A A . 43 ASN CG 1 1 15 11065 1 1 43 ASN H H 7.422 -8.714 2.230 1.00 . A A . 43 ASN H 1 1 15 11066 1 1 43 ASN HA H 9.228 -10.164 4.028 1.00 . A A . 43 ASN HA 1 1 15 11067 1 1 43 ASN HB2 H 9.479 -9.810 1.075 1.00 . A A . 43 ASN HB2 1 1 15 11068 1 1 43 ASN HB3 H 10.794 -10.329 2.112 1.00 . A A . 43 ASN HB3 1 1 15 11069 1 1 43 ASN HD21 H 7.780 -11.119 0.735 1.00 . A A . 43 ASN HD21 1 1 15 11070 1 1 43 ASN HD22 H 7.861 -12.814 1.111 1.00 . A A . 43 ASN HD22 1 1 15 11071 1 1 43 ASN N N 7.729 -9.286 2.963 1.00 . A A . 43 ASN N 1 1 15 11072 1 1 43 ASN ND2 N 8.185 -11.901 1.181 1.00 . A A . 43 ASN ND2 1 1 15 11073 1 1 43 ASN O O 10.877 -8.356 4.335 1.00 . A A . 43 ASN O 1 1 15 11074 1 1 43 ASN OD1 O 9.799 -12.624 2.488 1.00 . A A . 43 ASN OD1 1 1 15 11075 1 1 44 GLU C C 10.158 -4.756 3.141 1.00 . A A . 44 GLU C 1 1 15 11076 1 1 44 GLU CA C 10.787 -6.111 2.807 1.00 . A A . 44 GLU CA 1 1 15 11077 1 1 44 GLU CB C 11.659 -6.071 1.533 1.00 . A A . 44 GLU CB 1 1 15 11078 1 1 44 GLU CD C 13.318 -7.399 0.091 1.00 . A A . 44 GLU CD 1 1 15 11079 1 1 44 GLU CG C 12.432 -7.387 1.307 1.00 . A A . 44 GLU CG 1 1 15 11080 1 1 44 GLU H H 8.997 -7.096 2.206 1.00 . A A . 44 GLU H 1 1 15 11081 1 1 44 GLU HA H 11.432 -6.370 3.634 1.00 . A A . 44 GLU HA 1 1 15 11082 1 1 44 GLU HB2 H 11.037 -5.880 0.672 1.00 . A A . 44 GLU HB2 1 1 15 11083 1 1 44 GLU HB3 H 12.377 -5.272 1.631 1.00 . A A . 44 GLU HB3 1 1 15 11084 1 1 44 GLU HG2 H 13.068 -7.543 2.167 1.00 . A A . 44 GLU HG2 1 1 15 11085 1 1 44 GLU HG3 H 11.723 -8.201 1.246 1.00 . A A . 44 GLU HG3 1 1 15 11086 1 1 44 GLU N N 9.819 -7.202 2.733 1.00 . A A . 44 GLU N 1 1 15 11087 1 1 44 GLU O O 8.938 -4.617 3.157 1.00 . A A . 44 GLU O 1 1 15 11088 1 1 44 GLU OE1 O 12.846 -7.764 -0.994 1.00 . A A . 44 GLU OE1 1 1 15 11089 1 1 44 GLU OE2 O 14.518 -7.084 0.224 1.00 . A A . 44 GLU OE2 1 1 15 11090 1 1 45 ASP C C 9.831 -1.664 2.800 1.00 . A A . 45 ASP C 1 1 15 11091 1 1 45 ASP CA C 10.592 -2.438 3.867 1.00 . A A . 45 ASP CA 1 1 15 11092 1 1 45 ASP CB C 11.825 -1.592 4.252 1.00 . A A . 45 ASP CB 1 1 15 11093 1 1 45 ASP CG C 12.802 -2.299 5.155 1.00 . A A . 45 ASP CG 1 1 15 11094 1 1 45 ASP H H 11.972 -3.909 3.277 1.00 . A A . 45 ASP H 1 1 15 11095 1 1 45 ASP HA H 9.986 -2.561 4.750 1.00 . A A . 45 ASP HA 1 1 15 11096 1 1 45 ASP HB2 H 12.342 -1.300 3.352 1.00 . A A . 45 ASP HB2 1 1 15 11097 1 1 45 ASP HB3 H 11.487 -0.692 4.746 1.00 . A A . 45 ASP HB3 1 1 15 11098 1 1 45 ASP N N 11.010 -3.766 3.397 1.00 . A A . 45 ASP N 1 1 15 11099 1 1 45 ASP O O 10.387 -1.324 1.743 1.00 . A A . 45 ASP O 1 1 15 11100 1 1 45 ASP OD1 O 13.708 -2.992 4.620 1.00 . A A . 45 ASP OD1 1 1 15 11101 1 1 45 ASP OD2 O 12.727 -2.155 6.382 1.00 . A A . 45 ASP OD2 1 1 15 11102 1 1 46 TYR C C 8.085 0.955 2.468 1.00 . A A . 46 TYR C 1 1 15 11103 1 1 46 TYR CA C 7.838 -0.536 2.161 1.00 . A A . 46 TYR CA 1 1 15 11104 1 1 46 TYR CB C 6.330 -0.881 2.093 1.00 . A A . 46 TYR CB 1 1 15 11105 1 1 46 TYR CD1 C 5.597 0.161 -0.110 1.00 . A A . 46 TYR CD1 1 1 15 11106 1 1 46 TYR CD2 C 4.745 1.071 1.913 1.00 . A A . 46 TYR CD2 1 1 15 11107 1 1 46 TYR CE1 C 4.883 1.109 -0.829 1.00 . A A . 46 TYR CE1 1 1 15 11108 1 1 46 TYR CE2 C 4.059 2.008 1.204 1.00 . A A . 46 TYR CE2 1 1 15 11109 1 1 46 TYR CG C 5.528 0.128 1.283 1.00 . A A . 46 TYR CG 1 1 15 11110 1 1 46 TYR CZ C 4.124 2.019 -0.153 1.00 . A A . 46 TYR CZ 1 1 15 11111 1 1 46 TYR H H 8.165 -1.849 3.807 1.00 . A A . 46 TYR H 1 1 15 11112 1 1 46 TYR HA H 8.271 -0.703 1.184 1.00 . A A . 46 TYR HA 1 1 15 11113 1 1 46 TYR HB2 H 6.200 -1.823 1.579 1.00 . A A . 46 TYR HB2 1 1 15 11114 1 1 46 TYR HB3 H 5.900 -0.935 3.080 1.00 . A A . 46 TYR HB3 1 1 15 11115 1 1 46 TYR HD1 H 6.209 -0.570 -0.620 1.00 . A A . 46 TYR HD1 1 1 15 11116 1 1 46 TYR HD2 H 4.683 1.062 2.991 1.00 . A A . 46 TYR HD2 1 1 15 11117 1 1 46 TYR HE1 H 4.884 1.158 -1.910 1.00 . A A . 46 TYR HE1 1 1 15 11118 1 1 46 TYR HE2 H 3.446 2.739 1.708 1.00 . A A . 46 TYR HE2 1 1 15 11119 1 1 46 TYR HH H 3.474 3.798 -0.352 1.00 . A A . 46 TYR HH 1 1 15 11120 1 1 46 TYR N N 8.578 -1.392 3.047 1.00 . A A . 46 TYR N 1 1 15 11121 1 1 46 TYR O O 7.615 1.508 3.465 1.00 . A A . 46 TYR O 1 1 15 11122 1 1 46 TYR OH O 3.460 2.971 -0.840 1.00 . A A . 46 TYR OH 1 1 15 11123 1 1 47 ILE C C 8.177 3.640 0.654 1.00 . A A . 47 ILE C 1 1 15 11124 1 1 47 ILE CA C 9.117 2.986 1.673 1.00 . A A . 47 ILE CA 1 1 15 11125 1 1 47 ILE CB C 10.610 3.273 1.288 1.00 . A A . 47 ILE CB 1 1 15 11126 1 1 47 ILE CD1 C 11.441 2.777 3.694 1.00 . A A . 47 ILE CD1 1 1 15 11127 1 1 47 ILE CG1 C 11.578 2.476 2.199 1.00 . A A . 47 ILE CG1 1 1 15 11128 1 1 47 ILE CG2 C 10.928 4.761 1.367 1.00 . A A . 47 ILE CG2 1 1 15 11129 1 1 47 ILE H H 9.211 0.965 0.938 1.00 . A A . 47 ILE H 1 1 15 11130 1 1 47 ILE HA H 8.907 3.349 2.670 1.00 . A A . 47 ILE HA 1 1 15 11131 1 1 47 ILE HB H 10.761 2.945 0.269 1.00 . A A . 47 ILE HB 1 1 15 11132 1 1 47 ILE HD11 H 10.445 2.505 4.018 1.00 . A A . 47 ILE HD11 1 1 15 11133 1 1 47 ILE HD12 H 11.620 3.826 3.884 1.00 . A A . 47 ILE HD12 1 1 15 11134 1 1 47 ILE HD13 H 12.172 2.194 4.232 1.00 . A A . 47 ILE HD13 1 1 15 11135 1 1 47 ILE HG12 H 11.397 1.419 2.070 1.00 . A A . 47 ILE HG12 1 1 15 11136 1 1 47 ILE HG13 H 12.599 2.691 1.913 1.00 . A A . 47 ILE HG13 1 1 15 11137 1 1 47 ILE HG21 H 10.747 5.090 2.383 1.00 . A A . 47 ILE HG21 1 1 15 11138 1 1 47 ILE HG22 H 10.299 5.307 0.683 1.00 . A A . 47 ILE HG22 1 1 15 11139 1 1 47 ILE HG23 H 11.964 4.931 1.115 1.00 . A A . 47 ILE HG23 1 1 15 11140 1 1 47 ILE N N 8.850 1.574 1.616 1.00 . A A . 47 ILE N 1 1 15 11141 1 1 47 ILE O O 7.884 3.040 -0.361 1.00 . A A . 47 ILE O 1 1 15 11142 1 1 48 CYS C C 7.476 6.532 -0.779 1.00 . A A . 48 CYS C 1 1 15 11143 1 1 48 CYS CA C 6.756 5.431 -0.024 1.00 . A A . 48 CYS CA 1 1 15 11144 1 1 48 CYS CB C 5.547 6.052 0.697 1.00 . A A . 48 CYS CB 1 1 15 11145 1 1 48 CYS H H 7.896 5.386 1.685 1.00 . A A . 48 CYS H 1 1 15 11146 1 1 48 CYS HA H 6.409 4.673 -0.709 1.00 . A A . 48 CYS HA 1 1 15 11147 1 1 48 CYS HB2 H 4.756 6.209 -0.019 1.00 . A A . 48 CYS HB2 1 1 15 11148 1 1 48 CYS HB3 H 5.200 5.356 1.442 1.00 . A A . 48 CYS HB3 1 1 15 11149 1 1 48 CYS N N 7.676 4.829 0.915 1.00 . A A . 48 CYS N 1 1 15 11150 1 1 48 CYS O O 8.646 6.834 -0.494 1.00 . A A . 48 CYS O 1 1 15 11151 1 1 48 CYS SG S 5.871 7.639 1.510 1.00 . A A . 48 CYS SG 1 1 15 11152 1 1 49 ILE C C 7.739 9.425 -1.608 1.00 . A A . 49 ILE C 1 1 15 11153 1 1 49 ILE CA C 7.240 8.257 -2.492 1.00 . A A . 49 ILE CA 1 1 15 11154 1 1 49 ILE CB C 6.141 8.725 -3.491 1.00 . A A . 49 ILE CB 1 1 15 11155 1 1 49 ILE CD1 C 5.685 10.282 -5.415 1.00 . A A . 49 ILE CD1 1 1 15 11156 1 1 49 ILE CG1 C 6.627 9.895 -4.317 1.00 . A A . 49 ILE CG1 1 1 15 11157 1 1 49 ILE CG2 C 4.820 9.045 -2.793 1.00 . A A . 49 ILE CG2 1 1 15 11158 1 1 49 ILE H H 5.859 6.808 -1.858 1.00 . A A . 49 ILE H 1 1 15 11159 1 1 49 ILE HA H 8.078 7.911 -3.081 1.00 . A A . 49 ILE HA 1 1 15 11160 1 1 49 ILE HB H 5.943 7.897 -4.158 1.00 . A A . 49 ILE HB 1 1 15 11161 1 1 49 ILE HD11 H 5.610 9.429 -6.075 1.00 . A A . 49 ILE HD11 1 1 15 11162 1 1 49 ILE HD12 H 6.079 11.124 -5.966 1.00 . A A . 49 ILE HD12 1 1 15 11163 1 1 49 ILE HD13 H 4.701 10.493 -5.023 1.00 . A A . 49 ILE HD13 1 1 15 11164 1 1 49 ILE HG12 H 6.752 10.733 -3.647 1.00 . A A . 49 ILE HG12 1 1 15 11165 1 1 49 ILE HG13 H 7.576 9.620 -4.756 1.00 . A A . 49 ILE HG13 1 1 15 11166 1 1 49 ILE HG21 H 4.978 9.809 -2.047 1.00 . A A . 49 ILE HG21 1 1 15 11167 1 1 49 ILE HG22 H 4.447 8.153 -2.315 1.00 . A A . 49 ILE HG22 1 1 15 11168 1 1 49 ILE HG23 H 4.120 9.397 -3.535 1.00 . A A . 49 ILE HG23 1 1 15 11169 1 1 49 ILE N N 6.760 7.146 -1.699 1.00 . A A . 49 ILE N 1 1 15 11170 1 1 49 ILE O O 8.785 9.995 -1.869 1.00 . A A . 49 ILE O 1 1 15 11171 1 1 50 ASN C C 8.506 10.413 1.311 1.00 . A A . 50 ASN C 1 1 15 11172 1 1 50 ASN CA C 7.340 10.802 0.398 1.00 . A A . 50 ASN CA 1 1 15 11173 1 1 50 ASN CB C 6.119 11.205 1.239 1.00 . A A . 50 ASN CB 1 1 15 11174 1 1 50 ASN CG C 4.986 11.785 0.417 1.00 . A A . 50 ASN CG 1 1 15 11175 1 1 50 ASN H H 6.195 9.184 -0.361 1.00 . A A . 50 ASN H 1 1 15 11176 1 1 50 ASN HA H 7.642 11.653 -0.197 1.00 . A A . 50 ASN HA 1 1 15 11177 1 1 50 ASN HB2 H 5.741 10.338 1.755 1.00 . A A . 50 ASN HB2 1 1 15 11178 1 1 50 ASN HB3 H 6.430 11.955 1.947 1.00 . A A . 50 ASN HB3 1 1 15 11179 1 1 50 ASN HD21 H 5.667 13.620 0.735 1.00 . A A . 50 ASN HD21 1 1 15 11180 1 1 50 ASN HD22 H 4.230 13.509 -0.210 1.00 . A A . 50 ASN HD22 1 1 15 11181 1 1 50 ASN N N 7.001 9.717 -0.531 1.00 . A A . 50 ASN N 1 1 15 11182 1 1 50 ASN ND2 N 4.962 13.094 0.294 1.00 . A A . 50 ASN ND2 1 1 15 11183 1 1 50 ASN O O 9.391 11.222 1.582 1.00 . A A . 50 ASN O 1 1 15 11184 1 1 50 ASN OD1 O 4.122 11.059 -0.083 1.00 . A A . 50 ASN OD1 1 1 15 11185 1 1 51 CYS C C 10.936 8.655 1.940 1.00 . A A . 51 CYS C 1 1 15 11186 1 1 51 CYS CA C 9.571 8.650 2.639 1.00 . A A . 51 CYS CA 1 1 15 11187 1 1 51 CYS CB C 9.266 7.222 3.167 1.00 . A A . 51 CYS CB 1 1 15 11188 1 1 51 CYS H H 7.766 8.580 1.484 1.00 . A A . 51 CYS H 1 1 15 11189 1 1 51 CYS HA H 9.626 9.319 3.484 1.00 . A A . 51 CYS HA 1 1 15 11190 1 1 51 CYS HB2 H 8.913 6.616 2.347 1.00 . A A . 51 CYS HB2 1 1 15 11191 1 1 51 CYS HB3 H 10.193 6.797 3.527 1.00 . A A . 51 CYS HB3 1 1 15 11192 1 1 51 CYS N N 8.506 9.153 1.768 1.00 . A A . 51 CYS N 1 1 15 11193 1 1 51 CYS O O 11.963 8.828 2.587 1.00 . A A . 51 CYS O 1 1 15 11194 1 1 51 CYS SG S 8.037 7.071 4.505 1.00 . A A . 51 CYS SG 1 1 15 11195 1 1 52 ALA C C 12.782 9.761 -0.418 1.00 . A A . 52 ALA C 1 1 15 11196 1 1 52 ALA CA C 12.174 8.382 -0.125 1.00 . A A . 52 ALA CA 1 1 15 11197 1 1 52 ALA CB C 11.938 7.602 -1.409 1.00 . A A . 52 ALA CB 1 1 15 11198 1 1 52 ALA H H 10.054 8.515 0.186 1.00 . A A . 52 ALA H 1 1 15 11199 1 1 52 ALA HA H 12.867 7.819 0.484 1.00 . A A . 52 ALA HA 1 1 15 11200 1 1 52 ALA HB1 H 11.270 8.165 -2.044 1.00 . A A . 52 ALA HB1 1 1 15 11201 1 1 52 ALA HB2 H 11.510 6.636 -1.180 1.00 . A A . 52 ALA HB2 1 1 15 11202 1 1 52 ALA HB3 H 12.887 7.452 -1.899 1.00 . A A . 52 ALA HB3 1 1 15 11203 1 1 52 ALA N N 10.931 8.493 0.630 1.00 . A A . 52 ALA N 1 1 15 11204 2 2 1 ZN ZN ZN 5.914 7.437 3.783 1.00 . B A . 53 ZN ZN 1 1 15 11205 3 2 1 ZN ZN ZN -5.005 3.222 -1.904 1.00 . C A . 54 ZN ZN 1 1 16 11206 1 1 1 SER C C -11.632 6.281 1.930 1.00 . A A . 1 SER C 1 1 16 11207 1 1 1 SER CA C -12.548 6.479 3.164 1.00 . A A . 1 SER CA 1 1 16 11208 1 1 1 SER CB C -13.420 7.741 2.992 1.00 . A A . 1 SER CB 1 1 16 11209 1 1 1 SER HA H -13.182 5.609 3.263 1.00 . A A . 1 SER HA 1 1 16 11210 1 1 1 SER HB2 H -12.776 8.602 2.879 1.00 . A A . 1 SER HB2 1 1 16 11211 1 1 1 SER HB3 H -14.046 7.632 2.118 1.00 . A A . 1 SER HB3 1 1 16 11212 1 1 1 SER HG H -13.857 7.491 4.883 1.00 . A A . 1 SER HG 1 1 16 11213 1 1 1 SER N N -11.731 6.603 4.399 1.00 . A A . 1 SER N 1 1 16 11214 1 1 1 SER O O -11.982 5.553 0.973 1.00 . A A . 1 SER O 1 1 16 11215 1 1 1 SER OG O -14.249 7.960 4.136 1.00 . A A . 1 SER OG 1 1 16 11216 1 1 2 VAL C C -8.131 6.589 1.616 1.00 . A A . 2 VAL C 1 1 16 11217 1 1 2 VAL CA C -9.471 6.851 0.931 1.00 . A A . 2 VAL CA 1 1 16 11218 1 1 2 VAL CB C -9.402 8.181 0.100 1.00 . A A . 2 VAL CB 1 1 16 11219 1 1 2 VAL CG1 C -8.349 8.086 -0.989 1.00 . A A . 2 VAL CG1 1 1 16 11220 1 1 2 VAL CG2 C -10.757 8.497 -0.517 1.00 . A A . 2 VAL CG2 1 1 16 11221 1 1 2 VAL H H -10.248 7.466 2.759 1.00 . A A . 2 VAL H 1 1 16 11222 1 1 2 VAL HA H -9.703 6.019 0.285 1.00 . A A . 2 VAL HA 1 1 16 11223 1 1 2 VAL HB H -9.140 8.991 0.767 1.00 . A A . 2 VAL HB 1 1 16 11224 1 1 2 VAL HG11 H -7.386 7.913 -0.527 1.00 . A A . 2 VAL HG11 1 1 16 11225 1 1 2 VAL HG12 H -8.348 9.008 -1.549 1.00 . A A . 2 VAL HG12 1 1 16 11226 1 1 2 VAL HG13 H -8.594 7.268 -1.650 1.00 . A A . 2 VAL HG13 1 1 16 11227 1 1 2 VAL HG21 H -11.031 7.701 -1.192 1.00 . A A . 2 VAL HG21 1 1 16 11228 1 1 2 VAL HG22 H -10.685 9.429 -1.060 1.00 . A A . 2 VAL HG22 1 1 16 11229 1 1 2 VAL HG23 H -11.501 8.572 0.264 1.00 . A A . 2 VAL HG23 1 1 16 11230 1 1 2 VAL N N -10.478 6.925 1.972 1.00 . A A . 2 VAL N 1 1 16 11231 1 1 2 VAL O O -7.892 7.131 2.689 1.00 . A A . 2 VAL O 1 1 16 11232 1 1 3 CYS C C -4.968 6.469 1.214 1.00 . A A . 3 CYS C 1 1 16 11233 1 1 3 CYS CA C -6.003 5.430 1.678 1.00 . A A . 3 CYS CA 1 1 16 11234 1 1 3 CYS CB C -5.520 4.018 1.266 1.00 . A A . 3 CYS CB 1 1 16 11235 1 1 3 CYS H H -7.485 5.307 0.187 1.00 . A A . 3 CYS H 1 1 16 11236 1 1 3 CYS HA H -6.114 5.486 2.750 1.00 . A A . 3 CYS HA 1 1 16 11237 1 1 3 CYS HB2 H -4.959 3.587 2.080 1.00 . A A . 3 CYS HB2 1 1 16 11238 1 1 3 CYS HB3 H -6.387 3.408 1.052 1.00 . A A . 3 CYS HB3 1 1 16 11239 1 1 3 CYS N N -7.286 5.737 1.040 1.00 . A A . 3 CYS N 1 1 16 11240 1 1 3 CYS O O -5.313 7.420 0.499 1.00 . A A . 3 CYS O 1 1 16 11241 1 1 3 CYS SG S -4.431 3.993 -0.191 1.00 . A A . 3 CYS SG 1 1 16 11242 1 1 4 ALA C C -2.060 6.452 -0.098 1.00 . A A . 4 ALA C 1 1 16 11243 1 1 4 ALA CA C -2.679 7.115 1.119 1.00 . A A . 4 ALA CA 1 1 16 11244 1 1 4 ALA CB C -1.623 7.303 2.198 1.00 . A A . 4 ALA CB 1 1 16 11245 1 1 4 ALA H H -3.504 5.501 2.147 1.00 . A A . 4 ALA H 1 1 16 11246 1 1 4 ALA HA H -3.088 8.075 0.849 1.00 . A A . 4 ALA HA 1 1 16 11247 1 1 4 ALA HB1 H -1.243 6.339 2.501 1.00 . A A . 4 ALA HB1 1 1 16 11248 1 1 4 ALA HB2 H -2.028 7.817 3.055 1.00 . A A . 4 ALA HB2 1 1 16 11249 1 1 4 ALA HB3 H -0.801 7.877 1.801 1.00 . A A . 4 ALA HB3 1 1 16 11250 1 1 4 ALA N N -3.724 6.276 1.586 1.00 . A A . 4 ALA N 1 1 16 11251 1 1 4 ALA O O -1.650 5.321 -0.028 1.00 . A A . 4 ALA O 1 1 16 11252 1 1 5 ALA C C -1.579 7.833 -3.421 1.00 . A A . 5 ALA C 1 1 16 11253 1 1 5 ALA CA C -1.415 6.727 -2.442 1.00 . A A . 5 ALA CA 1 1 16 11254 1 1 5 ALA CB C -1.974 5.419 -3.042 1.00 . A A . 5 ALA CB 1 1 16 11255 1 1 5 ALA H H -2.684 7.919 -1.272 1.00 . A A . 5 ALA H 1 1 16 11256 1 1 5 ALA HA H -0.364 6.603 -2.221 1.00 . A A . 5 ALA HA 1 1 16 11257 1 1 5 ALA HB1 H -1.879 4.613 -2.331 1.00 . A A . 5 ALA HB1 1 1 16 11258 1 1 5 ALA HB2 H -1.432 5.130 -3.933 1.00 . A A . 5 ALA HB2 1 1 16 11259 1 1 5 ALA HB3 H -3.014 5.534 -3.304 1.00 . A A . 5 ALA HB3 1 1 16 11260 1 1 5 ALA N N -2.104 7.129 -1.219 1.00 . A A . 5 ALA N 1 1 16 11261 1 1 5 ALA O O -2.633 8.466 -3.439 1.00 . A A . 5 ALA O 1 1 16 11262 1 1 6 GLN C C -1.808 8.905 -6.138 1.00 . A A . 6 GLN C 1 1 16 11263 1 1 6 GLN CA C -0.566 9.136 -5.254 1.00 . A A . 6 GLN CA 1 1 16 11264 1 1 6 GLN CB C 0.703 8.954 -6.122 1.00 . A A . 6 GLN CB 1 1 16 11265 1 1 6 GLN CD C 2.012 9.589 -8.176 1.00 . A A . 6 GLN CD 1 1 16 11266 1 1 6 GLN CG C 0.939 10.007 -7.190 1.00 . A A . 6 GLN CG 1 1 16 11267 1 1 6 GLN H H 0.374 7.780 -4.010 1.00 . A A . 6 GLN H 1 1 16 11268 1 1 6 GLN HA H -0.562 10.121 -4.819 1.00 . A A . 6 GLN HA 1 1 16 11269 1 1 6 GLN HB2 H 1.571 8.968 -5.484 1.00 . A A . 6 GLN HB2 1 1 16 11270 1 1 6 GLN HB3 H 0.654 7.991 -6.607 1.00 . A A . 6 GLN HB3 1 1 16 11271 1 1 6 GLN HE21 H 3.436 10.398 -7.066 1.00 . A A . 6 GLN HE21 1 1 16 11272 1 1 6 GLN HE22 H 3.917 9.632 -8.543 1.00 . A A . 6 GLN HE22 1 1 16 11273 1 1 6 GLN HG2 H 0.037 10.232 -7.726 1.00 . A A . 6 GLN HG2 1 1 16 11274 1 1 6 GLN HG3 H 1.278 10.908 -6.700 1.00 . A A . 6 GLN HG3 1 1 16 11275 1 1 6 GLN N N -0.526 8.119 -4.187 1.00 . A A . 6 GLN N 1 1 16 11276 1 1 6 GLN NE2 N 3.236 9.907 -7.892 1.00 . A A . 6 GLN NE2 1 1 16 11277 1 1 6 GLN O O -2.528 9.834 -6.474 1.00 . A A . 6 GLN O 1 1 16 11278 1 1 6 GLN OE1 O 1.730 8.974 -9.184 1.00 . A A . 6 GLN OE1 1 1 16 11279 1 1 7 ASN C C -3.936 6.126 -6.523 1.00 . A A . 7 ASN C 1 1 16 11280 1 1 7 ASN CA C -3.197 7.240 -7.242 1.00 . A A . 7 ASN CA 1 1 16 11281 1 1 7 ASN CB C -2.768 6.727 -8.639 1.00 . A A . 7 ASN CB 1 1 16 11282 1 1 7 ASN CG C -2.011 7.751 -9.480 1.00 . A A . 7 ASN CG 1 1 16 11283 1 1 7 ASN H H -1.325 7.074 -6.135 1.00 . A A . 7 ASN H 1 1 16 11284 1 1 7 ASN HA H -3.842 8.095 -7.367 1.00 . A A . 7 ASN HA 1 1 16 11285 1 1 7 ASN HB2 H -2.126 5.868 -8.506 1.00 . A A . 7 ASN HB2 1 1 16 11286 1 1 7 ASN HB3 H -3.653 6.421 -9.181 1.00 . A A . 7 ASN HB3 1 1 16 11287 1 1 7 ASN HD21 H -1.031 6.301 -10.392 1.00 . A A . 7 ASN HD21 1 1 16 11288 1 1 7 ASN HD22 H -0.608 7.915 -10.843 1.00 . A A . 7 ASN HD22 1 1 16 11289 1 1 7 ASN N N -2.044 7.648 -6.462 1.00 . A A . 7 ASN N 1 1 16 11290 1 1 7 ASN ND2 N -1.134 7.270 -10.331 1.00 . A A . 7 ASN ND2 1 1 16 11291 1 1 7 ASN O O -3.473 4.991 -6.495 1.00 . A A . 7 ASN O 1 1 16 11292 1 1 7 ASN OD1 O -2.217 8.951 -9.373 1.00 . A A . 7 ASN OD1 1 1 16 11293 1 1 8 CYS C C -6.988 4.894 -6.025 1.00 . A A . 8 CYS C 1 1 16 11294 1 1 8 CYS CA C -5.758 5.340 -5.264 1.00 . A A . 8 CYS CA 1 1 16 11295 1 1 8 CYS CB C -6.057 5.585 -3.782 1.00 . A A . 8 CYS CB 1 1 16 11296 1 1 8 CYS H H -5.438 7.316 -5.919 1.00 . A A . 8 CYS H 1 1 16 11297 1 1 8 CYS HA H -5.051 4.531 -5.331 1.00 . A A . 8 CYS HA 1 1 16 11298 1 1 8 CYS HB2 H -5.138 5.807 -3.261 1.00 . A A . 8 CYS HB2 1 1 16 11299 1 1 8 CYS HB3 H -6.736 6.418 -3.687 1.00 . A A . 8 CYS HB3 1 1 16 11300 1 1 8 CYS N N -5.064 6.410 -5.917 1.00 . A A . 8 CYS N 1 1 16 11301 1 1 8 CYS O O -7.871 5.678 -6.341 1.00 . A A . 8 CYS O 1 1 16 11302 1 1 8 CYS SG S -6.845 4.140 -2.977 1.00 . A A . 8 CYS SG 1 1 16 11303 1 1 9 GLN C C -9.271 2.638 -6.039 1.00 . A A . 9 GLN C 1 1 16 11304 1 1 9 GLN CA C -8.107 2.948 -7.008 1.00 . A A . 9 GLN CA 1 1 16 11305 1 1 9 GLN CB C -7.575 1.636 -7.610 1.00 . A A . 9 GLN CB 1 1 16 11306 1 1 9 GLN CD C -5.854 0.495 -9.078 1.00 . A A . 9 GLN CD 1 1 16 11307 1 1 9 GLN CG C -6.378 1.809 -8.536 1.00 . A A . 9 GLN CG 1 1 16 11308 1 1 9 GLN H H -6.213 3.119 -6.027 1.00 . A A . 9 GLN H 1 1 16 11309 1 1 9 GLN HA H -8.455 3.582 -7.809 1.00 . A A . 9 GLN HA 1 1 16 11310 1 1 9 GLN HB2 H -7.267 1.001 -6.795 1.00 . A A . 9 GLN HB2 1 1 16 11311 1 1 9 GLN HB3 H -8.350 1.119 -8.154 1.00 . A A . 9 GLN HB3 1 1 16 11312 1 1 9 GLN HE21 H -4.024 1.235 -9.162 1.00 . A A . 9 GLN HE21 1 1 16 11313 1 1 9 GLN HE22 H -4.223 -0.388 -9.711 1.00 . A A . 9 GLN HE22 1 1 16 11314 1 1 9 GLN HG2 H -6.635 2.445 -9.370 1.00 . A A . 9 GLN HG2 1 1 16 11315 1 1 9 GLN HG3 H -5.586 2.279 -7.973 1.00 . A A . 9 GLN HG3 1 1 16 11316 1 1 9 GLN N N -7.013 3.612 -6.301 1.00 . A A . 9 GLN N 1 1 16 11317 1 1 9 GLN NE2 N -4.573 0.446 -9.335 1.00 . A A . 9 GLN NE2 1 1 16 11318 1 1 9 GLN O O -10.333 2.179 -6.448 1.00 . A A . 9 GLN O 1 1 16 11319 1 1 9 GLN OE1 O -6.589 -0.461 -9.248 1.00 . A A . 9 GLN OE1 1 1 16 11320 1 1 10 ARG C C -10.490 1.135 -3.609 1.00 . A A . 10 ARG C 1 1 16 11321 1 1 10 ARG CA C -9.980 2.619 -3.641 1.00 . A A . 10 ARG CA 1 1 16 11322 1 1 10 ARG CB C -11.170 3.594 -3.697 1.00 . A A . 10 ARG CB 1 1 16 11323 1 1 10 ARG CD C -12.023 5.948 -3.616 1.00 . A A . 10 ARG CD 1 1 16 11324 1 1 10 ARG CG C -10.798 5.052 -3.481 1.00 . A A . 10 ARG CG 1 1 16 11325 1 1 10 ARG CZ C -14.409 5.781 -2.857 1.00 . A A . 10 ARG CZ 1 1 16 11326 1 1 10 ARG H H -8.183 3.346 -4.540 1.00 . A A . 10 ARG H 1 1 16 11327 1 1 10 ARG HA H -9.436 2.802 -2.725 1.00 . A A . 10 ARG HA 1 1 16 11328 1 1 10 ARG HB2 H -11.650 3.508 -4.661 1.00 . A A . 10 ARG HB2 1 1 16 11329 1 1 10 ARG HB3 H -11.878 3.316 -2.928 1.00 . A A . 10 ARG HB3 1 1 16 11330 1 1 10 ARG HD2 H -11.722 6.970 -3.443 1.00 . A A . 10 ARG HD2 1 1 16 11331 1 1 10 ARG HD3 H -12.410 5.856 -4.620 1.00 . A A . 10 ARG HD3 1 1 16 11332 1 1 10 ARG HE H -12.748 5.178 -1.824 1.00 . A A . 10 ARG HE 1 1 16 11333 1 1 10 ARG HG2 H -10.395 5.151 -2.483 1.00 . A A . 10 ARG HG2 1 1 16 11334 1 1 10 ARG HG3 H -10.050 5.349 -4.198 1.00 . A A . 10 ARG HG3 1 1 16 11335 1 1 10 ARG HH11 H -14.161 6.592 -4.696 1.00 . A A . 10 ARG HH11 1 1 16 11336 1 1 10 ARG HH12 H -15.782 6.497 -4.227 1.00 . A A . 10 ARG HH12 1 1 16 11337 1 1 10 ARG HH21 H -15.021 4.999 -1.057 1.00 . A A . 10 ARG HH21 1 1 16 11338 1 1 10 ARG HH22 H -16.294 5.559 -2.030 1.00 . A A . 10 ARG HH22 1 1 16 11339 1 1 10 ARG N N -9.031 2.902 -4.746 1.00 . A A . 10 ARG N 1 1 16 11340 1 1 10 ARG NE N -13.086 5.580 -2.653 1.00 . A A . 10 ARG NE 1 1 16 11341 1 1 10 ARG NH1 N -14.824 6.323 -3.994 1.00 . A A . 10 ARG NH1 1 1 16 11342 1 1 10 ARG NH2 N -15.305 5.419 -1.921 1.00 . A A . 10 ARG NH2 1 1 16 11343 1 1 10 ARG O O -11.640 0.901 -3.257 1.00 . A A . 10 ARG O 1 1 16 11344 1 1 11 PRO C C -10.358 -1.866 -2.566 1.00 . A A . 11 PRO C 1 1 16 11345 1 1 11 PRO CA C -10.069 -1.283 -3.950 1.00 . A A . 11 PRO CA 1 1 16 11346 1 1 11 PRO CB C -8.878 -2.026 -4.582 1.00 . A A . 11 PRO CB 1 1 16 11347 1 1 11 PRO CD C -8.181 0.181 -4.082 1.00 . A A . 11 PRO CD 1 1 16 11348 1 1 11 PRO CG C -7.932 -0.959 -5.006 1.00 . A A . 11 PRO CG 1 1 16 11349 1 1 11 PRO HA H -10.941 -1.383 -4.579 1.00 . A A . 11 PRO HA 1 1 16 11350 1 1 11 PRO HB2 H -8.433 -2.646 -3.818 1.00 . A A . 11 PRO HB2 1 1 16 11351 1 1 11 PRO HB3 H -9.217 -2.625 -5.413 1.00 . A A . 11 PRO HB3 1 1 16 11352 1 1 11 PRO HD2 H -7.656 0.043 -3.149 1.00 . A A . 11 PRO HD2 1 1 16 11353 1 1 11 PRO HD3 H -7.904 1.122 -4.534 1.00 . A A . 11 PRO HD3 1 1 16 11354 1 1 11 PRO HG2 H -6.912 -1.305 -4.917 1.00 . A A . 11 PRO HG2 1 1 16 11355 1 1 11 PRO HG3 H -8.154 -0.679 -6.024 1.00 . A A . 11 PRO HG3 1 1 16 11356 1 1 11 PRO N N -9.618 0.104 -3.878 1.00 . A A . 11 PRO N 1 1 16 11357 1 1 11 PRO O O -9.548 -1.713 -1.627 1.00 . A A . 11 PRO O 1 1 16 11358 1 1 12 CYS C C -12.232 -4.616 -1.487 1.00 . A A . 12 CYS C 1 1 16 11359 1 1 12 CYS CA C -11.891 -3.151 -1.220 1.00 . A A . 12 CYS CA 1 1 16 11360 1 1 12 CYS CB C -13.120 -2.416 -0.669 1.00 . A A . 12 CYS CB 1 1 16 11361 1 1 12 CYS H H -12.081 -2.622 -3.214 1.00 . A A . 12 CYS H 1 1 16 11362 1 1 12 CYS HA H -11.085 -3.081 -0.503 1.00 . A A . 12 CYS HA 1 1 16 11363 1 1 12 CYS HB2 H -12.880 -1.378 -0.500 1.00 . A A . 12 CYS HB2 1 1 16 11364 1 1 12 CYS HB3 H -13.899 -2.476 -1.410 1.00 . A A . 12 CYS HB3 1 1 16 11365 1 1 12 CYS HG H -14.823 -3.822 0.550 1.00 . A A . 12 CYS HG 1 1 16 11366 1 1 12 CYS N N -11.476 -2.530 -2.450 1.00 . A A . 12 CYS N 1 1 16 11367 1 1 12 CYS O O -13.026 -4.913 -2.386 1.00 . A A . 12 CYS O 1 1 16 11368 1 1 12 CYS SG S -13.767 -3.084 0.874 1.00 . A A . 12 CYS SG 1 1 16 11369 1 1 13 LYS C C -11.619 -7.584 0.489 1.00 . A A . 13 LYS C 1 1 16 11370 1 1 13 LYS CA C -11.838 -6.943 -0.865 1.00 . A A . 13 LYS CA 1 1 16 11371 1 1 13 LYS CB C -10.863 -7.614 -1.867 1.00 . A A . 13 LYS CB 1 1 16 11372 1 1 13 LYS CD C -10.027 -7.994 -4.194 1.00 . A A . 13 LYS CD 1 1 16 11373 1 1 13 LYS CE C -10.128 -7.624 -5.667 1.00 . A A . 13 LYS CE 1 1 16 11374 1 1 13 LYS CG C -10.940 -7.146 -3.311 1.00 . A A . 13 LYS CG 1 1 16 11375 1 1 13 LYS H H -10.953 -5.241 -0.062 1.00 . A A . 13 LYS H 1 1 16 11376 1 1 13 LYS HA H -12.855 -7.117 -1.186 1.00 . A A . 13 LYS HA 1 1 16 11377 1 1 13 LYS HB2 H -9.858 -7.418 -1.522 1.00 . A A . 13 LYS HB2 1 1 16 11378 1 1 13 LYS HB3 H -11.028 -8.681 -1.843 1.00 . A A . 13 LYS HB3 1 1 16 11379 1 1 13 LYS HD2 H -9.007 -7.849 -3.865 1.00 . A A . 13 LYS HD2 1 1 16 11380 1 1 13 LYS HD3 H -10.279 -9.040 -4.069 1.00 . A A . 13 LYS HD3 1 1 16 11381 1 1 13 LYS HE2 H -9.560 -8.340 -6.237 1.00 . A A . 13 LYS HE2 1 1 16 11382 1 1 13 LYS HE3 H -11.164 -7.694 -5.955 1.00 . A A . 13 LYS HE3 1 1 16 11383 1 1 13 LYS HG2 H -11.964 -7.247 -3.635 1.00 . A A . 13 LYS HG2 1 1 16 11384 1 1 13 LYS HG3 H -10.632 -6.110 -3.365 1.00 . A A . 13 LYS HG3 1 1 16 11385 1 1 13 LYS HZ1 H -10.142 -5.534 -5.440 1.00 . A A . 13 LYS HZ1 1 1 16 11386 1 1 13 LYS HZ2 H -9.738 -6.063 -6.983 1.00 . A A . 13 LYS HZ2 1 1 16 11387 1 1 13 LYS HZ3 H -8.599 -6.190 -5.801 1.00 . A A . 13 LYS HZ3 1 1 16 11388 1 1 13 LYS N N -11.601 -5.513 -0.748 1.00 . A A . 13 LYS N 1 1 16 11389 1 1 13 LYS NZ N -9.627 -6.264 -5.966 1.00 . A A . 13 LYS NZ 1 1 16 11390 1 1 13 LYS O O -11.016 -6.975 1.372 1.00 . A A . 13 LYS O 1 1 16 11391 1 1 14 ASP C C -10.458 -10.152 1.841 1.00 . A A . 14 ASP C 1 1 16 11392 1 1 14 ASP CA C -11.857 -9.601 1.872 1.00 . A A . 14 ASP CA 1 1 16 11393 1 1 14 ASP CB C -12.816 -10.791 1.977 1.00 . A A . 14 ASP CB 1 1 16 11394 1 1 14 ASP CG C -14.261 -10.408 2.034 1.00 . A A . 14 ASP CG 1 1 16 11395 1 1 14 ASP H H -12.668 -9.191 -0.059 1.00 . A A . 14 ASP H 1 1 16 11396 1 1 14 ASP HA H -11.996 -8.952 2.725 1.00 . A A . 14 ASP HA 1 1 16 11397 1 1 14 ASP HB2 H -12.687 -11.425 1.113 1.00 . A A . 14 ASP HB2 1 1 16 11398 1 1 14 ASP HB3 H -12.577 -11.357 2.862 1.00 . A A . 14 ASP HB3 1 1 16 11399 1 1 14 ASP N N -12.098 -8.808 0.641 1.00 . A A . 14 ASP N 1 1 16 11400 1 1 14 ASP O O -9.928 -10.607 2.845 1.00 . A A . 14 ASP O 1 1 16 11401 1 1 14 ASP OD1 O -14.838 -10.161 0.961 1.00 . A A . 14 ASP OD1 1 1 16 11402 1 1 14 ASP OD2 O -14.835 -10.386 3.138 1.00 . A A . 14 ASP OD2 1 1 16 11403 1 1 15 LYS C C -7.705 -9.597 -0.269 1.00 . A A . 15 LYS C 1 1 16 11404 1 1 15 LYS CA C -8.552 -10.637 0.456 1.00 . A A . 15 LYS CA 1 1 16 11405 1 1 15 LYS CB C -8.619 -11.940 -0.386 1.00 . A A . 15 LYS CB 1 1 16 11406 1 1 15 LYS CD C -9.445 -14.318 -0.679 1.00 . A A . 15 LYS CD 1 1 16 11407 1 1 15 LYS CE C -10.366 -15.429 -0.174 1.00 . A A . 15 LYS CE 1 1 16 11408 1 1 15 LYS CG C -9.525 -13.054 0.179 1.00 . A A . 15 LYS CG 1 1 16 11409 1 1 15 LYS H H -10.297 -9.627 -0.062 1.00 . A A . 15 LYS H 1 1 16 11410 1 1 15 LYS HA H -8.116 -10.863 1.416 1.00 . A A . 15 LYS HA 1 1 16 11411 1 1 15 LYS HB2 H -8.995 -11.703 -1.372 1.00 . A A . 15 LYS HB2 1 1 16 11412 1 1 15 LYS HB3 H -7.619 -12.336 -0.492 1.00 . A A . 15 LYS HB3 1 1 16 11413 1 1 15 LYS HD2 H -9.722 -14.064 -1.688 1.00 . A A . 15 LYS HD2 1 1 16 11414 1 1 15 LYS HD3 H -8.427 -14.671 -0.675 1.00 . A A . 15 LYS HD3 1 1 16 11415 1 1 15 LYS HE2 H -10.186 -16.314 -0.767 1.00 . A A . 15 LYS HE2 1 1 16 11416 1 1 15 LYS HE3 H -10.136 -15.634 0.861 1.00 . A A . 15 LYS HE3 1 1 16 11417 1 1 15 LYS HG2 H -9.237 -13.287 1.193 1.00 . A A . 15 LYS HG2 1 1 16 11418 1 1 15 LYS HG3 H -10.544 -12.697 0.172 1.00 . A A . 15 LYS HG3 1 1 16 11419 1 1 15 LYS HZ1 H -12.065 -14.190 0.166 1.00 . A A . 15 LYS HZ1 1 1 16 11420 1 1 15 LYS HZ2 H -12.403 -15.851 0.086 1.00 . A A . 15 LYS HZ2 1 1 16 11421 1 1 15 LYS HZ3 H -12.051 -15.009 -1.300 1.00 . A A . 15 LYS HZ3 1 1 16 11422 1 1 15 LYS N N -9.862 -10.100 0.673 1.00 . A A . 15 LYS N 1 1 16 11423 1 1 15 LYS NZ N -11.810 -15.086 -0.292 1.00 . A A . 15 LYS NZ 1 1 16 11424 1 1 15 LYS O O -7.755 -9.501 -1.499 1.00 . A A . 15 LYS O 1 1 16 11425 1 1 16 VAL C C -5.276 -7.070 1.040 1.00 . A A . 16 VAL C 1 1 16 11426 1 1 16 VAL CA C -6.120 -7.730 -0.063 1.00 . A A . 16 VAL CA 1 1 16 11427 1 1 16 VAL CB C -6.868 -6.644 -0.906 1.00 . A A . 16 VAL CB 1 1 16 11428 1 1 16 VAL CG1 C -7.928 -5.958 -0.083 1.00 . A A . 16 VAL CG1 1 1 16 11429 1 1 16 VAL CG2 C -5.874 -5.623 -1.453 1.00 . A A . 16 VAL CG2 1 1 16 11430 1 1 16 VAL H H -7.045 -8.831 1.468 1.00 . A A . 16 VAL H 1 1 16 11431 1 1 16 VAL HA H -5.420 -8.248 -0.704 1.00 . A A . 16 VAL HA 1 1 16 11432 1 1 16 VAL HB H -7.354 -7.122 -1.741 1.00 . A A . 16 VAL HB 1 1 16 11433 1 1 16 VAL HG11 H -8.663 -6.685 0.235 1.00 . A A . 16 VAL HG11 1 1 16 11434 1 1 16 VAL HG12 H -8.392 -5.177 -0.662 1.00 . A A . 16 VAL HG12 1 1 16 11435 1 1 16 VAL HG13 H -7.416 -5.570 0.787 1.00 . A A . 16 VAL HG13 1 1 16 11436 1 1 16 VAL HG21 H -5.103 -6.132 -2.012 1.00 . A A . 16 VAL HG21 1 1 16 11437 1 1 16 VAL HG22 H -5.416 -5.107 -0.624 1.00 . A A . 16 VAL HG22 1 1 16 11438 1 1 16 VAL HG23 H -6.369 -4.901 -2.083 1.00 . A A . 16 VAL HG23 1 1 16 11439 1 1 16 VAL N N -6.998 -8.770 0.492 1.00 . A A . 16 VAL N 1 1 16 11440 1 1 16 VAL O O -5.765 -6.327 1.875 1.00 . A A . 16 VAL O 1 1 16 11441 1 1 17 ASP C C -2.731 -5.454 1.700 1.00 . A A . 17 ASP C 1 1 16 11442 1 1 17 ASP CA C -3.074 -6.920 2.004 1.00 . A A . 17 ASP CA 1 1 16 11443 1 1 17 ASP CB C -1.802 -7.759 1.926 1.00 . A A . 17 ASP CB 1 1 16 11444 1 1 17 ASP CG C -2.084 -9.232 1.960 1.00 . A A . 17 ASP CG 1 1 16 11445 1 1 17 ASP H H -3.849 -8.212 0.500 1.00 . A A . 17 ASP H 1 1 16 11446 1 1 17 ASP HA H -3.470 -7.002 3.005 1.00 . A A . 17 ASP HA 1 1 16 11447 1 1 17 ASP HB2 H -1.291 -7.526 1.008 1.00 . A A . 17 ASP HB2 1 1 16 11448 1 1 17 ASP HB3 H -1.161 -7.514 2.760 1.00 . A A . 17 ASP HB3 1 1 16 11449 1 1 17 ASP N N -4.059 -7.448 1.070 1.00 . A A . 17 ASP N 1 1 16 11450 1 1 17 ASP O O -2.607 -5.046 0.519 1.00 . A A . 17 ASP O 1 1 16 11451 1 1 17 ASP OD1 O -2.329 -9.809 0.864 1.00 . A A . 17 ASP OD1 1 1 16 11452 1 1 17 ASP OD2 O -2.092 -9.813 3.054 1.00 . A A . 17 ASP OD2 1 1 16 11453 1 1 18 TRP C C -0.788 -3.104 3.148 1.00 . A A . 18 TRP C 1 1 16 11454 1 1 18 TRP CA C -2.221 -3.269 2.693 1.00 . A A . 18 TRP CA 1 1 16 11455 1 1 18 TRP CB C -3.128 -2.450 3.624 1.00 . A A . 18 TRP CB 1 1 16 11456 1 1 18 TRP CD1 C -5.395 -3.500 3.037 1.00 . A A . 18 TRP CD1 1 1 16 11457 1 1 18 TRP CD2 C -5.414 -1.276 3.155 1.00 . A A . 18 TRP CD2 1 1 16 11458 1 1 18 TRP CE2 C -6.707 -1.719 2.833 1.00 . A A . 18 TRP CE2 1 1 16 11459 1 1 18 TRP CE3 C -5.183 0.089 3.277 1.00 . A A . 18 TRP CE3 1 1 16 11460 1 1 18 TRP CG C -4.585 -2.431 3.265 1.00 . A A . 18 TRP CG 1 1 16 11461 1 1 18 TRP CH2 C -7.515 0.486 2.786 1.00 . A A . 18 TRP CH2 1 1 16 11462 1 1 18 TRP CZ2 C -7.766 -0.847 2.649 1.00 . A A . 18 TRP CZ2 1 1 16 11463 1 1 18 TRP CZ3 C -6.231 0.957 3.099 1.00 . A A . 18 TRP CZ3 1 1 16 11464 1 1 18 TRP H H -2.688 -5.080 3.646 1.00 . A A . 18 TRP H 1 1 16 11465 1 1 18 TRP HA H -2.320 -2.906 1.681 1.00 . A A . 18 TRP HA 1 1 16 11466 1 1 18 TRP HB2 H -3.052 -2.848 4.625 1.00 . A A . 18 TRP HB2 1 1 16 11467 1 1 18 TRP HB3 H -2.772 -1.432 3.635 1.00 . A A . 18 TRP HB3 1 1 16 11468 1 1 18 TRP HD1 H -5.066 -4.529 3.048 1.00 . A A . 18 TRP HD1 1 1 16 11469 1 1 18 TRP HE1 H -7.411 -3.695 2.561 1.00 . A A . 18 TRP HE1 1 1 16 11470 1 1 18 TRP HE3 H -4.198 0.457 3.521 1.00 . A A . 18 TRP HE3 1 1 16 11471 1 1 18 TRP HH2 H -8.306 1.206 2.650 1.00 . A A . 18 TRP HH2 1 1 16 11472 1 1 18 TRP HZ2 H -8.753 -1.207 2.408 1.00 . A A . 18 TRP HZ2 1 1 16 11473 1 1 18 TRP HZ3 H -6.072 2.023 3.195 1.00 . A A . 18 TRP HZ3 1 1 16 11474 1 1 18 TRP N N -2.575 -4.684 2.755 1.00 . A A . 18 TRP N 1 1 16 11475 1 1 18 TRP NE1 N -6.665 -3.079 2.759 1.00 . A A . 18 TRP NE1 1 1 16 11476 1 1 18 TRP O O -0.262 -3.970 3.833 1.00 . A A . 18 TRP O 1 1 16 11477 1 1 19 VAL C C 1.337 -0.403 3.880 1.00 . A A . 19 VAL C 1 1 16 11478 1 1 19 VAL CA C 1.214 -1.772 3.207 1.00 . A A . 19 VAL CA 1 1 16 11479 1 1 19 VAL CB C 2.248 -1.887 2.023 1.00 . A A . 19 VAL CB 1 1 16 11480 1 1 19 VAL CG1 C 2.294 -3.295 1.463 1.00 . A A . 19 VAL CG1 1 1 16 11481 1 1 19 VAL CG2 C 1.938 -0.898 0.912 1.00 . A A . 19 VAL CG2 1 1 16 11482 1 1 19 VAL H H -0.551 -1.255 2.303 1.00 . A A . 19 VAL H 1 1 16 11483 1 1 19 VAL HA H 1.454 -2.519 3.949 1.00 . A A . 19 VAL HA 1 1 16 11484 1 1 19 VAL HB H 3.227 -1.658 2.421 1.00 . A A . 19 VAL HB 1 1 16 11485 1 1 19 VAL HG11 H 1.309 -3.577 1.116 1.00 . A A . 19 VAL HG11 1 1 16 11486 1 1 19 VAL HG12 H 2.624 -3.983 2.228 1.00 . A A . 19 VAL HG12 1 1 16 11487 1 1 19 VAL HG13 H 2.984 -3.319 0.632 1.00 . A A . 19 VAL HG13 1 1 16 11488 1 1 19 VAL HG21 H 2.687 -0.991 0.142 1.00 . A A . 19 VAL HG21 1 1 16 11489 1 1 19 VAL HG22 H 1.974 0.102 1.318 1.00 . A A . 19 VAL HG22 1 1 16 11490 1 1 19 VAL HG23 H 0.964 -1.103 0.490 1.00 . A A . 19 VAL HG23 1 1 16 11491 1 1 19 VAL N N -0.159 -2.012 2.794 1.00 . A A . 19 VAL N 1 1 16 11492 1 1 19 VAL O O 0.779 0.582 3.410 1.00 . A A . 19 VAL O 1 1 16 11493 1 1 20 GLN C C 3.653 1.329 5.401 1.00 . A A . 20 GLN C 1 1 16 11494 1 1 20 GLN CA C 2.248 0.863 5.702 1.00 . A A . 20 GLN CA 1 1 16 11495 1 1 20 GLN CB C 2.079 0.644 7.222 1.00 . A A . 20 GLN CB 1 1 16 11496 1 1 20 GLN CD C 2.162 1.667 9.560 1.00 . A A . 20 GLN CD 1 1 16 11497 1 1 20 GLN CG C 2.326 1.896 8.070 1.00 . A A . 20 GLN CG 1 1 16 11498 1 1 20 GLN H H 2.374 -1.193 5.348 1.00 . A A . 20 GLN H 1 1 16 11499 1 1 20 GLN HA H 1.538 1.607 5.367 1.00 . A A . 20 GLN HA 1 1 16 11500 1 1 20 GLN HB2 H 1.059 0.328 7.397 1.00 . A A . 20 GLN HB2 1 1 16 11501 1 1 20 GLN HB3 H 2.756 -0.132 7.549 1.00 . A A . 20 GLN HB3 1 1 16 11502 1 1 20 GLN HE21 H 3.494 3.076 9.977 1.00 . A A . 20 GLN HE21 1 1 16 11503 1 1 20 GLN HE22 H 2.804 2.314 11.318 1.00 . A A . 20 GLN HE22 1 1 16 11504 1 1 20 GLN HG2 H 3.359 2.176 7.924 1.00 . A A . 20 GLN HG2 1 1 16 11505 1 1 20 GLN HG3 H 1.674 2.697 7.748 1.00 . A A . 20 GLN HG3 1 1 16 11506 1 1 20 GLN N N 2.009 -0.361 4.983 1.00 . A A . 20 GLN N 1 1 16 11507 1 1 20 GLN NE2 N 2.878 2.410 10.348 1.00 . A A . 20 GLN NE2 1 1 16 11508 1 1 20 GLN O O 4.562 0.501 5.292 1.00 . A A . 20 GLN O 1 1 16 11509 1 1 20 GLN OE1 O 1.393 0.811 9.998 1.00 . A A . 20 GLN OE1 1 1 16 11510 1 1 21 CYS C C 5.809 3.490 6.317 1.00 . A A . 21 CYS C 1 1 16 11511 1 1 21 CYS CA C 5.175 3.089 4.988 1.00 . A A . 21 CYS CA 1 1 16 11512 1 1 21 CYS CB C 5.234 4.209 3.936 1.00 . A A . 21 CYS CB 1 1 16 11513 1 1 21 CYS H H 3.074 3.227 5.223 1.00 . A A . 21 CYS H 1 1 16 11514 1 1 21 CYS HA H 5.734 2.235 4.634 1.00 . A A . 21 CYS HA 1 1 16 11515 1 1 21 CYS HB2 H 6.240 4.482 3.678 1.00 . A A . 21 CYS HB2 1 1 16 11516 1 1 21 CYS HB3 H 4.748 3.861 3.039 1.00 . A A . 21 CYS HB3 1 1 16 11517 1 1 21 CYS N N 3.844 2.614 5.206 1.00 . A A . 21 CYS N 1 1 16 11518 1 1 21 CYS O O 5.588 4.601 6.838 1.00 . A A . 21 CYS O 1 1 16 11519 1 1 21 CYS SG S 4.432 5.752 4.360 1.00 . A A . 21 CYS SG 1 1 16 11520 1 1 22 ASP C C 8.504 3.606 8.051 1.00 . A A . 22 ASP C 1 1 16 11521 1 1 22 ASP CA C 7.228 2.780 8.156 1.00 . A A . 22 ASP CA 1 1 16 11522 1 1 22 ASP CB C 7.491 1.415 8.842 1.00 . A A . 22 ASP CB 1 1 16 11523 1 1 22 ASP CG C 6.226 0.719 9.351 1.00 . A A . 22 ASP CG 1 1 16 11524 1 1 22 ASP H H 6.854 1.824 6.293 1.00 . A A . 22 ASP H 1 1 16 11525 1 1 22 ASP HA H 6.517 3.332 8.750 1.00 . A A . 22 ASP HA 1 1 16 11526 1 1 22 ASP HB2 H 7.963 0.754 8.131 1.00 . A A . 22 ASP HB2 1 1 16 11527 1 1 22 ASP HB3 H 8.163 1.554 9.679 1.00 . A A . 22 ASP HB3 1 1 16 11528 1 1 22 ASP N N 6.617 2.606 6.843 1.00 . A A . 22 ASP N 1 1 16 11529 1 1 22 ASP O O 9.338 3.611 8.938 1.00 . A A . 22 ASP O 1 1 16 11530 1 1 22 ASP OD1 O 5.487 0.116 8.553 1.00 . A A . 22 ASP OD1 1 1 16 11531 1 1 22 ASP OD2 O 5.973 0.764 10.579 1.00 . A A . 22 ASP OD2 1 1 16 11532 1 1 23 GLY C C 9.520 6.620 7.246 1.00 . A A . 23 GLY C 1 1 16 11533 1 1 23 GLY CA C 9.731 5.203 6.735 1.00 . A A . 23 GLY CA 1 1 16 11534 1 1 23 GLY H H 7.800 4.402 6.399 1.00 . A A . 23 GLY H 1 1 16 11535 1 1 23 GLY HA2 H 10.595 4.770 7.218 1.00 . A A . 23 GLY HA2 1 1 16 11536 1 1 23 GLY HA3 H 9.916 5.253 5.672 1.00 . A A . 23 GLY HA3 1 1 16 11537 1 1 23 GLY N N 8.589 4.384 6.975 1.00 . A A . 23 GLY N 1 1 16 11538 1 1 23 GLY O O 10.425 7.449 7.154 1.00 . A A . 23 GLY O 1 1 16 11539 1 1 24 GLY C C 6.641 8.778 8.229 1.00 . A A . 24 GLY C 1 1 16 11540 1 1 24 GLY CA C 8.089 8.256 8.299 1.00 . A A . 24 GLY CA 1 1 16 11541 1 1 24 GLY H H 7.615 6.235 7.856 1.00 . A A . 24 GLY H 1 1 16 11542 1 1 24 GLY HA2 H 8.401 8.277 9.330 1.00 . A A . 24 GLY HA2 1 1 16 11543 1 1 24 GLY HA3 H 8.721 8.931 7.742 1.00 . A A . 24 GLY HA3 1 1 16 11544 1 1 24 GLY N N 8.314 6.919 7.781 1.00 . A A . 24 GLY N 1 1 16 11545 1 1 24 GLY O O 6.287 9.680 8.977 1.00 . A A . 24 GLY O 1 1 16 11546 1 1 25 CYS C C 3.484 7.919 8.073 1.00 . A A . 25 CYS C 1 1 16 11547 1 1 25 CYS CA C 4.417 8.786 7.246 1.00 . A A . 25 CYS CA 1 1 16 11548 1 1 25 CYS CB C 3.889 8.791 5.811 1.00 . A A . 25 CYS CB 1 1 16 11549 1 1 25 CYS H H 6.107 7.550 6.721 1.00 . A A . 25 CYS H 1 1 16 11550 1 1 25 CYS HA H 4.420 9.795 7.629 1.00 . A A . 