NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
569105 | 2md7 | 19472 | cing | 4-filtered-FRED | STAR | entry | full | 745 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2md7 # This FRED archive file contains, for PDB entry <2md7>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2md7 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2md7 _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "disulfide and other bound" _Assembly.Molecular_mass 6546.02 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 $Nuclear_body_protein_SP140 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_Nuclear_body_protein_SP140 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Nuclear body protein SP140" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GAMGMRNLDECEVCRDGGELFCCDTCSRVFHEDCHIPPVEAERTPWNCIFCRMKES _Entity.Number_of_monomers 56 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 ALA . 1 1 3 MET . 1 1 4 GLY . 1 1 5 MET . 1 1 6 ARG . 1 1 7 ASN . 1 1 8 LEU . 1 1 9 ASP . 1 1 10 GLU . 1 1 11 CYS . 1 1 12 GLU . 1 1 13 VAL . 1 1 14 CYS . 1 1 15 ARG . 1 1 16 ASP . 1 1 17 GLY . 1 1 18 GLY . 1 1 19 GLU . 1 1 20 LEU . 1 1 21 PHE . 1 1 22 CYS . 1 1 23 CYS . 1 1 24 ASP . 1 1 25 THR . 1 1 26 CYS . 1 1 27 SER . 1 1 28 ARG . 1 1 29 VAL . 1 1 30 PHE . 1 1 31 HIS . 1 1 32 GLU . 1 1 33 ASP . 1 1 34 CYS . 1 1 35 HIS . 1 1 36 ILE . 1 1 37 PRO . 1 1 38 PRO . 1 1 39 VAL . 1 1 40 GLU . 1 1 41 ALA . 1 1 42 GLU . 1 1 43 ARG . 1 1 44 THR . 1 1 45 PRO . 1 1 46 TRP . 1 1 47 ASN . 1 1 48 CYS . 1 1 49 ILE . 1 1 50 PHE . 1 1 51 CYS . 1 1 52 ARG . 1 1 53 MET . 1 1 54 LYS . 1 1 55 GLU . 1 1 56 SER . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 ALA 2 2 1 1 MET 3 3 1 1 GLY 4 4 1 1 MET 5 5 1 1 ARG 6 6 1 1 ASN 7 7 1 1 LEU 8 8 1 1 ASP 9 9 1 1 GLU 10 10 1 1 CYS 11 11 1 1 GLU 12 12 1 1 VAL 13 13 1 1 CYS 14 14 1 1 ARG 15 15 1 1 ASP 16 16 1 1 GLY 17 17 1 1 GLY 18 18 1 1 GLU 19 19 1 1 LEU 20 20 1 1 PHE 21 21 1 1 CYS 22 22 1 1 CYS 23 23 1 1 ASP 24 24 1 1 THR 25 25 1 1 CYS 26 26 1 1 SER 27 27 1 1 ARG 28 28 1 1 VAL 29 29 1 1 PHE 30 30 1 1 HIS 31 31 1 1 GLU 32 32 1 1 ASP 33 33 1 1 CYS 34 34 1 1 HIS 35 35 1 1 ILE 36 36 1 1 PRO 37 37 1 1 PRO 38 38 1 1 VAL 39 39 1 1 GLU 40 40 1 1 ALA 41 41 1 1 GLU 42 42 1 1 ARG 43 43 1 1 THR 44 44 1 1 PRO 45 45 1 1 TRP 46 46 1 1 ASN 47 47 1 1 CYS 48 48 1 1 ILE 49 49 1 1 PHE 50 50 1 1 CYS 51 51 1 1 ARG 52 52 1 1 MET 53 53 1 1 LYS 54 54 1 1 GLU 55 55 1 1 SER 56 56 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_4_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 2 . OR 1 1 9 2 . 3 . 1 1 9 3 . . . 1 1 10 1 2 . OR 1 1 10 2 . 3 . 1 1 10 3 . . . 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 2 . OR 1 1 34 2 . 3 . 1 1 34 3 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 2 . OR 1 1 37 2 . 3 . 1 1 37 3 . . . 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 2 . OR 1 1 185 2 . 3 . 1 1 185 3 . . . 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 2 . OR 1 1 381 2 . 3 . 1 1 381 3 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 2 . OR 1 1 384 2 . 3 . 1 1 384 3 . . . 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 2 . OR 1 1 491 2 . 3 . 1 1 491 3 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 . . . 1 1 557 1 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 1 . . . 1 1 673 1 . . . 1 1 674 1 . . . 1 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 2 . OR 1 1 716 2 . 3 . 1 1 716 3 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 725 1 . . . 1 1 726 1 . . . 1 1 727 1 . . . 1 1 728 1 . . . 1 1 729 1 . . . 1 1 730 1 . . . 1 1 731 1 . . . 1 1 732 1 . . . 1 1 733 1 . . . 1 1 734 1 . . . 1 1 735 1 . . . 1 1 736 1 . . . 1 1 737 1 . . . 1 1 738 1 . . . 1 1 739 1 . . . 1 1 740 1 . . . 1 1 741 1 . . . 1 1 742 1 . . . 1 1 743 1 . . . 1 1 744 1 . . . 1 1 745 1 . . . 1 1 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 1 GLY HA3 B 1 . HA2 1 1 1 1 2 1 1 2 ALA H B 2 . HN 1 1 2 1 1 1 1 2 ALA H B 2 . HN 1 1 2 1 2 1 1 2 ALA MB B 2 . HB1 1 1 3 1 1 1 1 2 ALA HA B 2 . HA 1 1 3 1 2 1 1 2 ALA MB B 2 . HB1 1 1 4 1 1 1 1 2 ALA HA B 2 . HA 1 1 4 1 2 1 1 3 MET H B 3 . HN 1 1 5 1 1 1 1 2 ALA HA B 2 . HA 1 1 5 1 2 1 1 3 MET QB B 3 . HB1 1 1 6 1 1 1 1 2 ALA MB B 2 . HB1 1 1 6 1 2 1 1 3 MET H B 3 . HN 1 1 7 1 1 1 1 3 MET H B 3 . HN 1 1 7 1 2 1 1 3 MET QB B 3 . HB1 1 1 8 1 1 1 1 3 MET H B 3 . HN 1 1 8 1 2 1 1 3 MET QG B 3 . HG1 1 1 9 2 1 1 1 3 MET HA B 3 . HA 1 1 9 2 2 1 1 3 MET QB B 3 . HB1 1 1 9 3 1 1 1 5 MET HA B 5 . HA 1 1 9 3 2 1 1 5 MET HB2 B 5 . HB1 1 1 10 2 1 1 1 3 MET HA B 3 . HA 1 1 10 2 2 1 1 3 MET HG2 B 3 . HG1 1 1 10 3 1 1 1 5 MET HA B 5 . HA 1 1 10 3 2 1 1 5 MET HG3 B 5 . HG2 1 1 11 1 1 1 1 3 MET HA B 3 . HA 1 1 11 1 2 1 1 4 GLY H B 4 . HN 1 1 12 1 1 1 1 3 MET QB B 3 . HB1 1 1 12 1 2 1 1 4 GLY H B 4 . HN 1 1 13 1 1 1 1 3 MET QB B 3 . HB1 1 1 13 1 2 1 1 4 GLY QA B 4 . HA1 1 1 14 1 1 1 1 3 MET HG2 B 3 . HG1 1 1 14 1 1 1 1 5 MET HG3 B 5 . HG2 1 1 14 1 2 1 1 4 GLY H B 4 . HN 1 1 15 1 1 1 1 3 MET HG3 B 3 . HG2 1 1 15 1 1 1 1 5 MET HG2 B 5 . HG1 1 1 15 1 2 1 1 4 GLY H B 4 . HN 1 1 16 1 1 1 1 4 GLY H B 4 . HN 1 1 16 1 2 1 1 4 GLY QA B 4 . HA1 1 1 17 1 1 1 1 4 GLY QA B 4 . HA1 1 1 17 1 2 1 1 5 MET H B 5 . HN 1 1 18 1 1 1 1 5 MET H B 5 . HN 1 1 18 1 2 1 1 5 MET HA B 5 . HA 1 1 19 1 1 1 1 5 MET H B 5 . HN 1 1 19 1 2 1 1 5 MET HB2 B 5 . HB1 1 1 20 1 1 1 1 5 MET H B 5 . HN 1 1 20 1 2 1 1 5 MET QG B 5 . HG1 1 1 21 1 1 1 1 5 MET HA B 5 . HA 1 1 21 1 2 1 1 5 MET HB2 B 5 . HB1 1 1 22 1 1 1 1 5 MET HA B 5 . HA 1 1 22 1 2 1 1 6 ARG H B 6 . HN 1 1 23 1 1 1 1 5 MET QB B 5 . HB1 1 1 23 1 2 1 1 6 ARG H B 6 . HN 1 1 24 1 1 1 1 5 MET HB2 B 5 . HB1 1 1 24 1 2 1 1 5 MET HG3 B 5 . HG2 1 1 25 1 1 1 1 5 MET QG B 5 . HG1 1 1 25 1 2 1 1 6 ARG H B 6 . HN 1 1 26 1 1 1 1 6 ARG H B 6 . HN 1 1 26 1 2 1 1 6 ARG QB B 6 . HB1 1 1 27 1 1 1 1 6 ARG H B 6 . HN 1 1 27 1 2 1 1 6 ARG QD B 6 . HD1 1 1 28 1 1 1 1 6 ARG H B 6 . HN 1 1 28 1 2 1 1 6 ARG QG B 6 . HG1 1 1 29 1 1 1 1 6 ARG H B 6 . HN 1 1 29 1 2 1 1 7 ASN H B 7 . HN 1 1 30 1 1 1 1 6 ARG HA B 6 . HA 1 1 30 1 2 1 1 6 ARG QB B 6 . HB1 1 1 31 1 1 1 1 6 ARG HA B 6 . HA 1 1 31 1 2 1 1 6 ARG QD B 6 . HD1 1 1 32 1 1 1 1 6 ARG HA B 6 . HA 1 1 32 1 2 1 1 6 ARG QG B 6 . HG1 1 1 33 1 1 1 1 6 ARG HA B 6 . HA 1 1 33 1 2 1 1 7 ASN H B 7 . HN 1 1 34 2 1 1 1 6 ARG QB B 6 . HB1 1 1 34 2 2 1 1 6 ARG HD2 B 6 . HD1 1 1 34 3 1 1 1 6 ARG HB2 B 6 . HB1 1 1 34 3 2 1 1 6 ARG HD3 B 6 . HD2 1 1 35 1 1 1 1 6 ARG HB2 B 6 . HB1 1 1 35 1 2 1 1 7 ASN H B 7 . HN 1 1 36 1 1 1 1 6 ARG HB2 B 6 . HB1 1 1 36 1 2 1 1 8 LEU H B 8 . HN 1 1 37 2 1 1 1 6 ARG QD B 6 . HD1 1 1 37 2 2 1 1 6 ARG HG3 B 6 . HG2 1 1 37 3 1 1 1 6 ARG HD3 B 6 . HD2 1 1 37 3 2 1 1 6 ARG HG2 B 6 . HG1 1 1 38 1 1 1 1 6 ARG QD B 6 . HD1 1 1 38 1 2 1 1 8 LEU MD1 B 8 . HD21 1 1 39 1 1 1 1 6 ARG QG B 6 . HG1 1 1 39 1 2 1 1 7 ASN H B 7 . HN 1 1 40 1 1 1 1 7 ASN H B 7 . HN 1 1 40 1 2 1 1 7 ASN HB2 B 7 . HB2 1 1 41 1 1 1 1 7 ASN H B 7 . HN 1 1 41 1 2 1 1 7 ASN HB3 B 7 . HB1 1 1 42 1 1 1 1 7 ASN HA B 7 . HA 1 1 42 1 2 1 1 7 ASN HB2 B 7 . HB2 1 1 43 1 1 1 1 7 ASN HA B 7 . HA 1 1 43 1 2 1 1 7 ASN HB3 B 7 . HB1 1 1 44 1 1 1 1 7 ASN HB2 B 7 . HB2 1 1 44 1 2 1 1 7 ASN HD21 B 7 . HD21 1 1 45 1 1 1 1 7 ASN HB2 B 7 . HB2 1 1 45 1 2 1 1 7 ASN HD22 B 7 . HD22 1 1 46 1 1 1 1 7 ASN HB2 B 7 . HB2 1 1 46 1 2 1 1 8 LEU H B 8 . HN 1 1 47 1 1 1 1 7 ASN HB3 B 7 . HB1 1 1 47 1 2 1 1 7 ASN HD22 B 7 . HD22 1 1 48 1 1 1 1 7 ASN HB3 B 7 . HB1 1 1 48 1 2 1 1 8 LEU H B 8 . HN 1 1 49 1 1 1 1 7 ASN HB3 B 7 . HB1 1 1 49 1 2 1 1 9 ASP H B 9 . HN 1 1 50 1 1 1 1 7 ASN HD21 B 7 . HD21 1 1 50 1 2 1 1 10 GLU QB B 10 . HB1 1 1 51 1 1 1 1 7 ASN HD21 B 7 . HD21 1 1 51 1 2 1 1 10 GLU QG B 10 . HG1 1 1 52 1 1 1 1 7 ASN HD22 B 7 . HD22 1 1 52 1 2 1 1 10 GLU HB2 B 10 . HB1 1 1 53 1 1 1 1 7 ASN HD22 B 7 . HD22 1 1 53 1 2 1 1 10 GLU QG B 10 . HG1 1 1 54 1 1 1 1 8 LEU H B 8 . HN 1 1 54 1 2 1 1 8 LEU HA B 8 . HA 1 1 55 1 1 1 1 8 LEU H B 8 . HN 1 1 55 1 2 1 1 8 LEU MD1 B 8 . HD21 1 1 56 1 1 1 1 8 LEU H B 8 . HN 1 1 56 1 2 1 1 8 LEU HG B 8 . HG 1 1 57 1 1 1 1 8 LEU HA B 8 . HA 1 1 57 1 2 1 1 8 LEU QD B 8 . HD11 1 1 58 1 1 1 1 8 LEU HA B 8 . HA 1 1 58 1 2 1 1 8 LEU MD2 B 8 . HD11 1 1 59 1 1 1 1 8 LEU HA B 8 . HA 1 1 59 1 2 1 1 9 ASP H B 9 . HN 1 1 60 1 1 1 1 8 LEU HA B 8 . HA 1 1 60 1 2 1 1 11 CYS H B 11 . HN 1 1 61 1 1 1 1 8 LEU QB B 8 . HB2 1 1 61 1 2 1 1 8 LEU MD2 B 8 . HD11 1 1 62 1 1 1 1 8 LEU QB B 8 . HB2 1 1 62 1 1 1 1 8 LEU HG B 8 . HG 1 1 62 1 2 1 1 8 LEU MD2 B 8 . HD11 1 1 63 1 1 1 1 8 LEU QB B 8 . HB1 1 1 63 1 1 1 1 8 LEU HG B 8 . HG 1 1 63 1 2 1 1 9 ASP H B 9 . HN 1 1 64 1 1 1 1 8 LEU QB B 8 . HB1 1 1 64 1 1 1 1 8 LEU HG B 8 . HG 1 1 64 1 2 1 1 10 GLU H B 10 . HN 1 1 65 1 1 1 1 8 LEU QB B 8 . HB2 1 1 65 1 2 1 1 11 CYS HB2 B 11 . HB1 1 1 66 1 1 1 1 8 LEU QB B 8 . HB2 1 1 66 1 2 1 1 11 CYS HB3 B 11 . HB2 1 1 67 1 1 1 1 8 LEU QB B 8 . HB2 1 1 67 1 1 1 1 15 ARG HG3 B 15 . HG2 1 1 67 1 2 1 1 14 CYS HB2 B 14 . HB1 1 1 68 1 1 1 1 8 LEU QB B 8 . HB2 1 1 68 1 2 1 1 31 HIS HE1 B 31 . HE1 1 1 69 1 1 1 1 8 LEU MD1 B 8 . HD21 1 1 69 1 2 1 1 9 ASP H B 9 . HN 1 1 70 1 1 1 1 8 LEU MD1 B 8 . HD21 1 1 70 1 2 1 1 14 CYS HB2 B 14 . HB1 1 1 71 1 1 1 1 8 LEU MD1 B 8 . HD21 1 1 71 1 2 1 1 14 CYS HB3 B 14 . HB2 1 1 72 1 1 1 1 8 LEU MD2 B 8 . HD11 1 1 72 1 2 1 1 8 LEU HG B 8 . HG 1 1 73 1 1 1 1 9 ASP H B 9 . HN 1 1 73 1 2 1 1 9 ASP HB2 B 9 . HB1 1 1 74 1 1 1 1 9 ASP H B 9 . HN 1 1 74 1 2 1 1 10 GLU H B 10 . HN 1 1 75 1 1 1 1 9 ASP HA B 9 . HA 1 1 75 1 2 1 1 9 ASP HB2 B 9 . HB1 1 1 76 1 1 1 1 9 ASP HA B 9 . HA 1 1 76 1 2 1 1 9 ASP QB B 9 . HB1 1 1 77 1 1 1 1 9 ASP HA B 9 . HA 1 1 77 1 2 1 1 9 ASP HB3 B 9 . HB2 1 1 78 1 1 1 1 9 ASP HA B 9 . HA 1 1 78 1 2 1 1 10 GLU H B 10 . HN 1 1 79 1 1 1 1 9 ASP QB B 9 . HB1 1 1 79 1 2 1 1 10 GLU H B 10 . HN 1 1 80 1 1 1 1 9 ASP QB B 9 . HB1 1 1 80 1 2 1 1 11 CYS H B 11 . HN 1 1 81 1 1 1 1 10 GLU H B 10 . HN 1 1 81 1 2 1 1 10 GLU HA B 10 . HA 1 1 82 1 1 1 1 10 GLU H B 10 . HN 1 1 82 1 2 1 1 10 GLU HB2 B 10 . HB1 1 1 83 1 1 1 1 10 GLU H B 10 . HN 1 1 83 1 2 1 1 10 GLU QG B 10 . HG1 1 1 84 1 1 1 1 10 GLU H B 10 . HN 1 1 84 1 2 1 1 11 CYS HB2 B 11 . HB1 1 1 85 1 1 1 1 10 GLU H B 10 . HN 1 1 85 1 2 1 1 11 CYS HB3 B 11 . HB2 1 1 86 1 1 1 1 10 GLU HA B 10 . HA 1 1 86 1 2 1 1 10 GLU HB3 B 10 . HB2 1 1 87 1 1 1 1 10 GLU HA B 10 . HA 1 1 87 1 2 1 1 11 CYS H B 11 . HN 1 1 88 1 1 1 1 10 GLU QB B 10 . HB1 1 1 88 1 2 1 1 11 CYS H B 11 . HN 1 1 89 1 1 1 1 10 GLU QB B 10 . HB1 1 1 89 1 2 1 1 11 CYS HA B 11 . HA 1 1 90 1 1 1 1 10 GLU QG B 10 . HG1 1 1 90 1 2 1 1 11 CYS H B 11 . HN 1 1 91 1 1 1 1 10 GLU HG2 B 10 . HG1 1 1 91 1 2 1 1 11 CYS H B 11 . HN 1 1 92 1 1 1 1 11 CYS H B 11 . HN 1 1 92 1 2 1 1 11 CYS HA B 11 . HA 1 1 93 1 1 1 1 11 CYS H B 11 . HN 1 1 93 1 2 1 1 11 CYS HB2 B 11 . HB1 1 1 94 1 1 1 1 11 CYS H B 11 . HN 1 1 94 1 2 1 1 11 CYS HB3 B 11 . HB2 1 1 95 1 1 1 1 11 CYS H B 11 . HN 1 1 95 1 2 1 1 12 GLU H B 12 . HN 1 1 96 1 1 1 1 11 CYS HA B 11 . HA 1 1 96 1 2 1 1 11 CYS HB2 B 11 . HB1 1 1 97 1 1 1 1 11 CYS HA B 11 . HA 1 1 97 1 2 1 1 12 GLU H B 12 . HN 1 1 98 1 1 1 1 11 CYS HA B 11 . HA 1 1 98 1 2 1 1 13 VAL H B 13 . HN 1 1 99 1 1 1 1 11 CYS HB2 B 11 . HB1 1 1 99 1 2 1 1 12 GLU H B 12 . HN 1 1 100 1 1 1 1 11 CYS HB2 B 11 . HB1 1 1 100 1 2 1 1 13 VAL H B 13 . HN 1 1 101 1 1 1 1 11 CYS HB2 B 11 . HB1 1 1 101 1 2 1 1 13 VAL QG B 13 . HG11 1 1 102 1 1 1 1 11 CYS HB2 B 11 . HB1 1 1 102 1 2 1 1 31 HIS HD2 B 31 . HD2 1 1 103 1 1 1 1 11 CYS HB3 B 11 . HB2 1 1 103 1 2 1 1 12 GLU H B 12 . HN 1 1 104 1 1 1 1 11 CYS HB3 B 11 . HB2 1 1 104 1 2 1 1 13 VAL H B 13 . HN 1 1 105 1 1 1 1 12 GLU H B 12 . HN 1 1 105 1 2 1 1 12 GLU HA B 12 . HA 1 1 106 1 1 1 1 12 GLU H B 12 . HN 1 1 106 1 2 1 1 12 GLU QB B 12 . HB1 1 1 107 1 1 1 1 12 GLU H B 12 . HN 1 1 107 1 2 1 1 12 GLU QG B 12 . HG1 1 1 108 1 1 1 1 12 GLU H B 12 . HN 1 1 108 1 2 1 1 13 VAL H B 13 . HN 1 1 109 1 1 1 1 12 GLU H B 12 . HN 1 1 109 1 2 1 1 13 VAL HA B 13 . HA 1 1 110 1 1 1 1 12 GLU H B 12 . HN 1 1 110 1 2 1 1 13 VAL HB B 13 . HB 1 1 111 1 1 1 1 12 GLU H B 12 . HN 1 1 111 1 2 1 1 13 VAL QG B 13 . HG11 1 1 112 1 1 1 1 12 GLU H B 12 . HN 1 1 112 1 2 1 1 14 CYS H B 14 . HN 1 1 113 1 1 1 1 12 GLU HA B 12 . HA 1 1 113 1 2 1 1 12 GLU HB2 B 12 . HB2 1 1 114 1 1 1 1 12 GLU HA B 12 . HA 1 1 114 1 2 1 1 12 GLU QB B 12 . HB1 1 1 115 1 1 1 1 12 GLU HA B 12 . HA 1 1 115 1 2 1 1 12 GLU HB3 B 12 . HB1 1 1 116 1 1 1 1 12 GLU HA B 12 . HA 1 1 116 1 2 1 1 12 GLU QG B 12 . HG1 1 1 117 1 1 1 1 12 GLU HA B 12 . HA 1 1 117 1 2 1 1 13 VAL H B 13 . HN 1 1 118 1 1 1 1 12 GLU HA B 12 . HA 1 1 118 1 2 1 1 14 CYS H B 14 . HN 1 1 119 1 1 1 1 12 GLU HA B 12 . HA 1 1 119 1 2 1 1 15 ARG H B 15 . HN 1 1 120 1 1 1 1 12 GLU HA B 12 . HA 1 1 120 1 2 1 1 15 ARG QD B 15 . HD1 1 1 121 1 1 1 1 12 GLU HA B 12 . HA 1 1 121 1 2 1 1 15 ARG HG3 B 15 . HG2 1 1 122 1 1 1 1 12 GLU HB2 B 12 . HB2 1 1 122 1 2 1 1 13 VAL H B 13 . HN 1 1 123 1 1 1 1 12 GLU HB2 B 12 . HB2 1 1 123 1 2 1 1 13 VAL HA B 13 . HA 1 1 124 1 1 1 1 12 GLU HB2 B 12 . HB2 1 1 124 1 2 1 1 13 VAL QG B 13 . HG11 1 1 125 1 1 1 1 12 GLU QG B 12 . HG1 1 1 125 1 2 1 1 13 VAL H B 13 . HN 1 1 126 1 1 1 1 12 GLU QG B 12 . HG1 1 1 126 1 2 1 1 13 VAL QG B 13 . HG11 1 1 127 1 1 1 1 13 VAL H B 13 . HN 1 1 127 1 2 1 1 13 VAL HA B 13 . HA 1 1 128 1 1 1 1 13 VAL H B 13 . HN 1 1 128 1 2 1 1 13 VAL HB B 13 . HB 1 1 129 1 1 1 1 13 VAL H B 13 . HN 1 1 129 1 2 1 1 13 VAL QG B 13 . HG11 1 1 130 1 1 1 1 13 VAL H B 13 . HN 1 1 130 1 2 1 1 14 CYS H B 14 . HN 1 1 131 1 1 1 1 13 VAL H B 13 . HN 1 1 131 1 1 1 1 15 ARG H B 15 . HN 1 1 131 1 2 1 1 14 CYS H B 14 . HN 1 1 132 1 1 1 1 13 VAL HA B 13 . HA 1 1 132 1 2 1 1 13 VAL HB B 13 . HB 1 1 133 1 1 1 1 13 VAL HA B 13 . HA 1 1 133 1 2 1 1 13 VAL QG B 13 . HG21 1 1 134 1 1 1 1 13 VAL HA B 13 . HA 1 1 134 1 2 1 1 14 CYS H B 14 . HN 1 1 135 1 1 1 1 13 VAL HA B 13 . HA 1 1 135 1 2 1 1 15 ARG H B 15 . HN 1 1 136 1 1 1 1 13 VAL HA B 13 . HA 1 1 136 1 2 1 1 16 ASP H B 16 . HN 1 1 137 1 1 1 1 13 VAL HA B 13 . HA 1 1 137 1 2 1 1 16 ASP HB2 B 16 . HB2 1 1 138 1 1 1 1 13 VAL HA B 13 . HA 1 1 138 1 2 1 1 16 ASP HB3 B 16 . HB1 1 1 139 1 1 1 1 13 VAL HB B 13 . HB 1 1 139 1 2 1 1 13 VAL QG B 13 . HG21 1 1 140 1 1 1 1 13 VAL HB B 13 . HB 1 1 140 1 2 1 1 14 CYS H B 14 . HN 1 1 141 1 1 1 1 13 VAL HB B 13 . HB 1 1 141 1 2 1 1 15 ARG H B 15 . HN 1 1 142 1 1 1 1 13 VAL MG1 B 13 . HG11 1 1 142 1 2 1 1 13 VAL MG2 B 13 . HG21 1 1 143 1 1 1 1 13 VAL QG B 13 . HG11 1 1 143 1 2 1 1 14 CYS H B 14 . HN 1 1 144 1 1 1 1 13 VAL QG B 13 . HG21 1 1 144 1 2 1 1 14 CYS HA B 14 . HA 1 1 145 1 1 1 1 13 VAL QG B 13 . HG11 1 1 145 1 2 1 1 15 ARG H B 15 . HN 1 1 146 1 1 1 1 13 VAL QG B 13 . HG21 1 1 146 1 2 1 1 16 ASP H B 16 . HN 1 1 147 1 1 1 1 13 VAL QG B 13 . HG11 1 1 147 1 2 1 1 16 ASP HB2 B 16 . HB2 1 1 148 1 1 1 1 13 VAL QG B 13 . HG21 1 1 148 1 2 1 1 17 GLY H B 17 . HN 1 1 149 1 1 1 1 13 VAL QG B 13 . HG21 1 1 149 1 2 1 1 18 GLY H B 18 . HN 1 1 150 1 1 1 1 13 VAL QG B 13 . HG21 1 1 150 1 2 1 1 18 GLY HA2 B 18 . HA2 1 1 151 1 1 1 1 13 VAL QG B 13 . HG21 1 1 151 1 2 1 1 18 GLY HA3 B 18 . HA1 1 1 152 1 1 1 1 13 VAL QG B 13 . HG21 1 1 152 1 2 1 1 19 GLU H B 19 . HN 1 1 153 1 1 1 1 13 VAL QG B 13 . HG11 1 1 153 1 2 1 1 32 GLU HA B 32 . HA 1 1 154 1 1 1 1 13 VAL QG B 13 . HG11 1 1 154 1 2 1 1 35 HIS HB2 B 35 . HB1 1 1 155 1 1 1 1 13 VAL QG B 13 . HG21 1 1 155 1 2 1 1 35 HIS HB3 B 35 . HB2 1 1 156 1 1 1 1 13 VAL QG B 13 . HG21 1 1 156 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 157 1 1 1 1 13 VAL QG B 13 . HG21 1 1 157 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 158 1 1 1 1 13 VAL QG B 13 . HG21 1 1 158 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 159 1 1 1 1 14 CYS H B 14 . HN 1 1 159 1 2 1 1 14 CYS HA B 14 . HA 1 1 160 1 1 1 1 14 CYS H B 14 . HN 1 1 160 1 2 1 1 14 CYS HB2 B 14 . HB1 1 1 161 1 1 1 1 14 CYS H B 14 . HN 1 1 161 1 2 1 1 14 CYS HB3 B 14 . HB2 1 1 162 1 1 1 1 14 CYS H B 14 . HN 1 1 162 1 2 1 1 15 ARG H B 15 . HN 1 1 163 1 1 1 1 14 CYS H B 14 . HN 1 1 163 1 2 1 1 15 ARG HA B 15 . HA 1 1 164 1 1 1 1 14 CYS H B 14 . HN 1 1 164 1 2 1 1 15 ARG QB B 15 . HB1 1 1 165 1 1 1 1 14 CYS H B 14 . HN 1 1 165 1 2 1 1 16 ASP H B 16 . HN 1 1 166 1 1 1 1 14 CYS HA B 14 . HA 1 1 166 1 2 1 1 14 CYS HB2 B 14 . HB1 1 1 167 1 1 1 1 14 CYS HA B 14 . HA 1 1 167 1 2 1 1 14 CYS HB3 B 14 . HB2 1 1 168 1 1 1 1 14 CYS HA B 14 . HA 1 1 168 1 2 1 1 15 ARG H B 15 . HN 1 1 169 1 1 1 1 14 CYS HA B 14 . HA 1 1 169 1 2 1 1 16 ASP H B 16 . HN 1 1 170 1 1 1 1 14 CYS HA B 14 . HA 1 1 170 1 2 1 1 18 GLY H B 18 . HN 1 1 171 1 1 1 1 14 CYS HA B 14 . HA 1 1 171 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 172 1 1 1 1 14 CYS HB2 B 14 . HB1 1 1 172 1 2 1 1 15 ARG H B 15 . HN 1 1 173 1 1 1 1 14 CYS HB3 B 14 . HB2 1 1 173 1 2 1 1 15 ARG H B 15 . HN 1 1 174 1 1 1 1 15 ARG H B 15 . HN 1 1 174 1 2 1 1 15 ARG HA B 15 . HA 1 1 175 1 1 1 1 15 ARG H B 15 . HN 1 1 175 1 2 1 1 16 ASP H B 16 . HN 1 1 176 1 1 1 1 15 ARG H B 15 . HN 1 1 176 1 2 1 1 16 ASP HB2 B 16 . HB2 1 1 177 1 1 1 1 15 ARG HA B 15 . HA 1 1 177 1 2 1 1 15 ARG QB B 15 . HB1 1 1 178 1 1 1 1 15 ARG HA B 15 . HA 1 1 178 1 2 1 1 15 ARG QD B 15 . HD1 1 1 179 1 1 1 1 15 ARG HA B 15 . HA 1 1 179 1 2 1 1 15 ARG HG2 B 15 . HG1 1 1 180 1 1 1 1 15 ARG HA B 15 . HA 1 1 180 1 2 1 1 15 ARG HG3 B 15 . HG2 1 1 181 1 1 1 1 15 ARG HA B 15 . HA 1 1 181 1 2 1 1 16 ASP H B 16 . HN 1 1 182 1 1 1 1 15 ARG HA B 15 . HA 1 1 182 1 2 1 1 16 ASP HA B 16 . HA 1 1 183 1 1 1 1 15 ARG HA B 15 . HA 1 1 183 1 2 1 1 16 ASP HB3 B 16 . HB1 1 1 184 1 1 1 1 15 ARG HA B 15 . HA 1 1 184 1 2 1 1 17 GLY H B 17 . HN 1 1 185 2 1 1 1 15 ARG QB B 15 . HB1 1 1 185 2 2 1 1 15 ARG HD2 B 15 . HD1 1 1 185 3 1 1 1 15 ARG HB3 B 15 . HB2 1 1 185 3 2 1 1 15 ARG HD3 B 15 . HD2 1 1 186 1 1 1 1 15 ARG QB B 15 . HB1 1 1 186 1 2 1 1 17 GLY H B 17 . HN 1 1 187 1 1 1 1 15 ARG HB3 B 15 . HB2 1 1 187 1 2 1 1 16 ASP H B 16 . HN 1 1 188 1 1 1 1 15 ARG QD B 15 . HD1 1 1 188 1 2 1 1 15 ARG HG2 B 15 . HG1 1 1 189 1 1 1 1 15 ARG QD B 15 . HD1 1 1 189 1 2 1 1 15 ARG HG3 B 15 . HG2 1 1 190 1 1 1 1 15 ARG QD B 15 . HD1 1 1 190 1 2 1 1 16 ASP H B 16 . HN 1 1 191 1 1 1 1 15 ARG HG3 B 15 . HG2 1 1 191 1 2 1 1 16 ASP H B 16 . HN 1 1 192 1 1 1 1 16 ASP H B 16 . HN 1 1 192 1 2 1 1 16 ASP HA B 16 . HA 1 1 193 1 1 1 1 16 ASP H B 16 . HN 1 1 193 1 2 1 1 16 ASP HB2 B 16 . HB2 1 1 194 1 1 1 1 16 ASP H B 16 . HN 1 1 194 1 2 1 1 16 ASP HB3 B 16 . HB1 1 1 195 1 1 1 1 16 ASP H B 16 . HN 1 1 195 1 2 1 1 17 GLY H B 17 . HN 1 1 196 1 1 1 1 16 ASP H B 16 . HN 1 1 196 1 2 1 1 18 GLY H B 18 . HN 1 1 197 1 1 1 1 16 ASP HA B 16 . HA 1 1 197 1 2 1 1 16 ASP HB3 B 16 . HB1 1 1 198 1 1 1 1 16 ASP HA B 16 . HA 1 1 198 1 2 1 1 17 GLY H B 17 . HN 1 1 199 1 1 1 1 16 ASP HB2 B 16 . HB2 1 1 199 1 2 1 1 17 GLY H B 17 . HN 1 1 200 1 1 1 1 16 ASP HB2 B 16 . HB2 1 1 200 1 2 1 1 18 GLY H B 18 . HN 1 1 201 1 1 1 1 16 ASP HB3 B 16 . HB1 1 1 201 1 2 1 1 17 GLY H B 17 . HN 1 1 202 1 1 1 1 16 ASP HB3 B 16 . HB1 1 1 202 1 2 1 1 18 GLY H B 18 . HN 1 1 203 1 1 1 1 17 GLY H B 17 . HN 1 1 203 1 2 1 1 17 GLY HA2 B 17 . HA1 1 1 204 1 1 1 1 17 GLY H B 17 . HN 1 1 204 1 2 1 1 17 GLY HA3 B 17 . HA2 1 1 205 1 1 1 1 17 GLY H B 17 . HN 1 1 205 1 2 1 1 18 GLY H B 18 . HN 1 1 206 1 1 1 1 17 GLY H B 17 . HN 1 1 206 1 2 1 1 18 GLY HA3 B 18 . HA1 1 1 207 1 1 1 1 17 GLY HA2 B 17 . HA1 1 1 207 1 2 1 1 18 GLY H B 18 . HN 1 1 208 1 1 1 1 18 GLY H B 18 . HN 1 1 208 1 2 1 1 18 GLY HA2 B 18 . HA2 1 1 209 1 1 1 1 18 GLY H B 18 . HN 1 1 209 1 2 1 1 18 GLY HA3 B 18 . HA1 1 1 210 1 1 1 1 18 GLY H B 18 . HN 1 1 210 1 1 1 1 20 LEU H B 20 . HN 1 1 210 1 2 1 1 19 GLU H B 19 . HN 1 1 211 1 1 1 1 18 GLY HA2 B 18 . HA2 1 1 211 1 2 1 1 19 GLU H B 19 . HN 1 1 212 1 1 1 1 18 GLY HA3 B 18 . HA1 1 1 212 1 2 1 1 19 GLU H B 19 . HN 1 1 213 1 1 1 1 18 GLY HA3 B 18 . HA1 1 1 213 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 214 1 1 1 1 19 GLU H B 19 . HN 1 1 214 1 2 1 1 19 GLU HB2 B 19 . HB1 1 1 215 1 1 1 1 19 GLU H B 19 . HN 1 1 215 1 2 1 1 19 GLU HB3 B 19 . HB2 1 1 216 1 1 1 1 19 GLU H B 19 . HN 1 1 216 1 2 1 1 19 GLU QG B 19 . HG1 1 1 217 1 1 1 1 19 GLU H B 19 . HN 1 1 217 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 218 1 1 1 1 19 GLU HA B 19 . HA 1 1 218 1 2 1 1 19 GLU HB3 B 19 . HB2 1 1 219 1 1 1 1 19 GLU HA B 19 . HA 1 1 219 1 2 1 1 19 GLU QG B 19 . HG1 1 1 220 1 1 1 1 19 GLU HA B 19 . HA 1 1 220 1 2 1 1 20 LEU H B 20 . HN 1 1 221 1 1 1 1 19 GLU HA B 19 . HA 1 1 221 1 2 1 1 21 PHE QE B 21 . HE1 1 1 222 1 1 1 1 19 GLU HB2 B 19 . HB1 1 1 222 1 2 1 1 20 LEU H B 20 . HN 1 1 223 1 1 1 1 19 GLU HB2 B 19 . HB1 1 1 223 1 2 1 1 21 PHE QE B 21 . HE1 1 1 224 1 1 1 1 19 GLU HB2 B 19 . HB1 1 1 224 1 2 1 1 21 PHE QE B 21 . HE1 1 1 224 1 2 1 1 21 PHE HZ B 21 . HZ 1 1 225 1 1 1 1 19 GLU HB2 B 19 . HB1 1 1 225 1 2 1 1 21 PHE HZ B 21 . HZ 1 1 226 1 1 1 1 19 GLU HB3 B 19 . HB2 1 1 226 1 2 1 1 19 GLU QG B 19 . HG1 1 1 227 1 1 1 1 19 GLU HB3 B 19 . HB2 1 1 227 1 2 1 1 21 PHE QE B 21 . HE1 1 1 228 1 1 1 1 19 GLU HB3 B 19 . HB2 1 1 228 1 2 1 1 21 PHE QE B 21 . HE1 1 1 228 1 2 1 1 21 PHE HZ B 21 . HZ 1 1 229 1 1 1 1 19 GLU HB3 B 19 . HB2 1 1 229 1 2 1 1 21 PHE HZ B 21 . HZ 1 1 230 1 1 1 1 19 GLU QG B 19 . HG1 1 1 230 1 2 1 1 20 LEU H B 20 . HN 1 1 231 1 1 1 1 19 GLU QG B 19 . HG1 1 1 231 1 2 1 1 21 PHE QE B 21 . HE1 1 1 232 1 1 1 1 19 GLU QG B 19 . HG1 1 1 232 1 2 1 1 21 PHE HZ B 21 . HZ 1 1 233 1 1 1 1 20 LEU H B 20 . HN 1 1 233 1 2 1 1 20 LEU HB2 B 20 . HB1 1 1 234 1 1 1 1 20 LEU H B 20 . HN 1 1 234 1 2 1 1 20 LEU HB3 B 20 . HB2 1 1 235 1 1 1 1 20 LEU H B 20 . HN 1 1 235 1 2 1 1 20 LEU QD B 20 . HD21 1 1 236 1 1 1 1 20 LEU H B 20 . HN 1 1 236 1 2 1 1 21 PHE HA B 21 . HA 1 1 237 1 1 1 1 20 LEU H B 20 . HN 1 1 237 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 238 1 1 1 1 20 LEU HA B 20 . HA 1 1 238 1 2 1 1 20 LEU HB2 B 20 . HB1 1 1 239 1 1 1 1 20 LEU HA B 20 . HA 1 1 239 1 2 1 1 20 LEU HB3 B 20 . HB2 1 1 240 1 1 1 1 20 LEU HA B 20 . HA 1 1 240 1 2 1 1 20 LEU QD B 20 . HD21 1 1 241 1 1 1 1 20 LEU HA B 20 . HA 1 1 241 1 2 1 1 20 LEU HG B 20 . HG 1 1 242 1 1 1 1 20 LEU HA B 20 . HA 1 1 242 1 2 1 1 21 PHE H B 21 . HN 1 1 243 1 1 1 1 20 LEU HA B 20 . HA 1 1 243 1 2 1 1 21 PHE QD B 21 . HD1 1 1 244 1 1 1 1 20 LEU HA B 20 . HA 1 1 244 1 2 1 1 22 CYS H B 22 . HN 1 1 245 1 1 1 1 20 LEU HA B 20 . HA 1 1 245 1 2 1 1 35 HIS HA B 35 . HA 1 1 246 1 1 1 1 20 LEU HA B 20 . HA 1 1 246 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 247 1 1 1 1 20 LEU HA B 20 . HA 1 1 247 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 248 1 1 1 1 20 LEU HB2 B 20 . HB1 1 1 248 1 2 1 1 20 LEU QD B 20 . HD21 1 1 249 1 1 1 1 20 LEU HB2 B 20 . HB1 1 1 249 1 2 1 1 20 LEU HG B 20 . HG 1 1 250 1 1 1 1 20 LEU HB2 B 20 . HB1 1 1 250 1 2 1 1 21 PHE H B 21 . HN 1 1 251 1 1 1 1 20 LEU HB2 B 20 . HB1 1 1 251 1 2 1 1 22 CYS H B 22 . HN 1 1 252 1 1 1 1 20 LEU HB2 B 20 . HB1 1 1 252 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 253 1 1 1 1 20 LEU HB3 B 20 . HB2 1 1 253 1 2 1 1 20 LEU QD B 20 . HD21 1 1 254 1 1 1 1 20 LEU HB3 B 20 . HB2 1 1 254 1 1 1 1 20 LEU HG B 20 . HG 1 1 254 1 2 1 1 20 LEU QD B 20 . HD21 1 1 255 1 1 1 1 20 LEU HB3 B 20 . HB2 1 1 255 1 2 1 1 21 PHE H B 21 . HN 1 1 256 1 1 1 1 20 LEU HB3 B 20 . HB2 1 1 256 1 2 1 1 22 CYS H B 22 . HN 1 1 257 1 1 1 1 20 LEU HB3 B 20 . HB2 1 1 257 1 2 1 1 34 CYS QB B 34 . HB1 1 1 258 1 1 1 1 20 LEU HB3 B 20 . HB2 1 1 258 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 259 1 1 1 1 20 LEU MD1 B 20 . HD11 1 1 259 1 2 1 1 20 LEU MD2 B 20 . HD21 1 1 260 1 1 1 1 20 LEU QD B 20 . HD11 1 1 260 1 2 1 1 21 PHE H B 21 . HN 1 1 261 1 1 1 1 20 LEU QD B 20 . HD11 1 1 261 1 2 1 1 22 CYS H B 22 . HN 1 1 262 1 1 1 1 20 LEU QD B 20 . HD21 1 1 262 1 2 1 1 27 SER HA B 27 . HA 1 1 263 1 1 1 1 20 LEU QD B 20 . HD11 1 1 263 1 2 1 1 27 SER QB B 27 . HB1 1 1 264 1 1 1 1 20 LEU QD B 20 . HD21 1 1 264 1 2 1 1 27 SER HB3 B 27 . HB1 1 1 265 1 1 1 1 20 LEU QD B 20 . HD21 1 1 265 1 2 1 1 31 HIS HA B 31 . HA 1 1 266 1 1 1 1 20 LEU QD B 20 . HD21 1 1 266 1 2 1 1 31 HIS HD2 B 31 . HD2 1 1 267 1 1 1 1 20 LEU QD B 20 . HD21 1 1 267 1 2 1 1 31 HIS HE1 B 31 . HE1 1 1 268 1 1 1 1 20 LEU QD B 20 . HD21 1 1 268 1 2 1 1 34 CYS QB B 34 . HB1 1 1 269 1 1 1 1 20 LEU QD B 20 . HD11 1 1 269 1 2 1 1 35 HIS HA B 35 . HA 1 1 270 1 1 1 1 20 LEU QD B 20 . HD21 1 1 270 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 271 1 1 1 1 20 LEU QD B 20 . HD21 1 1 271 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 272 1 1 1 1 20 LEU QD B 20 . HD21 1 1 272 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 273 1 1 1 1 20 LEU HG B 20 . HG 1 1 273 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 274 1 1 1 1 20 LEU HG B 20 . HG 1 1 274 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 275 1 1 1 1 21 PHE H B 21 . HN 1 1 275 1 2 1 1 21 PHE HB2 B 21 . HB1 1 1 276 1 1 1 1 21 PHE H B 21 . HN 1 1 276 1 2 1 1 21 PHE HB3 B 21 . HB2 1 1 277 1 1 1 1 21 PHE H B 21 . HN 1 1 277 1 2 1 1 21 PHE QD B 21 . HD1 1 1 278 1 1 1 1 21 PHE H B 21 . HN 1 1 278 1 2 1 1 22 CYS H B 22 . HN 1 1 279 1 1 1 1 21 PHE H B 21 . HN 1 1 279 1 2 1 1 34 CYS QB B 34 . HB2 1 1 280 1 1 1 1 21 PHE H B 21 . HN 1 1 280 1 2 1 1 35 HIS HA B 35 . HA 1 1 281 1 1 1 1 21 PHE H B 21 . HN 1 1 281 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 282 1 1 1 1 21 PHE HA B 21 . HA 1 1 282 1 2 1 1 21 PHE HB3 B 21 . HB2 1 1 283 1 1 1 1 21 PHE HA B 21 . HA 1 1 283 1 2 1 1 21 PHE QD B 21 . HD1 1 1 284 1 1 1 1 21 PHE HA B 21 . HA 1 1 284 1 2 1 1 21 PHE QE B 21 . HE1 1 1 285 1 1 1 1 21 PHE HA B 21 . HA 1 1 285 1 2 1 1 22 CYS H B 22 . HN 1 1 286 1 1 1 1 21 PHE HB2 B 21 . HB1 1 1 286 1 2 1 1 21 PHE QD B 21 . HD1 1 1 287 1 1 1 1 21 PHE HB2 B 21 . HB1 1 1 287 1 2 1 1 49 ILE MD B 49 . HD11 1 1 288 1 1 1 1 21 PHE HB2 B 21 . HB1 1 1 288 1 2 1 1 49 ILE HG12 B 49 . HG11 1 1 289 1 1 1 1 21 PHE HB2 B 21 . HB1 1 1 289 1 2 1 1 49 ILE MG B 49 . HG21 1 1 290 1 1 1 1 21 PHE HB3 B 21 . HB2 1 1 290 1 2 1 1 21 PHE QD B 21 . HD1 1 1 291 1 1 1 1 21 PHE HB3 B 21 . HB2 1 1 291 1 2 1 1 49 ILE MD B 49 . HD11 1 1 292 1 1 1 1 21 PHE HB3 B 21 . HB2 1 1 292 1 2 1 1 49 ILE MG B 49 . HG21 1 1 293 1 1 1 1 21 PHE QD B 21 . HD1 1 1 293 1 2 1 1 35 HIS HA B 35 . HA 1 1 294 1 1 1 1 21 PHE QE B 21 . HE1 1 1 294 1 2 1 1 43 ARG QD B 43 . HD1 1 1 295 1 1 1 1 22 CYS H B 22 . HN 1 1 295 1 2 1 1 22 CYS HB2 B 22 . HB2 1 1 296 1 1 1 1 22 CYS H B 22 . HN 1 1 296 1 2 1 1 22 CYS HB3 B 22 . HB1 1 1 297 1 1 1 1 22 CYS HA B 22 . HA 1 1 297 1 2 1 1 22 CYS HB3 B 22 . HB1 1 1 298 1 1 1 1 22 CYS HA B 22 . HA 1 1 298 1 2 1 1 23 CYS H B 23 . HN 1 1 299 1 1 1 1 22 CYS HA B 22 . HA 1 1 299 1 2 1 1 48 CYS HA B 48 . HA 1 1 300 1 1 1 1 22 CYS HA B 22 . HA 1 1 300 1 2 1 1 48 CYS HB2 B 48 . HB1 1 1 301 1 1 1 1 22 CYS HA B 22 . HA 1 1 301 1 2 1 1 48 CYS HB3 B 48 . HB2 1 1 302 1 1 1 1 22 CYS HA B 22 . HA 1 1 302 1 2 1 1 49 ILE H B 49 . HN 1 1 303 1 1 1 1 22 CYS HB2 B 22 . HB2 1 1 303 1 2 1 1 23 CYS H B 23 . HN 1 1 304 1 1 1 1 22 CYS HB2 B 22 . HB2 1 1 304 1 2 1 1 26 CYS HB2 B 26 . HB1 1 1 305 1 1 1 1 22 CYS HB2 B 22 . HB2 1 1 305 1 2 1 1 26 CYS QB B 26 . HB1 1 1 306 1 1 1 1 22 CYS HB2 B 22 . HB2 1 1 306 1 2 1 1 26 CYS HB3 B 26 . HB2 1 1 307 1 1 1 1 22 CYS HB2 B 22 . HB2 1 1 307 1 2 1 1 27 SER H B 27 . HN 1 1 308 1 1 1 1 22 CYS HB2 B 22 . HB2 1 1 308 1 2 1 1 27 SER HA B 27 . HA 1 1 309 1 1 1 1 22 CYS HB2 B 22 . HB2 1 1 309 1 2 1 1 27 SER QB B 27 . HB1 1 1 310 1 1 1 1 22 CYS HB3 B 22 . HB1 1 1 310 1 2 1 1 23 CYS H B 23 . HN 1 1 311 1 1 1 1 22 CYS HB3 B 22 . HB1 1 1 311 1 2 1 1 26 CYS H B 26 . HN 1 1 312 1 1 1 1 22 CYS HB3 B 22 . HB1 1 1 312 1 2 1 1 26 CYS HB2 B 26 . HB1 1 1 313 1 1 1 1 22 CYS HB3 B 22 . HB1 1 1 313 1 2 1 1 26 CYS HB3 B 26 . HB2 1 1 314 1 1 1 1 22 CYS HB3 B 22 . HB1 1 1 314 1 2 1 1 27 SER QB B 27 . HB1 1 1 315 1 1 1 1 23 CYS H B 23 . HN 1 1 315 1 2 1 1 23 CYS HB2 B 23 . HB1 1 1 316 1 1 1 1 23 CYS H B 23 . HN 1 1 316 1 2 1 1 26 CYS HB3 B 26 . HB2 1 1 317 1 1 1 1 23 CYS H B 23 . HN 1 1 317 1 2 1 1 48 CYS HA B 48 . HA 1 1 318 1 1 1 1 23 CYS H B 23 . HN 1 1 318 1 2 1 1 48 CYS HB3 B 48 . HB2 1 1 319 1 1 1 1 23 CYS HA B 23 . HA 1 1 319 1 2 1 1 23 CYS HB2 B 23 . HB1 1 1 320 1 1 1 1 23 CYS HA B 23 . HA 1 1 320 1 2 1 1 24 ASP H B 24 . HN 1 1 321 1 1 1 1 23 CYS HB2 B 23 . HB1 1 1 321 1 2 1 1 24 ASP H B 24 . HN 1 1 322 1 1 1 1 23 CYS HB2 B 23 . HB1 1 1 322 1 2 1 1 25 THR H B 25 . HN 1 1 323 1 1 1 1 23 CYS HB3 B 23 . HB2 1 1 323 1 2 1 1 24 ASP H B 24 . HN 1 1 324 1 1 1 1 24 ASP H B 24 . HN 1 1 324 1 2 1 1 24 ASP QB B 24 . HB1 1 1 325 1 1 1 1 24 ASP H B 24 . HN 1 1 325 1 2 1 1 25 THR H B 25 . HN 1 1 326 1 1 1 1 24 ASP HA B 24 . HA 1 1 326 1 2 1 1 24 ASP HB2 B 24 . HB1 1 1 327 1 1 1 1 24 ASP HA B 24 . HA 1 1 327 1 2 1 1 24 ASP QB B 24 . HB1 1 1 328 1 1 1 1 24 ASP HA B 24 . HA 1 1 328 1 2 1 1 24 ASP HB3 B 24 . HB2 1 1 329 1 1 1 1 24 ASP HA B 24 . HA 1 1 329 1 2 1 1 27 SER HB2 B 27 . HB2 1 1 330 1 1 1 1 24 ASP HB2 B 24 . HB1 1 1 330 1 2 1 1 25 THR H B 25 . HN 1 1 331 1 1 1 1 25 THR H B 25 . HN 1 1 331 1 2 1 1 25 THR HA B 25 . HA 1 1 332 1 1 1 1 25 THR H B 25 . HN 1 1 332 1 2 1 1 25 THR HB B 25 . HB 1 1 333 1 1 1 1 25 THR H B 25 . HN 1 1 333 1 2 1 1 25 THR MG B 25 . HG21 1 1 334 1 1 1 1 25 THR H B 25 . HN 1 1 334 1 2 1 1 26 CYS H B 26 . HN 1 1 335 1 1 1 1 25 THR HA B 25 . HA 1 1 335 1 2 1 1 25 THR HB B 25 . HB 1 1 336 1 1 1 1 25 THR HA B 25 . HA 1 1 336 1 2 1 1 25 THR MG B 25 . HG21 1 1 337 1 1 1 1 25 THR HA B 25 . HA 1 1 337 1 2 1 1 28 ARG QB B 28 . HB1 1 1 338 1 1 1 1 25 THR HA B 25 . HA 1 1 338 1 2 1 1 28 ARG QD B 28 . HD1 1 1 339 1 1 1 1 25 THR HA B 25 . HA 1 1 339 1 2 1 1 28 ARG QG B 28 . HG1 1 1 340 1 1 1 1 25 THR HA B 25 . HA 1 1 340 1 2 1 1 29 VAL MG2 B 29 . HG11 1 1 341 1 1 1 1 25 THR HB B 25 . HB 1 1 341 1 2 1 1 25 THR MG B 25 . HG21 1 1 342 1 1 1 1 25 THR HB B 25 . HB 1 1 342 1 2 1 1 26 CYS H B 26 . HN 1 1 343 1 1 1 1 25 THR MG B 25 . HG21 1 1 343 1 2 1 1 26 CYS H B 26 . HN 1 1 344 1 1 1 1 25 THR MG B 25 . HG21 1 1 344 1 2 1 1 26 CYS HA B 26 . HA 1 1 345 1 1 1 1 26 CYS H B 26 . HN 1 1 345 1 2 1 1 26 CYS HA B 26 . HA 1 1 346 1 1 1 1 26 CYS H B 26 . HN 1 1 346 1 2 1 1 26 CYS HB2 B 26 . HB1 1 1 347 1 1 1 1 26 CYS H B 26 . HN 1 1 347 1 2 1 1 27 SER H B 27 . HN 1 1 348 1 1 1 1 26 CYS H B 26 . HN 1 1 348 1 2 1 1 28 ARG H B 28 . HN 1 1 349 1 1 1 1 26 CYS HA B 26 . HA 1 1 349 1 2 1 1 26 CYS HB2 B 26 . HB1 1 1 350 1 1 1 1 26 CYS HA B 26 . HA 1 1 350 1 2 1 1 26 CYS QB B 26 . HB1 1 1 351 1 1 1 1 26 CYS HA B 26 . HA 1 1 351 1 2 1 1 26 CYS HB3 B 26 . HB2 1 1 352 1 1 1 1 26 CYS HA B 26 . HA 1 1 352 1 1 1 1 29 VAL HA B 29 . HA 1 1 352 1 2 1 1 29 VAL H B 29 . HN 1 1 353 1 1 1 1 26 CYS HA B 26 . HA 1 1 353 1 1 1 1 29 VAL HA B 29 . HA 1 1 353 1 