25 CYS HA 1 1 16 11551 1 1 25 CYS HB2 H 3.601 7.785 5.544 1.00 . A A . 25 CYS HB2 1 1 16 11552 1 1 25 CYS HB3 H 3.019 9.427 5.760 1.00 . A A . 25 CYS HB3 1 1 16 11553 1 1 25 CYS N N 5.804 8.257 7.322 1.00 . A A . 25 CYS N 1 1 16 11554 1 1 25 CYS O O 2.497 8.411 8.619 1.00 . A A . 25 CYS O 1 1 16 11555 1 1 25 CYS SG S 5.050 9.346 4.561 1.00 . A A . 25 CYS SG 1 1 16 11556 1 1 26 ASP C C 1.590 5.475 8.217 1.00 . A A . 26 ASP C 1 1 16 11557 1 1 26 ASP CA C 2.981 5.596 8.834 1.00 . A A . 26 ASP CA 1 1 16 11558 1 1 26 ASP CB C 2.895 5.853 10.349 1.00 . A A . 26 ASP CB 1 1 16 11559 1 1 26 ASP CG C 4.220 5.675 11.041 1.00 . A A . 26 ASP CG 1 1 16 11560 1 1 26 ASP H H 4.673 6.344 7.760 1.00 . A A . 26 ASP H 1 1 16 11561 1 1 26 ASP HA H 3.474 4.649 8.665 1.00 . A A . 26 ASP HA 1 1 16 11562 1 1 26 ASP HB2 H 2.558 6.859 10.534 1.00 . A A . 26 ASP HB2 1 1 16 11563 1 1 26 ASP HB3 H 2.188 5.161 10.783 1.00 . A A . 26 ASP HB3 1 1 16 11564 1 1 26 ASP N N 3.809 6.612 8.138 1.00 . A A . 26 ASP N 1 1 16 11565 1 1 26 ASP O O 0.680 4.918 8.817 1.00 . A A . 26 ASP O 1 1 16 11566 1 1 26 ASP OD1 O 5.019 6.613 11.047 1.00 . A A . 26 ASP OD1 1 1 16 11567 1 1 26 ASP OD2 O 4.458 4.580 11.598 1.00 . A A . 26 ASP OD2 1 1 16 11568 1 1 27 GLU C C 0.027 4.525 5.587 1.00 . A A . 27 GLU C 1 1 16 11569 1 1 27 GLU CA C 0.196 5.882 6.295 1.00 . A A . 27 GLU CA 1 1 16 11570 1 1 27 GLU CB C 0.054 7.081 5.327 1.00 . A A . 27 GLU CB 1 1 16 11571 1 1 27 GLU CD C -0.228 9.648 5.135 1.00 . A A . 27 GLU CD 1 1 16 11572 1 1 27 GLU CG C -0.026 8.436 6.058 1.00 . A A . 27 GLU CG 1 1 16 11573 1 1 27 GLU H H 2.242 6.312 6.554 1.00 . A A . 27 GLU H 1 1 16 11574 1 1 27 GLU HA H -0.570 5.954 7.052 1.00 . A A . 27 GLU HA 1 1 16 11575 1 1 27 GLU HB2 H 0.916 7.097 4.675 1.00 . A A . 27 GLU HB2 1 1 16 11576 1 1 27 GLU HB3 H -0.842 6.950 4.738 1.00 . A A . 27 GLU HB3 1 1 16 11577 1 1 27 GLU HG2 H -0.862 8.370 6.740 1.00 . A A . 27 GLU HG2 1 1 16 11578 1 1 27 GLU HG3 H 0.884 8.573 6.627 1.00 . A A . 27 GLU HG3 1 1 16 11579 1 1 27 GLU N N 1.455 5.938 6.997 1.00 . A A . 27 GLU N 1 1 16 11580 1 1 27 GLU O O 1.021 3.826 5.334 1.00 . A A . 27 GLU O 1 1 16 11581 1 1 27 GLU OE1 O -1.374 9.875 4.672 1.00 . A A . 27 GLU OE1 1 1 16 11582 1 1 27 GLU OE2 O 0.731 10.379 4.876 1.00 . A A . 27 GLU OE2 1 1 16 11583 1 1 28 TRP C C -1.872 3.000 3.199 1.00 . A A . 28 TRP C 1 1 16 11584 1 1 28 TRP CA C -1.547 2.880 4.679 1.00 . A A . 28 TRP CA 1 1 16 11585 1 1 28 TRP CB C -2.685 2.188 5.427 1.00 . A A . 28 TRP CB 1 1 16 11586 1 1 28 TRP CD1 C -2.278 2.505 7.945 1.00 . A A . 28 TRP CD1 1 1 16 11587 1 1 28 TRP CD2 C -1.889 0.431 7.198 1.00 . A A . 28 TRP CD2 1 1 16 11588 1 1 28 TRP CE2 C -1.628 0.461 8.580 1.00 . A A . 28 TRP CE2 1 1 16 11589 1 1 28 TRP CE3 C -1.720 -0.776 6.510 1.00 . A A . 28 TRP CE3 1 1 16 11590 1 1 28 TRP CG C -2.305 1.746 6.809 1.00 . A A . 28 TRP CG 1 1 16 11591 1 1 28 TRP CH2 C -1.049 -1.817 8.589 1.00 . A A . 28 TRP CH2 1 1 16 11592 1 1 28 TRP CZ2 C -1.212 -0.661 9.285 1.00 . A A . 28 TRP CZ2 1 1 16 11593 1 1 28 TRP CZ3 C -1.301 -1.883 7.208 1.00 . A A . 28 TRP CZ3 1 1 16 11594 1 1 28 TRP H H -1.888 4.858 5.460 1.00 . A A . 28 TRP H 1 1 16 11595 1 1 28 TRP HA H -0.666 2.263 4.763 1.00 . A A . 28 TRP HA 1 1 16 11596 1 1 28 TRP HB2 H -3.539 2.845 5.495 1.00 . A A . 28 TRP HB2 1 1 16 11597 1 1 28 TRP HB3 H -2.973 1.306 4.875 1.00 . A A . 28 TRP HB3 1 1 16 11598 1 1 28 TRP HD1 H -2.535 3.551 7.965 1.00 . A A . 28 TRP HD1 1 1 16 11599 1 1 28 TRP HE1 H -1.751 2.036 9.945 1.00 . A A . 28 TRP HE1 1 1 16 11600 1 1 28 TRP HE3 H -1.898 -0.861 5.449 1.00 . A A . 28 TRP HE3 1 1 16 11601 1 1 28 TRP HH2 H -0.721 -2.703 9.113 1.00 . A A . 28 TRP HH2 1 1 16 11602 1 1 28 TRP HZ2 H -1.019 -0.626 10.348 1.00 . A A . 28 TRP HZ2 1 1 16 11603 1 1 28 TRP HZ3 H -1.172 -2.815 6.678 1.00 . A A . 28 TRP HZ3 1 1 16 11604 1 1 28 TRP N N -1.212 4.174 5.283 1.00 . A A . 28 TRP N 1 1 16 11605 1 1 28 TRP NE1 N -1.860 1.739 9.014 1.00 . A A . 28 TRP NE1 1 1 16 11606 1 1 28 TRP O O -2.722 3.808 2.791 1.00 . A A . 28 TRP O 1 1 16 11607 1 1 29 PHE C C -1.846 0.823 0.533 1.00 . A A . 29 PHE C 1 1 16 11608 1 1 29 PHE CA C -1.325 2.188 0.978 1.00 . A A . 29 PHE CA 1 1 16 11609 1 1 29 PHE CB C 0.079 2.396 0.335 1.00 . A A . 29 PHE CB 1 1 16 11610 1 1 29 PHE CD1 C 1.351 3.675 2.080 1.00 . A A . 29 PHE CD1 1 1 16 11611 1 1 29 PHE CD2 C 1.067 4.712 -0.028 1.00 . A A . 29 PHE CD2 1 1 16 11612 1 1 29 PHE CE1 C 2.040 4.757 2.528 1.00 . A A . 29 PHE CE1 1 1 16 11613 1 1 29 PHE CE2 C 1.761 5.816 0.424 1.00 . A A . 29 PHE CE2 1 1 16 11614 1 1 29 PHE CG C 0.850 3.623 0.807 1.00 . A A . 29 PHE CG 1 1 16 11615 1 1 29 PHE CZ C 2.249 5.831 1.711 1.00 . A A . 29 PHE CZ 1 1 16 11616 1 1 29 PHE H H -0.557 1.563 2.828 1.00 . A A . 29 PHE H 1 1 16 11617 1 1 29 PHE HA H -1.981 2.981 0.657 1.00 . A A . 29 PHE HA 1 1 16 11618 1 1 29 PHE HB2 H 0.699 1.535 0.528 1.00 . A A . 29 PHE HB2 1 1 16 11619 1 1 29 PHE HB3 H -0.053 2.486 -0.731 1.00 . A A . 29 PHE HB3 1 1 16 11620 1 1 29 PHE HD1 H 1.189 2.832 2.731 1.00 . A A . 29 PHE HD1 1 1 16 11621 1 1 29 PHE HD2 H 0.684 4.705 -1.037 1.00 . A A . 29 PHE HD2 1 1 16 11622 1 1 29 PHE HE1 H 2.417 4.767 3.539 1.00 . A A . 29 PHE HE1 1 1 16 11623 1 1 29 PHE HE2 H 1.917 6.661 -0.232 1.00 . A A . 29 PHE HE2 1 1 16 11624 1 1 29 PHE HZ H 2.803 6.666 2.109 1.00 . A A . 29 PHE HZ 1 1 16 11625 1 1 29 PHE N N -1.198 2.191 2.419 1.00 . A A . 29 PHE N 1 1 16 11626 1 1 29 PHE O O -1.686 -0.172 1.244 1.00 . A A . 29 PHE O 1 1 16 11627 1 1 30 HIS C C -1.822 -0.946 -2.157 1.00 . A A . 30 HIS C 1 1 16 11628 1 1 30 HIS CA C -2.904 -0.481 -1.236 1.00 . A A . 30 HIS CA 1 1 16 11629 1 1 30 HIS CB C -4.183 -0.312 -2.085 1.00 . A A . 30 HIS CB 1 1 16 11630 1 1 30 HIS CD2 C -6.315 -0.997 -0.826 1.00 . A A . 30 HIS CD2 1 1 16 11631 1 1 30 HIS CE1 C -7.261 0.968 -0.712 1.00 . A A . 30 HIS CE1 1 1 16 11632 1 1 30 HIS CG C -5.461 -0.110 -1.371 1.00 . A A . 30 HIS CG 1 1 16 11633 1 1 30 HIS H H -2.584 1.638 -1.090 1.00 . A A . 30 HIS H 1 1 16 11634 1 1 30 HIS HA H -3.079 -1.195 -0.448 1.00 . A A . 30 HIS HA 1 1 16 11635 1 1 30 HIS HB2 H -4.016 0.624 -2.599 1.00 . A A . 30 HIS HB2 1 1 16 11636 1 1 30 HIS HB3 H -4.302 -1.040 -2.874 1.00 . A A . 30 HIS HB3 1 1 16 11637 1 1 30 HIS HD2 H -6.150 -2.062 -0.738 1.00 . A A . 30 HIS HD2 1 1 16 11638 1 1 30 HIS HE1 H -7.980 1.748 -0.518 1.00 . A A . 30 HIS HE1 1 1 16 11639 1 1 30 HIS HE2 H -8.307 -0.756 -0.374 1.00 . A A . 30 HIS HE2 1 1 16 11640 1 1 30 HIS N N -2.466 0.779 -0.630 1.00 . A A . 30 HIS N 1 1 16 11641 1 1 30 HIS ND1 N -6.070 1.121 -1.288 1.00 . A A . 30 HIS ND1 1 1 16 11642 1 1 30 HIS NE2 N -7.426 -0.310 -0.433 1.00 . A A . 30 HIS NE2 1 1 16 11643 1 1 30 HIS O O -1.251 -0.136 -2.880 1.00 . A A . 30 HIS O 1 1 16 11644 1 1 31 GLN C C -0.767 -2.462 -4.495 1.00 . A A . 31 GLN C 1 1 16 11645 1 1 31 GLN CA C -0.526 -2.787 -3.027 1.00 . A A . 31 GLN CA 1 1 16 11646 1 1 31 GLN CB C -0.343 -4.281 -2.829 1.00 . A A . 31 GLN CB 1 1 16 11647 1 1 31 GLN CD C 0.418 -6.140 -1.341 1.00 . A A . 31 GLN CD 1 1 16 11648 1 1 31 GLN CG C 0.270 -4.652 -1.500 1.00 . A A . 31 GLN CG 1 1 16 11649 1 1 31 GLN H H -2.054 -2.800 -1.533 1.00 . A A . 31 GLN H 1 1 16 11650 1 1 31 GLN HA H 0.379 -2.282 -2.718 1.00 . A A . 31 GLN HA 1 1 16 11651 1 1 31 GLN HB2 H -1.306 -4.765 -2.895 1.00 . A A . 31 GLN HB2 1 1 16 11652 1 1 31 GLN HB3 H 0.296 -4.667 -3.611 1.00 . A A . 31 GLN HB3 1 1 16 11653 1 1 31 GLN HE21 H -1.323 -6.250 -0.440 1.00 . A A . 31 GLN HE21 1 1 16 11654 1 1 31 GLN HE22 H -0.501 -7.743 -0.618 1.00 . A A . 31 GLN HE22 1 1 16 11655 1 1 31 GLN HG2 H 1.252 -4.201 -1.440 1.00 . A A . 31 GLN HG2 1 1 16 11656 1 1 31 GLN HG3 H -0.345 -4.268 -0.704 1.00 . A A . 31 GLN HG3 1 1 16 11657 1 1 31 GLN N N -1.555 -2.228 -2.155 1.00 . A A . 31 GLN N 1 1 16 11658 1 1 31 GLN NE2 N -0.555 -6.772 -0.752 1.00 . A A . 31 GLN NE2 1 1 16 11659 1 1 31 GLN O O 0.114 -2.034 -5.168 1.00 . A A . 31 GLN O 1 1 16 11660 1 1 31 GLN OE1 O 1.414 -6.704 -1.721 1.00 . A A . 31 GLN OE1 1 1 16 11661 1 1 32 VAL C C -2.224 -0.842 -6.669 1.00 . A A . 32 VAL C 1 1 16 11662 1 1 32 VAL CA C -2.229 -2.359 -6.365 1.00 . A A . 32 VAL CA 1 1 16 11663 1 1 32 VAL CB C -3.571 -2.987 -6.813 1.00 . A A . 32 VAL CB 1 1 16 11664 1 1 32 VAL CG1 C -4.700 -2.410 -6.001 1.00 . A A . 32 VAL CG1 1 1 16 11665 1 1 32 VAL CG2 C -3.810 -2.735 -8.282 1.00 . A A . 32 VAL CG2 1 1 16 11666 1 1 32 VAL H H -2.676 -2.943 -4.373 1.00 . A A . 32 VAL H 1 1 16 11667 1 1 32 VAL HA H -1.430 -2.825 -6.917 1.00 . A A . 32 VAL HA 1 1 16 11668 1 1 32 VAL HB H -3.531 -4.052 -6.645 1.00 . A A . 32 VAL HB 1 1 16 11669 1 1 32 VAL HG11 H -5.655 -2.796 -6.328 1.00 . A A . 32 VAL HG11 1 1 16 11670 1 1 32 VAL HG12 H -4.629 -1.339 -6.150 1.00 . A A . 32 VAL HG12 1 1 16 11671 1 1 32 VAL HG13 H -4.514 -2.625 -4.960 1.00 . A A . 32 VAL HG13 1 1 16 11672 1 1 32 VAL HG21 H -4.766 -3.141 -8.582 1.00 . A A . 32 VAL HG21 1 1 16 11673 1 1 32 VAL HG22 H -2.996 -3.155 -8.854 1.00 . A A . 32 VAL HG22 1 1 16 11674 1 1 32 VAL HG23 H -3.805 -1.659 -8.361 1.00 . A A . 32 VAL HG23 1 1 16 11675 1 1 32 VAL N N -1.962 -2.628 -4.960 1.00 . A A . 32 VAL N 1 1 16 11676 1 1 32 VAL O O -1.725 -0.407 -7.697 1.00 . A A . 32 VAL O 1 1 16 11677 1 1 33 CYS C C -1.554 2.089 -5.901 1.00 . A A . 33 CYS C 1 1 16 11678 1 1 33 CYS CA C -2.902 1.360 -5.947 1.00 . A A . 33 CYS CA 1 1 16 11679 1 1 33 CYS CB C -3.968 1.984 -4.986 1.00 . A A . 33 CYS CB 1 1 16 11680 1 1 33 CYS H H -3.024 -0.579 -4.952 1.00 . A A . 33 CYS H 1 1 16 11681 1 1 33 CYS HA H -3.233 1.523 -6.961 1.00 . A A . 33 CYS HA 1 1 16 11682 1 1 33 CYS HB2 H -4.391 2.859 -5.428 1.00 . A A . 33 CYS HB2 1 1 16 11683 1 1 33 CYS HB3 H -4.785 1.279 -4.895 1.00 . A A . 33 CYS HB3 1 1 16 11684 1 1 33 CYS N N -2.751 -0.066 -5.737 1.00 . A A . 33 CYS N 1 1 16 11685 1 1 33 CYS O O -1.353 3.064 -6.602 1.00 . A A . 33 CYS O 1 1 16 11686 1 1 33 CYS SG S -3.438 2.379 -3.321 1.00 . A A . 33 CYS SG 1 1 16 11687 1 1 34 VAL C C 1.727 1.423 -5.811 1.00 . A A . 34 VAL C 1 1 16 11688 1 1 34 VAL CA C 0.658 2.234 -5.027 1.00 . A A . 34 VAL CA 1 1 16 11689 1 1 34 VAL CB C 1.089 2.383 -3.556 1.00 . A A . 34 VAL CB 1 1 16 11690 1 1 34 VAL CG1 C 1.774 1.151 -3.006 1.00 . A A . 34 VAL CG1 1 1 16 11691 1 1 34 VAL CG2 C 1.853 3.638 -3.372 1.00 . A A . 34 VAL CG2 1 1 16 11692 1 1 34 VAL H H -0.747 0.828 -4.513 1.00 . A A . 34 VAL H 1 1 16 11693 1 1 34 VAL HA H 0.577 3.218 -5.466 1.00 . A A . 34 VAL HA 1 1 16 11694 1 1 34 VAL HB H 0.241 2.409 -2.894 1.00 . A A . 34 VAL HB 1 1 16 11695 1 1 34 VAL HG11 H 2.683 1.002 -3.570 1.00 . A A . 34 VAL HG11 1 1 16 11696 1 1 34 VAL HG12 H 1.144 0.281 -3.137 1.00 . A A . 34 VAL HG12 1 1 16 11697 1 1 34 VAL HG13 H 2.019 1.281 -1.964 1.00 . A A . 34 VAL HG13 1 1 16 11698 1 1 34 VAL HG21 H 2.741 3.585 -3.981 1.00 . A A . 34 VAL HG21 1 1 16 11699 1 1 34 VAL HG22 H 2.097 3.765 -2.330 1.00 . A A . 34 VAL HG22 1 1 16 11700 1 1 34 VAL HG23 H 1.186 4.422 -3.694 1.00 . A A . 34 VAL HG23 1 1 16 11701 1 1 34 VAL N N -0.619 1.595 -5.107 1.00 . A A . 34 VAL N 1 1 16 11702 1 1 34 VAL O O 2.916 1.786 -5.829 1.00 . A A . 34 VAL O 1 1 16 11703 1 1 35 GLY C C 3.187 -1.293 -6.322 1.00 . A A . 35 GLY C 1 1 16 11704 1 1 35 GLY CA C 2.188 -0.515 -7.213 1.00 . A A . 35 GLY CA 1 1 16 11705 1 1 35 GLY H H 0.294 0.339 -6.586 1.00 . A A . 35 GLY H 1 1 16 11706 1 1 35 GLY HA2 H 1.594 -1.243 -7.744 1.00 . A A . 35 GLY HA2 1 1 16 11707 1 1 35 GLY HA3 H 2.753 0.055 -7.937 1.00 . A A . 35 GLY HA3 1 1 16 11708 1 1 35 GLY N N 1.274 0.380 -6.499 1.00 . A A . 35 GLY N 1 1 16 11709 1 1 35 GLY O O 4.386 -0.995 -6.315 1.00 . A A . 35 GLY O 1 1 16 11710 1 1 36 VAL C C 3.026 -4.592 -5.185 1.00 . A A . 36 VAL C 1 1 16 11711 1 1 36 VAL CA C 3.463 -3.192 -4.788 1.00 . A A . 36 VAL CA 1 1 16 11712 1 1 36 VAL CB C 3.162 -3.004 -3.257 1.00 . A A . 36 VAL CB 1 1 16 11713 1 1 36 VAL CG1 C 3.808 -4.085 -2.390 1.00 . A A . 36 VAL CG1 1 1 16 11714 1 1 36 VAL CG2 C 3.591 -1.641 -2.786 1.00 . A A . 36 VAL CG2 1 1 16 11715 1 1 36 VAL H H 1.729 -2.472 -5.508 1.00 . A A . 36 VAL H 1 1 16 11716 1 1 36 VAL HA H 4.518 -3.049 -4.976 1.00 . A A . 36 VAL HA 1 1 16 11717 1 1 36 VAL HB H 2.093 -3.086 -3.127 1.00 . A A . 36 VAL HB 1 1 16 11718 1 1 36 VAL HG11 H 3.590 -3.899 -1.347 1.00 . A A . 36 VAL HG11 1 1 16 11719 1 1 36 VAL HG12 H 4.873 -4.148 -2.556 1.00 . A A . 36 VAL HG12 1 1 16 11720 1 1 36 VAL HG13 H 3.375 -5.037 -2.661 1.00 . A A . 36 VAL HG13 1 1 16 11721 1 1 36 VAL HG21 H 4.626 -1.462 -3.038 1.00 . A A . 36 VAL HG21 1 1 16 11722 1 1 36 VAL HG22 H 3.454 -1.576 -1.718 1.00 . A A . 36 VAL HG22 1 1 16 11723 1 1 36 VAL HG23 H 2.943 -0.906 -3.242 1.00 . A A . 36 VAL HG23 1 1 16 11724 1 1 36 VAL N N 2.689 -2.265 -5.590 1.00 . A A . 36 VAL N 1 1 16 11725 1 1 36 VAL O O 1.860 -4.790 -5.549 1.00 . A A . 36 VAL O 1 1 16 11726 1 1 37 SER C C 3.410 -7.625 -4.083 1.00 . A A . 37 SER C 1 1 16 11727 1 1 37 SER CA C 3.569 -6.891 -5.428 1.00 . A A . 37 SER CA 1 1 16 11728 1 1 37 SER CB C 4.672 -7.521 -6.276 1.00 . A A . 37 SER CB 1 1 16 11729 1 1 37 SER H H 4.864 -5.467 -4.898 1.00 . A A . 37 SER H 1 1 16 11730 1 1 37 SER HA H 2.636 -6.904 -5.975 1.00 . A A . 37 SER HA 1 1 16 11731 1 1 37 SER HB2 H 4.436 -8.562 -6.438 1.00 . A A . 37 SER HB2 1 1 16 11732 1 1 37 SER HB3 H 4.718 -7.014 -7.227 1.00 . A A . 37 SER HB3 1 1 16 11733 1 1 37 SER HG H 6.625 -7.741 -6.216 1.00 . A A . 37 SER HG 1 1 16 11734 1 1 37 SER N N 3.917 -5.541 -5.146 1.00 . A A . 37 SER N 1 1 16 11735 1 1 37 SER O O 4.075 -7.256 -3.102 1.00 . A A . 37 SER O 1 1 16 11736 1 1 37 SER OG O 5.934 -7.410 -5.631 1.00 . A A . 37 SER OG 1 1 16 11737 1 1 38 PRO C C 3.548 -9.950 -2.102 1.00 . A A . 38 PRO C 1 1 16 11738 1 1 38 PRO CA C 2.273 -9.417 -2.764 1.00 . A A . 38 PRO CA 1 1 16 11739 1 1 38 PRO CB C 1.385 -10.589 -3.246 1.00 . A A . 38 PRO CB 1 1 16 11740 1 1 38 PRO CD C 1.746 -9.170 -5.128 1.00 . A A . 38 PRO CD 1 1 16 11741 1 1 38 PRO CG C 1.529 -10.594 -4.736 1.00 . A A . 38 PRO CG 1 1 16 11742 1 1 38 PRO HA H 1.727 -8.822 -2.046 1.00 . A A . 38 PRO HA 1 1 16 11743 1 1 38 PRO HB2 H 1.748 -11.518 -2.829 1.00 . A A . 38 PRO HB2 1 1 16 11744 1 1 38 PRO HB3 H 0.355 -10.430 -2.966 1.00 . A A . 38 PRO HB3 1 1 16 11745 1 1 38 PRO HD2 H 2.286 -9.109 -6.063 1.00 . A A . 38 PRO HD2 1 1 16 11746 1 1 38 PRO HD3 H 0.817 -8.631 -5.195 1.00 . A A . 38 PRO HD3 1 1 16 11747 1 1 38 PRO HG2 H 2.415 -11.155 -4.990 1.00 . A A . 38 PRO HG2 1 1 16 11748 1 1 38 PRO HG3 H 0.647 -11.003 -5.208 1.00 . A A . 38 PRO HG3 1 1 16 11749 1 1 38 PRO N N 2.548 -8.659 -4.014 1.00 . A A . 38 PRO N 1 1 16 11750 1 1 38 PRO O O 3.613 -10.131 -0.894 1.00 . A A . 38 PRO O 1 1 16 11751 1 1 39 GLU C C 6.616 -9.630 -1.671 1.00 . A A . 39 GLU C 1 1 16 11752 1 1 39 GLU CA C 5.825 -10.677 -2.496 1.00 . A A . 39 GLU CA 1 1 16 11753 1 1 39 GLU CB C 6.608 -11.082 -3.744 1.00 . A A . 39 GLU CB 1 1 16 11754 1 1 39 GLU CD C 8.601 -12.193 -4.768 1.00 . A A . 39 GLU CD 1 1 16 11755 1 1 39 GLU CG C 7.871 -11.870 -3.484 1.00 . A A . 39 GLU CG 1 1 16 11756 1 1 39 GLU H H 4.463 -9.836 -3.839 1.00 . A A . 39 GLU H 1 1 16 11757 1 1 39 GLU HA H 5.638 -11.559 -1.906 1.00 . A A . 39 GLU HA 1 1 16 11758 1 1 39 GLU HB2 H 5.970 -11.686 -4.370 1.00 . A A . 39 GLU HB2 1 1 16 11759 1 1 39 GLU HB3 H 6.872 -10.183 -4.278 1.00 . A A . 39 GLU HB3 1 1 16 11760 1 1 39 GLU HG2 H 8.501 -11.263 -2.850 1.00 . A A . 39 GLU HG2 1 1 16 11761 1 1 39 GLU HG3 H 7.626 -12.787 -2.967 1.00 . A A . 39 GLU HG3 1 1 16 11762 1 1 39 GLU N N 4.563 -10.134 -2.914 1.00 . A A . 39 GLU N 1 1 16 11763 1 1 39 GLU O O 7.320 -9.967 -0.712 1.00 . A A . 39 GLU O 1 1 16 11764 1 1 39 GLU OE1 O 8.027 -12.892 -5.646 1.00 . A A . 39 GLU OE1 1 1 16 11765 1 1 39 GLU OE2 O 9.729 -11.729 -4.936 1.00 . A A . 39 GLU OE2 1 1 16 11766 1 1 40 MET C C 6.645 -6.976 -0.021 1.00 . A A . 40 MET C 1 1 16 11767 1 1 40 MET CA C 7.195 -7.273 -1.402 1.00 . A A . 40 MET CA 1 1 16 11768 1 1 40 MET CB C 7.186 -5.983 -2.249 1.00 . A A . 40 MET CB 1 1 16 11769 1 1 40 MET CE C 6.965 -2.829 -3.200 1.00 . A A . 40 MET CE 1 1 16 11770 1 1 40 MET CG C 8.119 -4.891 -1.684 1.00 . A A . 40 MET CG 1 1 16 11771 1 1 40 MET H H 5.793 -8.155 -2.735 1.00 . A A . 40 MET H 1 1 16 11772 1 1 40 MET HA H 8.214 -7.614 -1.302 1.00 . A A . 40 MET HA 1 1 16 11773 1 1 40 MET HB2 H 7.283 -6.134 -3.309 1.00 . A A . 40 MET HB2 1 1 16 11774 1 1 40 MET HB3 H 6.179 -5.615 -2.102 1.00 . A A . 40 MET HB3 1 1 16 11775 1 1 40 MET HE1 H 6.471 -2.527 -2.289 1.00 . A A . 40 MET HE1 1 1 16 11776 1 1 40 MET HE2 H 6.355 -3.552 -3.721 1.00 . A A . 40 MET HE2 1 1 16 11777 1 1 40 MET HE3 H 7.113 -1.964 -3.830 1.00 . A A . 40 MET HE3 1 1 16 11778 1 1 40 MET HG2 H 7.573 -4.460 -0.860 1.00 . A A . 40 MET HG2 1 1 16 11779 1 1 40 MET HG3 H 9.024 -5.348 -1.317 1.00 . A A . 40 MET HG3 1 1 16 11780 1 1 40 MET N N 6.457 -8.355 -2.042 1.00 . A A . 40 MET N 1 1 16 11781 1 1 40 MET O O 7.393 -6.726 0.897 1.00 . A A . 40 MET O 1 1 16 11782 1 1 40 MET SD S 8.542 -3.549 -2.837 1.00 . A A . 40 MET SD 1 1 16 11783 1 1 41 ALA C C 5.122 -7.530 2.557 1.00 . A A . 41 ALA C 1 1 16 11784 1 1 41 ALA CA C 4.620 -6.716 1.353 1.00 . A A . 41 ALA CA 1 1 16 11785 1 1 41 ALA CB C 3.110 -6.891 1.162 1.00 . A A . 41 ALA CB 1 1 16 11786 1 1 41 ALA H H 4.793 -7.281 -0.685 1.00 . A A . 41 ALA H 1 1 16 11787 1 1 41 ALA HA H 4.810 -5.676 1.565 1.00 . A A . 41 ALA HA 1 1 16 11788 1 1 41 ALA HB1 H 2.783 -6.287 0.323 1.00 . A A . 41 ALA HB1 1 1 16 11789 1 1 41 ALA HB2 H 2.568 -6.596 2.050 1.00 . A A . 41 ALA HB2 1 1 16 11790 1 1 41 ALA HB3 H 2.902 -7.928 0.941 1.00 . A A . 41 ALA HB3 1 1 16 11791 1 1 41 ALA N N 5.327 -7.048 0.103 1.00 . A A . 41 ALA N 1 1 16 11792 1 1 41 ALA O O 5.303 -6.977 3.644 1.00 . A A . 41 ALA O 1 1 16 11793 1 1 42 GLU C C 7.412 -9.609 3.505 1.00 . A A . 42 GLU C 1 1 16 11794 1 1 42 GLU CA C 5.874 -9.619 3.455 1.00 . A A . 42 GLU CA 1 1 16 11795 1 1 42 GLU CB C 5.357 -11.067 3.476 1.00 . A A . 42 GLU CB 1 1 16 11796 1 1 42 GLU CD C 3.476 -12.668 3.979 1.00 . A A . 42 GLU CD 1 1 16 11797 1 1 42 GLU CG C 3.877 -11.213 3.822 1.00 . A A . 42 GLU CG 1 1 16 11798 1 1 42 GLU H H 5.012 -9.131 1.492 1.00 . A A . 42 GLU H 1 1 16 11799 1 1 42 GLU HA H 5.533 -9.137 4.361 1.00 . A A . 42 GLU HA 1 1 16 11800 1 1 42 GLU HB2 H 5.521 -11.484 2.493 1.00 . A A . 42 GLU HB2 1 1 16 11801 1 1 42 GLU HB3 H 5.933 -11.642 4.189 1.00 . A A . 42 GLU HB3 1 1 16 11802 1 1 42 GLU HG2 H 3.698 -10.715 4.764 1.00 . A A . 42 GLU HG2 1 1 16 11803 1 1 42 GLU HG3 H 3.274 -10.762 3.044 1.00 . A A . 42 GLU HG3 1 1 16 11804 1 1 42 GLU N N 5.319 -8.821 2.372 1.00 . A A . 42 GLU N 1 1 16 11805 1 1 42 GLU O O 7.998 -9.443 4.580 1.00 . A A . 42 GLU O 1 1 16 11806 1 1 42 GLU OE1 O 3.090 -13.304 2.987 1.00 . A A . 42 GLU OE1 1 1 16 11807 1 1 42 GLU OE2 O 3.571 -13.201 5.114 1.00 . A A . 42 GLU OE2 1 1 16 11808 1 1 43 ASN C C 10.345 -8.657 2.550 1.00 . A A . 43 ASN C 1 1 16 11809 1 1 43 ASN CA C 9.531 -9.940 2.344 1.00 . A A . 43 ASN CA 1 1 16 11810 1 1 43 ASN CB C 10.002 -10.622 1.048 1.00 . A A . 43 ASN CB 1 1 16 11811 1 1 43 ASN CG C 9.519 -12.060 0.896 1.00 . A A . 43 ASN CG 1 1 16 11812 1 1 43 ASN H H 7.660 -9.893 1.480 1.00 . A A . 43 ASN H 1 1 16 11813 1 1 43 ASN HA H 9.779 -10.612 3.151 1.00 . A A . 43 ASN HA 1 1 16 11814 1 1 43 ASN HB2 H 9.636 -10.059 0.203 1.00 . A A . 43 ASN HB2 1 1 16 11815 1 1 43 ASN HB3 H 11.083 -10.620 1.020 1.00 . A A . 43 ASN HB3 1 1 16 11816 1 1 43 ASN HD21 H 9.444 -11.844 -1.065 1.00 . A A . 43 ASN HD21 1 1 16 11817 1 1 43 ASN HD22 H 8.967 -13.390 -0.455 1.00 . A A . 43 ASN HD22 1 1 16 11818 1 1 43 ASN N N 8.066 -9.792 2.365 1.00 . A A . 43 ASN N 1 1 16 11819 1 1 43 ASN ND2 N 9.291 -12.474 -0.332 1.00 . A A . 43 ASN ND2 1 1 16 11820 1 1 43 ASN O O 11.414 -8.704 3.178 1.00 . A A . 43 ASN O 1 1 16 11821 1 1 43 ASN OD1 O 9.338 -12.781 1.871 1.00 . A A . 43 ASN OD1 1 1 16 11822 1 1 44 GLU C C 10.054 -5.098 2.687 1.00 . A A . 44 GLU C 1 1 16 11823 1 1 44 GLU CA C 10.725 -6.330 2.074 1.00 . A A . 44 GLU CA 1 1 16 11824 1 1 44 GLU CB C 11.361 -6.044 0.689 1.00 . A A . 44 GLU CB 1 1 16 11825 1 1 44 GLU CD C 12.919 -6.945 -1.162 1.00 . A A . 44 GLU CD 1 1 16 11826 1 1 44 GLU CG C 12.241 -7.209 0.178 1.00 . A A . 44 GLU CG 1 1 16 11827 1 1 44 GLU H H 8.960 -7.438 1.697 1.00 . A A . 44 GLU H 1 1 16 11828 1 1 44 GLU HA H 11.525 -6.591 2.752 1.00 . A A . 44 GLU HA 1 1 16 11829 1 1 44 GLU HB2 H 10.575 -5.859 -0.030 1.00 . A A . 44 GLU HB2 1 1 16 11830 1 1 44 GLU HB3 H 11.985 -5.165 0.777 1.00 . A A . 44 GLU HB3 1 1 16 11831 1 1 44 GLU HG2 H 13.016 -7.398 0.908 1.00 . A A . 44 GLU HG2 1 1 16 11832 1 1 44 GLU HG3 H 11.629 -8.097 0.093 1.00 . A A . 44 GLU HG3 1 1 16 11833 1 1 44 GLU N N 9.879 -7.515 2.044 1.00 . A A . 44 GLU N 1 1 16 11834 1 1 44 GLU O O 8.837 -5.045 2.840 1.00 . A A . 44 GLU O 1 1 16 11835 1 1 44 GLU OE1 O 12.332 -7.272 -2.215 1.00 . A A . 44 GLU OE1 1 1 16 11836 1 1 44 GLU OE2 O 14.058 -6.440 -1.166 1.00 . A A . 44 GLU OE2 1 1 16 11837 1 1 45 ASP C C 9.874 -1.851 2.759 1.00 . A A . 45 ASP C 1 1 16 11838 1 1 45 ASP CA C 10.448 -2.900 3.736 1.00 . A A . 45 ASP CA 1 1 16 11839 1 1 45 ASP CB C 11.660 -2.324 4.482 1.00 . A A . 45 ASP CB 1 1 16 11840 1 1 45 ASP CG C 11.323 -1.165 5.386 1.00 . A A . 45 ASP CG 1 1 16 11841 1 1 45 ASP H H 11.826 -4.197 2.807 1.00 . A A . 45 ASP H 1 1 16 11842 1 1 45 ASP HA H 9.694 -3.167 4.465 1.00 . A A . 45 ASP HA 1 1 16 11843 1 1 45 ASP HB2 H 12.109 -3.101 5.083 1.00 . A A . 45 ASP HB2 1 1 16 11844 1 1 45 ASP HB3 H 12.388 -1.987 3.754 1.00 . A A . 45 ASP HB3 1 1 16 11845 1 1 45 ASP N N 10.876 -4.113 3.032 1.00 . A A . 45 ASP N 1 1 16 11846 1 1 45 ASP O O 10.576 -1.362 1.861 1.00 . A A . 45 ASP O 1 1 16 11847 1 1 45 ASP OD1 O 10.957 -1.414 6.559 1.00 . A A . 45 ASP OD1 1 1 16 11848 1 1 45 ASP OD2 O 11.452 -0.029 4.953 1.00 . A A . 45 ASP OD2 1 1 16 11849 1 1 46 TYR C C 8.197 0.912 2.418 1.00 . A A . 46 TYR C 1 1 16 11850 1 1 46 TYR CA C 7.915 -0.573 2.052 1.00 . A A . 46 TYR CA 1 1 16 11851 1 1 46 TYR CB C 6.389 -0.846 1.934 1.00 . A A . 46 TYR CB 1 1 16 11852 1 1 46 TYR CD1 C 5.537 0.150 -0.260 1.00 . A A . 46 TYR CD1 1 1 16 11853 1 1 46 TYR CD2 C 5.025 1.287 1.767 1.00 . A A . 46 TYR CD2 1 1 16 11854 1 1 46 TYR CE1 C 4.867 1.138 -0.966 1.00 . A A . 46 TYR CE1 1 1 16 11855 1 1 46 TYR CE2 C 4.375 2.255 1.053 1.00 . A A . 46 TYR CE2 1 1 16 11856 1 1 46 TYR CG C 5.630 0.212 1.128 1.00 . A A . 46 TYR CG 1 1 16 11857 1 1 46 TYR CZ C 4.297 2.171 -0.293 1.00 . A A . 46 TYR CZ 1 1 16 11858 1 1 46 TYR H H 8.104 -2.044 3.601 1.00 . A A . 46 TYR H 1 1 16 11859 1 1 46 TYR HA H 8.348 -0.708 1.073 1.00 . A A . 46 TYR HA 1 1 16 11860 1 1 46 TYR HB2 H 6.224 -1.788 1.433 1.00 . A A . 46 TYR HB2 1 1 16 11861 1 1 46 TYR HB3 H 5.960 -0.874 2.921 1.00 . A A . 46 TYR HB3 1 1 16 11862 1 1 46 TYR HD1 H 5.994 -0.676 -0.785 1.00 . A A . 46 TYR HD1 1 1 16 11863 1 1 46 TYR HD2 H 5.074 1.369 2.840 1.00 . A A . 46 TYR HD2 1 1 16 11864 1 1 46 TYR HE1 H 4.751 1.129 -2.041 1.00 . A A . 46 TYR HE1 1 1 16 11865 1 1 46 TYR HE2 H 3.895 3.095 1.530 1.00 . A A . 46 TYR HE2 1 1 16 11866 1 1 46 TYR HH H 3.083 2.696 -1.589 1.00 . A A . 46 TYR HH 1 1 16 11867 1 1 46 TYR N N 8.589 -1.551 2.909 1.00 . A A . 46 TYR N 1 1 16 11868 1 1 46 TYR O O 7.754 1.433 3.456 1.00 . A A . 46 TYR O 1 1 16 11869 1 1 46 TYR OH O 3.670 3.140 -0.971 1.00 . A A . 46 TYR OH 1 1 16 11870 1 1 47 ILE C C 8.237 3.613 0.552 1.00 . A A . 47 ILE C 1 1 16 11871 1 1 47 ILE CA C 9.166 2.973 1.597 1.00 . A A . 47 ILE CA 1 1 16 11872 1 1 47 ILE CB C 10.652 3.311 1.284 1.00 . A A . 47 ILE CB 1 1 16 11873 1 1 47 ILE CD1 C 11.430 2.936 3.727 1.00 . A A . 47 ILE CD1 1 1 16 11874 1 1 47 ILE CG1 C 11.611 2.577 2.254 1.00 . A A . 47 ILE CG1 1 1 16 11875 1 1 47 ILE CG2 C 10.880 4.818 1.377 1.00 . A A . 47 ILE CG2 1 1 16 11876 1 1 47 ILE H H 9.263 0.945 0.856 1.00 . A A . 47 ILE H 1 1 16 11877 1 1 47 ILE HA H 8.893 3.329 2.578 1.00 . A A . 47 ILE HA 1 1 16 11878 1 1 47 ILE HB H 10.858 2.982 0.275 1.00 . A A . 47 ILE HB 1 1 16 11879 1 1 47 ILE HD11 H 11.576 4.000 3.840 1.00 . A A . 47 ILE HD11 1 1 16 11880 1 1 47 ILE HD12 H 12.150 2.404 4.337 1.00 . A A . 47 ILE HD12 1 1 16 11881 1 1 47 ILE HD13 H 10.428 2.673 4.035 1.00 . A A . 47 ILE HD13 1 1 16 11882 1 1 47 ILE HG12 H 11.459 1.510 2.157 1.00 . A A . 47 ILE HG12 1 1 16 11883 1 1 47 ILE HG13 H 12.629 2.817 1.972 1.00 . A A . 47 ILE HG13 1 1 16 11884 1 1 47 ILE HG21 H 10.537 5.135 2.355 1.00 . A A . 47 ILE HG21 1 1 16 11885 1 1 47 ILE HG22 H 10.349 5.337 0.594 1.00 . A A . 47 ILE HG22 1 1 16 11886 1 1 47 ILE HG23 H 11.937 5.025 1.293 1.00 . A A . 47 ILE HG23 1 1 16 11887 1 1 47 ILE N N 8.924 1.555 1.539 1.00 . A A . 47 ILE N 1 1 16 11888 1 1 47 ILE O O 7.965 3.002 -0.473 1.00 . A A . 47 ILE O 1 1 16 11889 1 1 48 CYS C C 7.404 6.582 -0.865 1.00 . A A . 48 CYS C 1 1 16 11890 1 1 48 CYS CA C 6.770 5.390 -0.144 1.00 . A A . 48 CYS CA 1 1 16 11891 1 1 48 CYS CB C 5.516 5.898 0.580 1.00 . A A . 48 CYS CB 1 1 16 11892 1 1 48 CYS H H 7.974 5.404 1.537 1.00 . A A . 48 CYS H 1 1 16 11893 1 1 48 CYS HA H 6.487 4.626 -0.854 1.00 . A A . 48 CYS HA 1 1 16 11894 1 1 48 CYS HB2 H 4.706 5.967 -0.135 1.00 . A A . 48 CYS HB2 1 1 16 11895 1 1 48 CYS HB3 H 5.235 5.199 1.351 1.00 . A A . 48 CYS HB3 1 1 16 11896 1 1 48 CYS N N 7.724 4.820 0.796 1.00 . A A . 48 CYS N 1 1 16 11897 1 1 48 CYS O O 8.542 6.962 -0.570 1.00 . A A . 48 CYS O 1 1 16 11898 1 1 48 CYS SG S 5.733 7.539 1.351 1.00 . A A . 48 CYS SG 1 1 16 11899 1 1 49 ILE C C 7.454 9.543 -1.603 1.00 . A A . 49 ILE C 1 1 16 11900 1 1 49 ILE CA C 6.998 8.355 -2.514 1.00 . A A . 49 ILE CA 1 1 16 11901 1 1 49 ILE CB C 5.811 8.765 -3.436 1.00 . A A . 49 ILE CB 1 1 16 11902 1 1 49 ILE CD1 C 5.147 10.323 -5.311 1.00 . A A . 49 ILE CD1 1 1 16 11903 1 1 49 ILE CG1 C 6.158 9.999 -4.251 1.00 . A A . 49 ILE CG1 1 1 16 11904 1 1 49 ILE CG2 C 4.512 8.958 -2.642 1.00 . A A . 49 ILE CG2 1 1 16 11905 1 1 49 ILE H H 5.741 6.789 -1.913 1.00 . A A . 49 ILE H 1 1 16 11906 1 1 49 ILE HA H 7.825 8.104 -3.163 1.00 . A A . 49 ILE HA 1 1 16 11907 1 1 49 ILE HB H 5.651 7.935 -4.110 1.00 . A A . 49 ILE HB 1 1 16 11908 1 1 49 ILE HD11 H 5.120 9.481 -5.987 1.00 . A A . 49 ILE HD11 1 1 16 11909 1 1 49 ILE HD12 H 5.432 11.205 -5.862 1.00 . A A . 49 ILE HD12 1 1 16 11910 1 1 49 ILE HD13 H 4.161 10.453 -4.891 1.00 . A A . 49 ILE HD13 1 1 16 11911 1 1 49 ILE HG12 H 6.213 10.842 -3.583 1.00 . A A . 49 ILE HG12 1 1 16 11912 1 1 49 ILE HG13 H 7.119 9.853 -4.721 1.00 . A A . 49 ILE HG13 1 1 16 11913 1 1 49 ILE HG21 H 4.638 9.750 -1.916 1.00 . A A . 49 ILE HG21 1 1 16 11914 1 1 49 ILE HG22 H 4.250 8.037 -2.140 1.00 . A A . 49 ILE HG22 1 1 16 11915 1 1 49 ILE HG23 H 3.704 9.216 -3.310 1.00 . A A . 49 ILE HG23 1 1 16 11916 1 1 49 ILE N N 6.623 7.181 -1.753 1.00 . A A . 49 ILE N 1 1 16 11917 1 1 49 ILE O O 8.433 10.221 -1.896 1.00 . A A . 49 ILE O 1 1 16 11918 1 1 50 ASN C C 8.211 10.455 1.415 1.00 . A A . 50 ASN C 1 1 16 11919 1 1 50 ASN CA C 7.076 10.830 0.458 1.00 . A A . 50 ASN CA 1 1 16 11920 1 1 50 ASN CB C 5.830 11.227 1.270 1.00 . A A . 50 ASN CB 1 1 16 11921 1 1 50 ASN CG C 4.714 11.795 0.416 1.00 . A A . 50 ASN CG 1 1 16 11922 1 1 50 ASN H H 6.006 9.153 -0.282 1.00 . A A . 50 ASN H 1 1 16 11923 1 1 50 ASN HA H 7.378 11.681 -0.135 1.00 . A A . 50 ASN HA 1 1 16 11924 1 1 50 ASN HB2 H 5.448 10.360 1.782 1.00 . A A . 50 ASN HB2 1 1 16 11925 1 1 50 ASN HB3 H 6.121 11.975 1.991 1.00 . A A . 50 ASN HB3 1 1 16 11926 1 1 50 ASN HD21 H 5.368 13.642 0.721 1.00 . A A . 50 ASN HD21 1 1 16 11927 1 1 50 ASN HD22 H 3.965 13.483 -0.268 1.00 . A A . 50 ASN HD22 1 1 16 11928 1 1 50 ASN N N 6.765 9.740 -0.484 1.00 . A A . 50 ASN N 1 1 16 11929 1 1 50 ASN ND2 N 4.679 13.104 0.281 1.00 . A A . 50 ASN ND2 1 1 16 11930 1 1 50 ASN O O 8.953 11.311 1.868 1.00 . A A . 50 ASN O 1 1 16 11931 1 1 50 ASN OD1 O 3.871 11.066 -0.093 1.00 . A A . 50 ASN OD1 1 1 16 11932 1 1 51 CYS C C 10.754 8.718 1.890 1.00 . A A . 51 CYS C 1 1 16 11933 1 1 51 CYS CA C 9.406 8.691 2.591 1.00 . A A . 51 CYS CA 1 1 16 11934 1 1 51 CYS CB C 9.144 7.260 3.101 1.00 . A A . 51 CYS CB 1 1 16 11935 1 1 51 CYS H H 7.696 8.558 1.292 1.00 . A A . 51 CYS H 1 1 16 11936 1 1 51 CYS HA H 9.455 9.358 3.438 1.00 . A A . 51 CYS HA 1 1 16 11937 1 1 51 CYS HB2 H 8.836 6.659 2.260 1.00 . A A . 51 CYS HB2 1 1 16 11938 1 1 51 CYS HB3 H 10.076 6.856 3.468 1.00 . A A . 51 CYS HB3 1 1 16 11939 1 1 51 CYS N N 8.340 9.166 1.707 1.00 . A A . 51 CYS N 1 1 16 11940 1 1 51 CYS O O 11.782 8.873 2.520 1.00 . A A . 51 CYS O 1 1 16 11941 1 1 51 CYS SG S 7.885 7.046 4.391 1.00 . A A . 51 CYS SG 1 1 16 11942 1 1 52 ALA C C 12.570 9.904 -0.403 1.00 . A A . 52 ALA C 1 1 16 11943 1 1 52 ALA CA C 11.968 8.508 -0.164 1.00 . A A . 52 ALA CA 1 1 16 11944 1 1 52 ALA CB C 11.737 7.759 -1.469 1.00 . A A . 52 ALA CB 1 1 16 11945 1 1 52 ALA H H 9.848 8.577 0.172 1.00 . A A . 52 ALA H 1 1 16 11946 1 1 52 ALA HA H 12.661 7.933 0.436 1.00 . A A . 52 ALA HA 1 1 16 11947 1 1 52 ALA HB1 H 11.038 8.302 -2.091 1.00 . A A . 52 ALA HB1 1 1 16 11948 1 1 52 ALA HB2 H 11.325 6.789 -1.218 1.00 . A A . 52 ALA HB2 1 1 16 11949 1 1 52 ALA HB3 H 12.682 7.641 -1.977 1.00 . A A . 52 ALA HB3 1 1 16 11950 1 1 52 ALA N N 10.734 8.582 0.594 1.00 . A A . 52 ALA N 1 1 16 11951 2 2 1 ZN ZN ZN 5.779 7.427 3.626 1.00 . B A . 53 ZN ZN 1 1 16 11952 3 2 1 ZN ZN ZN -5.257 2.839 -1.932 1.00 . C A . 54 ZN ZN 1 1 17 11953 1 1 1 SER C C -11.585 5.969 1.757 1.00 . A A . 1 SER C 1 1 17 11954 1 1 1 SER CA C -12.649 6.136 2.867 1.00 . A A . 1 SER CA 1 1 17 11955 1 1 1 SER CB C -13.996 6.551 2.244 1.00 . A A . 1 SER CB 1 1 17 11956 1 1 1 SER HA H -12.756 5.190 3.374 1.00 . A A . 1 SER HA 1 1 17 11957 1 1 1 SER HB2 H -13.860 7.477 1.703 1.00 . A A . 1 SER HB2 1 1 17 11958 1 1 1 SER HB3 H -14.314 5.777 1.560 1.00 . A A . 1 SER HB3 1 1 17 11959 1 1 1 SER HG H -14.554 7.021 4.043 1.00 . A A . 1 SER HG 1 1 17 11960 1 1 1 SER N N -12.216 7.167 3.860 1.00 . A A . 1 SER N 1 1 17 11961 1 1 1 SER O O -11.666 5.077 0.899 1.00 . A A . 1 SER O 1 1 17 11962 1 1 1 SER OG O -14.999 6.744 3.236 1.00 . A A . 1 SER OG 1 1 17 11963 1 1 2 VAL C C -8.180 6.658 1.485 1.00 . A A . 2 VAL C 1 1 17 11964 1 1 2 VAL CA C -9.529 6.812 0.781 1.00 . A A . 2 VAL CA 1 1 17 11965 1 1 2 VAL CB C -9.538 8.116 -0.077 1.00 . A A . 2 VAL CB 1 1 17 11966 1 1 2 VAL CG1 C -8.527 8.033 -1.198 1.00 . A A . 2 VAL CG1 1 1 17 11967 1 1 2 VAL CG2 C -10.933 8.394 -0.641 1.00 . A A . 2 VAL CG2 1 1 17 11968 1 1 2 VAL H H -10.511 7.485 2.507 1.00 . A A . 2 VAL H 1 1 17 11969 1 1 2 VAL HA H -9.674 5.955 0.137 1.00 . A A . 2 VAL HA 1 1 17 11970 1 1 2 VAL HB H -9.266 8.934 0.573 1.00 . A A . 2 VAL HB 1 1 17 11971 1 1 2 VAL HG11 H -7.546 7.848 -0.784 1.00 . A A . 2 VAL HG11 1 1 17 11972 1 1 2 VAL HG12 H -8.518 8.956 -1.760 1.00 . A A . 2 VAL HG12 1 1 17 11973 1 1 2 VAL HG13 H -8.815 7.211 -1.839 1.00 . A A . 2 VAL HG13 1 1 17 11974 1 1 2 VAL HG21 H -10.925 9.315 -1.206 1.00 . A A . 2 VAL HG21 1 1 17 11975 1 1 2 VAL HG22 H -11.629 8.475 0.181 1.00 . A A . 2 VAL HG22 1 1 17 11976 1 1 2 VAL HG23 H -11.219 7.571 -1.277 1.00 . A A . 2 VAL HG23 1 1 17 11977 1 1 2 VAL N N -10.580 6.824 1.780 1.00 . A A . 2 VAL N 1 1 17 11978 1 1 2 VAL O O -7.983 7.227 2.557 1.00 . A A . 2 VAL O 1 1 17 11979 1 1 3 CYS C C -4.973 6.662 1.082 1.00 . A A . 3 CYS C 1 1 17 11980 1 1 3 CYS CA C -5.997 5.577 1.515 1.00 . A A . 3 CYS CA 1 1 17 11981 1 1 3 CYS CB C -5.484 4.216 1.012 1.00 . A A . 3 CYS CB 1 1 17 11982 1 1 3 CYS H H -7.485 5.443 0.046 1.00 . A A . 3 CYS H 1 1 17 11983 1 1 3 CYS HA H -6.091 5.549 2.591 1.00 . A A . 3 CYS HA 1 1 17 11984 1 1 3 CYS HB2 H -4.829 3.779 1.747 1.00 . A A . 3 CYS HB2 1 1 17 11985 1 1 3 CYS HB3 H -6.324 3.565 0.828 1.00 . A A . 3 CYS HB3 1 1 17 11986 1 1 3 CYS N N -7.287 5.860 0.907 1.00 . A A . 3 CYS N 1 1 17 11987 1 1 3 CYS O O -5.339 7.662 0.449 1.00 . A A . 3 CYS O 1 1 17 11988 1 1 3 CYS SG S -4.551 4.336 -0.536 1.00 . A A . 3 CYS SG 1 1 17 11989 1 1 4 ALA C C -2.064 6.627 -0.313 1.00 . A A . 4 ALA C 1 1 17 11990 1 1 4 ALA CA C -2.652 7.297 0.939 1.00 . A A . 4 ALA CA 1 1 17 11991 1 1 4 ALA CB C -1.560 7.444 2.004 1.00 . A A . 4 ALA CB 1 1 17 11992 1 1 4 ALA H H -3.493 5.665 1.972 1.00 . A A . 4 ALA H 1 1 17 11993 1 1 4 ALA HA H -3.047 8.270 0.685 1.00 . A A . 4 ALA HA 1 1 17 11994 1 1 4 ALA HB1 H -1.194 6.467 2.283 1.00 . A A . 4 ALA HB1 1 1 17 11995 1 1 4 ALA HB2 H -1.938 7.958 2.873 1.00 . A A . 4 ALA HB2 1 1 17 11996 1 1 4 ALA HB3 H -0.732 8.012 1.610 1.00 . A A . 4 ALA HB3 1 1 17 11997 1 1 4 ALA N N -3.711 6.452 1.426 1.00 . A A . 4 ALA N 1 1 17 11998 1 1 4 ALA O O -1.647 5.497 -0.251 1.00 . A A . 4 ALA O 1 1 17 11999 1 1 5 ALA C C -1.768 7.985 -3.718 1.00 . A A . 5 ALA C 1 1 17 12000 1 1 5 ALA CA C -1.490 6.915 -2.704 1.00 . A A . 5 ALA CA 1 1 17 12001 1 1 5 ALA CB C -1.989 5.552 -3.240 1.00 . A A . 5 ALA CB 1 1 17 12002 1 1 5 ALA H H -2.736 8.085 -1.483 1.00 . A A . 5 ALA H 1 1 17 12003 1 1 5 ALA HA H -0.428 6.866 -2.519 1.00 . A A . 5 ALA HA 1 1 17 12004 1 1 5 ALA HB1 H -1.433 5.267 -4.124 1.00 . A A . 5 ALA HB1 1 1 17 12005 1 1 5 ALA HB2 H -3.036 5.604 -3.502 1.00 . A A . 5 ALA HB2 1 1 17 12006 1 1 5 ALA HB3 H -1.850 4.783 -2.493 1.00 . A A . 5 ALA HB3 1 1 17 12007 1 1 5 ALA N N -2.145 7.310 -1.447 1.00 . A A . 5 ALA N 1 1 17 12008 1 1 5 ALA O O -2.887 8.490 -3.764 1.00 . A A . 5 ALA O 1 1 17 12009 1 1 6 GLN C C -2.050 9.040 -6.478 1.00 . A A . 6 GLN C 1 1 17 12010 1 1 6 GLN CA C -0.889 9.409 -5.539 1.00 . A A . 6 GLN CA 1 1 17 12011 1 1 6 GLN CB C 0.428 9.515 -6.343 1.00 . A A . 6 GLN CB 1 1 17 12012 1 1 6 GLN CD C 1.636 11.203 -4.827 1.00 . A A . 6 GLN CD 1 1 17 12013 1 1 6 GLN CG C 1.681 9.846 -5.516 1.00 . A A . 6 GLN CG 1 1 17 12014 1 1 6 GLN H H 0.177 8.100 -4.309 1.00 . A A . 6 GLN H 1 1 17 12015 1 1 6 GLN HA H -1.090 10.363 -5.075 1.00 . A A . 6 GLN HA 1 1 17 12016 1 1 6 GLN HB2 H 0.609 8.572 -6.837 1.00 . A A . 6 GLN HB2 1 1 17 12017 1 1 6 GLN HB3 H 0.321 10.276 -7.108 1.00 . A A . 6 GLN HB3 1 1 17 12018 1 1 6 GLN HE21 H 0.892 10.408 -3.164 1.00 . A A . 6 GLN HE21 1 1 17 12019 1 1 6 GLN HE22 H 1.168 12.114 -3.164 1.00 . A A . 6 GLN HE22 1 1 17 12020 1 1 6 GLN HG2 H 1.801 9.081 -4.762 1.00 . A A . 6 GLN HG2 1 1 17 12021 1 1 6 GLN HG3 H 2.538 9.825 -6.173 1.00 . A A . 6 GLN HG3 1 1 17 12022 1 1 6 GLN N N -0.739 8.395 -4.482 1.00 . A A . 6 GLN N 1 1 17 12023 1 1 6 GLN NE2 N 1.183 11.233 -3.598 1.00 . A A . 6 GLN NE2 1 1 17 12024 1 1 6 GLN O O -2.853 9.879 -6.853 1.00 . A A . 6 GLN O 1 1 17 12025 1 1 6 GLN OE1 O 2.048 12.200 -5.385 1.00 . A A . 6 GLN OE1 1 1 17 12026 1 1 7 ASN C C -3.903 6.163 -6.905 1.00 . A A . 7 ASN C 1 1 17 12027 1 1 7 ASN CA C -3.209 7.269 -7.635 1.00 . A A . 7 ASN CA 1 1 17 12028 1 1 7 ASN CB C -2.724 6.773 -9.009 1.00 . A A . 7 ASN CB 1 1 17 12029 1 1 7 ASN CG C -3.877 6.253 -9.876 1.00 . A A . 7 ASN CG 1 1 17 12030 1 1 7 ASN H H -1.372 7.221 -6.535 1.00 . A A . 7 ASN H 1 1 17 12031 1 1 7 ASN HA H -3.910 8.071 -7.783 1.00 . A A . 7 ASN HA 1 1 17 12032 1 1 7 ASN HB2 H -2.264 7.589 -9.540 1.00 . A A . 7 ASN HB2 1 1 17 12033 1 1 7 ASN HB3 H -2.018 5.972 -8.876 1.00 . A A . 7 ASN HB3 1 1 17 12034 1 1 7 ASN HD21 H -4.116 8.052 -10.659 1.00 . A A . 7 ASN HD21 1 1 17 12035 1 1 7 ASN HD22 H -5.176 6.812 -11.239 1.00 . A A . 7 ASN HD22 1 1 17 12036 1 1 7 ASN N N -2.117 7.777 -6.835 1.00 . A A . 