2 1 1 29 VAL HB B 29 . HB 1 1 354 1 1 1 1 26 CYS HA B 26 . HA 1 1 354 1 2 1 1 29 VAL HB B 29 . HB 1 1 355 1 1 1 1 26 CYS HA B 26 . HA 1 1 355 1 2 1 1 30 PHE QD B 30 . HD1 1 1 356 1 1 1 1 26 CYS HB2 B 26 . HB1 1 1 356 1 2 1 1 30 PHE QD B 30 . HD1 1 1 357 1 1 1 1 26 CYS HB3 B 26 . HB2 1 1 357 1 2 1 1 27 SER H B 27 . HN 1 1 358 1 1 1 1 26 CYS HB3 B 26 . HB2 1 1 358 1 2 1 1 29 VAL HB B 29 . HB 1 1 359 1 1 1 1 26 CYS HB3 B 26 . HB2 1 1 359 1 2 1 1 30 PHE QD B 30 . HD1 1 1 360 1 1 1 1 26 CYS HB3 B 26 . HB2 1 1 360 1 2 1 1 30 PHE QE B 30 . HE1 1 1 361 1 1 1 1 26 CYS HB3 B 26 . HB2 1 1 361 1 2 1 1 50 PHE QD B 50 . HD1 1 1 362 1 1 1 1 27 SER H B 27 . HN 1 1 362 1 2 1 1 27 SER HA B 27 . HA 1 1 363 1 1 1 1 27 SER H B 27 . HN 1 1 363 1 2 1 1 27 SER HB2 B 27 . HB2 1 1 364 1 1 1 1 27 SER H B 27 . HN 1 1 364 1 2 1 1 28 ARG H B 28 . HN 1 1 365 1 1 1 1 27 SER H B 27 . HN 1 1 365 1 2 1 1 28 ARG QB B 28 . HB1 1 1 366 1 1 1 1 27 SER HA B 27 . HA 1 1 366 1 2 1 1 27 SER QB B 27 . HB1 1 1 367 1 1 1 1 27 SER HA B 27 . HA 1 1 367 1 2 1 1 30 PHE H B 30 . HN 1 1 368 1 1 1 1 27 SER HA B 27 . HA 1 1 368 1 2 1 1 31 HIS HA B 31 . HA 1 1 369 1 1 1 1 27 SER HA B 27 . HA 1 1 369 1 2 1 1 34 CYS QB B 34 . HB2 1 1 370 1 1 1 1 27 SER QB B 27 . HB1 1 1 370 1 2 1 1 34 CYS QB B 34 . HB2 1 1 371 1 1 1 1 27 SER HB2 B 27 . HB2 1 1 371 1 2 1 1 31 HIS HD1 B 31 . HD1 1 1 372 1 1 1 1 28 ARG H B 28 . HN 1 1 372 1 2 1 1 28 ARG HA B 28 . HA 1 1 373 1 1 1 1 28 ARG H B 28 . HN 1 1 373 1 2 1 1 28 ARG QB B 28 . HB1 1 1 374 1 1 1 1 28 ARG H B 28 . HN 1 1 374 1 2 1 1 28 ARG QD B 28 . HD1 1 1 375 1 1 1 1 28 ARG H B 28 . HN 1 1 375 1 2 1 1 28 ARG QG B 28 . HG1 1 1 376 1 1 1 1 28 ARG HA B 28 . HA 1 1 376 1 2 1 1 28 ARG QB B 28 . HB1 1 1 377 1 1 1 1 28 ARG HA B 28 . HA 1 1 377 1 2 1 1 28 ARG QG B 28 . HG1 1 1 378 1 1 1 1 28 ARG HA B 28 . HA 1 1 378 1 2 1 1 28 ARG HG3 B 28 . HG2 1 1 379 1 1 1 1 28 ARG HA B 28 . HA 1 1 379 1 2 1 1 31 HIS H B 31 . HN 1 1 380 1 1 1 1 28 ARG HA B 28 . HA 1 1 380 1 2 1 1 31 HIS HB2 B 31 . HB1 1 1 381 2 1 1 1 28 ARG QB B 28 . HB1 1 1 381 2 2 1 1 28 ARG HD3 B 28 . HD2 1 1 381 3 1 1 1 28 ARG HB3 B 28 . HB2 1 1 381 3 2 1 1 28 ARG HD2 B 28 . HD1 1 1 382 1 1 1 1 28 ARG QB B 28 . HB1 1 1 382 1 2 1 1 29 VAL MG1 B 29 . HG21 1 1 383 1 1 1 1 28 ARG QB B 28 . HB1 1 1 383 1 2 1 1 29 VAL MG2 B 29 . HG11 1 1 384 2 1 1 1 28 ARG HD2 B 28 . HD1 1 1 384 2 2 1 1 28 ARG HG2 B 28 . HG1 1 1 384 3 1 1 1 28 ARG QD B 28 . HD1 1 1 384 3 2 1 1 28 ARG HG3 B 28 . HG2 1 1 385 1 1 1 1 29 VAL H B 29 . HN 1 1 385 1 2 1 1 29 VAL HB B 29 . HB 1 1 386 1 1 1 1 29 VAL H B 29 . HN 1 1 386 1 2 1 1 29 VAL MG1 B 29 . HG21 1 1 387 1 1 1 1 29 VAL H B 29 . HN 1 1 387 1 2 1 1 29 VAL MG2 B 29 . HG11 1 1 388 1 1 1 1 29 VAL H B 29 . HN 1 1 388 1 2 1 1 30 PHE H B 30 . HN 1 1 389 1 1 1 1 29 VAL HA B 29 . HA 1 1 389 1 2 1 1 29 VAL HB B 29 . HB 1 1 390 1 1 1 1 29 VAL HA B 29 . HA 1 1 390 1 2 1 1 29 VAL MG1 B 29 . HG21 1 1 391 1 1 1 1 29 VAL HA B 29 . HA 1 1 391 1 2 1 1 29 VAL MG2 B 29 . HG11 1 1 392 1 1 1 1 29 VAL HA B 29 . HA 1 1 392 1 2 1 1 30 PHE H B 30 . HN 1 1 393 1 1 1 1 29 VAL HA B 29 . HA 1 1 393 1 2 1 1 31 HIS H B 31 . HN 1 1 394 1 1 1 1 29 VAL HB B 29 . HB 1 1 394 1 2 1 1 29 VAL MG1 B 29 . HG21 1 1 395 1 1 1 1 29 VAL HB B 29 . HB 1 1 395 1 2 1 1 29 VAL MG2 B 29 . HG11 1 1 396 1 1 1 1 29 VAL HB B 29 . HB 1 1 396 1 2 1 1 30 PHE H B 30 . HN 1 1 397 1 1 1 1 29 VAL HB B 29 . HB 1 1 397 1 2 1 1 30 PHE QD B 30 . HD1 1 1 398 1 1 1 1 29 VAL HB B 29 . HB 1 1 398 1 2 1 1 30 PHE QE B 30 . HE1 1 1 399 1 1 1 1 29 VAL MG1 B 29 . HG11 1 1 399 1 2 1 1 29 VAL MG2 B 29 . HG21 1 1 400 1 1 1 1 29 VAL MG1 B 29 . HG21 1 1 400 1 2 1 1 30 PHE H B 30 . HN 1 1 401 1 1 1 1 29 VAL MG1 B 29 . HG21 1 1 401 1 2 1 1 30 PHE QD B 30 . HD1 1 1 402 1 1 1 1 29 VAL MG1 B 29 . HG21 1 1 402 1 2 1 1 30 PHE QE B 30 . HE1 1 1 403 1 1 1 1 29 VAL MG2 B 29 . HG11 1 1 403 1 2 1 1 30 PHE H B 30 . HN 1 1 404 1 1 1 1 29 VAL MG2 B 29 . HG11 1 1 404 1 2 1 1 30 PHE QD B 30 . HD1 1 1 405 1 1 1 1 29 VAL MG2 B 29 . HG11 1 1 405 1 2 1 1 30 PHE QE B 30 . HE1 1 1 406 1 1 1 1 30 PHE H B 30 . HN 1 1 406 1 2 1 1 30 PHE HB2 B 30 . HB1 1 1 407 1 1 1 1 30 PHE H B 30 . HN 1 1 407 1 2 1 1 30 PHE HB3 B 30 . HB2 1 1 408 1 1 1 1 30 PHE H B 30 . HN 1 1 408 1 2 1 1 30 PHE QD B 30 . HD1 1 1 409 1 1 1 1 30 PHE H B 30 . HN 1 1 409 1 2 1 1 31 HIS H B 31 . HN 1 1 410 1 1 1 1 30 PHE H B 30 . HN 1 1 410 1 2 1 1 34 CYS QB B 34 . HB2 1 1 411 1 1 1 1 30 PHE HA B 30 . HA 1 1 411 1 2 1 1 30 PHE HB2 B 30 . HB1 1 1 412 1 1 1 1 30 PHE HA B 30 . HA 1 1 412 1 2 1 1 30 PHE HB3 B 30 . HB2 1 1 413 1 1 1 1 30 PHE HA B 30 . HA 1 1 413 1 2 1 1 30 PHE QD B 30 . HD1 1 1 414 1 1 1 1 30 PHE HA B 30 . HA 1 1 414 1 2 1 1 31 HIS H B 31 . HN 1 1 415 1 1 1 1 30 PHE HA B 30 . HA 1 1 415 1 2 1 1 32 GLU H B 32 . HN 1 1 416 1 1 1 1 30 PHE HA B 30 . HA 1 1 416 1 2 1 1 33 ASP H B 33 . HN 1 1 417 1 1 1 1 30 PHE HB2 B 30 . HB1 1 1 417 1 2 1 1 30 PHE QD B 30 . HD1 1 1 418 1 1 1 1 30 PHE HB2 B 30 . HB1 1 1 418 1 1 1 1 31 HIS HB3 B 31 . HB2 1 1 418 1 2 1 1 33 ASP H B 33 . HN 1 1 419 1 1 1 1 30 PHE HB2 B 30 . HB1 1 1 419 1 2 1 1 33 ASP QB B 33 . HB2 1 1 420 1 1 1 1 30 PHE HB2 B 30 . HB1 1 1 420 1 2 1 1 50 PHE QE B 50 . HE1 1 1 420 1 2 1 1 50 PHE HZ B 50 . HZ 1 1 421 1 1 1 1 30 PHE HB3 B 30 . HB2 1 1 421 1 2 1 1 33 ASP H B 33 . HN 1 1 422 1 1 1 1 30 PHE HB3 B 30 . HB2 1 1 422 1 2 1 1 50 PHE QE B 50 . HE1 1 1 422 1 2 1 1 50 PHE HZ B 50 . HZ 1 1 423 1 1 1 1 30 PHE QD B 30 . HD1 1 1 423 1 2 1 1 50 PHE HB2 B 50 . HB1 1 1 424 1 1 1 1 30 PHE QD B 30 . HD1 1 1 424 1 2 1 1 50 PHE HB3 B 50 . HB2 1 1 425 1 1 1 1 31 HIS H B 31 . HN 1 1 425 1 2 1 1 31 HIS HA B 31 . HA 1 1 426 1 1 1 1 31 HIS H B 31 . HN 1 1 426 1 2 1 1 31 HIS HB2 B 31 . HB1 1 1 427 1 1 1 1 31 HIS H B 31 . HN 1 1 427 1 2 1 1 31 HIS HB3 B 31 . HB2 1 1 428 1 1 1 1 31 HIS H B 31 . HN 1 1 428 1 2 1 1 32 GLU H B 32 . HN 1 1 429 1 1 1 1 31 HIS H B 31 . HN 1 1 429 1 2 1 1 32 GLU HB2 B 32 . HB1 1 1 430 1 1 1 1 31 HIS H B 31 . HN 1 1 430 1 2 1 1 32 GLU QG B 32 . HG1 1 1 431 1 1 1 1 31 HIS HA B 31 . HA 1 1 431 1 2 1 1 31 HIS HB2 B 31 . HB1 1 1 432 1 1 1 1 31 HIS HA B 31 . HA 1 1 432 1 2 1 1 31 HIS HB3 B 31 . HB2 1 1 433 1 1 1 1 31 HIS HA B 31 . HA 1 1 433 1 2 1 1 31 HIS HD2 B 31 . HD2 1 1 434 1 1 1 1 31 HIS HA B 31 . HA 1 1 434 1 2 1 1 32 GLU H B 32 . HN 1 1 435 1 1 1 1 31 HIS HA B 31 . HA 1 1 435 1 2 1 1 34 CYS H B 34 . HN 1 1 436 1 1 1 1 31 HIS HA B 31 . HA 1 1 436 1 2 1 1 34 CYS QB B 34 . HB2 1 1 437 1 1 1 1 31 HIS HB2 B 31 . HB1 1 1 437 1 2 1 1 32 GLU H B 32 . HN 1 1 438 1 1 1 1 31 HIS HB3 B 31 . HB2 1 1 438 1 2 1 1 31 HIS HD2 B 31 . HD2 1 1 439 1 1 1 1 31 HIS HB3 B 31 . HB2 1 1 439 1 2 1 1 32 GLU H B 32 . HN 1 1 440 1 1 1 1 31 HIS HB3 B 31 . HB2 1 1 440 1 2 1 1 34 CYS H B 34 . HN 1 1 441 1 1 1 1 31 HIS HD2 B 31 . HD2 1 1 441 1 2 1 1 32 GLU H B 32 . HN 1 1 442 1 1 1 1 31 HIS HD2 B 31 . HD2 1 1 442 1 2 1 1 32 GLU HA B 32 . HA 1 1 443 1 1 1 1 31 HIS HD2 B 31 . HD2 1 1 443 1 2 1 1 32 GLU HB3 B 32 . HB2 1 1 444 1 1 1 1 31 HIS HD2 B 31 . HD2 1 1 444 1 2 1 1 32 GLU HG3 B 32 . HG2 1 1 445 1 1 1 1 31 HIS HD2 B 31 . HD2 1 1 445 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 446 1 1 1 1 32 GLU H B 32 . HN 1 1 446 1 2 1 1 32 GLU HA B 32 . HA 1 1 447 1 1 1 1 32 GLU H B 32 . HN 1 1 447 1 2 1 1 32 GLU HB2 B 32 . HB1 1 1 448 1 1 1 1 32 GLU H B 32 . HN 1 1 448 1 2 1 1 32 GLU QG B 32 . HG1 1 1 449 1 1 1 1 32 GLU H B 32 . HN 1 1 449 1 2 1 1 33 ASP H B 33 . HN 1 1 450 1 1 1 1 32 GLU H B 32 . HN 1 1 450 1 2 1 1 33 ASP QB B 33 . HB2 1 1 451 1 1 1 1 32 GLU H B 32 . HN 1 1 451 1 2 1 1 34 CYS H B 34 . HN 1 1 452 1 1 1 1 32 GLU H B 32 . HN 1 1 452 1 2 1 1 34 CYS QB B 34 . HB2 1 1 453 1 1 1 1 32 GLU H B 32 . HN 1 1 453 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 454 1 1 1 1 32 GLU HA B 32 . HA 1 1 454 1 2 1 1 32 GLU QB B 32 . HB1 1 1 455 1 1 1 1 32 GLU HA B 32 . HA 1 1 455 1 2 1 1 32 GLU HB3 B 32 . HB2 1 1 456 1 1 1 1 32 GLU HA B 32 . HA 1 1 456 1 2 1 1 32 GLU QG B 32 . HG1 1 1 457 1 1 1 1 32 GLU HA B 32 . HA 1 1 457 1 2 1 1 32 GLU HG3 B 32 . HG2 1 1 458 1 1 1 1 32 GLU HA B 32 . HA 1 1 458 1 2 1 1 33 ASP H B 33 . HN 1 1 459 1 1 1 1 32 GLU HA B 32 . HA 1 1 459 1 2 1 1 35 HIS H B 35 . HN 1 1 460 1 1 1 1 32 GLU HA B 32 . HA 1 1 460 1 2 1 1 35 HIS HB2 B 35 . HB1 1 1 461 1 1 1 1 32 GLU HA B 32 . HA 1 1 461 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 462 1 1 1 1 32 GLU HA B 32 . HA 1 1 462 1 2 1 1 36 ILE MD B 36 . HD11 1 1 463 1 1 1 1 32 GLU QB B 32 . HB1 1 1 463 1 2 1 1 32 GLU HG3 B 32 . HG2 1 1 464 1 1 1 1 32 GLU QB B 32 . HB1 1 1 464 1 2 1 1 34 CYS H B 34 . HN 1 1 465 1 1 1 1 32 GLU HB2 B 32 . HB1 1 1 465 1 2 1 1 32 GLU QG B 32 . HG1 1 1 466 1 1 1 1 32 GLU HB2 B 32 . HB1 1 1 466 1 2 1 1 33 ASP H B 33 . HN 1 1 467 1 1 1 1 32 GLU HB2 B 32 . HB1 1 1 467 1 2 1 1 33 ASP HA B 33 . HA 1 1 468 1 1 1 1 32 GLU HB3 B 32 . HB2 1 1 468 1 2 1 1 32 GLU QG B 32 . HG1 1 1 469 1 1 1 1 32 GLU HB3 B 32 . HB2 1 1 469 1 2 1 1 33 ASP HA B 33 . HA 1 1 470 1 1 1 1 32 GLU HG3 B 32 . HG2 1 1 470 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 471 1 1 1 1 33 ASP H B 33 . HN 1 1 471 1 2 1 1 33 ASP HA B 33 . HA 1 1 472 1 1 1 1 33 ASP H B 33 . HN 1 1 472 1 2 1 1 33 ASP QB B 33 . HB2 1 1 473 1 1 1 1 33 ASP H B 33 . HN 1 1 473 1 2 1 1 34 CYS QB B 34 . HB2 1 1 474 1 1 1 1 33 ASP H B 33 . HN 1 1 474 1 2 1 1 35 HIS H B 35 . HN 1 1 475 1 1 1 1 33 ASP H B 33 . HN 1 1 475 1 2 1 1 50 PHE QD B 50 . HD1 1 1 476 1 1 1 1 33 ASP H B 33 . HN 1 1 476 1 2 1 1 50 PHE QE B 50 . HE1 1 1 476 1 2 1 1 50 PHE HZ B 50 . HZ 1 1 477 1 1 1 1 33 ASP HA B 33 . HA 1 1 477 1 2 1 1 33 ASP QB B 33 . HB1 1 1 478 1 1 1 1 33 ASP HA B 33 . HA 1 1 478 1 2 1 1 34 CYS H B 34 . HN 1 1 479 1 1 1 1 33 ASP HA B 33 . HA 1 1 479 1 2 1 1 35 HIS H B 35 . HN 1 1 480 1 1 1 1 33 ASP HA B 33 . HA 1 1 480 1 2 1 1 36 ILE H B 36 . HN 1 1 481 1 1 1 1 33 ASP HA B 33 . HA 1 1 481 1 2 1 1 36 ILE MD B 36 . HD11 1 1 482 1 1 1 1 33 ASP HA B 33 . HA 1 1 482 1 2 1 1 36 ILE HG12 B 36 . HG12 1 1 483 1 1 1 1 33 ASP QB B 33 . HB2 1 1 483 1 2 1 1 34 CYS H B 34 . HN 1 1 484 1 1 1 1 33 ASP QB B 33 . HB2 1 1 484 1 2 1 1 50 PHE QD B 50 . HD1 1 1 485 1 1 1 1 33 ASP QB B 33 . HB2 1 1 485 1 2 1 1 50 PHE QE B 50 . HE1 1 1 486 1 1 1 1 34 CYS H B 34 . HN 1 1 486 1 2 1 1 34 CYS HA B 34 . HA 1 1 487 1 1 1 1 34 CYS H B 34 . HN 1 1 487 1 2 1 1 34 CYS QB B 34 . HB2 1 1 488 1 1 1 1 34 CYS H B 34 . HN 1 1 488 1 2 1 1 35 HIS H B 35 . HN 1 1 489 1 1 1 1 34 CYS H B 34 . HN 1 1 489 1 2 1 1 50 PHE QE B 50 . HE1 1 1 490 1 1 1 1 34 CYS HA B 34 . HA 1 1 490 1 2 1 1 34 CYS QB B 34 . HB1 1 1 491 2 1 1 1 34 CYS HA B 34 . HA 1 1 491 2 2 1 1 34 CYS QB B 34 . HB2 1 1 491 3 1 1 1 44 THR HA B 44 . HA 1 1 491 3 2 1 1 45 PRO HD2 B 45 . HD2 1 1 492 1 1 1 1 34 CYS HA B 34 . HA 1 1 492 1 2 1 1 35 HIS H B 35 . HN 1 1 493 1 1 1 1 34 CYS HA B 34 . HA 1 1 493 1 2 1 1 49 ILE MD B 49 . HD11 1 1 494 1 1 1 1 34 CYS QB B 34 . HB1 1 1 494 1 2 1 1 35 HIS H B 35 . HN 1 1 495 1 1 1 1 35 HIS H B 35 . HN 1 1 495 1 2 1 1 35 HIS HA B 35 . HA 1 1 496 1 1 1 1 35 HIS H B 35 . HN 1 1 496 1 2 1 1 35 HIS HB2 B 35 . HB1 1 1 497 1 1 1 1 35 HIS H B 35 . HN 1 1 497 1 2 1 1 35 HIS HB3 B 35 . HB2 1 1 498 1 1 1 1 35 HIS H B 35 . HN 1 1 498 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 499 1 1 1 1 35 HIS H B 35 . HN 1 1 499 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 500 1 1 1 1 35 HIS H B 35 . HN 1 1 500 1 2 1 1 36 ILE HB B 36 . HB 1 1 501 1 1 1 1 35 HIS H B 35 . HN 1 1 501 1 2 1 1 36 ILE MD B 36 . HD11 1 1 502 1 1 1 1 35 HIS H B 35 . HN 1 1 502 1 2 1 1 36 ILE HG12 B 36 . HG12 1 1 503 1 1 1 1 35 HIS H B 35 . HN 1 1 503 1 2 1 1 36 ILE HG13 B 36 . HG11 1 1 504 1 1 1 1 35 HIS HA B 35 . HA 1 1 504 1 2 1 1 35 HIS HB2 B 35 . HB1 1 1 505 1 1 1 1 35 HIS HA B 35 . HA 1 1 505 1 2 1 1 35 HIS HB3 B 35 . HB2 1 1 506 1 1 1 1 35 HIS HA B 35 . HA 1 1 506 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 507 1 1 1 1 35 HIS HA B 35 . HA 1 1 507 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 508 1 1 1 1 35 HIS HA B 35 . HA 1 1 508 1 2 1 1 35 HIS HE1 B 35 . HE1 1 1 509 1 1 1 1 35 HIS HA B 35 . HA 1 1 509 1 2 1 1 36 ILE H B 36 . HN 1 1 510 1 1 1 1 35 HIS HB2 B 35 . HB1 1 1 510 1 2 1 1 35 HIS HD2 B 35 . HD2 1 1 511 1 1 1 1 35 HIS HB2 B 35 . HB1 1 1 511 1 2 1 1 36 ILE H B 36 . HN 1 1 512 1 1 1 1 35 HIS HB3 B 35 . HB2 1 1 512 1 2 1 1 35 HIS HD1 B 35 . HD1 1 1 513 1 1 1 1 35 HIS HB3 B 35 . HB2 1 1 513 1 2 1 1 36 ILE H B 36 . HN 1 1 514 1 1 1 1 35 HIS HB3 B 35 . HB2 1 1 514 1 2 1 1 36 ILE HG12 B 36 . HG12 1 1 515 1 1 1 1 35 HIS HD1 B 35 . HD1 1 1 515 1 2 1 1 36 ILE H B 36 . HN 1 1 516 1 1 1 1 36 ILE H B 36 . HN 1 1 516 1 2 1 1 36 ILE HA B 36 . HA 1 1 517 1 1 1 1 36 ILE H B 36 . HN 1 1 517 1 2 1 1 36 ILE HB B 36 . HB 1 1 518 1 1 1 1 36 ILE H B 36 . HN 1 1 518 1 2 1 1 36 ILE HG12 B 36 . HG12 1 1 519 1 1 1 1 36 ILE H B 36 . HN 1 1 519 1 2 1 1 36 ILE HG13 B 36 . HG11 1 1 520 1 1 1 1 36 ILE H B 36 . HN 1 1 520 1 2 1 1 36 ILE MG B 36 . HG21 1 1 521 1 1 1 1 36 ILE HA B 36 . HA 1 1 521 1 2 1 1 36 ILE HB B 36 . HB 1 1 522 1 1 1 1 36 ILE HA B 36 . HA 1 1 522 1 2 1 1 36 ILE MD B 36 . HD11 1 1 523 1 1 1 1 36 ILE HA B 36 . HA 1 1 523 1 2 1 1 36 ILE HG12 B 36 . HG12 1 1 524 1 1 1 1 36 ILE HA B 36 . HA 1 1 524 1 2 1 1 36 ILE HG13 B 36 . HG11 1 1 525 1 1 1 1 36 ILE HA B 36 . HA 1 1 525 1 2 1 1 36 ILE MG B 36 . HG21 1 1 526 1 1 1 1 36 ILE HB B 36 . HB 1 1 526 1 2 1 1 36 ILE MD B 36 . HD11 1 1 527 1 1 1 1 36 ILE HB B 36 . HB 1 1 527 1 2 1 1 36 ILE HG12 B 36 . HG12 1 1 528 1 1 1 1 36 ILE HB B 36 . HB 1 1 528 1 2 1 1 36 ILE HG13 B 36 . HG11 1 1 529 1 1 1 1 36 ILE HB B 36 . HB 1 1 529 1 2 1 1 36 ILE MG B 36 . HG21 1 1 530 1 1 1 1 36 ILE MD B 36 . HD11 1 1 530 1 2 1 1 36 ILE HG12 B 36 . HG12 1 1 531 1 1 1 1 36 ILE MD B 36 . HD11 1 1 531 1 2 1 1 36 ILE HG13 B 36 . HG11 1 1 532 1 1 1 1 36 ILE HG12 B 36 . HG12 1 1 532 1 2 1 1 36 ILE MG B 36 . HG21 1 1 533 1 1 1 1 36 ILE HG13 B 36 . HG11 1 1 533 1 2 1 1 36 ILE MG B 36 . HG21 1 1 534 1 1 1 1 37 PRO HA B 37 . HA 1 1 534 1 2 1 1 37 PRO HB3 B 37 . HB2 1 1 535 1 1 1 1 37 PRO HB3 B 37 . HB2 1 1 535 1 2 1 1 37 PRO HG2 B 37 . HG1 1 1 536 1 1 1 1 38 PRO HA B 38 . HA 1 1 536 1 2 1 1 38 PRO HD2 B 38 . HD1 1 1 537 1 1 1 1 38 PRO HA B 38 . HA 1 1 537 1 2 1 1 38 PRO HD3 B 38 . HD2 1 1 538 1 1 1 1 38 PRO HA B 38 . HA 1 1 538 1 2 1 1 38 PRO QG B 38 . HG1 1 1 539 1 1 1 1 38 PRO HA B 38 . HA 1 1 539 1 2 1 1 38 PRO HG3 B 38 . HG2 1 1 540 1 1 1 1 38 PRO HA B 38 . HA 1 1 540 1 2 1 1 39 VAL H B 39 . HN 1 1 541 1 1 1 1 38 PRO HA B 38 . HA 1 1 541 1 2 1 1 39 VAL QG B 39 . HG11 1 1 542 1 1 1 1 38 PRO HB2 B 38 . HB1 1 1 542 1 2 1 1 38 PRO HD2 B 38 . HD1 1 1 543 1 1 1 1 38 PRO HB2 B 38 . HB1 1 1 543 1 2 1 1 38 PRO HG2 B 38 . HG1 1 1 544 1 1 1 1 38 PRO HB2 B 38 . HB1 1 1 544 1 2 1 1 38 PRO QG B 38 . HG1 1 1 545 1 1 1 1 38 PRO HB2 B 38 . HB1 1 1 545 1 2 1 1 38 PRO HG3 B 38 . HG2 1 1 546 1 1 1 1 38 PRO HD2 B 38 . HD1 1 1 546 1 2 1 1 38 PRO HG3 B 38 . HG2 1 1 547 1 1 1 1 38 PRO HD3 B 38 . HD2 1 1 547 1 2 1 1 38 PRO HG2 B 38 . HG1 1 1 548 1 1 1 1 38 PRO HD3 B 38 . HD2 1 1 548 1 2 1 1 38 PRO QG B 38 . HG1 1 1 549 1 1 1 1 39 VAL H B 39 . HN 1 1 549 1 2 1 1 39 VAL HA B 39 . HA 1 1 550 1 1 1 1 39 VAL H B 39 . HN 1 1 550 1 2 1 1 39 VAL HB B 39 . HB 1 1 551 1 1 1 1 39 VAL H B 39 . HN 1 1 551 1 2 1 1 39 VAL QG B 39 . HG11 1 1 552 1 1 1 1 39 VAL HA B 39 . HA 1 1 552 