7 ASN N 1 1 17 12037 1 1 7 ASN ND2 N -4.445 7.127 -10.668 1.00 . A A . 7 ASN ND2 1 1 17 12038 1 1 7 ASN O O -3.387 5.061 -6.809 1.00 . A A . 7 ASN O 1 1 17 12039 1 1 7 ASN OD1 O -4.228 5.074 -9.842 1.00 . A A . 7 ASN OD1 1 1 17 12040 1 1 8 CYS C C -6.963 4.955 -6.465 1.00 . A A . 8 CYS C 1 1 17 12041 1 1 8 CYS CA C -5.743 5.391 -5.688 1.00 . A A . 8 CYS CA 1 1 17 12042 1 1 8 CYS CB C -6.061 5.658 -4.214 1.00 . A A . 8 CYS CB 1 1 17 12043 1 1 8 CYS H H -5.426 7.347 -6.360 1.00 . A A . 8 CYS H 1 1 17 12044 1 1 8 CYS HA H -5.046 4.572 -5.738 1.00 . A A . 8 CYS HA 1 1 17 12045 1 1 8 CYS HB2 H -5.148 5.881 -3.678 1.00 . A A . 8 CYS HB2 1 1 17 12046 1 1 8 CYS HB3 H -6.746 6.495 -4.154 1.00 . A A . 8 CYS HB3 1 1 17 12047 1 1 8 CYS N N -5.048 6.442 -6.337 1.00 . A A . 8 CYS N 1 1 17 12048 1 1 8 CYS O O -7.853 5.738 -6.761 1.00 . A A . 8 CYS O 1 1 17 12049 1 1 8 CYS SG S -6.853 4.229 -3.406 1.00 . A A . 8 CYS SG 1 1 17 12050 1 1 9 GLN C C -9.196 2.716 -6.561 1.00 . A A . 9 GLN C 1 1 17 12051 1 1 9 GLN CA C -8.047 3.032 -7.527 1.00 . A A . 9 GLN CA 1 1 17 12052 1 1 9 GLN CB C -7.482 1.730 -8.097 1.00 . A A . 9 GLN CB 1 1 17 12053 1 1 9 GLN CD C -5.695 0.627 -9.517 1.00 . A A . 9 GLN CD 1 1 17 12054 1 1 9 GLN CG C -6.202 1.914 -8.903 1.00 . A A . 9 GLN CG 1 1 17 12055 1 1 9 GLN H H -6.159 3.190 -6.550 1.00 . A A . 9 GLN H 1 1 17 12056 1 1 9 GLN HA H -8.390 3.660 -8.331 1.00 . A A . 9 GLN HA 1 1 17 12057 1 1 9 GLN HB2 H -7.242 1.099 -7.258 1.00 . A A . 9 GLN HB2 1 1 17 12058 1 1 9 GLN HB3 H -8.210 1.223 -8.709 1.00 . A A . 9 GLN HB3 1 1 17 12059 1 1 9 GLN HE21 H -3.816 1.254 -9.362 1.00 . A A . 9 GLN HE21 1 1 17 12060 1 1 9 GLN HE22 H -4.041 -0.304 -10.064 1.00 . A A . 9 GLN HE22 1 1 17 12061 1 1 9 GLN HG2 H -6.357 2.647 -9.678 1.00 . A A . 9 GLN HG2 1 1 17 12062 1 1 9 GLN HG3 H -5.431 2.290 -8.243 1.00 . A A . 9 GLN HG3 1 1 17 12063 1 1 9 GLN N N -6.966 3.684 -6.795 1.00 . A A . 9 GLN N 1 1 17 12064 1 1 9 GLN NE2 N -4.393 0.516 -9.658 1.00 . A A . 9 GLN NE2 1 1 17 12065 1 1 9 GLN O O -10.283 2.324 -6.956 1.00 . A A . 9 GLN O 1 1 17 12066 1 1 9 GLN OE1 O -6.469 -0.260 -9.847 1.00 . A A . 9 GLN OE1 1 1 17 12067 1 1 10 ARG C C -10.357 1.219 -4.200 1.00 . A A . 10 ARG C 1 1 17 12068 1 1 10 ARG CA C -9.731 2.632 -4.120 1.00 . A A . 10 ARG CA 1 1 17 12069 1 1 10 ARG CB C -10.794 3.712 -3.886 1.00 . A A . 10 ARG CB 1 1 17 12070 1 1 10 ARG CD C -12.422 4.783 -2.287 1.00 . A A . 10 ARG CD 1 1 17 12071 1 1 10 ARG CG C -11.281 3.792 -2.448 1.00 . A A . 10 ARG CG 1 1 17 12072 1 1 10 ARG CZ C -14.824 4.960 -2.954 1.00 . A A . 10 ARG CZ 1 1 17 12073 1 1 10 ARG H H -8.027 3.368 -5.142 1.00 . A A . 10 ARG H 1 1 17 12074 1 1 10 ARG HA H -9.043 2.621 -3.284 1.00 . A A . 10 ARG HA 1 1 17 12075 1 1 10 ARG HB2 H -10.383 4.665 -4.181 1.00 . A A . 10 ARG HB2 1 1 17 12076 1 1 10 ARG HB3 H -11.640 3.496 -4.522 1.00 . A A . 10 ARG HB3 1 1 17 12077 1 1 10 ARG HD2 H -12.531 5.027 -1.241 1.00 . A A . 10 ARG HD2 1 1 17 12078 1 1 10 ARG HD3 H -12.153 5.680 -2.823 1.00 . A A . 10 ARG HD3 1 1 17 12079 1 1 10 ARG HE H -13.660 3.294 -3.039 1.00 . A A . 10 ARG HE 1 1 17 12080 1 1 10 ARG HG2 H -11.634 2.817 -2.147 1.00 . A A . 10 ARG HG2 1 1 17 12081 1 1 10 ARG HG3 H -10.453 4.093 -1.822 1.00 . A A . 10 ARG HG3 1 1 17 12082 1 1 10 ARG HH11 H -13.945 6.779 -2.694 1.00 . A A . 10 ARG HH11 1 1 17 12083 1 1 10 ARG HH12 H -15.638 6.826 -2.948 1.00 . A A . 10 ARG HH12 1 1 17 12084 1 1 10 ARG HH21 H -16.042 3.365 -3.399 1.00 . A A . 10 ARG HH21 1 1 17 12085 1 1 10 ARG HH22 H -16.833 4.851 -3.310 1.00 . A A . 10 ARG HH22 1 1 17 12086 1 1 10 ARG N N -8.890 2.930 -5.292 1.00 . A A . 10 ARG N 1 1 17 12087 1 1 10 ARG NE N -13.686 4.253 -2.835 1.00 . A A . 10 ARG NE 1 1 17 12088 1 1 10 ARG NH1 N -14.801 6.284 -2.858 1.00 . A A . 10 ARG NH1 1 1 17 12089 1 1 10 ARG NH2 N -15.962 4.350 -3.250 1.00 . A A . 10 ARG NH2 1 1 17 12090 1 1 10 ARG O O -11.573 1.074 -4.273 1.00 . A A . 10 ARG O 1 1 17 12091 1 1 11 PRO C C -10.479 -1.716 -2.944 1.00 . A A . 11 PRO C 1 1 17 12092 1 1 11 PRO CA C -9.963 -1.229 -4.292 1.00 . A A . 11 PRO CA 1 1 17 12093 1 1 11 PRO CB C -8.664 -1.984 -4.663 1.00 . A A . 11 PRO CB 1 1 17 12094 1 1 11 PRO CD C -8.056 0.236 -4.252 1.00 . A A . 11 PRO CD 1 1 17 12095 1 1 11 PRO CG C -7.731 -0.916 -5.104 1.00 . A A . 11 PRO CG 1 1 17 12096 1 1 11 PRO HA H -10.706 -1.401 -5.058 1.00 . A A . 11 PRO HA 1 1 17 12097 1 1 11 PRO HB2 H -8.300 -2.501 -3.789 1.00 . A A . 11 PRO HB2 1 1 17 12098 1 1 11 PRO HB3 H -8.850 -2.700 -5.448 1.00 . A A . 11 PRO HB3 1 1 17 12099 1 1 11 PRO HD2 H -7.633 0.092 -3.268 1.00 . A A . 11 PRO HD2 1 1 17 12100 1 1 11 PRO HD3 H -7.717 1.162 -4.695 1.00 . A A . 11 PRO HD3 1 1 17 12101 1 1 11 PRO HG2 H -6.703 -1.211 -4.950 1.00 . A A . 11 PRO HG2 1 1 17 12102 1 1 11 PRO HG3 H -7.926 -0.671 -6.138 1.00 . A A . 11 PRO HG3 1 1 17 12103 1 1 11 PRO N N -9.508 0.168 -4.229 1.00 . A A . 11 PRO N 1 1 17 12104 1 1 11 PRO O O -9.810 -1.517 -1.905 1.00 . A A . 11 PRO O 1 1 17 12105 1 1 12 CYS C C -12.498 -4.386 -1.918 1.00 . A A . 12 CYS C 1 1 17 12106 1 1 12 CYS CA C -12.234 -2.890 -1.766 1.00 . A A . 12 CYS CA 1 1 17 12107 1 1 12 CYS CB C -13.538 -2.137 -1.433 1.00 . A A . 12 CYS CB 1 1 17 12108 1 1 12 CYS H H -12.127 -2.490 -3.808 1.00 . A A . 12 CYS H 1 1 17 12109 1 1 12 CYS HA H -11.532 -2.748 -0.957 1.00 . A A . 12 CYS HA 1 1 17 12110 1 1 12 CYS HB2 H -13.326 -1.083 -1.339 1.00 . A A . 12 CYS HB2 1 1 17 12111 1 1 12 CYS HB3 H -14.236 -2.267 -2.248 1.00 . A A . 12 CYS HB3 1 1 17 12112 1 1 12 CYS HG H -13.424 -2.744 1.051 1.00 . A A . 12 CYS HG 1 1 17 12113 1 1 12 CYS N N -11.640 -2.359 -2.965 1.00 . A A . 12 CYS N 1 1 17 12114 1 1 12 CYS O O -13.430 -4.802 -2.612 1.00 . A A . 12 CYS O 1 1 17 12115 1 1 12 CYS SG S -14.354 -2.683 0.101 1.00 . A A . 12 CYS SG 1 1 17 12116 1 1 13 LYS C C -11.330 -7.042 0.117 1.00 . A A . 13 LYS C 1 1 17 12117 1 1 13 LYS CA C -11.764 -6.623 -1.259 1.00 . A A . 13 LYS CA 1 1 17 12118 1 1 13 LYS CB C -10.905 -7.326 -2.345 1.00 . A A . 13 LYS CB 1 1 17 12119 1 1 13 LYS CD C -10.559 -7.855 -4.806 1.00 . A A . 13 LYS CD 1 1 17 12120 1 1 13 LYS CE C -11.069 -7.589 -6.230 1.00 . A A . 13 LYS CE 1 1 17 12121 1 1 13 LYS CG C -11.353 -7.050 -3.780 1.00 . A A . 13 LYS CG 1 1 17 12122 1 1 13 LYS H H -10.883 -4.795 -0.830 1.00 . A A . 13 LYS H 1 1 17 12123 1 1 13 LYS HA H -12.808 -6.870 -1.383 1.00 . A A . 13 LYS HA 1 1 17 12124 1 1 13 LYS HB2 H -9.880 -6.989 -2.250 1.00 . A A . 13 LYS HB2 1 1 17 12125 1 1 13 LYS HB3 H -10.944 -8.390 -2.173 1.00 . A A . 13 LYS HB3 1 1 17 12126 1 1 13 LYS HD2 H -9.522 -7.570 -4.737 1.00 . A A . 13 LYS HD2 1 1 17 12127 1 1 13 LYS HD3 H -10.676 -8.905 -4.582 1.00 . A A . 13 LYS HD3 1 1 17 12128 1 1 13 LYS HE2 H -12.117 -7.849 -6.278 1.00 . A A . 13 LYS HE2 1 1 17 12129 1 1 13 LYS HE3 H -10.954 -6.539 -6.441 1.00 . A A . 13 LYS HE3 1 1 17 12130 1 1 13 LYS HG2 H -12.396 -7.311 -3.867 1.00 . A A . 13 LYS HG2 1 1 17 12131 1 1 13 LYS HG3 H -11.243 -5.998 -4.000 1.00 . A A . 13 LYS HG3 1 1 17 12132 1 1 13 LYS HZ1 H -10.780 -8.201 -8.178 1.00 . A A . 13 LYS HZ1 1 1 17 12133 1 1 13 LYS HZ2 H -10.412 -9.398 -7.070 1.00 . A A . 13 LYS HZ2 1 1 17 12134 1 1 13 LYS HZ3 H -9.340 -8.114 -7.332 1.00 . A A . 13 LYS HZ3 1 1 17 12135 1 1 13 LYS N N -11.643 -5.175 -1.315 1.00 . A A . 13 LYS N 1 1 17 12136 1 1 13 LYS NZ N -10.340 -8.377 -7.254 1.00 . A A . 13 LYS NZ 1 1 17 12137 1 1 13 LYS O O -10.659 -6.266 0.795 1.00 . A A . 13 LYS O 1 1 17 12138 1 1 14 ASP C C -9.938 -9.211 1.930 1.00 . A A . 14 ASP C 1 1 17 12139 1 1 14 ASP CA C -11.340 -8.638 1.892 1.00 . A A . 14 ASP CA 1 1 17 12140 1 1 14 ASP CB C -12.356 -9.620 2.499 1.00 . A A . 14 ASP CB 1 1 17 12141 1 1 14 ASP CG C -13.725 -8.995 2.721 1.00 . A A . 14 ASP CG 1 1 17 12142 1 1 14 ASP H H -12.286 -8.777 -0.005 1.00 . A A . 14 ASP H 1 1 17 12143 1 1 14 ASP HA H -11.331 -7.743 2.498 1.00 . A A . 14 ASP HA 1 1 17 12144 1 1 14 ASP HB2 H -12.476 -10.469 1.841 1.00 . A A . 14 ASP HB2 1 1 17 12145 1 1 14 ASP HB3 H -11.980 -9.964 3.451 1.00 . A A . 14 ASP HB3 1 1 17 12146 1 1 14 ASP N N -11.717 -8.204 0.553 1.00 . A A . 14 ASP N 1 1 17 12147 1 1 14 ASP O O -9.128 -8.823 2.760 1.00 . A A . 14 ASP O 1 1 17 12148 1 1 14 ASP OD1 O -13.934 -8.351 3.772 1.00 . A A . 14 ASP OD1 1 1 17 12149 1 1 14 ASP OD2 O -14.602 -9.137 1.839 1.00 . A A . 14 ASP OD2 1 1 17 12150 1 1 15 LYS C C -7.173 -9.903 0.452 1.00 . A A . 15 LYS C 1 1 17 12151 1 1 15 LYS CA C -8.323 -10.799 0.989 1.00 . A A . 15 LYS CA 1 1 17 12152 1 1 15 LYS CB C -8.406 -12.046 0.099 1.00 . A A . 15 LYS CB 1 1 17 12153 1 1 15 LYS CD C -9.334 -14.299 -0.392 1.00 . A A . 15 LYS CD 1 1 17 12154 1 1 15 LYS CE C -10.256 -15.412 0.063 1.00 . A A . 15 LYS CE 1 1 17 12155 1 1 15 LYS CG C -9.388 -13.107 0.548 1.00 . A A . 15 LYS CG 1 1 17 12156 1 1 15 LYS H H -10.251 -10.511 0.368 1.00 . A A . 15 LYS H 1 1 17 12157 1 1 15 LYS HA H -8.086 -11.132 1.989 1.00 . A A . 15 LYS HA 1 1 17 12158 1 1 15 LYS HB2 H -8.712 -11.748 -0.889 1.00 . A A . 15 LYS HB2 1 1 17 12159 1 1 15 LYS HB3 H -7.430 -12.497 0.050 1.00 . A A . 15 LYS HB3 1 1 17 12160 1 1 15 LYS HD2 H -9.641 -13.977 -1.382 1.00 . A A . 15 LYS HD2 1 1 17 12161 1 1 15 LYS HD3 H -8.317 -14.665 -0.434 1.00 . A A . 15 LYS HD3 1 1 17 12162 1 1 15 LYS HE2 H -10.000 -15.684 1.077 1.00 . A A . 15 LYS HE2 1 1 17 12163 1 1 15 LYS HE3 H -11.274 -15.047 0.042 1.00 . A A . 15 LYS HE3 1 1 17 12164 1 1 15 LYS HG2 H -9.140 -13.435 1.545 1.00 . A A . 15 LYS HG2 1 1 17 12165 1 1 15 LYS HG3 H -10.382 -12.687 0.527 1.00 . A A . 15 LYS HG3 1 1 17 12166 1 1 15 LYS HZ1 H -9.180 -16.981 -0.780 1.00 . A A . 15 LYS HZ1 1 1 17 12167 1 1 15 LYS HZ2 H -10.393 -16.388 -1.786 1.00 . A A . 15 LYS HZ2 1 1 17 12168 1 1 15 LYS HZ3 H -10.766 -17.359 -0.452 1.00 . A A . 15 LYS HZ3 1 1 17 12169 1 1 15 LYS N N -9.640 -10.134 1.031 1.00 . A A . 15 LYS N 1 1 17 12170 1 1 15 LYS NZ N -10.146 -16.599 -0.798 1.00 . A A . 15 LYS NZ 1 1 17 12171 1 1 15 LYS O O -6.124 -10.425 0.079 1.00 . A A . 15 LYS O 1 1 17 12172 1 1 16 VAL C C -5.460 -7.069 1.058 1.00 . A A . 16 VAL C 1 1 17 12173 1 1 16 VAL CA C -6.260 -7.741 -0.078 1.00 . A A . 16 VAL CA 1 1 17 12174 1 1 16 VAL CB C -6.768 -6.689 -1.105 1.00 . A A . 16 VAL CB 1 1 17 12175 1 1 16 VAL CG1 C -7.843 -5.832 -0.495 1.00 . A A . 16 VAL CG1 1 1 17 12176 1 1 16 VAL CG2 C -5.616 -5.813 -1.593 1.00 . A A . 16 VAL CG2 1 1 17 12177 1 1 16 VAL H H -8.137 -8.218 0.825 1.00 . A A . 16 VAL H 1 1 17 12178 1 1 16 VAL HA H -5.565 -8.401 -0.582 1.00 . A A . 16 VAL HA 1 1 17 12179 1 1 16 VAL HB H -7.179 -7.214 -1.956 1.00 . A A . 16 VAL HB 1 1 17 12180 1 1 16 VAL HG11 H -8.207 -5.112 -1.211 1.00 . A A . 16 VAL HG11 1 1 17 12181 1 1 16 VAL HG12 H -7.394 -5.331 0.350 1.00 . A A . 16 VAL HG12 1 1 17 12182 1 1 16 VAL HG13 H -8.646 -6.469 -0.151 1.00 . A A . 16 VAL HG13 1 1 17 12183 1 1 16 VAL HG21 H -5.243 -5.259 -0.741 1.00 . A A . 16 VAL HG21 1 1 17 12184 1 1 16 VAL HG22 H -5.968 -5.110 -2.335 1.00 . A A . 16 VAL HG22 1 1 17 12185 1 1 16 VAL HG23 H -4.828 -6.428 -2.006 1.00 . A A . 16 VAL HG23 1 1 17 12186 1 1 16 VAL N N -7.327 -8.601 0.439 1.00 . A A . 16 VAL N 1 1 17 12187 1 1 16 VAL O O -5.980 -6.245 1.811 1.00 . A A . 16 VAL O 1 1 17 12188 1 1 17 ASP C C -2.845 -5.514 1.829 1.00 . A A . 17 ASP C 1 1 17 12189 1 1 17 ASP CA C -3.299 -6.939 2.186 1.00 . A A . 17 ASP CA 1 1 17 12190 1 1 17 ASP CB C -2.108 -7.885 2.375 1.00 . A A . 17 ASP CB 1 1 17 12191 1 1 17 ASP CG C -1.149 -7.445 3.461 1.00 . A A . 17 ASP CG 1 1 17 12192 1 1 17 ASP H H -4.004 -8.251 0.624 1.00 . A A . 17 ASP H 1 1 17 12193 1 1 17 ASP HA H -3.837 -6.878 3.119 1.00 . A A . 17 ASP HA 1 1 17 12194 1 1 17 ASP HB2 H -2.480 -8.859 2.643 1.00 . A A . 17 ASP HB2 1 1 17 12195 1 1 17 ASP HB3 H -1.560 -7.945 1.445 1.00 . A A . 17 ASP HB3 1 1 17 12196 1 1 17 ASP N N -4.234 -7.488 1.188 1.00 . A A . 17 ASP N 1 1 17 12197 1 1 17 ASP O O -2.727 -5.158 0.635 1.00 . A A . 17 ASP O 1 1 17 12198 1 1 17 ASP OD1 O -1.538 -7.471 4.651 1.00 . A A . 17 ASP OD1 1 1 17 12199 1 1 17 ASP OD2 O -0.012 -7.120 3.145 1.00 . A A . 17 ASP OD2 1 1 17 12200 1 1 18 TRP C C -0.842 -3.074 3.221 1.00 . A A . 18 TRP C 1 1 17 12201 1 1 18 TRP CA C -2.259 -3.295 2.732 1.00 . A A . 18 TRP CA 1 1 17 12202 1 1 18 TRP CB C -3.209 -2.430 3.587 1.00 . A A . 18 TRP CB 1 1 17 12203 1 1 18 TRP CD1 C -5.428 -3.539 2.924 1.00 . A A . 18 TRP CD1 1 1 17 12204 1 1 18 TRP CD2 C -5.530 -1.318 3.045 1.00 . A A . 18 TRP CD2 1 1 17 12205 1 1 18 TRP CE2 C -6.805 -1.812 2.679 1.00 . A A . 18 TRP CE2 1 1 17 12206 1 1 18 TRP CE3 C -5.355 0.058 3.200 1.00 . A A . 18 TRP CE3 1 1 17 12207 1 1 18 TRP CG C -4.664 -2.451 3.180 1.00 . A A . 18 TRP CG 1 1 17 12208 1 1 18 TRP CH2 C -7.696 0.374 2.621 1.00 . A A . 18 TRP CH2 1 1 17 12209 1 1 18 TRP CZ2 C -7.899 -0.970 2.463 1.00 . A A . 18 TRP CZ2 1 1 17 12210 1 1 18 TRP CZ3 C -6.440 0.893 2.980 1.00 . A A . 18 TRP CZ3 1 1 17 12211 1 1 18 TRP H H -2.634 -5.097 3.758 1.00 . A A . 18 TRP H 1 1 17 12212 1 1 18 TRP HA H -2.344 -2.993 1.699 1.00 . A A . 18 TRP HA 1 1 17 12213 1 1 18 TRP HB2 H -3.165 -2.743 4.619 1.00 . A A . 18 TRP HB2 1 1 17 12214 1 1 18 TRP HB3 H -2.873 -1.404 3.534 1.00 . A A . 18 TRP HB3 1 1 17 12215 1 1 18 TRP HD1 H -5.056 -4.555 2.941 1.00 . A A . 18 TRP HD1 1 1 17 12216 1 1 18 TRP HE1 H -7.391 -3.830 2.348 1.00 . A A . 18 TRP HE1 1 1 17 12217 1 1 18 TRP HE3 H -4.394 0.470 3.477 1.00 . A A . 18 TRP HE3 1 1 17 12218 1 1 18 TRP HH2 H -8.512 1.065 2.463 1.00 . A A . 18 TRP HH2 1 1 17 12219 1 1 18 TRP HZ2 H -8.873 -1.349 2.190 1.00 . A A . 18 TRP HZ2 1 1 17 12220 1 1 18 TRP HZ3 H -6.330 1.963 3.088 1.00 . A A . 18 TRP HZ3 1 1 17 12221 1 1 18 TRP N N -2.612 -4.711 2.856 1.00 . A A . 18 TRP N 1 1 17 12222 1 1 18 TRP NE1 N -6.699 -3.171 2.588 1.00 . A A . 18 TRP NE1 1 1 17 12223 1 1 18 TRP O O -0.334 -3.862 4.006 1.00 . A A . 18 TRP O 1 1 17 12224 1 1 19 VAL C C 1.260 -0.345 3.836 1.00 . A A . 19 VAL C 1 1 17 12225 1 1 19 VAL CA C 1.147 -1.712 3.174 1.00 . A A . 19 VAL CA 1 1 17 12226 1 1 19 VAL CB C 2.129 -1.803 1.959 1.00 . A A . 19 VAL CB 1 1 17 12227 1 1 19 VAL CG1 C 2.171 -3.205 1.403 1.00 . A A . 19 VAL CG1 1 1 17 12228 1 1 19 VAL CG2 C 1.761 -0.811 0.861 1.00 . A A . 19 VAL CG2 1 1 17 12229 1 1 19 VAL H H -0.600 -1.233 2.298 1.00 . A A . 19 VAL H 1 1 17 12230 1 1 19 VAL HA H 1.434 -2.455 3.906 1.00 . A A . 19 VAL HA 1 1 17 12231 1 1 19 VAL HB H 3.107 -1.544 2.335 1.00 . A A . 19 VAL HB 1 1 17 12232 1 1 19 VAL HG11 H 1.183 -3.494 1.077 1.00 . A A . 19 VAL HG11 1 1 17 12233 1 1 19 VAL HG12 H 2.498 -3.884 2.175 1.00 . A A . 19 VAL HG12 1 1 17 12234 1 1 19 VAL HG13 H 2.849 -3.232 0.563 1.00 . A A . 19 VAL HG13 1 1 17 12235 1 1 19 VAL HG21 H 1.808 0.181 1.284 1.00 . A A . 19 VAL HG21 1 1 17 12236 1 1 19 VAL HG22 H 0.755 -1.007 0.514 1.00 . A A . 19 VAL HG22 1 1 17 12237 1 1 19 VAL HG23 H 2.467 -0.856 0.043 1.00 . A A . 19 VAL HG23 1 1 17 12238 1 1 19 VAL N N -0.221 -1.984 2.804 1.00 . A A . 19 VAL N 1 1 17 12239 1 1 19 VAL O O 0.621 0.615 3.408 1.00 . A A . 19 VAL O 1 1 17 12240 1 1 20 GLN C C 3.696 1.402 5.394 1.00 . A A . 20 GLN C 1 1 17 12241 1 1 20 GLN CA C 2.257 0.947 5.607 1.00 . A A . 20 GLN CA 1 1 17 12242 1 1 20 GLN CB C 1.971 0.728 7.106 1.00 . A A . 20 GLN CB 1 1 17 12243 1 1 20 GLN CD C 1.891 1.721 9.435 1.00 . A A . 20 GLN CD 1 1 17 12244 1 1 20 GLN CG C 2.151 1.965 7.961 1.00 . A A . 20 GLN CG 1 1 17 12245 1 1 20 GLN H H 2.437 -1.123 5.178 1.00 . A A . 20 GLN H 1 1 17 12246 1 1 20 GLN HA H 1.588 1.708 5.226 1.00 . A A . 20 GLN HA 1 1 17 12247 1 1 20 GLN HB2 H 0.944 0.414 7.220 1.00 . A A . 20 GLN HB2 1 1 17 12248 1 1 20 GLN HB3 H 2.642 -0.039 7.469 1.00 . A A . 20 GLN HB3 1 1 17 12249 1 1 20 GLN HE21 H 3.238 3.078 9.933 1.00 . A A . 20 GLN HE21 1 1 17 12250 1 1 20 GLN HE22 H 2.428 2.309 11.240 1.00 . A A . 20 GLN HE22 1 1 17 12251 1 1 20 GLN HG2 H 3.164 2.319 7.840 1.00 . A A . 20 GLN HG2 1 1 17 12252 1 1 20 GLN HG3 H 1.468 2.733 7.622 1.00 . A A . 20 GLN HG3 1 1 17 12253 1 1 20 GLN N N 2.025 -0.281 4.881 1.00 . A A . 20 GLN N 1 1 17 12254 1 1 20 GLN NE2 N 2.585 2.439 10.281 1.00 . A A . 20 GLN NE2 1 1 17 12255 1 1 20 GLN O O 4.599 0.572 5.359 1.00 . A A . 20 GLN O 1 1 17 12256 1 1 20 GLN OE1 O 1.087 0.886 9.805 1.00 . A A . 20 GLN OE1 1 1 17 12257 1 1 21 CYS C C 5.789 3.627 6.413 1.00 . A A . 21 CYS C 1 1 17 12258 1 1 21 CYS CA C 5.274 3.176 5.058 1.00 . A A . 21 CYS CA 1 1 17 12259 1 1 21 CYS CB C 5.429 4.293 3.972 1.00 . A A . 21 CYS CB 1 1 17 12260 1 1 21 CYS H H 3.148 3.312 5.151 1.00 . A A . 21 CYS H 1 1 17 12261 1 1 21 CYS HA H 5.871 2.321 4.775 1.00 . A A . 21 CYS HA 1 1 17 12262 1 1 21 CYS HB2 H 6.448 4.579 3.800 1.00 . A A . 21 CYS HB2 1 1 17 12263 1 1 21 CYS HB3 H 5.024 3.930 3.045 1.00 . A A . 21 CYS HB3 1 1 17 12264 1 1 21 CYS N N 3.914 2.696 5.193 1.00 . A A . 21 CYS N 1 1 17 12265 1 1 21 CYS O O 5.485 4.730 6.881 1.00 . A A . 21 CYS O 1 1 17 12266 1 1 21 CYS SG S 4.584 5.846 4.304 1.00 . A A . 21 CYS SG 1 1 17 12267 1 1 22 ASP C C 8.394 3.890 8.291 1.00 . A A . 22 ASP C 1 1 17 12268 1 1 22 ASP CA C 7.129 3.046 8.376 1.00 . A A . 22 ASP CA 1 1 17 12269 1 1 22 ASP CB C 7.432 1.728 9.104 1.00 . A A . 22 ASP CB 1 1 17 12270 1 1 22 ASP CG C 6.202 0.911 9.412 1.00 . A A . 22 ASP CG 1 1 17 12271 1 1 22 ASP H H 6.916 2.004 6.533 1.00 . A A . 22 ASP H 1 1 17 12272 1 1 22 ASP HA H 6.372 3.588 8.926 1.00 . A A . 22 ASP HA 1 1 17 12273 1 1 22 ASP HB2 H 8.076 1.124 8.481 1.00 . A A . 22 ASP HB2 1 1 17 12274 1 1 22 ASP HB3 H 7.929 1.954 10.038 1.00 . A A . 22 ASP HB3 1 1 17 12275 1 1 22 ASP N N 6.604 2.794 7.025 1.00 . A A . 22 ASP N 1 1 17 12276 1 1 22 ASP O O 9.219 3.912 9.199 1.00 . A A . 22 ASP O 1 1 17 12277 1 1 22 ASP OD1 O 5.542 1.195 10.429 1.00 . A A . 22 ASP OD1 1 1 17 12278 1 1 22 ASP OD2 O 5.898 -0.033 8.660 1.00 . A A . 22 ASP OD2 1 1 17 12279 1 1 23 GLY C C 9.396 6.909 7.393 1.00 . A A . 23 GLY C 1 1 17 12280 1 1 23 GLY CA C 9.649 5.465 6.994 1.00 . A A . 23 GLY CA 1 1 17 12281 1 1 23 GLY H H 7.711 4.655 6.637 1.00 . A A . 23 GLY H 1 1 17 12282 1 1 23 GLY HA2 H 10.473 5.080 7.577 1.00 . A A . 23 GLY HA2 1 1 17 12283 1 1 23 GLY HA3 H 9.910 5.435 5.946 1.00 . A A . 23 GLY HA3 1 1 17 12284 1 1 23 GLY N N 8.497 4.645 7.216 1.00 . A A . 23 GLY N 1 1 17 12285 1 1 23 GLY O O 10.272 7.760 7.225 1.00 . A A . 23 GLY O 1 1 17 12286 1 1 24 GLY C C 6.443 8.998 8.238 1.00 . A A . 24 GLY C 1 1 17 12287 1 1 24 GLY CA C 7.915 8.571 8.304 1.00 . A A . 24 GLY CA 1 1 17 12288 1 1 24 GLY H H 7.506 6.515 8.053 1.00 . A A . 24 GLY H 1 1 17 12289 1 1 24 GLY HA2 H 8.261 8.707 9.316 1.00 . A A . 24 GLY HA2 1 1 17 12290 1 1 24 GLY HA3 H 8.500 9.224 7.669 1.00 . A A . 24 GLY HA3 1 1 17 12291 1 1 24 GLY N N 8.188 7.205 7.913 1.00 . A A . 24 GLY N 1 1 17 12292 1 1 24 GLY O O 5.993 9.789 9.073 1.00 . A A . 24 GLY O 1 1 17 12293 1 1 25 CYS C C 3.365 8.085 7.984 1.00 . A A . 25 CYS C 1 1 17 12294 1 1 25 CYS CA C 4.271 8.970 7.139 1.00 . A A . 25 CYS CA 1 1 17 12295 1 1 25 CYS CB C 3.780 8.906 5.685 1.00 . A A . 25 CYS CB 1 1 17 12296 1 1 25 CYS H H 6.029 7.825 6.654 1.00 . A A . 25 CYS H 1 1 17 12297 1 1 25 CYS HA H 4.237 9.988 7.499 1.00 . A A . 25 CYS HA 1 1 17 12298 1 1 25 CYS HB2 H 3.523 7.890 5.428 1.00 . A A . 25 CYS HB2 1 1 17 12299 1 1 25 CYS HB3 H 2.885 9.500 5.602 1.00 . A A . 25 CYS HB3 1 1 17 12300 1 1 25 CYS N N 5.678 8.502 7.263 1.00 . A A . 25 CYS N 1 1 17 12301 1 1 25 CYS O O 2.372 8.542 8.534 1.00 . A A . 25 CYS O 1 1 17 12302 1 1 25 CYS SG S 4.944 9.499 4.459 1.00 . A A . 25 CYS SG 1 1 17 12303 1 1 26 ASP C C 1.606 5.546 8.208 1.00 . A A . 26 ASP C 1 1 17 12304 1 1 26 ASP CA C 2.998 5.732 8.790 1.00 . A A . 26 ASP CA 1 1 17 12305 1 1 26 ASP CB C 2.900 5.986 10.309 1.00 . A A . 26 ASP CB 1 1 17 12306 1 1 26 ASP CG C 4.242 6.113 10.987 1.00 . A A . 26 ASP CG 1 1 17 12307 1 1 26 ASP H H 4.619 6.538 7.702 1.00 . A A . 26 ASP H 1 1 17 12308 1 1 26 ASP HA H 3.544 4.815 8.624 1.00 . A A . 26 ASP HA 1 1 17 12309 1 1 26 ASP HB2 H 2.315 6.871 10.502 1.00 . A A . 26 ASP HB2 1 1 17 12310 1 1 26 ASP HB3 H 2.377 5.153 10.752 1.00 . A A . 26 ASP HB3 1 1 17 12311 1 1 26 ASP N N 3.753 6.795 8.076 1.00 . A A . 26 ASP N 1 1 17 12312 1 1 26 ASP O O 0.730 4.976 8.841 1.00 . A A . 26 ASP O 1 1 17 12313 1 1 26 ASP OD1 O 5.238 5.601 10.456 1.00 . A A . 26 ASP OD1 1 1 17 12314 1 1 26 ASP OD2 O 4.291 6.716 12.088 1.00 . A A . 26 ASP OD2 1 1 17 12315 1 1 27 GLU C C -0.043 4.541 5.624 1.00 . A A . 27 GLU C 1 1 17 12316 1 1 27 GLU CA C 0.143 5.883 6.336 1.00 . A A . 27 GLU CA 1 1 17 12317 1 1 27 GLU CB C -0.089 7.087 5.409 1.00 . A A . 27 GLU CB 1 1 17 12318 1 1 27 GLU CD C -0.596 9.596 5.301 1.00 . A A . 27 GLU CD 1 1 17 12319 1 1 27 GLU CG C -0.215 8.415 6.173 1.00 . A A . 27 GLU CG 1 1 17 12320 1 1 27 GLU H H 2.198 6.337 6.507 1.00 . A A . 27 GLU H 1 1 17 12321 1 1 27 GLU HA H -0.584 5.918 7.136 1.00 . A A . 27 GLU HA 1 1 17 12322 1 1 27 GLU HB2 H 0.778 7.159 4.767 1.00 . A A . 27 GLU HB2 1 1 17 12323 1 1 27 GLU HB3 H -0.964 6.932 4.802 1.00 . A A . 27 GLU HB3 1 1 17 12324 1 1 27 GLU HG2 H -0.932 8.310 6.970 1.00 . A A . 27 GLU HG2 1 1 17 12325 1 1 27 GLU HG3 H 0.744 8.621 6.626 1.00 . A A . 27 GLU HG3 1 1 17 12326 1 1 27 GLU N N 1.427 5.970 6.983 1.00 . A A . 27 GLU N 1 1 17 12327 1 1 27 GLU O O 0.924 3.817 5.386 1.00 . A A . 27 GLU O 1 1 17 12328 1 1 27 GLU OE1 O -1.821 9.773 5.038 1.00 . A A . 27 GLU OE1 1 1 17 12329 1 1 27 GLU OE2 O 0.300 10.355 4.883 1.00 . A A . 27 GLU OE2 1 1 17 12330 1 1 28 TRP C C -1.964 3.087 3.189 1.00 . A A . 28 TRP C 1 1 17 12331 1 1 28 TRP CA C -1.660 2.943 4.672 1.00 . A A . 28 TRP CA 1 1 17 12332 1 1 28 TRP CB C -2.842 2.292 5.397 1.00 . A A . 28 TRP CB 1 1 17 12333 1 1 28 TRP CD1 C -2.431 2.619 7.920 1.00 . A A . 28 TRP CD1 1 1 17 12334 1 1 28 TRP CD2 C -2.212 0.504 7.205 1.00 . A A . 28 TRP CD2 1 1 17 12335 1 1 28 TRP CE2 C -1.955 0.538 8.586 1.00 . A A . 28 TRP CE2 1 1 17 12336 1 1 28 TRP CE3 C -2.134 -0.721 6.539 1.00 . A A . 28 TRP CE3 1 1 17 12337 1 1 28 TRP CG C -2.508 1.844 6.794 1.00 . A A . 28 TRP CG 1 1 17 12338 1 1 28 TRP CH2 C -1.565 -1.790 8.631 1.00 . A A . 28 TRP CH2 1 1 17 12339 1 1 28 TRP CZ2 C -1.635 -0.607 9.312 1.00 . A A . 28 TRP CZ2 1 1 17 12340 1 1 28 TRP CZ3 C -1.813 -1.854 7.257 1.00 . A A . 28 TRP CZ3 1 1 17 12341 1 1 28 TRP H H -1.971 4.917 5.455 1.00 . A A . 28 TRP H 1 1 17 12342 1 1 28 TRP HA H -0.801 2.296 4.774 1.00 . A A . 28 TRP HA 1 1 17 12343 1 1 28 TRP HB2 H -3.655 2.997 5.457 1.00 . A A . 28 TRP HB2 1 1 17 12344 1 1 28 TRP HB3 H -3.167 1.427 4.836 1.00 . A A . 28 TRP HB3 1 1 17 12345 1 1 28 TRP HD1 H -2.600 3.685 7.941 1.00 . A A . 28 TRP HD1 1 1 17 12346 1 1 28 TRP HE1 H -1.965 2.154 9.916 1.00 . A A . 28 TRP HE1 1 1 17 12347 1 1 28 TRP HE3 H -2.318 -0.784 5.477 1.00 . A A . 28 TRP HE3 1 1 17 12348 1 1 28 TRP HH2 H -1.318 -2.703 9.142 1.00 . A A . 28 TRP HH2 1 1 17 12349 1 1 28 TRP HZ2 H -1.439 -0.571 10.376 1.00 . A A . 28 TRP HZ2 1 1 17 12350 1 1 28 TRP HZ3 H -1.750 -2.814 6.769 1.00 . A A . 28 TRP HZ3 1 1 17 12351 1 1 28 TRP N N -1.298 4.225 5.289 1.00 . A A . 28 TRP N 1 1 17 12352 1 1 28 TRP NE1 N -2.093 1.836 8.996 1.00 . A A . 28 TRP NE1 1 1 17 12353 1 1 28 TRP O O -2.795 3.919 2.780 1.00 . A A . 28 TRP O 1 1 17 12354 1 1 29 PHE C C -1.979 0.915 0.529 1.00 . A A . 29 PHE C 1 1 17 12355 1 1 29 PHE CA C -1.416 2.266 0.971 1.00 . A A . 29 PHE CA 1 1 17 12356 1 1 29 PHE CB C -0.004 2.445 0.341 1.00 . A A . 29 PHE CB 1 1 17 12357 1 1 29 PHE CD1 C 1.332 3.577 2.142 1.00 . A A . 29 PHE CD1 1 1 17 12358 1 1 29 PHE CD2 C 1.016 4.764 0.113 1.00 . A A . 29 PHE CD2 1 1 17 12359 1 1 29 PHE CE1 C 2.048 4.625 2.639 1.00 . A A . 29 PHE CE1 1 1 17 12360 1 1 29 PHE CE2 C 1.742 5.821 0.616 1.00 . A A . 29 PHE CE2 1 1 17 12361 1 1 29 PHE CG C 0.800 3.623 0.879 1.00 . A A . 29 PHE CG 1 1 17 12362 1 1 29 PHE CZ C 2.256 5.745 1.888 1.00 . A A . 29 PHE CZ 1 1 17 12363 1 1 29 PHE H H -0.668 1.634 2.818 1.00 . A A . 29 PHE H 1 1 17 12364 1 1 29 PHE HA H -2.053 3.075 0.643 1.00 . A A . 29 PHE HA 1 1 17 12365 1 1 29 PHE HB2 H 0.577 1.544 0.469 1.00 . A A . 29 PHE HB2 1 1 17 12366 1 1 29 PHE HB3 H -0.141 2.591 -0.721 1.00 . A A . 29 PHE HB3 1 1 17 12367 1 1 29 PHE HD1 H 1.181 2.699 2.751 1.00 . A A . 29 PHE HD1 1 1 17 12368 1 1 29 PHE HD2 H 0.610 4.832 -0.889 1.00 . A A . 29 PHE HD2 1 1 17 12369 1 1 29 PHE HE1 H 2.458 4.579 3.637 1.00 . A A . 29 PHE HE1 1 1 17 12370 1 1 29 PHE HE2 H 1.905 6.706 0.019 1.00 . A A . 29 PHE HE2 1 1 17 12371 1 1 29 PHE HZ H 2.829 6.547 2.330 1.00 . A A . 29 PHE HZ 1 1 17 12372 1 1 29 PHE N N -1.302 2.271 2.409 1.00 . A A . 29 PHE N 1 1 17 12373 1 1 29 PHE O O -1.838 -0.084 1.237 1.00 . A A . 29 PHE O 1 1 17 12374 1 1 30 HIS C C -2.023 -0.898 -2.120 1.00 . A A . 30 HIS C 1 1 17 12375 1 1 30 HIS CA C -3.103 -0.384 -1.212 1.00 . A A . 30 HIS CA 1 1 17 12376 1 1 30 HIS CB C -4.354 -0.171 -2.088 1.00 . A A . 30 HIS CB 1 1 17 12377 1 1 30 HIS CD2 C -6.547 -0.691 -0.840 1.00 . A A . 30 HIS CD2 1 1 17 12378 1 1 30 HIS CE1 C -7.406 1.314 -0.898 1.00 . A A . 30 HIS CE1 1 1 17 12379 1 1 30 HIS CG C -5.639 0.123 -1.422 1.00 . A A . 30 HIS CG 1 1 17 12380 1 1 30 HIS H H -2.697 1.733 -1.096 1.00 . A A . 30 HIS H 1 1 17 12381 1 1 30 HIS HA H -3.320 -1.081 -0.415 1.00 . A A . 30 HIS HA 1 1 17 12382 1 1 30 HIS HB2 H -4.125 0.762 -2.585 1.00 . A A . 30 HIS HB2 1 1 17 12383 1 1 30 HIS HB3 H -4.490 -0.879 -2.887 1.00 . A A . 30 HIS HB3 1 1 17 12384 1 1 30 HIS HD2 H -6.436 -1.747 -0.639 1.00 . A A . 30 HIS HD2 1 1 17 12385 1 1 30 HIS HE1 H -8.089 2.140 -0.797 1.00 . A A . 30 HIS HE1 1 1 17 12386 1 1 30 HIS HE2 H -8.538 -0.291 -0.358 1.00 . A A . 30 HIS HE2 1 1 17 12387 1 1 30 HIS N N -2.616 0.877 -0.628 1.00 . A A . 30 HIS N 1 1 17 12388 1 1 30 HIS ND1 N -6.196 1.372 -1.441 1.00 . A A . 30 HIS ND1 1 1 17 12389 1 1 30 HIS NE2 N -7.640 0.078 -0.536 1.00 . A A . 30 HIS NE2 1 1 17 12390 1 1 30 HIS O O -1.451 -0.110 -2.862 1.00 . A A . 30 HIS O 1 1 17 12391 1 1 31 GLN C C -0.895 -2.408 -4.435 1.00 . A A . 31 GLN C 1 1 17 12392 1 1 31 GLN CA C -0.724 -2.771 -2.952 1.00 . A A . 31 GLN CA 1 1 17 12393 1 1 31 GLN CB C -0.528 -4.277 -2.742 1.00 . A A . 31 GLN CB 1 1 17 12394 1 1 31 GLN CD C 0.405 -6.114 -1.265 1.00 . A A . 31 GLN CD 1 1 17 12395 1 1 31 GLN CG C 0.182 -4.626 -1.436 1.00 . A A . 31 GLN CG 1 1 17 12396 1 1 31 GLN H H -2.246 -2.767 -1.461 1.00 . A A . 31 GLN H 1 1 17 12397 1 1 31 GLN HA H 0.188 -2.279 -2.643 1.00 . A A . 31 GLN HA 1 1 17 12398 1 1 31 GLN HB2 H -1.485 -4.775 -2.757 1.00 . A A . 31 GLN HB2 1 1 17 12399 1 1 31 GLN HB3 H 0.083 -4.638 -3.556 1.00 . A A . 31 GLN HB3 1 1 17 12400 1 1 31 GLN HE21 H -1.257 -6.297 -0.218 1.00 . A A . 31 GLN HE21 1 1 17 12401 1 1 31 GLN HE22 H -0.349 -7.737 -0.452 1.00 . A A . 31 GLN HE22 1 1 17 12402 1 1 31 GLN HG2 H 1.154 -4.149 -1.455 1.00 . A A . 31 GLN HG2 1 1 17 12403 1 1 31 GLN HG3 H -0.375 -4.251 -0.593 1.00 . A A . 31 GLN HG3 1 1 17 12404 1 1 31 GLN N N -1.756 -2.197 -2.090 1.00 . A A . 31 GLN N 1 1 17 12405 1 1 31 GLN NE2 N -0.488 -6.777 -0.590 1.00 . A A . 31 GLN NE2 1 1 17 12406 1 1 31 GLN O O 0.008 -1.884 -5.023 1.00 . A A . 31 GLN O 1 1 17 12407 1 1 31 GLN OE1 O 1.398 -6.642 -1.709 1.00 . A A . 31 GLN OE1 1 1 17 12408 1 1 32 VAL C C -2.223 -0.802 -6.736 1.00 . A A . 32 VAL C 1 1 17 12409 1 1 32 VAL CA C -2.267 -2.327 -6.436 1.00 . A A . 32 VAL CA 1 1 17 12410 1 1 32 VAL CB C -3.597 -2.931 -6.965 1.00 . A A . 32 VAL CB 1 1 17 12411 1 1 32 VAL CG1 C -4.758 -2.348 -6.212 1.00 . A A . 32 VAL CG1 1 1 17 12412 1 1 32 VAL CG2 C -3.755 -2.637 -8.432 1.00 . A A . 32 VAL CG2 1 1 17 12413 1 1 32 VAL H H -2.808 -2.988 -4.484 1.00 . A A . 32 VAL H 1 1 17 12414 1 1 32 VAL HA H -1.449 -2.792 -6.961 1.00 . A A . 32 VAL HA 1 1 17 12415 1 1 32 VAL HB H -3.576 -4.000 -6.819 1.00 . A A . 32 VAL HB 1 1 17 12416 1 1 32 VAL HG11 H -4.681 -1.286 -6.395 1.00 . A A . 32 VAL HG11 1 1 17 12417 1 1 32 VAL HG12 H -4.640 -2.556 -5.159 1.00 . A A . 32 VAL HG12 1 1 17 12418 1 1 32 VAL HG13 H -5.699 -2.715 -6.589 1.00 . A A . 32 VAL HG13 1 1 17 12419 1 1 32 VAL HG21 H -4.701 -3.007 -8.801 1.00 . A A . 32 VAL HG21 1 1 17 12420 1 1 32 VAL HG22 H -2.920 -3.051 -8.976 1.00 . A A . 32 VAL HG22 1 1 17 12421 1 1 32 VAL HG23 H -3.729 -1.559 -8.497 1.00 . A A . 32 VAL HG23 1 1 17 12422 1 1 32 VAL N N -2.069 -2.620 -5.006 1.00 . A A . 32 VAL N 1 1 17 12423 1 1 32 VAL O O -1.690 -0.370 -7.747 1.00 . A A . 32 VAL O 1 1 17 12424 1 1 33 CYS C C -1.495 2.080 -5.936 1.00 . A A . 33 CYS C 1 1 17 12425 1 1 33 CYS CA C -2.860 1.411 -6.043 1.00 . A A . 33 CYS CA 1 1 17 12426 1 1 33 CYS CB C -3.927 2.069 -5.140 1.00 . A A . 33 CYS CB 1 1 17 12427 1 1 33 CYS H H -3.073 -0.524 -5.055 1.00 . A A . 33 CYS H 1 1 17 12428 1 1 33 CYS HA H -3.146 1.573 -7.074 1.00 . A A . 33 CYS HA 1 1 17 12429 1 1 33 CYS HB2 H -4.300 2.969 -5.570 1.00 . A A . 33 CYS HB2 1 1 17 12430 1 1 33 CYS HB3 H -4.768 1.391 -5.097 1.00 . A A . 33 CYS HB3 1 1 17 12431 1 1 33 CYS N N -2.763 -0.013 -5.824 1.00 . A A . 33 CYS N 1 1 17 12432 1 1 33 CYS O O -1.259 3.101 -6.548 1.00 . A A . 33 CYS O 1 1 17 12433 1 1 33 CYS SG S -3.466 2.420 -3.452 1.00 . A A . 33 CYS SG 1 1 17 12434 1 1 34 VAL C C 1.772 1.111 -5.777 1.00 . A A . 34 VAL C 1 1 17 12435 1 1 34 VAL CA C 0.721 2.038 -5.057 1.00 . A A . 34 VAL CA 1 1 17 12436 1 1 34 VAL CB C 1.080 2.282 -3.569 1.00 . A A . 34 VAL CB 1 1 17 12437 1 1 34 VAL CG1 C 1.706 1.114 -2.868 1.00 . A A . 34 VAL CG1 1 1 17 12438 1 1 34 VAL CG2 C 1.810 3.561 -3.410 1.00 . A A . 34 VAL CG2 1 1 17 12439 1 1 34 VAL H H -0.771 0.717 -4.596 1.00 . A A . 34 VAL H 1 1 17 12440 1 1 34 VAL HA H 0.709 2.983 -5.578 1.00 . A A . 34 VAL HA 1 1 17 12441 1 1 34 VAL HB H 0.184 2.350 -2.979 1.00 . A A . 34 VAL HB 1 1 17 12442 1 1 34 VAL HG11 H 2.650 0.927 -3.358 1.00 . A A . 34 VAL HG11 1 1 17 12443 1 1 34 VAL HG12 H 1.065 0.248 -2.946 1.00 . A A . 34 VAL HG12 1 1 17 12444 1 1 34 VAL HG13 H 1.877 1.342 -1.827 1.00 . A A . 34 VAL HG13 1 1 17 12445 1 1 34 VAL HG21 H 1.129 4.309 -3.791 1.00 . A A . 34 VAL HG21 1 1 17 12446 1 1 34 VAL HG22 H 2.711 3.521 -4.001 1.00 . A A . 34 VAL HG22 1 1 17 12447 1 1 34 VAL HG23 H 1.999 3.722 -2.360 1.00 . A A . 34 VAL HG23 1 1 17 12448 1 1 34 VAL N N -0.589 1.492 -5.164 1.00 . A A . 34 VAL N 1 1 17 12449 1 1 34 VAL O O 2.984 1.290 -5.656 1.00 . A A . 34 VAL O 1 1 17 12450 1 1 35 GLY C C 3.038 -1.731 -6.582 1.00 . A A . 35 GLY C 1 1 17 12451 1 1 35 GLY CA C 2.117 -0.757 -7.366 1.00 . A A . 35 GLY CA 1 1 17 12452 1 1 35 GLY H H 0.280 0.157 -6.664 1.00 . A A . 35 GLY H 1 1 17 12453 1 1 35 GLY HA2 H 1.468 -1.356 -7.985 1.00 . A A . 35 GLY HA2 1 1 17 12454 1 1 35 GLY HA3 H 2.730 -0.169 -8.033 1.00 . A A . 35 GLY HA3 1 1 17 12455 1 1 35 GLY N N 1.261 0.165 -6.567 1.00 . A A . 35 GLY N 1 1 17 12456 1 1 35 GLY O O 4.152 -2.018 -7.028 1.00 . A A . 35 GLY O 1 1 17 12457 1 1 36 VAL C C 2.870 -4.628 -5.042 1.00 . A A . 36 VAL C 1 1 17 12458 1 1 36 VAL CA C 3.320 -3.222 -4.660 1.00 . A A . 36 VAL CA 1 1 17 12459 1 1 36 VAL CB C 3.071 -3.027 -3.133 1.00 . A A . 36 VAL CB 1 1 17 12460 1 1 36 VAL CG1 C 3.779 -4.072 -2.300 1.00 . A A . 36 VAL CG1 1 1 17 12461 1 1 36 VAL CG2 C 3.488 -1.670 -2.695 1.00 . A A . 36 VAL CG2 1 1 17 12462 1 1 36 VAL H H 1.709 -1.948 -5.105 1.00 . A A . 36 VAL H 1 1 17 12463 1 1 36 VAL HA H 4.376 -3.109 -4.864 1.00 . A A . 36 VAL HA 1 1 17 12464 1 1 36 VAL HB H 2.011 -3.125 -2.955 1.00 . A A . 36 VAL HB 1 1 17 12465 1 1 36 VAL HG11 H 3.595 -3.867 -1.257 1.00 . A A . 36 VAL HG11 1 1 17 12466 1 1 36 VAL HG12 H 4.834 -4.071 -2.525 1.00 . A A . 36 VAL HG12 1 1 17 12467 1 1 36 VAL HG13 H 3.354 -5.033 -2.552 1.00 . A A . 36 VAL HG13 1 1 17 12468 1 1 36 VAL HG21 H 3.412 -1.571 -1.621 1.00 . A A . 36 VAL HG21 1 1 17 12469 1 1 36 VAL HG22 H 2.823 -0.966 -3.169 1.00 . A A . 36 VAL HG22 1 1 17 12470 1 1 36 VAL HG23 H 4.504 -1.488 -3.014 1.00 . A A . 36 VAL HG23 1 1 17 12471 1 1 36 VAL N N 2.581 -2.233 -5.452 1.00 . A A . 36 VAL N 1 1 17 12472 1 1 36 VAL O O 1.708 -4.844 -5.405 1.00 . A A . 36 VAL O 1 1 17 12473 1 1 37 SER C C 3.454 -7.634 -3.833 1.00 . A A . 37 SER C 1 1 17 12474 1 1 37 SER CA C 3.479 -6.936 -5.206 1.00 . A A . 37 SER CA 1 1 17 12475 1 1 37 SER CB C 4.573 -7.532 -6.100 1.00 . A A . 37 SER CB 1 1 17 12476 1 1 37 SER H H 4.725 -5.485 -4.746 1.00 . A A . 37 SER H 1 1 17 12477 1 1 37 SER HA H 2.517 -7.031 -5.685 1.00 . A A . 37 SER HA 1 1 17 12478 1 1 37 SER HB2 H 4.392 -8.582 -6.268 1.00 . A A . 37 SER HB2 1 1 17 12479 1 1 37 SER HB3 H 4.579 -7.009 -7.041 1.00 . A A . 37 SER HB3 1 1 17 12480 1 1 37 SER HG H 6.525 -7.830 -6.015 1.00 . A A . 37 SER HG 1 1 17 12481 1 1 37 SER N N 3.778 -5.572 -4.977 1.00 . A A . 37 SER N 1 1 17 12482 1 1 37 SER O O 4.160 -7.191 -2.921 1.00 . A A . 37 SER O 1 1 17 12483 1 1 37 SER OG O 5.862 -7.372 -5.489 1.00 . A A . 37 SER OG 1 1 17 12484 1 1 38 PRO C C 3.839 -9.752 -1.700 1.00 . A A . 38 PRO C 1 1 17 12485 1 1 38 PRO CA C 2.495 -9.438 -2.373 1.00 . A A . 38 PRO CA 1 1 17 12486 1 1 38 PRO CB C 1.773 -10.739 -2.762 1.00 . A A . 38 PRO CB 1 1 17 12487 1 1 38 PRO CD C 1.814 -9.314 -4.703 1.00 . A A . 38 PRO CD 1 1 17 12488 1 1 38 PRO CG C 1.730 -10.744 -4.258 1.00 . A A . 38 PRO CG 1 1 17 12489 1 1 38 PRO HA H 1.871 -8.865 -1.701 1.00 . A A . 38 PRO HA 1 1 17 12490 1 1 38 PRO HB2 H 2.322 -11.588 -2.378 1.00 . A A . 38 PRO HB2 1 1 17 12491 1 1 38 PRO HB3 H 0.780 -10.745 -2.340 1.00 . A A . 38 PRO HB3 1 1 17 12492 1 1 38 PRO HD2 H 2.294 -9.252 -5.670 1.00 . A A . 38 PRO HD2 1 1 17 12493 1 1 38 PRO HD3 H 0.848 -8.831 -4.749 1.00 . A A . 38 PRO HD3 1 1 17 12494 1 1 38 PRO HG2 H 2.597 -11.274 -4.613 1.00 . A A . 38 PRO HG2 1 1 17 12495 1 1 38 PRO HG3 H 0.827 -11.205 -4.626 1.00 . A A . 38 PRO HG3 1 1 17 12496 1 1 38 PRO N N 2.647 -8.718 -3.667 1.00 . A A . 38 PRO N 1 1 17 12497 1 1 38 PRO O O 3.979 -9.635 -0.486 1.00 . A A . 38 PRO O 1 1 17 12498 1 1 39 GLU C C 6.833 -9.252 -1.387 1.00 . A A . 39 GLU C 1 1 17 12499 1 1 39 GLU CA C 6.184 -10.442 -2.095 1.00 . A A . 39 GLU CA 1 1 17 12500 1 1 39 GLU CB C 6.993 -10.806 -3.357 1.00 . A A . 39 GLU CB 1 1 17 12501 1 1 39 GLU CD C 9.156 -11.473 -4.448 1.00 . A A . 39 GLU CD 1 1 17 12502 1 1 39 GLU CG C 8.455 -11.168 -3.135 1.00 . A A . 39 GLU CG 1 1 17 12503 1 1 39 GLU H H 4.658 -10.256 -3.480 1.00 . A A . 39 GLU H 1 1 17 12504 1 1 39 GLU HA H 6.225 -11.287 -1.418 1.00 . A A . 39 GLU HA 1 1 17 12505 1 1 39 GLU HB2 H 6.530 -11.655 -3.839 1.00 . A A . 39 GLU HB2 1 1 17 12506 1 1 39 GLU HB3 H 6.951 -9.963 -4.033 1.00 . A A . 39 GLU HB3 1 1 17 12507 1 1 39 GLU HG2 H 8.967 -10.347 -2.654 1.00 . A A . 39 GLU HG2 1 1 17 12508 1 1 39 GLU HG3 H 8.496 -12.053 -2.511 1.00 . A A . 39 GLU HG3 1 1 17 12509 1 1 39 GLU N N 4.822 -10.136 -2.522 1.00 . A A . 39 GLU N 1 1 17 12510 1 1 39 GLU O O 7.509 -9.419 -0.393 1.00 . A A . 39 GLU O 1 1 17 12511 1 1 39 GLU OE1 O 9.541 -10.540 -5.157 1.00 . A A . 39 GLU OE1 1 1 17 12512 1 1 39 GLU OE2 O 9.304 -12.654 -4.802 1.00 . A A . 39 GLU OE2 1 1 17 12513 1 1 40 MET C C 6.707 -6.609 0.098 1.00 . A A . 40 MET C 1 1 17 12514 1 1 40 MET CA C 7.264 -6.920 -1.280 1.00 . A A . 40 MET CA 1 1 17 12515 1 1 40 MET CB C 7.205 -5.696 -2.188 1.00 . A A . 40 MET CB 1 1 17 12516 1 1 40 MET CE C 6.873 -2.742 -3.472 1.00 . A A . 40 MET CE 1 1 17 12517 1 1 40 MET CG C 8.053 -4.541 -1.657 1.00 . A A . 40 MET CG 1 1 17 12518 1 1 40 MET H H 5.929 -7.922 -2.564 1.00 . A A . 