1 2 1 1 39 VAL HB B 39 . HB 1 1 553 1 1 1 1 39 VAL HA B 39 . HA 1 1 553 1 2 1 1 39 VAL QG B 39 . HG11 1 1 554 1 1 1 1 39 VAL HA B 39 . HA 1 1 554 1 2 1 1 40 GLU H B 40 . HN 1 1 555 1 1 1 1 39 VAL HA B 39 . HA 1 1 555 1 2 1 1 41 ALA H B 41 . HN 1 1 556 1 1 1 1 39 VAL HB B 39 . HB 1 1 556 1 2 1 1 39 VAL QG B 39 . HG11 1 1 557 1 1 1 1 39 VAL HB B 39 . HB 1 1 557 1 2 1 1 40 GLU H B 40 . HN 1 1 558 1 1 1 1 39 VAL QG B 39 . HG21 1 1 558 1 2 1 1 40 GLU H B 40 . HN 1 1 559 1 1 1 1 39 VAL QG B 39 . HG11 1 1 559 1 2 1 1 40 GLU HA B 40 . HA 1 1 560 1 1 1 1 39 VAL QG B 39 . HG21 1 1 560 1 2 1 1 41 ALA H B 41 . HN 1 1 561 1 1 1 1 39 VAL QG B 39 . HG21 1 1 561 1 2 1 1 42 GLU H B 42 . HN 1 1 562 1 1 1 1 39 VAL QG B 39 . HG21 1 1 562 1 2 1 1 42 GLU QG B 42 . HG1 1 1 563 1 1 1 1 40 GLU H B 40 . HN 1 1 563 1 2 1 1 40 GLU HA B 40 . HA 1 1 564 1 1 1 1 40 GLU H B 40 . HN 1 1 564 1 2 1 1 40 GLU QB B 40 . HB1 1 1 565 1 1 1 1 40 GLU H B 40 . HN 1 1 565 1 2 1 1 40 GLU HG2 B 40 . HG1 1 1 566 1 1 1 1 40 GLU HA B 40 . HA 1 1 566 1 2 1 1 40 GLU QB B 40 . HB1 1 1 567 1 1 1 1 40 GLU HA B 40 . HA 1 1 567 1 2 1 1 40 GLU HG2 B 40 . HG1 1 1 568 1 1 1 1 40 GLU HA B 40 . HA 1 1 568 1 2 1 1 40 GLU QG B 40 . HG1 1 1 569 1 1 1 1 40 GLU HA B 40 . HA 1 1 569 1 2 1 1 41 ALA H B 41 . HN 1 1 570 1 1 1 1 40 GLU QB B 40 . HB1 1 1 570 1 2 1 1 41 ALA H B 41 . HN 1 1 571 1 1 1 1 41 ALA H B 41 . HN 1 1 571 1 2 1 1 41 ALA MB B 41 . HB1 1 1 572 1 1 1 1 41 ALA H B 41 . HN 1 1 572 1 2 1 1 42 GLU HA B 42 . HA 1 1 573 1 1 1 1 41 ALA H B 41 . HN 1 1 573 1 2 1 1 42 GLU QG B 42 . HG1 1 1 574 1 1 1 1 41 ALA H B 41 . HN 1 1 574 1 2 1 1 43 ARG HB3 B 43 . HB2 1 1 575 1 1 1 1 41 ALA H B 41 . HN 1 1 575 1 2 1 1 43 ARG QG B 43 . HG2 1 1 576 1 1 1 1 41 ALA HA B 41 . HA 1 1 576 1 2 1 1 41 ALA MB B 41 . HB1 1 1 577 1 1 1 1 41 ALA HA B 41 . HA 1 1 577 1 2 1 1 42 GLU H B 42 . HN 1 1 578 1 1 1 1 41 ALA HA B 41 . HA 1 1 578 1 2 1 1 42 GLU QG B 42 . HG1 1 1 579 1 1 1 1 41 ALA MB B 41 . HB1 1 1 579 1 2 1 1 42 GLU H B 42 . HN 1 1 580 1 1 1 1 41 ALA MB B 41 . HB1 1 1 580 1 2 1 1 42 GLU QG B 42 . HG1 1 1 581 1 1 1 1 41 ALA MB B 41 . HB1 1 1 581 1 2 1 1 43 ARG H B 43 . HN 1 1 582 1 1 1 1 42 GLU H B 42 . HN 1 1 582 1 2 1 1 42 GLU HA B 42 . HA 1 1 583 1 1 1 1 42 GLU H B 42 . HN 1 1 583 1 2 1 1 42 GLU QB B 42 . HB1 1 1 584 1 1 1 1 42 GLU H B 42 . HN 1 1 584 1 2 1 1 42 GLU HG3 B 42 . HG2 1 1 585 1 1 1 1 42 GLU H B 42 . HN 1 1 585 1 2 1 1 43 ARG QG B 43 . HG1 1 1 586 1 1 1 1 42 GLU HA B 42 . HA 1 1 586 1 2 1 1 42 GLU QG B 42 . HG1 1 1 587 1 1 1 1 42 GLU HA B 42 . HA 1 1 587 1 1 1 1 43 ARG HA B 43 . HA 1 1 587 1 2 1 1 43 ARG H B 43 . HN 1 1 588 1 1 1 1 42 GLU QB B 42 . HB1 1 1 588 1 2 1 1 43 ARG H B 43 . HN 1 1 589 1 1 1 1 43 ARG H B 43 . HN 1 1 589 1 2 1 1 43 ARG HB3 B 43 . HB2 1 1 590 1 1 1 1 43 ARG H B 43 . HN 1 1 590 1 2 1 1 43 ARG QG B 43 . HG2 1 1 591 1 1 1 1 43 ARG H B 43 . HN 1 1 591 1 2 1 1 44 THR MG B 44 . HG21 1 1 592 1 1 1 1 43 ARG HA B 43 . HA 1 1 592 1 2 1 1 43 ARG QD B 43 . HD1 1 1 593 1 1 1 1 43 ARG HA B 43 . HA 1 1 593 1 2 1 1 43 ARG QG B 43 . HG1 1 1 594 1 1 1 1 43 ARG HA B 43 . HA 1 1 594 1 2 1 1 44 THR H B 44 . HN 1 1 595 1 1 1 1 43 ARG HA B 43 . HA 1 1 595 1 2 1 1 44 THR HB B 44 . HB 1 1 596 1 1 1 1 43 ARG HA B 43 . HA 1 1 596 1 2 1 1 44 THR MG B 44 . HG21 1 1 597 1 1 1 1 43 ARG HB2 B 43 . HB1 1 1 597 1 2 1 1 44 THR H B 44 . HN 1 1 598 1 1 1 1 43 ARG HB2 B 43 . HB1 1 1 598 1 1 1 1 45 PRO QG B 45 . HG1 1 1 598 1 2 1 1 44 THR HA B 44 . HA 1 1 599 1 1 1 1 43 ARG HB2 B 43 . HB1 1 1 599 1 1 1 1 45 PRO HG2 B 45 . HG1 1 1 599 1 2 1 1 44 THR MG B 44 . HG21 1 1 600 1 1 1 1 43 ARG HB3 B 43 . HB2 1 1 600 1 2 1 1 44 THR H B 44 . HN 1 1 601 1 1 1 1 43 ARG QG B 43 . HG2 1 1 601 1 2 1 1 44 THR H B 44 . HN 1 1 602 1 1 1 1 44 THR H B 44 . HN 1 1 602 1 2 1 1 44 THR HA B 44 . HA 1 1 603 1 1 1 1 44 THR H B 44 . HN 1 1 603 1 2 1 1 44 THR HB B 44 . HB 1 1 604 1 1 1 1 44 THR H B 44 . HN 1 1 604 1 2 1 1 44 THR MG B 44 . HG21 1 1 605 1 1 1 1 44 THR H B 44 . HN 1 1 605 1 2 1 1 45 PRO HD2 B 45 . HD2 1 1 606 1 1 1 1 44 THR H B 44 . HN 1 1 606 1 2 1 1 47 ASN HB2 B 47 . HB1 1 1 607 1 1 1 1 44 THR H B 44 . HN 1 1 607 1 2 1 1 47 ASN HB3 B 47 . HB2 1 1 608 1 1 1 1 44 THR HA B 44 . HA 1 1 608 1 2 1 1 44 THR HB B 44 . HB 1 1 609 1 1 1 1 44 THR HA B 44 . HA 1 1 609 1 2 1 1 44 THR MG B 44 . HG21 1 1 610 1 1 1 1 44 THR HA B 44 . HA 1 1 610 1 2 1 1 45 PRO HD2 B 45 . HD2 1 1 611 1 1 1 1 44 THR HA B 44 . HA 1 1 611 1 2 1 1 45 PRO HD3 B 45 . HD1 1 1 612 1 1 1 1 44 THR HA B 44 . HA 1 1 612 1 2 1 1 46 TRP H B 46 . HN 1 1 613 1 1 1 1 44 THR HB B 44 . HB 1 1 613 1 2 1 1 44 THR MG B 44 . HG21 1 1 614 1 1 1 1 44 THR HB B 44 . HB 1 1 614 1 2 1 1 45 PRO HD2 B 45 . HD2 1 1 615 1 1 1 1 44 THR HB B 44 . HB 1 1 615 1 2 1 1 46 TRP H B 46 . HN 1 1 616 1 1 1 1 44 THR MG B 44 . HG21 1 1 616 1 2 1 1 45 PRO HD2 B 45 . HD2 1 1 617 1 1 1 1 44 THR MG B 44 . HG21 1 1 617 1 2 1 1 45 PRO HD3 B 45 . HD1 1 1 618 1 1 1 1 44 THR MG B 44 . HG21 1 1 618 1 2 1 1 46 TRP H B 46 . HN 1 1 619 1 1 1 1 44 THR MG B 44 . HG21 1 1 619 1 2 1 1 46 TRP HE1 B 46 . HE1 1 1 620 1 1 1 1 44 THR MG B 44 . HG21 1 1 620 1 2 1 1 46 TRP HZ2 B 46 . HZ2 1 1 621 1 1 1 1 44 THR MG B 44 . HG21 1 1 621 1 2 1 1 47 ASN HD21 B 47 . HD21 1 1 622 1 1 1 1 45 PRO HA B 45 . HA 1 1 622 1 2 1 1 45 PRO QB B 45 . HB1 1 1 623 1 1 1 1 45 PRO HA B 45 . HA 1 1 623 1 2 1 1 45 PRO HD2 B 45 . HD2 1 1 624 1 1 1 1 45 PRO HA B 45 . HA 1 1 624 1 2 1 1 45 PRO QG B 45 . HG1 1 1 625 1 1 1 1 45 PRO HA B 45 . HA 1 1 625 1 2 1 1 46 TRP H B 46 . HN 1 1 626 1 1 1 1 45 PRO QB B 45 . HB1 1 1 626 1 2 1 1 45 PRO HD2 B 45 . HD2 1 1 627 1 1 1 1 45 PRO QB B 45 . HB1 1 1 627 1 2 1 1 45 PRO HD3 B 45 . HD1 1 1 628 1 1 1 1 45 PRO QB B 45 . HB2 1 1 628 1 2 1 1 46 TRP H B 46 . HN 1 1 629 1 1 1 1 45 PRO QB B 45 . HB2 1 1 629 1 2 1 1 46 TRP HE3 B 46 . HE3 1 1 630 1 1 1 1 45 PRO HD2 B 45 . HD2 1 1 630 1 2 1 1 46 TRP HH2 B 46 . HH2 1 1 631 1 1 1 1 45 PRO HD3 B 45 . HD1 1 1 631 1 2 1 1 46 TRP HH2 B 46 . HH2 1 1 632 1 1 1 1 45 PRO QG B 45 . HG1 1 1 632 1 2 1 1 46 TRP H B 46 . HN 1 1 633 1 1 1 1 46 TRP H B 46 . HN 1 1 633 1 2 1 1 46 TRP QB B 46 . HB1 1 1 634 1 1 1 1 46 TRP H B 46 . HN 1 1 634 1 2 1 1 47 ASN H B 47 . HN 1 1 635 1 1 1 1 46 TRP H B 46 . HN 1 1 635 1 2 1 1 47 ASN HA B 47 . HA 1 1 636 1 1 1 1 46 TRP HA B 46 . HA 1 1 636 1 2 1 1 46 TRP HB2 B 46 . HB1 1 1 637 1 1 1 1 46 TRP HA B 46 . HA 1 1 637 1 2 1 1 46 TRP QB B 46 . HB1 1 1 638 1 1 1 1 46 TRP HA B 46 . HA 1 1 638 1 2 1 1 46 TRP HB3 B 46 . HB2 1 1 639 1 1 1 1 46 TRP HA B 46 . HA 1 1 639 1 2 1 1 46 TRP HD1 B 46 . HD1 1 1 640 1 1 1 1 46 TRP HA B 46 . HA 1 1 640 1 2 1 1 46 TRP HE3 B 46 . HE3 1 1 641 1 1 1 1 46 TRP HA B 46 . HA 1 1 641 1 2 1 1 47 ASN H B 47 . HN 1 1 642 1 1 1 1 46 TRP QB B 46 . HB1 1 1 642 1 2 1 1 47 ASN H B 47 . HN 1 1 643 1 1 1 1 46 TRP QB B 46 . HB1 1 1 643 1 2 1 1 48 CYS H B 48 . HN 1 1 644 1 1 1 1 46 TRP HB2 B 46 . HB1 1 1 644 1 2 1 1 46 TRP HD1 B 46 . HD1 1 1 645 1 1 1 1 46 TRP HB3 B 46 . HB2 1 1 645 1 2 1 1 46 TRP HE3 B 46 . HE3 1 1 646 1 1 1 1 47 ASN H B 47 . HN 1 1 646 1 2 1 1 47 ASN HA B 47 . HA 1 1 647 1 1 1 1 47 ASN H B 47 . HN 1 1 647 1 2 1 1 47 ASN HB2 B 47 . HB1 1 1 648 1 1 1 1 47 ASN H B 47 . HN 1 1 648 1 2 1 1 47 ASN HB3 B 47 . HB2 1 1 649 1 1 1 1 47 ASN HA B 47 . HA 1 1 649 1 2 1 1 47 ASN HB2 B 47 . HB1 1 1 650 1 1 1 1 47 ASN HA B 47 . HA 1 1 650 1 2 1 1 47 ASN HB3 B 47 . HB2 1 1 651 1 1 1 1 47 ASN HA B 47 . HA 1 1 651 1 2 1 1 48 CYS H B 48 . HN 1 1 652 1 1 1 1 47 ASN HB2 B 47 . HB1 1 1 652 1 2 1 1 48 CYS H B 48 . HN 1 1 653 1 1 1 1 47 ASN HB3 B 47 . HB2 1 1 653 1 2 1 1 48 CYS H B 48 . HN 1 1 654 1 1 1 1 48 CYS H B 48 . HN 1 1 654 1 2 1 1 48 CYS HB2 B 48 . HB1 1 1 655 1 1 1 1 48 CYS H B 48 . HN 1 1 655 1 2 1 1 48 CYS HB3 B 48 . HB2 1 1 656 1 1 1 1 48 CYS H B 48 . HN 1 1 656 1 2 1 1 49 ILE HG12 B 49 . HG11 1 1 657 1 1 1 1 48 CYS HA B 48 . HA 1 1 657 1 2 1 1 48 CYS HB3 B 48 . HB2 1 1 658 1 1 1 1 48 CYS HA B 48 . HA 1 1 658 1 2 1 1 49 ILE H B 49 . HN 1 1 659 1 1 1 1 48 CYS HA B 48 . HA 1 1 659 1 2 1 1 50 PHE H B 50 . HN 1 1 660 1 1 1 1 48 CYS HB2 B 48 . HB1 1 1 660 1 2 1 1 49 ILE H B 49 . HN 1 1 661 1 1 1 1 48 CYS HB3 B 48 . HB2 1 1 661 1 2 1 1 49 ILE H B 49 . HN 1 1 662 1 1 1 1 48 CYS HB3 B 48 . HB2 1 1 662 1 2 1 1 50 PHE H B 50 . HN 1 1 663 1 1 1 1 49 ILE H B 49 . HN 1 1 663 1 2 1 1 49 ILE HA B 49 . HA 1 1 664 1 1 1 1 49 ILE H B 49 . HN 1 1 664 1 2 1 1 49 ILE HB B 49 . HB 1 1 665 1 1 1 1 49 ILE H B 49 . HN 1 1 665 1 2 1 1 49 ILE MD B 49 . HD11 1 1 666 1 1 1 1 49 ILE H B 49 . HN 1 1 666 1 2 1 1 49 ILE HG12 B 49 . HG11 1 1 667 1 1 1 1 49 ILE H B 49 . HN 1 1 667 1 2 1 1 49 ILE MG B 49 . HG21 1 1 668 1 1 1 1 49 ILE H B 49 . HN 1 1 668 1 2 1 1 50 PHE H B 50 . HN 1 1 669 1 1 1 1 49 ILE HA B 49 . HA 1 1 669 1 2 1 1 49 ILE HB B 49 . HB 1 1 670 1 1 1 1 49 ILE HA B 49 . HA 1 1 670 1 2 1 1 49 ILE MD B 49 . HD11 1 1 671 1 1 1 1 49 ILE HA B 49 . HA 1 1 671 1 2 1 1 49 ILE HG12 B 49 . HG11 1 1 672 1 1 1 1 49 ILE HA B 49 . HA 1 1 672 1 2 1 1 49 ILE MG B 49 . HG21 1 1 673 1 1 1 1 49 ILE HA B 49 . HA 1 1 673 1 2 1 1 50 PHE H B 50 . HN 1 1 674 1 1 1 1 49 ILE HA B 49 . HA 1 1 674 1 2 1 1 52 ARG QD B 52 . HD1 1 1 675 1 1 1 1 49 ILE HA B 49 . HA 1 1 675 1 2 1 1 52 ARG QG B 52 . HG1 1 1 676 1 1 1 1 49 ILE HB B 49 . HB 1 1 676 1 2 1 1 49 ILE MD B 49 . HD11 1 1 677 1 1 1 1 49 ILE HB B 49 . HB 1 1 677 1 2 1 1 49 ILE HG12 B 49 . HG11 1 1 678 1 1 1 1 49 ILE HB B 49 . HB 1 1 678 1 2 1 1 49 ILE MG B 49 . HG21 1 1 679 1 1 1 1 49 ILE HB B 49 . HB 1 1 679 1 2 1 1 50 PHE H B 50 . HN 1 1 680 1 1 1 1 49 ILE HB B 49 . HB 1 1 680 1 2 1 1 50 PHE QD B 50 . HD1 1 1 681 1 1 1 1 49 ILE MD B 49 . HD11 1 1 681 1 2 1 1 49 ILE HG12 B 49 . HG11 1 1 682 1 1 1 1 49 ILE MD B 49 . HD11 1 1 682 1 2 1 1 50 PHE H B 50 . HN 1 1 683 1 1 1 1 49 ILE MD B 49 . HD11 1 1 683 1 2 1 1 50 PHE QD B 50 . HD1 1 1 684 1 1 1 1 49 ILE HG12 B 49 . HG11 1 1 684 1 2 1 1 49 ILE MG B 49 . HG21 1 1 685 1 1 1 1 49 ILE HG12 B 49 . HG11 1 1 685 1 2 1 1 50 PHE H B 50 . HN 1 1 686 1 1 1 1 49 ILE HG12 B 49 . HG11 1 1 686 1 2 1 1 50 PHE QD B 50 . HD1 1 1 687 1 1 1 1 49 ILE MG B 49 . HG21 1 1 687 1 2 1 1 50 PHE H B 50 . HN 1 1 688 1 1 1 1 49 ILE MG B 49 . HG21 1 1 688 1 2 1 1 50 PHE QD B 50 . HD1 1 1 689 1 1 1 1 50 PHE H B 50 . HN 1 1 689 1 2 1 1 50 PHE HB2 B 50 . HB1 1 1 690 1 1 1 1 50 PHE H B 50 . HN 1 1 690 1 2 1 1 50 PHE HB3 B 50 . HB2 1 1 691 1 1 1 1 50 PHE H B 50 . HN 1 1 691 1 2 1 1 50 PHE QD B 50 . HD1 1 1 692 1 1 1 1 50 PHE H B 50 . HN 1 1 692 1 2 1 1 51 CYS H B 51 . HN 1 1 693 1 1 1 1 50 PHE HA B 50 . HA 1 1 693 1 2 1 1 50 PHE HB3 B 50 . HB2 1 1 694 1 1 1 1 50 PHE HA B 50 . HA 1 1 694 1 2 1 1 50 PHE QD B 50 . HD1 1 1 695 1 1 1 1 50 PHE HA B 50 . HA 1 1 695 1 2 1 1 53 MET HG3 B 53 . HG2 1 1 696 1 1 1 1 50 PHE HB2 B 50 . HB1 1 1 696 1 2 1 1 50 PHE QD B 50 . HD1 1 1 697 1 1 1 1 50 PHE HB2 B 50 . HB1 1 1 697 1 2 1 1 51 CYS H B 51 . HN 1 1 698 1 1 1 1 50 PHE HB3 B 50 . HB2 1 1 698 1 2 1 1 50 PHE QD B 50 . HD1 1 1 699 1 1 1 1 50 PHE HB3 B 50 . HB2 1 1 699 1 2 1 1 51 CYS H B 51 . HN 1 1 700 1 1 1 1 51 CYS H B 51 . HN 1 1 700 1 2 1 1 51 CYS HB3 B 51 . HB2 1 1 701 1 1 1 1 51 CYS H B 51 . HN 1 1 701 1 2 1 1 52 ARG H B 52 . HN 1 1 702 1 1 1 1 51 CYS HA B 51 . HA 1 1 702 1 2 1 1 51 CYS HB2 B 51 . HB1 1 1 703 1 1 1 1 51 CYS HA B 51 . HA 1 1 703 1 2 1 1 52 ARG H B 52 . HN 1 1 704 1 1 1 1 51 CYS QB B 51 . HB1 1 1 704 1 2 1 1 52 ARG H B 52 . HN 1 1 705 1 1 1 1 51 CYS QB B 51 . HB1 1 1 705 1 2 1 1 52 ARG HA B 52 . HA 1 1 706 1 1 1 1 52 ARG H B 52 . HN 1 1 706 1 2 1 1 52 ARG HA B 52 . HA 1 1 707 1 1 1 1 52 ARG H B 52 . HN 1 1 707 1 2 1 1 52 ARG QB B 52 . HB1 1 1 708 1 1 1 1 52 ARG H B 52 . HN 1 1 708 1 2 1 1 52 ARG QG B 52 . HG1 1 1 709 1 1 1 1 52 ARG HA B 52 . HA 1 1 709 1 2 1 1 52 ARG QD B 52 . HD1 1 1 710 1 1 1 1 52 ARG HA B 52 . HA 1 1 710 1 2 1 1 52 ARG QG B 52 . HG1 1 1 711 1 1 1 1 52 ARG HA B 52 . HA 1 1 711 1 2 1 1 53 MET H B 53 . HN 1 1 712 1 1 1 1 52 ARG HA B 52 . HA 1 1 712 1 2 1 1 54 LYS H B 54 . HN 1 1 713 1 1 1 1 52 ARG HA B 52 . HA 1 1 713 1 2 1 1 54 LYS QB B 54 . HB2 1 1 714 1 1 1 1 52 ARG QB B 52 . HB1 1 1 714 1 2 1 1 52 ARG QD B 52 . HD1 1 1 715 1 1 1 1 52 ARG QB B 52 . HB1 1 1 715 1 2 1 1 53 MET H B 53 . HN 1 1 716 2 1 1 1 52 ARG HD2 B 52 . HD1 1 1 716 2 2 1 1 52 ARG HG2 B 52 . HG1 1 1 716 3 1 1 1 52 ARG QD B 52 . HD1 1 1 716 3 2 1 1 52 ARG HG3 B 52 . HG2 1 1 717 1 1 1 1 52 ARG QG B 52 . HG1 1 1 717 1 2 1 1 53 MET H B 53 . HN 1 1 718 1 1 1 1 53 MET H B 53 . HN 1 1 718 1 2 1 1 53 MET HA B 53 . HA 1 1 719 1 1 1 1 53 MET H B 53 . HN 1 1 719 1 2 1 1 53 MET HB3 B 53 . HB2 1 1 720 1 1 1 1 53 MET H B 53 . HN 1 1 720 1 2 1 1 53 MET QG B 53 . HG1 1 1 721 1 1 1 1 53 MET H B 53 . HN 1 1 721 1 2 1 1 54 LYS H B 54 . HN 1 1 722 1 1 1 1 53 MET HA B 53 . HA 1 1 722 1 2 1 1 54 LYS H B 54 . HN 1 1 723 1 1 1 1 53 MET HG3 B 53 . HG2 1 1 723 1 2 1 1 54 LYS H B 54 . HN 1 1 724 1 1 1 1 54 LYS H B 54 . HN 1 1 724 1 2 1 1 54 LYS QB B 54 . HB2 1 1 725 1 1 1 1 54 LYS H B 54 . HN 1 1 725 1 2 1 1 54 LYS QG B 54 . HG1 1 1 726 1 1 1 1 54 LYS H B 54 . HN 1 1 726 1 2 1 1 55 GLU H B 55 . HN 1 1 727 1 1 1 1 54 LYS HA B 54 . HA 1 1 727 1 2 1 1 54 LYS QB B 54 . HB1 1 1 728 1 1 1 1 54 LYS HA B 54 . HA 1 1 728 1 2 1 1 54 LYS QG B 54 . HG1 1 1 729 1 1 1 1 54 LYS HA B 54 . HA 1 1 729 1 1 1 1 55 GLU HA B 55 . HA 1 1 729 1 2 1 1 55 GLU H B 55 . HN 1 1 730 1 1 1 1 54 LYS QB B 54 . HB1 1 1 730 1 2 1 1 54 LYS HE3 B 54 . HE2 1 1 731 1 1 1 1 54 LYS QB B 54 . HB2 1 1 731 1 2 1 1 54 LYS QG B 54 . HG1 1 1 732 1 1 1 1 54 LYS QB B 54 . HB2 1 1 732 1 2 1 1 55 GLU H B 55 . HN 1 1 733 1 1 1 1 54 LYS HD2 B 54 . HD1 1 1 733 1 2 1 1 54 LYS HE3 B 54 . HE2 1 1 734 1 1 1 1 54 LYS HE3 B 54 . HE2 1 1 734 1 2 1 1 54 LYS QG B 54 . HG2 1 1 735 1 1 1 1 54 LYS QG B 54 . HG1 1 1 735 1 2 1 1 56 SER H B 56 . HN 1 1 736 1 1 1 1 55 GLU H B 55 . HN 1 1 736 1 2 1 1 55 GLU HB2 B 55 . HB1 1 1 737 1 1 1 1 55 GLU H B 55 . HN 1 1 737 1 2 1 1 55 GLU HB3 B 55 . HB2 1 1 738 1 1 1 1 55 GLU H B 55 . HN 1 1 738 1 2 1 1 55 GLU QG B 55 . HG1 1 1 739 1 1 1 1 55 GLU HA B 55 . HA 1 1 739 1 2 1 1 55 GLU HB2 B 55 . HB1 1 1 740 1 1 1 1 55 GLU HA B 55 . HA 1 1 740 1 2 1 1 55 GLU HB3 B 55 . HB2 1 1 741 1 1 1 1 55 GLU HA B 55 . HA 1 1 741 1 2 1 1 55 GLU HG3 B 55 . HG2 1 1 742 1 1 1 1 55 GLU HA B 55 . HA 1 1 742 1 2 1 1 56 SER H B 56 . HN 1 1 743 1 1 1 1 55 GLU HB2 B 55 . HB1 1 1 743 1 2 1 1 56 SER H B 56 . HN 1 1 744 1 1 1 1 55 GLU HB3 B 55 . HB2 1 1 744 1 2 1 1 56 SER H B 56 . HN 1 1 745 1 1 1 1 56 SER H B 56 . HN 1 1 745 1 2 1 1 56 SER HB3 B 56 . HB2 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 . . . . . 4.869 1.906 7.832 1 1 2 1 . . . . . 4.339 1.986 6.692 1 1 3 1 . . . . . 2.451 1.7 3.202 1 1 4 1 . . . . . 3.044 1.885 4.203 1 1 5 1 . . . . . 3.832 1.996 5.668 1 1 6 1 . . . . . 4.218 1.994 6.442 1 1 7 1 . . . . . 3.388 1.953 4.823 1 1 8 1 . . . . . 4.24 1.993 6.487 1 1 9 2 . . . . . 2.404 1.682 3.126 1 1 9 3 . . . . . 2.404 1.682 3.126 1 1 10 2 . . . . . 3.01 1.878 4.142 1 1 10 3 . . . . . 3.01 1.878 4.142 1 1 11 1 . . . . . 2.766 1.809 3.723 1 1 12 1 . . . . . 4.036 2.0 6.072 1 1 13 1 . . . . . 3.011 1.878 4.144 1 1 14 1 . . . . . 4.728 1.933 7.523 1 1 15 1 . . . . . 4.875 1.905 7.845 1 1 16 1 . . . . . 2.626 1.764 3.488 1 1 17 1 . . . . . 2.467 1.706 3.228 1 1 18 1 . . . . . 2.763 1.809 3.717 1 1 19 1 . . . . . 