40 MET H 1 1 17 12519 1 1 40 MET HA H 8.297 -7.205 -1.156 1.00 . A A . 40 MET HA 1 1 17 12520 1 1 40 MET HB2 H 7.328 -5.906 -3.237 1.00 . A A . 40 MET HB2 1 1 17 12521 1 1 40 MET HB3 H 6.177 -5.379 -2.115 1.00 . A A . 40 MET HB3 1 1 17 12522 1 1 40 MET HE1 H 6.390 -3.588 -3.939 1.00 . A A . 40 MET HE1 1 1 17 12523 1 1 40 MET HE2 H 6.982 -1.943 -4.192 1.00 . A A . 40 MET HE2 1 1 17 12524 1 1 40 MET HE3 H 6.283 -2.410 -2.631 1.00 . A A . 40 MET HE3 1 1 17 12525 1 1 40 MET HG2 H 7.476 -4.054 -0.888 1.00 . A A . 40 MET HG2 1 1 17 12526 1 1 40 MET HG3 H 8.957 -4.949 -1.227 1.00 . A A . 40 MET HG3 1 1 17 12527 1 1 40 MET N N 6.594 -8.053 -1.858 1.00 . A A . 40 MET N 1 1 17 12528 1 1 40 MET O O 7.449 -6.275 1.002 1.00 . A A . 40 MET O 1 1 17 12529 1 1 40 MET SD S 8.475 -3.265 -2.891 1.00 . A A . 40 MET SD 1 1 17 12530 1 1 41 ALA C C 5.222 -7.398 2.637 1.00 . A A . 41 ALA C 1 1 17 12531 1 1 41 ALA CA C 4.705 -6.495 1.498 1.00 . A A . 41 ALA CA 1 1 17 12532 1 1 41 ALA CB C 3.207 -6.724 1.303 1.00 . A A . 41 ALA CB 1 1 17 12533 1 1 41 ALA H H 4.864 -6.950 -0.561 1.00 . A A . 41 ALA H 1 1 17 12534 1 1 41 ALA HA H 4.847 -5.463 1.781 1.00 . A A . 41 ALA HA 1 1 17 12535 1 1 41 ALA HB1 H 2.671 -6.499 2.214 1.00 . A A . 41 ALA HB1 1 1 17 12536 1 1 41 ALA HB2 H 3.054 -7.761 1.042 1.00 . A A . 41 ALA HB2 1 1 17 12537 1 1 41 ALA HB3 H 2.837 -6.108 0.498 1.00 . A A . 41 ALA HB3 1 1 17 12538 1 1 41 ALA N N 5.399 -6.731 0.230 1.00 . A A . 41 ALA N 1 1 17 12539 1 1 41 ALA O O 5.530 -6.923 3.724 1.00 . A A . 41 ALA O 1 1 17 12540 1 1 42 GLU C C 7.264 -9.825 3.486 1.00 . A A . 42 GLU C 1 1 17 12541 1 1 42 GLU CA C 5.764 -9.615 3.433 1.00 . A A . 42 GLU CA 1 1 17 12542 1 1 42 GLU CB C 5.100 -10.985 3.357 1.00 . A A . 42 GLU CB 1 1 17 12543 1 1 42 GLU CD C 3.097 -12.436 3.622 1.00 . A A . 42 GLU CD 1 1 17 12544 1 1 42 GLU CG C 3.591 -11.011 3.482 1.00 . A A . 42 GLU CG 1 1 17 12545 1 1 42 GLU H H 5.032 -8.942 1.478 1.00 . A A . 42 GLU H 1 1 17 12546 1 1 42 GLU HA H 5.471 -9.159 4.364 1.00 . A A . 42 GLU HA 1 1 17 12547 1 1 42 GLU HB2 H 5.360 -11.422 2.407 1.00 . A A . 42 GLU HB2 1 1 17 12548 1 1 42 GLU HB3 H 5.511 -11.595 4.145 1.00 . A A . 42 GLU HB3 1 1 17 12549 1 1 42 GLU HG2 H 3.300 -10.448 4.363 1.00 . A A . 42 GLU HG2 1 1 17 12550 1 1 42 GLU HG3 H 3.159 -10.578 2.588 1.00 . A A . 42 GLU HG3 1 1 17 12551 1 1 42 GLU N N 5.324 -8.689 2.378 1.00 . A A . 42 GLU N 1 1 17 12552 1 1 42 GLU O O 7.806 -10.184 4.546 1.00 . A A . 42 GLU O 1 1 17 12553 1 1 42 GLU OE1 O 2.979 -13.142 2.595 1.00 . A A . 42 GLU OE1 1 1 17 12554 1 1 42 GLU OE2 O 2.851 -12.880 4.773 1.00 . A A . 42 GLU OE2 1 1 17 12555 1 1 43 ASN C C 10.280 -8.780 2.616 1.00 . A A . 43 ASN C 1 1 17 12556 1 1 43 ASN CA C 9.358 -9.955 2.369 1.00 . A A . 43 ASN CA 1 1 17 12557 1 1 43 ASN CB C 9.755 -10.693 1.082 1.00 . A A . 43 ASN CB 1 1 17 12558 1 1 43 ASN CG C 9.043 -12.030 0.902 1.00 . A A . 43 ASN CG 1 1 17 12559 1 1 43 ASN H H 7.586 -9.191 1.589 1.00 . A A . 43 ASN H 1 1 17 12560 1 1 43 ASN HA H 9.512 -10.636 3.194 1.00 . A A . 43 ASN HA 1 1 17 12561 1 1 43 ASN HB2 H 9.517 -10.072 0.229 1.00 . A A . 43 ASN HB2 1 1 17 12562 1 1 43 ASN HB3 H 10.820 -10.854 1.121 1.00 . A A . 43 ASN HB3 1 1 17 12563 1 1 43 ASN HD21 H 10.460 -12.902 1.883 1.00 . A A . 43 ASN HD21 1 1 17 12564 1 1 43 ASN HD22 H 9.191 -13.944 1.339 1.00 . A A . 43 ASN HD22 1 1 17 12565 1 1 43 ASN N N 7.957 -9.608 2.394 1.00 . A A . 43 ASN N 1 1 17 12566 1 1 43 ASN ND2 N 9.617 -13.068 1.428 1.00 . A A . 43 ASN ND2 1 1 17 12567 1 1 43 ASN O O 11.372 -8.966 3.147 1.00 . A A . 43 ASN O 1 1 17 12568 1 1 43 ASN OD1 O 7.978 -12.116 0.303 1.00 . A A . 43 ASN OD1 1 1 17 12569 1 1 44 GLU C C 10.085 -5.186 2.953 1.00 . A A . 44 GLU C 1 1 17 12570 1 1 44 GLU CA C 10.747 -6.436 2.423 1.00 . A A . 44 GLU CA 1 1 17 12571 1 1 44 GLU CB C 11.583 -6.152 1.159 1.00 . A A . 44 GLU CB 1 1 17 12572 1 1 44 GLU CD C 13.533 -6.887 -0.253 1.00 . A A . 44 GLU CD 1 1 17 12573 1 1 44 GLU CG C 12.622 -7.221 0.877 1.00 . A A . 44 GLU CG 1 1 17 12574 1 1 44 GLU H H 8.943 -7.430 1.950 1.00 . A A . 44 GLU H 1 1 17 12575 1 1 44 GLU HA H 11.441 -6.728 3.198 1.00 . A A . 44 GLU HA 1 1 17 12576 1 1 44 GLU HB2 H 10.913 -6.104 0.313 1.00 . A A . 44 GLU HB2 1 1 17 12577 1 1 44 GLU HB3 H 12.086 -5.204 1.264 1.00 . A A . 44 GLU HB3 1 1 17 12578 1 1 44 GLU HG2 H 13.220 -7.356 1.767 1.00 . A A . 44 GLU HG2 1 1 17 12579 1 1 44 GLU HG3 H 12.110 -8.145 0.662 1.00 . A A . 44 GLU HG3 1 1 17 12580 1 1 44 GLU N N 9.861 -7.572 2.273 1.00 . A A . 44 GLU N 1 1 17 12581 1 1 44 GLU O O 8.896 -5.155 3.257 1.00 . A A . 44 GLU O 1 1 17 12582 1 1 44 GLU OE1 O 14.422 -6.036 -0.061 1.00 . A A . 44 GLU OE1 1 1 17 12583 1 1 44 GLU OE2 O 13.405 -7.486 -1.330 1.00 . A A . 44 GLU OE2 1 1 17 12584 1 1 45 ASP C C 9.893 -1.943 2.652 1.00 . A A . 45 ASP C 1 1 17 12585 1 1 45 ASP CA C 10.565 -2.892 3.661 1.00 . A A . 45 ASP CA 1 1 17 12586 1 1 45 ASP CB C 11.886 -2.304 4.159 1.00 . A A . 45 ASP CB 1 1 17 12587 1 1 45 ASP CG C 11.782 -0.937 4.776 1.00 . A A . 45 ASP CG 1 1 17 12588 1 1 45 ASP H H 11.821 -4.276 2.774 1.00 . A A . 45 ASP H 1 1 17 12589 1 1 45 ASP HA H 9.934 -3.051 4.520 1.00 . A A . 45 ASP HA 1 1 17 12590 1 1 45 ASP HB2 H 12.297 -2.969 4.903 1.00 . A A . 45 ASP HB2 1 1 17 12591 1 1 45 ASP HB3 H 12.555 -2.263 3.314 1.00 . A A . 45 ASP HB3 1 1 17 12592 1 1 45 ASP N N 10.898 -4.179 3.076 1.00 . A A . 45 ASP N 1 1 17 12593 1 1 45 ASP O O 10.468 -1.620 1.612 1.00 . A A . 45 ASP O 1 1 17 12594 1 1 45 ASP OD1 O 11.361 -0.843 5.938 1.00 . A A . 45 ASP OD1 1 1 17 12595 1 1 45 ASP OD2 O 12.192 0.035 4.132 1.00 . A A . 45 ASP OD2 1 1 17 12596 1 1 46 TYR C C 8.202 0.887 2.527 1.00 . A A . 46 TYR C 1 1 17 12597 1 1 46 TYR CA C 7.947 -0.580 2.113 1.00 . A A . 46 TYR CA 1 1 17 12598 1 1 46 TYR CB C 6.415 -0.886 2.004 1.00 . A A . 46 TYR CB 1 1 17 12599 1 1 46 TYR CD1 C 5.452 0.118 -0.147 1.00 . A A . 46 TYR CD1 1 1 17 12600 1 1 46 TYR CD2 C 5.052 1.252 1.904 1.00 . A A . 46 TYR CD2 1 1 17 12601 1 1 46 TYR CE1 C 4.741 1.119 -0.819 1.00 . A A . 46 TYR CE1 1 1 17 12602 1 1 46 TYR CE2 C 4.355 2.222 1.232 1.00 . A A . 46 TYR CE2 1 1 17 12603 1 1 46 TYR CG C 5.623 0.179 1.237 1.00 . A A . 46 TYR CG 1 1 17 12604 1 1 46 TYR CZ C 4.208 2.151 -0.109 1.00 . A A . 46 TYR CZ 1 1 17 12605 1 1 46 TYR H H 8.248 -2.002 3.709 1.00 . A A . 46 TYR H 1 1 17 12606 1 1 46 TYR HA H 8.375 -0.699 1.129 1.00 . A A . 46 TYR HA 1 1 17 12607 1 1 46 TYR HB2 H 6.264 -1.809 1.459 1.00 . A A . 46 TYR HB2 1 1 17 12608 1 1 46 TYR HB3 H 5.995 -0.964 2.993 1.00 . A A . 46 TYR HB3 1 1 17 12609 1 1 46 TYR HD1 H 5.881 -0.710 -0.689 1.00 . A A . 46 TYR HD1 1 1 17 12610 1 1 46 TYR HD2 H 5.160 1.326 2.976 1.00 . A A . 46 TYR HD2 1 1 17 12611 1 1 46 TYR HE1 H 4.566 1.123 -1.887 1.00 . A A . 46 TYR HE1 1 1 17 12612 1 1 46 TYR HE2 H 3.915 3.056 1.756 1.00 . A A . 46 TYR HE2 1 1 17 12613 1 1 46 TYR HH H 2.899 2.736 -1.347 1.00 . A A . 46 TYR HH 1 1 17 12614 1 1 46 TYR N N 8.653 -1.550 2.941 1.00 . A A . 46 TYR N 1 1 17 12615 1 1 46 TYR O O 7.759 1.364 3.584 1.00 . A A . 46 TYR O 1 1 17 12616 1 1 46 TYR OH O 3.537 3.136 -0.753 1.00 . A A . 46 TYR OH 1 1 17 12617 1 1 47 ILE C C 8.312 3.649 0.662 1.00 . A A . 47 ILE C 1 1 17 12618 1 1 47 ILE CA C 9.137 2.979 1.775 1.00 . A A . 47 ILE CA 1 1 17 12619 1 1 47 ILE CB C 10.657 3.318 1.634 1.00 . A A . 47 ILE CB 1 1 17 12620 1 1 47 ILE CD1 C 11.073 3.099 4.167 1.00 . A A . 47 ILE CD1 1 1 17 12621 1 1 47 ILE CG1 C 11.468 2.654 2.760 1.00 . A A . 47 ILE CG1 1 1 17 12622 1 1 47 ILE CG2 C 10.883 4.806 1.666 1.00 . A A . 47 ILE CG2 1 1 17 12623 1 1 47 ILE H H 9.256 0.967 0.988 1.00 . A A . 47 ILE H 1 1 17 12624 1 1 47 ILE HA H 8.761 3.324 2.729 1.00 . A A . 47 ILE HA 1 1 17 12625 1 1 47 ILE HB H 11.008 2.933 0.687 1.00 . A A . 47 ILE HB 1 1 17 12626 1 1 47 ILE HD11 H 10.045 2.825 4.344 1.00 . A A . 47 ILE HD11 1 1 17 12627 1 1 47 ILE HD12 H 11.192 4.169 4.269 1.00 . A A . 47 ILE HD12 1 1 17 12628 1 1 47 ILE HD13 H 11.708 2.606 4.887 1.00 . A A . 47 ILE HD13 1 1 17 12629 1 1 47 ILE HG12 H 11.328 1.585 2.719 1.00 . A A . 47 ILE HG12 1 1 17 12630 1 1 47 ILE HG13 H 12.518 2.870 2.637 1.00 . A A . 47 ILE HG13 1 1 17 12631 1 1 47 ILE HG21 H 10.482 5.152 2.611 1.00 . A A . 47 ILE HG21 1 1 17 12632 1 1 47 ILE HG22 H 10.364 5.263 0.835 1.00 . A A . 47 ILE HG22 1 1 17 12633 1 1 47 ILE HG23 H 11.940 5.028 1.618 1.00 . A A . 47 ILE HG23 1 1 17 12634 1 1 47 ILE N N 8.910 1.564 1.678 1.00 . A A . 47 ILE N 1 1 17 12635 1 1 47 ILE O O 8.219 3.110 -0.429 1.00 . A A . 47 ILE O 1 1 17 12636 1 1 48 CYS C C 7.600 6.468 -0.838 1.00 . A A . 48 CYS C 1 1 17 12637 1 1 48 CYS CA C 6.830 5.402 -0.074 1.00 . A A . 48 CYS CA 1 1 17 12638 1 1 48 CYS CB C 5.607 6.078 0.573 1.00 . A A . 48 CYS CB 1 1 17 12639 1 1 48 CYS H H 7.829 5.338 1.731 1.00 . A A . 48 CYS H 1 1 17 12640 1 1 48 CYS HA H 6.501 4.635 -0.753 1.00 . A A . 48 CYS HA 1 1 17 12641 1 1 48 CYS HB2 H 4.858 6.243 -0.191 1.00 . A A . 48 CYS HB2 1 1 17 12642 1 1 48 CYS HB3 H 5.204 5.429 1.333 1.00 . A A . 48 CYS HB3 1 1 17 12643 1 1 48 CYS N N 7.701 4.805 0.927 1.00 . A A . 48 CYS N 1 1 17 12644 1 1 48 CYS O O 8.733 6.788 -0.496 1.00 . A A . 48 CYS O 1 1 17 12645 1 1 48 CYS SG S 5.961 7.693 1.329 1.00 . A A . 48 CYS SG 1 1 17 12646 1 1 49 ILE C C 7.989 9.324 -1.798 1.00 . A A . 49 ILE C 1 1 17 12647 1 1 49 ILE CA C 7.485 8.117 -2.648 1.00 . A A . 49 ILE CA 1 1 17 12648 1 1 49 ILE CB C 6.423 8.566 -3.688 1.00 . A A . 49 ILE CB 1 1 17 12649 1 1 49 ILE CD1 C 6.058 10.030 -5.695 1.00 . A A . 49 ILE CD1 1 1 17 12650 1 1 49 ILE CG1 C 6.981 9.657 -4.577 1.00 . A A . 49 ILE CG1 1 1 17 12651 1 1 49 ILE CG2 C 5.125 9.022 -3.009 1.00 . A A . 49 ILE CG2 1 1 17 12652 1 1 49 ILE H H 6.061 6.680 -2.035 1.00 . A A . 49 ILE H 1 1 17 12653 1 1 49 ILE HA H 8.333 7.734 -3.200 1.00 . A A . 49 ILE HA 1 1 17 12654 1 1 49 ILE HB H 6.179 7.715 -4.308 1.00 . A A . 49 ILE HB 1 1 17 12655 1 1 49 ILE HD11 H 6.506 10.777 -6.332 1.00 . A A . 49 ILE HD11 1 1 17 12656 1 1 49 ILE HD12 H 5.140 10.391 -5.257 1.00 . A A . 49 ILE HD12 1 1 17 12657 1 1 49 ILE HD13 H 5.882 9.127 -6.259 1.00 . A A . 49 ILE HD13 1 1 17 12658 1 1 49 ILE HG12 H 7.141 10.521 -3.952 1.00 . A A . 49 ILE HG12 1 1 17 12659 1 1 49 ILE HG13 H 7.912 9.313 -5.000 1.00 . A A . 49 ILE HG13 1 1 17 12660 1 1 49 ILE HG21 H 4.403 9.310 -3.759 1.00 . A A . 49 ILE HG21 1 1 17 12661 1 1 49 ILE HG22 H 5.336 9.864 -2.368 1.00 . A A . 49 ILE HG22 1 1 17 12662 1 1 49 ILE HG23 H 4.728 8.214 -2.412 1.00 . A A . 49 ILE HG23 1 1 17 12663 1 1 49 ILE N N 6.947 7.046 -1.831 1.00 . A A . 49 ILE N 1 1 17 12664 1 1 49 ILE O O 9.016 9.915 -2.097 1.00 . A A . 49 ILE O 1 1 17 12665 1 1 50 ASN C C 8.772 10.357 1.100 1.00 . A A . 50 ASN C 1 1 17 12666 1 1 50 ASN CA C 7.653 10.757 0.153 1.00 . A A . 50 ASN CA 1 1 17 12667 1 1 50 ASN CB C 6.448 11.243 0.982 1.00 . A A . 50 ASN CB 1 1 17 12668 1 1 50 ASN CG C 5.279 11.738 0.138 1.00 . A A . 50 ASN CG 1 1 17 12669 1 1 50 ASN H H 6.534 9.052 -0.471 1.00 . A A . 50 ASN H 1 1 17 12670 1 1 50 ASN HA H 8.003 11.565 -0.475 1.00 . A A . 50 ASN HA 1 1 17 12671 1 1 50 ASN HB2 H 6.100 10.437 1.607 1.00 . A A . 50 ASN HB2 1 1 17 12672 1 1 50 ASN HB3 H 6.771 12.051 1.621 1.00 . A A . 50 ASN HB3 1 1 17 12673 1 1 50 ASN HD21 H 5.934 13.617 0.217 1.00 . A A . 50 ASN HD21 1 1 17 12674 1 1 50 ASN HD22 H 4.479 13.342 -0.656 1.00 . A A . 50 ASN HD22 1 1 17 12675 1 1 50 ASN N N 7.291 9.624 -0.707 1.00 . A A . 50 ASN N 1 1 17 12676 1 1 50 ASN ND2 N 5.234 13.023 -0.124 1.00 . A A . 50 ASN ND2 1 1 17 12677 1 1 50 ASN O O 9.643 11.152 1.411 1.00 . A A . 50 ASN O 1 1 17 12678 1 1 50 ASN OD1 O 4.405 10.960 -0.248 1.00 . A A . 50 ASN OD1 1 1 17 12679 1 1 51 CYS C C 11.087 8.323 1.716 1.00 . A A . 51 CYS C 1 1 17 12680 1 1 51 CYS CA C 9.749 8.594 2.453 1.00 . A A . 51 CYS CA 1 1 17 12681 1 1 51 CYS CB C 9.255 7.295 3.162 1.00 . A A . 51 CYS CB 1 1 17 12682 1 1 51 CYS H H 8.025 8.520 1.237 1.00 . A A . 51 CYS H 1 1 17 12683 1 1 51 CYS HA H 9.925 9.348 3.208 1.00 . A A . 51 CYS HA 1 1 17 12684 1 1 51 CYS HB2 H 8.853 6.629 2.413 1.00 . A A . 51 CYS HB2 1 1 17 12685 1 1 51 CYS HB3 H 10.125 6.830 3.603 1.00 . A A . 51 CYS HB3 1 1 17 12686 1 1 51 CYS N N 8.738 9.114 1.547 1.00 . A A . 51 CYS N 1 1 17 12687 1 1 51 CYS O O 12.161 8.318 2.317 1.00 . A A . 51 CYS O 1 1 17 12688 1 1 51 CYS SG S 7.987 7.483 4.462 1.00 . A A . 51 CYS SG 1 1 17 12689 1 1 52 ALA C C 12.982 9.067 -0.737 1.00 . A A . 52 ALA C 1 1 17 12690 1 1 52 ALA CA C 12.200 7.798 -0.376 1.00 . A A . 52 ALA CA 1 1 17 12691 1 1 52 ALA CB C 11.823 7.024 -1.625 1.00 . A A . 52 ALA CB 1 1 17 12692 1 1 52 ALA H H 10.109 8.128 0.034 1.00 . A A . 52 ALA H 1 1 17 12693 1 1 52 ALA HA H 12.839 7.177 0.229 1.00 . A A . 52 ALA HA 1 1 17 12694 1 1 52 ALA HB1 H 12.722 6.719 -2.141 1.00 . A A . 52 ALA HB1 1 1 17 12695 1 1 52 ALA HB2 H 11.217 7.644 -2.270 1.00 . A A . 52 ALA HB2 1 1 17 12696 1 1 52 ALA HB3 H 11.257 6.155 -1.318 1.00 . A A . 52 ALA HB3 1 1 17 12697 1 1 52 ALA N N 11.009 8.093 0.428 1.00 . A A . 52 ALA N 1 1 17 12698 2 2 1 ZN ZN ZN 5.880 7.613 3.604 1.00 . B A . 53 ZN ZN 1 1 17 12699 3 2 1 ZN ZN ZN -5.320 3.015 -2.185 1.00 . C A . 54 ZN ZN 1 1 18 12700 1 1 1 SER C C -10.833 5.351 2.544 1.00 . A A . 1 SER C 1 1 18 12701 1 1 1 SER CA C -11.874 5.210 3.689 1.00 . A A . 1 SER CA 1 1 18 12702 1 1 1 SER CB C -11.187 4.946 5.064 1.00 . A A . 1 SER CB 1 1 18 12703 1 1 1 SER HA H -12.441 6.130 3.731 1.00 . A A . 1 SER HA 1 1 18 12704 1 1 1 SER HB2 H -11.950 4.873 5.827 1.00 . A A . 1 SER HB2 1 1 18 12705 1 1 1 SER HB3 H -10.646 4.014 5.001 1.00 . A A . 1 SER HB3 1 1 18 12706 1 1 1 SER HG H -9.613 5.648 6.036 1.00 . A A . 1 SER HG 1 1 18 12707 1 1 1 SER N N -12.845 4.120 3.385 1.00 . A A . 1 SER N 1 1 18 12708 1 1 1 SER O O -10.550 4.381 1.811 1.00 . A A . 1 SER O 1 1 18 12709 1 1 1 SER OG O -10.280 5.991 5.425 1.00 . A A . 1 SER OG 1 1 18 12710 1 1 2 VAL C C -7.935 6.749 1.932 1.00 . A A . 2 VAL C 1 1 18 12711 1 1 2 VAL CA C -9.330 6.825 1.338 1.00 . A A . 2 VAL CA 1 1 18 12712 1 1 2 VAL CB C -9.573 8.230 0.708 1.00 . A A . 2 VAL CB 1 1 18 12713 1 1 2 VAL CG1 C -8.517 8.554 -0.341 1.00 . A A . 2 VAL CG1 1 1 18 12714 1 1 2 VAL CG2 C -10.966 8.329 0.091 1.00 . A A . 2 VAL CG2 1 1 18 12715 1 1 2 VAL H H -10.478 7.259 3.037 1.00 . A A . 2 VAL H 1 1 18 12716 1 1 2 VAL HA H -9.419 6.060 0.579 1.00 . A A . 2 VAL HA 1 1 18 12717 1 1 2 VAL HB H -9.505 8.947 1.512 1.00 . A A . 2 VAL HB 1 1 18 12718 1 1 2 VAL HG11 H -8.551 7.809 -1.122 1.00 . A A . 2 VAL HG11 1 1 18 12719 1 1 2 VAL HG12 H -7.542 8.558 0.128 1.00 . A A . 2 VAL HG12 1 1 18 12720 1 1 2 VAL HG13 H -8.712 9.530 -0.758 1.00 . A A . 2 VAL HG13 1 1 18 12721 1 1 2 VAL HG21 H -11.724 8.227 0.853 1.00 . A A . 2 VAL HG21 1 1 18 12722 1 1 2 VAL HG22 H -11.091 7.561 -0.658 1.00 . A A . 2 VAL HG22 1 1 18 12723 1 1 2 VAL HG23 H -11.076 9.304 -0.365 1.00 . A A . 2 VAL HG23 1 1 18 12724 1 1 2 VAL N N -10.281 6.547 2.391 1.00 . A A . 2 VAL N 1 1 18 12725 1 1 2 VAL O O -7.656 7.373 2.960 1.00 . A A . 2 VAL O 1 1 18 12726 1 1 3 CYS C C -4.774 6.763 1.225 1.00 . A A . 3 CYS C 1 1 18 12727 1 1 3 CYS CA C -5.763 5.777 1.857 1.00 . A A . 3 CYS CA 1 1 18 12728 1 1 3 CYS CB C -5.308 4.314 1.659 1.00 . A A . 3 CYS CB 1 1 18 12729 1 1 3 CYS H H -7.307 5.516 0.482 1.00 . A A . 3 CYS H 1 1 18 12730 1 1 3 CYS HA H -5.824 5.978 2.918 1.00 . A A . 3 CYS HA 1 1 18 12731 1 1 3 CYS HB2 H -4.845 3.976 2.573 1.00 . A A . 3 CYS HB2 1 1 18 12732 1 1 3 CYS HB3 H -6.177 3.703 1.473 1.00 . A A . 3 CYS HB3 1 1 18 12733 1 1 3 CYS N N -7.075 5.971 1.315 1.00 . A A . 3 CYS N 1 1 18 12734 1 1 3 CYS O O -5.158 7.631 0.419 1.00 . A A . 3 CYS O 1 1 18 12735 1 1 3 CYS SG S -4.127 4.017 0.303 1.00 . A A . 3 CYS SG 1 1 18 12736 1 1 4 ALA C C -1.911 6.904 -0.228 1.00 . A A . 4 ALA C 1 1 18 12737 1 1 4 ALA CA C -2.493 7.488 1.062 1.00 . A A . 4 ALA CA 1 1 18 12738 1 1 4 ALA CB C -1.396 7.646 2.116 1.00 . A A . 4 ALA CB 1 1 18 12739 1 1 4 ALA H H -3.280 5.836 2.112 1.00 . A A . 4 ALA H 1 1 18 12740 1 1 4 ALA HA H -2.919 8.455 0.850 1.00 . A A . 4 ALA HA 1 1 18 12741 1 1 4 ALA HB1 H -0.646 8.321 1.731 1.00 . A A . 4 ALA HB1 1 1 18 12742 1 1 4 ALA HB2 H -0.957 6.678 2.311 1.00 . A A . 4 ALA HB2 1 1 18 12743 1 1 4 ALA HB3 H -1.804 8.041 3.035 1.00 . A A . 4 ALA HB3 1 1 18 12744 1 1 4 ALA N N -3.521 6.615 1.562 1.00 . A A . 4 ALA N 1 1 18 12745 1 1 4 ALA O O -1.470 5.777 -0.235 1.00 . A A . 4 ALA O 1 1 18 12746 1 1 5 ALA C C -1.572 8.399 -3.585 1.00 . A A . 5 ALA C 1 1 18 12747 1 1 5 ALA CA C -1.350 7.298 -2.585 1.00 . A A . 5 ALA CA 1 1 18 12748 1 1 5 ALA CB C -1.871 5.984 -3.166 1.00 . A A . 5 ALA CB 1 1 18 12749 1 1 5 ALA H H -2.605 8.417 -1.322 1.00 . A A . 5 ALA H 1 1 18 12750 1 1 5 ALA HA H -0.288 7.208 -2.396 1.00 . A A . 5 ALA HA 1 1 18 12751 1 1 5 ALA HB1 H -1.747 5.195 -2.438 1.00 . A A . 5 ALA HB1 1 1 18 12752 1 1 5 ALA HB2 H -1.314 5.729 -4.055 1.00 . A A . 5 ALA HB2 1 1 18 12753 1 1 5 ALA HB3 H -2.914 6.088 -3.426 1.00 . A A . 5 ALA HB3 1 1 18 12754 1 1 5 ALA N N -2.010 7.643 -1.326 1.00 . A A . 5 ALA N 1 1 18 12755 1 1 5 ALA O O -2.599 9.091 -3.544 1.00 . A A . 5 ALA O 1 1 18 12756 1 1 6 GLN C C -1.980 9.299 -6.376 1.00 . A A . 6 GLN C 1 1 18 12757 1 1 6 GLN CA C -0.653 9.533 -5.594 1.00 . A A . 6 GLN CA 1 1 18 12758 1 1 6 GLN CB C 0.575 9.242 -6.496 1.00 . A A . 6 GLN CB 1 1 18 12759 1 1 6 GLN CD C 1.965 9.772 -8.534 1.00 . A A . 6 GLN CD 1 1 18 12760 1 1 6 GLN CG C 0.809 10.199 -7.646 1.00 . A A . 6 GLN CG 1 1 18 12761 1 1 6 GLN H H 0.323 8.250 -4.277 1.00 . A A . 6 GLN H 1 1 18 12762 1 1 6 GLN HA H -0.600 10.548 -5.239 1.00 . A A . 6 GLN HA 1 1 18 12763 1 1 6 GLN HB2 H 1.471 9.248 -5.890 1.00 . A A . 6 GLN HB2 1 1 18 12764 1 1 6 GLN HB3 H 0.448 8.251 -6.901 1.00 . A A . 6 GLN HB3 1 1 18 12765 1 1 6 GLN HE21 H 0.746 8.716 -9.707 1.00 . A A . 6 GLN HE21 1 1 18 12766 1 1 6 GLN HE22 H 2.422 8.708 -10.117 1.00 . A A . 6 GLN HE22 1 1 18 12767 1 1 6 GLN HG2 H -0.074 10.225 -8.249 1.00 . A A . 6 GLN HG2 1 1 18 12768 1 1 6 GLN HG3 H 1.027 11.174 -7.239 1.00 . A A . 6 GLN HG3 1 1 18 12769 1 1 6 GLN N N -0.574 8.598 -4.447 1.00 . A A . 6 GLN N 1 1 18 12770 1 1 6 GLN NE2 N 1.675 8.991 -9.551 1.00 . A A . 6 GLN NE2 1 1 18 12771 1 1 6 GLN O O -2.666 10.242 -6.768 1.00 . A A . 6 GLN O 1 1 18 12772 1 1 6 GLN OE1 O 3.095 10.147 -8.308 1.00 . A A . 6 GLN OE1 1 1 18 12773 1 1 7 ASN C C -4.182 6.490 -6.365 1.00 . A A . 7 ASN C 1 1 18 12774 1 1 7 ASN CA C -3.599 7.648 -7.142 1.00 . A A . 7 ASN CA 1 1 18 12775 1 1 7 ASN CB C -3.452 7.277 -8.633 1.00 . A A . 7 ASN CB 1 1 18 12776 1 1 7 ASN CG C -4.778 6.852 -9.293 1.00 . A A . 7 ASN CG 1 1 18 12777 1 1 7 ASN H H -1.605 7.466 -6.210 1.00 . A A . 7 ASN H 1 1 18 12778 1 1 7 ASN HA H -4.272 8.491 -7.045 1.00 . A A . 7 ASN HA 1 1 18 12779 1 1 7 ASN HB2 H -3.077 8.126 -9.184 1.00 . A A . 7 ASN HB2 1 1 18 12780 1 1 7 ASN HB3 H -2.748 6.464 -8.726 1.00 . A A . 7 ASN HB3 1 1 18 12781 1 1 7 ASN HD21 H -4.438 4.974 -8.833 1.00 . A A . 7 ASN HD21 1 1 18 12782 1 1 7 ASN HD22 H -5.921 5.265 -9.682 1.00 . A A . 7 ASN HD22 1 1 18 12783 1 1 7 ASN N N -2.321 8.043 -6.545 1.00 . A A . 7 ASN N 1 1 18 12784 1 1 7 ASN ND2 N -5.083 5.567 -9.270 1.00 . A A . 7 ASN ND2 1 1 18 12785 1 1 7 ASN O O -3.777 5.327 -6.561 1.00 . A A . 7 ASN O 1 1 18 12786 1 1 7 ASN OD1 O -5.512 7.682 -9.819 1.00 . A A . 7 ASN OD1 1 1 18 12787 1 1 8 CYS C C -6.969 5.228 -5.286 1.00 . A A . 8 CYS C 1 1 18 12788 1 1 8 CYS CA C -5.678 5.742 -4.671 1.00 . A A . 8 CYS CA 1 1 18 12789 1 1 8 CYS CB C -5.910 6.166 -3.223 1.00 . A A . 8 CYS CB 1 1 18 12790 1 1 8 CYS H H -5.461 7.682 -5.338 1.00 . A A . 8 CYS H 1 1 18 12791 1 1 8 CYS HA H -4.951 4.948 -4.674 1.00 . A A . 8 CYS HA 1 1 18 12792 1 1 8 CYS HB2 H -4.981 6.457 -2.756 1.00 . A A . 8 CYS HB2 1 1 18 12793 1 1 8 CYS HB3 H -6.590 7.004 -3.234 1.00 . A A . 8 CYS HB3 1 1 18 12794 1 1 8 CYS N N -5.103 6.780 -5.465 1.00 . A A . 8 CYS N 1 1 18 12795 1 1 8 CYS O O -7.938 5.971 -5.452 1.00 . A A . 8 CYS O 1 1 18 12796 1 1 8 CYS SG S -6.679 4.863 -2.223 1.00 . A A . 8 CYS SG 1 1 18 12797 1 1 9 GLN C C -8.919 2.783 -5.043 1.00 . A A . 9 GLN C 1 1 18 12798 1 1 9 GLN CA C -8.078 3.273 -6.198 1.00 . A A . 9 GLN CA 1 1 18 12799 1 1 9 GLN CB C -7.582 2.055 -6.993 1.00 . A A . 9 GLN CB 1 1 18 12800 1 1 9 GLN CD C -5.975 1.122 -8.708 1.00 . A A . 9 GLN CD 1 1 18 12801 1 1 9 GLN CG C -6.468 2.359 -7.987 1.00 . A A . 9 GLN CG 1 1 18 12802 1 1 9 GLN H H -6.127 3.460 -5.496 1.00 . A A . 9 GLN H 1 1 18 12803 1 1 9 GLN HA H -8.636 3.924 -6.851 1.00 . A A . 9 GLN HA 1 1 18 12804 1 1 9 GLN HB2 H -7.227 1.287 -6.321 1.00 . A A . 9 GLN HB2 1 1 18 12805 1 1 9 GLN HB3 H -8.417 1.665 -7.556 1.00 . A A . 9 GLN HB3 1 1 18 12806 1 1 9 GLN HE21 H -4.122 1.846 -8.786 1.00 . A A . 9 GLN HE21 1 1 18 12807 1 1 9 GLN HE22 H -4.366 0.294 -9.485 1.00 . A A . 9 GLN HE22 1 1 18 12808 1 1 9 GLN HG2 H -6.812 3.074 -8.717 1.00 . A A . 9 GLN HG2 1 1 18 12809 1 1 9 GLN HG3 H -5.637 2.786 -7.446 1.00 . A A . 9 GLN HG3 1 1 18 12810 1 1 9 GLN N N -6.954 3.952 -5.639 1.00 . A A . 9 GLN N 1 1 18 12811 1 1 9 GLN NE2 N -4.698 1.092 -9.023 1.00 . A A . 9 GLN NE2 1 1 18 12812 1 1 9 GLN O O -8.426 2.741 -3.894 1.00 . A A . 9 GLN O 1 1 18 12813 1 1 9 GLN OE1 O -6.714 0.193 -8.944 1.00 . A A . 9 GLN OE1 1 1 18 12814 1 1 10 ARG C C -11.442 0.422 -4.470 1.00 . A A . 10 ARG C 1 1 18 12815 1 1 10 ARG CA C -11.034 1.889 -4.264 1.00 . A A . 10 ARG CA 1 1 18 12816 1 1 10 ARG CB C -12.274 2.786 -3.954 1.00 . A A . 10 ARG CB 1 1 18 12817 1 1 10 ARG CD C -11.221 5.097 -4.035 1.00 . A A . 10 ARG CD 1 1 18 12818 1 1 10 ARG CG C -11.979 4.089 -3.211 1.00 . A A . 10 ARG CG 1 1 18 12819 1 1 10 ARG CZ C -11.669 6.592 -5.969 1.00 . A A . 10 ARG CZ 1 1 18 12820 1 1 10 ARG H H -10.440 2.491 -6.240 1.00 . A A . 10 ARG H 1 1 18 12821 1 1 10 ARG HA H -10.406 1.879 -3.382 1.00 . A A . 10 ARG HA 1 1 18 12822 1 1 10 ARG HB2 H -12.765 3.056 -4.878 1.00 . A A . 10 ARG HB2 1 1 18 12823 1 1 10 ARG HB3 H -12.971 2.232 -3.343 1.00 . A A . 10 ARG HB3 1 1 18 12824 1 1 10 ARG HD2 H -10.983 5.914 -3.375 1.00 . A A . 10 ARG HD2 1 1 18 12825 1 1 10 ARG HD3 H -10.318 4.646 -4.416 1.00 . A A . 10 ARG HD3 1 1 18 12826 1 1 10 ARG HE H -12.915 5.176 -5.235 1.00 . A A . 10 ARG HE 1 1 18 12827 1 1 10 ARG HG2 H -12.927 4.526 -2.931 1.00 . A A . 10 ARG HG2 1 1 18 12828 1 1 10 ARG HG3 H -11.418 3.854 -2.315 1.00 . A A . 10 ARG HG3 1 1 18 12829 1 1 10 ARG HH11 H -9.716 6.724 -5.326 1.00 . A A . 10 ARG HH11 1 1 18 12830 1 1 10 ARG HH12 H -10.117 7.826 -6.536 1.00 . A A . 10 ARG HH12 1 1 18 12831 1 1 10 ARG HH21 H -13.472 6.678 -6.915 1.00 . A A . 10 ARG HH21 1 1 18 12832 1 1 10 ARG HH22 H -12.317 7.781 -7.493 1.00 . A A . 10 ARG HH22 1 1 18 12833 1 1 10 ARG N N -10.148 2.411 -5.309 1.00 . A A . 10 ARG N 1 1 18 12834 1 1 10 ARG NE N -12.029 5.600 -5.155 1.00 . A A . 10 ARG NE 1 1 18 12835 1 1 10 ARG NH1 N -10.425 7.072 -5.947 1.00 . A A . 10 ARG NH1 1 1 18 12836 1 1 10 ARG NH2 N -12.537 7.047 -6.851 1.00 . A A . 10 ARG NH2 1 1 18 12837 1 1 10 ARG O O -12.483 0.125 -5.069 1.00 . A A . 10 ARG O 1 1 18 12838 1 1 11 PRO C C -11.916 -2.283 -2.934 1.00 . A A . 11 PRO C 1 1 18 12839 1 1 11 PRO CA C -10.875 -1.946 -4.005 1.00 . A A . 11 PRO CA 1 1 18 12840 1 1 11 PRO CB C -9.532 -2.580 -3.614 1.00 . A A . 11 PRO CB 1 1 18 12841 1 1 11 PRO CD C -9.226 -0.244 -3.598 1.00 . A A . 11 PRO CD 1 1 18 12842 1 1 11 PRO CG C -8.528 -1.529 -3.871 1.00 . A A . 11 PRO CG 1 1 18 12843 1 1 11 PRO HA H -11.192 -2.309 -4.970 1.00 . A A . 11 PRO HA 1 1 18 12844 1 1 11 PRO HB2 H -9.567 -2.788 -2.555 1.00 . A A . 11 PRO HB2 1 1 18 12845 1 1 11 PRO HB3 H -9.333 -3.472 -4.191 1.00 . A A . 11 PRO HB3 1 1 18 12846 1 1 11 PRO HD2 H -9.205 0.076 -2.569 1.00 . A A . 11 PRO HD2 1 1 18 12847 1 1 11 PRO HD3 H -8.815 0.537 -4.219 1.00 . A A . 11 PRO HD3 1 1 18 12848 1 1 11 PRO HG2 H -7.686 -1.653 -3.205 1.00 . A A . 11 PRO HG2 1 1 18 12849 1 1 11 PRO HG3 H -8.193 -1.568 -4.897 1.00 . A A . 11 PRO HG3 1 1 18 12850 1 1 11 PRO N N -10.578 -0.513 -4.032 1.00 . A A . 11 PRO N 1 1 18 12851 1 1 11 PRO O O -12.073 -1.541 -1.966 1.00 . A A . 11 PRO O 1 1 18 12852 1 1 12 CYS C C -13.502 -5.332 -1.850 1.00 . A A . 12 CYS C 1 1 18 12853 1 1 12 CYS CA C -13.627 -3.831 -2.173 1.00 . A A . 12 CYS CA 1 1 18 12854 1 1 12 CYS CB C -14.975 -3.528 -2.808 1.00 . A A . 12 CYS CB 1 1 18 12855 1 1 12 CYS H H -12.437 -3.969 -3.888 1.00 . A A . 12 CYS H 1 1 18 12856 1 1 12 CYS HA H -13.544 -3.262 -1.259 1.00 . A A . 12 CYS HA 1 1 18 12857 1 1 12 CYS HB2 H -15.767 -3.959 -2.211 1.00 . A A . 12 CYS HB2 1 1 18 12858 1 1 12 CYS HB3 H -15.109 -2.457 -2.865 1.00 . A A . 12 CYS HB3 1 1 18 12859 1 1 12 CYS HG H -16.199 -3.586 -5.023 1.00 . A A . 12 CYS HG 1 1 18 12860 1 1 12 CYS N N -12.593 -3.403 -3.105 1.00 . A A . 12 CYS N 1 1 18 12861 1 1 12 CYS O O -14.476 -5.986 -1.478 1.00 . A A . 12 CYS O 1 1 18 12862 1 1 12 CYS SG S -15.144 -4.181 -4.487 1.00 . A A . 12 CYS SG 1 1 18 12863 1 1 13 LYS C C -11.688 -7.577 -0.284 1.00 . A A . 13 LYS C 1 1 18 12864 1 1 13 LYS CA C -12.080 -7.287 -1.706 1.00 . A A . 13 LYS CA 1 1 18 12865 1 1 13 LYS CB C -11.040 -7.863 -2.663 1.00 . A A . 13 LYS CB 1 1 18 12866 1 1 13 LYS CD C -10.347 -8.336 -5.022 1.00 . A A . 13 LYS CD 1 1 18 12867 1 1 13 LYS CE C -10.645 -8.113 -6.495 1.00 . A A . 13 LYS CE 1 1 18 12868 1 1 13 LYS CG C -11.390 -7.685 -4.132 1.00 . A A . 13 LYS CG 1 1 18 12869 1 1 13 LYS H H -11.520 -5.279 -2.113 1.00 . A A . 13 LYS H 1 1 18 12870 1 1 13 LYS HA H -13.014 -7.789 -1.869 1.00 . A A . 13 LYS HA 1 1 18 12871 1 1 13 LYS HB2 H -10.090 -7.377 -2.480 1.00 . A A . 13 LYS HB2 1 1 18 12872 1 1 13 LYS HB3 H -10.942 -8.919 -2.458 1.00 . A A . 13 LYS HB3 1 1 18 12873 1 1 13 LYS HD2 H -9.376 -7.919 -4.798 1.00 . A A . 13 LYS HD2 1 1 18 12874 1 1 13 LYS HD3 H -10.332 -9.396 -4.819 1.00 . A A . 13 LYS HD3 1 1 18 12875 1 1 13 LYS HE2 H -11.644 -8.461 -6.706 1.00 . A A . 13 LYS HE2 1 1 18 12876 1 1 13 LYS HE3 H -10.578 -7.053 -6.691 1.00 . A A . 13 LYS HE3 1 1 18 12877 1 1 13 LYS HG2 H -12.347 -8.148 -4.321 1.00 . A A . 13 LYS HG2 1 1 18 12878 1 1 13 LYS HG3 H -11.443 -6.630 -4.356 1.00 . A A . 13 LYS HG3 1 1 18 12879 1 1 13 LYS HZ1 H -9.905 -8.681 -8.375 1.00 . A A . 13 LYS HZ1 1 1 18 12880 1 1 13 LYS HZ2 H -9.732 -9.861 -7.195 1.00 . A A . 13 LYS HZ2 1 1 18 12881 1 1 13 LYS HZ3 H -8.712 -8.536 -7.200 1.00 . A A . 13 LYS HZ3 1 1 18 12882 1 1 13 LYS N N -12.286 -5.860 -1.937 1.00 . A A . 13 LYS N 1 1 18 12883 1 1 13 LYS NZ N -9.689 -8.833 -7.369 1.00 . A A . 13 LYS NZ 1 1 18 12884 1 1 13 LYS O O -11.029 -6.769 0.352 1.00 . A A . 13 LYS O 1 1 18 12885 1 1 14 ASP C C -10.259 -9.555 1.474 1.00 . A A . 14 ASP C 1 1 18 12886 1 1 14 ASP CA C -11.726 -9.203 1.531 1.00 . A A . 14 ASP CA 1 1 18 12887 1 1 14 ASP CB C -12.526 -10.455 1.941 1.00 . A A . 14 ASP CB 1 1 18 12888 1 1 14 ASP CG C -14.021 -10.241 1.966 1.00 . A A . 14 ASP CG 1 1 18 12889 1 1 14 ASP H H -12.777 -9.262 -0.294 1.00 . A A . 14 ASP H 1 1 18 12890 1 1 14 ASP HA H -11.883 -8.414 2.252 1.00 . A A . 14 ASP HA 1 1 18 12891 1 1 14 ASP HB2 H -12.319 -11.259 1.251 1.00 . A A . 14 ASP HB2 1 1 18 12892 1 1 14 ASP HB3 H -12.208 -10.757 2.930 1.00 . A A . 14 ASP HB3 1 1 18 12893 1 1 14 ASP N N -12.128 -8.728 0.213 1.00 . A A . 14 ASP N 1 1 18 12894 1 1 14 ASP O O -9.457 -9.100 2.289 1.00 . A A . 14 ASP O 1 1 18 12895 1 1 14 ASP OD1 O -14.663 -10.435 0.909 1.00 . A A . 14 ASP OD1 1 1 18 12896 1 1 14 ASP OD2 O -14.570 -9.894 3.031 1.00 . A A . 14 ASP OD2 1 1 18 12897 1 1 15 LYS C C -7.778 -9.646 -0.492 1.00 . A A . 15 LYS C 1 1 18 12898 1 1 15 LYS CA C -8.531 -10.774 0.254 1.00 . A A . 15 LYS CA 1 1 18 12899 1 1 15 LYS CB C -8.481 -12.063 -0.584 1.00 . A A . 15 LYS CB 1 1 18 12900 1 1 15 LYS CD C -9.176 -14.447 -0.926 1.00 . A A . 15 LYS CD 1 1 18 12901 1 1 15 LYS CE C -9.715 -15.736 -0.287 1.00 . A A . 15 LYS CE 1 1 18 12902 1 1 15 LYS CG C -9.089 -13.295 0.076 1.00 . A A . 15 LYS CG 1 1 18 12903 1 1 15 LYS H H -10.580 -10.875 -0.026 1.00 . A A . 15 LYS H 1 1 18 12904 1 1 15 LYS HA H -8.046 -10.962 1.203 1.00 . A A . 15 LYS HA 1 1 18 12905 1 1 15 LYS HB2 H -9.037 -11.892 -1.493 1.00 . A A . 15 LYS HB2 1 1 18 12906 1 1 15 LYS HB3 H -7.449 -12.275 -0.821 1.00 . A A . 15 LYS HB3 1 1 18 12907 1 1 15 LYS HD2 H -9.845 -14.152 -1.724 1.00 . A A . 15 LYS HD2 1 1 18 12908 1 1 15 LYS HD3 H -8.190 -14.620 -1.335 1.00 . A A . 15 LYS HD3 1 1 18 12909 1 1 15 LYS HE2 H -10.639 -15.505 0.223 1.00 . A A . 15 LYS HE2 1 1 18 12910 1 1 15 LYS HE3 H -9.928 -16.467 -1.053 1.00 . A A . 15 LYS HE3 1 1 18 12911 1 1 15 LYS HG2 H -8.482 -13.589 0.916 1.00 . A A . 15 LYS HG2 1 1 18 12912 1 1 15 LYS HG3 H -10.082 -13.066 0.430 1.00 . A A . 15 LYS HG3 1 1 18 12913 1 1 15 LYS HZ1 H -9.193 -17.179 1.112 1.00 . A A . 15 LYS HZ1 1 1 18 12914 1 1 15 LYS HZ2 H -8.565 -15.666 1.481 1.00 . A A . 15 LYS HZ2 1 1 18 12915 1 1 15 LYS HZ3 H -7.888 -16.612 0.238 1.00 . A A . 15 LYS HZ3 1 1 18 12916 1 1 15 LYS N N -9.914 -10.405 0.516 1.00 . A A . 15 LYS N 1 1 18 12917 1 1 15 LYS NZ N -8.773 -16.320 0.701 1.00 . A A . 15 LYS NZ 1 1 18 12918 1 1 15 LYS O O -7.841 -9.553 -1.726 1.00 . A A . 15 LYS O 1 1 18 12919 1 1 16 VAL C C -5.519 -7.024 0.872 1.00 . A A . 16 VAL C 1 1 18 12920 1 1 16 VAL CA C -6.281 -7.720 -0.258 1.00 . A A . 16 VAL CA 1 1 18 12921 1 1 16 VAL CB C -6.994 -6.682 -1.185 1.00 . A A . 16 VAL CB 1 1 18 12922 1 1 16 VAL CG1 C -8.172 -6.040 -0.488 1.00 . A A . 16 VAL CG1 1 1 18 12923 1 1 16 VAL CG2 C -5.999 -5.627 -1.677 1.00 . A A . 16 VAL CG2 1 1 18 12924 1 1 16 VAL H H -7.295 -8.798 1.237 1.00 . A A . 16 VAL H 1 1 18 12925 1 1 16 VAL HA H -5.533 -8.247 -0.831 1.00 . A A . 16 VAL HA 1 1 18 12926 1 1 16 VAL HB H -7.389 -7.198 -2.041 1.00 . A A . 16 VAL HB 1 1 18 12927 1 1 16 VAL HG11 H -7.778 -5.608 0.421 1.00 . A A . 16 VAL HG11 1 1 18 12928 1 1 16 VAL HG12 H -8.924 -6.793 -0.282 1.00 . A A . 16 VAL HG12 1 1 18 12929 1 1 16 VAL HG13 H -8.606 -5.271 -1.108 1.00 . A A . 16 VAL HG13 1 1 18 12930 1 1 16 VAL HG21 H -6.498 -4.920 -2.323 1.00 . A A . 16 VAL HG21 1 1 18 12931 1 1 16 VAL HG22 H -5.192 -6.110 -2.212 1.00 . A A . 16 VAL HG22 1 1 18 12932 1 1 16 VAL HG23 H -5.583 -5.126 -0.815 1.00 . A A . 16 VAL HG23 1 1 18 12933 1 1 16 VAL N N -7.149 -8.771 0.267 1.00 . A A . 16 VAL N 1 1 18 12934 1 1 16 VAL O O -6.045 -6.187 1.604 1.00 . A A . 16 VAL O 1 1 18 12935 1 1 17 ASP C C -2.969 -5.474 1.817 1.00 . A A . 17 ASP C 1 1 18 12936 1 1 17 ASP CA C -3.393 -6.934 2.056 1.00 . A A . 17 ASP CA 1 1 18 12937 1 1 17 ASP CB C -2.167 -7.850 2.193 1.00 . A A . 17 ASP CB 1 1 18 12938 1 1 17 ASP CG C -2.533 -9.255 2.654 1.00 . A A . 17 ASP CG 1 1 18 12939 1 1 17 ASP H H -4.084 -8.217 0.481 1.00 . A A . 17 ASP H 1 1 18 12940 1 1 17 ASP HA H -3.937 -6.967 2.989 1.00 . A A . 17 ASP HA 1 1 18 12941 1 1 17 ASP HB2 H -1.687 -7.926 1.228 1.00 . A A . 17 ASP HB2 1 1 18 12942 1 1 17 ASP HB3 H -1.472 -7.413 2.894 1.00 . A A . 17 ASP HB3 1 1 18 12943 1 1 17 ASP N N -4.316 -7.451 1.040 1.00 . A A . 17 ASP N 1 1 18 12944 1 1 17 ASP O O -2.760 -5.032 0.674 1.00 . A A . 17 ASP O 1 1 18 12945 1 1 17 ASP OD1 O -2.642 -9.471 3.870 1.00 . A A . 17 ASP OD1 1 1 18 12946 1 1 17 ASP OD2 O -2.730 -10.146 1.794 1.00 . A A . 17 ASP OD2 1 1 18 12947 1 1 18 TRP C C -1.063 -3.125 3.460 1.00 . A A . 18 TRP C 1 1 18 12948 1 1 18 TRP CA C -2.486 -3.307 2.924 1.00 . A A . 18 TRP CA 1 1 18 12949 1 1 18 TRP CB C -3.461 -2.540 3.822 1.00 . A A . 18 TRP CB 1 1 18 12950 1 1 18 TRP CD1 C -5.674 -3.553 3.006 1.00 . A A . 18 TRP CD1 1 1 18 12951 1 1 18 TRP CD2 C -5.706 -1.336 3.189 1.00 . A A . 18 TRP CD2 1 1 18 12952 1 1 18 TRP CE2 C -6.969 -1.768 2.741 1.00 . A A . 18 TRP CE2 1 1 18 12953 1 1 18 TRP CE3 C -5.489 0.027 3.395 1.00 . A A . 18 TRP CE3 1 1 18 12954 1 1 18 TRP CG C -4.890 -2.501 3.341 1.00 . A A . 18 TRP CG 1 1 18 12955 1 1 18 TRP CH2 C -7.768 0.453 2.693 1.00 . A A . 18 TRP CH2 1 1 18 12956 1 1 18 TRP CZ2 C -8.005 -0.883 2.481 1.00 . A A . 18 TRP CZ2 1 1 18 12957 1 1 18 TRP CZ3 C -6.518 0.907 3.141 1.00 . A A . 18 TRP CZ3 1 1 18 12958 1 1 18 TRP H H -2.962 -5.185 3.773 1.00 . A A . 18 TRP H 1 1 18 12959 1 1 18 TRP HA H -2.548 -2.921 1.916 1.00 . A A . 18 TRP HA 1 1 18 12960 1 1 18 TRP HB2 H -3.463 -3.010 4.794 1.00 . A A . 18 TRP HB2 1 1 18 12961 1 1 18 TRP HB3 H -3.106 -1.525 3.912 1.00 . A A . 18 TRP HB3 1 1 18 12962 1 1 18 TRP HD1 H -5.344 -4.580 3.014 1.00 . A A . 18 TRP HD1 1 1 18 12963 1 1 18 TRP HE1 H -7.612 -3.751 2.317 1.00 . A A . 18 TRP HE1 1 1 18 12964 1 1 18 TRP HE3 H -4.531 0.387 3.740 1.00 . A A . 18 TRP HE3 1 1 18 12965 1 1 18 TRP HH2 H -8.541 1.183 2.508 1.00 . A A . 18 TRP HH2 1 1 18 12966 1 1 18 TRP HZ2 H -8.968 -1.235 2.139 1.00 . A A . 18 TRP HZ2 1 1 18 12967 1 1 18 TRP HZ3 H -6.352 1.962 3.294 1.00 . A A . 18 TRP HZ3 1 1 18 12968 1 1 18 TRP N N -2.838 -4.740 2.910 1.00 . A A . 18 TRP N 1 1 18 12969 1 1 18 TRP NE1 N -6.910 -3.130 2.615 1.00 . A A . 18 TRP NE1 1 1 18 12970 1 1 18 TRP O O -0.536 -4.023 4.130 1.00 . A A . 18 TRP O 1 1 18 12971 1 1 19 VAL C C 1.077 -0.362 4.311 1.00 . A A . 19 VAL C 1 1 18 12972 1 1 19 VAL CA C 0.935 -1.732 3.612 1.00 . A A . 19 VAL CA 1 1 18 12973 1 1 19 VAL CB C 1.964 -1.829 2.437 1.00 . A A . 19 VAL CB 1 1 18 12974 1 1 19 VAL CG1 C 2.047 -3.241 1.887 1.00 . A A . 19 VAL CG1 1 1 18 12975 1 1 19 VAL CG2 C 1.602 -0.865 1.309 1.00 . A A . 19 VAL CG2 1 1 18 12976 1 1 19 VAL H H -0.834 -1.210 2.712 1.00 . A A . 19 VAL H 1 1 18 12977 1 1 19 VAL HA H 1.173 -2.497 4.337 1.00 . A A . 19 VAL HA 1 1 18 12978 1 1 19 VAL HB H 2.939 -1.558 2.813 1.00 . A A . 19 VAL HB 1 1 18 12979 1 1 19 VAL HG11 H 1.092 -3.525 1.471 1.00 . A A . 19 VAL HG11 1 1 18 12980 1 1 19 VAL HG12 H 2.311 -3.931 2.675 1.00 . A A . 19 VAL HG12 1 1 18 12981 1 1 19 VAL HG13 H 2.802 -3.276 1.113 1.00 . A A . 19 VAL HG13 1 1 18 12982 1 1 19 VAL HG21 H 2.312 -0.955 0.502 1.00 . A A . 19 VAL HG21 1 1 18 12983 1 1 19 VAL HG22 H 1.612 0.144 1.683 1.00 . A A . 19 VAL HG22 1 1 18 12984 1 1 19 VAL HG23 H 0.608 -1.086 0.942 1.00 . A A . 19 VAL HG23 1 1 18 12985 1 1 19 VAL N N -0.438 -1.982 3.176 1.00 . A A . 19 VAL N 1 1 18 12986 1 1 19 VAL O O 0.420 0.607 3.951 1.00 . A A . 19 VAL O 1 1 18 12987 1 1 20 GLN C C 3.679 1.292 5.778 1.00 . A A . 20 GLN C 1 1 18 12988 1 1 20 GLN CA C 2.220 0.906 6.048 1.00 . A A . 20 GLN CA 1 1 18 12989 1 1 20 GLN CB C 1.975 0.703 7.547 1.00 . A A . 20 GLN CB 1 1 18 12990 1 1 20 GLN CD C 2.030 1.676 9.887 1.00 . A A . 20 GLN CD 1 1 18 12991 1 1 20 GLN CG C 2.217 1.936 8.404 1.00 . A A . 20 GLN CG 1 1 18 12992 1 1 20 GLN H H 2.342 -1.162 5.580 1.00 . A A . 20 GLN H 1 1 18 12993 1 1 20 GLN HA H 1.579 1.693 5.675 1.00 . A A . 20 GLN HA 1 1 18 12994 1 1 20 GLN HB2 H 0.953 0.382 7.674 1.00 . A A . 20 GLN HB2 1 1 18 12995 1 1 20 GLN HB3 H 2.625 -0.088 7.888 1.00 . A A . 20 GLN HB3 1 1 18 12996 1 1 20 GLN HE21 H 0.132 2.202 9.766 1.00 . A A . 20 GLN HE21 1 1 18 12997 1 1 20 GLN HE22 H 0.713 1.726 11.336 1.00 . A A . 20 GLN HE22 1 1 18 12998 1 1 20 GLN HG2 H 3.215 2.311 8.243 1.00 . A A . 20 GLN HG2 1 1 18 12999 1 1 20 GLN HG3 H 1.505 2.694 8.114 1.00 . A A . 20 GLN HG3 1 1 18 13000 1 1 20 GLN N N 1.915 -0.322 5.318 1.00 . A A . 20 GLN N 1 1 18 13001 1 1 20 GLN NE2 N 0.835 1.887 10.378 1.00 . A A . 20 GLN NE2 1 1 18 13002 1 1 20 GLN O O 4.549 0.416 5.715 1.00 . A A . 