2.661 1.776 3.546 1 1 20 1 . . . . . 3.282 1.936 4.628 1 1 21 1 . . . . . 2.854 1.836 3.872 1 1 22 1 . . . . . 2.329 1.651 3.007 1 1 23 1 . . . . . 3.592 1.979 5.205 1 1 24 1 . . . . . 2.611 1.759 3.463 1 1 25 1 . . . . . 4.481 1.972 6.99 1 1 26 1 . . . . . 2.556 1.739 3.373 1 1 27 1 . . . . . 4.413 1.978 6.848 1 1 28 1 . . . . . 2.706 1.791 3.621 1 1 29 1 . . . . . 3.364 1.95 4.778 1 1 30 1 . . . . . 2.478 1.71 3.246 1 1 31 1 . . . . . 2.677 1.782 3.572 1 1 32 1 . . . . . 2.73 1.799 3.661 1 1 33 1 . . . . . 2.347 1.659 3.035 1 1 34 2 . . . . . 2.582 1.749 3.415 1 1 34 3 . . . . . 2.582 1.749 3.415 1 1 35 1 . . . . . 3.508 1.97 5.046 1 1 36 1 . . . . . 3.974 2.0 5.948 1 1 37 2 . . . . . 2.236 1.611 2.861 1 1 37 3 . . . . . 2.236 1.611 2.861 1 1 38 1 . . . . . 3.479 1.966 4.992 1 1 39 1 . . . . . 4.564 1.961 7.167 1 1 40 1 . . . . . 3.097 1.898 4.296 1 1 41 1 . . . . . 2.971 1.868 4.074 1 1 42 1 . . . . . 2.677 1.781 3.573 1 1 43 1 . . . . . 2.667 1.778 3.556 1 1 44 1 . . . . . 4.115 1.998 6.232 1 1 45 1 . . . . . 2.987 1.872 4.102 1 1 46 1 . . . . . 3.605 1.98 5.23 1 1 47 1 . . . . . 3.503 1.969 5.037 1 1 48 1 . . . . . 3.64 1.984 5.296 1 1 49 1 . . . . . 4.184 1.996 6.372 1 1 50 1 . . . . . 4.137 1.998 6.276 1 1 51 1 . . . . . 3.699 1.988 5.41 1 1 52 1 . . . . . 3.952 1.999 5.905 1 1 53 1 . . . . . 4.553 1.962 7.144 1 1 54 1 . . . . . 2.599 1.754 3.444 1 1 55 1 . . . . . 3.791 1.995 5.587 1 1 56 1 . . . . . 1.999 1.5 2.498 1 1 57 1 . . . . . 2.6 1.755 3.445 1 1 58 1 . . . . . 3.634 1.983 5.285 1 1 59 1 . . . . . 2.545 1.735 3.355 1 1 60 1 . . . . . 3.556 1.975 5.137 1 1 61 1 . . . . . 2.309 1.777 2.975 1 1 62 1 . . . . . 1.934 1.467 2.401 1 1 63 1 . . . . . 2.77 1.811 3.729 1 1 64 1 . . . . . 4.266 1.991 6.541 1 1 65 1 . . . . . 3.72 1.99 5.45 1 1 66 1 . . . . . 3.644 1.984 5.304 1 1 67 1 . . . . . 3.975 2.0 5.95 1 1 68 1 . . . . . 3.454 1.963 4.945 1 1 69 1 . . . . . 3.97 2.0 5.94 1 1 70 1 . . . . . 3.967 2.0 5.934 1 1 71 1 . . . . . 3.276 1.935 4.617 1 1 72 1 . . . . . 2.282 1.631 2.933 1 1 73 1 . . . . . 2.267 1.625 2.909 1 1 74 1 . . . . . 2.471 1.708 3.234 1 1 75 1 . . . . . 2.732 1.799 3.665 1 1 76 1 . . . . . 2.223 1.605 2.841 1 1 77 1 . . . . . 2.587 1.75 3.424 1 1 78 1 . . . . . 2.899 1.848 3.95 1 1 79 1 . . . . . 3.109 1.901 4.317 1 1 80 1 . . . . . 4.391 1.981 6.801 1 1 81 1 . . . . . 2.764 1.809 3.719 1 1 82 1 . . . . . 2.814 1.824 3.804 1 1 83 1 . . . . . 2.6 1.755 3.445 1 1 84 1 . . . . . 3.995 2.0 5.99 1 1 85 1 . . . . . 4.577 1.958 7.196 1 1 86 1 . . . . . 2.404 1.682 3.126 1 1 87 1 . . . . . 2.53 1.73 3.33 1 1 88 1 . . . . . 3.215 1.923 4.507 1 1 89 1 . . . . . 3.915 1.999 5.831 1 1 90 1 . . . . . 3.79 1.995 5.585 1 1 91 1 . . . . . 3.646 1.985 5.307 1 1 92 1 . . . . . 2.779 1.814 3.744 1 1 93 1 . . . . . 2.387 1.675 3.099 1 1 94 1 . . . . . 2.384 1.674 3.094 1 1 95 1 . . . . . 3.83 1.996 5.664 1 1 96 1 . . . . . 2.457 1.702 3.212 1 1 97 1 . . . . . 2.184 1.588 2.78 1 1 98 1 . . . . . 3.367 1.95 4.784 1 1 99 1 . . . . . 4.265 1.992 6.538 1 1 100 1 . . . . . 4.13 1.998 6.262 1 1 101 1 . . . . . 3.985 2.0 5.97 1 1 102 1 . . . . . 3.35 1.947 4.753 1 1 103 1 . . . . . 4.163 1.997 6.329 1 1 104 1 . . . . . 3.575 1.977 5.173 1 1 105 1 . . . . . 2.888 1.845 3.931 1 1 106 1 . . . . . 2.546 1.736 3.356 1 1 107 1 . . . . . 3.014 1.878 4.15 1 1 108 1 . . . . . 2.449 1.699 3.199 1 1 109 1 . . . . . 4.801 1.92 7.682 1 1 110 1 . . . . . 4.636 1.949 7.323 1 1 111 1 . . . . . 4.239 1.993 6.485 1 1 112 1 . . . . . 3.774 1.994 5.554 1 1 113 1 . . . . . 2.871 1.841 3.901 1 1 114 1 . . . . . 2.146 1.57 2.722 1 1 115 1 . . . . . 2.479 1.711 3.247 1 1 116 1 . . . . . 2.872 1.841 3.903 1 1 117 1 . . . . . 3.172 1.914 4.43 1 1 118 1 . . . . . 3.911 1.999 5.823 1 1 119 1 . . . . . 2.722 1.796 3.648 1 1 120 1 . . . . . 3.05 1.887 4.213 1 1 121 1 . . . . . 3.578 1.978 5.178 1 1 122 1 . . . . . 2.723 1.796 3.65 1 1 123 1 . . . . . 3.333 1.944 4.722 1 1 124 1 . . . . . 3.189 1.918 4.46 1 1 125 1 . . . . . 4.45 1.975 6.925 1 1 126 1 . . . . . 3.75 1.992 5.508 1 1 127 1 . . . . . 2.686 1.784 3.588 1 1 128 1 . . . . . 2.19 1.59 2.79 1 1 129 1 . . . . . 2.195 1.955 2.797 1 1 130 1 . . . . . 2.345 1.658 3.032 1 1 131 1 . . . . . 2.22 1.604 2.836 1 1 132 1 . . . . . 2.575 1.746 3.404 1 1 133 1 . . . . . 2.25 1.663 2.883 1 1 134 1 . . . . . 3.372 1.951 4.793 1 1 135 1 . . . . . 3.634 1.983 5.285 1 1 136 1 . . . . . 3.007 1.877 4.137 1 1 137 1 . . . . . 2.609 1.758 3.46 1 1 138 1 . . . . . 4.207 1.995 6.419 1 1 139 1 . . . . . 2.121 1.559 2.384 1 1 140 1 . . . . . 2.507 1.721 6.0 1 1 141 1 . . . . . 4.014 2.0 6.028 1 1 142 1 . . . . . 1.779 1.383 2.175 1 1 143 1 . . . . . 2.971 1.937 4.074 1 1 144 1 . . . . . 3.516 1.971 5.061 1 1 145 1 . . . . . 4.263 1.992 6.534 1 1 146 1 . . . . . 4.095 1.999 6.191 1 1 147 1 . . . . . 3.978 2.0 5.956 1 1 148 1 . . . . . 4.839 1.912 7.766 1 1 149 1 . . . . . 3.178 1.916 4.44 1 1 150 1 . . . . . 3.173 1.915 4.431 1 1 151 1 . . . . . 2.137 1.988 2.708 1 1 152 1 . . . . . 3.758 1.993 5.523 1 1 153 1 . . . . . 3.474 1.965 4.983 1 1 154 1 . . . . . 3.453 2.0 4.943 1 1 155 1 . . . . . 2.839 1.903 3.846 1 1 156 1 . . . . . 3.029 1.882 4.176 1 1 157 1 . . . . . 4.055 1.999 6.111 1 1 158 1 . . . . . 3.454 1.963 4.945 1 1 159 1 . . . . . 2.876 1.842 3.91 1 1 160 1 . . . . . 2.183 1.587 2.779 1 1 161 1 . . . . . 3.526 1.972 5.08 1 1 162 1 . . . . . 2.524 1.727 3.321 1 1 163 1 . . . . . 4.616 1.953 7.279 1 1 164 1 . . . . . 4.44 1.976 6.904 1 1 165 1 . . . . . 4.112 1.998 6.226 1 1 166 1 . . . . . 2.65 1.772 3.528 1 1 167 1 . . . . . 2.463 1.704 3.222 1 1 168 1 . . . . . 3.072 1.893 4.251 1 1 169 1 . . . . . 3.688 1.988 5.388 1 1 170 1 . . . . . 2.886 1.845 3.927 1 1 171 1 . . . . . 2.912 1.852 3.972 1 1 172 1 . . . . . 2.595 1.753 3.437 1 1 173 1 . . . . . 2.907 1.851 3.963 1 1 174 1 . . . . . 2.581 1.748 3.414 1 1 175 1 . . . . . 2.495 1.717 3.273 1 1 176 1 . . . . . 4.403 1.98 6.826 1 1 177 1 . . . . . 2.191 1.591 2.791 1 1 178 1 . . . . . 4.104 1.999 6.209 1 1 179 1 . . . . . 2.733 1.8 3.666 1 1 180 1 . . . . . 2.79 1.817 3.763 1 1 181 1 . . . . . 3.17 1.914 4.426 1 1 182 1 . . . . . 4.064 1.999 6.129 1 1 183 1 . . . . . 4.74 1.932 7.548 1 1 184 1 . . . . . 3.235 1.927 4.543 1 1 185 2 . . . . . 2.365 1.666 3.064 1 1 185 3 . . . . . 2.365 1.666 3.064 1 1 186 1 . . . . . 4.19 1.996 6.384 1 1 187 1 . . . . . 2.418 1.687 3.149 1 1 188 1 . . . . . 2.356 1.662 3.05 1 1 189 1 . . . . . 2.161 1.577 2.745 1 1 190 1 . . . . . 3.684 1.988 5.38 1 1 191 1 . . . . . 3.501 1.969 5.033 1 1 192 1 . . . . . 2.789 1.817 3.761 1 1 193 1 . . . . . 2.217 1.602 2.832 1 1 194 1 . . . . . 3.339 1.946 4.732 1 1 195 1 . . . . . 2.464 1.705 3.223 1 1 196 1 . . . . . 3.161 1.912 4.41 1 1 197 1 . . . . . 2.628 1.765 3.491 1 1 198 1 . . . . . 3.112 1.901 4.323 1 1 199 1 . . . . . 3.616 1.981 5.251 1 1 200 1 . . . . . 3.486 1.967 5.005 1 1 201 1 . . . . . 4.024 2.0 6.048 1 1 202 1 . . . . . 4.035 2.0 6.07 1 1 203 1 . . . . . 2.305 1.641 2.969 1 1 204 1 . . . . . 2.908 1.851 3.965 1 1 205 1 . . . . . 2.439 1.695 3.183 1 1 206 1 . . . . . 4.492 1.97 7.014 1 1 207 1 . . . . . 3.247 1.929 4.565 1 1 208 1 . . . . . 2.725 1.797 3.653 1 1 209 1 . . . . . 2.198 1.594 2.802 1 1 210 1 . . . . . 3.376 1.952 4.8 1 1 211 1 . . . . . 2.118 1.557 2.679 1 1 212 1 . . . . . 2.598 1.754 3.442 1 1 213 1 . . . . . 3.577 1.978 5.176 1 1 214 1 . . . . . 2.203 1.596 2.81 1 1 215 1 . . . . . 3.409 1.956 4.862 1 1 216 1 . . . . . 3.246 1.929 4.563 1 1 217 1 . . . . . 3.919 2.0 5.838 1 1 218 1 . . . . . 2.724 1.797 3.651 1 1 219 1 . . . . . 2.707 1.791 3.623 1 1 220 1 . . . . . 2.115 1.556 2.674 1 1 221 1 . . . . . 4.658 1.946 7.37 1 1 222 1 . . . . . 3.763 1.993 5.533 1 1 223 1 . . . . . 3.421 1.958 4.884 1 1 224 1 . . . . . 3.476 1.965 4.987 1 1 225 1 . . . . . 3.148 1.909 4.387 1 1 226 1 . . . . . 3.011 1.878 4.144 1 1 227 1 . . . . . 3.559 1.976 5.142 1 1 228 1 . . . . . 3.528 1.972 5.084 1 1 229 1 . . . . . 3.234 1.926 4.542 1 1 230 1 . . . . . 4.149 1.998 6.3 1 1 231 1 . . . . . 4.609 1.953 7.265 1 1 232 1 . . . . . 4.35 1.985 6.715 1 1 233 1 . . . . . 2.31 1.643 2.977 1 1 234 1 . . . . . 3.343 1.946 4.74 1 1 235 1 . . . . . 4.525 1.999 6.127 1 1 236 1 . . . . . 4.185 1.996 6.374 1 1 237 1 . . . . . 4.594 1.956 7.232 1 1 238 1 . . . . . 2.791 1.817 3.765 1 1 239 1 . . . . . 2.274 1.627 2.921 1 1 240 1 . . . . . 2.406 1.927 3.13 1 1 241 1 . . . . . 2.893 1.847 3.939 1 1 242 1 . . . . . 2.301 1.639 2.963 1 1 243 1 . . . . . 3.99 2.0 5.98 1 1 244 1 . . . . . 4.051 2.0 6.102 1 1 245 1 . . . . . 2.867 1.84 3.894 1 1 246 1 . . . . . 3.34 1.946 4.734 1 1 247 1 . . . . . 4.061 1.999 6.123 1 1 248 1 . . . . . . 1.964 2.933 1 1 249 1 . . . . . 2.669 1.778 3.56 1 1 250 1 . . . . . 4.525 1.965 7.085 1 1 251 1 . . . . . 4.103 1.999 6.207 1 1 252 1 . . . . . 4.75 1.929 7.571 1 1 253 1 . . . . . 2.662 1.776 3.273 1 1 254 1 . . . . . 2.152 1.573 2.634 1 1 255 1 . . . . . 3.219 1.924 4.514 1 1 256 1 . . . . . 2.591 1.752 3.43 1 1 257 1 . . . . . 3.319 1.942 4.696 1 1 258 1 . . . . . 4.217 1.994 6.44 1 1 259 1 . . . . . 1.996 1.498 2.494 1 1 260 1 . . . . . 4.592 1.995 5.593 1 1 261 1 . . . . . 4.267 1.991 6.543 1 1 262 1 . . . . . 3.873 1.998 5.748 1 1 263 1 . . . . . 2.679 1.782 3.576 1 1 264 1 . . . . . 3.124 1.904 4.344 1 1 265 1 . . . . . 3.716 1.99 5.442 1 1 266 1 . . . . . 4.236 1.993 6.479 1 1 267 1 . . . . . 3.057 1.889 3.513 1 1 268 1 . . . . . 2.649 1.968 3.526 1 1 269 1 . . . . . . 1.933 4.31 1 1 270 1 . . . . . 3.749 1.992 5.506 1 1 271 1 . . . . . 3.922 1.999 5.845 1 1 272 1 . . . . . 3.288 1.973 4.639 1 1 273 1 . . . . . 3.962 1.999 5.925 1 1 274 1 . . . . . 2.65 1.772 3.528 1 1 275 1 . . . . . 2.652 1.773 3.531 1 1 276 1 . . . . . 4.039 2.0 6.078 1 1 277 1 . . . . . 3.403 1.956 4.85 1 1 278 1 . . . . . 3.135 1.906 4.364 1 1 279 1 . . . . . 4.949 1.887 8.011 1 1 280 1 . . . . . 3.825 1.997 5.653 1 1 281 1 . . . . . 4.797 1.92 7.674 1 1 282 1 . . . . . 2.943 1.86 4.026 1 1 283 1 . . . . . 3.214 1.922 4.506 1 1 284 1 . . . . . 3.925 2.0 5.85 1 1 285 1 . . . . . 3.026 1.882 4.17 1 1 286 1 . . . . . 3.069 1.892 4.246 1 1 287 1 . . . . . 2.672 1.78 3.564 1 1 288 1 . . . . . 3.116 1.902 4.33 1 1 289 1 . . . . . 3.471 1.965 4.977 1 1 290 1 . . . . . 3.189 1.918 4.46 1 1 291 1 . . . . . 3.505 1.97 5.04 1 1 292 1 . . . . . 3.065 1.89 4.24 1 1 293 1 . . . . . 3.34 1.945 4.735 1 1 294 1 . . . . . 3.672 1.986 5.358 1 1 295 1 . . . . . 2.719 1.795 3.643 1 1 296 1 . . . . . 4.106 1.999 6.213 1 1 297 1 . . . . . 3.0 1.875 4.125 1 1 298 1 . . . . . 2.736 1.8 3.672 1 1 299 1 . . . . . 2.58 1.748 3.412 1 1 300 1 . . . . . 4.715 1.936 7.494 1 1 301 1 . . . . . 3.275 1.934 4.616 1 1 302 1 . . . . . 3.487 1.967 5.007 1 1 303 1 . . . . . 4.2 1.995 6.405 1 1 304 1 . . . . . 4.309 1.988 6.63 1 1 305 1 . . . . . 4.147 1.998 6.296 1 1 306 1 . . . . . 4.522 1.966 7.078 1 1 307 1 . . . . . 3.758 1.992 5.524 1 1 308 1 . . . . . 2.979 1.869 4.089 1 1 309 1 . . . . . 3.026 1.881 4.171 1 1 310 1 . . . . . 3.021 1.881 4.161 1 1 311 1 . . . . . 4.057 1.999 6.115 1 1 312 1 . . . . . 2.404 1.682 3.126 1 1 313 1 . . . . . 3.074 1.892 4.256 1 1 314 1 . . . . . 3.929 1.999 5.859 1 1 315 1 . . . . . 4.006 2.0 6.012 1 1 316 1 . . . . . 3.961 2.0 5.922 1 1 317 1 . . . . . 4.013 2.0 6.026 1 1 318 1 . . . . . 2.812 1.823 3.801 1 1 319 1 . . . . . 2.701 1.789 3.613 1 1 320 1 . . . . . 2.699 1.788 3.61 1 1 321 1 . . . . . 2.719 1.795 3.643 1 1 322 1 . . . . . 3.242 1.928 4.556 1 1 323 1 . . . . . 3.875 1.998 5.752 1 1 324 1 . . . . . 2.781 1.814 3.748 1 1 325 1 . . . . . 2.788 1.816 3.76 1 1 326 1 . . . . . 2.886 1.845 3.927 1 1 327 1 . . . . . 2.423 1.689 3.157 1 1 328 1 . . . . . 2.577 1.747 3.407 1 1 329 1 . . . . . 2.846 1.833 3.859 1 1 330 1 . . . . . 2.643 1.77 3.516 1 1 331 1 . . . . . 2.619 1.762 3.476 1 1 332 1 . . . . . 2.303 1.64 2.966 1 1 333 1 . . . . . 3.655 1.985 5.325 1 1 334 1 . . . . . 2.534 1.731 3.337 1 1 335 1 . . . . . 2.694 1.787 3.601 1 1 336 1 . . . . . 2.326 1.65 3.002 1 1 337 1 . . . . . 2.98 1.87 4.09 1 1 338 1 . . . . . 3.167 1.913 4.421 1 1 339 1 . . . . . 4.223 1.994 6.452 1 1 340 1 . . . . . 4.02 2.0 6.04 1 1 341 1 . . . . . 2.031 1.515 2.547 1 1 342 1 . . . . . 2.534 1.731 3.337 1 1 343 1 . . . . . 3.72 1.99 5.45 1 1 344 1 . . . . . 3.437 1.961 4.913 1 1 345 1 . . . . . 2.946 1.861 4.031 1 1 346 1 . . . . . 2.648 1.772 3.524 1 1 347 1 . . . . . 2.688 1.785 3.591 1 1 348 1 . . . . . 3.877 1.998 5.756 1 1 349 1 . . . . . 2.929 1.857 4.001 1 1 350 1 . . . . . 2.537 1.733 3.341 1 1 351 1 . . . . . 2.747 1.803 3.691 1 1 352 1 . . . . . 2.567 1.743 3.391 1 1 353 1 . . . . . 2.58 1.748 3.412 1 1 354 1 . . . . . 2.826 1.828 3.824 1 1 355 1 . . . . . 3.826 1.996 5.656 1 1 356 1 . . . . . 4.086 1.999 6.173 1 1 357 1 . . . . . 3.465 1.964 4.966 1 1 358 1 . . . . . 3.921 1.999 5.843 1 1 359 1 . . . . . 3.148 1.909 4.387 1 1 360 1 . . . . . 3.613 1.981 5.245 1 1 361 1 . . . . . 3.803 1.996 5.61 1 1 362 1 . . . . . 2.784 1.815 3.753 1 1 363 1 . . . . . 2.358 1.663 3.053 1 1 364 1 . . . . . 2.688 1.785 3.591 1 1 365 1 . . . . . 4.617 1.952 7.282 1 1 366 1 . . . . . 2.333 1.653 3.013 1 1 367 1 . . . . . 3.671 1.986 5.356 1 1 368 1 . . . . . 2.893 1.847 3.939 1 1 369 1 . . . . . 2.911 1.958 3.97 1 1 370 1 . . . . . 3.823 1.996 5.65 1 1 371 1 . . . . . 5.109 1.847 8.371 1 1 372 1 . . . . . 2.609 1.758 3.46 1 1 373 1 . . . . . 2.165 1.579 2.751 1 1 374 1 . . . . . 4.102 1.998 6.206 1 1 375 1 . . . . . 3.093 1.897 4.289 1 1 376 1 . . . . . 2.469 1.707 3.231 1 1 377 1 . . . . . 2.642 1.77 3.514 1 1 378 1 . . . . . 2.599 1.755 3.443 1 1 379 1 . . . . . 3.812 1.995 5.629 1 1 380 1 . . . . . 3.535 1.973 5.097 1 1 381 2 . . . . . 2.529 1.729 3.329 1 1 381 3 . . . . . 2.529 1.729 3.329 1 1 382 1 . . . . . 3.877 1.999 5.755 1 1 383 1 . . . . . 3.516 1.97 5.062 1 1 384 2 . . . . . 2.323 1.649 2.997 1 1 384 3 . . . . . 2.323 1.649 2.997 1 1 385 1 . . . . . 2.507 1.721 3.293 1 1 386 1 . . . . . 3.634 1.983 5.285 1 1 387 1 . . . . . 2.457 1.702 3.212 1 1 388 1 . . . . . 2.435 1.694 3.176 1 1 389 1 . . . . . 2.636 1.767 3.505 1 1 390 1 . . . . . 2.487 1.714 3.26 1 1 391 1 . . . . . 2.248 1.617 2.879 1 1 392 1 . . . . . 3.326 1.943 4.709 1 1 393 1 . . . . . 3.706 1.989 5.423 1 1 394 1 . . . . . 2.207 1.598 2.816 1 1 395 1 . . . . . 2.172 1.582 2.762 1 1 396 1 . . . . . 2.861 1.838 3.884 1 1 397 1 . . . . . 3.794 1.995 5.593 1 1 398 1 . . . . . 3.832 1.997 5.667 1 1 399 1 . . . . . 1.929 1.464 2.394 1 1 400 1 . . . . . 3.971 2.0 5.942 1 1 401 1 . . . . . 3.746 1.992 5.5 1 1 402 1 . . . . . 3.328 1.943 4.713 1 1 403 1 . . . . . 3.969 2.0 5.938 1 1 404 1 . . . . . 4.283 1.99 6.576 1 1 405 1 . . . . . 3.922 1.999 5.845 1 1 406 1 . . . . . 3.101 1.899 4.303 1 1 407 1 . . . . . 3.559 1.976 5.142 1 1 408 1 . . . . . 3.819 1.996 5.642 1 1 409 1 . . . . . 2.907 1.851 3.963 1 1 410 1 . . . . . 3.975 2.0 5.95 1 1 411 1 . . . . . 2.965 1.866 4.064 1 1 412 1 . . . . . 2.787 1.816 3.758 1 1 413 1 . . . . . 3.225 1.925 4.525 1 1 414 1 . . . . . 2.761 1.808 3.714 1 1 415 1 . . . . . 4.055 1.999 6.111 1 1 416 1 . . . . . 3.948 2.0 5.896 1 1 417 1 . . . . . 3.261 1.932 4.59 1 1 418 1 . . . . . 4.189 1.996 6.382 1 1 419 1 . . . . . 3.823 1.997 5.649 1 1 420 1 . . . . . 