20 GLN O 1 1 18 13003 1 1 20 GLN OE1 O 2.963 1.299 10.584 1.00 . A A . 20 GLN OE1 1 1 18 13004 1 1 21 CYS C C 6.138 3.098 6.521 1.00 . A A . 21 CYS C 1 1 18 13005 1 1 21 CYS CA C 5.281 3.044 5.277 1.00 . A A . 21 CYS CA 1 1 18 13006 1 1 21 CYS CB C 5.255 4.395 4.549 1.00 . A A . 21 CYS CB 1 1 18 13007 1 1 21 CYS H H 3.170 3.188 5.655 1.00 . A A . 21 CYS H 1 1 18 13008 1 1 21 CYS HA H 5.783 2.325 4.655 1.00 . A A . 21 CYS HA 1 1 18 13009 1 1 21 CYS HB2 H 4.623 4.317 3.683 1.00 . A A . 21 CYS HB2 1 1 18 13010 1 1 21 CYS HB3 H 4.822 5.148 5.189 1.00 . A A . 21 CYS HB3 1 1 18 13011 1 1 21 CYS N N 3.934 2.576 5.579 1.00 . A A . 21 CYS N 1 1 18 13012 1 1 21 CYS O O 6.054 4.032 7.318 1.00 . A A . 21 CYS O 1 1 18 13013 1 1 21 CYS SG S 6.857 5.034 3.997 1.00 . A A . 21 CYS SG 1 1 18 13014 1 1 22 ASP C C 9.152 2.730 7.546 1.00 . A A . 22 ASP C 1 1 18 13015 1 1 22 ASP CA C 7.855 1.985 7.843 1.00 . A A . 22 ASP CA 1 1 18 13016 1 1 22 ASP CB C 8.147 0.513 8.164 1.00 . A A . 22 ASP CB 1 1 18 13017 1 1 22 ASP CG C 8.018 0.169 9.656 1.00 . A A . 22 ASP CG 1 1 18 13018 1 1 22 ASP H H 7.029 1.385 5.989 1.00 . A A . 22 ASP H 1 1 18 13019 1 1 22 ASP HA H 7.362 2.454 8.681 1.00 . A A . 22 ASP HA 1 1 18 13020 1 1 22 ASP HB2 H 7.475 -0.122 7.602 1.00 . A A . 22 ASP HB2 1 1 18 13021 1 1 22 ASP HB3 H 9.163 0.299 7.865 1.00 . A A . 22 ASP HB3 1 1 18 13022 1 1 22 ASP N N 6.985 2.088 6.674 1.00 . A A . 22 ASP N 1 1 18 13023 1 1 22 ASP O O 10.133 2.669 8.284 1.00 . A A . 22 ASP O 1 1 18 13024 1 1 22 ASP OD1 O 8.237 1.041 10.527 1.00 . A A . 22 ASP OD1 1 1 18 13025 1 1 22 ASP OD2 O 7.709 -1.000 9.977 1.00 . A A . 22 ASP OD2 1 1 18 13026 1 1 23 GLY C C 10.149 5.627 6.684 1.00 . A A . 23 GLY C 1 1 18 13027 1 1 23 GLY CA C 10.245 4.261 6.065 1.00 . A A . 23 GLY CA 1 1 18 13028 1 1 23 GLY H H 8.310 3.471 5.908 1.00 . A A . 23 GLY H 1 1 18 13029 1 1 23 GLY HA2 H 11.145 3.766 6.402 1.00 . A A . 23 GLY HA2 1 1 18 13030 1 1 23 GLY HA3 H 10.258 4.367 4.989 1.00 . A A . 23 GLY HA3 1 1 18 13031 1 1 23 GLY N N 9.129 3.469 6.442 1.00 . A A . 23 GLY N 1 1 18 13032 1 1 23 GLY O O 11.025 6.472 6.485 1.00 . A A . 23 GLY O 1 1 18 13033 1 1 24 GLY C C 7.522 7.650 8.171 1.00 . A A . 24 GLY C 1 1 18 13034 1 1 24 GLY CA C 8.919 7.116 8.105 1.00 . A A . 24 GLY CA 1 1 18 13035 1 1 24 GLY H H 8.365 5.177 7.489 1.00 . A A . 24 GLY H 1 1 18 13036 1 1 24 GLY HA2 H 9.284 7.021 9.116 1.00 . A A . 24 GLY HA2 1 1 18 13037 1 1 24 GLY HA3 H 9.514 7.864 7.616 1.00 . A A . 24 GLY HA3 1 1 18 13038 1 1 24 GLY N N 9.057 5.867 7.412 1.00 . A A . 24 GLY N 1 1 18 13039 1 1 24 GLY O O 7.208 8.398 9.083 1.00 . A A . 24 GLY O 1 1 18 13040 1 1 25 CYS C C 4.279 6.838 7.547 1.00 . A A . 25 CYS C 1 1 18 13041 1 1 25 CYS CA C 5.347 7.884 7.292 1.00 . A A . 25 CYS CA 1 1 18 13042 1 1 25 CYS CB C 5.004 8.825 6.099 1.00 . A A . 25 CYS CB 1 1 18 13043 1 1 25 CYS H H 6.904 6.640 6.553 1.00 . A A . 25 CYS H 1 1 18 13044 1 1 25 CYS HA H 5.377 8.479 8.195 1.00 . A A . 25 CYS HA 1 1 18 13045 1 1 25 CYS HB2 H 4.077 9.334 6.329 1.00 . A A . 25 CYS HB2 1 1 18 13046 1 1 25 CYS HB3 H 5.790 9.559 5.972 1.00 . A A . 25 CYS HB3 1 1 18 13047 1 1 25 CYS N N 6.665 7.304 7.228 1.00 . A A . 25 CYS N 1 1 18 13048 1 1 25 CYS O O 3.821 6.169 6.634 1.00 . A A . 25 CYS O 1 1 18 13049 1 1 25 CYS SG S 4.703 8.050 4.496 1.00 . A A . 25 CYS SG 1 1 18 13050 1 1 26 ASP C C 1.511 5.758 8.720 1.00 . A A . 26 ASP C 1 1 18 13051 1 1 26 ASP CA C 2.925 5.742 9.421 1.00 . A A . 26 ASP CA 1 1 18 13052 1 1 26 ASP CB C 2.757 6.031 10.947 1.00 . A A . 26 ASP CB 1 1 18 13053 1 1 26 ASP CG C 2.257 7.443 11.295 1.00 . A A . 26 ASP CG 1 1 18 13054 1 1 26 ASP H H 4.733 6.968 9.418 1.00 . A A . 26 ASP H 1 1 18 13055 1 1 26 ASP HA H 3.295 4.731 9.339 1.00 . A A . 26 ASP HA 1 1 18 13056 1 1 26 ASP HB2 H 2.058 5.325 11.368 1.00 . A A . 26 ASP HB2 1 1 18 13057 1 1 26 ASP HB3 H 3.711 5.887 11.430 1.00 . A A . 26 ASP HB3 1 1 18 13058 1 1 26 ASP N N 4.026 6.627 8.829 1.00 . A A . 26 ASP N 1 1 18 13059 1 1 26 ASP O O 0.550 5.220 9.277 1.00 . A A . 26 ASP O 1 1 18 13060 1 1 26 ASP OD1 O 3.018 8.412 11.089 1.00 . A A . 26 ASP OD1 1 1 18 13061 1 1 26 ASP OD2 O 1.116 7.577 11.839 1.00 . A A . 26 ASP OD2 1 1 18 13062 1 1 27 GLU C C -0.010 4.917 6.070 1.00 . A A . 27 GLU C 1 1 18 13063 1 1 27 GLU CA C 0.162 6.281 6.776 1.00 . A A . 27 GLU CA 1 1 18 13064 1 1 27 GLU CB C 0.086 7.457 5.773 1.00 . A A . 27 GLU CB 1 1 18 13065 1 1 27 GLU CD C -0.159 10.000 5.507 1.00 . A A . 27 GLU CD 1 1 18 13066 1 1 27 GLU CG C 0.113 8.833 6.450 1.00 . A A . 27 GLU CG 1 1 18 13067 1 1 27 GLU H H 2.210 6.669 7.114 1.00 . A A . 27 GLU H 1 1 18 13068 1 1 27 GLU HA H -0.641 6.371 7.494 1.00 . A A . 27 GLU HA 1 1 18 13069 1 1 27 GLU HB2 H 0.933 7.389 5.107 1.00 . A A . 27 GLU HB2 1 1 18 13070 1 1 27 GLU HB3 H -0.819 7.371 5.191 1.00 . A A . 27 GLU HB3 1 1 18 13071 1 1 27 GLU HG2 H -0.586 8.859 7.269 1.00 . A A . 27 GLU HG2 1 1 18 13072 1 1 27 GLU HG3 H 1.106 8.956 6.860 1.00 . A A . 27 GLU HG3 1 1 18 13073 1 1 27 GLU N N 1.404 6.292 7.523 1.00 . A A . 27 GLU N 1 1 18 13074 1 1 27 GLU O O 0.970 4.164 5.898 1.00 . A A . 27 GLU O 1 1 18 13075 1 1 27 GLU OE1 O -1.349 10.259 5.169 1.00 . A A . 27 GLU OE1 1 1 18 13076 1 1 27 GLU OE2 O 0.797 10.681 5.110 1.00 . A A . 27 GLU OE2 1 1 18 13077 1 1 28 TRP C C -1.783 3.451 3.567 1.00 . A A . 28 TRP C 1 1 18 13078 1 1 28 TRP CA C -1.545 3.320 5.057 1.00 . A A . 28 TRP CA 1 1 18 13079 1 1 28 TRP CB C -2.732 2.635 5.737 1.00 . A A . 28 TRP CB 1 1 18 13080 1 1 28 TRP CD1 C -2.334 2.852 8.278 1.00 . A A . 28 TRP CD1 1 1 18 13081 1 1 28 TRP CD2 C -2.215 0.759 7.481 1.00 . A A . 28 TRP CD2 1 1 18 13082 1 1 28 TRP CE2 C -1.983 0.721 8.866 1.00 . A A . 28 TRP CE2 1 1 18 13083 1 1 28 TRP CE3 C -2.192 -0.434 6.758 1.00 . A A . 28 TRP CE3 1 1 18 13084 1 1 28 TRP CG C -2.434 2.123 7.120 1.00 . A A . 28 TRP CG 1 1 18 13085 1 1 28 TRP CH2 C -1.718 -1.613 8.811 1.00 . A A . 28 TRP CH2 1 1 18 13086 1 1 28 TRP CZ2 C -1.735 -0.461 9.541 1.00 . A A . 28 TRP CZ2 1 1 18 13087 1 1 28 TRP CZ3 C -1.945 -1.608 7.428 1.00 . A A . 28 TRP CZ3 1 1 18 13088 1 1 28 TRP H H -1.915 5.299 5.805 1.00 . A A . 28 TRP H 1 1 18 13089 1 1 28 TRP HA H -0.672 2.699 5.191 1.00 . A A . 28 TRP HA 1 1 18 13090 1 1 28 TRP HB2 H -3.546 3.342 5.815 1.00 . A A . 28 TRP HB2 1 1 18 13091 1 1 28 TRP HB3 H -3.048 1.802 5.126 1.00 . A A . 28 TRP HB3 1 1 18 13092 1 1 28 TRP HD1 H -2.450 3.924 8.339 1.00 . A A . 28 TRP HD1 1 1 18 13093 1 1 28 TRP HE1 H -1.936 2.303 10.267 1.00 . A A . 28 TRP HE1 1 1 18 13094 1 1 28 TRP HE3 H -2.363 -0.447 5.692 1.00 . A A . 28 TRP HE3 1 1 18 13095 1 1 28 TRP HH2 H -1.527 -2.556 9.302 1.00 . A A . 28 TRP HH2 1 1 18 13096 1 1 28 TRP HZ2 H -1.561 -0.495 10.605 1.00 . A A . 28 TRP HZ2 1 1 18 13097 1 1 28 TRP HZ3 H -1.925 -2.540 6.884 1.00 . A A . 28 TRP HZ3 1 1 18 13098 1 1 28 TRP N N -1.232 4.605 5.683 1.00 . A A . 28 TRP N 1 1 18 13099 1 1 28 TRP NE1 N -2.056 2.013 9.335 1.00 . A A . 28 TRP NE1 1 1 18 13100 1 1 28 TRP O O -2.552 4.313 3.121 1.00 . A A . 28 TRP O 1 1 18 13101 1 1 29 PHE C C -1.739 1.210 0.872 1.00 . A A . 29 PHE C 1 1 18 13102 1 1 29 PHE CA C -1.184 2.586 1.359 1.00 . A A . 29 PHE CA 1 1 18 13103 1 1 29 PHE CB C 0.249 2.806 0.760 1.00 . A A . 29 PHE CB 1 1 18 13104 1 1 29 PHE CD1 C 1.537 4.033 2.563 1.00 . A A . 29 PHE CD1 1 1 18 13105 1 1 29 PHE CD2 C 1.160 5.168 0.504 1.00 . A A . 29 PHE CD2 1 1 18 13106 1 1 29 PHE CE1 C 2.218 5.129 3.049 1.00 . A A . 29 PHE CE1 1 1 18 13107 1 1 29 PHE CE2 C 1.847 6.274 0.989 1.00 . A A . 29 PHE CE2 1 1 18 13108 1 1 29 PHE CG C 0.993 4.032 1.285 1.00 . A A . 29 PHE CG 1 1 18 13109 1 1 29 PHE CZ C 2.372 6.249 2.269 1.00 . A A . 29 PHE CZ 1 1 18 13110 1 1 29 PHE H H -0.508 1.963 3.266 1.00 . A A . 29 PHE H 1 1 18 13111 1 1 29 PHE HA H -1.829 3.391 1.036 1.00 . A A . 29 PHE HA 1 1 18 13112 1 1 29 PHE HB2 H 0.863 1.935 0.923 1.00 . A A . 29 PHE HB2 1 1 18 13113 1 1 29 PHE HB3 H 0.133 2.927 -0.310 1.00 . A A . 29 PHE HB3 1 1 18 13114 1 1 29 PHE HD1 H 1.411 3.149 3.175 1.00 . A A . 29 PHE HD1 1 1 18 13115 1 1 29 PHE HD2 H 0.743 5.201 -0.494 1.00 . A A . 29 PHE HD2 1 1 18 13116 1 1 29 PHE HE1 H 2.635 5.116 4.045 1.00 . A A . 29 PHE HE1 1 1 18 13117 1 1 29 PHE HE2 H 1.966 7.149 0.367 1.00 . A A . 29 PHE HE2 1 1 18 13118 1 1 29 PHE HZ H 2.907 7.102 2.658 1.00 . A A . 29 PHE HZ 1 1 18 13119 1 1 29 PHE N N -1.110 2.597 2.811 1.00 . A A . 29 PHE N 1 1 18 13120 1 1 29 PHE O O -1.579 0.184 1.546 1.00 . A A . 29 PHE O 1 1 18 13121 1 1 30 HIS C C -1.772 -0.573 -1.812 1.00 . A A . 30 HIS C 1 1 18 13122 1 1 30 HIS CA C -2.864 -0.063 -0.928 1.00 . A A . 30 HIS CA 1 1 18 13123 1 1 30 HIS CB C -4.085 0.157 -1.851 1.00 . A A . 30 HIS CB 1 1 18 13124 1 1 30 HIS CD2 C -6.337 -0.588 -0.848 1.00 . A A . 30 HIS CD2 1 1 18 13125 1 1 30 HIS CE1 C -7.278 1.374 -0.711 1.00 . A A . 30 HIS CE1 1 1 18 13126 1 1 30 HIS CG C -5.433 0.322 -1.248 1.00 . A A . 30 HIS CG 1 1 18 13127 1 1 30 HIS H H -2.549 2.064 -0.713 1.00 . A A . 30 HIS H 1 1 18 13128 1 1 30 HIS HA H -3.116 -0.784 -0.165 1.00 . A A . 30 HIS HA 1 1 18 13129 1 1 30 HIS HB2 H -3.895 1.116 -2.310 1.00 . A A . 30 HIS HB2 1 1 18 13130 1 1 30 HIS HB3 H -4.137 -0.535 -2.680 1.00 . A A . 30 HIS HB3 1 1 18 13131 1 1 30 HIS HD2 H -6.180 -1.657 -0.786 1.00 . A A . 30 HIS HD2 1 1 18 13132 1 1 30 HIS HE1 H -8.012 2.144 -0.541 1.00 . A A . 30 HIS HE1 1 1 18 13133 1 1 30 HIS HE2 H -8.169 -0.282 0.078 1.00 . A A . 30 HIS HE2 1 1 18 13134 1 1 30 HIS N N -2.406 1.196 -0.285 1.00 . A A . 30 HIS N 1 1 18 13135 1 1 30 HIS ND1 N -6.039 1.540 -1.150 1.00 . A A . 30 HIS ND1 1 1 18 13136 1 1 30 HIS NE2 N -7.481 0.085 -0.522 1.00 . A A . 30 HIS NE2 1 1 18 13137 1 1 30 HIS O O -1.127 0.221 -2.489 1.00 . A A . 30 HIS O 1 1 18 13138 1 1 31 GLN C C -0.826 -2.062 -4.204 1.00 . A A . 31 GLN C 1 1 18 13139 1 1 31 GLN CA C -0.585 -2.457 -2.750 1.00 . A A . 31 GLN CA 1 1 18 13140 1 1 31 GLN CB C -0.439 -3.977 -2.603 1.00 . A A . 31 GLN CB 1 1 18 13141 1 1 31 GLN CD C 0.333 -5.923 -1.204 1.00 . A A . 31 GLN CD 1 1 18 13142 1 1 31 GLN CG C 0.178 -4.423 -1.288 1.00 . A A . 31 GLN CG 1 1 18 13143 1 1 31 GLN H H -2.105 -2.464 -1.256 1.00 . A A . 31 GLN H 1 1 18 13144 1 1 31 GLN HA H 0.344 -1.992 -2.450 1.00 . A A . 31 GLN HA 1 1 18 13145 1 1 31 GLN HB2 H -1.410 -4.442 -2.685 1.00 . A A . 31 GLN HB2 1 1 18 13146 1 1 31 GLN HB3 H 0.188 -4.333 -3.408 1.00 . A A . 31 GLN HB3 1 1 18 13147 1 1 31 GLN HE21 H -1.391 -6.042 -0.322 1.00 . A A . 31 GLN HE21 1 1 18 13148 1 1 31 GLN HE22 H -0.585 -7.549 -0.589 1.00 . A A . 31 GLN HE22 1 1 18 13149 1 1 31 GLN HG2 H 1.152 -3.972 -1.197 1.00 . A A . 31 GLN HG2 1 1 18 13150 1 1 31 GLN HG3 H -0.441 -4.083 -0.474 1.00 . A A . 31 GLN HG3 1 1 18 13151 1 1 31 GLN N N -1.585 -1.885 -1.855 1.00 . A A . 31 GLN N 1 1 18 13152 1 1 31 GLN NE2 N -0.638 -6.574 -0.651 1.00 . A A . 31 GLN NE2 1 1 18 13153 1 1 31 GLN O O 0.042 -1.527 -4.822 1.00 . A A . 31 GLN O 1 1 18 13154 1 1 31 GLN OE1 O 1.337 -6.469 -1.606 1.00 . A A . 31 GLN OE1 1 1 18 13155 1 1 32 VAL C C -2.263 -0.433 -6.404 1.00 . A A . 32 VAL C 1 1 18 13156 1 1 32 VAL CA C -2.312 -1.956 -6.108 1.00 . A A . 32 VAL CA 1 1 18 13157 1 1 32 VAL CB C -3.689 -2.524 -6.549 1.00 . A A . 32 VAL CB 1 1 18 13158 1 1 32 VAL CG1 C -4.787 -1.929 -5.718 1.00 . A A . 32 VAL CG1 1 1 18 13159 1 1 32 VAL CG2 C -3.934 -2.224 -8.010 1.00 . A A . 32 VAL CG2 1 1 18 13160 1 1 32 VAL H H -2.722 -2.633 -4.137 1.00 . A A . 32 VAL H 1 1 18 13161 1 1 32 VAL HA H -1.546 -2.426 -6.704 1.00 . A A . 32 VAL HA 1 1 18 13162 1 1 32 VAL HB H -3.674 -3.596 -6.416 1.00 . A A . 32 VAL HB 1 1 18 13163 1 1 32 VAL HG11 H -5.749 -2.325 -6.002 1.00 . A A . 32 VAL HG11 1 1 18 13164 1 1 32 VAL HG12 H -4.725 -0.866 -5.914 1.00 . A A . 32 VAL HG12 1 1 18 13165 1 1 32 VAL HG13 H -4.552 -2.116 -4.683 1.00 . A A . 32 VAL HG13 1 1 18 13166 1 1 32 VAL HG21 H -3.155 -2.657 -8.620 1.00 . A A . 32 VAL HG21 1 1 18 13167 1 1 32 VAL HG22 H -3.897 -1.147 -8.088 1.00 . A A . 32 VAL HG22 1 1 18 13168 1 1 32 VAL HG23 H -4.911 -2.576 -8.305 1.00 . A A . 32 VAL HG23 1 1 18 13169 1 1 32 VAL N N -2.018 -2.267 -4.706 1.00 . A A . 32 VAL N 1 1 18 13170 1 1 32 VAL O O -1.742 -0.001 -7.441 1.00 . A A . 32 VAL O 1 1 18 13171 1 1 33 CYS C C -1.526 2.471 -5.673 1.00 . A A . 33 CYS C 1 1 18 13172 1 1 33 CYS CA C -2.908 1.784 -5.704 1.00 . A A . 33 CYS CA 1 1 18 13173 1 1 33 CYS CB C -3.968 2.464 -4.755 1.00 . A A . 33 CYS CB 1 1 18 13174 1 1 33 CYS H H -3.069 -0.145 -4.691 1.00 . A A . 33 CYS H 1 1 18 13175 1 1 33 CYS HA H -3.244 1.900 -6.724 1.00 . A A . 33 CYS HA 1 1 18 13176 1 1 33 CYS HB2 H -4.348 3.333 -5.249 1.00 . A A . 33 CYS HB2 1 1 18 13177 1 1 33 CYS HB3 H -4.791 1.775 -4.635 1.00 . A A . 33 CYS HB3 1 1 18 13178 1 1 33 CYS N N -2.790 0.359 -5.476 1.00 . A A . 33 CYS N 1 1 18 13179 1 1 33 CYS O O -1.324 3.490 -6.327 1.00 . A A . 33 CYS O 1 1 18 13180 1 1 33 CYS SG S -3.398 2.937 -3.114 1.00 . A A . 33 CYS SG 1 1 18 13181 1 1 34 VAL C C 1.791 1.507 -5.608 1.00 . A A . 34 VAL C 1 1 18 13182 1 1 34 VAL CA C 0.747 2.426 -4.858 1.00 . A A . 34 VAL CA 1 1 18 13183 1 1 34 VAL CB C 1.143 2.628 -3.378 1.00 . A A . 34 VAL CB 1 1 18 13184 1 1 34 VAL CG1 C 1.813 1.440 -2.735 1.00 . A A . 34 VAL CG1 1 1 18 13185 1 1 34 VAL CG2 C 1.857 3.916 -3.181 1.00 . A A . 34 VAL CG2 1 1 18 13186 1 1 34 VAL H H -0.747 1.109 -4.367 1.00 . A A . 34 VAL H 1 1 18 13187 1 1 34 VAL HA H 0.712 3.386 -5.347 1.00 . A A . 34 VAL HA 1 1 18 13188 1 1 34 VAL HB H 0.258 2.651 -2.768 1.00 . A A . 34 VAL HB 1 1 18 13189 1 1 34 VAL HG11 H 2.735 1.270 -3.270 1.00 . A A . 34 VAL HG11 1 1 18 13190 1 1 34 VAL HG12 H 1.177 0.569 -2.816 1.00 . A A . 34 VAL HG12 1 1 18 13191 1 1 34 VAL HG13 H 2.028 1.652 -1.698 1.00 . A A . 34 VAL HG13 1 1 18 13192 1 1 34 VAL HG21 H 1.202 4.682 -3.573 1.00 . A A . 34 VAL HG21 1 1 18 13193 1 1 34 VAL HG22 H 2.780 3.896 -3.738 1.00 . A A . 34 VAL HG22 1 1 18 13194 1 1 34 VAL HG23 H 2.004 4.073 -2.123 1.00 . A A . 34 VAL HG23 1 1 18 13195 1 1 34 VAL N N -0.576 1.885 -4.934 1.00 . A A . 34 VAL N 1 1 18 13196 1 1 34 VAL O O 3.004 1.736 -5.551 1.00 . A A . 34 VAL O 1 1 18 13197 1 1 35 GLY C C 3.087 -1.362 -6.359 1.00 . A A . 35 GLY C 1 1 18 13198 1 1 35 GLY CA C 2.120 -0.423 -7.138 1.00 . A A . 35 GLY CA 1 1 18 13199 1 1 35 GLY H H 0.296 0.485 -6.397 1.00 . A A . 35 GLY H 1 1 18 13200 1 1 35 GLY HA2 H 1.444 -1.051 -7.698 1.00 . A A . 35 GLY HA2 1 1 18 13201 1 1 35 GLY HA3 H 2.681 0.160 -7.855 1.00 . A A . 35 GLY HA3 1 1 18 13202 1 1 35 GLY N N 1.276 0.510 -6.337 1.00 . A A . 35 GLY N 1 1 18 13203 1 1 35 GLY O O 4.218 -1.597 -6.795 1.00 . A A . 35 GLY O 1 1 18 13204 1 1 36 VAL C C 3.026 -4.272 -4.942 1.00 . A A . 36 VAL C 1 1 18 13205 1 1 36 VAL CA C 3.400 -2.883 -4.482 1.00 . A A . 36 VAL CA 1 1 18 13206 1 1 36 VAL CB C 3.090 -2.744 -2.963 1.00 . A A . 36 VAL CB 1 1 18 13207 1 1 36 VAL CG1 C 3.715 -3.859 -2.141 1.00 . A A . 36 VAL CG1 1 1 18 13208 1 1 36 VAL CG2 C 3.531 -1.404 -2.455 1.00 . A A . 36 VAL CG2 1 1 18 13209 1 1 36 VAL H H 1.751 -1.667 -4.911 1.00 . A A . 36 VAL H 1 1 18 13210 1 1 36 VAL HA H 4.455 -2.714 -4.643 1.00 . A A . 36 VAL HA 1 1 18 13211 1 1 36 VAL HB H 2.018 -2.810 -2.847 1.00 . A A . 36 VAL HB 1 1 18 13212 1 1 36 VAL HG11 H 4.748 -4.021 -2.416 1.00 . A A . 36 VAL HG11 1 1 18 13213 1 1 36 VAL HG12 H 3.145 -4.757 -2.318 1.00 . A A . 36 VAL HG12 1 1 18 13214 1 1 36 VAL HG13 H 3.652 -3.596 -1.096 1.00 . A A . 36 VAL HG13 1 1 18 13215 1 1 36 VAL HG21 H 4.582 -1.244 -2.648 1.00 . A A . 36 VAL HG21 1 1 18 13216 1 1 36 VAL HG22 H 3.336 -1.333 -1.394 1.00 . A A . 36 VAL HG22 1 1 18 13217 1 1 36 VAL HG23 H 2.960 -0.656 -2.983 1.00 . A A . 36 VAL HG23 1 1 18 13218 1 1 36 VAL N N 2.641 -1.906 -5.251 1.00 . A A . 36 VAL N 1 1 18 13219 1 1 36 VAL O O 1.901 -4.492 -5.387 1.00 . A A . 36 VAL O 1 1 18 13220 1 1 37 SER C C 3.447 -7.336 -3.914 1.00 . A A . 37 SER C 1 1 18 13221 1 1 37 SER CA C 3.661 -6.557 -5.211 1.00 . A A . 37 SER CA 1 1 18 13222 1 1 37 SER CB C 4.823 -7.129 -6.019 1.00 . A A . 37 SER CB 1 1 18 13223 1 1 37 SER H H 4.885 -5.129 -4.549 1.00 . A A . 37 SER H 1 1 18 13224 1 1 37 SER HA H 2.766 -6.558 -5.813 1.00 . A A . 37 SER HA 1 1 18 13225 1 1 37 SER HB2 H 4.657 -8.187 -6.166 1.00 . A A . 37 SER HB2 1 1 18 13226 1 1 37 SER HB3 H 4.878 -6.627 -6.976 1.00 . A A . 37 SER HB3 1 1 18 13227 1 1 37 SER HG H 6.773 -7.083 -5.961 1.00 . A A . 37 SER HG 1 1 18 13228 1 1 37 SER N N 3.956 -5.205 -4.868 1.00 . A A . 37 SER N 1 1 18 13229 1 1 37 SER O O 4.059 -6.994 -2.892 1.00 . A A . 37 SER O 1 1 18 13230 1 1 37 SER OG O 6.057 -6.957 -5.329 1.00 . A A . 37 SER OG 1 1 18 13231 1 1 38 PRO C C 3.516 -9.631 -1.937 1.00 . A A . 38 PRO C 1 1 18 13232 1 1 38 PRO CA C 2.277 -9.171 -2.697 1.00 . A A . 38 PRO CA 1 1 18 13233 1 1 38 PRO CB C 1.513 -10.393 -3.245 1.00 . A A . 38 PRO CB 1 1 18 13234 1 1 38 PRO CD C 1.925 -8.945 -5.087 1.00 . A A . 38 PRO CD 1 1 18 13235 1 1 38 PRO CG C 1.782 -10.382 -4.710 1.00 . A A . 38 PRO CG 1 1 18 13236 1 1 38 PRO HA H 1.626 -8.607 -2.044 1.00 . A A . 38 PRO HA 1 1 18 13237 1 1 38 PRO HB2 H 1.893 -11.292 -2.781 1.00 . A A . 38 PRO HB2 1 1 18 13238 1 1 38 PRO HB3 H 0.458 -10.290 -3.036 1.00 . A A . 38 PRO HB3 1 1 18 13239 1 1 38 PRO HD2 H 2.531 -8.864 -5.979 1.00 . A A . 38 PRO HD2 1 1 18 13240 1 1 38 PRO HD3 H 0.958 -8.488 -5.226 1.00 . A A . 38 PRO HD3 1 1 18 13241 1 1 38 PRO HG2 H 2.709 -10.905 -4.880 1.00 . A A . 38 PRO HG2 1 1 18 13242 1 1 38 PRO HG3 H 0.984 -10.850 -5.270 1.00 . A A . 38 PRO HG3 1 1 18 13243 1 1 38 PRO N N 2.608 -8.398 -3.918 1.00 . A A . 38 PRO N 1 1 18 13244 1 1 38 PRO O O 3.538 -9.660 -0.707 1.00 . A A . 38 PRO O 1 1 18 13245 1 1 39 GLU C C 6.559 -9.351 -1.411 1.00 . A A . 39 GLU C 1 1 18 13246 1 1 39 GLU CA C 5.768 -10.437 -2.129 1.00 . A A . 39 GLU CA 1 1 18 13247 1 1 39 GLU CB C 6.602 -11.041 -3.229 1.00 . A A . 39 GLU CB 1 1 18 13248 1 1 39 GLU CD C 6.850 -12.798 -5.014 1.00 . A A . 39 GLU CD 1 1 18 13249 1 1 39 GLU CG C 5.952 -12.212 -3.957 1.00 . A A . 39 GLU CG 1 1 18 13250 1 1 39 GLU H H 4.585 -9.847 -3.651 1.00 . A A . 39 GLU H 1 1 18 13251 1 1 39 GLU HA H 5.532 -11.225 -1.432 1.00 . A A . 39 GLU HA 1 1 18 13252 1 1 39 GLU HB2 H 6.782 -10.256 -3.953 1.00 . A A . 39 GLU HB2 1 1 18 13253 1 1 39 GLU HB3 H 7.531 -11.338 -2.783 1.00 . A A . 39 GLU HB3 1 1 18 13254 1 1 39 GLU HG2 H 5.699 -12.996 -3.261 1.00 . A A . 39 GLU HG2 1 1 18 13255 1 1 39 GLU HG3 H 5.055 -11.859 -4.438 1.00 . A A . 39 GLU HG3 1 1 18 13256 1 1 39 GLU N N 4.562 -9.946 -2.681 1.00 . A A . 39 GLU N 1 1 18 13257 1 1 39 GLU O O 7.293 -9.643 -0.482 1.00 . A A . 39 GLU O 1 1 18 13258 1 1 39 GLU OE1 O 6.992 -12.178 -6.082 1.00 . A A . 39 GLU OE1 1 1 18 13259 1 1 39 GLU OE2 O 7.423 -13.867 -4.780 1.00 . A A . 39 GLU OE2 1 1 18 13260 1 1 40 MET C C 6.626 -6.744 0.160 1.00 . A A . 40 MET C 1 1 18 13261 1 1 40 MET CA C 7.175 -7.014 -1.218 1.00 . A A . 40 MET CA 1 1 18 13262 1 1 40 MET CB C 7.164 -5.701 -2.046 1.00 . A A . 40 MET CB 1 1 18 13263 1 1 40 MET CE C 7.009 -2.257 -1.942 1.00 . A A . 40 MET CE 1 1 18 13264 1 1 40 MET CG C 8.250 -4.730 -1.556 1.00 . A A . 40 MET CG 1 1 18 13265 1 1 40 MET H H 5.745 -7.905 -2.528 1.00 . A A . 40 MET H 1 1 18 13266 1 1 40 MET HA H 8.191 -7.367 -1.115 1.00 . A A . 40 MET HA 1 1 18 13267 1 1 40 MET HB2 H 7.208 -5.878 -3.110 1.00 . A A . 40 MET HB2 1 1 18 13268 1 1 40 MET HB3 H 6.209 -5.234 -1.852 1.00 . A A . 40 MET HB3 1 1 18 13269 1 1 40 MET HE1 H 7.007 -1.274 -2.392 1.00 . A A . 40 MET HE1 1 1 18 13270 1 1 40 MET HE2 H 7.050 -2.147 -0.867 1.00 . A A . 40 MET HE2 1 1 18 13271 1 1 40 MET HE3 H 6.109 -2.777 -2.218 1.00 . A A . 40 MET HE3 1 1 18 13272 1 1 40 MET HG2 H 7.892 -4.456 -0.580 1.00 . A A . 40 MET HG2 1 1 18 13273 1 1 40 MET HG3 H 9.203 -5.228 -1.494 1.00 . A A . 40 MET HG3 1 1 18 13274 1 1 40 MET N N 6.404 -8.094 -1.828 1.00 . A A . 40 MET N 1 1 18 13275 1 1 40 MET O O 7.371 -6.483 1.086 1.00 . A A . 40 MET O 1 1 18 13276 1 1 40 MET SD S 8.422 -3.179 -2.497 1.00 . A A . 40 MET SD 1 1 18 13277 1 1 41 ALA C C 5.026 -7.620 2.629 1.00 . A A . 41 ALA C 1 1 18 13278 1 1 41 ALA CA C 4.579 -6.629 1.527 1.00 . A A . 41 ALA CA 1 1 18 13279 1 1 41 ALA CB C 3.074 -6.767 1.263 1.00 . A A . 41 ALA CB 1 1 18 13280 1 1 41 ALA H H 4.790 -7.055 -0.533 1.00 . A A . 41 ALA H 1 1 18 13281 1 1 41 ALA HA H 4.774 -5.616 1.852 1.00 . A A . 41 ALA HA 1 1 18 13282 1 1 41 ALA HB1 H 2.863 -7.769 0.920 1.00 . A A . 41 ALA HB1 1 1 18 13283 1 1 41 ALA HB2 H 2.735 -6.074 0.503 1.00 . A A . 41 ALA HB2 1 1 18 13284 1 1 41 ALA HB3 H 2.514 -6.588 2.167 1.00 . A A . 41 ALA HB3 1 1 18 13285 1 1 41 ALA N N 5.310 -6.843 0.271 1.00 . A A . 41 ALA N 1 1 18 13286 1 1 41 ALA O O 5.019 -7.287 3.811 1.00 . A A . 41 ALA O 1 1 18 13287 1 1 42 GLU C C 7.358 -9.899 3.368 1.00 . A A . 42 GLU C 1 1 18 13288 1 1 42 GLU CA C 5.829 -9.854 3.183 1.00 . A A . 42 GLU CA 1 1 18 13289 1 1 42 GLU CB C 5.331 -11.263 2.750 1.00 . A A . 42 GLU CB 1 1 18 13290 1 1 42 GLU CD C 3.407 -12.861 2.275 1.00 . A A . 42 GLU CD 1 1 18 13291 1 1 42 GLU CG C 3.820 -11.428 2.642 1.00 . A A . 42 GLU CG 1 1 18 13292 1 1 42 GLU H H 5.367 -8.972 1.258 1.00 . A A . 42 GLU H 1 1 18 13293 1 1 42 GLU HA H 5.375 -9.618 4.134 1.00 . A A . 42 GLU HA 1 1 18 13294 1 1 42 GLU HB2 H 5.744 -11.506 1.783 1.00 . A A . 42 GLU HB2 1 1 18 13295 1 1 42 GLU HB3 H 5.703 -11.980 3.467 1.00 . A A . 42 GLU HB3 1 1 18 13296 1 1 42 GLU HG2 H 3.397 -11.203 3.609 1.00 . A A . 42 GLU HG2 1 1 18 13297 1 1 42 GLU HG3 H 3.441 -10.749 1.890 1.00 . A A . 42 GLU HG3 1 1 18 13298 1 1 42 GLU N N 5.411 -8.826 2.227 1.00 . A A . 42 GLU N 1 1 18 13299 1 1 42 GLU O O 7.857 -10.387 4.385 1.00 . A A . 42 GLU O 1 1 18 13300 1 1 42 GLU OE1 O 3.362 -13.735 3.181 1.00 . A A . 42 GLU OE1 1 1 18 13301 1 1 42 GLU OE2 O 3.126 -13.135 1.086 1.00 . A A . 42 GLU OE2 1 1 18 13302 1 1 43 ASN C C 10.356 -8.284 2.629 1.00 . A A . 43 ASN C 1 1 18 13303 1 1 43 ASN CA C 9.547 -9.551 2.422 1.00 . A A . 43 ASN CA 1 1 18 13304 1 1 43 ASN CB C 10.023 -10.262 1.157 1.00 . A A . 43 ASN CB 1 1 18 13305 1 1 43 ASN CG C 9.613 -11.713 1.092 1.00 . A A . 43 ASN CG 1 1 18 13306 1 1 43 ASN H H 7.714 -8.881 1.661 1.00 . A A . 43 ASN H 1 1 18 13307 1 1 43 ASN HA H 9.774 -10.213 3.246 1.00 . A A . 43 ASN HA 1 1 18 13308 1 1 43 ASN HB2 H 9.596 -9.763 0.299 1.00 . A A . 43 ASN HB2 1 1 18 13309 1 1 43 ASN HB3 H 11.094 -10.189 1.103 1.00 . A A . 43 ASN HB3 1 1 18 13310 1 1 43 ASN HD21 H 9.536 -11.629 -0.874 1.00 . A A . 43 ASN HD21 1 1 18 13311 1 1 43 ASN HD22 H 9.139 -13.154 -0.139 1.00 . A A . 43 ASN HD22 1 1 18 13312 1 1 43 ASN N N 8.103 -9.382 2.404 1.00 . A A . 43 ASN N 1 1 18 13313 1 1 43 ASN ND2 N 9.412 -12.213 -0.099 1.00 . A A . 43 ASN ND2 1 1 18 13314 1 1 43 ASN O O 11.415 -8.336 3.252 1.00 . A A . 43 ASN O 1 1 18 13315 1 1 43 ASN OD1 O 9.482 -12.382 2.107 1.00 . A A . 43 ASN OD1 1 1 18 13316 1 1 44 GLU C C 10.088 -4.817 2.905 1.00 . A A . 44 GLU C 1 1 18 13317 1 1 44 GLU CA C 10.748 -5.976 2.196 1.00 . A A . 44 GLU CA 1 1 18 13318 1 1 44 GLU CB C 11.244 -5.539 0.807 1.00 . A A . 44 GLU CB 1 1 18 13319 1 1 44 GLU CD C 12.637 -6.110 -1.209 1.00 . A A . 44 GLU CD 1 1 18 13320 1 1 44 GLU CG C 12.002 -6.616 0.055 1.00 . A A . 44 GLU CG 1 1 18 13321 1 1 44 GLU H H 9.000 -7.079 1.759 1.00 . A A . 44 GLU H 1 1 18 13322 1 1 44 GLU HA H 11.613 -6.252 2.782 1.00 . A A . 44 GLU HA 1 1 18 13323 1 1 44 GLU HB2 H 10.387 -5.245 0.220 1.00 . A A . 44 GLU HB2 1 1 18 13324 1 1 44 GLU HB3 H 11.900 -4.688 0.931 1.00 . A A . 44 GLU HB3 1 1 18 13325 1 1 44 GLU HG2 H 12.784 -6.993 0.697 1.00 . A A . 44 GLU HG2 1 1 18 13326 1 1 44 GLU HG3 H 11.320 -7.417 -0.185 1.00 . A A . 44 GLU HG3 1 1 18 13327 1 1 44 GLU N N 9.904 -7.161 2.133 1.00 . A A . 44 GLU N 1 1 18 13328 1 1 44 GLU O O 8.868 -4.783 3.086 1.00 . A A . 44 GLU O 1 1 18 13329 1 1 44 GLU OE1 O 11.927 -5.920 -2.209 1.00 . A A . 44 GLU OE1 1 1 18 13330 1 1 44 GLU OE2 O 13.880 -5.932 -1.215 1.00 . A A . 44 GLU OE2 1 1 18 13331 1 1 45 ASP C C 9.939 -1.644 2.996 1.00 . A A . 45 ASP C 1 1 18 13332 1 1 45 ASP CA C 10.473 -2.680 3.987 1.00 . A A . 45 ASP CA 1 1 18 13333 1 1 45 ASP CB C 11.659 -2.143 4.797 1.00 . A A . 45 ASP CB 1 1 18 13334 1 1 45 ASP CG C 11.375 -0.868 5.513 1.00 . A A . 45 ASP CG 1 1 18 13335 1 1 45 ASP H H 11.864 -3.947 3.089 1.00 . A A . 45 ASP H 1 1 18 13336 1 1 45 ASP HA H 9.683 -2.961 4.666 1.00 . A A . 45 ASP HA 1 1 18 13337 1 1 45 ASP HB2 H 11.927 -2.882 5.535 1.00 . A A . 45 ASP HB2 1 1 18 13338 1 1 45 ASP HB3 H 12.502 -1.988 4.141 1.00 . A A . 45 ASP HB3 1 1 18 13339 1 1 45 ASP N N 10.910 -3.863 3.283 1.00 . A A . 45 ASP N 1 1 18 13340 1 1 45 ASP O O 10.683 -1.143 2.121 1.00 . A A . 45 ASP O 1 1 18 13341 1 1 45 ASP OD1 O 10.772 -0.920 6.603 1.00 . A A . 45 ASP OD1 1 1 18 13342 1 1 45 ASP OD2 O 11.798 0.176 5.009 1.00 . A A . 45 ASP OD2 1 1 18 13343 1 1 46 TYR C C 8.346 1.052 2.487 1.00 . A A . 46 TYR C 1 1 18 13344 1 1 46 TYR CA C 7.966 -0.406 2.225 1.00 . A A . 46 TYR CA 1 1 18 13345 1 1 46 TYR CB C 6.404 -0.588 2.205 1.00 . A A . 46 TYR CB 1 1 18 13346 1 1 46 TYR CD1 C 5.405 0.337 0.027 1.00 . A A . 46 TYR CD1 1 1 18 13347 1 1 46 TYR CD2 C 5.217 1.649 1.990 1.00 . A A . 46 TYR CD2 1 1 18 13348 1 1 46 TYR CE1 C 4.756 1.339 -0.684 1.00 . A A . 46 TYR CE1 1 1 18 13349 1 1 46 TYR CE2 C 4.567 2.629 1.297 1.00 . A A . 46 TYR CE2 1 1 18 13350 1 1 46 TYR CG C 5.651 0.485 1.387 1.00 . A A . 46 TYR CG 1 1 18 13351 1 1 46 TYR CZ C 4.350 2.478 -0.032 1.00 . A A . 46 TYR CZ 1 1 18 13352 1 1 46 TYR H H 8.162 -1.864 3.796 1.00 . A A . 46 TYR H 1 1 18 13353 1 1 46 TYR HA H 8.332 -0.633 1.234 1.00 . A A . 46 TYR HA 1 1 18 13354 1 1 46 TYR HB2 H 6.170 -1.540 1.747 1.00 . A A . 46 TYR HB2 1 1 18 13355 1 1 46 TYR HB3 H 6.029 -0.557 3.218 1.00 . A A . 46 TYR HB3 1 1 18 13356 1 1 46 TYR HD1 H 5.725 -0.562 -0.476 1.00 . A A . 46 TYR HD1 1 1 18 13357 1 1 46 TYR HD2 H 5.388 1.775 3.041 1.00 . A A . 46 TYR HD2 1 1 18 13358 1 1 46 TYR HE1 H 4.542 1.246 -1.741 1.00 . A A . 46 TYR HE1 1 1 18 13359 1 1 46 TYR HE2 H 4.233 3.528 1.795 1.00 . A A . 46 TYR HE2 1 1 18 13360 1 1 46 TYR HH H 3.035 3.058 -1.245 1.00 . A A . 46 TYR HH 1 1 18 13361 1 1 46 TYR N N 8.640 -1.362 3.106 1.00 . A A . 46 TYR N 1 1 18 13362 1 1 46 TYR O O 7.963 1.667 3.505 1.00 . A A . 46 TYR O 1 1 18 13363 1 1 46 TYR OH O 3.730 3.472 -0.727 1.00 . A A . 46 TYR OH 1 1 18 13364 1 1 47 ILE C C 8.382 3.553 0.496 1.00 . A A . 47 ILE C 1 1 18 13365 1 1 47 ILE CA C 9.371 2.986 1.510 1.00 . A A . 47 ILE CA 1 1 18 13366 1 1 47 ILE CB C 10.819 3.270 1.011 1.00 . A A . 47 ILE CB 1 1 18 13367 1 1 47 ILE CD1 C 11.931 2.970 3.320 1.00 . A A . 47 ILE CD1 1 1 18 13368 1 1 47 ILE CG1 C 11.873 2.532 1.873 1.00 . A A . 47 ILE CG1 1 1 18 13369 1 1 47 ILE CG2 C 11.082 4.767 1.036 1.00 . A A . 47 ILE CG2 1 1 18 13370 1 1 47 ILE H H 9.422 0.943 0.902 1.00 . A A . 47 ILE H 1 1 18 13371 1 1 47 ILE HA H 9.202 3.423 2.481 1.00 . A A . 47 ILE HA 1 1 18 13372 1 1 47 ILE HB H 10.909 2.946 -0.017 1.00 . A A . 47 ILE HB 1 1 18 13373 1 1 47 ILE HD11 H 12.175 4.022 3.363 1.00 . A A . 47 ILE HD11 1 1 18 13374 1 1 47 ILE HD12 H 12.674 2.409 3.868 1.00 . A A . 47 ILE HD12 1 1 18 13375 1 1 47 ILE HD13 H 10.968 2.806 3.777 1.00 . A A . 47 ILE HD13 1 1 18 13376 1 1 47 ILE HG12 H 11.655 1.474 1.866 1.00 . A A . 47 ILE HG12 1 1 18 13377 1 1 47 ILE HG13 H 12.844 2.694 1.428 1.00 . A A . 47 ILE HG13 1 1 18 13378 1 1 47 ILE HG21 H 10.926 5.133 2.042 1.00 . A A . 47 ILE HG21 1 1 18 13379 1 1 47 ILE HG22 H 10.390 5.268 0.372 1.00 . A A . 47 ILE HG22 1 1 18 13380 1 1 47 ILE HG23 H 12.094 4.972 0.726 1.00 . A A . 47 ILE HG23 1 1 18 13381 1 1 47 ILE N N 9.081 1.584 1.560 1.00 . A A . 47 ILE N 1 1 18 13382 1 1 47 ILE O O 8.027 2.856 -0.449 1.00 . A A . 47 ILE O 1 1 18 13383 1 1 48 CYS C C 7.558 6.351 -1.154 1.00 . A A . 48 CYS C 1 1 18 13384 1 1 48 CYS CA C 6.930 5.295 -0.252 1.00 . A A . 48 CYS CA 1 1 18 13385 1 1 48 CYS CB C 5.818 5.966 0.519 1.00 . A A . 48 CYS CB 1 1 18 13386 1 1 48 CYS H H 8.182 5.368 1.395 1.00 . A A . 48 CYS H 1 1 18 13387 1 1 48 CYS HA H 6.508 4.493 -0.841 1.00 . A A . 48 CYS HA 1 1 18 13388 1 1 48 CYS HB2 H 4.995 6.180 -0.147 1.00 . A A . 48 CYS HB2 1 1 18 13389 1 1 48 CYS HB3 H 5.482 5.318 1.314 1.00 . A A . 48 CYS HB3 1 1 18 13390 1 1 48 CYS N N 7.910 4.768 0.674 1.00 . A A . 48 CYS N 1 1 18 13391 1 1 48 CYS O O 8.720 6.715 -0.984 1.00 . A A . 48 CYS O 1 1 18 13392 1 1 48 CYS SG S 6.336 7.509 1.271 1.00 . A A . 48 CYS SG 1 1 18 13393 1 1 49 ILE C C 7.747 9.170 -2.318 1.00 . A A . 49 ILE C 1 1 18 13394 1 1 49 ILE CA C 7.083 7.935 -3.003 1.00 . A A . 49 ILE CA 1 1 18 13395 1 1 49 ILE CB C 5.802 8.353 -3.790 1.00 . A A . 49 ILE CB 1 1 18 13396 1 1 49 ILE CD1 C 4.928 9.773 -5.703 1.00 . A A . 49 ILE CD1 1 1 18 13397 1 1 49 ILE CG1 C 6.094 9.464 -4.788 1.00 . A A . 49 ILE CG1 1 1 18 13398 1 1 49 ILE CG2 C 4.667 8.745 -2.841 1.00 . A A . 49 ILE CG2 1 1 18 13399 1 1 49 ILE H H 5.835 6.503 -2.116 1.00 . A A . 49 ILE H 1 1 18 13400 1 1 49 ILE HA H 7.777 7.550 -3.735 1.00 . A A . 49 ILE HA 1 1 18 13401 1 1 49 ILE HB H 5.481 7.471 -4.332 1.00 . A A . 49 ILE HB 1 1 18 13402 1 1 49 ILE HD11 H 5.202 10.543 -6.408 1.00 . A A . 49 ILE HD11 1 1 18 13403 1 1 49 ILE HD12 H 4.053 10.076 -5.148 1.00 . A A . 49 ILE HD12 1 1 18 13404 1 1 49 ILE HD13 H 4.682 8.870 -6.239 1.00 . A A . 49 ILE HD13 1 1 18 13405 1 1 49 ILE HG12 H 6.326 10.348 -4.217 1.00 . A A . 49 ILE HG12 1 1 18 13406 1 1 49 ILE HG13 H 6.949 9.195 -5.390 1.00 . A A . 49 ILE HG13 1 1 18 13407 1 1 49 ILE HG21 H 4.987 9.570 -2.223 1.00 . A A . 49 ILE HG21 1 1 18 13408 1 1 49 ILE HG22 H 4.379 7.900 -2.231 1.00 . A A . 49 ILE HG22 1 1 18 13409 1 1 49 ILE HG23 H 3.823 9.054 -3.437 1.00 . A A . 49 ILE HG23 1 1 18 13410 1 1 49 ILE N N 6.736 6.877 -2.063 1.00 . A A . 49 ILE N 1 1 18 13411 1 1 49 ILE O O 8.654 9.775 -2.876 1.00 . A A . 49 ILE O 1 1 18 13412 1 1 50 ASN C C 9.101 10.371 0.428 1.00 . A A . 50 ASN C 1 1 18 13413 1 1 50 ASN CA C 7.871 10.688 -0.400 1.00 . A A . 50 ASN CA 1 1 18 13414 1 1 50 ASN CB C 6.832 11.393 0.497 1.00 . A A . 50 ASN CB 1 1 18 13415 1 1 50 ASN CG C 5.623 11.915 -0.258 1.00 . A A . 50 ASN CG 1 1 18 13416 1 1 50 ASN H H 6.645 8.968 -0.629 1.00 . A A . 50 ASN H 1 1 18 13417 1 1 50 ASN HA H 8.176 11.381 -1.168 1.00 . A A . 50 ASN HA 1 1 18 13418 1 1 50 ASN HB2 H 6.475 10.698 1.241 1.00 . A A . 50 ASN HB2 1 1 18 13419 1 1 50 ASN HB3 H 7.309 12.224 0.990 1.00 . A A . 50 ASN HB3 1 1 18 13420 1 1 50 ASN HD21 H 4.557 10.291 0.186 1.00 . A A . 50 ASN HD21 1 1 18 13421 1 1 50 ASN HD22 H 3.778 11.503 -0.768 1.00 . A A . 50 ASN HD22 1 1 18 13422 1 1 50 ASN N N 7.326 9.504 -1.086 1.00 . A A . 50 ASN N 1 1 18 13423 1 1 50 ASN ND2 N 4.551 11.152 -0.277 1.00 . A A . 50 ASN ND2 1 1 18 13424 1 1 50 ASN O O 10.029 11.158 0.472 1.00 . A A . 50 ASN O 1 1 18 13425 1 1 50 ASN OD1 O 5.642 13.020 -0.783 1.00 . A A . 50 ASN OD1 1 1 18 13426 1 1 51 CYS C C 11.433 8.386 1.125 1.00 . A A . 51 CYS C 1 1 18 13427 1 1 51 CYS CA C 10.231 8.862 1.940 1.00 . A A . 51 CYS CA 1 1 18 13428 1 1 51 CYS CB C 9.823 7.845 3.005 1.00 . A A . 51 CYS CB 1 1 18 13429 1 1 51 CYS H H 8.362 8.610 0.941 1.00 . A A . 51 CYS H 1 1 18 13430 1 1 51 CYS HA H 10.545 9.774 2.428 1.00 . A A . 51 CYS HA 1 1 18 13431 1 1 51 CYS HB2 H 9.485 6.941 2.518 1.00 . A A . 51 CYS HB2 1 1 18 13432 1 1 51 CYS HB3 H 10.682 7.625 3.620 1.00 . A A . 51 CYS HB3 1 1 18 13433 1 1 51 CYS N N 9.113 9.222 1.070 1.00 . A A . 51 CYS N 1 1 18 13434 1 1 51 CYS O O 12.563 8.439 1.585 1.00 . A A . 51 CYS O 1 1 18 13435 1 1 51 CYS SG S 8.473 8.395 4.121 1.00 . A A . 51 CYS SG 1 1 18 13436 1 1 52 ALA C C 13.224 8.557 -1.329 1.00 . A A . 52 ALA C 1 1 18 13437 1 1 52 ALA CA C 12.246 7.432 -0.978 1.00 . A A . 52 ALA CA 1 1 18 13438 1 1 52 ALA CB C 11.670 6.820 -2.242 1.00 . A A . 52 ALA CB 1 1 18 13439 1 1 52 ALA H H 10.238 7.903 -0.408 1.00 . A A . 52 ALA H 1 1 18 13440 1 1 52 ALA HA H 12.790 6.670 -0.441 1.00 . A A . 52 ALA HA 1 1 18 13441 1 1 52 ALA HB1 H 11.108 7.561 -2.791 1.00 . A A . 52 ALA HB1 1 1 18 13442 1 1 52 ALA HB2 H 11.021 6.008 -1.948 1.00 . A A . 52 ALA HB2 1 1 18 13443 1 1 52 ALA HB3 H 12.480 6.447 -2.851 1.00 . A A . 52 ALA HB3 1 1 18 13444 1 1 52 ALA N N 11.172 7.912 -0.092 1.00 . A A . 52 ALA N 1 1 18 13445 2 2 1 ZN ZN ZN 6.594 7.249 3.510 1.00 . B A . 53 ZN ZN 1 1 18 13446 3 2 1 ZN ZN ZN -5.138 3.273 -1.581 1.00 . C A . 54 ZN ZN 1 1 19 13447 1 1 1 SER C C -11.611 5.923 0.997 1.00 . A A . 1 SER C 1 1 19 13448 1 1 1 SER CA C -12.707 5.900 2.092 1.00 . A A . 1 SER CA 1 1 19 13449 1 1 1 SER CB C -12.329 4.905 3.206 1.00 . A A . 1 SER CB 1 1 19 13450 1 1 1 SER HA H -12.783 6.891 2.511 1.00 . A A . 1 SER HA 1 1 19 13451 1 1 1 SER HB2 H -12.249 3.913 2.790 1.00 . A A . 1 SER HB2 1 1 19 13452 1 1 1 SER HB3 H -11.381 5.185 3.640 1.00 . A A . 1 SER HB3 1 1 19 13453 1 1 1 SER HG H -14.177 4.708 3.858 1.00 . A A . 1 SER HG 1 1 19 13454 1 1 1 SER N N -14.031 5.533 1.515 1.00 . A A . 1 SER N 1 1 19 13455 1 1 1 SER O O -11.721 5.234 -0.031 1.00 . A A . 1 SER O 1 1 19 13456 1 1 1 SER OG O -13.312 4.889 4.238 1.00 . A A . 1 SER OG 1 1 19 13457 1 1 2 VAL C C -8.191 6.682 1.104 1.00 . A A . 2 VAL C 1 1 19 13458 1 1 2 VAL CA C -9.468 6.865 0.298 1.00 . A A . 2 VAL CA 1 1 19 13459 1 1 2 VAL CB C -9.463 8.283 -0.372 1.00 . A A . 2 VAL CB 1 1 19 13460 1 1 2 VAL CG1 C -8.330 8.416 -1.393 1.00 . A A . 2 VAL CG1 1 1 19 13461 1 1 2 VAL CG2 C -10.802 8.578 -1.030 1.00 . A A . 2 VAL CG2 1 1 19 13462 1 1 2 VAL H H -10.530 7.248 2.049 1.00 . A A . 2 VAL H 1 1 19 13463 1 1 2 VAL HA H -9.536 6.101 -0.460 1.00 . A A . 2 VAL HA 1 1 19 13464 1 1 2 VAL HB H -9.291 9.009 0.411 1.00 . A A . 2 VAL HB 1 1 19 13465 1 1 2 VAL HG11 H -8.472 7.685 -2.173 1.00 . A A . 2 VAL HG11 1 1 19 13466 1 1 2 VAL HG12 H -7.384 8.238 -0.905 1.00 . A A . 2 VAL HG12 1 1 19 13467 1 1 2 VAL HG13 H -8.338 9.410 -1.817 1.00 . A A . 2 VAL HG13 1 1 19 13468 1 1 2 VAL HG21 H -10.998 7.828 -1.780 1.00 . A A . 2 VAL HG21 1 1 19 13469 1 1 2 VAL HG22 H -10.784 9.552 -1.494 1.00 . A A . 2 VAL HG22 1 1 19 13470 1 1 2 VAL HG23 H -11.585 8.543 -0.286 1.00 . A A . 2 VAL HG23 1 1 19 13471 1 1 2 VAL N N -10.581 6.724 1.220 1.00 . A A . 2 VAL N 1 1 19 13472 1 1 2 VAL O O -8.105 7.176 2.225 1.00 . A A . 2 VAL O 1 1 19 13473 1 1 3 CYS C C -4.924 6.688 0.819 1.00 . A A . 3 CYS C 1 1 19 13474 1 1 3 CYS CA C -6.006 5.728 1.335 1.00 . A A . 3 CYS CA 1 1 19 13475 1 1 3 CYS CB C -5.517 4.255 1.209 1.00 . A A . 3 CYS CB 1 1 19 13476 1 1 3 CYS H H -7.298 5.561 -0.313 1.00 . A A . 3 CYS H 1 1 19 13477 1 1 3 CYS HA H -6.212 5.953 2.370 1.00 . A A . 3 CYS HA 1 1 19 13478 1 1 3 CYS HB2 H -5.050 3.971 2.141 1.00 . A A . 3 CYS HB2 1 1 19 13479 1 1 3 CYS HB3 H -6.351 3.590 1.048 1.00 . A A . 3 CYS HB3 1 1 19 13480 1 1 3 CYS N N -7.224 5.950 0.580 1.00 . A A . 3 CYS N 1 1 19 13481 1 1 3 CYS O O -5.206 7.562 -0.018 1.00 . A A . 3 CYS O 1 1 19 13482 1 1 3 CYS SG S -4.312 3.960 -0.110 1.00 . A A . 3 CYS SG 1 1 19 13483 1 1 4 ALA C C -1.990 6.732 -0.397 1.00 . A A . 4 ALA C 1 1 19 13484 1 1 4 ALA CA C -2.618 7.358 0.845 1.00 . A A . 4 ALA CA 1 1 19 13485 1 1 4 ALA CB C -1.571 7.485 1.952 1.00 . A A . 4 ALA CB 1 1 19 13486 1 1 4 ALA H H -3.547 5.754 1.875 1.00 . A A . 4 ALA H 1 1 19 13487 1 1 4 ALA HA H -3.001 8.338 0.604 1.00 . A A . 4 ALA HA 1 1 19 13488 1 1 4 ALA HB1 H -2.006 7.935 2.833 1.00 . A A . 4 ALA HB1 1 1 19 13489 1 1 4 ALA HB2 H -0.748 8.095 1.611 1.00 . A A . 4 ALA HB2 1 1 19 13490 1 1 4 ALA HB3 H -1.187 6.505 2.203 1.00 . A A . 4 ALA HB3 1 1 19 13491 1 1 4 ALA N N -3.700 6.523 1.285 1.00 . A A . 4 ALA N 1 1 19 13492 1 1 4 ALA O O -1.590 5.588 -0.365 1.00 . A A . 4 ALA O 1 1 19 13493 1 1 5 ALA C C -1.552 8.179 -3.755 1.00 . A A . 5 ALA C 1 1 19 13494 1 1 5 ALA CA C -1.328 7.082 -2.753 1.00 . A A . 5 ALA CA 1 1 19 13495 1 1 5 ALA CB C -1.874 5.766 -3.341 1.00 . A A . 5 ALA CB 1 1 19 13496 1 1 5 ALA H H -2.589 8.250 -1.531 1.00 . A A . 5 ALA H 1 1 19 13497 1 1 5 ALA HA H -0.271 6.977 -2.551 1.00 . A A . 5 ALA HA 1 1 19 13498 1 1 5 ALA HB1 H -2.939 5.856 -3.505 1.00 . A A . 5 ALA HB1 1 1 19 13499 1 1 5 ALA HB2 H -1.701 4.955 -2.654 1.00 . A A . 5 ALA HB2 1 1 19 13500 1 1 5 ALA HB3 H -1.395 5.528 -4.280 1.00 . A A . 5 ALA HB3 1 1 19 13501 1 1 5 ALA N N -2.016 7.457 -1.504 1.00 . A A . 5 ALA N 1 1 19 13502 1 1 5 ALA O O -2.625 8.794 -3.744 1.00 . A A . 5 ALA O 1 1 19 13503 1 1 6 GLN C C -1.957 9.218 -6.500 1.00 . A A . 6 GLN C 1 1 19 13504 1 1 6 GLN CA C -0.665 9.456 -5.693 1.00 . A A . 6 GLN CA 1 1 19 13505 1 1 6 GLN CB C 0.559 9.371 -6.638 1.00 . A A . 6 GLN CB 1 1 19 13506 1 1 6 GLN CD C 3.037 9.564 -6.972 1.00 . A A . 6 GLN CD 1 1 19 13507 1 1 6 GLN CG C 1.890 9.621 -5.974 1.00 . A A . 6 GLN CG 1 1 19 13508 1 1 6 GLN H H 0.369 8.135 -4.421 1.00 . A A . 6 GLN H 1 1 19 13509 1 1 6 GLN HA H -0.702 10.442 -5.250 1.00 . A A . 6 GLN HA 1 1 19 13510 1 1 6 GLN HB2 H 0.631 8.376 -7.052 1.00 . A A . 6 GLN HB2 1 1 19 13511 1 1 6 GLN HB3 H 0.451 10.079 -7.449 1.00 . A A . 6 GLN HB3 1 1 19 13512 1 1 6 GLN HE21 H 3.244 7.598 -6.711 1.00 . A A . 6 GLN HE21 1 1 19 13513 1 1 6 GLN HE22 H 4.311 8.350 -7.842 1.00 . A A . 6 GLN HE22 1 1 19 13514 1 1 6 GLN HG2 H 1.862 10.599 -5.519 1.00 . A A . 6 GLN HG2 1 1 19 13515 1 1 6 GLN HG3 H 2.059 8.864 -5.221 1.00 . A A . 6 GLN HG3 1 1 19 13516 1 1 6 GLN N N -0.536 8.466 -4.592 1.00 . A A . 6 GLN N 1 1 19 13517 1 1 6 GLN NE2 N 3.581 8.384 -7.189 1.00 . A A . 6 GLN NE2 1 1 19 13518 1 1 6 GLN O O -2.649 10.162 -6.871 1.00 . A A . 6 GLN O 1 1 19 13519 1 1 6 GLN OE1 O 3.411 10.571 -7.546 1.00 . A A . 6 GLN OE1 1 1 19 13520 1 1 7 ASN C C -4.090 6.388 -6.679 1.00 . A A . 7 ASN C 1 1 19 13521 1 1 7 ASN CA C -3.496 7.586 -7.378 1.00 . A A . 7 ASN CA 1 1 19 13522 1 1 7 ASN CB C -3.324 7.313 -8.877 1.00 . A A . 7 ASN CB 1 1 19 13523 1 1 7 ASN CG C -4.637 6.908 -9.551 1.00 . A A . 7 ASN CG 1 1 19 13524 1 1 7 ASN H H -1.537 7.373 -6.442 1.00 . A A . 7 ASN H 1 1 19 13525 1 1 7 ASN HA H -4.168 8.423 -7.245 1.00 . A A . 7 ASN HA 1 1 19 13526 1 1 7 ASN HB2 H -2.962 8.204 -9.365 1.00 . A A . 7 ASN HB2 1 1 19 13527 1 1 7 ASN HB3 H -2.609 6.515 -9.006 1.00 . A A . 7 ASN HB3 1 1 19 13528 1 1 7 ASN HD21 H -3.641 5.885 -10.910 1.00 . A A . 7 ASN HD21 1 1 19 13529 1 1 7 ASN HD22 H -5.350 5.880 -11.109 1.00 . A A . 7 ASN HD22 1 1 19 13530 1 1 7 ASN N N -2.254 7.968 -6.742 1.00 . A A . 7 ASN N 1 1 19 13531 1 1 7 ASN ND2 N -4.543 6.143 -10.621 1.00 . A A . 7 ASN ND2 1 1 19 13532 1 1 7 ASN O O -3.640 5.261 -6.863 1.00 . A A . 7 ASN O 1 1 19 13533 1 1 7 ASN OD1 O -5.719 7.300 -9.118 1.00 . A A . 7 ASN OD1 1 1 19 13534 1 1 8 CYS C C -6.944 5.082 -5.888 1.00 . A A . 8 CYS C 1 1 19 13535 1 1 8 CYS CA C -5.698 5.550 -5.164 1.00 . A A . 8 CYS CA 1 1 19 13536 1 1 8 CYS CB C -5.993 5.868 -3.697 1.00 . A A . 8 CYS CB 1 1 19 13537 1 1 8 CYS H H -5.442 7.523 -5.732 1.00 . A A . 8 CYS H 1 1 19 13538 1 1 8 CYS HA H -4.985 4.746 -5.194 1.00 . A A . 8 CYS HA 1 1 19 13539 1 1 8 CYS HB2 H -5.078 6.112 -3.172 1.00 . A A . 8 CYS HB2 1 1 19 13540 1 1 8 CYS HB3 H -6.655 6.718 -3.648 1.00 . A A . 8 CYS HB3 1 1 19 13541 1 1 8 CYS N N -5.086 6.618 -5.856 1.00 . A A . 8 CYS N 1 1 19 13542 1 1 8 CYS O O -7.913 5.823 -6.027 1.00 . A A . 8 CYS O 1 1 19 13543 1 1 8 CYS SG S -6.797 4.482 -2.822 1.00 . A A . 8 CYS SG 1 1 19 13544 1 1 9 GLN C C -9.152 2.791 -6.129 1.00 . A A . 9 GLN C 1 1 19 13545 1 1 9 GLN CA C -7.984 3.185 -7.062 1.00 . A A . 9 GLN CA 1 1 19 13546 1 1 9 GLN CB C -7.415 1.930 -7.728 1.00 . A A . 9 GLN CB 1 1 19 13547 1 1 9 GLN CD C -5.609 0.934 -9.199 1.00 . A A . 9 GLN CD 1 1 19 13548 1 1 9 GLN CG C -6.215 2.197 -8.626 1.00 . A A . 9 GLN CG 1 1 19 13549 1 1 9 GLN H H -6.073 3.345 -6.152 1.00 . A A . 9 GLN H 1 1 19 13550 1 1 9 GLN HA H -8.327 3.861 -7.832 1.00 . A A . 9 GLN HA 1 1 19 13551 1 1 9 GLN HB2 H -7.112 1.255 -6.942 1.00 . A A . 9 GLN HB2 1 1 19 13552 1 1 9 GLN HB3 H -8.190 1.462 -8.312 1.00 . A A . 9 GLN HB3 1 1 19 13553 1 1 9 GLN HE21 H -3.815 1.763 -9.160 1.00 . A A . 9 GLN HE21 1 1 19 13554 1 1 9 GLN HE22 H -3.901 0.149 -9.769 1.00 . A A . 9 GLN HE22 1 1 19 13555 1 1 9 GLN HG2 H -6.501 2.821 -9.459 1.00 . A A . 9 GLN HG2 1 1 19 13556 1 1 9 GLN HG3 H -5.450 2.689 -8.043 1.00 . A A . 9 GLN HG3 1 1 19 13557 1 1 9 GLN N N -6.902 3.835 -6.318 1.00 . A A . 9 GLN N 1 1 19 13558 1 1 9 GLN NE2 N -4.314 0.954 -9.394 1.00 . A A . 9 GLN NE2 1 1 19 13559 1 1 9 GLN O O -10.171 2.305 -6.576 1.00 . A A . 9 GLN O 1 1 19 13560 1 1 9 GLN OE1 O -6.291 -0.056 -9.436 1.00 . A A . 9 GLN OE1 1 1 19 13561 1 1 10 ARG C C -10.424 1.174 -3.773 1.00 . A A . 10 ARG C 1 1 19 13562 1 1 10 ARG CA C -9.928 2.667 -3.763 1.00 . A A . 10 ARG CA 1 1 19 13563 1 1 10 ARG CB C -11.144 3.613 -3.859 1.00 . A A . 10 ARG CB 1 1 19 13564 1 1 10 ARG CD C -12.060 5.964 -3.809 1.00 . A A . 10 ARG CD 1 1 19 13565 1 1 10 ARG CG C -10.805 5.099 -3.754 1.00 . A A . 10 ARG CG 1 1 19 13566 1 1 10 ARG CZ C -14.220 6.133 -2.536 1.00 . A A . 10 ARG CZ 1 1 19 13567 1 1 10 ARG H H -8.096 3.421 -4.580 1.00 . A A . 10 ARG H 1 1 19 13568 1 1 10 ARG HA H -9.441 2.857 -2.818 1.00 . A A . 10 ARG HA 1 1 19 13569 1 1 10 ARG HB2 H -11.617 3.441 -4.815 1.00 . A A . 10 ARG HB2 1 1 19 13570 1 1 10 ARG HB3 H -11.839 3.356 -3.075 1.00 . A A . 10 ARG HB3 1 1 19 13571 1 1 10 ARG HD2 H -11.765 6.999 -3.862 1.00 . A A . 10 ARG HD2 1 1 19 13572 1 1 10 ARG HD3 H -12.609 5.707 -4.701 1.00 . A A . 10 ARG HD3 1 1 19 13573 1 1 10 ARG HE H -12.468 5.364 -1.848 1.00 . A A . 10 ARG HE 1 1 19 13574 1 1 10 ARG HG2 H -10.294 5.286 -2.820 1.00 . A A . 10 ARG HG2 1 1 19 13575 1 1 10 ARG HG3 H -10.152 5.370 -4.570 1.00 . A A . 10 ARG HG3 1 1 19 13576 1 1 10 ARG HH11 H -14.403 6.756 -4.488 1.00 . A A . 10 ARG HH11 1 1 19 13577 1 1 10 ARG HH12 H -15.817 6.909 -3.561 1.00 . A A . 10 ARG HH12 1 1 19 13578 1 1 10 ARG HH21 H -14.431 5.571 -0.583 1.00 . A A . 10 ARG HH21 1 1 19 13579 1 1 10 ARG HH22 H -15.849 6.195 -1.283 1.00 . A A . 10 ARG HH22 1 1 19 13580 1 1 10 ARG N N -8.943 2.996 -4.825 1.00 . A A . 10 ARG N 1 1 19 13581 1 1 10 ARG NE N -12.925 5.768 -2.624 1.00 . A A . 10 ARG NE 1 1 19 13582 1 1 10 ARG NH1 N -14.859 6.625 -3.600 1.00 . A A . 10 ARG NH1 1 1 19 13583 1 1 10 ARG NH2 N -14.883 5.954 -1.391 1.00 . A A . 10 ARG NH2 1 1 19 13584 1 1 10 ARG O O -11.569 0.926 -3.448 1.00 . A A . 10 ARG O 1 1 19 13585 1 1 11 PRO C C -10.406 -1.815 -2.781 1.00 . A A . 11 PRO C 1 1 19 13586 1 1 11 PRO CA C -10.016 -1.255 -4.144 1.00 . A A . 11 PRO CA 1 1 19 13587 1 1 11 PRO CB C -8.799 -2.028 -4.681 1.00 . A A . 11 PRO CB 1 1 19 13588 1 1 11 PRO CD C -8.111 0.227 -4.292 1.00 . A A . 11 PRO CD 1 1 19 13589 1 1 11 PRO CG C -7.848 -0.975 -5.144 1.00 . A A . 11 PRO CG 1 1 19 13590 1 1 11 PRO HA H -10.844 -1.350 -4.829 1.00 . A A . 11 PRO HA 1 1 19 13591 1 1 11 PRO HB2 H -8.376 -2.624 -3.883 1.00 . A A . 11 PRO HB2 1 1 19 13592 1 1 11 PRO HB3 H -9.102 -2.665 -5.499 1.00 . A A . 11 PRO HB3 1 1 19 13593 1 1 11 PRO HD2 H -7.563 0.178 -3.359 1.00 . A A . 11 PRO HD2 1 1 19 13594 1 1 11 PRO HD3 H -7.859 1.133 -4.821 1.00 . A A . 11 PRO HD3 1 1 19 13595 1 1 11 PRO HG2 H -6.835 -1.317 -4.991 1.00 . A A . 11 PRO HG2 1 1 19 13596 1 1 11 PRO HG3 H -8.014 -0.753 -6.187 1.00 . A A . 11 PRO HG3 1 1 19 13597 1 1 11 PRO N N -9.550 0.145 -4.061 1.00 . A A . 11 PRO N 1 1 19 13598 1 1 11 PRO O O -9.707 -1.573 -1.767 1.00 . A A . 11 PRO O 1 1 19 13599 1 1 12 CYS C C -12.477 -4.581 -1.841 1.00 . A A . 12 CYS C 1 1 19 13600 1 1 12 CYS CA C -11.982 -3.172 -1.551 1.00 . A A . 12 CYS CA 1 1 19 13601 1 1 12 CYS CB C -13.112 -2.327 -0.947 1.00 . A A . 12 CYS CB 1 1 19 13602 1 1 12 CYS H H -12.010 -2.706 -3.572 1.00 . A A . 12 CYS H 1 1 19 13603 1 1 12 CYS HA H -11.177 -3.229 -0.838 1.00 . A A . 12 CYS HA 1 1 19 13604 1 1 12 CYS HB2 H -12.728 -1.348 -0.711 1.00 . A A . 12 CYS HB2 1 1 19 13605 1 1 12 CYS HB3 H -13.907 -2.250 -1.671 1.00 . A A . 12 CYS HB3 1 1 19 13606 1 1 12 CYS HG H -14.632 -3.954 0.258 1.00 . A A . 12 CYS HG 1 1 19 13607 1 1 12 CYS N N -11.491 -2.561 -2.754 1.00 . A A . 12 CYS N 1 1 19 13608 1 1 12 CYS O O -13.380 -4.771 -2.652 1.00 . A A . 12 CYS O 1 1 19 13609 1 1 12 CYS SG S -13.797 -2.978 0.588 1.00 . A A . 12 CYS SG 1 1 19 13610 1 1 13 LYS C C -11.958 -7.560 0.070 1.00 . A A . 13 LYS C 1 1 19 13611 1 1 13 LYS CA C -12.217 -6.943 -1.270 1.00 . A A . 13 LYS CA 1 1 19 13612 1 1 13 LYS CB C -11.396 -7.721 -2.318 1.00 . A A . 13 LYS CB 1 1 19 13613 1 1 13 LYS CD C -10.843 -8.295 -4.676 1.00 . A A . 13 LYS CD 1 1 19 13614 1 1 13 LYS CE C -11.096 -8.036 -6.151 1.00 . A A . 13 LYS CE 1 1 19 13615 1 1 13 LYS CG C -11.587 -7.316 -3.769 1.00 . A A . 13 LYS CG 1 1 19 13616 1 1 13 LYS H H -11.096 -5.339 -0.609 1.00 . A A . 13 LYS H 1 1 19 13617 1 1 13 LYS HA H -13.269 -7.024 -1.506 1.00 . A A . 13 LYS HA 1 1 19 13618 1 1 13 LYS HB2 H -10.348 -7.622 -2.091 1.00 . A A . 13 LYS HB2 1 1 19 13619 1 1 13 LYS HB3 H -11.659 -8.765 -2.225 1.00 . A A . 13 LYS HB3 1 1 19 13620 1 1 13 LYS HD2 H -9.788 -8.184 -4.489 1.00 . A A . 13 LYS HD2 1 1 19 13621 1 1 13 LYS HD3 H -11.140 -9.302 -4.429 1.00 . A A . 13 LYS HD3 1 1 19 13622 1 1 13 LYS HE2 H -12.162 -8.029 -6.324 1.00 . A A . 13 LYS HE2 1 1 19 13623 1 1 13 LYS HE3 H -10.683 -7.073 -6.419 1.00 . A A . 13 LYS HE3 1 1 19 13624 1 1 13 LYS HG2 H -12.646 -7.345 -3.977 1.00 . A A . 13 LYS HG2 1 1 19 13625 1 1 13 LYS HG3 H -11.201 -6.317 -3.914 1.00 . A A . 13 LYS HG3 1 1 19 13626 1 1 13 LYS HZ1 H -9.437 -9.136 -6.883 1.00 . A A . 13 LYS HZ1 1 1 19 13627 1 1 13 LYS HZ2 H -10.672 -8.914 -8.010 1.00 . A A . 13 LYS HZ2 1 1 19 13628 1 1 13 LYS HZ3 H -10.888 -10.010 -6.789 1.00 . A A . 13 LYS HZ3 1 1 19 13629 1 1 13 LYS N N -11.848 -5.546 -1.200 1.00 . A A . 13 LYS N 1 1 19 13630 1 1 13 LYS NZ N -10.469 -9.080 -7.002 1.00 . A A . 13 LYS NZ 1 1 19 13631 1 1 13 LYS O O -11.406 -6.900 0.954 1.00 . A A . 13 LYS O 1 1 19 13632 1 1 14 ASP C C -10.590 -9.820 1.563 1.00 . A A . 14 ASP C 1 1 19 13633 1 1 14 ASP CA C -12.057 -9.515 1.458 1.00 . A A . 14 ASP CA 1 1 19 13634 1 1 14 ASP CB C -12.847 -10.824 1.561 1.00 . A A . 14 ASP CB 1 1 19 13635 1 1 14 ASP CG C -14.320 -10.629 1.775 1.00 . A A . 14 ASP CG 1 1 19 13636 1 1 14 ASP H H -12.856 -9.244 -0.473 1.00 . A A . 14 ASP H 1 1 19 13637 1 1 14 ASP HA H -12.343 -8.882 2.284 1.00 . A A . 14 ASP HA 1 1 19 13638 1 1 14 ASP HB2 H -12.700 -11.383 0.649 1.00 . A A . 14 ASP HB2 1 1 19 13639 1 1 14 ASP HB3 H -12.451 -11.400 2.384 1.00 . A A . 14 ASP HB3 1 1 19 13640 1 1 14 ASP N N -12.346 -8.804 0.237 1.00 . A A . 14 ASP N 1 1 19 13641 1 1 14 ASP O O -9.896 -9.316 2.442 1.00 . A A . 14 ASP O 1 1 19 13642 1 1 14 ASP OD1 O -14.728 -10.388 2.935 1.00 . A A . 14 ASP OD1 1 1 19 13643 1 1 14 ASP OD2 O -15.089 -10.754 0.821 1.00 . A A . 14 ASP OD2 1 1 19 13644 1 1 15 LYS C C -7.887 -10.059 -0.091 1.00 . A A . 15 LYS C 1 1 19 13645 1 1 15 LYS CA C -8.728 -11.056 0.709 1.00 . A A . 15 LYS CA 1 1 19 13646 1 1 15 LYS CB C -8.599 -12.459 0.084 1.00 . A A . 15 LYS CB 1 1 19 13647 1 1 15 LYS CD C -7.357 -13.645 1.905 1.00 . A A . 15 LYS CD 1 1 19 13648 1 1 15 LYS CE C -6.201 -14.567 2.253 1.00 . A A . 15 LYS CE 1 1 19 13649 1 1 15 LYS CG C -7.334 -13.236 0.436 1.00 . A A . 15 LYS CG 1 1 19 13650 1 1 15 LYS H H -10.665 -11.076 -0.002 1.00 . A A . 15 LYS H 1 1 19 13651 1 1 15 LYS HA H -8.408 -11.100 1.738 1.00 . A A . 15 LYS HA 1 1 19 13652 1 1 15 LYS HB2 H -9.439 -13.051 0.415 1.00 . A A . 15 LYS HB2 1 1 19 13653 1 1 15 LYS HB3 H -8.659 -12.364 -0.991 1.00 . A A . 15 LYS HB3 1 1 19 13654 1 1 15 LYS HD2 H -7.292 -12.764 2.524 1.00 . A A . 15 LYS HD2 1 1 19 13655 1 1 15 LYS HD3 H -8.287 -14.149 2.119 1.00 . A A . 15 LYS HD3 1 1 19 13656 1 1 15 LYS HE2 H -6.247 -15.442 1.622 1.00 . A A . 15 LYS HE2 1 1 19 13657 1 1 15 LYS HE3 H -5.275 -14.037 2.086 1.00 . A A . 15 LYS HE3 1 1 19 13658 1 1 15 LYS HG2 H -7.270 -14.132 -0.162 1.00 . A A . 15 LYS HG2 1 1 19 13659 1 1 15 LYS HG3 H -6.458 -12.626 0.266 1.00 . A A . 15 LYS HG3 1 1 19 13660 1 1 15 LYS HZ1 H -6.208 -14.174 4.307 1.00 . A A . 15 LYS HZ1 1 1 19 13661 1 1 15 LYS HZ2 H -5.509 -15.660 3.919 1.00 . A A . 15 LYS HZ2 1 1 19 13662 1 1 15 LYS HZ3 H -7.170 -15.463 3.869 1.00 . A A . 15 LYS HZ3 1 1 19 13663 1 1 15 LYS N N -10.110 -10.654 0.684 1.00 . A A . 15 LYS N 1 1 19 13664 1 1 15 LYS NZ N -6.264 -14.996 3.668 1.00 . A A . 15 LYS NZ 1 1 19 13665 1 1 15 LYS O O -7.816 -10.145 -1.323 1.00 . A A . 15 LYS O 1 1 19 13666 1 1 16 VAL C C -5.648 -7.306 1.047 1.00 . A A . 16 VAL C 1 1 19 13667 1 1 16 VAL CA C -6.438 -8.091 -0.018 1.00 . A A . 16 VAL CA 1 1 19 13668 1 1 16 VAL CB C -7.164 -7.116 -1.019 1.00 . A A . 16 VAL CB 1 1 19 13669 1 1 16 VAL CG1 C -8.254 -6.328 -0.344 1.00 . A A . 16 VAL CG1 1 1 19 13670 1 1 16 VAL CG2 C -6.157 -6.188 -1.672 1.00 . A A . 16 VAL CG2 1 1 19 13671 1 1 16 VAL H H -7.518 -8.977 1.556 1.00 . A A . 16 VAL H 1 1 19 13672 1 1 16 VAL HA H -5.705 -8.665 -0.565 1.00 . A A . 16 VAL HA 1 1 19 13673 1 1 16 VAL HB H -7.617 -7.720 -1.792 1.00 . A A . 16 VAL HB 1 1 19 13674 1 1 16 VAL HG11 H -8.677 -5.633 -1.056 1.00 . A A . 16 VAL HG11 1 1 19 13675 1 1 16 VAL HG12 H -7.789 -5.809 0.483 1.00 . A A . 16 VAL HG12 1 1 19 13676 1 1 16 VAL HG13 H -9.013 -7.007 0.013 1.00 . A A . 16 VAL HG13 1 1 19 13677 1 1 16 VAL HG21 H -5.690 -5.594 -0.902 1.00 . A A . 16 VAL HG21 1 1 19 13678 1 1 16 VAL HG22 H -6.657 -5.533 -2.368 1.00 . A A . 16 VAL HG22 1 1 19 13679 1 1 16 VAL HG23 H -5.406 -6.770 -2.183 1.00 . A A . 16 VAL HG23 1 1 19 13680 1 1 16 VAL N N -7.326 -9.076 0.598 1.00 . A A . 16 VAL N 1 1 19 13681 1 1 16 VAL O O -6.182 -6.471 1.766 1.00 . A A . 16 VAL O 1 1 19 13682 1 1 17 ASP C C -3.064 -5.621 1.724 1.00 . A A . 17 ASP C 1 1 19 13683 1 1 17 ASP CA C -3.451 -7.064 2.100 1.00 . A A . 17 ASP CA 1 1 19 13684 1 1 17 ASP CB C -2.201 -7.953 2.218 1.00 . A A . 17 ASP CB 1 1 19 13685 1 1 17 ASP CG C -2.530 -9.353 2.717 1.00 . A A . 17 ASP CG 1 1 19 13686 1 1 17 ASP H H -4.170 -8.452 0.643 1.00 . A A . 17 ASP H 1 1 19 13687 1 1 17 ASP HA H -3.932 -7.035 3.065 1.00 . A A . 17 ASP HA 1 1 19 13688 1 1 17 ASP HB2 H -1.744 -8.047 1.245 1.00 . A A . 17 ASP HB2 1 1 19 13689 1 1 17 ASP HB3 H -1.503 -7.500 2.907 1.00 . A A . 17 ASP HB3 1 1 19 13690 1 1 17 ASP N N -4.412 -7.669 1.166 1.00 . A A . 17 ASP N 1 1 19 13691 1 1 17 ASP O O -2.974 -5.255 0.529 1.00 . A A . 17 ASP O 1 1 19 13692 1 1 17 ASP OD1 O -2.934 -10.197 1.899 1.00 . A A . 17 ASP OD1 1 1 19 13693 1 1 17 ASP OD2 O -2.405 -9.607 3.945 1.00 . A A . 17 ASP OD2 1 1 19 13694 1 1 18 TRP C C -1.071 -3.183 3.212 1.00 . A A . 18 TRP C 1 1 19 13695 1 1 18 TRP CA C -2.489 -3.397 2.672 1.00 . A A . 18 TRP CA 1 1 19 13696 1 1 18 TRP CB C -3.467 -2.581 3.525 1.00 . A A . 18 TRP CB 1 1 19 13697 1 1 18 TRP CD1 C -5.682 -3.669 2.804 1.00 . A A . 18 TRP CD1 1 1 19 13698 1 1 18 TRP CD2 C -5.744 -1.445 2.909 1.00 . A A . 18 TRP CD2 1 1 19 13699 1 1 18 TRP CE2 C -7.019 -1.910 2.509 1.00 . A A . 18 TRP CE2 1 1 19 13700 1 1 18 TRP CE3 C -5.538 -0.073 3.054 1.00 . A A . 18 TRP CE3 1 1 19 13701 1 1 18 TRP CG C -4.905 -2.588 3.071 1.00 . A A . 18 TRP CG 1 1 19 13702 1 1 18 TRP CH2 C -7.853 0.302 2.415 1.00 . A A . 18 TRP CH2 1 1 19 13703 1 1 18 TRP CZ2 C -8.088 -1.045 2.258 1.00 . A A . 18 TRP CZ2 1 1 19 13704 1 1 18 TRP CZ3 C -6.588 0.784 2.813 1.00 . A A . 18 TRP CZ3 1 1 19 13705 1 1 18 TRP H H -2.846 -5.222 3.648 1.00 . A A . 18 TRP H 1 1 19 13706 1 1 18 TRP HA H -2.553 -3.074 1.646 1.00 . A A . 18 TRP HA 1 1 19 13707 1 1 18 TRP HB2 H -3.449 -2.970 4.534 1.00 . A A . 18 TRP HB2 1 1 19 13708 1 1 18 TRP HB3 H -3.130 -1.555 3.538 1.00 . A A . 18 TRP HB3 1 1 19 13709 1 1 18 TRP HD1 H -5.327 -4.689 2.844 1.00 . A A . 18 TRP HD1 1 1 19 13710 1 1 18 TRP HE1 H -7.642 -3.916 2.183 1.00 . A A . 18 TRP HE1 1 1 19 13711 1 1 18 TRP HE3 H -4.577 0.315 3.355 1.00 . A A . 18 TRP HE3 1 1 19 13712 1 1 18 TRP HH2 H -8.639 1.020 2.235 1.00 . A A . 18 TRP HH2 1 1 19 13713 1 1 18 TRP HZ2 H -9.067 -1.396 1.959 1.00 . A A . 18 TRP HZ2 1 1 19 13714 1 1 18 TRP HZ3 H -6.430 1.848 2.920 1.00 . A A . 18 TRP HZ3 1 1 19 13715 1 1 18 TRP N N -2.826 -4.824 2.752 1.00 . A A . 18 TRP N 1 1 19 13716 1 1 18 TRP NE1 N -6.939 -3.277 2.434 1.00 . A A . 18 TRP NE1 1 1 19 13717 1 1 18 TRP O O -0.559 -4.025 3.941 1.00 . A A . 18 TRP O 1 1 19 13718 1 1 19 VAL C C 0.986 -0.411 3.996 1.00 . A A . 19 VAL C 1 1 19 13719 1 1 19 VAL CA C 0.913 -1.782 3.318 1.00 . A A . 19 VAL CA 1 1 19 13720 1 1 19 VAL CB C 1.972 -1.836 2.153 1.00 . A A . 19 VAL CB 1 1 19 13721 1 1 19 VAL CG1 C 2.116 -3.237 1.592 1.00 . A A . 19 VAL CG1 1 1 19 13722 1 1 19 VAL CG2 C 1.614 -0.855 1.036 1.00 . A A . 19 VAL CG2 1 1 19 13723 1 1 19 VAL H H -0.798 -1.292 2.369 1.00 . A A . 19 VAL H 1 1 19 13724 1 1 19 VAL HA H 1.170 -2.531 4.051 1.00 . A A . 19 VAL HA 1 1 19 13725 1 1 19 VAL HB H 2.933 -1.549 2.558 1.00 . A A . 19 VAL HB 1 1 19 13726 1 1 19 VAL HG11 H 1.158 -3.602 1.254 1.00 . A A . 19 VAL HG11 1 1 19 13727 1 1 19 VAL HG12 H 2.527 -3.905 2.334 1.00 . A A . 19 VAL HG12 1 1 19 13728 1 1 19 VAL HG13 H 2.791 -3.182 0.751 1.00 . A A . 19 VAL HG13 1 1 19 13729 1 1 19 VAL HG21 H 0.652 -1.118 0.621 1.00 . A A . 19 VAL HG21 1 1 19 13730 1 1 19 VAL HG22 H 2.357 -0.904 0.257 1.00 . A A . 19 VAL HG22 1 1 19 13731 1 1 19 VAL HG23 H 1.565 0.151 1.429 1.00 . A A . 19 VAL HG23 1 1 19 13732 1 1 19 VAL N N -0.438 -2.062 2.867 1.00 . A A . 19 VAL N 1 1 19 13733 1 1 19 VAL O O 0.377 0.549 3.537 1.00 . A A . 19 VAL O 1 1 19 13734 1 1 20 GLN C C 3.379 1.303 5.515 1.00 . A A . 20 GLN C 1 1 19 13735 1 1 20 GLN CA C 1.940 0.899 5.787 1.00 . A A . 20 GLN CA 1 1 19 13736 1 1 20 GLN CB C 1.724 0.745 7.311 1.00 . A A . 20 GLN CB 1 1 19 13737 1 1 20 GLN CD C 1.842 1.877 9.609 1.00 . A A . 20 GLN CD 1 1 19 13738 1 1 20 GLN CG C 2.004 2.029 8.104 1.00 . A A . 20 GLN CG 1 1 19 13739 1 1 20 GLN H H 2.039 -1.195 5.438 1.00 . A A . 20 GLN H 1 1 19 13740 1 1 20 GLN HA H 1.273 1.656 5.399 1.00 . A A . 20 GLN HA 1 1 19 13741 1 1 20 GLN HB2 H 0.698 0.447 7.479 1.00 . A A . 20 GLN HB2 1 1 19 13742 1 1 20 GLN HB3 H 2.384 -0.035 7.669 1.00 . A A . 20 GLN HB3 1 1 19 13743 1 1 20 GLN HE21 H 3.243 3.233 9.898 1.00 . A A . 20 GLN HE21 1 1 19 13744 1 1 20 GLN HE22 H 2.588 2.597 11.328 1.00 . A A . 20 GLN HE22 1 1 19 13745 1 1 20 GLN HG2 H 3.015 2.342 7.898 1.00 . A A . 20 GLN HG2 1 1 19 13746 1 1 20 GLN HG3 H 1.335 2.810 7.767 1.00 . A A . 20 GLN HG3 1 1 19 13747 1 1 20 GLN N N 1.681 -0.354 5.089 1.00 . A A . 20 GLN N 1 1 19 13748 1 1 20 GLN NE2 N 2.621 2.631 10.354 1.00 . A A . 20 GLN NE2 1 1 19 13749 1 1 20 GLN O O 4.260 0.449 5.495 1.00 . A A . 20 GLN O 1 1 19 13750 1 1 20 GLN OE1 O 1.043 1.084 10.095 1.00 . A A . 20 GLN OE1 1 1 19 13751 1 1 21 CYS C C 5.588 3.335 6.443 1.00 . A A . 21 CYS C 1 1 19 13752 1 1 21 CYS CA C 4.992 2.986 5.083 1.00 . A A . 21 CYS CA 1 1 19 13753 1 1 21 CYS CB C 5.160 4.139 4.046 1.00 . A A . 21 CYS CB 1 1 19 13754 1 1 21 CYS H H 2.881 3.209 5.210 1.00 . A A . 21 CYS H 1 1 19 13755 1 1 21 CYS HA H 5.522 2.110 4.736 1.00 . A A . 21 CYS HA 1 1 19 13756 1 1 21 CYS HB2 H 6.190 4.362 3.829 1.00 . A A . 21 CYS HB2 1 1 19 13757 1 1 21 CYS HB3 H 4.688 3.836 3.126 1.00 . A A . 21 CYS HB3 1 1 19 13758 1 1 21 CYS N N 3.632 2.577 5.262 1.00 . A A . 21 CYS N 1 1 19 13759 1 1 21 CYS O O 5.292 4.394 7.038 1.00 . A A . 21 CYS O 1 1 19 13760 1 1 21 CYS SG S 4.456 5.729 4.484 1.00 . A A . 21 CYS SG 1 1 19 13761 1 1 22 ASP C C 8.294 3.530 8.190 1.00 . A A . 22 ASP C 1 1 19 13762 1 1 22 ASP CA C 7.069 2.623 8.250 1.00 . A A . 22 ASP CA 1 1 19 13763 1 1 22 ASP CB C 7.452 1.256 8.883 1.00 . A A . 22 ASP CB 1 1 19 13764 1 1 22 ASP CG C 6.268 0.440 9.422 1.00 . A A . 22 ASP CG 1 1 19 13765 1 1 22 ASP H H 6.662 1.707 6.333 1.00 . A A . 22 ASP H 1 1 19 13766 1 1 22 ASP HA H 6.342 3.107 8.888 1.00 . A A . 22 ASP HA 1 1 19 13767 1 1 22 ASP HB2 H 7.947 0.663 8.131 1.00 . A A . 22 ASP HB2 1 1 19 13768 1 1 22 ASP HB3 H 8.145 1.441 9.690 1.00 . A A . 22 ASP HB3 1 1 19 13769 1 1 22 ASP N N 6.440 2.467 6.923 1.00 . A A . 22 ASP N 1 1 19 13770 1 1 22 ASP O O 9.067 3.609 9.139 1.00 . A A . 22 ASP O 1 1 19 13771 1 1 22 ASP OD1 O 5.654 -0.333 8.660 1.00 . A A . 22 ASP OD1 1 1 19 13772 1 1 22 ASP OD2 O 5.975 0.561 10.642 1.00 . A A . 22 ASP OD2 1 1 19 13773 1 1 23 GLY C C 9.354 6.555 7.432 1.00 . A A . 23 GLY C 1 1 19 13774 1 1 23 GLY CA C 9.551 5.138 6.914 1.00 . A A . 23 GLY CA 1 1 19 13775 1 1 23 GLY H H 7.643 4.319 6.500 1.00 . A A . 23 GLY H 1 1 19 13776 1 1 23 GLY HA2 H 10.418 4.711 7.399 1.00 . A A . 23 GLY HA2 1 1 19 13777 1 1 23 GLY HA3 H 9.744 5.190 5.853 1.00 . A A . 23 GLY HA3 1 1 19 13778 1 1 23 GLY N N 8.403 4.300 7.112 1.00 . A A . 23 GLY N 1 1 19 13779 1 1 23 GLY O O 10.262 7.367 7.329 1.00 . A A . 23 GLY O 1 1 19 13780 1 1 24 GLY C C 6.543 8.730 8.426 1.00 . A A . 24 GLY C 1 1 19 13781 1 1 24 GLY CA C 7.975 8.199 8.485 1.00 . A A . 24 GLY CA 1 1 19 13782 1 1 24 GLY H H 7.460 6.194 8.034 1.00 . A A . 24 GLY H 1 1 19 13783 1 1 24 GLY HA2 H 8.284 8.217 9.520 1.00 . A A . 24 GLY HA2 1 1 19 13784 1 1 24 GLY HA3 H 8.606 8.879 7.931 1.00 . A A . 24 GLY HA3 1 1 19 13785 1 1 24 GLY N N 8.172 6.864 7.970 1.00 . A A . 24 GLY N 1 1 19 13786 1 1 24 GLY O O 6.164 9.512 9.284 1.00 . A A . 24 GLY O 1 1 19 13787 1 1 25 CYS C C 3.389 8.138 8.186 1.00 . A A . 25 CYS C 1 1 19 13788 1 1 25 CYS CA C 4.376 8.915 7.317 1.00 . A A . 25 CYS CA 1 1 19 13789 1 1 25 CYS CB C 3.859 8.887 5.864 1.00 . A A . 25 CYS CB 1 1 19 13790 1 1 25 CYS H H 6.056 7.650 6.799 1.00 . A A . 25 CYS H 1 1 19 13791 1 1 25 CYS HA H 4.423 9.937 7.666 1.00 . A A . 25 CYS HA 1 1 19 13792 1 1 25 CYS HB2 H 3.520 7.891 5.619 1.00 . A A . 25 CYS HB2 1 1 19 13793 1 1 25 CYS HB3 H 3.019 9.565 5.802 1.00 . A A . 25 CYS HB3 1 1 19 13794 1 1 25 CYS N N 5.740 8.322 7.432 1.00 . A A . 25 CYS N 1 1 19 13795 1 1 25 CYS O O 2.400 8.686 8.672 1.00 . A A . 25 CYS O 1 1 19 13796 1 1 25 CYS SG S 5.060 9.368 4.604 1.00 . A A . 25 CYS SG 1 1 19 13797 1 1 26 ASP C C 1.468 5.721 8.468 1.00 . A A . 26 ASP C 1 1 19 13798 1 1 26 ASP CA C 2.854 5.875 9.101 1.00 . A A . 26 ASP CA 1 1 19 13799 1 1 26 ASP CB C 2.734 6.226 10.614 1.00 . A A . 26 ASP CB 1 1 19 13800 1 1 26 ASP CG C 4.065 6.174 11.349 1.00 . A A . 26 ASP CG 1 1 19 13801 1 1 26 ASP H H 4.570 6.559 8.045 1.00 . A A . 26 ASP H 1 1 19 13802 1 1 26 ASP HA H 3.358 4.923 9.012 1.00 . A A . 26 ASP HA 1 1 19 13803 1 1 26 ASP HB2 H 2.288 7.202 10.735 1.00 . A A . 26 ASP HB2 1 1 19 13804 1 1 26 ASP HB3 H 2.071 5.496 11.056 1.00 . A A . 26 ASP HB3 1 1 19 13805 1 1 26 ASP N N 3.695 6.844 8.369 1.00 . A A . 26 ASP N 1 1 19 13806 1 1 26 ASP O O 0.524 5.250 9.119 1.00 . A A . 26 ASP O 1 1 19 13807 1 1 26 ASP OD1 O 4.493 5.063 11.718 1.00 . A A . 26 ASP OD1 1 1 19 13808 1 1 26 ASP OD2 O 4.697 7.236 11.562 1.00 . A A . 26 ASP OD2 1 1 19 13809 1 1 27 GLU C C -0.073 4.643 5.731 1.00 . A A . 27 GLU C 1 1 19 13810 1 1 27 GLU CA C 0.095 5.986 6.480 1.00 . A A . 27 GLU CA 1 1 19 13811 1 1 27 GLU CB C -0.108 7.210 5.570 1.00 . A A . 27 GLU CB 1 1 19 13812 1 1 27 GLU CD C -0.577 9.712 5.559 1.00 . A A . 27 GLU CD 1 1 19 13813 1 1 27 GLU CG C -0.179 8.503 6.366 1.00 . A A . 27 GLU CG 1 1 19 13814 1 1 27 GLU H H 2.148 6.373 6.706 1.00 . A A . 27 GLU H 1 1 19 13815 1 1 27 GLU HA H -0.663 6.000 7.248 1.00 . A A . 27 GLU HA 1 1 19 13816 1 1 27 GLU HB2 H 0.745 7.275 4.910 1.00 . A A . 27 GLU HB2 1 1 19 13817 1 1 27 GLU HB3 H -0.997 7.112 4.969 1.00 . A A . 27 GLU HB3 1 1 19 13818 1 1 27 GLU HG2 H -0.898 8.382 7.160 1.00 . A A . 27 GLU HG2 1 1 19 13819 1 1 27 GLU HG3 H 0.791 8.673 6.801 1.00 . A A . 27 GLU HG3 1 1 19 13820 1 1 27 GLU N N 1.357 6.063 7.186 1.00 . A A . 27 GLU N 1 1 19 13821 1 1 27 GLU O O 0.892 3.890 5.550 1.00 . A A . 27 GLU O 1 1 19 13822 1 1 27 GLU OE1 O -1.807 9.933 5.413 1.00 . A A . 27 GLU OE1 1 1 19 13823 1 1 27 GLU OE2 O 0.311 10.465 5.099 1.00 . A A . 27 GLU OE2 1 1 19 13824 1 1 28 TRP C C -1.926 3.234 3.181 1.00 . A A . 28 TRP C 1 1 19 13825 1 1 28 TRP CA C -1.652 3.082 4.659 1.00 . A A . 28 TRP CA 1 1 19 13826 1 1 28 TRP CB C -2.832 2.412 5.355 1.00 . A A . 28 TRP CB 1 1 19 13827 1 1 28 TRP CD1 C -2.468 2.719 7.870 1.00 . A A . 28 TRP CD1 1 1 19 13828 1 1 28 TRP CD2 C -2.188 0.625 7.139 1.00 . A A . 28 TRP CD2 1 1 19 13829 1 1 28 TRP CE2 C -1.955 0.645 8.517 1.00 . A A . 28 TRP CE2 1 1 19 13830 1 1 28 TRP CE3 C -2.074 -0.592 6.454 1.00 . A A . 28 TRP CE3 1 1 19 13831 1 1 28 TRP CG C -2.511 1.959 6.739 1.00 . A A . 28 TRP CG 1 1 19 13832 1 1 28 TRP CH2 C -1.509 -1.682 8.538 1.00 . A A . 28 TRP CH2 1 1 19 13833 1 1 28 TRP CZ2 C -1.610 -0.507 9.234 1.00 . A A . 28 TRP CZ2 1 1 19 13834 1 1 28 TRP CZ3 C -1.737 -1.729 7.161 1.00 . A A . 28 TRP CZ3 1 1 19 13835 1 1 28 TRP H H -1.970 5.072 5.405 1.00 . A A . 28 TRP H 1 1 19 13836 1 1 28 TRP HA H -0.787 2.444 4.758 1.00 . A A . 28 TRP HA 1 1 19 13837 1 1 28 TRP HB2 H -3.670 3.094 5.403 1.00 . A A . 28 TRP HB2 1 1 19 13838 1 1 28 TRP HB3 H -3.133 1.555 4.772 1.00 . A A . 28 TRP HB3 1 1 19 13839 1 1 28 TRP HD1 H -2.669 3.780 7.893 1.00 . A A . 28 TRP HD1 1 1 19 13840 1 1 28 TRP HE1 H -2.025 2.242 9.867 1.00 . A A . 28 TRP HE1 1 1 19 13841 1 1 28 TRP HE3 H -2.245 -0.650 5.390 1.00 . A A . 28 TRP HE3 1 1 19 13842 1 1 28 TRP HH2 H -1.250 -2.591 9.065 1.00 . A A . 28 TRP HH2 1 1 19 13843 1 1 28 TRP HZ2 H -1.427 -0.495 10.298 1.00 . A A . 28 TRP HZ2 1 1 19 13844 1 1 28 TRP HZ3 H -1.648 -2.673 6.640 1.00 . A A . 28 TRP HZ3 1 1 19 13845 1 1 28 TRP N N -1.302 4.363 5.305 1.00 . A A . 28 TRP N 1 1 19 13846 1 1 28 TRP NE1 N -2.127 1.933 8.942 1.00 . A A . 28 TRP NE1 1 1 19 13847 1 1 28 TRP O O -2.684 4.116 2.759 1.00 . A A . 28 TRP O 1 1 19 13848 1 1 29 PHE C C -1.879 1.005 0.466 1.00 . A A . 29 PHE C 1 1 19 13849 1 1 29 PHE CA C -1.367 2.381 0.966 1.00 . A A . 29 PHE CA 1 1 19 13850 1 1 29 PHE CB C 0.065 2.604 0.386 1.00 . A A . 29 PHE CB 1 1 19 13851 1 1 29 PHE CD1 C 1.297 3.748 2.251 1.00 . A A . 29 PHE CD1 1 1 19 13852 1 1 29 PHE CD2 C 1.085 4.925 0.203 1.00 . A A . 29 PHE CD2 1 1 19 13853 1 1 29 PHE CE1 C 1.985 4.790 2.779 1.00 . A A . 29 PHE CE1 1 1 19 13854 1 1 29 PHE CE2 C 1.784 5.984 0.737 1.00 . A A . 29 PHE CE2 1 1 19 13855 1 1 29 PHE CG C 0.836 3.786 0.956 1.00 . A A . 29 PHE CG 1 1 19 13856 1 1 29 PHE CZ C 2.228 5.913 2.035 1.00 . A A . 29 PHE CZ 1 1 19 13857 1 1 29 PHE H H -0.701 1.716 2.851 1.00 . A A . 29 PHE H 1 1 19 13858 1 1 29 PHE HA H -2.009 3.181 0.626 1.00 . A A . 29 PHE HA 1 1 19 13859 1 1 29 PHE HB2 H 0.666 1.730 0.571 1.00 . A A . 29 PHE HB2 1 1 19 13860 1 1 29 PHE HB3 H -0.017 2.744 -0.681 1.00 . A A . 29 PHE HB3 1 1 19 13861 1 1 29 PHE HD1 H 1.101 2.867 2.845 1.00 . A A . 29 PHE HD1 1 1 19 13862 1 1 29 PHE HD2 H 0.730 4.995 -0.815 1.00 . A A . 29 PHE HD2 1 1 19 13863 1 1 29 PHE HE1 H 2.338 4.737 3.800 1.00 . A A . 29 PHE HE1 1 1 19 13864 1 1 29 PHE HE2 H 1.972 6.866 0.145 1.00 . A A . 29 PHE HE2 1 1 19 13865 1 1 29 PHE HZ H 2.773 6.718 2.502 1.00 . A A . 29 PHE HZ 1 1 19 13866 1 1 29 PHE N N -1.294 2.373 2.414 1.00 . A A . 29 PHE N 1 1 19 13867 1 1 29 PHE O O -1.718 -0.020 1.142 1.00 . A A . 29 PHE O 1 1 19 13868 1 1 30 HIS C C -1.809 -0.704 -2.262 1.00 . A A . 30 HIS C 1 1 19 13869 1 1 30 HIS CA C -2.911 -0.264 -1.365 1.00 . A A . 30 HIS CA 1 1 19 13870 1 1 30 HIS CB C -4.149 -0.091 -2.254 1.00 . A A . 30 HIS CB 1 1 19 13871 1 1 30 HIS CD2 C -6.340 -0.856 -1.150 1.00 . A A . 30 HIS CD2 1 1 19 13872 1 1 30 HIS CE1 C -7.287 1.112 -0.965 1.00 . A A . 30 HIS CE1 1 1 19 13873 1 1 30 HIS CG C -5.457 0.066 -1.599 1.00 . A A . 30 HIS CG 1 1 19 13874 1 1 30 HIS H H -2.648 1.874 -1.109 1.00 . A A . 30 HIS H 1 1 19 13875 1 1 30 HIS HA H -3.100 -1.015 -0.614 1.00 . A A . 30 HIS HA 1 1 19 13876 1 1 30 HIS HB2 H -3.988 0.873 -2.719 1.00 . A A . 30 HIS HB2 1 1 19 13877 1 1 30 HIS HB3 H -4.223 -0.803 -3.064 1.00 . A A . 30 HIS HB3 1 1 19 13878 1 1 30 HIS HD2 H -6.174 -1.923 -1.112 1.00 . A A . 30 HIS HD2 1 1 19 13879 1 1 30 HIS HE1 H -8.003 1.897 -0.762 1.00 . A A . 30 HIS HE1 1 1 19 13880 1 1 30 HIS HE2 H -8.369 -0.608 -0.752 1.00 . A A . 30 HIS HE2 1 1 19 13881 1 1 30 HIS N N -2.502 0.995 -0.701 1.00 . A A . 30 HIS N 1 1 19 13882 1 1 30 HIS ND1 N -6.067 1.286 -1.469 1.00 . A A . 30 HIS ND1 1 1 19 13883 1 1 30 HIS NE2 N -7.474 -0.183 -0.765 1.00 . A A . 30 HIS NE2 1 1 19 13884 1 1 30 HIS O O -1.262 0.108 -2.983 1.00 . A A . 30 HIS O 1 1 19 13885 1 1 31 GLN C C -0.674 -2.212 -4.584 1.00 . A A . 31 GLN C 1 1 19 13886 1 1 31 GLN CA C -0.475 -2.541 -3.104 1.00 . A A . 31 GLN CA 1 1 19 13887 1 1 31 GLN CB C -0.308 -4.033 -2.880 1.00 . A A . 31 GLN CB 1 1 19 13888 1 1 31 GLN CD C 0.376 -5.864 -1.306 1.00 . A A . 31 GLN CD 1 1 19 13889 1 1 31 GLN CG C 0.264 -4.377 -1.520 1.00 . A A . 31 GLN CG 1 1 19 13890 1 1 31 GLN H H -2.037 -2.546 -1.644 1.00 . A A . 31 GLN H 1 1 19 13891 1 1 31 GLN HA H 0.429 -2.046 -2.784 1.00 . A A . 31 GLN HA 1 1 19 13892 1 1 31 GLN HB2 H -1.271 -4.511 -2.977 1.00 . A A . 31 GLN HB2 1 1 19 13893 1 1 31 GLN HB3 H 0.364 -4.432 -3.629 1.00 . A A . 31 GLN HB3 1 1 19 13894 1 1 31 GLN HE21 H -1.394 -5.913 -0.435 1.00 . A A . 31 GLN HE21 1 1 19 13895 1 1 31 GLN HE22 H -0.570 -7.420 -0.571 1.00 . A A . 31 GLN HE22 1 1 19 13896 1 1 31 GLN HG2 H 1.253 -3.946 -1.460 1.00 . A A . 31 GLN HG2 1 1 19 13897 1 1 31 GLN HG3 H -0.357 -3.951 -0.752 1.00 . A A . 31 GLN HG3 1 1 19 13898 1 1 31 GLN N N -1.527 -1.979 -2.256 1.00 . A A . 31 GLN N 1 1 19 13899 1 1 31 GLN NE2 N -0.626 -6.455 -0.717 1.00 . A A . 31 GLN NE2 1 1 19 13900 1 1 31 GLN O O 0.224 -1.779 -5.232 1.00 . A A . 31 GLN O 1 1 19 13901 1 1 31 GLN OE1 O 1.371 -6.461 -1.644 1.00 . A A . 31 GLN OE1 1 1 19 13902 1 1 32 VAL C C -2.093 -0.511 -6.745 1.00 . A A . 32 VAL C 1 1 19 13903 1 1 32 VAL CA C -2.116 -2.050 -6.484 1.00 . A A . 32 VAL CA 1 1 19 13904 1 1 32 VAL CB C -3.467 -2.645 -6.966 1.00 . A A . 32 VAL CB 1 1 19 13905 1 1 32 VAL CG1 C -4.599 -2.065 -6.172 1.00 . A A . 32 VAL CG1 1 1 19 13906 1 1 32 VAL CG2 C -3.678 -2.364 -8.431 1.00 . A A . 32 VAL CG2 1 1 19 13907 1 1 32 VAL H H -2.605 -2.696 -4.532 1.00 . A A . 32 VAL H 1 1 19 13908 1 1 32 VAL HA H -1.325 -2.500 -7.061 1.00 . A A . 32 VAL HA 1 1 19 13909 1 1 32 VAL HB H -3.447 -3.715 -6.821 1.00 . A A . 32 VAL HB 1 1 19 13910 1 1 32 VAL HG11 H -4.517 -0.997 -6.327 1.00 . A A . 32 VAL HG11 1 1 19 13911 1 1 32 VAL HG12 H -4.450 -2.297 -5.130 1.00 . A A . 32 VAL HG12 1 1 19 13912 1 1 32 VAL HG13 H -5.550 -2.419 -6.540 1.00 . A A . 32 VAL HG13 1 1 19 13913 1 1 32 VAL HG21 H -4.645 -2.719 -8.756 1.00 . A A . 32 VAL HG21 1 1 19 13914 1 1 32 VAL HG22 H -2.888 -2.816 -9.011 1.00 . A A . 32 VAL HG22 1 1 19 13915 1 1 32 VAL HG23 H -3.630 -1.287 -8.523 1.00 . A A . 32 VAL HG23 1 1 19 13916 1 1 32 VAL N N -1.870 -2.363 -5.086 1.00 . A A . 32 VAL N 1 1 19 13917 1 1 32 VAL O O -1.543 -0.044 -7.731 1.00 . A A . 32 VAL O 1 1 19 13918 1 1 33 CYS C C -1.500 2.423 -5.892 1.00 . A A . 33 CYS C 1 1 19 13919 1 1 33 CYS CA C -2.840 1.674 -6.019 1.00 . A A . 33 CYS CA 1 1 19 13920 1 1 33 CYS CB C -3.937 2.266 -5.078 1.00 . A A . 33 CYS CB 1 1 19 13921 1 1 33 CYS H H -2.960 -0.278 -5.058 1.00 . A A . 33 CYS H 1 1 19 13922 1 1 33 CYS HA H -3.162 1.813 -7.042 1.00 . A A . 33 CYS HA 1 1 19 13923 1 1 33 CYS HB2 H -4.359 3.135 -5.536 1.00 . A A . 33 CYS HB2 1 1 19 13924 1 1 33 CYS HB3 H -4.738 1.545 -5.009 1.00 . A A . 33 CYS HB3 1 1 19 13925 1 1 33 CYS N N -2.671 0.247 -5.825 1.00 . A A . 33 CYS N 1 1 19 13926 1 1 33 CYS O O -1.282 3.423 -6.564 1.00 . A A . 33 CYS O 1 1 19 13927 1 1 33 CYS SG S -3.420 2.689 -3.404 1.00 . A A . 33 CYS SG 1 1 19 13928 1 1 34 VAL C C 1.777 1.767 -5.625 1.00 . A A . 34 VAL C 1 1 19 13929 1 1 34 VAL CA C 0.673 2.567 -4.877 1.00 . A A . 34 VAL CA 1 1 19 13930 1 1 34 VAL CB C 1.033 2.670 -3.383 1.00 . A A . 34 VAL CB 1 1 19 13931 1 1 34 VAL CG1 C 1.625 1.401 -2.824 1.00 . A A . 34 VAL CG1 1 1 19 13932 1 1 34 VAL CG2 C 1.840 3.888 -3.110 1.00 . A A . 34 VAL CG2 1 1 19 13933 1 1 34 VAL H H -0.744 1.155 -4.457 1.00 . A A . 34 VAL H 1 1 19 13934 1 1 34 VAL HA H 0.611 3.561 -5.292 1.00 . A A . 34 VAL HA 1 1 19 13935 1 1 34 VAL HB H 0.140 2.726 -2.787 1.00 . A A . 34 VAL HB 1 1 19 13936 1 1 34 VAL HG11 H 2.539 1.221 -3.369 1.00 . A A . 34 VAL HG11 1 1 19 13937 1 1 34 VAL HG12 H 0.959 0.561 -2.981 1.00 . A A . 34 VAL HG12 1 1 19 13938 1 1 34 VAL HG13 H 1.859 1.520 -1.776 1.00 . A A . 34 VAL HG13 1 1 19 13939 1 1 34 VAL HG21 H 1.223 4.735 -3.368 1.00 . A A . 34 VAL HG21 1 1 19 13940 1 1 34 VAL HG22 H 2.718 3.864 -3.730 1.00 . A A . 34 VAL HG22 1 1 19 13941 1 1 34 VAL HG23 H 2.091 3.916 -2.061 1.00 . A A . 34 VAL HG23 1 1 19 13942 1 1 34 VAL N N -0.595 1.928 -5.042 1.00 . A A . 34 VAL N 1 1 19 13943 1 1 34 VAL O O 2.962 2.101 -5.563 1.00 . A A . 34 VAL O 1 1 19 13944 1 1 35 GLY C C 3.290 -0.868 -6.193 1.00 . A A . 35 GLY C 1 1 19 13945 1 1 35 GLY CA C 2.284 -0.107 -7.082 1.00 . A A . 35 GLY CA 1 1 19 13946 1 1 35 GLY H H 0.374 0.738 -6.498 1.00 . A A . 35 GLY H 1 1 19 13947 1 1 35 GLY HA2 H 1.712 -0.837 -7.635 1.00 . A A . 35 GLY HA2 1 1 19 13948 1 1 35 GLY HA3 H 2.831 0.507 -7.786 1.00 . A A . 35 GLY HA3 1 1 19 13949 1 1 35 GLY N N 1.350 0.768 -6.369 1.00 . A A . 35 GLY N 1 1 19 13950 1 1 35 GLY O O 4.479 -0.529 -6.149 1.00 . A A . 35 GLY O 1 1 19 13951 1 1 36 VAL C C 3.221 -4.184 -5.145 1.00 . A A . 36 VAL C 1 1 19 13952 1 1 36 VAL CA C 3.588 -2.788 -4.696 1.00 . A A . 36 VAL CA 1 1 19 13953 1 1 36 VAL CB C 3.210 -2.676 -3.181 1.00 . A A . 36 VAL CB 1 1 19 13954 1 1 36 VAL CG1 C 3.857 -3.788 -2.337 1.00 . A A . 36 VAL CG1 1 1 19 13955 1 1 36 VAL CG2 C 3.552 -1.315 -2.626 1.00 . A A . 36 VAL CG2 1 1 19 13956 1 1 36 VAL H H 1.846 -2.101 -5.455 1.00 . A A . 36 VAL H 1 1 19 13957 1 1 36 VAL HA H 4.643 -2.596 -4.831 1.00 . A A . 36 VAL HA 1 1 19 13958 1 1 36 VAL HB H 2.139 -2.805 -3.129 1.00 . A A . 36 VAL HB 1 1 19 13959 1 1 36 VAL HG11 H 4.935 -3.803 -2.431 1.00 . A A . 36 VAL HG11 1 1 19 13960 1 1 36 VAL HG12 H 3.484 -4.736 -2.699 1.00 . A A . 36 VAL HG12 1 1 19 13961 1 1 36 VAL HG13 H 3.567 -3.666 -1.304 1.00 . A A . 36 VAL HG13 1 1 19 13962 1 1 36 VAL HG21 H 3.303 -1.284 -1.578 1.00 . A A . 36 VAL HG21 1 1 19 13963 1 1 36 VAL HG22 H 2.957 -0.569 -3.139 1.00 . A A . 36 VAL HG22 1 1 19 13964 1 1 36 VAL HG23 H 4.602 -1.095 -2.761 1.00 . A A . 36 VAL HG23 1 1 19 13965 1 1 36 VAL N N 2.805 -1.873 -5.498 1.00 . A A . 36 VAL N 1 1 19 13966 1 1 36 VAL O O 2.067 -4.426 -5.497 1.00 . A A . 36 VAL O 1 1 19 13967 1 1 37 SER C C 3.552 -7.203 -4.165 1.00 . A A . 37 SER C 1 1 19 13968 1 1 37 SER CA C 3.867 -6.453 -5.470 1.00 . A A . 37 SER CA 1 1 19 13969 1 1 37 SER CB C 5.072 -7.044 -6.192 1.00 . A A . 37 SER CB 1 1 19 13970 1 1 37 SER H H 5.103 -5.019 -4.902 1.00 . A A . 37 SER H 1 1 19 13971 1 1 37 SER HA H 2.998 -6.493 -6.110 1.00 . A A . 37 SER HA 1 1 19 13972 1 1 37 SER HB2 H 4.905 -8.100 -6.337 1.00 . A A . 