3.654 1.985 5.323 1 1 421 1 . . . . . 3.316 1.942 4.69 1 1 422 1 . . . . . 3.801 1.995 5.607 1 1 423 1 . . . . . 3.219 1.924 4.514 1 1 424 1 . . . . . 2.917 1.853 3.981 1 1 425 1 . . . . . 2.695 1.787 3.603 1 1 426 1 . . . . . 2.293 1.636 2.95 1 1 427 1 . . . . . 2.457 1.702 3.212 1 1 428 1 . . . . . 2.966 1.866 4.066 1 1 429 1 . . . . . 4.594 1.956 7.232 1 1 430 1 . . . . . 4.321 1.987 6.655 1 1 431 1 . . . . . 2.423 1.689 3.157 1 1 432 1 . . . . . 2.956 1.864 4.048 1 1 433 1 . . . . . 4.155 1.997 6.313 1 1 434 1 . . . . . 3.513 1.971 5.055 1 1 435 1 . . . . . 3.432 1.96 4.904 1 1 436 1 . . . . . 2.452 1.999 3.204 1 1 437 1 . . . . . 3.971 2.0 5.942 1 1 438 1 . . . . . 3.01 1.878 4.142 1 1 439 1 . . . . . 2.414 1.686 3.142 1 1 440 1 . . . . . 3.603 1.98 6.0 1 1 441 1 . . . . . 3.851 1.997 5.705 1 1 442 1 . . . . . 3.266 1.933 4.599 1 1 443 1 . . . . . 4.653 1.947 7.359 1 1 444 1 . . . . . 3.596 1.98 5.212 1 1 445 1 . . . . . 2.998 1.875 4.121 1 1 446 1 . . . . . 2.804 1.821 3.787 1 1 447 1 . . . . . 2.37 1.668 3.072 1 1 448 1 . . . . . 2.785 1.815 3.755 1 1 449 1 . . . . . 2.519 1.726 3.312 1 1 450 1 . . . . . 4.448 1.975 6.921 1 1 451 1 . . . . . 2.889 1.845 3.933 1 1 452 1 . . . . . 3.976 2.0 5.952 1 1 453 1 . . . . . 4.346 1.985 6.707 1 1 454 1 . . . . . 2.268 1.625 2.911 1 1 455 1 . . . . . 2.628 1.765 3.491 1 1 456 1 . . . . . 2.6 1.755 3.445 1 1 457 1 . . . . . 2.706 1.791 3.621 1 1 458 1 . . . . . 3.397 1.955 4.839 1 1 459 1 . . . . . 3.493 1.968 5.018 1 1 460 1 . . . . . 3.322 1.942 4.702 1 1 461 1 . . . . . 2.767 1.81 3.724 1 1 462 1 . . . . . 3.899 1.999 5.799 1 1 463 1 . . . . . 2.138 1.567 2.709 1 1 464 1 . . . . . 4.176 1.996 6.356 1 1 465 1 . . . . . 2.48 1.711 3.249 1 1 466 1 . . . . . 2.484 1.713 3.255 1 1 467 1 . . . . . 4.415 1.979 6.851 1 1 468 1 . . . . . 2.598 1.754 3.442 1 1 469 1 . . . . . 4.143 1.997 6.289 1 1 470 1 . . . . . 4.779 1.925 7.633 1 1 471 1 . . . . . 2.801 1.821 3.781 1 1 472 1 . . . . . 2.312 1.644 2.98 1 1 473 1 . . . . . 4.557 1.961 7.153 1 1 474 1 . . . . . 3.641 1.984 5.298 1 1 475 1 . . . . . 4.897 1.899 7.895 1 1 476 1 . . . . . 4.974 1.881 8.067 1 1 477 1 . . . . . 2.982 1.887 4.093 1 1 478 1 . . . . . 3.419 1.958 4.88 1 1 479 1 . . . . . 3.819 1.996 5.642 1 1 480 1 . . . . . 3.592 1.979 5.205 1 1 481 1 . . . . . 2.979 1.87 4.088 1 1 482 1 . . . . . 4.342 1.986 6.698 1 1 483 1 . . . . . 2.727 1.797 3.657 1 1 484 1 . . . . . 3.945 2.0 5.89 1 1 485 1 . . . . . 3.622 1.99 5.262 1 1 486 1 . . . . . 2.856 1.837 3.875 1 1 487 1 . . . . . 2.244 1.974 2.874 1 1 488 1 . . . . . 2.488 1.714 3.262 1 1 489 1 . . . . . 4.389 1.981 6.797 1 1 490 1 . . . . . 2.651 1.969 3.529 1 1 491 2 . . . . . 2.742 1.802 3.682 1 1 491 3 . . . . . 2.742 1.802 3.682 1 1 492 1 . . . . . 3.329 1.944 4.714 1 1 493 1 . . . . . 2.553 1.738 3.368 1 1 494 1 . . . . . 3.837 1.997 5.677 1 1 495 1 . . . . . 2.988 1.872 4.104 1 1 496 1 . . . . . 2.299 1.638 2.96 1 1 497 1 . . . . . 3.594 1.98 5.208 1 1 498 1 . . . . . 4.882 1.903 7.861 1 1 499 1 . . . . . 3.373 1.951 4.795 1 1 500 1 . . . . . 4.677 1.943 7.411 1 1 501 1 . . . . . 4.601 1.955 7.247 1 1 502 1 . . . . . 5.107 1.847 8.367 1 1 503 1 . . . . . 3.901 1.998 5.804 1 1 504 1 . . . . . 2.819 1.826 3.812 1 1 505 1 . . . . . 2.4 1.68 3.12 1 1 506 1 . . . . . 2.789 1.817 3.761 1 1 507 1 . . . . . 4.057 2.0 6.114 1 1 508 1 . . . . . 4.161 1.996 6.326 1 1 509 1 . . . . . 3.063 1.89 4.236 1 1 510 1 . . . . . 2.85 1.835 3.865 1 1 511 1 . . . . . 3.49 1.967 5.013 1 1 512 1 . . . . . 3.113 1.902 4.324 1 1 513 1 . . . . . 4.163 1.997 6.329 1 1 514 1 . . . . . 4.485 1.97 7.0 1 1 515 1 . . . . . 5.028 1.868 8.188 1 1 516 1 . . . . . 2.827 1.828 3.826 1 1 517 1 . . . . . 2.383 1.673 3.093 1 1 518 1 . . . . . 3.51 1.97 5.05 1 1 519 1 . . . . . 2.484 1.713 3.255 1 1 520 1 . . . . . 3.587 1.979 5.195 1 1 521 1 . . . . . 2.998 1.874 4.122 1 1 522 1 . . . . . 3.65 1.984 5.316 1 1 523 1 . . . . . 2.76 1.808 3.712 1 1 524 1 . . . . . 3.138 1.907 4.369 1 1 525 1 . . . . . 2.393 1.677 3.109 1 1 526 1 . . . . . 2.618 1.761 3.475 1 1 527 1 . . . . . 2.854 1.836 3.872 1 1 528 1 . . . . . 2.514 1.724 3.304 1 1 529 1 . . . . . 2.175 1.584 2.766 1 1 530 1 . . . . . 2.3 1.639 2.961 1 1 531 1 . . . . . 2.356 1.662 3.05 1 1 532 1 . . . . . 2.622 1.763 3.481 1 1 533 1 . . . . . 2.802 1.821 3.783 1 1 534 1 . . . . . 2.877 1.843 3.911 1 1 535 1 . . . . . 2.966 1.866 4.066 1 1 536 1 . . . . . 3.588 1.979 5.197 1 1 537 1 . . . . . 3.575 1.978 5.172 1 1 538 1 . . . . . 2.72 1.795 3.645 1 1 539 1 . . . . . 3.935 2.0 5.87 1 1 540 1 . . . . . 2.238 1.612 2.864 1 1 541 1 . . . . . 3.999 2.0 5.998 1 1 542 1 . . . . . 4.049 2.0 6.098 1 1 543 1 . . . . . 2.35 1.66 3.04 1 1 544 1 . . . . . 1.982 1.491 2.473 1 1 545 1 . . . . . 2.764 1.809 3.719 1 1 546 1 . . . . . 2.543 1.734 3.352 1 1 547 1 . . . . . 2.54 1.734 3.346 1 1 548 1 . . . . . 2.419 1.688 3.15 1 1 549 1 . . . . . 2.685 1.784 3.586 1 1 550 1 . . . . . 2.41 1.684 3.136 1 1 551 1 . . . . . 2.451 1.7 3.202 1 1 552 1 . . . . . 2.337 1.654 3.02 1 1 553 1 . . . . . 2.459 1.707 2.894 1 1 554 1 . . . . . 2.297 1.638 2.956 1 1 555 1 . . . . . 4.927 1.893 7.961 1 1 556 1 . . . . . 1.94 1.5 2.41 1 1 557 1 . . . . . 3.325 1.943 4.707 1 1 558 1 . . . . . 3.026 1.882 4.17 1 1 559 1 . . . . . 3.697 1.989 5.405 1 1 560 1 . . . . . 3.6 1.98 5.22 1 1 561 1 . . . . . 2.669 1.778 3.56 1 1 562 1 . . . . . 3.227 1.925 4.529 1 1 563 1 . . . . . 2.795 1.819 3.771 1 1 564 1 . . . . . 2.629 1.765 3.493 1 1 565 1 . . . . . 3.152 1.91 4.394 1 1 566 1 . . . . . 2.539 1.733 3.345 1 1 567 1 . . . . . 2.951 1.862 4.04 1 1 568 1 . . . . . 2.804 1.821 3.787 1 1 569 1 . . . . . 2.53 1.73 3.33 1 1 570 1 . . . . . 3.45 1.963 4.937 1 1 571 1 . . . . . 2.575 1.746 3.404 1 1 572 1 . . . . . 4.598 1.955 7.241 1 1 573 1 . . . . . 4.449 1.975 6.923 1 1 574 1 . . . . . 4.311 1.988 6.634 1 1 575 1 . . . . . 3.801 1.995 5.607 1 1 576 1 . . . . . 2.173 1.583 2.763 1 1 577 1 . . . . . 2.87 1.84 3.9 1 1 578 1 . . . . . 3.563 1.976 5.15 1 1 579 1 . . . . . 2.887 1.845 3.929 1 1 580 1 . . . . . 2.748 1.804 3.692 1 1 581 1 . . . . . 4.097 1.999 6.195 1 1 582 1 . . . . . 2.809 1.822 3.796 1 1 583 1 . . . . . 2.815 1.824 3.806 1 1 584 1 . . . . . 2.767 1.81 3.724 1 1 585 1 . . . . . 3.768 1.993 5.543 1 1 586 1 . . . . . 2.484 1.713 3.255 1 1 587 1 . . . . . 2.484 1.713 3.255 1 1 588 1 . . . . . 3.253 1.931 4.575 1 1 589 1 . . . . . 2.666 1.777 3.555 1 1 590 1 . . . . . 3.518 1.971 5.065 1 1 591 1 . . . . . 3.518 1.971 5.065 1 1 592 1 . . . . . 3.468 1.965 4.971 1 1 593 1 . . . . . 3.591 1.979 5.203 1 1 594 1 . . . . . 2.295 1.637 2.953 1 1 595 1 . . . . . 3.688 1.988 6.0 1 1 596 1 . . . . . 3.763 1.993 5.533 1 1 597 1 . . . . . 3.457 1.963 4.951 1 1 598 1 . . . . . 4.439 1.976 6.902 1 1 599 1 . . . . . 3.871 1.998 5.744 1 1 600 1 . . . . . 4.03 2.0 6.06 1 1 601 1 . . . . . 4.77 1.926 7.614 1 1 602 1 . . . . . 2.868 1.84 3.896 1 1 603 1 . . . . . 3.495 1.968 5.022 1 1 604 1 . . . . . 2.843 1.833 3.853 1 1 605 1 . . . . . 4.957 1.886 8.028 1 1 606 1 . . . . . 5.188 1.823 8.553 1 1 607 1 . . . . . 4.803 1.92 7.686 1 1 608 1 . . . . . 2.679 1.782 3.576 1 1 609 1 . . . . . 2.478 1.711 3.245 1 1 610 1 . . . . . 3.103 1.899 4.307 1 1 611 1 . . . . . 1.874 1.435 2.313 1 1 612 1 . . . . . 3.562 1.976 5.148 1 1 613 1 . . . . . 2.219 1.604 2.834 1 1 614 1 . . . . . 3.005 1.877 4.133 1 1 615 1 . . . . . 2.991 1.873 4.109 1 1 616 1 . . . . . 3.833 1.996 5.67 1 1 617 1 . . . . . 4.333 1.986 6.68 1 1 618 1 . . . . . 4.671 1.944 7.398 1 1 619 1 . . . . . 4.047 1.999 6.095 1 1 620 1 . . . . . 3.619 1.982 5.256 1 1 621 1 . . . . . 4.45 1.975 6.925 1 1 622 1 . . . . . 2.327 1.889 3.004 1 1 623 1 . . . . . 3.886 1.998 5.774 1 1 624 1 . . . . . 3.155 1.911 4.399 1 1 625 1 . . . . . 3.119 1.903 4.335 1 1 626 1 . . . . . 4.261 1.992 4.262 1 1 627 1 . . . . . 4.511 1.994 6.466 1 1 628 1 . . . . . 3.486 1.967 5.005 1 1 629 1 . . . . . 3.468 1.965 4.971 1 1 630 1 . . . . . 3.127 1.905 4.349 1 1 631 1 . . . . . 4.08 1.999 6.161 1 1 632 1 . . . . . 3.886 1.999 5.773 1 1 633 1 . . . . . 3.124 1.904 4.344 1 1 634 1 . . . . . 3.258 1.931 4.585 1 1 635 1 . . . . . 3.454 1.963 6.0 1 1 636 1 . . . . . 2.943 1.86 4.026 1 1 637 1 . . . . . 3.156 1.911 4.401 1 1 638 1 . . . . . 2.842 1.832 3.852 1 1 639 1 . . . . . 3.914 1.999 5.829 1 1 640 1 . . . . . 4.106 1.999 6.213 1 1 641 1 . . . . . 2.821 1.826 3.816 1 1 642 1 . . . . . 3.576 1.978 5.174 1 1 643 1 . . . . . 4.289 1.99 6.588 1 1 644 1 . . . . . 2.841 1.832 3.85 1 1 645 1 . . . . . 2.916 1.853 3.979 1 1 646 1 . . . . . 2.789 1.816 3.762 1 1 647 1 . . . . . 3.273 1.934 4.612 1 1 648 1 . . . . . 3.394 1.954 4.834 1 1 649 1 . . . . . 2.631 1.766 3.496 1 1 650 1 . . . . . 2.904 1.85 3.958 1 1 651 1 . . . . . 2.596 1.753 3.439 1 1 652 1 . . . . . 4.373 1.983 6.763 1 1 653 1 . . . . . 4.43 1.977 6.883 1 1 654 1 . . . . . 2.775 1.812 3.738 1 1 655 1 . . . . . 2.953 1.863 4.043 1 1 656 1 . . . . . 4.923 1.894 7.952 1 1 657 1 . . . . . 2.874 1.842 3.906 1 1 658 1 . . . . . 2.364 1.666 3.062 1 1 659 1 . . . . . 4.224 1.993 6.455 1 1 660 1 . . . . . 4.351 1.985 6.717 1 1 661 1 . . . . . 4.659 1.946 7.372 1 1 662 1 . . . . . 4.286 1.99 6.582 1 1 663 1 . . . . . 2.931 1.857 4.005 1 1 664 1 . . . . . 3.567 1.976 5.158 1 1 665 1 . . . . . 4.743 1.931 7.555 1 1 666 1 . . . . . 2.205 1.597 2.813 1 1 667 1 . . . . . 3.056 1.889 4.223 1 1 668 1 . . . . . 2.804 1.821 3.787 1 1 669 1 . . . . . 2.635 1.767 3.503 1 1 670 1 . . . . . 4.064 1.999 6.129 1 1 671 1 . . . . . 3.104 1.9 4.308 1 1 672 1 . . . . . 2.625 1.764 3.486 1 1 673 1 . . . . . 3.643 1.984 5.302 1 1 674 1 . . . . . 3.504 1.969 5.039 1 1 675 1 . . . . . 3.33 1.944 4.716 1 1 676 1 . . . . . 2.412 1.685 3.139 1 1 677 1 . . . . . 2.723 1.796 3.65 1 1 678 1 . . . . . 2.356 1.662 3.05 1 1 679 1 . . . . . 3.588 1.979 5.197 1 1 680 1 . . . . . 3.717 1.99 5.444 1 1 681 1 . . . . . 1.924 1.461 2.387 1 1 682 1 . . . . . 5.235 1.809 8.661 1 1 683 1 . . . . . 3.772 1.994 5.55 1 1 684 1 . . . . . 2.291 1.635 2.947 1 1 685 1 . . . . . 3.88 1.998 5.762 1 1 686 1 . . . . . 4.051 1.999 6.103 1 1 687 1 . . . . . 4.254 1.992 6.516 1 1 688 1 . . . . . 4.192 1.996 6.388 1 1 689 1 . . . . . 2.757 1.807 3.707 1 1 690 1 . . . . . 4.076 1.999 6.153 1 1 691 1 . . . . . 3.96 2.0 5.92 1 1 692 1 . . . . . 2.581 1.749 3.413 1 1 693 1 . . . . . 2.817 1.825 3.809 1 1 694 1 . . . . . 2.994 1.874 4.114 1 1 695 1 . . . . . 4.17 1.996 6.344 1 1 696 1 . . . . . 2.709 1.791 3.627 1 1 697 1 . . . . . 3.697 1.988 5.406 1 1 698 1 . . . . . 3.232 1.926 4.538 1 1 699 1 . . . . . 3.657 1.985 5.329 1 1 700 1 . . . . . 2.809 1.823 3.795 1 1 701 1 . . . . . 2.913 1.852 3.974 1 1 702 1 . . . . . 2.936 1.858 4.014 1 1 703 1 . . . . . 3.069 1.892 4.246 1 1 704 1 . . . . . 2.822 1.826 3.818 1 1 705 1 . . . . . 3.139 1.908 4.37 1 1 706 1 . . . . . 2.72 1.796 3.644 1 1 707 1 . . . . . 2.782 1.814 3.75 1 1 708 1 . . . . . 2.711 1.792 3.63 1 1 709 1 . . . . . 4.144 1.997 6.291 1 1 710 1 . . . . . 3.09 1.897 4.283 1 1 711 1 . . . . . 2.933 1.858 4.008 1 1 712 1 . . . . . 3.82 1.996 5.644 1 1 713 1 . . . . . 2.289 1.634 6.0 1 1 714 1 . . . . . 2.729 1.798 3.66 1 1 715 1 . . . . . 3.309 1.94 4.678 1 1 716 2 . . . . . 2.362 1.665 3.059 1 1 716 3 . . . . . 2.362 1.665 3.059 1 1 717 1 . . . . . 4.043 1.999 6.087 1 1 718 1 . . . . . 2.92 1.854 3.986 1 1 719 1 . . . . . 3.3 1.939 4.661 1 1 720 1 . . . . . 2.991 1.873 4.109 1 1 721 1 . . . . . 2.695 1.787 3.603 1 1 722 1 . . . . . 2.66 1.776 3.544 1 1 723 1 . . . . . 3.733 1.991 5.475 1 1 724 1 . . . . . 2.658 1.775 3.541 1 1 725 1 . . . . . 3.354 1.948 4.76 1 1 726 1 . . . . . 3.293 1.937 4.649 1 1 727 1 . . . . . 2.81 1.89 3.797 1 1 728 1 . . . . . 3.225 1.932 4.525 1 1 729 1 . . . . . 2.516 1.725 3.307 1 1 730 1 . . . . . 4.828 1.915 7.741 1 1 731 1 . . . . . 2.727 1.907 3.657 1 1 732 1 . . . . . 3.316 1.942 4.69 1 1 733 1 . . . . . 2.364 1.665 3.063 1 1 734 1 . . . . . . 1.982 3.207 1 1 735 1 . . . . . 4.087 1.999 6.175 1 1 736 1 . . . . . 3.947 1.999 5.895 1 1 737 1 . . . . . 2.756 1.807 3.705 1 1 738 1 . . . . . 3.633 1.983 5.283 1 1 739 1 . . . . . 2.169 1.581 2.757 1 1 740 1 . . . . . 2.707 1.791 3.623 1 1 741 1 . . . . . 3.366 1.949 4.783 1 1 742 1 . . . . . 2.336 1.654 3.018 1 1 743 1 . . . . . 3.721 1.991 5.451 1 1 744 1 . . . . . 4.083 1.999 6.167 1 1 745 1 . . . . . 3.135 1.906 4.364 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 9.837 -11.913 7.076 1.00 . A B . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 9.893 -10.413 7.273 1.00 . A B . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 10.307 -8.680 6.192 1.00 . A B . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 9.548 -9.888 5.285 1.00 . A B . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 11.185 -10.032 5.681 1.00 . A B . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 10.623 -10.185 8.034 1.00 . A B . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 8.924 -10.065 7.601 1.00 . A B . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 10.259 -9.704 6.022 1.00 . A B . 1 GLY N 1 1 1 9 1 1 1 GLY O O 9.914 -12.394 5.944 1.00 . A B . 1 GLY O 1 1 1 10 1 1 2 ALA C C 8.391 -14.563 7.346 1.00 . A B . 2 ALA C 1 1 1 11 1 1 2 ALA CA C 9.632 -14.111 8.105 1.00 . A B . 2 ALA CA 1 1 1 12 1 1 2 ALA CB C 9.647 -14.707 9.507 1.00 . A B . 2 ALA CB 1 1 1 13 1 1 2 ALA H H 9.644 -12.211 9.045 1.00 . A B . 2 ALA H 1 1 1 14 1 1 2 ALA HA H 10.508 -14.462 7.579 1.00 . A B . 2 ALA HA 1 1 1 15 1 1 2 ALA HB1 H 8.768 -14.386 10.045 1.00 . A B . 2 ALA HB1 1 1 1 16 1 1 2 ALA HB2 H 10.530 -14.375 10.033 1.00 . A B . 2 ALA HB2 1 1 1 17 1 1 2 ALA HB3 H 9.653 -15.787 9.440 1.00 . A B . 2 ALA HB3 1 1 1 18 1 1 2 ALA N N 9.699 -12.655 8.169 1.00 . A B . 2 ALA N 1 1 1 19 1 1 2 ALA O O 8.459 -15.434 6.478 1.00 . A B . 2 ALA O 1 1 1 20 1 1 3 MET C C 5.372 -12.991 6.470 1.00 . A B . 3 MET C 1 1 1 21 1 1 3 MET CA C 6.003 -14.272 7.015 1.00 . A B . 3 MET CA 1 1 1 22 1 1 3 MET CB C 5.062 -14.971 8.004 1.00 . A B . 3 MET CB 1 1 1 23 1 1 3 MET CE C 1.325 -16.755 7.511 1.00 . A B . 3 MET CE 1 1 1 24 1 1 3 MET CG C 3.812 -15.558 7.363 1.00 . A B . 3 MET CG 1 1 1 25 1 1 3 MET H H 7.276 -13.268 8.373 1.00 . A B . 3 MET H 1 1 1 26 1 1 3 MET HA H 6.214 -14.936 6.192 1.00 . A B . 3 MET HA 1 1 1 27 1 1 3 MET HB2 H 5.602 -15.772 8.487 1.00 . A B . 3 MET HB2 1 1 1 28 1 1 3 MET HB3 H 4.755 -14.257 8.754 1.00 . A B . 3 MET HB3 1 1 1 29 1 1 3 MET HE1 H 1.669 -17.437 6.747 1.00 . A B . 3 MET HE1 1 1 1 30 1 1 3 MET HE2 H 0.920 -15.867 7.047 1.00 . A B . 3 MET HE2 1 1 1 31 1 1 3 MET HE3 H 0.558 -17.232 8.101 1.00 . A B . 3 MET HE3 1 1 1 32 1 1 3 MET HG2 H 3.283 -14.771 6.846 1.00 . A B . 3 MET HG2 1 1 1 33 1 1 3 MET HG3 H 4.108 -16.316 6.653 1.00 . A B . 3 MET HG3 1 1 1 34 1 1 3 MET N N 7.263 -13.953 7.669 1.00 . A B . 3 MET N 1 1 1 35 1 1 3 MET O O 4.158 -12.883 6.310 1.00 . A B . 3 MET O 1 1 1 36 1 1 3 MET SD S 2.696 -16.300 8.569 1.00 . A B . 3 MET SD 1 1 1 37 1 1 4 GLY C C 6.663 -10.212 4.590 1.00 . A B . 4 GLY C 1 1 1 38 1 1 4 GLY CA C 5.756 -10.745 5.675 1.00 . A B . 4 GLY CA 1 1 1 39 1 1 4 GLY H H 7.184 -12.170 6.303 1.00 . A B . 4 GLY H 1 1 1 40 1 1 4 GLY HA2 H 4.761 -10.872 5.275 1.00 . A B . 4 GLY HA2 1 1 1 41 1 1 4 GLY HA3 H 5.721 -10.033 6.487 1.00 . A B . 4 GLY HA3 1 1 1 42 1 1 4 GLY N N 6.223 -12.018 6.183 1.00 . A B . 4 GLY N 1 1 1 43 1 1 4 GLY O O 7.883 -10.354 4.676 1.00 . A B . 4 GLY O 1 1 1 44 1 1 5 MET C C 6.653 -7.579 2.317 1.00 . A B . 5 MET C 1 1 1 45 1 1 5 MET CA C 6.841 -9.082 2.445 1.00 . A B . 5 MET CA 1 1 1 46 1 1 5 MET CB C 6.437 -9.763 1.133 1.00 . A B . 5 MET CB 1 1 1 47 1 1 5 MET CE C 9.175 -10.516 -0.328 1.00 . A B . 5 MET CE 1 1 1 48 1 1 5 MET CG C 6.863 -11.220 1.040 1.00 . A B . 5 MET CG 1 1 1 49 1 1 5 MET H H 5.101 -9.512 3.564 1.00 . A B . 5 MET H 1 1 1 50 1 1 5 MET HA H 7.884 -9.285 2.636 1.00 . A B . 5 MET HA 1 1 1 51 1 1 5 MET HB2 H 5.362 -9.716 1.034 1.00 . A B . 5 MET HB2 1 1 1 52 1 1 5 MET HB3 H 6.887 -9.225 0.312 1.00 . A B . 5 MET HB3 1 1 1 53 1 1 5 MET HE1 H 8.703 -10.932 -1.205 1.00 . A B . 5 MET HE1 1 1 1 54 1 1 5 MET HE2 H 10.248 -10.586 -0.430 1.00 . A B . 5 MET HE2 1 1 1 55 1 1 5 MET HE3 H 8.891 -9.480 -0.222 1.00 . A B . 5 MET HE3 1 1 1 56 1 1 5 MET HG2 H 6.414 -11.764 1.857 1.00 . A B . 5 MET HG2 1 1 1 57 1 1 5 MET HG3 H 6.509 -11.625 0.103 1.00 . A B . 5 MET HG3 1 1 1 58 1 1 5 MET N N 6.074 -9.612 3.564 1.00 . A B . 5 MET N 1 1 1 59 1 1 5 MET O O 5.702 -7.112 1.691 1.00 . A B . 5 MET O 1 1 1 60 1 1 5 MET SD S 8.654 -11.432 1.123 1.00 . A B . 5 MET SD 1 1 1 61 1 1 6 ARG C C 8.641 -4.932 1.837 1.00 . A B . 6 ARG C 1 1 1 62 1 1 6 ARG CA C 7.547 -5.378 2.800 1.00 . A B . 6 ARG CA 1 1 1 63 1 1 6 ARG CB C 7.742 -4.704 4.161 1.00 . A B . 6 ARG CB 1 1 1 64 1 1 6 ARG CD C 6.863 -4.233 6.462 1.00 . A B . 6 ARG CD 1 1 1 65 1 1 6 ARG CG C 6.619 -4.964 5.152 1.00 . A B . 6 ARG CG 1 1 1 66 1 1 6 ARG CZ C 5.715 -3.846 8.606 1.00 . A B . 6 ARG CZ 1 1 1 67 1 1 6 ARG H H 8.263 -7.257 3.451 1.00 . A B . 6 ARG H 1 1 1 68 1 1 6 ARG HA H 6.588 -5.087 2.396 1.00 . A B . 6 ARG HA 1 1 1 69 1 1 6 ARG HB2 H 8.664 -5.060 4.595 1.00 . A B . 6 ARG HB2 1 1 1 70 1 1 6 ARG HB3 H 7.817 -3.637 4.009 1.00 . A B . 6 ARG HB3 1 1 1 71 1 1 6 ARG HD2 H 7.816 -4.546 6.863 1.00 . A B . 6 ARG HD2 1 1 1 72 1 1 6 ARG HD3 H 6.891 -3.172 6.265 1.00 . A B . 6 ARG HD3 1 1 1 73 1 1 6 ARG HE H 5.172 -5.207 7.242 1.00 . A B . 6 ARG HE 1 1 1 74 1 1 6 ARG HG2 H 5.688 -4.620 4.728 1.00 . A B . 6 ARG HG2 1 1 1 75 1 1 6 ARG HG3 H 6.560 -6.026 5.346 1.00 . A B . 6 ARG HG3 1 1 1 76 1 1 6 ARG HH11 H 7.326 -2.659 8.279 1.00 . A B . 6 ARG HH11 1 1 1 77 1 1 6 ARG HH12 H 6.505 -2.399 9.783 1.00 . A B . 6 ARG HH12 1 1 1 78 1 1 6 ARG HH21 H 4.078 -4.865 9.225 1.00 . A B . 6 ARG HH21 1 1 1 79 1 1 6 ARG HH22 H 4.662 -3.659 10.325 1.00 . A B . 6 ARG HH22 1 1 1 80 1 1 6 ARG N N 7.558 -6.826 2.920 1.00 . A B . 6 ARG N 1 1 1 81 1 1 6 ARG NE N 5.822 -4.500 7.451 1.00 . A B . 6 ARG NE 1 1 1 82 1 1 6 ARG NH1 N 6.584 -2.892 8.914 1.00 . A B . 6 ARG NH1 1 1 1 83 1 1 6 ARG NH2 N 4.740 -4.146 9.452 1.00 . A B . 6 ARG NH2 1 1 1 84 1 1 6 ARG O O 9.730 -4.528 2.252 1.00 . A B . 6 ARG O 1 1 1 85 1 1 7 ASN C C 9.298 -3.101 -0.649 1.00 . A B . 7 ASN C 1 1 1 86 1 1 7 ASN CA C 9.283 -4.618 -0.493 1.00 . A B . 7 ASN CA 1 1 1 87 1 1 7 ASN CB C 8.940 -5.292 -1.832 1.00 . A B . 7 ASN CB 1 1 1 88 1 1 7 ASN CG C 7.478 -5.144 -2.241 1.00 . A B . 7 ASN CG 1 1 1 89 1 1 7 ASN H H 7.460 -5.348 0.287 1.00 . A B . 7 ASN H 1 1 1 90 1 1 7 ASN HA H 10.268 -4.938 -0.183 1.00 . A B . 7 ASN HA 1 1 1 91 1 1 7 ASN HB2 H 9.553 -4.857 -2.604 1.00 . A B . 7 ASN HB2 1 1 1 92 1 1 7 ASN HB3 H 9.167 -6.347 -1.756 1.00 . A B . 7 ASN HB3 1 1 1 93 1 1 7 ASN HD21 H 7.985 -4.983 -4.158 1.00 . A B . 7 ASN HD21 1 1 1 94 1 1 7 ASN HD22 H 6.296 -4.892 -3.820 1.00 . A B . 7 ASN HD22 1 1 1 95 1 1 7 ASN N N 8.346 -5.016 0.550 1.00 . A B . 7 ASN N 1 1 1 96 1 1 7 ASN ND2 N 7.229 -4.991 -3.536 1.00 . A B . 7 ASN ND2 1 1 1 97 1 1 7 ASN O O 9.005 -2.556 -1.714 1.00 . A B . 7 ASN O 1 1 1 98 1 1 7 ASN OD1 O 6.574 -5.173 -1.405 1.00 . A B . 7 ASN OD1 1 1 1 99 1 1 8 LEU C C 10.989 -0.372 0.091 1.00 . A B . 8 LEU C 1 1 1 100 1 1 8 LEU CA C 9.647 -0.978 0.481 1.00 . A B . 8 LEU CA 1 1 1 101 1 1 8 LEU CB C 9.217 -0.498 1.875 1.00 . A B . 8 LEU CB 1 1 1 102 1 1 8 LEU CD1 C 11.320 -1.015 3.185 1.00 . A B . 8 LEU CD1 1 1 1 103 1 1 8 LEU CD2 C 9.117 -0.836 4.350 1.00 . A B . 8 LEU CD2 1 1 1 104 1 1 8 LEU CG C 9.821 -1.250 3.069 1.00 . A B . 8 LEU CG 1 1 1 105 1 1 8 LEU H H 9.970 -2.932 1.214 1.00 . A B . 8 LEU H 1 1 1 106 1 1 8 LEU HA H 8.912 -0.648 -0.233 1.00 . A B . 8 LEU HA 1 1 1 107 1 1 8 LEU HB2 H 9.482 0.545 1.967 1.00 . A B . 8 LEU HB2 1 1 1 108 1 1 8 LEU HB3 H 8.142 -0.579 1.940 1.00 . A B . 8 LEU HB3 1 1 1 109 1 1 8 LEU HD11 H 11.510 0.031 3.372 1.00 . A B . 8 LEU HD11 1 1 1 110 1 1 8 LEU HD12 H 11.800 -1.308 2.262 1.00 . A B . 8 LEU HD12 1 1 1 111 1 1 8 LEU HD13 H 11.715 -1.604 3.999 1.00 . A B . 8 LEU HD13 1 1 1 112 1 1 8 LEU HD21 H 9.231 0.229 4.495 1.00 . A B . 8 LEU HD21 1 1 1 113 1 1 8 LEU HD22 H 9.551 -1.361 5.186 1.00 . A B . 8 LEU HD22 1 1 1 114 1 1 8 LEU HD23 H 8.068 -1.078 4.277 1.00 . A B . 8 LEU HD23 1 1 1 115 1 1 8 LEU HG H 9.663 -2.309 2.934 1.00 . A B . 8 LEU HG 1 1 1 116 1 1 8 LEU N N 9.670 -2.429 0.428 1.00 . A B . 8 LEU N 1 1 1 117 1 1 8 LEU O O 11.140 0.851 0.061 1.00 . A B . 8 LEU O 1 1 1 118 1 1 9 ASP C C 13.203 -0.278 -2.085 1.00 . A B . 9 ASP C 1 1 1 119 1 1 9 ASP CA C 13.265 -0.737 -0.636 1.00 . A B . 9 ASP CA 1 1 1 120 1 1 9 ASP CB C 14.337 -1.812 -0.456 1.00 . A B . 9 ASP CB 1 1 1 121 1 1 9 ASP CG C 15.715 -1.331 -0.863 1.00 . A B . 9 ASP CG 1 1 1 122 1 1 9 ASP H H 11.788 -2.185 -0.180 1.00 . A B . 9 ASP H 1 1 1 123 1 1 9 ASP HA H 13.512 0.113 -0.017 1.00 . A B . 9 ASP HA 1 1 1 124 1 1 9 ASP HB2 H 14.372 -2.105 0.583 1.00 . A B . 9 ASP HB2 1 1 1 125 1 1 9 ASP HB3 H 14.083 -2.671 -1.056 1.00 . A B . 9 ASP HB3 1 1 1 126 1 1 9 ASP N N 11.958 -1.221 -0.220 1.00 . A B . 9 ASP N 1 1 1 127 1 1 9 ASP O O 13.887 0.661 -2.482 1.00 . A B . 9 ASP O 1 1 1 128 1 1 9 ASP OD1 O 16.297 -0.492 -0.139 1.00 . A B . 9 ASP OD1 1 1 1 129 1 1 9 ASP OD2 O 16.228 -1.786 -1.903 1.00 . A B . 9 ASP OD2 1 1 1 130 1 1 10 GLU C C 10.907 0.415 -4.307 1.00 . A B . 10 GLU C 1 1 1 131 1 1 10 GLU CA C 12.089 -0.546 -4.241 1.00 . A B . 10 GLU CA 1 1 1 132 1 1 10 GLU CB C 11.798 -1.776 -5.098 1.00 . A B . 10 GLU CB 1 1 1 133 1 1 10 GLU CD C 14.062 -1.964 -6.181 1.00 . A B . 10 GLU CD 1 1 1 134 1 1 10 GLU CG C 13.009 -2.654 -5.340 1.00 . A B . 10 GLU CG 1 1 1 135 1 1 10 GLU H H 11.903 -1.731 -2.494 1.00 . A B . 10 GLU H 1 1 1 136 1 1 10 GLU HA H 12.968 -0.049 -4.621 1.00 . A B . 10 GLU HA 1 1 1 137 1 1 10 GLU HB2 H 11.040 -2.371 -4.609 1.00 . A B . 10 GLU HB2 1 1 1 138 1 1 10 GLU HB3 H 11.422 -1.450 -6.053 1.00 . A B . 10 GLU HB3 1 1 1 139 1 1 10 GLU HG2 H 13.445 -2.910 -4.386 1.00 . A B . 10 GLU HG2 1 1 1 140 1 1 10 GLU HG3 H 12.694 -3.554 -5.847 1.00 . A B . 10 GLU HG3 1 1 1 141 1 1 10 GLU N N 12.354 -0.939 -2.859 1.00 . A B . 10 GLU N 1 1 1 142 1 1 10 GLU O O 10.416 0.762 -5.383 1.00 . A B . 10 GLU O 1 1 1 143 1 1 10 GLU OE1 O 13.730 -1.508 -7.296 1.00 . A B . 10 GLU OE1 1 1 1 144 1 1 10 GLU OE2 O 15.228 -1.890 -5.744 1.00 . A B . 10 GLU OE2 1 1 1 145 1 1 11 CYS C C 9.757 3.134 -2.752 1.00 . A B . 11 CYS C 1 1 1 146 1 1 11 CYS CA C 9.307 1.709 -3.039 1.00 . A B . 11 CYS CA 1 1 1 147 1 1 11 CYS CB C 8.399 1.197 -1.934 1.00 . A B . 11 CYS CB 1 1 1 148 1 1 11 CYS H H 10.925 0.566 -2.329 1.00 . A B . 11 CYS H 1 1 1 149 1 1 11 CYS HA H 8.777 1.685 -3.979 1.00 . A B . 11 CYS HA 1 1 1 150 1 1 11 CYS HB2 H 8.230 0.145 -2.087 1.00 . A B . 11 CYS HB2 1 1 1 151 1 1 11 CYS HB3 H 8.898 1.336 -0.986 1.00 . A B . 11 CYS HB3 1 1 1 152 1 1 11 CYS N N 10.457 0.838 -3.145 1.00 . A B . 11 CYS N 1 1 1 153 1 1 11 CYS O O 9.981 3.508 -1.597 1.00 . A B . 11 CYS O 1 1 1 154 1 1 11 CYS SG S 6.784 1.994 -1.821 1.00 . A B . 11 CYS SG 1 1 1 155 1 1 12 GLU C C 9.460 6.078 -2.739 1.00 . A B . 12 GLU C 1 1 1 156 1 1 12 GLU CA C 10.337 5.301 -3.718 1.00 . A B . 12 GLU CA 1 1 1 157 1 1 12 GLU CB C 10.267 5.976 -5.092 1.00 . A B . 12 GLU CB 1 1 1 158 1 1 12 GLU CD C 12.230 4.722 -6.108 1.00 . A B . 12 GLU CD 1 1 1 159 1 1 12 GLU CG C 10.781 5.125 -6.251 1.00 . A B . 12 GLU CG 1 1 1 160 1 1 12 GLU H H 9.706 3.546 -4.700 1.00 . A B . 12 GLU H 1 1 1 161 1 1 12 GLU HA H 11.356 5.309 -3.369 1.00 . A B . 12 GLU HA 1 1 1 162 1 1 12 GLU HB2 H 9.239 6.231 -5.296 1.00 . A B . 12 GLU HB2 1 1 1 163 1 1 12 GLU HB3 H 10.850 6.884 -5.060 1.00 . A B . 12 GLU HB3 1 1 1 164 1 1 12 GLU HG2 H 10.182 4.230 -6.314 1.00 . A B . 12 GLU HG2 1 1 1 165 1 1 12 GLU HG3 H 10.672 5.691 -7.166 1.00 . A B . 12 GLU HG3 1 1 1 166 1 1 12 GLU N N 9.893 3.916 -3.815 1.00 . A B . 12 GLU N 1 1 1 167 1 1 12 GLU O O 9.946 6.861 -1.924 1.00 . A B . 12 GLU O 1 1 1 168 1 1 12 GLU OE1 O 13.104 5.611 -6.090 1.00 . A B . 12 GLU OE1 1 1 1 169 1 1 12 GLU OE2 O 12.509 3.509 -6.013 1.00 . A B . 12 GLU OE2 1 1 1 170 1 1 13 VAL C C 7.234 6.242 -0.551 1.00 . A B . 13 VAL C 1 1 1 171 1 1 13 VAL CA C 7.180 6.570 -2.048 1.00 . A B . 13 VAL CA 1 1 1 172 1 1 13 VAL CB C 5.756 6.350 -2.610 1.00 . A B . 13 VAL CB 1 1 1 173 1 1 13 VAL CG1 C 5.385 4.882 -2.602 1.00 . A B . 13 VAL CG1 1 1 1 174 1 1 13 VAL CG2 C 4.729 7.165 -1.845 1.00 . A B . 13 VAL CG2 1 1 1 175 1 1 13 VAL H H 7.860 5.093 -3.396 1.00 . A B . 13 VAL H 1 1 1 176 1 1 13 VAL HA H 7.421 7.615 -2.168 1.00 . A B . 13 VAL HA 1 1 1 177 1 1 13 VAL HB H 5.750 6.683 -3.637 1.00 . A B . 13 VAL HB 1 1 1 178 1 1 13 VAL HG11 H 6.083 4.327 -3.209 1.00 . A B . 13 VAL HG11 1 1 1 179 1 1 13 VAL HG12 H 4.390 4.764 -3.001 1.00 . A B . 13 VAL HG12 1 1 1 180 1 1 13 VAL HG13 H 5.412 4.510 -1.588 1.00 . A B . 13 VAL HG13 1 1 1 181 1 1 13 VAL HG21 H 4.718 6.845 -0.815 1.00 . A B . 13 VAL HG21 1 1 1 182 1 1 13 VAL HG22 H 3.753 7.016 -2.281 1.00 . A B . 13 VAL HG22 1 1 1 183 1 1 13 VAL HG23 H 4.992 8.212 -1.893 1.00 . A B . 13 VAL HG23 1 1 1 184 1 1 13 VAL N N 8.164 5.817 -2.811 1.00 . A B . 13 VAL N 1 1 1 185 1 1 13 VAL O O 6.888 7.078 0.284 1.00 . A B . 13 VAL O 1 1 1 186 1 1 14 CYS C C 8.892 5.503 1.885 1.00 . A B . 14 CYS C 1 1 1 187 1 1 14 CYS CA C 7.804 4.679 1.212 1.00 . A B . 14 CYS CA 1 1 1 188 1 1 14 CYS CB C 8.093 3.189 1.389 1.00 . A B . 14 CYS CB 1 1 1 189 1 1 14 CYS H H 7.995 4.416 -0.891 1.00 . A B . 14 CYS H 1 1 1 190 1 1 14 CYS HA H 6.860 4.908 1.682 1.00 . A B . 14 CYS HA 1 1 1 191 1 1 14 CYS HB2 H 8.452 2.788 0.455 1.00 . A B . 14 CYS HB2 1 1 1 192 1 1 14 CYS HB3 H 8.854 3.067 2.145 1.00 . A B . 14 CYS HB3 1 1 1 193 1 1 14 CYS N N 7.693 5.045 -0.198 1.00 . A B . 14 CYS N 1 1 1 194 1 1 14 CYS O O 8.781 5.865 3.055 1.00 . A B . 14 CYS O 1 1 1 195 1 1 14 CYS SG S 6.654 2.215 1.893 1.00 . A B . 14 CYS SG 1 1 1 196 1 1 15 ARG C C 10.556 8.073 1.830 1.00 . A B . 15 ARG C 1 1 1 197 1 1 15 ARG CA C 11.023 6.640 1.635 1.00 . A B . 15 ARG CA 1 1 1 198 1 1 15 ARG CB C 12.205 6.622 0.674 1.00 . A B . 15 ARG CB 1 1 1 199 1 1 15 ARG CD C 13.798 5.298 -0.715 1.00 . A B . 15 ARG CD 1 1 1 200 1 1 15 ARG CG C 12.622 5.232 0.238 1.00 . A B . 15 ARG CG 1 1 1 201 1 1 15 ARG CZ C 13.818 4.165 -2.893 1.00 . A B . 15 ARG CZ 1 1 1 202 1 1 15 ARG H H 9.951 5.508 0.196 1.00 . A B . 15 ARG H 1 1 1 203 1 1 15 ARG HA H 11.327 6.236 2.584 1.00 . A B . 15 ARG HA 1 1 1 204 1 1 15 ARG HB2 H 11.942 7.189 -0.207 1.00 . A B . 15 ARG HB2 1 1 1 205 1 1 15 ARG HB3 H 13.050 7.094 1.154 1.00 . A B . 15 ARG HB3 1 1 1 206 1 1 15 ARG HD2 H 13.686 6.171 -1.338 1.00 . A B . 15 ARG HD2 1 1 1 207 1 1 15 ARG HD3 H 14.707 5.383 -0.138 1.00 . A B . 15 ARG HD3 1 1 1 208 1 1 15 ARG HE H 13.973 3.242 -1.119 1.00 . A B . 15 ARG HE 1 1 1 209 1 1 15 ARG HG2 H 12.905 4.658 1.108 1.00 . A B . 15 ARG HG2 1 1 1 210 1 1 15 ARG HG3 H 11.791 4.756 -0.258 1.00 . A B . 15 ARG HG3 1 1 1 211 1 1 15 ARG HH11 H 13.750 6.191 -2.987 1.00 . A B . 15 ARG HH11 1 1 1 212 1 1 15 ARG HH12 H 13.694 5.377 -4.522 1.00 . A B . 15 ARG HH12 1 1 1 213 1 1 15 ARG HH21 H 13.922 2.154 -3.150 1.00 . A B . 15 ARG HH21 1 1 1 214 1 1 15 ARG HH22 H 13.765 3.092 -4.609 1.00 . A B . 15 ARG HH22 1 1 1 215 1 1 15 ARG N N 9.928 5.825 1.124 1.00 . A B . 15 ARG N 1 1 1 216 1 1 15 ARG NE N 13.883 4.116 -1.565 1.00 . A B . 15 ARG NE 1 1 1 217 1 1 15 ARG NH1 N 13.749 5.338 -3.513 1.00 . A B . 15 ARG NH1 1 1 1 218 1 1 15 ARG NH2 N 13.845 3.050 -3.607 1.00 . A B . 15 ARG NH2 1 1 1 219 1 1 15 ARG O O 11.048 8.794 2.698 1.00 . A B . 15 ARG O 1 1 1 220 1 1 16 ASP C C 8.106 9.901 2.317 1.00 . A B . 16 ASP C 1 1 1 221 1 1 16 ASP CA C 9.002 9.800 1.085 1.00 . A B . 16 ASP CA 1 1 1 222 1 1 16 ASP CB C 8.190 10.080 -0.186 1.00 . A B . 16 ASP CB 1 1 1 223 1 1 16 ASP CG C 7.581 11.469 -0.212 1.00 . A B . 16 ASP CG 1 1 1 224 1 1 16 ASP H H 9.323 7.869 0.284 1.00 . A B . 16 ASP H 1 1 1 225 1 1 16 ASP HA H 9.796 10.527 1.166 1.00 . A B . 16 ASP HA 1 1 1 226 1 1 16 ASP HB2 H 8.836 9.977 -1.043 1.00 . A B . 16 ASP HB2 1 1 1 227 1 1 16 ASP HB3 H 7.392 9.354 -0.258 1.00 . A B . 16 ASP HB3 1 1 1 228 1 1 16 ASP N N 9.608 8.475 0.998 1.00 . A B . 16 ASP N 1 1 1 229 1 1 16 ASP O O 7.684 10.987 2.713 1.00 . A B . 16 ASP O 1 1 1 230 1 1 16 ASP OD1 O 8.267 12.412 -0.658 1.00 . A B . 16 ASP OD1 1 1 1 231 1 1 16 ASP OD2 O 6.409 11.623 0.191 1.00 . A B . 16 ASP OD2 1 1 1 232 1 1 17 GLY C C 5.524 8.493 3.688 1.00 . A B . 17 GLY C 1 1 1 233 1 1 17 GLY CA C 6.966 8.721 4.081 1.00 . A B . 17 GLY CA 1 1 1 234 1 1 17 GLY H H 8.265 7.933 2.612 1.00 . A B . 17 GLY H 1 1 1 235 1 1 17 GLY HA2 H 7.282 7.923 4.738 1.00 . A B . 17 GLY HA2 1 1 1 236 1 1 17 GLY HA3 H 7.039 9.661 4.610 1.00 . A B . 17 GLY HA3 1 1 1 237 1 1 17 GLY N N 7.841 8.758 2.931 1.00 . A B . 17 GLY N 1 1 1 238 1 1 17 GLY O O 4.607 8.857 4.426 1.00 . A B . 17 GLY O 1 1 1 239 1 1 18 GLY C C 3.277 6.579 2.899 1.00 . A B . 18 GLY C 1 1 1 240 1 1 18 GLY CA C 3.978 7.618 2.055 1.00 . A B . 18 GLY CA 1 1 1 241 1 1 18 GLY H H 6.082 7.613 1.971 1.00 . A B . 18 GLY H 1 1 1 242 1 1 18 GLY HA2 H 3.405 8.532 2.079 1.00 . A B . 18 GLY HA2 1 1 1 243 1 1 18 GLY HA3 H 4.027 7.262 1.039 1.00 . A B . 18 GLY HA3 1 1 1 244 1 1 18 GLY N N 5.318 7.889 2.522 1.00 . A B . 18 GLY N 1 1 1 245 1 1 18 GLY O O 3.896 5.613 3.353 1.00 . A B . 18 GLY O 1 1 1 246 1 1 19 GLU C C 0.593 4.767 3.066 1.00 . A B . 19 GLU C 1 1 1 247 1 1 19 GLU CA C 1.191 5.875 3.915 1.00 . A B . 19 GLU CA 1 1 1 248 1 1 19 GLU CB C 0.075 6.640 4.632 1.00 . A B . 19 GLU CB 1 1 1 249 1 1 19 GLU CD C 0.934 6.273 6.975 1.00 . A B . 19 GLU CD 1 1 1 250 1 1 19 GLU CG C 0.522 7.293 5.932 1.00 . A B . 19 GLU CG 1 1 1 251 1 1 19 GLU H H 1.560 7.561 2.700 1.00 . A B . 19 GLU H 1 1 1 252 1 1 19 GLU HA H 1.840 5.433 4.655 1.00 . A B . 19 GLU HA 1 1 1 253 1 1 19 GLU HB2 H -0.292 7.414 3.974 1.00 . A B . 19 GLU HB2 1 1 1 254 1 1 19 GLU HB3 H -0.732 5.954 4.853 1.00 . A B . 19 GLU HB3 1 1 1 255 1 1 19 GLU HG2 H 1.364 7.937 5.729 1.00 . A B . 19 GLU HG2 1 1 1 256 1 1 19 GLU HG3 H -0.294 7.882 6.328 1.00 . A B . 19 GLU HG3 1 1 1 257 1 1 19 GLU N N 1.990 6.782 3.107 1.00 . A B . 19 GLU N 1 1 1 258 1 1 19 GLU O O 0.332 4.945 1.875 1.00 . A B . 19 GLU O 1 1 1 259 1 1 19 GLU OE1 O 0.052 5.768 7.702 1.00 . A B . 19 GLU OE1 1 1 1 260 1 1 19 GLU OE2 O 2.142 5.972 7.073 1.00 . A B . 19 GLU OE2 1 1 1 261 1 1 20 LEU C C -1.738 2.512 3.346 1.00 . A B . 20 LEU C 1 1 1 262 1 1 20 LEU CA C -0.250 2.489 3.056 1.00 . A B . 20 LEU CA 1 1 1 263 1 1 20 LEU CB C 0.337 1.172 3.565 1.00 . A B . 20 LEU CB 1 1 1 264 1 1 20 LEU CD1 C 2.268 -0.403 3.690 1.00 . A B . 