37 SER HB2 1 1 19 13973 1 1 37 SER HB3 H 5.169 -6.565 -7.154 1.00 . A A . 37 SER HB3 1 1 19 13974 1 1 37 SER HG H 6.985 -6.678 -6.073 1.00 . A A . 37 SER HG 1 1 19 13975 1 1 37 SER N N 4.157 -5.096 -5.145 1.00 . A A . 37 SER N 1 1 19 13976 1 1 37 SER O O 4.124 -6.877 -3.126 1.00 . A A . 37 SER O 1 1 19 13977 1 1 37 SER OG O 6.271 -6.836 -5.443 1.00 . A A . 37 SER OG 1 1 19 13978 1 1 38 PRO C C 3.326 -9.440 -2.111 1.00 . A A . 38 PRO C 1 1 19 13979 1 1 38 PRO CA C 2.188 -8.932 -2.998 1.00 . A A . 38 PRO CA 1 1 19 13980 1 1 38 PRO CB C 1.362 -10.102 -3.561 1.00 . A A . 38 PRO CB 1 1 19 13981 1 1 38 PRO CD C 2.033 -8.746 -5.412 1.00 . A A . 38 PRO CD 1 1 19 13982 1 1 38 PRO CG C 1.709 -10.155 -5.010 1.00 . A A . 38 PRO CG 1 1 19 13983 1 1 38 PRO HA H 1.556 -8.305 -2.387 1.00 . A A . 38 PRO HA 1 1 19 13984 1 1 38 PRO HB2 H 1.636 -11.015 -3.050 1.00 . A A . 38 PRO HB2 1 1 19 13985 1 1 38 PRO HB3 H 0.310 -9.907 -3.417 1.00 . A A . 38 PRO HB3 1 1 19 13986 1 1 38 PRO HD2 H 2.716 -8.722 -6.252 1.00 . A A . 38 PRO HD2 1 1 19 13987 1 1 38 PRO HD3 H 1.129 -8.205 -5.650 1.00 . A A . 38 PRO HD3 1 1 19 13988 1 1 38 PRO HG2 H 2.583 -10.778 -5.117 1.00 . A A . 38 PRO HG2 1 1 19 13989 1 1 38 PRO HG3 H 0.869 -10.532 -5.575 1.00 . A A . 38 PRO HG3 1 1 19 13990 1 1 38 PRO N N 2.656 -8.215 -4.202 1.00 . A A . 38 PRO N 1 1 19 13991 1 1 38 PRO O O 3.262 -9.362 -0.893 1.00 . A A . 38 PRO O 1 1 19 13992 1 1 39 GLU C C 6.383 -9.426 -1.417 1.00 . A A . 39 GLU C 1 1 19 13993 1 1 39 GLU CA C 5.488 -10.467 -2.068 1.00 . A A . 39 GLU CA 1 1 19 13994 1 1 39 GLU CB C 6.230 -11.332 -3.019 1.00 . A A . 39 GLU CB 1 1 19 13995 1 1 39 GLU CD C 6.078 -13.424 -4.405 1.00 . A A . 39 GLU CD 1 1 19 13996 1 1 39 GLU CG C 5.368 -12.483 -3.501 1.00 . A A . 39 GLU CG 1 1 19 13997 1 1 39 GLU H H 4.436 -9.941 -3.711 1.00 . A A . 39 GLU H 1 1 19 13998 1 1 39 GLU HA H 5.115 -11.109 -1.282 1.00 . A A . 39 GLU HA 1 1 19 13999 1 1 39 GLU HB2 H 6.557 -10.735 -3.859 1.00 . A A . 39 GLU HB2 1 1 19 14000 1 1 39 GLU HB3 H 7.089 -11.711 -2.505 1.00 . A A . 39 GLU HB3 1 1 19 14001 1 1 39 GLU HG2 H 5.009 -13.037 -2.646 1.00 . A A . 39 GLU HG2 1 1 19 14002 1 1 39 GLU HG3 H 4.528 -12.054 -4.029 1.00 . A A . 39 GLU HG3 1 1 19 14003 1 1 39 GLU N N 4.366 -9.922 -2.739 1.00 . A A . 39 GLU N 1 1 19 14004 1 1 39 GLU O O 7.079 -9.725 -0.451 1.00 . A A . 39 GLU O 1 1 19 14005 1 1 39 GLU OE1 O 6.246 -13.100 -5.592 1.00 . A A . 39 GLU OE1 1 1 19 14006 1 1 39 GLU OE2 O 6.441 -14.526 -3.948 1.00 . A A . 39 GLU OE2 1 1 19 14007 1 1 40 MET C C 6.630 -6.814 0.000 1.00 . A A . 40 MET C 1 1 19 14008 1 1 40 MET CA C 7.181 -7.154 -1.371 1.00 . A A . 40 MET CA 1 1 19 14009 1 1 40 MET CB C 7.195 -5.893 -2.269 1.00 . A A . 40 MET CB 1 1 19 14010 1 1 40 MET CE C 6.989 -2.797 -3.220 1.00 . A A . 40 MET CE 1 1 19 14011 1 1 40 MET CG C 8.251 -4.884 -1.844 1.00 . A A . 40 MET CG 1 1 19 14012 1 1 40 MET H H 5.765 -8.045 -2.683 1.00 . A A . 40 MET H 1 1 19 14013 1 1 40 MET HA H 8.184 -7.535 -1.250 1.00 . A A . 40 MET HA 1 1 19 14014 1 1 40 MET HB2 H 7.168 -6.053 -3.332 1.00 . A A . 40 MET HB2 1 1 19 14015 1 1 40 MET HB3 H 6.248 -5.413 -2.064 1.00 . A A . 40 MET HB3 1 1 19 14016 1 1 40 MET HE1 H 6.343 -3.521 -3.694 1.00 . A A . 40 MET HE1 1 1 19 14017 1 1 40 MET HE2 H 7.064 -1.925 -3.853 1.00 . A A . 40 MET HE2 1 1 19 14018 1 1 40 MET HE3 H 6.601 -2.526 -2.251 1.00 . A A . 40 MET HE3 1 1 19 14019 1 1 40 MET HG2 H 7.907 -4.455 -0.911 1.00 . A A . 40 MET HG2 1 1 19 14020 1 1 40 MET HG3 H 9.168 -5.428 -1.673 1.00 . A A . 40 MET HG3 1 1 19 14021 1 1 40 MET N N 6.363 -8.214 -1.932 1.00 . A A . 40 MET N 1 1 19 14022 1 1 40 MET O O 7.371 -6.562 0.924 1.00 . A A . 40 MET O 1 1 19 14023 1 1 40 MET SD S 8.575 -3.547 -3.042 1.00 . A A . 40 MET SD 1 1 19 14024 1 1 41 ALA C C 5.014 -7.529 2.495 1.00 . A A . 41 ALA C 1 1 19 14025 1 1 41 ALA CA C 4.589 -6.586 1.338 1.00 . A A . 41 ALA CA 1 1 19 14026 1 1 41 ALA CB C 3.081 -6.704 1.077 1.00 . A A . 41 ALA CB 1 1 19 14027 1 1 41 ALA H H 4.775 -7.083 -0.687 1.00 . A A . 41 ALA H 1 1 19 14028 1 1 41 ALA HA H 4.795 -5.567 1.635 1.00 . A A . 41 ALA HA 1 1 19 14029 1 1 41 ALA HB1 H 2.509 -6.459 1.960 1.00 . A A . 41 ALA HB1 1 1 19 14030 1 1 41 ALA HB2 H 2.834 -7.704 0.757 1.00 . A A . 41 ALA HB2 1 1 19 14031 1 1 41 ALA HB3 H 2.781 -6.039 0.278 1.00 . A A . 41 ALA HB3 1 1 19 14032 1 1 41 ALA N N 5.308 -6.865 0.108 1.00 . A A . 41 ALA N 1 1 19 14033 1 1 41 ALA O O 5.132 -7.098 3.633 1.00 . A A . 41 ALA O 1 1 19 14034 1 1 42 GLU C C 7.089 -9.889 3.492 1.00 . A A . 42 GLU C 1 1 19 14035 1 1 42 GLU CA C 5.593 -9.782 3.232 1.00 . A A . 42 GLU CA 1 1 19 14036 1 1 42 GLU CB C 5.052 -11.175 2.921 1.00 . A A . 42 GLU CB 1 1 19 14037 1 1 42 GLU CD C 3.104 -12.703 2.628 1.00 . A A . 42 GLU CD 1 1 19 14038 1 1 42 GLU CG C 3.541 -11.283 2.880 1.00 . A A . 42 GLU CG 1 1 19 14039 1 1 42 GLU H H 5.104 -9.021 1.246 1.00 . A A . 42 GLU H 1 1 19 14040 1 1 42 GLU HA H 5.125 -9.452 4.149 1.00 . A A . 42 GLU HA 1 1 19 14041 1 1 42 GLU HB2 H 5.435 -11.487 1.959 1.00 . A A . 42 GLU HB2 1 1 19 14042 1 1 42 GLU HB3 H 5.427 -11.861 3.669 1.00 . A A . 42 GLU HB3 1 1 19 14043 1 1 42 GLU HG2 H 3.134 -10.950 3.822 1.00 . A A . 42 GLU HG2 1 1 19 14044 1 1 42 GLU HG3 H 3.169 -10.656 2.085 1.00 . A A . 42 GLU HG3 1 1 19 14045 1 1 42 GLU N N 5.231 -8.804 2.191 1.00 . A A . 42 GLU N 1 1 19 14046 1 1 42 GLU O O 7.501 -10.334 4.571 1.00 . A A . 42 GLU O 1 1 19 14047 1 1 42 GLU OE1 O 3.072 -13.115 1.466 1.00 . A A . 42 GLU OE1 1 1 19 14048 1 1 42 GLU OE2 O 2.800 -13.430 3.602 1.00 . A A . 42 GLU OE2 1 1 19 14049 1 1 43 ASN C C 10.155 -8.471 2.777 1.00 . A A . 43 ASN C 1 1 19 14050 1 1 43 ASN CA C 9.320 -9.732 2.678 1.00 . A A . 43 ASN CA 1 1 19 14051 1 1 43 ASN CB C 9.819 -10.580 1.512 1.00 . A A . 43 ASN CB 1 1 19 14052 1 1 43 ASN CG C 9.258 -12.003 1.502 1.00 . A A . 43 ASN CG 1 1 19 14053 1 1 43 ASN H H 7.577 -9.031 1.749 1.00 . A A . 43 ASN H 1 1 19 14054 1 1 43 ASN HA H 9.466 -10.312 3.576 1.00 . A A . 43 ASN HA 1 1 19 14055 1 1 43 ASN HB2 H 9.505 -10.077 0.607 1.00 . A A . 43 ASN HB2 1 1 19 14056 1 1 43 ASN HB3 H 10.897 -10.602 1.551 1.00 . A A . 43 ASN HB3 1 1 19 14057 1 1 43 ASN HD21 H 9.334 -12.059 -0.464 1.00 . A A . 43 ASN HD21 1 1 19 14058 1 1 43 ASN HD22 H 8.725 -13.474 0.341 1.00 . A A . 43 ASN HD22 1 1 19 14059 1 1 43 ASN N N 7.902 -9.495 2.547 1.00 . A A . 43 ASN N 1 1 19 14060 1 1 43 ASN ND2 N 9.094 -12.565 0.337 1.00 . A A . 43 ASN ND2 1 1 19 14061 1 1 43 ASN O O 11.178 -8.457 3.459 1.00 . A A . 43 ASN O 1 1 19 14062 1 1 43 ASN OD1 O 8.978 -12.588 2.539 1.00 . A A . 43 ASN OD1 1 1 19 14063 1 1 44 GLU C C 9.909 -5.046 2.721 1.00 . A A . 44 GLU C 1 1 19 14064 1 1 44 GLU CA C 10.563 -6.244 2.039 1.00 . A A . 44 GLU CA 1 1 19 14065 1 1 44 GLU CB C 10.878 -5.962 0.559 1.00 . A A . 44 GLU CB 1 1 19 14066 1 1 44 GLU CD C 11.781 -6.937 -1.639 1.00 . A A . 44 GLU CD 1 1 19 14067 1 1 44 GLU CG C 11.535 -7.153 -0.158 1.00 . A A . 44 GLU CG 1 1 19 14068 1 1 44 GLU H H 8.821 -7.366 1.773 1.00 . A A . 44 GLU H 1 1 19 14069 1 1 44 GLU HA H 11.490 -6.466 2.547 1.00 . A A . 44 GLU HA 1 1 19 14070 1 1 44 GLU HB2 H 9.959 -5.712 0.059 1.00 . A A . 44 GLU HB2 1 1 19 14071 1 1 44 GLU HB3 H 11.553 -5.123 0.504 1.00 . A A . 44 GLU HB3 1 1 19 14072 1 1 44 GLU HG2 H 12.487 -7.332 0.323 1.00 . A A . 44 GLU HG2 1 1 19 14073 1 1 44 GLU HG3 H 10.914 -8.027 -0.020 1.00 . A A . 44 GLU HG3 1 1 19 14074 1 1 44 GLU N N 9.729 -7.416 2.143 1.00 . A A . 44 GLU N 1 1 19 14075 1 1 44 GLU O O 8.694 -5.005 2.914 1.00 . A A . 44 GLU O 1 1 19 14076 1 1 44 GLU OE1 O 10.872 -7.219 -2.452 1.00 . A A . 44 GLU OE1 1 1 19 14077 1 1 44 GLU OE2 O 12.907 -6.518 -1.999 1.00 . A A . 44 GLU OE2 1 1 19 14078 1 1 45 ASP C C 9.731 -1.877 2.840 1.00 . A A . 45 ASP C 1 1 19 14079 1 1 45 ASP CA C 10.265 -2.918 3.819 1.00 . A A . 45 ASP CA 1 1 19 14080 1 1 45 ASP CB C 11.429 -2.346 4.625 1.00 . A A . 45 ASP CB 1 1 19 14081 1 1 45 ASP CG C 11.027 -1.189 5.505 1.00 . A A . 45 ASP CG 1 1 19 14082 1 1 45 ASP H H 11.676 -4.161 2.900 1.00 . A A . 45 ASP H 1 1 19 14083 1 1 45 ASP HA H 9.477 -3.218 4.495 1.00 . A A . 45 ASP HA 1 1 19 14084 1 1 45 ASP HB2 H 11.822 -3.130 5.257 1.00 . A A . 45 ASP HB2 1 1 19 14085 1 1 45 ASP HB3 H 12.208 -2.031 3.947 1.00 . A A . 45 ASP HB3 1 1 19 14086 1 1 45 ASP N N 10.721 -4.096 3.098 1.00 . A A . 45 ASP N 1 1 19 14087 1 1 45 ASP O O 10.472 -1.395 1.967 1.00 . A A . 45 ASP O 1 1 19 14088 1 1 45 ASP OD1 O 10.576 -1.447 6.633 1.00 . A A . 45 ASP OD1 1 1 19 14089 1 1 45 ASP OD2 O 11.180 -0.033 5.089 1.00 . A A . 45 ASP OD2 1 1 19 14090 1 1 46 TYR C C 8.063 0.843 2.438 1.00 . A A . 46 TYR C 1 1 19 14091 1 1 46 TYR CA C 7.857 -0.616 2.031 1.00 . A A . 46 TYR CA 1 1 19 14092 1 1 46 TYR CB C 6.382 -0.900 1.672 1.00 . A A . 46 TYR CB 1 1 19 14093 1 1 46 TYR CD1 C 6.415 0.140 -0.629 1.00 . A A . 46 TYR CD1 1 1 19 14094 1 1 46 TYR CD2 C 4.833 0.983 0.940 1.00 . A A . 46 TYR CD2 1 1 19 14095 1 1 46 TYR CE1 C 5.972 1.046 -1.567 1.00 . A A . 46 TYR CE1 1 1 19 14096 1 1 46 TYR CE2 C 4.378 1.895 -0.009 1.00 . A A . 46 TYR CE2 1 1 19 14097 1 1 46 TYR CG C 5.855 0.083 0.637 1.00 . A A . 46 TYR CG 1 1 19 14098 1 1 46 TYR CZ C 4.967 1.917 -1.256 1.00 . A A . 46 TYR CZ 1 1 19 14099 1 1 46 TYR H H 7.921 -2.052 3.612 1.00 . A A . 46 TYR H 1 1 19 14100 1 1 46 TYR HA H 8.430 -0.728 1.123 1.00 . A A . 46 TYR HA 1 1 19 14101 1 1 46 TYR HB2 H 6.279 -1.898 1.276 1.00 . A A . 46 TYR HB2 1 1 19 14102 1 1 46 TYR HB3 H 5.778 -0.794 2.562 1.00 . A A . 46 TYR HB3 1 1 19 14103 1 1 46 TYR HD1 H 7.206 -0.551 -0.874 1.00 . A A . 46 TYR HD1 1 1 19 14104 1 1 46 TYR HD2 H 4.387 0.940 1.924 1.00 . A A . 46 TYR HD2 1 1 19 14105 1 1 46 TYR HE1 H 6.428 1.068 -2.544 1.00 . A A . 46 TYR HE1 1 1 19 14106 1 1 46 TYR HE2 H 3.577 2.594 0.202 1.00 . A A . 46 TYR HE2 1 1 19 14107 1 1 46 TYR HH H 4.437 2.383 -3.040 1.00 . A A . 46 TYR HH 1 1 19 14108 1 1 46 TYR N N 8.439 -1.571 2.935 1.00 . A A . 46 TYR N 1 1 19 14109 1 1 46 TYR O O 7.393 1.387 3.330 1.00 . A A . 46 TYR O 1 1 19 14110 1 1 46 TYR OH O 4.544 2.827 -2.192 1.00 . A A . 46 TYR OH 1 1 19 14111 1 1 47 ILE C C 8.415 3.540 0.746 1.00 . A A . 47 ILE C 1 1 19 14112 1 1 47 ILE CA C 9.234 2.860 1.846 1.00 . A A . 47 ILE CA 1 1 19 14113 1 1 47 ILE CB C 10.746 3.174 1.667 1.00 . A A . 47 ILE CB 1 1 19 14114 1 1 47 ILE CD1 C 11.244 2.957 4.180 1.00 . A A . 47 ILE CD1 1 1 19 14115 1 1 47 ILE CG1 C 11.574 2.487 2.770 1.00 . A A . 47 ILE CG1 1 1 19 14116 1 1 47 ILE CG2 C 10.985 4.671 1.690 1.00 . A A . 47 ILE CG2 1 1 19 14117 1 1 47 ILE H H 9.422 0.815 1.146 1.00 . A A . 47 ILE H 1 1 19 14118 1 1 47 ILE HA H 8.893 3.193 2.812 1.00 . A A . 47 ILE HA 1 1 19 14119 1 1 47 ILE HB H 11.058 2.783 0.708 1.00 . A A . 47 ILE HB 1 1 19 14120 1 1 47 ILE HD11 H 10.220 2.717 4.430 1.00 . A A . 47 ILE HD11 1 1 19 14121 1 1 47 ILE HD12 H 11.398 4.025 4.233 1.00 . A A . 47 ILE HD12 1 1 19 14122 1 1 47 ILE HD13 H 11.912 2.475 4.880 1.00 . A A . 47 ILE HD13 1 1 19 14123 1 1 47 ILE HG12 H 11.382 1.424 2.741 1.00 . A A . 47 ILE HG12 1 1 19 14124 1 1 47 ILE HG13 H 12.627 2.665 2.606 1.00 . A A . 47 ILE HG13 1 1 19 14125 1 1 47 ILE HG21 H 10.459 5.125 0.860 1.00 . A A . 47 ILE HG21 1 1 19 14126 1 1 47 ILE HG22 H 12.044 4.879 1.650 1.00 . A A . 47 ILE HG22 1 1 19 14127 1 1 47 ILE HG23 H 10.557 5.026 2.619 1.00 . A A . 47 ILE HG23 1 1 19 14128 1 1 47 ILE N N 8.977 1.454 1.741 1.00 . A A . 47 ILE N 1 1 19 14129 1 1 47 ILE O O 8.360 3.027 -0.370 1.00 . A A . 47 ILE O 1 1 19 14130 1 1 48 CYS C C 7.636 6.398 -0.662 1.00 . A A . 48 CYS C 1 1 19 14131 1 1 48 CYS CA C 6.896 5.272 0.046 1.00 . A A . 48 CYS CA 1 1 19 14132 1 1 48 CYS CB C 5.631 5.859 0.700 1.00 . A A . 48 CYS CB 1 1 19 14133 1 1 48 CYS H H 7.871 5.209 1.849 1.00 . A A . 48 CYS H 1 1 19 14134 1 1 48 CYS HA H 6.615 4.521 -0.674 1.00 . A A . 48 CYS HA 1 1 19 14135 1 1 48 CYS HB2 H 4.863 5.963 -0.054 1.00 . A A . 48 CYS HB2 1 1 19 14136 1 1 48 CYS HB3 H 5.280 5.176 1.456 1.00 . A A . 48 CYS HB3 1 1 19 14137 1 1 48 CYS N N 7.769 4.674 1.038 1.00 . A A . 48 CYS N 1 1 19 14138 1 1 48 CYS O O 8.770 6.725 -0.309 1.00 . A A . 48 CYS O 1 1 19 14139 1 1 48 CYS SG S 5.898 7.493 1.470 1.00 . A A . 48 CYS SG 1 1 19 14140 1 1 49 ILE C C 7.927 9.314 -1.479 1.00 . A A . 49 ILE C 1 1 19 14141 1 1 49 ILE CA C 7.477 8.130 -2.387 1.00 . A A . 49 ILE CA 1 1 19 14142 1 1 49 ILE CB C 6.427 8.582 -3.430 1.00 . A A . 49 ILE CB 1 1 19 14143 1 1 49 ILE CD1 C 6.046 10.098 -5.394 1.00 . A A . 49 ILE CD1 1 1 19 14144 1 1 49 ILE CG1 C 6.944 9.745 -4.246 1.00 . A A . 49 ILE CG1 1 1 19 14145 1 1 49 ILE CG2 C 5.092 8.920 -2.773 1.00 . A A . 49 ILE CG2 1 1 19 14146 1 1 49 ILE H H 6.073 6.654 -1.818 1.00 . A A . 49 ILE H 1 1 19 14147 1 1 49 ILE HA H 8.345 7.788 -2.934 1.00 . A A . 49 ILE HA 1 1 19 14148 1 1 49 ILE HB H 6.249 7.749 -4.092 1.00 . A A . 49 ILE HB 1 1 19 14149 1 1 49 ILE HD11 H 6.019 9.242 -6.052 1.00 . A A . 49 ILE HD11 1 1 19 14150 1 1 49 ILE HD12 H 6.416 10.956 -5.934 1.00 . A A . 49 ILE HD12 1 1 19 14151 1 1 49 ILE HD13 H 5.049 10.273 -5.022 1.00 . A A . 49 ILE HD13 1 1 19 14152 1 1 49 ILE HG12 H 7.005 10.596 -3.586 1.00 . A A . 49 ILE HG12 1 1 19 14153 1 1 49 ILE HG13 H 7.918 9.480 -4.630 1.00 . A A . 49 ILE HG13 1 1 19 14154 1 1 49 ILE HG21 H 4.728 8.044 -2.256 1.00 . A A . 49 ILE HG21 1 1 19 14155 1 1 49 ILE HG22 H 4.387 9.222 -3.533 1.00 . A A . 49 ILE HG22 1 1 19 14156 1 1 49 ILE HG23 H 5.247 9.718 -2.065 1.00 . A A . 49 ILE HG23 1 1 19 14157 1 1 49 ILE N N 6.962 7.008 -1.619 1.00 . A A . 49 ILE N 1 1 19 14158 1 1 49 ILE O O 8.989 9.891 -1.690 1.00 . A A . 49 ILE O 1 1 19 14159 1 1 50 ASN C C 8.559 10.339 1.459 1.00 . A A . 50 ASN C 1 1 19 14160 1 1 50 ASN CA C 7.444 10.729 0.488 1.00 . A A . 50 ASN CA 1 1 19 14161 1 1 50 ASN CB C 6.195 11.152 1.287 1.00 . A A . 50 ASN CB 1 1 19 14162 1 1 50 ASN CG C 5.069 11.678 0.418 1.00 . A A . 50 ASN CG 1 1 19 14163 1 1 50 ASN H H 6.340 9.060 -0.289 1.00 . A A . 50 ASN H 1 1 19 14164 1 1 50 ASN HA H 7.784 11.564 -0.103 1.00 . A A . 50 ASN HA 1 1 19 14165 1 1 50 ASN HB2 H 5.823 10.304 1.841 1.00 . A A . 50 ASN HB2 1 1 19 14166 1 1 50 ASN HB3 H 6.487 11.929 1.977 1.00 . A A . 50 ASN HB3 1 1 19 14167 1 1 50 ASN HD21 H 5.698 13.547 0.660 1.00 . A A . 50 ASN HD21 1 1 19 14168 1 1 50 ASN HD22 H 4.285 13.341 -0.299 1.00 . A A . 50 ASN HD22 1 1 19 14169 1 1 50 ASN N N 7.136 9.613 -0.439 1.00 . A A . 50 ASN N 1 1 19 14170 1 1 50 ASN ND2 N 5.019 12.983 0.238 1.00 . A A . 50 ASN ND2 1 1 19 14171 1 1 50 ASN O O 9.379 11.166 1.860 1.00 . A A . 50 ASN O 1 1 19 14172 1 1 50 ASN OD1 O 4.236 10.915 -0.067 1.00 . A A . 50 ASN OD1 1 1 19 14173 1 1 51 CYS C C 10.984 8.449 2.011 1.00 . A A . 51 CYS C 1 1 19 14174 1 1 51 CYS CA C 9.623 8.542 2.721 1.00 . A A . 51 CYS CA 1 1 19 14175 1 1 51 CYS CB C 9.245 7.160 3.296 1.00 . A A . 51 CYS CB 1 1 19 14176 1 1 51 CYS H H 7.905 8.472 1.439 1.00 . A A . 51 CYS H 1 1 19 14177 1 1 51 CYS HA H 9.705 9.246 3.536 1.00 . A A . 51 CYS HA 1 1 19 14178 1 1 51 CYS HB2 H 8.936 6.514 2.488 1.00 . A A . 51 CYS HB2 1 1 19 14179 1 1 51 CYS HB3 H 10.145 6.745 3.726 1.00 . A A . 51 CYS HB3 1 1 19 14180 1 1 51 CYS N N 8.591 9.061 1.820 1.00 . A A . 51 CYS N 1 1 19 14181 1 1 51 CYS O O 12.021 8.532 2.631 1.00 . A A . 51 CYS O 1 1 19 14182 1 1 51 CYS SG S 7.950 7.115 4.580 1.00 . A A . 51 CYS SG 1 1 19 14183 1 1 52 ALA C C 12.843 9.481 -0.378 1.00 . A A . 52 ALA C 1 1 19 14184 1 1 52 ALA CA C 12.188 8.137 -0.058 1.00 . A A . 52 ALA CA 1 1 19 14185 1 1 52 ALA CB C 11.917 7.348 -1.318 1.00 . A A . 52 ALA CB 1 1 19 14186 1 1 52 ALA H H 10.070 8.324 0.291 1.00 . A A . 52 ALA H 1 1 19 14187 1 1 52 ALA HA H 12.874 7.571 0.554 1.00 . A A . 52 ALA HA 1 1 19 14188 1 1 52 ALA HB1 H 12.849 7.168 -1.834 1.00 . A A . 52 ALA HB1 1 1 19 14189 1 1 52 ALA HB2 H 11.246 7.921 -1.938 1.00 . A A . 52 ALA HB2 1 1 19 14190 1 1 52 ALA HB3 H 11.455 6.411 -1.040 1.00 . A A . 52 ALA HB3 1 1 19 14191 1 1 52 ALA N N 10.955 8.297 0.714 1.00 . A A . 52 ALA N 1 1 19 14192 2 2 1 ZN ZN ZN 5.848 7.410 3.748 1.00 . B A . 53 ZN ZN 1 1 19 14193 3 2 1 ZN ZN ZN -5.216 3.035 -1.960 1.00 . C A . 54 ZN ZN 1 1 20 14194 1 1 1 SER C C -11.625 6.461 1.184 1.00 . A A . 1 SER C 1 1 20 14195 1 1 1 SER CA C -12.743 6.707 2.228 1.00 . A A . 1 SER CA 1 1 20 14196 1 1 1 SER CB C -12.478 5.902 3.507 1.00 . A A . 1 SER CB 1 1 20 14197 1 1 1 SER HA H -12.766 7.764 2.458 1.00 . A A . 1 SER HA 1 1 20 14198 1 1 1 SER HB2 H -12.386 4.855 3.263 1.00 . A A . 1 SER HB2 1 1 20 14199 1 1 1 SER HB3 H -11.563 6.249 3.960 1.00 . A A . 1 SER HB3 1 1 20 14200 1 1 1 SER HG H -14.354 6.209 3.933 1.00 . A A . 1 SER HG 1 1 20 14201 1 1 1 SER N N -14.073 6.333 1.670 1.00 . A A . 1 SER N 1 1 20 14202 1 1 1 SER O O -11.767 5.608 0.289 1.00 . A A . 1 SER O 1 1 20 14203 1 1 1 SER OG O -13.546 6.080 4.444 1.00 . A A . 1 SER OG 1 1 20 14204 1 1 2 VAL C C -8.147 6.842 1.174 1.00 . A A . 2 VAL C 1 1 20 14205 1 1 2 VAL CA C -9.423 7.101 0.371 1.00 . A A . 2 VAL CA 1 1 20 14206 1 1 2 VAL CB C -9.264 8.417 -0.464 1.00 . A A . 2 VAL CB 1 1 20 14207 1 1 2 VAL CG1 C -8.155 8.294 -1.494 1.00 . A A . 2 VAL CG1 1 1 20 14208 1 1 2 VAL CG2 C -10.580 8.800 -1.143 1.00 . A A . 2 VAL CG2 1 1 20 14209 1 1 2 VAL H H -10.428 7.842 2.037 1.00 . A A . 2 VAL H 1 1 20 14210 1 1 2 VAL HA H -9.627 6.274 -0.292 1.00 . A A . 2 VAL HA 1 1 20 14211 1 1 2 VAL HB H -9.003 9.199 0.235 1.00 . A A . 2 VAL HB 1 1 20 14212 1 1 2 VAL HG11 H -8.077 9.210 -2.059 1.00 . A A . 2 VAL HG11 1 1 20 14213 1 1 2 VAL HG12 H -8.396 7.478 -2.158 1.00 . A A . 2 VAL HG12 1 1 20 14214 1 1 2 VAL HG13 H -7.227 8.091 -0.983 1.00 . A A . 2 VAL HG13 1 1 20 14215 1 1 2 VAL HG21 H -10.442 9.693 -1.735 1.00 . A A . 2 VAL HG21 1 1 20 14216 1 1 2 VAL HG22 H -11.341 8.974 -0.395 1.00 . A A . 2 VAL HG22 1 1 20 14217 1 1 2 VAL HG23 H -10.895 7.985 -1.781 1.00 . A A . 2 VAL HG23 1 1 20 14218 1 1 2 VAL N N -10.534 7.204 1.298 1.00 . A A . 2 VAL N 1 1 20 14219 1 1 2 VAL O O -8.004 7.378 2.258 1.00 . A A . 2 VAL O 1 1 20 14220 1 1 3 CYS C C -4.903 6.638 0.951 1.00 . A A . 3 CYS C 1 1 20 14221 1 1 3 CYS CA C -6.029 5.681 1.411 1.00 . A A . 3 CYS CA 1 1 20 14222 1 1 3 CYS CB C -5.596 4.209 1.169 1.00 . A A . 3 CYS CB 1 1 20 14223 1 1 3 CYS H H -7.399 5.553 -0.185 1.00 . A A . 3 CYS H 1 1 20 14224 1 1 3 CYS HA H -6.219 5.833 2.462 1.00 . A A . 3 CYS HA 1 1 20 14225 1 1 3 CYS HB2 H -5.144 3.823 2.072 1.00 . A A . 3 CYS HB2 1 1 20 14226 1 1 3 CYS HB3 H -6.473 3.625 0.927 1.00 . A A . 3 CYS HB3 1 1 20 14227 1 1 3 CYS N N -7.257 5.985 0.676 1.00 . A A . 3 CYS N 1 1 20 14228 1 1 3 CYS O O -5.162 7.588 0.186 1.00 . A A . 3 CYS O 1 1 20 14229 1 1 3 CYS SG S -4.388 3.967 -0.164 1.00 . A A . 3 CYS SG 1 1 20 14230 1 1 4 ALA C C -1.958 6.539 -0.290 1.00 . A A . 4 ALA C 1 1 20 14231 1 1 4 ALA CA C -2.543 7.178 0.972 1.00 . A A . 4 ALA CA 1 1 20 14232 1 1 4 ALA CB C -1.468 7.214 2.071 1.00 . A A . 4 ALA CB 1 1 20 14233 1 1 4 ALA H H -3.513 5.627 1.998 1.00 . A A . 4 ALA H 1 1 20 14234 1 1 4 ALA HA H -2.855 8.191 0.749 1.00 . A A . 4 ALA HA 1 1 20 14235 1 1 4 ALA HB1 H -0.600 7.759 1.727 1.00 . A A . 4 ALA HB1 1 1 20 14236 1 1 4 ALA HB2 H -1.155 6.211 2.328 1.00 . A A . 4 ALA HB2 1 1 20 14237 1 1 4 ALA HB3 H -1.872 7.701 2.947 1.00 . A A . 4 ALA HB3 1 1 20 14238 1 1 4 ALA N N -3.677 6.393 1.406 1.00 . A A . 4 ALA N 1 1 20 14239 1 1 4 ALA O O -1.605 5.379 -0.271 1.00 . A A . 4 ALA O 1 1 20 14240 1 1 5 ALA C C -1.440 8.013 -3.609 1.00 . A A . 5 ALA C 1 1 20 14241 1 1 5 ALA CA C -1.282 6.895 -2.633 1.00 . A A . 5 ALA CA 1 1 20 14242 1 1 5 ALA CB C -1.845 5.593 -3.247 1.00 . A A . 5 ALA CB 1 1 20 14243 1 1 5 ALA H H -2.514 8.081 -1.397 1.00 . A A . 5 ALA H 1 1 20 14244 1 1 5 ALA HA H -0.236 6.758 -2.411 1.00 . A A . 5 ALA HA 1 1 20 14245 1 1 5 ALA HB1 H -1.792 4.776 -2.541 1.00 . A A . 5 ALA HB1 1 1 20 14246 1 1 5 ALA HB2 H -1.272 5.319 -4.125 1.00 . A A . 5 ALA HB2 1 1 20 14247 1 1 5 ALA HB3 H -2.870 5.746 -3.541 1.00 . A A . 5 ALA HB3 1 1 20 14248 1 1 5 ALA N N -1.958 7.276 -1.389 1.00 . A A . 5 ALA N 1 1 20 14249 1 1 5 ALA O O -2.446 8.697 -3.569 1.00 . A A . 5 ALA O 1 1 20 14250 1 1 6 GLN C C -1.790 9.091 -6.329 1.00 . A A . 6 GLN C 1 1 20 14251 1 1 6 GLN CA C -0.486 9.242 -5.539 1.00 . A A . 6 GLN CA 1 1 20 14252 1 1 6 GLN CB C 0.678 8.976 -6.499 1.00 . A A . 6 GLN CB 1 1 20 14253 1 1 6 GLN CD C 3.128 8.558 -6.879 1.00 . A A . 6 GLN CD 1 1 20 14254 1 1 6 GLN CG C 2.067 9.012 -5.884 1.00 . A A . 6 GLN CG 1 1 20 14255 1 1 6 GLN H H 0.470 7.864 -4.307 1.00 . A A . 6 GLN H 1 1 20 14256 1 1 6 GLN HA H -0.380 10.236 -5.128 1.00 . A A . 6 GLN HA 1 1 20 14257 1 1 6 GLN HB2 H 0.570 7.991 -6.920 1.00 . A A . 6 GLN HB2 1 1 20 14258 1 1 6 GLN HB3 H 0.643 9.706 -7.295 1.00 . A A . 6 GLN HB3 1 1 20 14259 1 1 6 GLN HE21 H 2.958 6.653 -6.281 1.00 . A A . 6 GLN HE21 1 1 20 14260 1 1 6 GLN HE22 H 4.077 6.956 -7.549 1.00 . A A . 6 GLN HE22 1 1 20 14261 1 1 6 GLN HG2 H 2.285 10.022 -5.573 1.00 . A A . 6 GLN HG2 1 1 20 14262 1 1 6 GLN HG3 H 2.092 8.356 -5.029 1.00 . A A . 6 GLN HG3 1 1 20 14263 1 1 6 GLN N N -0.423 8.235 -4.451 1.00 . A A . 6 GLN N 1 1 20 14264 1 1 6 GLN NE2 N 3.417 7.266 -6.891 1.00 . A A . 6 GLN NE2 1 1 20 14265 1 1 6 GLN O O -2.453 10.067 -6.661 1.00 . A A . 6 GLN O 1 1 20 14266 1 1 6 GLN OE1 O 3.688 9.350 -7.611 1.00 . A A . 6 GLN OE1 1 1 20 14267 1 1 7 ASN C C -4.018 6.353 -6.627 1.00 . A A . 7 ASN C 1 1 20 14268 1 1 7 ASN CA C -3.385 7.555 -7.264 1.00 . A A . 7 ASN CA 1 1 20 14269 1 1 7 ASN CB C -3.232 7.360 -8.789 1.00 . A A . 7 ASN CB 1 1 20 14270 1 1 7 ASN CG C -4.574 7.082 -9.488 1.00 . A A . 7 ASN CG 1 1 20 14271 1 1 7 ASN H H -1.413 7.248 -6.362 1.00 . A A . 7 ASN H 1 1 20 14272 1 1 7 ASN HA H -4.035 8.398 -7.084 1.00 . A A . 7 ASN HA 1 1 20 14273 1 1 7 ASN HB2 H -2.814 8.255 -9.225 1.00 . A A . 7 ASN HB2 1 1 20 14274 1 1 7 ASN HB3 H -2.563 6.534 -8.987 1.00 . A A . 7 ASN HB3 1 1 20 14275 1 1 7 ASN HD21 H -4.897 9.027 -9.734 1.00 . A A . 7 ASN HD21 1 1 20 14276 1 1 7 ASN HD22 H -6.106 7.975 -10.360 1.00 . A A . 7 ASN HD22 1 1 20 14277 1 1 7 ASN N N -2.132 7.860 -6.618 1.00 . A A . 7 ASN N 1 1 20 14278 1 1 7 ASN ND2 N -5.258 8.131 -9.895 1.00 . A A . 7 ASN ND2 1 1 20 14279 1 1 7 ASN O O -3.560 5.231 -6.804 1.00 . A A . 7 ASN O 1 1 20 14280 1 1 7 ASN OD1 O -4.981 5.942 -9.656 1.00 . A A . 7 ASN OD1 1 1 20 14281 1 1 8 CYS C C -6.919 5.063 -5.992 1.00 . A A . 8 CYS C 1 1 20 14282 1 1 8 CYS CA C -5.683 5.505 -5.224 1.00 . A A . 8 CYS CA 1 1 20 14283 1 1 8 CYS CB C -6.005 5.789 -3.767 1.00 . A A . 8 CYS CB 1 1 20 14284 1 1 8 CYS H H -5.372 7.491 -5.727 1.00 . A A . 8 CYS H 1 1 20 14285 1 1 8 CYS HA H -4.951 4.715 -5.256 1.00 . A A . 8 CYS HA 1 1 20 14286 1 1 8 CYS HB2 H -5.091 5.999 -3.235 1.00 . A A . 8 CYS HB2 1 1 20 14287 1 1 8 CYS HB3 H -6.675 6.634 -3.711 1.00 . A A . 8 CYS HB3 1 1 20 14288 1 1 8 CYS N N -5.040 6.578 -5.858 1.00 . A A . 8 CYS N 1 1 20 14289 1 1 8 CYS O O -7.892 5.819 -6.156 1.00 . A A . 8 CYS O 1 1 20 14290 1 1 8 CYS SG S -6.818 4.389 -2.925 1.00 . A A . 8 CYS SG 1 1 20 14291 1 1 9 GLN C C -9.144 2.880 -6.227 1.00 . A A . 9 GLN C 1 1 20 14292 1 1 9 GLN CA C -7.953 3.171 -7.174 1.00 . A A . 9 GLN CA 1 1 20 14293 1 1 9 GLN CB C -7.445 1.856 -7.756 1.00 . A A . 9 GLN CB 1 1 20 14294 1 1 9 GLN CD C -5.774 0.642 -9.217 1.00 . A A . 9 GLN CD 1 1 20 14295 1 1 9 GLN CG C -6.242 1.987 -8.683 1.00 . A A . 9 GLN CG 1 1 20 14296 1 1 9 GLN H H -6.027 3.331 -6.333 1.00 . A A . 9 GLN H 1 1 20 14297 1 1 9 GLN HA H -8.279 3.806 -7.981 1.00 . A A . 9 GLN HA 1 1 20 14298 1 1 9 GLN HB2 H -7.168 1.215 -6.934 1.00 . A A . 9 GLN HB2 1 1 20 14299 1 1 9 GLN HB3 H -8.247 1.380 -8.297 1.00 . A A . 9 GLN HB3 1 1 20 14300 1 1 9 GLN HE21 H -3.886 1.274 -9.294 1.00 . A A . 9 GLN HE21 1 1 20 14301 1 1 9 GLN HE22 H -4.158 -0.336 -9.826 1.00 . A A . 9 GLN HE22 1 1 20 14302 1 1 9 GLN HG2 H -6.484 2.625 -9.521 1.00 . A A . 9 GLN HG2 1 1 20 14303 1 1 9 GLN HG3 H -5.431 2.434 -8.126 1.00 . A A . 9 GLN HG3 1 1 20 14304 1 1 9 GLN N N -6.862 3.826 -6.455 1.00 . A A . 9 GLN N 1 1 20 14305 1 1 9 GLN NE2 N -4.486 0.517 -9.463 1.00 . A A . 9 GLN NE2 1 1 20 14306 1 1 9 GLN O O -10.218 2.480 -6.662 1.00 . A A . 9 GLN O 1 1 20 14307 1 1 9 GLN OE1 O -6.562 -0.283 -9.382 1.00 . A A . 9 GLN OE1 1 1 20 14308 1 1 10 ARG C C -10.520 1.390 -3.864 1.00 . A A . 10 ARG C 1 1 20 14309 1 1 10 ARG CA C -9.884 2.863 -3.852 1.00 . A A . 10 ARG CA 1 1 20 14310 1 1 10 ARG CB C -10.966 3.965 -3.931 1.00 . A A . 10 ARG CB 1 1 20 14311 1 1 10 ARG CD C -12.918 5.143 -2.918 1.00 . A A . 10 ARG CD 1 1 20 14312 1 1 10 ARG CG C -11.913 4.031 -2.742 1.00 . A A . 10 ARG CG 1 1 20 14313 1 1 10 ARG CZ C -15.097 5.576 -1.814 1.00 . A A . 10 ARG CZ 1 1 20 14314 1 1 10 ARG H H -8.048 3.504 -4.715 1.00 . A A . 10 ARG H 1 1 20 14315 1 1 10 ARG HA H -9.343 2.988 -2.924 1.00 . A A . 10 ARG HA 1 1 20 14316 1 1 10 ARG HB2 H -10.481 4.927 -4.014 1.00 . A A . 10 ARG HB2 1 1 20 14317 1 1 10 ARG HB3 H -11.546 3.785 -4.824 1.00 . A A . 10 ARG HB3 1 1 20 14318 1 1 10 ARG HD2 H -12.367 6.067 -3.041 1.00 . A A . 10 ARG HD2 1 1 20 14319 1 1 10 ARG HD3 H -13.505 4.931 -3.799 1.00 . A A . 10 ARG HD3 1 1 20 14320 1 1 10 ARG HE H -13.339 5.101 -0.898 1.00 . A A . 10 ARG HE 1 1 20 14321 1 1 10 ARG HG2 H -12.442 3.092 -2.662 1.00 . A A . 10 ARG HG2 1 1 20 14322 1 1 10 ARG HG3 H -11.340 4.211 -1.842 1.00 . A A . 10 ARG HG3 1 1 20 14323 1 1 10 ARG HH11 H -15.166 5.791 -3.858 1.00 . A A . 10 ARG HH11 1 1 20 14324 1 1 10 ARG HH12 H -16.655 6.042 -3.058 1.00 . A A . 10 ARG HH12 1 1 20 14325 1 1 10 ARG HH21 H -15.416 5.520 0.217 1.00 . A A . 10 ARG HH21 1 1 20 14326 1 1 10 ARG HH22 H -16.780 5.910 -0.734 1.00 . A A . 10 ARG HH22 1 1 20 14327 1 1 10 ARG N N -8.910 3.098 -4.932 1.00 . A A . 10 ARG N 1 1 20 14328 1 1 10 ARG NE N -13.797 5.269 -1.756 1.00 . A A . 10 ARG NE 1 1 20 14329 1 1 10 ARG NH1 N -15.675 5.831 -2.992 1.00 . A A . 10 ARG NH1 1 1 20 14330 1 1 10 ARG NH2 N -15.801 5.679 -0.697 1.00 . A A . 10 ARG NH2 1 1 20 14331 1 1 10 ARG O O -11.703 1.224 -3.616 1.00 . A A . 10 ARG O 1 1 20 14332 1 1 11 PRO C C -10.531 -1.655 -2.757 1.00 . A A . 11 PRO C 1 1 20 14333 1 1 11 PRO CA C -10.251 -1.068 -4.145 1.00 . A A . 11 PRO CA 1 1 20 14334 1 1 11 PRO CB C -9.125 -1.871 -4.820 1.00 . A A . 11 PRO CB 1 1 20 14335 1 1 11 PRO CD C -8.278 0.280 -4.280 1.00 . A A . 11 PRO CD 1 1 20 14336 1 1 11 PRO CG C -8.105 -0.864 -5.218 1.00 . A A . 11 PRO CG 1 1 20 14337 1 1 11 PRO HA H -11.145 -1.126 -4.745 1.00 . A A . 11 PRO HA 1 1 20 14338 1 1 11 PRO HB2 H -8.716 -2.545 -4.082 1.00 . A A . 11 PRO HB2 1 1 20 14339 1 1 11 PRO HB3 H -9.485 -2.426 -5.674 1.00 . A A . 11 PRO HB3 1 1 20 14340 1 1 11 PRO HD2 H -7.746 0.087 -3.358 1.00 . A A . 11 PRO HD2 1 1 20 14341 1 1 11 PRO HD3 H -7.938 1.195 -4.745 1.00 . A A . 11 PRO HD3 1 1 20 14342 1 1 11 PRO HG2 H -7.121 -1.294 -5.099 1.00 . A A . 11 PRO HG2 1 1 20 14343 1 1 11 PRO HG3 H -8.277 -0.547 -6.236 1.00 . A A . 11 PRO HG3 1 1 20 14344 1 1 11 PRO N N -9.714 0.298 -4.083 1.00 . A A . 11 PRO N 1 1 20 14345 1 1 11 PRO O O -9.788 -1.378 -1.784 1.00 . A A . 11 PRO O 1 1 20 14346 1 1 12 CYS C C -12.278 -4.589 -1.718 1.00 . A A . 12 CYS C 1 1 20 14347 1 1 12 CYS CA C -11.986 -3.111 -1.454 1.00 . A A . 12 CYS CA 1 1 20 14348 1 1 12 CYS CB C -13.249 -2.424 -0.901 1.00 . A A . 12 CYS CB 1 1 20 14349 1 1 12 CYS H H -12.127 -2.630 -3.470 1.00 . A A . 12 CYS H 1 1 20 14350 1 1 12 CYS HA H -11.198 -3.035 -0.716 1.00 . A A . 12 CYS HA 1 1 20 14351 1 1 12 CYS HB2 H -13.037 -1.385 -0.697 1.00 . A A . 12 CYS HB2 1 1 20 14352 1 1 12 CYS HB3 H -14.031 -2.483 -1.643 1.00 . A A . 12 CYS HB3 1 1 20 14353 1 1 12 CYS HG H -14.991 -3.814 0.322 1.00 . A A . 12 CYS HG 1 1 20 14354 1 1 12 CYS N N -11.576 -2.459 -2.677 1.00 . A A . 12 CYS N 1 1 20 14355 1 1 12 CYS O O -13.168 -4.925 -2.501 1.00 . A A . 12 CYS O 1 1 20 14356 1 1 12 CYS SG S -13.895 -3.137 0.633 1.00 . A A . 12 CYS SG 1 1 20 14357 1 1 13 LYS C C -11.258 -7.501 0.153 1.00 . A A . 13 LYS C 1 1 20 14358 1 1 13 LYS CA C -11.699 -6.896 -1.160 1.00 . A A . 13 LYS CA 1 1 20 14359 1 1 13 LYS CB C -10.892 -7.576 -2.293 1.00 . A A . 13 LYS CB 1 1 20 14360 1 1 13 LYS CD C -10.519 -8.057 -4.693 1.00 . A A . 13 LYS CD 1 1 20 14361 1 1 13 LYS CE C -10.930 -7.782 -6.126 1.00 . A A . 13 LYS CE 1 1 20 14362 1 1 13 LYS CG C -11.277 -7.199 -3.703 1.00 . A A . 13 LYS CG 1 1 20 14363 1 1 13 LYS H H -10.741 -5.156 -0.557 1.00 . A A . 13 LYS H 1 1 20 14364 1 1 13 LYS HA H -12.750 -7.105 -1.304 1.00 . A A . 13 LYS HA 1 1 20 14365 1 1 13 LYS HB2 H -9.849 -7.341 -2.162 1.00 . A A . 13 LYS HB2 1 1 20 14366 1 1 13 LYS HB3 H -11.022 -8.644 -2.193 1.00 . A A . 13 LYS HB3 1 1 20 14367 1 1 13 LYS HD2 H -9.461 -7.868 -4.587 1.00 . A A . 13 LYS HD2 1 1 20 14368 1 1 13 LYS HD3 H -10.709 -9.093 -4.461 1.00 . A A . 13 LYS HD3 1 1 20 14369 1 1 13 LYS HE2 H -11.991 -7.966 -6.220 1.00 . A A . 13 LYS HE2 1 1 20 14370 1 1 13 LYS HE3 H -10.714 -6.753 -6.379 1.00 . A A . 13 LYS HE3 1 1 20 14371 1 1 13 LYS HG2 H -12.341 -7.341 -3.800 1.00 . A A . 13 LYS HG2 1 1 20 14372 1 1 13 LYS HG3 H -11.028 -6.164 -3.877 1.00 . A A . 13 LYS HG3 1 1 20 14373 1 1 13 LYS HZ1 H -9.176 -8.590 -6.972 1.00 . A A . 13 LYS HZ1 1 1 20 14374 1 1 13 LYS HZ2 H -10.476 -8.480 -8.055 1.00 . A A . 13 LYS HZ2 1 1 20 14375 1 1 13 LYS HZ3 H -10.460 -9.667 -6.893 1.00 . A A . 13 LYS HZ3 1 1 20 14376 1 1 13 LYS N N -11.496 -5.455 -1.107 1.00 . A A . 13 LYS N 1 1 20 14377 1 1 13 LYS NZ N -10.206 -8.672 -7.071 1.00 . A A . 13 LYS NZ 1 1 20 14378 1 1 13 LYS O O -10.397 -6.950 0.826 1.00 . A A . 13 LYS O 1 1 20 14379 1 1 14 ASP C C -10.043 -9.964 1.569 1.00 . A A . 14 ASP C 1 1 20 14380 1 1 14 ASP CA C -11.448 -9.380 1.711 1.00 . A A . 14 ASP CA 1 1 20 14381 1 1 14 ASP CB C -12.409 -10.552 1.922 1.00 . A A . 14 ASP CB 1 1 20 14382 1 1 14 ASP CG C -13.844 -10.151 2.069 1.00 . A A . 14 ASP CG 1 1 20 14383 1 1 14 ASP H H -12.556 -9.005 -0.039 1.00 . A A . 14 ASP H 1 1 20 14384 1 1 14 ASP HA H -11.496 -8.730 2.570 1.00 . A A . 14 ASP HA 1 1 20 14385 1 1 14 ASP HB2 H -12.344 -11.223 1.079 1.00 . A A . 14 ASP HB2 1 1 20 14386 1 1 14 ASP HB3 H -12.128 -11.098 2.810 1.00 . A A . 14 ASP HB3 1 1 20 14387 1 1 14 ASP N N -11.822 -8.636 0.498 1.00 . A A . 14 ASP N 1 1 20 14388 1 1 14 ASP O O -9.441 -10.413 2.537 1.00 . A A . 14 ASP O 1 1 20 14389 1 1 14 ASP OD1 O -14.483 -9.816 1.038 1.00 . A A . 14 ASP OD1 1 1 20 14390 1 1 14 ASP OD2 O -14.372 -10.236 3.191 1.00 . A A . 14 ASP OD2 1 1 20 14391 1 1 15 LYS C C -7.302 -9.593 -0.606 1.00 . A A . 15 LYS C 1 1 20 14392 1 1 15 LYS CA C -8.265 -10.575 0.037 1.00 . A A . 15 LYS CA 1 1 20 14393 1 1 15 LYS CB C -8.501 -11.794 -0.876 1.00 . A A . 15 LYS CB 1 1 20 14394 1 1 15 LYS CD C -9.598 -14.055 -1.135 1.00 . A A . 15 LYS CD 1 1 20 14395 1 1 15 LYS CE C -10.400 -15.114 -0.401 1.00 . A A . 15 LYS CE 1 1 20 14396 1 1 15 LYS CG C -9.327 -12.878 -0.211 1.00 . A A . 15 LYS CG 1 1 20 14397 1 1 15 LYS H H -9.995 -9.423 -0.329 1.00 . A A . 15 LYS H 1 1 20 14398 1 1 15 LYS HA H -7.833 -10.929 0.962 1.00 . A A . 15 LYS HA 1 1 20 14399 1 1 15 LYS HB2 H -9.003 -11.487 -1.781 1.00 . A A . 15 LYS HB2 1 1 20 14400 1 1 15 LYS HB3 H -7.540 -12.210 -1.144 1.00 . A A . 15 LYS HB3 1 1 20 14401 1 1 15 LYS HD2 H -10.150 -13.723 -2.003 1.00 . A A . 15 LYS HD2 1 1 20 14402 1 1 15 LYS HD3 H -8.654 -14.484 -1.434 1.00 . A A . 15 LYS HD3 1 1 20 14403 1 1 15 LYS HE2 H -9.823 -15.443 0.452 1.00 . A A . 15 LYS HE2 1 1 20 14404 1 1 15 LYS HE3 H -11.333 -14.687 -0.062 1.00 . A A . 15 LYS HE3 1 1 20 14405 1 1 15 LYS HG2 H -8.806 -13.237 0.665 1.00 . A A . 15 LYS HG2 1 1 20 14406 1 1 15 LYS HG3 H -10.268 -12.436 0.086 1.00 . A A . 15 LYS HG3 1 1 20 14407 1 1 15 LYS HZ1 H -11.145 -17.015 -0.654 1.00 . A A . 15 LYS HZ1 1 1 20 14408 1 1 15 LYS HZ2 H -9.817 -16.721 -1.620 1.00 . A A . 15 LYS HZ2 1 1 20 14409 1 1 15 LYS HZ3 H -11.350 -16.072 -2.011 1.00 . A A . 15 LYS HZ3 1 1 20 14410 1 1 15 LYS N N -9.525 -9.941 0.353 1.00 . A A . 15 LYS N 1 1 20 14411 1 1 15 LYS NZ N -10.686 -16.289 -1.245 1.00 . A A . 15 LYS NZ 1 1 20 14412 1 1 15 LYS O O -6.762 -9.849 -1.689 1.00 . A A . 15 LYS O 1 1 20 14413 1 1 16 VAL C C -5.459 -6.843 0.765 1.00 . A A . 16 VAL C 1 1 20 14414 1 1 16 VAL CA C -6.155 -7.485 -0.413 1.00 . A A . 16 VAL CA 1 1 20 14415 1 1 16 VAL CB C -6.731 -6.399 -1.384 1.00 . A A . 16 VAL CB 1 1 20 14416 1 1 16 VAL CG1 C -7.883 -5.661 -0.758 1.00 . A A . 16 VAL CG1 1 1 20 14417 1 1 16 VAL CG2 C -5.631 -5.424 -1.803 1.00 . A A . 16 VAL CG2 1 1 20 14418 1 1 16 VAL H H -7.644 -8.270 0.844 1.00 . A A . 16 VAL H 1 1 20 14419 1 1 16 VAL HA H -5.401 -8.053 -0.943 1.00 . A A . 16 VAL HA 1 1 20 14420 1 1 16 VAL HB H -7.103 -6.887 -2.268 1.00 . A A . 16 VAL HB 1 1 20 14421 1 1 16 VAL HG11 H -7.495 -5.199 0.138 1.00 . A A . 16 VAL HG11 1 1 20 14422 1 1 16 VAL HG12 H -8.635 -6.387 -0.487 1.00 . A A . 16 VAL HG12 1 1 20 14423 1 1 16 VAL HG13 H -8.278 -4.914 -1.431 1.00 . A A . 16 VAL HG13 1 1 20 14424 1 1 16 VAL HG21 H -5.317 -4.900 -0.912 1.00 . A A . 16 VAL HG21 1 1 20 14425 1 1 16 VAL HG22 H -6.004 -4.710 -2.522 1.00 . A A . 16 VAL HG22 1 1 20 14426 1 1 16 VAL HG23 H -4.786 -5.965 -2.204 1.00 . A A . 16 VAL HG23 1 1 20 14427 1 1 16 VAL N N -7.122 -8.459 0.034 1.00 . A A . 16 VAL N 1 1 20 14428 1 1 16 VAL O O -6.008 -6.009 1.456 1.00 . A A . 16 VAL O 1 1 20 14429 1 1 17 ASP C C -2.935 -5.393 1.753 1.00 . A A . 17 ASP C 1 1 20 14430 1 1 17 ASP CA C -3.454 -6.790 2.084 1.00 . A A . 17 ASP CA 1 1 20 14431 1 1 17 ASP CB C -2.307 -7.757 2.403 1.00 . A A . 17 ASP CB 1 1 20 14432 1 1 17 ASP CG C -2.821 -9.098 2.903 1.00 . A A . 17 ASP CG 1 1 20 14433 1 1 17 ASP H H -4.061 -8.128 0.542 1.00 . A A . 17 ASP H 1 1 20 14434 1 1 17 ASP HA H -4.072 -6.700 2.965 1.00 . A A . 17 ASP HA 1 1 20 14435 1 1 17 ASP HB2 H -1.729 -7.924 1.504 1.00 . A A . 17 ASP HB2 1 1 20 14436 1 1 17 ASP HB3 H -1.681 -7.317 3.167 1.00 . A A . 17 ASP HB3 1 1 20 14437 1 1 17 ASP N N -4.301 -7.321 1.031 1.00 . A A . 17 ASP N 1 1 20 14438 1 1 17 ASP O O -2.655 -5.059 0.574 1.00 . A A . 17 ASP O 1 1 20 14439 1 1 17 ASP OD1 O -3.077 -9.233 4.129 1.00 . A A . 17 ASP OD1 1 1 20 14440 1 1 17 ASP OD2 O -2.995 -10.011 2.080 1.00 . A A . 17 ASP OD2 1 1 20 14441 1 1 18 TRP C C -1.005 -3.044 3.223 1.00 . A A . 18 TRP C 1 1 20 14442 1 1 18 TRP CA C -2.421 -3.195 2.705 1.00 . A A . 18 TRP CA 1 1 20 14443 1 1 18 TRP CB C -3.375 -2.338 3.555 1.00 . A A . 18 TRP CB 1 1 20 14444 1 1 18 TRP CD1 C -5.593 -3.413 2.836 1.00 . A A . 18 TRP CD1 1 1 20 14445 1 1 18 TRP CD2 C -5.656 -1.188 2.924 1.00 . A A . 18 TRP CD2 1 1 20 14446 1 1 18 TRP CE2 C -6.920 -1.662 2.518 1.00 . A A . 18 TRP CE2 1 1 20 14447 1 1 18 TRP CE3 C -5.462 0.191 3.060 1.00 . A A . 18 TRP CE3 1 1 20 14448 1 1 18 TRP CG C -4.814 -2.333 3.101 1.00 . A A . 18 TRP CG 1 1 20 14449 1 1 18 TRP CH2 C -7.766 0.537 2.399 1.00 . A A . 18 TRP CH2 1 1 20 14450 1 1 18 TRP CZ2 C -7.989 -0.806 2.254 1.00 . A A . 18 TRP CZ2 1 1 20 14451 1 1 18 TRP CZ3 C -6.520 1.034 2.797 1.00 . A A . 18 TRP CZ3 1 1 20 14452 1 1 18 TRP H H -2.984 -4.969 3.673 1.00 . A A . 18 TRP H 1 1 20 14453 1 1 18 TRP HA H -2.472 -2.872 1.678 1.00 . A A . 18 TRP HA 1 1 20 14454 1 1 18 TRP HB2 H -3.367 -2.716 4.568 1.00 . A A . 18 TRP HB2 1 1 20 14455 1 1 18 TRP HB3 H -3.020 -1.320 3.561 1.00 . A A . 18 TRP HB3 1 1 20 14456 1 1 18 TRP HD1 H -5.242 -4.432 2.881 1.00 . A A . 18 TRP HD1 1 1 20 14457 1 1 18 TRP HE1 H -7.546 -3.667 2.200 1.00 . A A . 18 TRP HE1 1 1 20 14458 1 1 18 TRP HE3 H -4.510 0.598 3.371 1.00 . A A . 18 TRP HE3 1 1 20 14459 1 1 18 TRP HH2 H -8.564 1.236 2.205 1.00 . A A . 18 TRP HH2 1 1 20 14460 1 1 18 TRP HZ2 H -8.963 -1.162 1.943 1.00 . A A . 18 TRP HZ2 1 1 20 14461 1 1 18 TRP HZ3 H -6.371 2.097 2.901 1.00 . A A . 18 TRP HZ3 1 1 20 14462 1 1 18 TRP N N -2.817 -4.595 2.784 1.00 . A A . 18 TRP N 1 1 20 14463 1 1 18 TRP NE1 N -6.842 -3.024 2.453 1.00 . A A . 18 TRP NE1 1 1 20 14464 1 1 18 TRP O O -0.525 -3.907 3.953 1.00 . A A . 18 TRP O 1 1 20 14465 1 1 19 VAL C C 1.210 -0.419 3.992 1.00 . A A . 19 VAL C 1 1 20 14466 1 1 19 VAL CA C 1.047 -1.769 3.290 1.00 . A A . 19 VAL CA 1 1 20 14467 1 1 19 VAL CB C 2.070 -1.892 2.107 1.00 . A A . 19 VAL CB 1 1 20 14468 1 1 19 VAL CG1 C 2.030 -3.284 1.510 1.00 . A A . 19 VAL CG1 1 1 20 14469 1 1 19 VAL CG2 C 1.789 -0.851 1.026 1.00 . A A . 19 VAL CG2 1 1 20 14470 1 1 19 VAL H H -0.683 -1.191 2.361 1.00 . A A . 19 VAL H 1 1 20 14471 1 1 19 VAL HA H 1.260 -2.537 4.017 1.00 . A A . 19 VAL HA 1 1 20 14472 1 1 19 VAL HB H 3.067 -1.723 2.498 1.00 . A A . 19 VAL HB 1 1 20 14473 1 1 19 VAL HG11 H 2.320 -4.009 2.257 1.00 . A A . 19 VAL HG11 1 1 20 14474 1 1 19 VAL HG12 H 2.698 -3.325 0.661 1.00 . A A . 19 VAL HG12 1 1 20 14475 1 1 19 VAL HG13 H 1.025 -3.499 1.178 1.00 . A A . 19 VAL HG13 1 1 20 14476 1 1 19 VAL HG21 H 2.529 -0.947 0.246 1.00 . A A . 19 VAL HG21 1 1 20 14477 1 1 19 VAL HG22 H 1.868 0.131 1.467 1.00 . A A . 19 VAL HG22 1 1 20 14478 1 1 19 VAL HG23 H 0.798 -0.986 0.619 1.00 . A A . 19 VAL HG23 1 1 20 14479 1 1 19 VAL N N -0.327 -1.960 2.863 1.00 . A A . 19 VAL N 1 1 20 14480 1 1 19 VAL O O 0.590 0.566 3.606 1.00 . A A . 19 VAL O 1 1 20 14481 1 1 20 GLN C C 3.729 1.234 5.577 1.00 . A A . 20 GLN C 1 1 20 14482 1 1 20 GLN CA C 2.278 0.809 5.799 1.00 . A A . 20 GLN CA 1 1 20 14483 1 1 20 GLN CB C 2.026 0.537 7.297 1.00 . A A . 20 GLN CB 1 1 20 14484 1 1 20 GLN CD C 1.999 1.424 9.670 1.00 . A A . 20 GLN CD 1 1 20 14485 1 1 20 GLN CG C 2.183 1.746 8.198 1.00 . A A . 20 GLN CG 1 1 20 14486 1 1 20 GLN H H 2.410 -1.257 5.295 1.00 . A A . 20 GLN H 1 1 20 14487 1 1 20 GLN HA H 1.620 1.590 5.454 1.00 . A A . 20 GLN HA 1 1 20 14488 1 1 20 GLN HB2 H 1.014 0.180 7.406 1.00 . A A . 20 GLN HB2 1 1 20 14489 1 1 20 GLN HB3 H 2.711 -0.225 7.637 1.00 . A A . 20 GLN HB3 1 1 20 14490 1 1 20 GLN HE21 H 1.273 3.229 9.971 1.00 . A A . 20 GLN HE21 1 1 20 14491 1 1 20 GLN HE22 H 1.381 2.224 11.365 1.00 . A A . 20 GLN HE22 1 1 20 14492 1 1 20 GLN HG2 H 3.163 2.182 8.066 1.00 . A A . 20 GLN HG2 1 1 20 14493 1 1 20 GLN HG3 H 1.439 2.476 7.915 1.00 . A A . 20 GLN HG3 1 1 20 14494 1 1 20 GLN N N 2.008 -0.406 5.030 1.00 . A A . 20 GLN N 1 1 20 14495 1 1 20 GLN NE2 N 1.503 2.377 10.407 1.00 . A A . 20 GLN NE2 1 1 20 14496 1 1 20 GLN O O 4.613 0.378 5.544 1.00 . A A . 20 GLN O 1 1 20 14497 1 1 20 GLN OE1 O 2.295 0.316 10.131 1.00 . A A . 20 GLN OE1 1 1 20 14498 1 1 21 CYS C C 5.926 3.440 6.552 1.00 . A A . 21 CYS C 1 1 20 14499 1 1 21 CYS CA C 5.347 2.997 5.217 1.00 . A A . 21 CYS CA 1 1 20 14500 1 1 21 CYS CB C 5.476 4.112 4.132 1.00 . A A . 21 CYS CB 1 1 20 14501 1 1 21 CYS H H 3.232 3.180 5.392 1.00 . A A . 21 CYS H 1 1 20 14502 1 1 21 CYS HA H 5.919 2.134 4.903 1.00 . A A . 21 CYS HA 1 1 20 14503 1 1 21 CYS HB2 H 6.494 4.396 3.929 1.00 . A A . 21 CYS HB2 1 1 20 14504 1 1 21 CYS HB3 H 5.048 3.734 3.218 1.00 . A A . 21 CYS HB3 1 1 20 14505 1 1 21 CYS N N 3.977 2.539 5.399 1.00 . A A . 21 CYS N 1 1 20 14506 1 1 21 CYS O O 5.618 4.536 7.058 1.00 . A A . 21 CYS O 1 1 20 14507 1 1 21 CYS SG S 4.651 5.665 4.476 1.00 . A A . 21 CYS SG 1 1 20 14508 1 1 22 ASP C C 8.635 3.729 8.279 1.00 . A A . 22 ASP C 1 1 20 14509 1 1 22 ASP CA C 7.365 2.899 8.431 1.00 . A A . 22 ASP CA 1 1 20 14510 1 1 22 ASP CB C 7.634 1.602 9.218 1.00 . A A . 22 ASP CB 1 1 20 14511 1 1 22 ASP CG C 8.580 0.638 8.540 1.00 . A A . 22 ASP CG 1 1 20 14512 1 1 22 ASP H H 7.090 1.801 6.660 1.00 . A A . 22 ASP H 1 1 20 14513 1 1 22 ASP HA H 6.654 3.506 8.975 1.00 . A A . 22 ASP HA 1 1 20 14514 1 1 22 ASP HB2 H 8.076 1.872 10.164 1.00 . A A . 22 ASP HB2 1 1 20 14515 1 1 22 ASP HB3 H 6.700 1.094 9.414 1.00 . A A . 22 ASP HB3 1 1 20 14516 1 1 22 ASP N N 6.779 2.620 7.117 1.00 . A A . 22 ASP N 1 1 20 14517 1 1 22 ASP O O 9.458 3.802 9.182 1.00 . A A . 22 ASP O 1 1 20 14518 1 1 22 ASP OD1 O 8.292 0.224 7.402 1.00 . A A . 22 ASP OD1 1 1 20 14519 1 1 22 ASP OD2 O 9.578 0.228 9.168 1.00 . A A . 22 ASP OD2 1 1 20 14520 1 1 23 GLY C C 9.647 6.680 7.441 1.00 . A A . 23 GLY C 1 1 20 14521 1 1 23 GLY CA C 9.853 5.282 6.878 1.00 . A A . 23 GLY CA 1 1 20 14522 1 1 23 GLY H H 7.934 4.447 6.572 1.00 . A A . 23 GLY H 1 1 20 14523 1 1 23 GLY HA2 H 10.737 4.840 7.314 1.00 . A A . 23 GLY HA2 1 1 20 14524 1 1 23 GLY HA3 H 9.975 5.358 5.805 1.00 . A A . 23 GLY HA3 1 1 20 14525 1 1 23 GLY N N 8.715 4.448 7.160 1.00 . A A . 23 GLY N 1 1 20 14526 1 1 23 GLY O O 10.539 7.523 7.363 1.00 . A A . 23 GLY O 1 1 20 14527 1 1 24 GLY C C 6.741 8.746 8.506 1.00 . A A . 24 GLY C 1 1 20 14528 1 1 24 GLY CA C 8.195 8.247 8.587 1.00 . A A . 24 GLY CA 1 1 20 14529 1 1 24 GLY H H 7.737 6.271 8.017 1.00 . A A . 24 GLY H 1 1 20 14530 1 1 24 GLY HA2 H 8.471 8.221 9.631 1.00 . A A . 24 GLY HA2 1 1 20 14531 1 1 24 GLY HA3 H 8.833 8.959 8.088 1.00 . A A . 24 GLY HA3 1 1 20 14532 1 1 24 GLY N N 8.447 6.941 7.994 1.00 . A A . 24 GLY N 1 1 20 14533 1 1 24 GLY O O 6.376 9.674 9.236 1.00 . A A . 24 GLY O 1 1 20 14534 1 1 25 CYS C C 3.573 7.787 8.326 1.00 . A A . 25 CYS C 1 1 20 14535 1 1 25 CYS CA C 4.531 8.663 7.507 1.00 . A A . 25 CYS CA 1 1 20 14536 1 1 25 CYS CB C 4.061 8.636 6.047 1.00 . A A . 25 CYS CB 1 1 20 14537 1 1 25 CYS H H 6.234 7.436 7.068 1.00 . A A . 25 CYS H 1 1 20 14538 1 1 25 CYS HA H 4.481 9.676 7.879 1.00 . A A . 25 CYS HA 1 1 20 14539 1 1 25 CYS HB2 H 3.857 7.610 5.782 1.00 . A A . 25 CYS HB2 1 1 20 14540 1 1 25 CYS HB3 H 3.144 9.202 5.979 1.00 . A A . 25 CYS HB3 1 1 20 14541 1 1 25 CYS N N 5.919 8.169 7.632 1.00 . A A . 25 CYS N 1 1 20 14542 1 1 25 CYS O O 2.579 8.284 8.862 1.00 . A A . 25 CYS O 1 1 20 14543 1 1 25 CYS SG S 5.228 9.262 4.819 1.00 . A A . 25 CYS SG 1 1 20 14544 1 1 26 ASP C C 1.662 5.312 8.457 1.00 . A A . 26 ASP C 1 1 20 14545 1 1 26 ASP CA C 3.044 5.445 9.104 1.00 . A A . 26 ASP CA 1 1 20 14546 1 1 26 ASP CB C 2.865 5.744 10.619 1.00 . A A . 26 ASP CB 1 1 20 14547 1 1 26 ASP CG C 4.148 5.730 11.412 1.00 . A A . 26 ASP CG 1 1 20 14548 1 1 26 ASP H H 4.750 6.179 8.030 1.00 . A A . 26 ASP H 1 1 20 14549 1 1 26 ASP HA H 3.557 4.503 8.989 1.00 . A A . 26 ASP HA 1 1 20 14550 1 1 26 ASP HB2 H 2.397 6.704 10.755 1.00 . A A . 26 ASP HB2 1 1 20 14551 1 1 26 ASP HB3 H 2.206 4.999 11.040 1.00 . A A . 26 ASP HB3 1 1 20 14552 1 1 26 ASP N N 3.892 6.467 8.406 1.00 . A A . 26 ASP N 1 1 20 14553 1 1 26 ASP O O 0.739 4.744 9.058 1.00 . A A . 26 ASP O 1 1 20 14554 1 1 26 ASP OD1 O 4.819 6.791 11.494 1.00 . A A . 26 ASP OD1 1 1 20 14555 1 1 26 ASP OD2 O 4.487 4.657 11.980 1.00 . A A . 26 ASP OD2 1 1 20 14556 1 1 27 GLU C C 0.023 4.423 5.839 1.00 . A A . 27 GLU C 1 1 20 14557 1 1 27 GLU CA C 0.267 5.768 6.511 1.00 . A A . 27 GLU CA 1 1 20 14558 1 1 27 GLU CB C 0.216 6.923 5.495 1.00 . A A . 27 GLU CB 1 1 20 14559 1 1 27 GLU CD C 0.386 9.444 5.161 1.00 . A A . 27 GLU CD 1 1 20 14560 1 1 27 GLU CG C 0.382 8.287 6.143 1.00 . A A . 27 GLU CG 1 1 20 14561 1 1 27 GLU H H 2.350 6.097 6.771 1.00 . A A . 27 GLU H 1 1 20 14562 1 1 27 GLU HA H -0.513 5.918 7.245 1.00 . A A . 27 GLU HA 1 1 20 14563 1 1 27 GLU HB2 H 0.998 6.792 4.765 1.00 . A A . 27 GLU HB2 1 1 20 14564 1 1 27 GLU HB3 H -0.733 6.906 4.981 1.00 . A A . 27 GLU HB3 1 1 20 14565 1 1 27 GLU HG2 H -0.424 8.444 6.846 1.00 . A A . 27 GLU HG2 1 1 20 14566 1 1 27 GLU HG3 H 1.320 8.295 6.680 1.00 . A A . 27 GLU HG3 1 1 20 14567 1 1 27 GLU N N 1.542 5.770 7.220 1.00 . A A . 27 GLU N 1 1 20 14568 1 1 27 GLU O O 0.939 3.598 5.746 1.00 . A A . 27 GLU O 1 1 20 14569 1 1 27 GLU OE1 O 1.414 9.641 4.487 1.00 . A A . 27 GLU OE1 1 1 20 14570 1 1 27 GLU OE2 O -0.626 10.181 5.091 1.00 . A A . 27 GLU OE2 1 1 20 14571 1 1 28 TRP C C -1.937 3.085 3.300 1.00 . A A . 28 TRP C 1 1 20 14572 1 1 28 TRP CA C -1.612 2.939 4.772 1.00 . A A . 28 TRP CA 1 1 20 14573 1 1 28 TRP CB C -2.791 2.321 5.527 1.00 . A A . 28 TRP CB 1 1 20 14574 1 1 28 TRP CD1 C -2.470 2.675 8.041 1.00 . A A . 28 TRP CD1 1 1 20 14575 1 1 28 TRP CD2 C -2.003 0.607 7.327 1.00 . A A . 28 TRP CD2 1 1 20 14576 1 1 28 TRP CE2 C -1.784 0.660 8.715 1.00 . A A . 28 TRP CE2 1 1 20 14577 1 1 28 TRP CE3 C -1.781 -0.601 6.651 1.00 . A A . 28 TRP CE3 1 1 20 14578 1 1 28 TRP CG C -2.442 1.908 6.919 1.00 . A A . 28 TRP CG 1 1 20 14579 1 1 28 TRP CH2 C -1.133 -1.610 8.756 1.00 . A A . 28 TRP CH2 1 1 20 14580 1 1 28 TRP CZ2 C -1.341 -0.444 9.445 1.00 . A A . 28 TRP CZ2 1 1 20 14581 1 1 28 TRP CZ3 C -1.343 -1.695 7.378 1.00 . A A . 28 TRP CZ3 1 1 20 14582 1 1 28 TRP H H -1.836 4.955 5.407 1.00 . A A . 28 TRP H 1 1 20 14583 1 1 28 TRP HA H -0.768 2.270 4.857 1.00 . A A . 28 TRP HA 1 1 20 14584 1 1 28 TRP HB2 H -3.606 3.025 5.572 1.00 . A A . 28 TRP HB2 1 1 20 14585 1 1 28 TRP HB3 H -3.120 1.442 4.994 1.00 . A A . 28 TRP HB3 1 1 20 14586 1 1 28 TRP HD1 H -2.761 3.714 8.058 1.00 . A A . 28 TRP HD1 1 1 20 14587 1 1 28 TRP HE1 H -2.003 2.264 10.044 1.00 . A A . 28 TRP HE1 1 1 20 14588 1 1 28 TRP HE3 H -1.937 -0.683 5.584 1.00 . A A . 28 TRP HE3 1 1 20 14589 1 1 28 TRP HH2 H -0.799 -2.497 9.272 1.00 . A A . 28 TRP HH2 1 1 20 14590 1 1 28 TRP HZ2 H -1.171 -0.397 10.513 1.00 . A A . 28 TRP HZ2 1 1 20 14591 1 1 28 TRP HZ3 H -1.163 -2.637 6.882 1.00 . A A . 28 TRP HZ3 1 1 20 14592 1 1 28 TRP N N -1.203 4.211 5.370 1.00 . A A . 28 TRP N 1 1 20 14593 1 1 28 TRP NE1 N -2.075 1.933 9.123 1.00 . A A . 28 TRP NE1 1 1 20 14594 1 1 28 TRP O O -2.770 3.922 2.901 1.00 . A A . 28 TRP O 1 1 20 14595 1 1 29 PHE C C -1.938 0.937 0.561 1.00 . A A . 29 PHE C 1 1 20 14596 1 1 29 PHE CA C -1.394 2.292 1.063 1.00 . A A . 29 PHE CA 1 1 20 14597 1 1 29 PHE CB C 0.029 2.497 0.456 1.00 . A A . 29 PHE CB 1 1 20 14598 1 1 29 PHE CD1 C 1.339 3.602 2.311 1.00 . A A . 29 PHE CD1 1 1 20 14599 1 1 29 PHE CD2 C 1.105 4.787 0.268 1.00 . A A . 29 PHE CD2 1 1 20 14600 1 1 29 PHE CE1 C 2.081 4.623 2.827 1.00 . A A . 29 PHE CE1 1 1 20 14601 1 1 29 PHE CE2 C 1.851 5.822 0.785 1.00 . A A . 29 PHE CE2 1 1 20 14602 1 1 29 PHE CG C 0.837 3.660 1.026 1.00 . A A . 29 PHE CG 1 1 20 14603 1 1 29 PHE CZ C 2.338 5.736 2.071 1.00 . A A . 29 PHE CZ 1 1 20 14604 1 1 29 PHE H H -0.665 1.613 2.924 1.00 . A A . 29 PHE H 1 1 20 14605 1 1 29 PHE HA H -2.032 3.103 0.748 1.00 . A A . 29 PHE HA 1 1 20 14606 1 1 29 PHE HB2 H 0.623 1.607 0.609 1.00 . A A . 29 PHE HB2 1 1 20 14607 1 1 29 PHE HB3 H -0.063 2.652 -0.606 1.00 . A A . 29 PHE HB3 1 1 20 14608 1 1 29 PHE HD1 H 1.140 2.723 2.909 1.00 . A A . 29 PHE HD1 1 1 20 14609 1 1 29 PHE HD2 H 0.725 4.854 -0.745 1.00 . A A . 29 PHE HD2 1 1 20 14610 1 1 29 PHE HE1 H 2.457 4.547 3.836 1.00 . A A . 29 PHE HE1 1 1 20 14611 1 1 29 PHE HE2 H 2.058 6.700 0.191 1.00 . A A . 29 PHE HE2 1 1 20 14612 1 1 29 PHE HZ H 2.937 6.515 2.517 1.00 . A A . 29 PHE HZ 1 1 20 14613 1 1 29 PHE N N -1.284 2.264 2.512 1.00 . A A . 29 PHE N 1 1 20 14614 1 1 29 PHE O O -1.853 -0.069 1.255 1.00 . A A . 29 PHE O 1 1 20 14615 1 1 30 HIS C C -1.829 -0.823 -2.170 1.00 . A A . 30 HIS C 1 1 20 14616 1 1 30 HIS CA C -2.932 -0.333 -1.285 1.00 . A A . 30 HIS CA 1 1 20 14617 1 1 30 HIS CB C -4.158 -0.130 -2.197 1.00 . A A . 30 HIS CB 1 1 20 14618 1 1 30 HIS CD2 C -6.370 -0.888 -1.114 1.00 . A A . 30 HIS CD2 1 1 20 14619 1 1 30 HIS CE1 C -7.326 1.074 -0.990 1.00 . A A . 30 HIS CE1 1 1 20 14620 1 1 30 HIS CG C -5.489 0.030 -1.571 1.00 . A A . 30 HIS CG 1 1 20 14621 1 1 30 HIS H H -2.574 1.779 -1.111 1.00 . A A . 30 HIS H 1 1 20 14622 1 1 30 HIS HA H -3.158 -1.079 -0.537 1.00 . A A . 30 HIS HA 1 1 20 14623 1 1 30 HIS HB2 H -3.964 0.848 -2.608 1.00 . A A . 30 HIS HB2 1 1 20 14624 1 1 30 HIS HB3 H -4.223 -0.790 -3.048 1.00 . A A . 30 HIS HB3 1 1 20 14625 1 1 30 HIS HD2 H -6.198 -1.955 -1.049 1.00 . A A . 30 HIS HD2 1 1 20 14626 1 1 30 HIS HE1 H -8.049 1.856 -0.810 1.00 . A A . 30 HIS HE1 1 1 20 14627 1 1 30 HIS HE2 H -8.392 -0.653 -0.754 1.00 . A A . 30 HIS HE2 1 1 20 14628 1 1 30 HIS N N -2.495 0.923 -0.640 1.00 . A A . 30 HIS N 1 1 20 14629 1 1 30 HIS ND1 N -6.106 1.247 -1.478 1.00 . A A . 30 HIS ND1 1 1 20 14630 1 1 30 HIS NE2 N -7.504 -0.216 -0.763 1.00 . A A . 30 HIS NE2 1 1 20 14631 1 1 30 HIS O O -1.254 -0.033 -2.920 1.00 . A A . 30 HIS O 1 1 20 14632 1 1 31 GLN C C -0.773 -2.418 -4.468 1.00 . A A . 31 GLN C 1 1 20 14633 1 1 31 GLN CA C -0.533 -2.701 -2.983 1.00 . A A . 31 GLN CA 1 1 20 14634 1 1 31 GLN CB C -0.351 -4.199 -2.723 1.00 . A A . 31 GLN CB 1 1 20 14635 1 1 31 GLN CD C 0.475 -5.982 -1.127 1.00 . A A . 31 GLN CD 1 1 20 14636 1 1 31 GLN CG C 0.277 -4.505 -1.374 1.00 . A A . 31 GLN CG 1 1 20 14637 1 1 31 GLN H H -2.035 -2.660 -1.466 1.00 . A A . 31 GLN H 1 1 20 14638 1 1 31 GLN HA H 0.380 -2.194 -2.703 1.00 . A A . 31 GLN HA 1 1 20 14639 1 1 31 GLN HB2 H -1.315 -4.688 -2.768 1.00 . A A . 31 GLN HB2 1 1 20 14640 1 1 31 GLN HB3 H 0.292 -4.600 -3.491 1.00 . A A . 31 GLN HB3 1 1 20 14641 1 1 31 GLN HE21 H -1.227 -6.059 -0.169 1.00 . A A . 31 GLN HE21 1 1 20 14642 1 1 31 GLN HE22 H -0.391 -7.556 -0.293 1.00 . A A . 31 GLN HE22 1 1 20 14643 1 1 31 GLN HG2 H 1.242 -4.026 -1.315 1.00 . A A . 31 GLN HG2 1 1 20 14644 1 1 31 GLN HG3 H -0.352 -4.100 -0.600 1.00 . A A . 31 GLN HG3 1 1 20 14645 1 1 31 GLN N N -1.554 -2.114 -2.124 1.00 . A A . 31 GLN N 1 1 20 14646 1 1 31 GLN NE2 N -0.467 -6.597 -0.466 1.00 . A A . 31 GLN NE2 1 1 20 14647 1 1 31 GLN O O 0.133 -2.102 -5.173 1.00 . A A . 31 GLN O 1 1 20 14648 1 1 31 GLN OE1 O 1.499 -6.542 -1.480 1.00 . A A . 31 GLN OE1 1 1 20 14649 1 1 32 VAL C C -2.206 -0.712 -6.646 1.00 . A A . 32 VAL C 1 1 20 14650 1 1 32 VAL CA C -2.276 -2.227 -6.318 1.00 . A A . 32 VAL CA 1 1 20 14651 1 1 32 VAL CB C -3.647 -2.800 -6.749 1.00 . A A . 32 VAL CB 1 1 20 14652 1 1 32 VAL CG1 C -4.739 -2.163 -5.945 1.00 . A A . 32 VAL CG1 1 1 20 14653 1 1 32 VAL CG2 C -3.888 -2.572 -8.222 1.00 . A A . 32 VAL CG2 1 1 20 14654 1 1 32 VAL H H -2.725 -2.749 -4.317 1.00 . A A . 32 VAL H 1 1 20 14655 1 1 32 VAL HA H -1.505 -2.719 -6.888 1.00 . A A . 32 VAL HA 1 1 20 14656 1 1 32 VAL HB H -3.650 -3.861 -6.555 1.00 . A A . 32 VAL HB 1 1 20 14657 1 1 32 VAL HG11 H -4.573 -2.375 -4.901 1.00 . A A . 32 VAL HG11 1 1 20 14658 1 1 32 VAL HG12 H -5.707 -2.498 -6.282 1.00 . A A . 32 VAL HG12 1 1 20 14659 1 1 32 VAL HG13 H -4.619 -1.097 -6.109 1.00 . A A . 32 VAL HG13 1 1 20 14660 1 1 32 VAL HG21 H -3.888 -1.496 -8.337 1.00 . A A . 32 VAL HG21 1 1 20 14661 1 1 32 VAL HG22 H -4.856 -2.963 -8.494 1.00 . A A . 32 VAL HG22 1 1 20 14662 1 1 32 VAL HG23 H -3.105 -3.031 -8.809 1.00 . A A . 32 VAL HG23 1 1 20 14663 1 1 32 VAL N N -1.999 -2.492 -4.915 1.00 . A A . 32 VAL N 1 1 20 14664 1 1 32 VAL O O -1.640 -0.316 -7.648 1.00 . A A . 32 VAL O 1 1 20 14665 1 1 33 CYS C C -1.480 2.231 -5.930 1.00 . A A . 33 CYS C 1 1 20 14666 1 1 33 CYS CA C -2.856 1.540 -6.011 1.00 . A A . 33 CYS CA 1 1 20 14667 1 1 33 CYS CB C -3.931 2.226 -5.102 1.00 . A A . 33 CYS CB 1 1 20 14668 1 1 33 CYS H H -3.071 -0.361 -4.968 1.00 . A A . 33 CYS H 1 1 20 14669 1 1 33 CYS HA H -3.156 1.669 -7.039 1.00 . A A . 33 CYS HA 1 1 20 14670 1 1 33 CYS HB2 H -4.231 3.134 -5.576 1.00 . A A . 33 CYS HB2 1 1 20 14671 1 1 33 CYS HB3 H -4.797 1.583 -5.074 1.00 . A A . 33 CYS HB3 1 1 20 14672 1 1 33 CYS N N -2.753 0.111 -5.756 1.00 . A A . 33 CYS N 1 1 20 14673 1 1 33 CYS O O -1.239 3.219 -6.605 1.00 . A A . 33 CYS O 1 1 20 14674 1 1 33 CYS SG S -3.439 2.593 -3.418 1.00 . A A . 33 CYS SG 1 1 20 14675 1 1 34 VAL C C 1.780 1.419 -5.769 1.00 . A A . 34 VAL C 1 1 20 14676 1 1 34 VAL CA C 0.725 2.276 -5.014 1.00 . A A . 34 VAL CA 1 1 20 14677 1 1 34 VAL CB C 1.126 2.424 -3.539 1.00 . A A . 34 VAL CB 1 1 20 14678 1 1 34 VAL CG1 C 1.744 1.182 -2.949 1.00 . A A . 34 VAL CG1 1 1 20 14679 1 1 34 VAL CG2 C 1.926 3.655 -3.326 1.00 . A A . 34 VAL CG2 1 1 20 14680 1 1 34 VAL H H -0.759 0.940 -4.528 1.00 . A A . 34 VAL H 1 1 20 14681 1 1 34 VAL HA H 0.674 3.260 -5.460 1.00 . A A . 34 VAL HA 1 1 20 14682 1 1 34 VAL HB H 0.247 2.489 -2.926 1.00 . A A . 34 VAL HB 1 1 20 14683 1 1 34 VAL HG11 H 2.678 1.006 -3.459 1.00 . A A . 34 VAL HG11 1 1 20 14684 1 1 34 VAL HG12 H 1.092 0.339 -3.121 1.00 . A A . 34 VAL HG12 1 1 20 14685 1 1 34 VAL HG13 H 1.925 1.317 -1.893 1.00 . A A . 34 VAL HG13 1 1 20 14686 1 1 34 VAL HG21 H 1.292 4.459 -3.672 1.00 . A A . 34 VAL HG21 1 1 20 14687 1 1 34 VAL HG22 H 2.819 3.602 -3.927 1.00 . A A . 34 VAL HG22 1 1 20 14688 1 1 34 VAL HG23 H 2.130 3.760 -2.272 1.00 . A A . 34 VAL HG23 1 1 20 14689 1 1 34 VAL N N -0.574 1.696 -5.120 1.00 . A A . 34 VAL N 1 1 20 14690 1 1 34 VAL O O 2.972 1.744 -5.773 1.00 . A A . 34 VAL O 1 1 20 14691 1 1 35 GLY C C 3.228 -1.285 -6.248 1.00 . A A . 35 GLY C 1 1 20 14692 1 1 35 GLY CA C 2.213 -0.536 -7.154 1.00 . A A . 35 GLY CA 1 1 20 14693 1 1 35 GLY H H 0.333 0.391 -6.561 1.00 . A A . 35 GLY H 1 1 20 14694 1 1 35 GLY HA2 H 1.603 -1.273 -7.652 1.00 . A A . 35 GLY HA2 1 1 20 14695 1 1 35 GLY HA3 H 2.761 0.002 -7.911 1.00 . A A . 35 GLY HA3 1 1 20 14696 1 1 35 GLY N N 1.311 0.398 -6.457 1.00 . A A . 35 GLY N 1 1 20 14697 1 1 35 GLY O O 4.418 -0.980 -6.254 1.00 . A A . 35 GLY O 1 1 20 14698 1 1 36 VAL C C 3.151 -4.544 -5.050 1.00 . A A . 36 VAL C 1 1 20 14699 1 1 36 VAL CA C 3.522 -3.141 -4.660 1.00 . A A . 36 VAL CA 1 1 20 14700 1 1 36 VAL CB C 3.184 -2.944 -3.139 1.00 . A A . 36 VAL CB 1 1 20 14701 1 1 36 VAL CG1 C 3.803 -4.032 -2.248 1.00 . A A . 36 VAL CG1 1 1 20 14702 1 1 36 VAL CG2 C 3.586 -1.571 -2.667 1.00 . A A . 36 VAL CG2 1 1 20 14703 1 1 36 VAL H H 1.777 -2.450 -5.424 1.00 . A A . 36 VAL H 1 1 20 14704 1 1 36 VAL HA H 4.578 -2.990 -4.826 1.00 . A A . 36 VAL HA 1 1 20 14705 1 1 36 VAL HB H 2.113 -3.033 -3.048 1.00 . A A . 36 VAL HB 1 1 20 14706 1 1 36 VAL HG11 H 4.843 -4.188 -2.491 1.00 . A A . 36 VAL HG11 1 1 20 14707 1 1 36 VAL HG12 H 3.272 -4.957 -2.424 1.00 . A A . 36 VAL HG12 1 1 20 14708 1 1 36 VAL HG13 H 3.699 -3.784 -1.203 1.00 . A A . 36 VAL HG13 1 1 20 14709 1 1 36 VAL HG21 H 4.637 -1.391 -2.840 1.00 . A A . 36 VAL HG21 1 1 20 14710 1 1 36 VAL HG22 H 3.363 -1.477 -1.614 1.00 . A A . 36 VAL HG22 1 1 20 14711 1 1 36 VAL HG23 H 2.995 -0.847 -3.213 1.00 . A A . 36 VAL HG23 1 1 20 14712 1 1 36 VAL N N 2.736 -2.245 -5.492 1.00 . A A . 36 VAL N 1 1 20 14713 1 1 36 VAL O O 2.016 -4.775 -5.477 1.00 . A A . 36 VAL O 1 1 20 14714 1 1 37 SER C C 3.557 -7.536 -3.879 1.00 . A A . 37 SER C 1 1 20 14715 1 1 37 SER CA C 3.761 -6.826 -5.219 1.00 . A A . 37 SER CA 1 1 20 14716 1 1 37 SER CB C 4.919 -7.443 -6.015 1.00 . A A . 37 SER CB 1 1 20 14717 1 1 37 SER H H 4.995 -5.396 -4.617 1.00 . A A . 37 SER H 1 1 20 14718 1 1 37 SER HA H 2.852 -6.863 -5.804 1.00 . A A . 37 SER HA 1 1 20 14719 1 1 37 SER HB2 H 4.734 -8.502 -6.131 1.00 . A A . 37 SER HB2 1 1 20 14720 1 1 37 SER HB3 H 4.994 -6.977 -6.990 1.00 . A A . 37 SER HB3 1 1 20 14721 1 1 37 SER HG H 6.885 -7.341 -5.962 1.00 . A A . 37 SER HG 1 1 20 14722 1 1 37 SER N N 4.068 -5.471 -4.936 1.00 . A A . 37 SER N 1 1 20 14723 1 1 37 SER O O 4.204 -7.165 -2.893 1.00 . A A . 37 SER O 1 1 20 14724 1 1 37 SER OG O 6.159 -7.271 -5.327 1.00 . A A . 37 SER OG 1 1 20 14725 1 1 38 PRO C C 3.592 -9.832 -1.865 1.00 . A A . 38 PRO C 1 1 20 14726 1 1 38 PRO CA C 2.349 -9.260 -2.548 1.00 . A A . 38 PRO CA 1 1 20 14727 1 1 38 PRO CB C 1.408 -10.388 -3.004 1.00 . A A . 38 PRO CB 1 1 20 14728 1 1 38 PRO CD C 1.925 -9.099 -4.941 1.00 . A A . 38 PRO CD 1 1 20 14729 1 1 38 PRO CG C 1.639 -10.488 -4.474 1.00 . A A . 38 PRO CG 1 1 20 14730 1 1 38 PRO HA H 1.841 -8.610 -1.851 1.00 . A A . 38 PRO HA 1 1 20 14731 1 1 38 PRO HB2 H 1.646 -11.315 -2.500 1.00 . A A . 38 PRO HB2 1 1 20 14732 1 1 38 PRO HB3 H 0.383 -10.112 -2.799 1.00 . A A . 38 PRO HB3 1 1 20 14733 1 1 38 PRO HD2 H 2.528 -9.098 -5.837 1.00 . A A . 38 PRO HD2 1 1 20 14734 1 1 38 PRO HD3 H 1.023 -8.532 -5.104 1.00 . A A . 38 PRO HD3 1 1 20 14735 1 1 38 PRO HG2 H 2.499 -11.116 -4.644 1.00 . A A . 38 PRO HG2 1 1 20 14736 1 1 38 PRO HG3 H 0.772 -10.894 -4.967 1.00 . A A . 38 PRO HG3 1 1 20 14737 1 1 38 PRO N N 2.677 -8.550 -3.813 1.00 . A A . 38 PRO N 1 1 20 14738 1 1 38 PRO O O 3.647 -9.953 -0.647 1.00 . A A . 38 PRO O 1 1 20 14739 1 1 39 GLU C C 6.683 -9.600 -1.501 1.00 . A A . 39 GLU C 1 1 20 14740 1 1 39 GLU CA C 5.831 -10.665 -2.208 1.00 . A A . 39 GLU CA 1 1 20 14741 1 1 39 GLU CB C 6.583 -11.282 -3.382 1.00 . A A . 39 GLU CB 1 1 20 14742 1 1 39 GLU CD C 6.660 -13.109 -5.152 1.00 . A A . 39 GLU CD 1 1 20 14743 1 1 39 GLU CG C 5.908 -12.520 -3.967 1.00 . A A . 39 GLU CG 1 1 20 14744 1 1 39 GLU H H 4.568 -9.954 -3.628 1.00 . A A . 39 GLU H 1 1 20 14745 1 1 39 GLU HA H 5.617 -11.449 -1.500 1.00 . A A . 39 GLU HA 1 1 20 14746 1 1 39 GLU HB2 H 6.672 -10.545 -4.167 1.00 . A A . 39 GLU HB2 1 1 20 14747 1 1 39 GLU HB3 H 7.556 -11.545 -3.027 1.00 . A A . 39 GLU HB3 1 1 20 14748 1 1 39 GLU HG2 H 5.814 -13.268 -3.194 1.00 . A A . 39 GLU HG2 1 1 20 14749 1 1 39 GLU HG3 H 4.917 -12.239 -4.295 1.00 . A A . 39 GLU HG3 1 1 20 14750 1 1 39 GLU N N 4.597 -10.131 -2.668 1.00 . A A . 39 GLU N 1 1 20 14751 1 1 39 GLU O O 7.463 -9.913 -0.602 1.00 . A A . 39 GLU O 1 1 20 14752 1 1 39 GLU OE1 O 7.730 -13.725 -4.947 1.00 . A A . 39 GLU OE1 1 1 20 14753 1 1 39 GLU OE2 O 6.159 -12.974 -6.300 1.00 . A A . 39 GLU OE2 1 1 20 14754 1 1 40 MET C C 6.783 -7.006 0.100 1.00 . A A . 40 MET C 1 1 20 14755 1 1 40 MET CA C 7.294 -7.276 -1.295 1.00 . A A . 40 MET CA 1 1 20 14756 1 1 40 MET CB C 7.248 -5.971 -2.126 1.00 . A A . 40 MET CB 1 1 20 14757 1 1 40 MET CE C 7.143 -2.500 -2.063 1.00 . A A . 40 MET CE 1 1 20 14758 1 1 40 MET CG C 8.366 -4.995 -1.724 1.00 . A A . 40 MET CG 1 1 20 14759 1 1 40 MET H H 5.838 -8.134 -2.568 1.00 . A A . 40 MET H 1 1 20 14760 1 1 40 MET HA H 8.313 -7.625 -1.231 1.00 . A A . 40 MET HA 1 1 20 14761 1 1 40 MET HB2 H 7.236 -6.143 -3.191 1.00 . A A . 40 MET HB2 1 1 20 14762 1 1 40 MET HB3 H 6.316 -5.491 -1.873 1.00 . A A . 40 MET HB3 1 1 20 14763 1 1 40 MET HE1 H 7.328 -2.334 -1.012 1.00 . A A . 40 MET HE1 1 1 20 14764 1 1 40 MET HE2 H 6.210 -3.020 -2.187 1.00 . A A . 40 MET HE2 1 1 20 14765 1 1 40 MET HE3 H 7.100 -1.558 -2.588 1.00 . A A . 40 MET HE3 1 1 20 14766 1 1 40 MET HG2 H 8.082 -4.684 -0.732 1.00 . A A . 40 MET HG2 1 1 20 14767 1 1 40 MET HG3 H 9.321 -5.502 -1.711 1.00 . A A . 40 MET HG3 1 1 20 14768 1 1 40 MET N N 6.512 -8.342 -1.888 1.00 . A A . 40 MET N 1 1 20 14769 1 1 40 MET O O 7.555 -6.797 1.012 1.00 . A A . 40 MET O 1 1 20 14770 1 1 40 MET SD S 8.477 -3.475 -2.723 1.00 . A A . 40 MET SD 1 1 20 14771 1 1 41 ALA C C 5.264 -7.638 2.682 1.00 . A A . 41 ALA C 1 1 20 14772 1 1 41 ALA CA C 4.787 -6.747 1.513 1.00 . A A . 41 ALA CA 1 1 20 14773 1 1 41 ALA CB C 3.258 -6.822 1.336 1.00 . A A . 41 ALA CB 1 1 20 14774 1 1 41 ALA H H 4.905 -7.260 -0.537 1.00 . A A . 41 ALA H 1 1 20 14775 1 1 41 ALA HA H 5.041 -5.726 1.757 1.00 . A A . 41 ALA HA 1 1 20 14776 1 1 41 ALA HB1 H 2.770 -6.500 2.245 1.00 . A A . 41 ALA HB1 1 1 20 14777 1 1 41 ALA HB2 H 2.953 -7.832 1.098 1.00 . A A . 41 ALA HB2 1 1 20 14778 1 1 41 ALA HB3 H 2.945 -6.173 0.527 1.00 . A A . 41 ALA HB3 1 1 20 14779 1 1 41 ALA N N 5.460 -7.049 0.245 1.00 . A A . 41 ALA N 1 1 20 14780 1 1 41 ALA O O 5.499 -7.141 3.793 1.00 . A A . 41 ALA O 1 1 20 14781 1 1 42 GLU C C 7.395 -10.009 3.559 1.00 . A A . 42 GLU C 1 1 20 14782 1 1 42 GLU CA C 5.870 -9.862 3.476 1.00 . A A . 42 GLU CA 1 1 20 14783 1 1 42 GLU CB C 5.205 -11.247 3.392 1.00 . A A . 42 GLU CB 1 1 20 14784 1 1 42 GLU CD C 3.148 -12.659 3.750 1.00 . A A . 42 GLU CD 1 1 20 14785 1 1 42 GLU CG C 3.714 -11.253 3.703 1.00 . A A . 42 GLU CG 1 1 20 14786 1 1 42 GLU H H 5.134 -9.208 1.534 1.00 . A A . 42 GLU H 1 1 20 14787 1 1 42 GLU HA H 5.549 -9.401 4.399 1.00 . A A . 42 GLU HA 1 1 20 14788 1 1 42 GLU HB2 H 5.327 -11.627 2.389 1.00 . A A . 42 GLU HB2 1 1 20 14789 1 1 42 GLU HB3 H 5.692 -11.924 4.081 1.00 . A A . 42 GLU HB3 1 1 20 14790 1 1 42 GLU HG2 H 3.577 -10.804 4.679 1.00 . A A . 42 GLU HG2 1 1 20 14791 1 1 42 GLU HG3 H 3.173 -10.680 2.965 1.00 . A A . 42 GLU HG3 1 1 20 14792 1 1 42 GLU N N 5.404 -8.932 2.434 1.00 . A A . 42 GLU N 1 1 20 14793 1 1 42 GLU O O 7.905 -10.560 4.539 1.00 . A A . 42 GLU O 1 1 20 14794 1 1 42 GLU OE1 O 2.728 -13.186 2.708 1.00 . A A . 42 GLU OE1 1 1 20 14795 1 1 42 GLU OE2 O 3.123 -13.250 4.850 1.00 . A A . 42 GLU OE2 1 1 20 14796 1 1 43 ASN C C 10.409 -8.481 2.714 1.00 . A A . 43 ASN C 1 1 20 14797 1 1 43 ASN CA C 9.567 -9.735 2.525 1.00 . A A . 43 ASN CA 1 1 20 14798 1 1 43 ASN CB C 10.004 -10.442 1.251 1.00 . A A . 43 ASN CB 1 1 20 14799 1 1 43 ASN CG C 9.612 -11.906 1.203 1.00 . A A . 43 ASN CG 1 1 20 14800 1 1 43 ASN H H 7.716 -9.033 1.818 1.00 . A A . 43 ASN H 1 1 20 14801 1 1 43 ASN HA H 9.803 -10.402 3.340 1.00 . A A . 43 ASN HA 1 1 20 14802 1 1 43 ASN HB2 H 9.536 -9.941 0.416 1.00 . A A . 43 ASN HB2 1 1 20 14803 1 1 43 ASN HB3 H 11.075 -10.363 1.165 1.00 . A A . 43 ASN HB3 1 1 20 14804 1 1 43 ASN HD21 H 9.438 -11.810 -0.762 1.00 . A A . 43 ASN HD21 1 1 20 14805 1 1 43 ASN HD22 H 9.104 -13.352 -0.039 1.00 . A A . 43 ASN HD22 1 1 20 14806 1 1 43 ASN N N 8.123 -9.534 2.550 1.00 . A A . 43 ASN N 1 1 20 14807 1 1 43 ASN ND2 N 9.361 -12.406 0.011 1.00 . A A . 43 ASN ND2 1 1 20 14808 1 1 43 ASN O O 11.411 -8.529 3.407 1.00 . A A . 43 ASN O 1 1 20 14809 1 1 43 ASN OD1 O 9.539 -12.577 2.220 1.00 . A A . 43 ASN OD1 1 1 20 14810 1 1 44 GLU C C 10.233 -4.933 2.673 1.00 . A A . 44 GLU C 1 1 20 14811 1 1 44 GLU CA C 10.887 -6.189 2.112 1.00 . A A . 44 GLU CA 1 1 20 14812 1 1 44 GLU CB C 11.422 -5.945 0.691 1.00 . A A . 44 GLU CB 1 1 20 14813 1 1 44 GLU CD C 12.810 -6.865 -1.223 1.00 . A A . 44 GLU CD 1 1 20 14814 1 1 44 GLU CG C 12.261 -7.103 0.160 1.00 . A A . 44 GLU CG 1 1 20 14815 1 1 44 GLU H H 9.105 -7.281 1.758 1.00 . A A . 44 GLU H 1 1 20 14816 1 1 44 GLU HA H 11.734 -6.428 2.739 1.00 . A A . 44 GLU HA 1 1 20 14817 1 1 44 GLU HB2 H 10.580 -5.796 0.028 1.00 . A A . 44 GLU HB2 1 1 20 14818 1 1 44 GLU HB3 H 12.038 -5.058 0.689 1.00 . A A . 44 GLU HB3 1 1 20 14819 1 1 44 GLU HG2 H 13.094 -7.255 0.832 1.00 . A A . 44 GLU HG2 1 1 20 14820 1 1 44 GLU HG3 H 11.652 -7.995 0.148 1.00 . A A . 44 GLU HG3 1 1 20 14821 1 1 44 GLU N N 10.010 -7.362 2.136 1.00 . A A . 44 GLU N 1 1 20 14822 1 1 44 GLU O O 9.017 -4.877 2.858 1.00 . A A . 44 GLU O 1 1 20 14823 1 1 44 GLU OE1 O 13.943 -6.327 -1.329 1.00 . A A . 44 GLU OE1 1 1 20 14824 1 1 44 GLU OE2 O 12.155 -7.246 -2.201 1.00 . A A . 44 GLU OE2 1 1 20 14825 1 1 45 ASP C C 9.920 -1.773 2.496 1.00 . A A . 45 ASP C 1 1 20 14826 1 1 45 ASP CA C 10.636 -2.655 3.507 1.00 . A A . 45 ASP CA 1 1 20 14827 1 1 45 ASP CB C 11.840 -1.901 4.134 1.00 . A A . 45 ASP CB 1 1 20 14828 1 1 45 ASP CG C 12.983 -1.644 3.159 1.00 . A A . 45 ASP CG 1 1 20 14829 1 1 45 ASP H H 12.017 -4.010 2.740 1.00 . A A . 45 ASP H 1 1 20 14830 1 1 45 ASP HA H 9.939 -2.884 4.296 1.00 . A A . 45 ASP HA 1 1 20 14831 1 1 45 ASP HB2 H 11.501 -0.947 4.507 1.00 . A A . 45 ASP HB2 1 1 20 14832 1 1 45 ASP HB3 H 12.225 -2.483 4.958 1.00 . A A . 45 ASP HB3 1 1 20 14833 1 1 45 ASP N N 11.059 -3.929 2.935 1.00 . A A . 45 ASP N 1 1 20 14834 1 1 45 ASP O O 10.467 -1.412 1.442 1.00 . A A . 45 ASP O 1 1 20 14835 1 1 45 ASP OD1 O 13.701 -2.611 2.821 1.00 . A A . 45 ASP OD1 1 1 20 14836 1 1 45 ASP OD2 O 13.203 -0.482 2.751 1.00 . A A . 45 ASP OD2 1 1 20 14837 1 1 46 TYR C C 8.183 0.905 2.351 1.00 . A A . 46 TYR C 1 1 20 14838 1 1 46 TYR CA C 7.905 -0.570 1.991 1.00 . A A . 46 TYR CA 1 1 20 14839 1 1 46 TYR CB C 6.379 -0.887 2.016 1.00 . A A . 46 TYR CB 1 1 20 14840 1 1 46 TYR CD1 C 5.398 0.143 -0.090 1.00 . A A . 46 TYR CD1 1 1 20 14841 1 1 46 TYR CD2 C 4.984 1.214 1.992 1.00 . A A . 46 TYR CD2 1 1 20 14842 1 1 46 TYR CE1 C 4.698 1.147 -0.737 1.00 . A A . 46 TYR CE1 1 1 20 14843 1 1 46 TYR CE2 C 4.286 2.189 1.350 1.00 . A A . 46 TYR CE2 1 1 20 14844 1 1 46 TYR CG C 5.561 0.169 1.292 1.00 . A A . 46 TYR CG 1 1 20 14845 1 1 46 TYR CZ C 4.151 2.156 -0.001 1.00 . A A . 46 TYR CZ 1 1 20 14846 1 1 46 TYR H H 8.286 -1.917 3.577 1.00 . A A . 46 TYR H 1 1 20 14847 1 1 46 TYR HA H 8.262 -0.732 0.986 1.00 . A A . 46 TYR HA 1 1 20 14848 1 1 46 TYR HB2 H 6.206 -1.829 1.512 1.00 . A A . 46 TYR HB2 1 1 20 14849 1 1 46 TYR HB3 H 6.033 -0.951 3.035 1.00 . A A . 46 TYR HB3 1 1 20 14850 1 1 46 TYR HD1 H 5.835 -0.659 -0.663 1.00 . A A . 46 TYR HD1 1 1 20 14851 1 1 46 TYR HD2 H 5.081 1.254 3.067 1.00 . A A . 46 TYR HD2 1 1 20 14852 1 1 46 TYR HE1 H 4.546 1.157 -1.809 1.00 . A A . 46 TYR HE1 1 1 20 14853 1 1 46 TYR HE2 H 3.840 3.001 1.906 1.00 . A A . 46 TYR HE2 1 1 20 14854 1 1 46 TYR HH H 2.855 2.722 -1.203 1.00 . A A . 46 TYR HH 1 1 20 14855 1 1 46 TYR N N 8.674 -1.474 2.798 1.00 . A A . 46 TYR N 1 1 20 14856 1 1 46 TYR O O 7.733 1.432 3.371 1.00 . A A . 46 TYR O 1 1 20 14857 1 1 46 TYR OH O 3.486 3.147 -0.621 1.00 . A A . 46 TYR OH 1 1 20 14858 1 1 47 ILE C C 8.276 3.614 0.585 1.00 . A A . 47 ILE C 1 1 20 14859 1 1 47 ILE CA C 9.193 2.935 1.604 1.00 . A A . 47 ILE CA 1 1 20 14860 1 1 47 ILE CB C 10.682 3.250 1.300 1.00 . A A . 47 ILE CB 1 1 20 14861 1 1 47 ILE CD1 C 11.428 2.669 3.706 1.00 . A A . 47 ILE CD1 1 1 20 14862 1 1 47 ILE CG1 C 11.616 2.424 2.218 1.00 . A A . 47 ILE CG1 1 1 20 14863 1 1 47 ILE CG2 C 10.947 4.728 1.490 1.00 . A A . 47 ILE CG2 1 1 20 14864 1 1 47 ILE H H 9.288 0.903 0.846 1.00 . A A . 47 ILE H 1 1 20 14865 1 1 47 ILE HA H 8.932 3.270 2.599 1.00 . A A . 47 ILE HA 1 1 20 14866 1 1 47 ILE HB H 10.895 2.998 0.270 1.00 . A A . 47 ILE HB 1 1 20 14867 1 1 47 ILE HD11 H 10.416 2.419 3.985 1.00 . A A . 47 ILE HD11 1 1 20 14868 1 1 47 ILE HD12 H 11.615 3.709 3.927 1.00 . A A . 47 ILE HD12 1 1 20 14869 1 1 47 ILE HD13 H 12.110 2.049 4.270 1.00 . A A . 47 ILE HD13 1 1 20 14870 1 1 47 ILE HG12 H 11.428 1.374 2.048 1.00 . A A . 47 ILE HG12 1 1 20 14871 1 1 47 ILE HG13 H 12.642 2.651 1.967 1.00 . A A . 47 ILE HG13 1 1 20 14872 1 1 47 ILE HG21 H 10.337 5.300 0.802 1.00 . A A . 47 ILE HG21 1 1 20 14873 1 1 47 ILE HG22 H 11.992 4.958 1.329 1.00 . A A . 47 ILE HG22 1 1 20 14874 1 1 47 ILE HG23 H 10.657 4.955 2.511 1.00 . A A . 47 ILE HG23 1 1 20 14875 1 1 47 ILE N N 8.938 1.529 1.512 1.00 . A A . 47 ILE N 1 1 20 14876 1 1 47 ILE O O 8.032 3.052 -0.481 1.00 . A A . 47 ILE O 1 1 20 14877 1 1 48 CYS C C 7.516 6.537 -0.756 1.00 . A A . 48 CYS C 1 1 20 14878 1 1 48 CYS CA C 6.808 5.415 -0.024 1.00 . A A . 48 CYS CA 1 1 20 14879 1 1 48 CYS CB C 5.611 6.023 0.722 1.00 . A A . 48 CYS CB 1 1 20 14880 1 1 48 CYS H H 7.960 5.349 1.660 1.00 . A A . 48 CYS H 1 1 20 14881 1 1 48 CYS HA H 6.456 4.683 -0.736 1.00 . A A . 48 CYS HA 1 1 20 14882 1 1 48 CYS HB2 H 4.824 6.206 0.007 1.00 . A A . 48 CYS HB2 1 1 20 14883 1 1 48 CYS HB3 H 5.262 5.331 1.469 1.00 . A A . 48 CYS HB3 1 1 20 14884 1 1 48 CYS N N 7.741 4.793 0.890 1.00 . A A . 48 CYS N 1 1 20 14885 1 1 48 CYS O O 8.664 6.862 -0.439 1.00 . A A . 48 CYS O 1 1 20 14886 1 1 48 CYS SG S 5.966 7.611 1.530 1.00 . A A . 48 CYS SG 1 1 20 14887 1 1 49 ILE C C 7.829 9.434 -1.583 1.00 . A A . 49 ILE C 1 1 20 14888 1 1 49 ILE CA C 7.276 8.267 -2.458 1.00 . A A . 49 ILE CA 1 1 20 14889 1 1 49 ILE CB C 6.154 8.762 -3.404 1.00 . A A . 49 ILE CB 1 1 20 14890 1 1 49 ILE CD1 C 5.651 10.402 -5.251 1.00 . A A . 49 ILE CD1 1 1 20 14891 1 1 49 ILE CG1 C 6.656 9.913 -4.259 1.00 . A A . 49 ILE CG1 1 1 20 14892 1 1 49 ILE CG2 C 4.889 9.145 -2.632 1.00 . A A . 49 ILE CG2 1 1 20 14893 1 1 49 ILE H H 5.899 6.806 -1.837 1.00 . A A . 49 ILE H 1 1 20 14894 1 1 49 ILE HA H 8.090 7.939 -3.086 1.00 . A A . 49 ILE HA 1 1 20 14895 1 1 49 ILE HB H 5.885 7.941 -4.053 1.00 . A A . 49 ILE HB 1 1 20 14896 1 1 49 ILE HD11 H 5.407 9.562 -5.885 1.00 . A A . 49 ILE HD11 1 1 20 14897 1 1 49 ILE HD12 H 6.047 11.216 -5.837 1.00 . A A . 49 ILE HD12 1 1 20 14898 1 1 49 ILE HD13 H 4.768 10.708 -4.715 1.00 . A A . 49 ILE HD13 1 1 20 14899 1 1 49 ILE HG12 H 6.909 10.719 -3.590 1.00 . A A . 49 ILE HG12 1 1 20 14900 1 1 49 ILE HG13 H 7.544 9.606 -4.791 1.00 . A A . 49 ILE HG13 1 1 20 14901 1 1 49 ILE HG21 H 4.132 9.495 -3.319 1.00 . A A . 49 ILE HG21 1 1 20 14902 1 1 49 ILE HG22 H 5.135 9.951 -1.958 1.00 . A A . 49 ILE HG22 1 1 20 14903 1 1 49 ILE HG23 H 4.521 8.293 -2.082 1.00 . A A . 49 ILE HG23 1 1 20 14904 1 1 49 ILE N N 6.797 7.157 -1.674 1.00 . A A . 49 ILE N 1 1 20 14905 1 1 49 ILE O O 8.838 10.039 -1.915 1.00 . A A . 49 ILE O 1 1 20 14906 1 1 50 ASN C C 8.678 10.380 1.420 1.00 . A A . 50 ASN C 1 1 20 14907 1 1 50 ASN CA C 7.604 10.822 0.431 1.00 . A A . 50 ASN CA 1 1 20 14908 1 1 50 ASN CB C 6.431 11.500 1.169 1.00 . A A . 50 ASN CB 1 1 20 14909 1 1 50 ASN CG C 5.405 12.142 0.248 1.00 . A A . 50 ASN CG 1 1 20 14910 1 1 50 ASN H H 6.398 9.179 -0.167 1.00 . A A . 50 ASN H 1 1 20 14911 1 1 50 ASN HA H 8.065 11.537 -0.230 1.00 . A A . 50 ASN HA 1 1 20 14912 1 1 50 ASN HB2 H 5.916 10.773 1.781 1.00 . A A . 50 ASN HB2 1 1 20 14913 1 1 50 ASN HB3 H 6.843 12.271 1.801 1.00 . A A . 50 ASN HB3 1 1 20 14914 1 1 50 ASN HD21 H 4.230 10.535 0.353 1.00 . A A . 50 ASN HD21 1 1 20 14915 1 1 50 ASN HD22 H 3.675 11.863 -0.610 1.00 . A A . 50 ASN HD22 1 1 20 14916 1 1 50 ASN N N 7.174 9.712 -0.438 1.00 . A A . 50 ASN N 1 1 20 14917 1 1 50 ASN ND2 N 4.334 11.432 -0.031 1.00 . A A . 50 ASN ND2 1 1 20 14918 1 1 50 ASN O O 9.488 11.178 1.857 1.00 . A A . 50 ASN O 1 1 20 14919 1 1 50 ASN OD1 O 5.551 13.283 -0.166 1.00 . A A . 50 ASN OD1 1 1 20 14920 1 1 51 CYS C C 11.074 8.469 1.907 1.00 . A A . 51 CYS C 1 1 20 14921 1 1 51 CYS CA C 9.727 8.556 2.641 1.00 . A A . 51 CYS CA 1 1 20 14922 1 1 51 CYS CB C 9.354 7.159 3.197 1.00 . A A . 51 CYS CB 1 1 20 14923 1 1 51 CYS H H 7.998 8.504 1.394 1.00 . A A . 51 CYS H 1 1 20 14924 1 1 51 CYS HA H 9.817 9.252 3.459 1.00 . A A . 51 CYS HA 1 1 20 14925 1 1 51 CYS HB2 H 8.970 6.555 2.389 1.00 . A A . 51 CYS HB2 1 1 20 14926 1 1 51 CYS HB3 H 10.255 6.681 3.555 1.00 . A A . 51 CYS HB3 1 1 20 14927 1 1 51 CYS N N 8.689 9.092 1.760 1.00 . A A . 51 CYS N 1 1 20 14928 1 1 51 CYS O O 12.123 8.513 2.515 1.00 . A A . 51 CYS O 1 1 20 14929 1 1 51 CYS SG S 8.123 7.078 4.535 1.00 . A A . 51 CYS SG 1 1 20 14930 1 1 52 ALA C C 12.865 9.564 -0.548 1.00 . A A . 52 ALA C 1 1 20 14931 1 1 52 ALA CA C 12.231 8.217 -0.209 1.00 . A A . 52 ALA CA 1 1 20 14932 1 1 52 ALA CB C 11.931 7.429 -1.464 1.00 . A A . 52 ALA CB 1 1 20 14933 1 1 52 ALA H H 10.126 8.389 0.195 1.00 . A A . 52 ALA H 1 1 20 14934 1 1 52 ALA HA H 12.940 7.654 0.379 1.00 . A A . 52 ALA HA 1 1 20 14935 1 1 52 ALA HB1 H 12.847 7.247 -2.008 1.00 . A A . 52 ALA HB1 1 1 20 14936 1 1 52 ALA HB2 H 11.240 7.990 -2.075 1.00 . A A . 52 ALA HB2 1 1 20 14937 1 1 52 ALA HB3 H 11.477 6.495 -1.164 1.00 . A A . 52 ALA HB3 1 1 20 14938 1 1 52 ALA N N 11.018 8.357 0.600 1.00 . A A . 52 ALA N 1 1 20 14939 2 2 1 ZN ZN ZN 6.000 7.399 3.804 1.00 . B A . 53 ZN ZN 1 1 20 14940 3 2 1 ZN ZN ZN -5.253 2.978 -2.000 1.00 . C A . 54 ZN ZN 1 1 stop_ save_
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