20 LEU CD1 1 1 1 265 1 1 20 LEU CD2 C 1.315 0.195 1.474 1.00 . A B . 20 LEU CD2 1 1 1 266 1 1 20 LEU CG C 1.618 0.701 2.878 1.00 . A B . 20 LEU CG 1 1 1 267 1 1 20 LEU H H 0.686 3.538 4.626 1.00 . A B . 20 LEU H 1 1 1 268 1 1 20 LEU HA H -0.090 2.563 1.991 1.00 . A B . 20 LEU HA 1 1 1 269 1 1 20 LEU HB2 H 0.542 1.283 4.621 1.00 . A B . 20 LEU HB2 1 1 1 270 1 1 20 LEU HB3 H -0.413 0.405 3.443 1.00 . A B . 20 LEU HB3 1 1 1 271 1 1 20 LEU HD11 H 1.572 -1.221 3.805 1.00 . A B . 20 LEU HD11 1 1 1 272 1 1 20 LEU HD12 H 2.543 -0.023 4.662 1.00 . A B . 20 LEU HD12 1 1 1 273 1 1 20 LEU HD13 H 3.150 -0.754 3.177 1.00 . A B . 20 LEU HD13 1 1 1 274 1 1 20 LEU HD21 H 2.228 -0.164 1.020 1.00 . A B . 20 LEU HD21 1 1 1 275 1 1 20 LEU HD22 H 0.910 0.997 0.876 1.00 . A B . 20 LEU HD22 1 1 1 276 1 1 20 LEU HD23 H 0.600 -0.612 1.527 1.00 . A B . 20 LEU HD23 1 1 1 277 1 1 20 LEU HG H 2.313 1.528 2.803 1.00 . A B . 20 LEU HG 1 1 1 278 1 1 20 LEU N N 0.398 3.621 3.692 1.00 . A B . 20 LEU N 1 1 1 279 1 1 20 LEU O O -2.154 2.794 4.472 1.00 . A B . 20 LEU O 1 1 1 280 1 1 21 PHE C C -4.428 0.710 2.202 1.00 . A B . 21 PHE C 1 1 1 281 1 1 21 PHE CA C -3.973 2.131 2.512 1.00 . A B . 21 PHE CA 1 1 1 282 1 1 21 PHE CB C -4.686 3.165 1.632 1.00 . A B . 21 PHE CB 1 1 1 283 1 1 21 PHE CD1 C -4.926 5.224 3.061 1.00 . A B . 21 PHE CD1 1 1 1 284 1 1 21 PHE CD2 C -3.345 5.268 1.272 1.00 . A B . 21 PHE CD2 1 1 1 285 1 1 21 PHE CE1 C -4.574 6.514 3.406 1.00 . A B . 21 PHE CE1 1 1 1 286 1 1 21 PHE CE2 C -2.994 6.560 1.614 1.00 . A B . 21 PHE CE2 1 1 1 287 1 1 21 PHE CG C -4.317 4.583 1.991 1.00 . A B . 21 PHE CG 1 1 1 288 1 1 21 PHE CZ C -3.607 7.183 2.682 1.00 . A B . 21 PHE CZ 1 1 1 289 1 1 21 PHE H H -2.151 2.084 1.441 1.00 . A B . 21 PHE H 1 1 1 290 1 1 21 PHE HA H -4.186 2.342 3.551 1.00 . A B . 21 PHE HA 1 1 1 291 1 1 21 PHE HB2 H -4.418 2.998 0.597 1.00 . A B . 21 PHE HB2 1 1 1 292 1 1 21 PHE HB3 H -5.755 3.057 1.748 1.00 . A B . 21 PHE HB3 1 1 1 293 1 1 21 PHE HD1 H -5.684 4.706 3.630 1.00 . A B . 21 PHE HD1 1 1 1 294 1 1 21 PHE HD2 H -2.860 4.787 0.434 1.00 . A B . 21 PHE HD2 1 1 1 295 1 1 21 PHE HE1 H -5.056 7.000 4.241 1.00 . A B . 21 PHE HE1 1 1 1 296 1 1 21 PHE HE2 H -2.238 7.081 1.049 1.00 . A B . 21 PHE HE2 1 1 1 297 1 1 21 PHE HZ H -3.331 8.192 2.952 1.00 . A B . 21 PHE HZ 1 1 1 298 1 1 21 PHE N N -2.535 2.228 2.334 1.00 . A B . 21 PHE N 1 1 1 299 1 1 21 PHE O O -5.476 0.479 1.600 1.00 . A B . 21 PHE O 1 1 1 300 1 1 22 CYS C C -3.613 -2.423 3.715 1.00 . A B . 22 CYS C 1 1 1 301 1 1 22 CYS CA C -3.892 -1.651 2.439 1.00 . A B . 22 CYS CA 1 1 1 302 1 1 22 CYS CB C -3.050 -2.233 1.302 1.00 . A B . 22 CYS CB 1 1 1 303 1 1 22 CYS H H -2.779 0.018 3.074 1.00 . A B . 22 CYS H 1 1 1 304 1 1 22 CYS HA H -4.936 -1.750 2.189 1.00 . A B . 22 CYS HA 1 1 1 305 1 1 22 CYS HB2 H -2.050 -1.824 1.359 1.00 . A B . 22 CYS HB2 1 1 1 306 1 1 22 CYS HB3 H -3.000 -3.307 1.416 1.00 . A B . 22 CYS HB3 1 1 1 307 1 1 22 CYS N N -3.607 -0.240 2.621 1.00 . A B . 22 CYS N 1 1 1 308 1 1 22 CYS O O -2.798 -2.010 4.543 1.00 . A B . 22 CYS O 1 1 1 309 1 1 22 CYS SG S -3.691 -1.885 -0.362 1.00 . A B . 22 CYS SG 1 1 1 310 1 1 23 CYS C C -2.840 -5.254 4.775 1.00 . A B . 23 CYS C 1 1 1 311 1 1 23 CYS CA C -4.099 -4.421 4.996 1.00 . A B . 23 CYS CA 1 1 1 312 1 1 23 CYS CB C -5.324 -5.327 5.174 1.00 . A B . 23 CYS CB 1 1 1 313 1 1 23 CYS H H -4.938 -3.800 3.166 1.00 . A B . 23 CYS H 1 1 1 314 1 1 23 CYS HA H -3.970 -3.807 5.877 1.00 . A B . 23 CYS HA 1 1 1 315 1 1 23 CYS HB2 H -5.273 -5.802 6.143 1.00 . A B . 23 CYS HB2 1 1 1 316 1 1 23 CYS HB3 H -6.218 -4.721 5.122 1.00 . A B . 23 CYS HB3 1 1 1 317 1 1 23 CYS N N -4.294 -3.548 3.857 1.00 . A B . 23 CYS N 1 1 1 318 1 1 23 CYS O O -2.300 -5.252 3.664 1.00 . A B . 23 CYS O 1 1 1 319 1 1 23 CYS SG S -5.477 -6.638 3.934 1.00 . A B . 23 CYS SG 1 1 1 320 1 1 24 ASP C C -1.195 -7.668 4.488 1.00 . A B . 24 ASP C 1 1 1 321 1 1 24 ASP CA C -1.165 -6.768 5.714 1.00 . A B . 24 ASP CA 1 1 1 322 1 1 24 ASP CB C -0.978 -7.636 6.965 1.00 . A B . 24 ASP CB 1 1 1 323 1 1 24 ASP CG C -0.420 -6.871 8.145 1.00 . A B . 24 ASP CG 1 1 1 324 1 1 24 ASP H H -2.874 -5.931 6.659 1.00 . A B . 24 ASP H 1 1 1 325 1 1 24 ASP HA H -0.325 -6.096 5.629 1.00 . A B . 24 ASP HA 1 1 1 326 1 1 24 ASP HB2 H -1.930 -8.051 7.253 1.00 . A B . 24 ASP HB2 1 1 1 327 1 1 24 ASP HB3 H -0.298 -8.443 6.732 1.00 . A B . 24 ASP HB3 1 1 1 328 1 1 24 ASP N N -2.382 -5.956 5.808 1.00 . A B . 24 ASP N 1 1 1 329 1 1 24 ASP O O -0.267 -7.662 3.680 1.00 . A B . 24 ASP O 1 1 1 330 1 1 24 ASP OD1 O -1.164 -6.080 8.759 1.00 . A B . 24 ASP OD1 1 1 1 331 1 1 24 ASP OD2 O 0.765 -7.077 8.483 1.00 . A B . 24 ASP OD2 1 1 1 332 1 1 25 THR C C -2.233 -8.746 1.890 1.00 . A B . 25 THR C 1 1 1 333 1 1 25 THR CA C -2.417 -9.382 3.271 1.00 . A B . 25 THR CA 1 1 1 334 1 1 25 THR CB C -3.787 -10.081 3.346 1.00 . A B . 25 THR CB 1 1 1 335 1 1 25 THR CG2 C -3.875 -11.225 2.349 1.00 . A B . 25 THR CG2 1 1 1 336 1 1 25 THR H H -3.034 -8.280 4.966 1.00 . A B . 25 THR H 1 1 1 337 1 1 25 THR HA H -1.651 -10.128 3.414 1.00 . A B . 25 THR HA 1 1 1 338 1 1 25 THR HB H -4.556 -9.359 3.115 1.00 . A B . 25 THR HB 1 1 1 339 1 1 25 THR HG1 H -3.246 -11.129 4.931 1.00 . A B . 25 THR HG1 1 1 1 340 1 1 25 THR HG21 H -4.854 -11.677 2.406 1.00 . A B . 25 THR HG21 1 1 1 341 1 1 25 THR HG22 H -3.123 -11.963 2.585 1.00 . A B . 25 THR HG22 1 1 1 342 1 1 25 THR HG23 H -3.708 -10.847 1.352 1.00 . A B . 25 THR HG23 1 1 1 343 1 1 25 THR N N -2.289 -8.401 4.336 1.00 . A B . 25 THR N 1 1 1 344 1 1 25 THR O O -1.459 -9.242 1.074 1.00 . A B . 25 THR O 1 1 1 345 1 1 25 THR OG1 O -4.001 -10.584 4.672 1.00 . A B . 25 THR OG1 1 1 1 346 1 1 26 CYS C C -1.525 -6.242 0.147 1.00 . A B . 26 CYS C 1 1 1 347 1 1 26 CYS CA C -2.840 -6.993 0.333 1.00 . A B . 26 CYS CA 1 1 1 348 1 1 26 CYS CB C -4.010 -6.036 0.122 1.00 . A B . 26 CYS CB 1 1 1 349 1 1 26 CYS H H -3.482 -7.252 2.342 1.00 . A B . 26 CYS H 1 1 1 350 1 1 26 CYS HA H -2.894 -7.773 -0.412 1.00 . A B . 26 CYS HA 1 1 1 351 1 1 26 CYS HB2 H -3.963 -5.259 0.866 1.00 . A B . 26 CYS HB2 1 1 1 352 1 1 26 CYS HB3 H -3.929 -5.590 -0.857 1.00 . A B . 26 CYS HB3 1 1 1 353 1 1 26 CYS N N -2.916 -7.637 1.640 1.00 . A B . 26 CYS N 1 1 1 354 1 1 26 CYS O O -0.994 -6.193 -0.957 1.00 . A B . 26 CYS O 1 1 1 355 1 1 26 CYS SG S -5.637 -6.807 0.245 1.00 . A B . 26 CYS SG 1 1 1 356 1 1 27 SER C C 1.412 -5.785 0.743 1.00 . A B . 27 SER C 1 1 1 357 1 1 27 SER CA C 0.242 -4.889 1.134 1.00 . A B . 27 SER CA 1 1 1 358 1 1 27 SER CB C 0.532 -4.193 2.470 1.00 . A B . 27 SER CB 1 1 1 359 1 1 27 SER H H -1.418 -5.773 2.102 1.00 . A B . 27 SER H 1 1 1 360 1 1 27 SER HA H 0.104 -4.137 0.369 1.00 . A B . 27 SER HA 1 1 1 361 1 1 27 SER HB2 H -0.271 -3.509 2.699 1.00 . A B . 27 SER HB2 1 1 1 362 1 1 27 SER HB3 H 0.603 -4.936 3.250 1.00 . A B . 27 SER HB3 1 1 1 363 1 1 27 SER HG H 2.249 -3.632 3.229 1.00 . A B . 27 SER HG 1 1 1 364 1 1 27 SER N N -0.991 -5.666 1.223 1.00 . A B . 27 SER N 1 1 1 365 1 1 27 SER O O 2.279 -5.392 -0.028 1.00 . A B . 27 SER O 1 1 1 366 1 1 27 SER OG O 1.745 -3.461 2.424 1.00 . A B . 27 SER OG 1 1 1 367 1 1 28 ARG C C 2.459 -8.419 -0.464 1.00 . A B . 28 ARG C 1 1 1 368 1 1 28 ARG CA C 2.497 -7.944 0.984 1.00 . A B . 28 ARG CA 1 1 1 369 1 1 28 ARG CB C 2.401 -9.135 1.936 1.00 . A B . 28 ARG CB 1 1 1 370 1 1 28 ARG CD C 2.238 -9.890 4.332 1.00 . A B . 28 ARG CD 1 1 1 371 1 1 28 ARG CG C 2.544 -8.737 3.393 1.00 . A B . 28 ARG CG 1 1 1 372 1 1 28 ARG CZ C 1.816 -10.222 6.742 1.00 . A B . 28 ARG CZ 1 1 1 373 1 1 28 ARG H H 0.686 -7.280 1.855 1.00 . A B . 28 ARG H 1 1 1 374 1 1 28 ARG HA H 3.430 -7.431 1.157 1.00 . A B . 28 ARG HA 1 1 1 375 1 1 28 ARG HB2 H 1.439 -9.610 1.805 1.00 . A B . 28 ARG HB2 1 1 1 376 1 1 28 ARG HB3 H 3.181 -9.842 1.697 1.00 . A B . 28 ARG HB3 1 1 1 377 1 1 28 ARG HD2 H 1.291 -10.326 4.052 1.00 . A B . 28 ARG HD2 1 1 1 378 1 1 28 ARG HD3 H 3.018 -10.629 4.241 1.00 . A B . 28 ARG HD3 1 1 1 379 1 1 28 ARG HE H 2.372 -8.494 5.896 1.00 . A B . 28 ARG HE 1 1 1 380 1 1 28 ARG HG2 H 3.555 -8.407 3.565 1.00 . A B . 28 ARG HG2 1 1 1 381 1 1 28 ARG HG3 H 1.862 -7.924 3.600 1.00 . A B . 28 ARG HG3 1 1 1 382 1 1 28 ARG HH11 H 1.629 -11.908 5.629 1.00 . A B . 28 ARG HH11 1 1 1 383 1 1 28 ARG HH12 H 1.301 -12.094 7.319 1.00 . A B . 28 ARG HH12 1 1 1 384 1 1 28 ARG HH21 H 1.907 -8.734 8.113 1.00 . A B . 28 ARG HH21 1 1 1 385 1 1 28 ARG HH22 H 1.467 -10.291 8.734 1.00 . A B . 28 ARG HH22 1 1 1 386 1 1 28 ARG N N 1.418 -7.005 1.260 1.00 . A B . 28 ARG N 1 1 1 387 1 1 28 ARG NE N 2.165 -9.443 5.721 1.00 . A B . 28 ARG NE 1 1 1 388 1 1 28 ARG NH1 N 1.561 -11.510 6.549 1.00 . A B . 28 ARG NH1 1 1 1 389 1 1 28 ARG NH2 N 1.722 -9.709 7.960 1.00 . A B . 28 ARG NH2 1 1 1 390 1 1 28 ARG O O 3.463 -8.892 -0.994 1.00 . A B . 28 ARG O 1 1 1 391 1 1 29 VAL C C 1.181 -7.591 -3.471 1.00 . A B . 29 VAL C 1 1 1 392 1 1 29 VAL CA C 1.140 -8.748 -2.469 1.00 . A B . 29 VAL CA 1 1 1 393 1 1 29 VAL CB C -0.181 -9.529 -2.640 1.00 . A B . 29 VAL CB 1 1 1 394 1 1 29 VAL CG1 C -0.301 -10.093 -4.046 1.00 . A B . 29 VAL CG1 1 1 1 395 1 1 29 VAL CG2 C -0.282 -10.646 -1.616 1.00 . A B . 29 VAL CG2 1 1 1 396 1 1 29 VAL H H 0.553 -7.857 -0.644 1.00 . A B . 29 VAL H 1 1 1 397 1 1 29 VAL HA H 1.955 -9.420 -2.686 1.00 . A B . 29 VAL HA 1 1 1 398 1 1 29 VAL HB H -1.001 -8.846 -2.475 1.00 . A B . 29 VAL HB 1 1 1 399 1 1 29 VAL HG11 H 0.518 -10.771 -4.232 1.00 . A B . 29 VAL HG11 1 1 1 400 1 1 29 VAL HG12 H -0.269 -9.287 -4.764 1.00 . A B . 29 VAL HG12 1 1 1 401 1 1 29 VAL HG13 H -1.235 -10.624 -4.143 1.00 . A B . 29 VAL HG13 1 1 1 402 1 1 29 VAL HG21 H -1.195 -11.201 -1.779 1.00 . A B . 29 VAL HG21 1 1 1 403 1 1 29 VAL HG22 H -0.291 -10.224 -0.622 1.00 . A B . 29 VAL HG22 1 1 1 404 1 1 29 VAL HG23 H 0.564 -11.307 -1.720 1.00 . A B . 29 VAL HG23 1 1 1 405 1 1 29 VAL N N 1.307 -8.280 -1.103 1.00 . A B . 29 VAL N 1 1 1 406 1 1 29 VAL O O 1.811 -7.698 -4.522 1.00 . A B . 29 VAL O 1 1 1 407 1 1 30 PHE C C 0.930 -4.070 -3.433 1.00 . A B . 30 PHE C 1 1 1 408 1 1 30 PHE CA C 0.418 -5.359 -4.067 1.00 . A B . 30 PHE CA 1 1 1 409 1 1 30 PHE CB C -1.040 -5.153 -4.503 1.00 . A B . 30 PHE CB 1 1 1 410 1 1 30 PHE CD1 C -1.304 -6.839 -6.356 1.00 . A B . 30 PHE CD1 1 1 1 411 1 1 30 PHE CD2 C -2.713 -7.019 -4.438 1.00 . A B . 30 PHE CD2 1 1 1 412 1 1 30 PHE CE1 C -1.916 -7.945 -6.912 1.00 . A B . 30 PHE CE1 1 1 1 413 1 1 30 PHE CE2 C -3.328 -8.125 -4.990 1.00 . A B . 30 PHE CE2 1 1 1 414 1 1 30 PHE CG C -1.694 -6.364 -5.111 1.00 . A B . 30 PHE CG 1 1 1 415 1 1 30 PHE CZ C -2.929 -8.590 -6.228 1.00 . A B . 30 PHE CZ 1 1 1 416 1 1 30 PHE H H 0.131 -6.403 -2.242 1.00 . A B . 30 PHE H 1 1 1 417 1 1 30 PHE HA H 1.018 -5.586 -4.935 1.00 . A B . 30 PHE HA 1 1 1 418 1 1 30 PHE HB2 H -1.624 -4.869 -3.640 1.00 . A B . 30 PHE HB2 1 1 1 419 1 1 30 PHE HB3 H -1.078 -4.353 -5.232 1.00 . A B . 30 PHE HB3 1 1 1 420 1 1 30 PHE HD1 H -0.512 -6.338 -6.894 1.00 . A B . 30 PHE HD1 1 1 1 421 1 1 30 PHE HD2 H -3.030 -6.655 -3.472 1.00 . A B . 30 PHE HD2 1 1 1 422 1 1 30 PHE HE1 H -1.605 -8.305 -7.882 1.00 . A B . 30 PHE HE1 1 1 1 423 1 1 30 PHE HE2 H -4.120 -8.626 -4.452 1.00 . A B . 30 PHE HE2 1 1 1 424 1 1 30 PHE HZ H -3.409 -9.455 -6.661 1.00 . A B . 30 PHE HZ 1 1 1 425 1 1 30 PHE N N 0.531 -6.481 -3.139 1.00 . A B . 30 PHE N 1 1 1 426 1 1 30 PHE O O 0.334 -3.012 -3.614 1.00 . A B . 30 PHE O 1 1 1 427 1 1 31 HIS C C 2.736 -1.802 -2.907 1.00 . A B . 31 HIS C 1 1 1 428 1 1 31 HIS CA C 2.621 -3.021 -1.997 1.00 . A B . 31 HIS CA 1 1 1 429 1 1 31 HIS CB C 4.002 -3.408 -1.456 1.00 . A B . 31 HIS CB 1 1 1 430 1 1 31 HIS CD2 C 5.780 -1.588 -0.940 1.00 . A B . 31 HIS CD2 1 1 1 431 1 1 31 HIS CE1 C 5.225 -1.095 1.092 1.00 . A B . 31 HIS CE1 1 1 1 432 1 1 31 HIS CG C 4.695 -2.349 -0.639 1.00 . A B . 31 HIS CG 1 1 1 433 1 1 31 HIS H H 2.464 -5.044 -2.612 1.00 . A B . 31 HIS H 1 1 1 434 1 1 31 HIS HA H 1.977 -2.776 -1.167 1.00 . A B . 31 HIS HA 1 1 1 435 1 1 31 HIS HB2 H 3.894 -4.282 -0.830 1.00 . A B . 31 HIS HB2 1 1 1 436 1 1 31 HIS HB3 H 4.641 -3.655 -2.292 1.00 . A B . 31 HIS HB3 1 1 1 437 1 1 31 HIS HD1 H 3.600 -2.405 1.164 1.00 . A B . 31 HIS HD1 1 1 1 438 1 1 31 HIS HD2 H 6.296 -1.573 -1.886 1.00 . A B . 31 HIS HD2 1 1 1 439 1 1 31 HIS HE1 H 5.200 -0.648 2.076 1.00 . A B . 31 HIS HE1 1 1 1 440 1 1 31 HIS N N 2.033 -4.168 -2.699 1.00 . A B . 31 HIS N 1 1 1 441 1 1 31 HIS ND1 N 4.353 -2.025 0.653 1.00 . A B . 31 HIS ND1 1 1 1 442 1 1 31 HIS NE2 N 6.114 -0.796 0.161 1.00 . A B . 31 HIS NE2 1 1 1 443 1 1 31 HIS O O 2.304 -0.713 -2.552 1.00 . A B . 31 HIS O 1 1 1 444 1 1 32 GLU C C 2.261 -0.249 -5.501 1.00 . A B . 32 GLU C 1 1 1 445 1 1 32 GLU CA C 3.545 -0.925 -5.025 1.00 . A B . 32 GLU CA 1 1 1 446 1 1 32 GLU CB C 4.331 -1.462 -6.220 1.00 . A B . 32 GLU CB 1 1 1 447 1 1 32 GLU CD C 6.265 -2.899 -6.969 1.00 . A B . 32 GLU CD 1 1 1 448 1 1 32 GLU CG C 5.668 -2.083 -5.844 1.00 . A B . 32 GLU CG 1 1 1 449 1 1 32 GLU H H 3.406 -2.938 -4.392 1.00 . A B . 32 GLU H 1 1 1 450 1 1 32 GLU HA H 4.148 -0.196 -4.502 1.00 . A B . 32 GLU HA 1 1 1 451 1 1 32 GLU HB2 H 3.735 -2.215 -6.715 1.00 . A B . 32 GLU HB2 1 1 1 452 1 1 32 GLU HB3 H 4.514 -0.652 -6.909 1.00 . A B . 32 GLU HB3 1 1 1 453 1 1 32 GLU HG2 H 6.358 -1.292 -5.589 1.00 . A B . 32 GLU HG2 1 1 1 454 1 1 32 GLU HG3 H 5.528 -2.726 -4.987 1.00 . A B . 32 GLU HG3 1 1 1 455 1 1 32 GLU N N 3.252 -2.016 -4.105 1.00 . A B . 32 GLU N 1 1 1 456 1 1 32 GLU O O 2.208 0.970 -5.659 1.00 . A B . 32 GLU O 1 1 1 457 1 1 32 GLU OE1 O 5.883 -4.079 -7.114 1.00 . A B . 32 GLU OE1 1 1 1 458 1 1 32 GLU OE2 O 7.117 -2.368 -7.712 1.00 . A B . 32 GLU OE2 1 1 1 459 1 1 33 ASP C C -0.839 0.067 -5.034 1.00 . A B . 33 ASP C 1 1 1 460 1 1 33 ASP CA C -0.055 -0.546 -6.191 1.00 . A B . 33 ASP CA 1 1 1 461 1 1 33 ASP CB C -0.861 -1.681 -6.832 1.00 . A B . 33 ASP CB 1 1 1 462 1 1 33 ASP CG C -2.005 -1.187 -7.704 1.00 . A B . 33 ASP CG 1 1 1 463 1 1 33 ASP H H 1.330 -2.010 -5.544 1.00 . A B . 33 ASP H 1 1 1 464 1 1 33 ASP HA H 0.137 0.219 -6.931 1.00 . A B . 33 ASP HA 1 1 1 465 1 1 33 ASP HB2 H -0.203 -2.279 -7.445 1.00 . A B . 33 ASP HB2 1 1 1 466 1 1 33 ASP HB3 H -1.272 -2.300 -6.048 1.00 . A B . 33 ASP HB3 1 1 1 467 1 1 33 ASP N N 1.229 -1.052 -5.716 1.00 . A B . 33 ASP N 1 1 1 468 1 1 33 ASP O O -1.638 0.982 -5.222 1.00 . A B . 33 ASP O 1 1 1 469 1 1 33 ASP OD1 O -3.069 -0.819 -7.165 1.00 . A B . 33 ASP OD1 1 1 1 470 1 1 33 ASP OD2 O -1.846 -1.177 -8.943 1.00 . A B . 33 ASP OD2 1 1 1 471 1 1 34 CYS C C -0.905 1.404 -2.189 1.00 . A B . 34 CYS C 1 1 1 472 1 1 34 CYS CA C -1.293 -0.004 -2.633 1.00 . A B . 34 CYS CA 1 1 1 473 1 1 34 CYS CB C -1.054 -1.002 -1.500 1.00 . A B . 34 CYS CB 1 1 1 474 1 1 34 CYS H H 0.123 -1.118 -3.745 1.00 . A B . 34 CYS H 1 1 1 475 1 1 34 CYS HA H -2.348 -0.004 -2.872 1.00 . A B . 34 CYS HA 1 1 1 476 1 1 34 CYS HB2 H -0.035 -1.366 -1.555 1.00 . A B . 34 CYS HB2 1 1 1 477 1 1 34 CYS HB3 H -1.205 -0.508 -0.551 1.00 . A B . 34 CYS HB3 1 1 1 478 1 1 34 CYS N N -0.575 -0.429 -3.831 1.00 . A B . 34 CYS N 1 1 1 479 1 1 34 CYS O O -1.529 1.976 -1.293 1.00 . A B . 34 CYS O 1 1 1 480 1 1 34 CYS SG S -2.154 -2.448 -1.556 1.00 . A B . 34 CYS SG 1 1 1 481 1 1 35 HIS C C -0.128 4.293 -3.517 1.00 . A B . 35 HIS C 1 1 1 482 1 1 35 HIS CA C 0.524 3.334 -2.528 1.00 . A B . 35 HIS CA 1 1 1 483 1 1 35 HIS CB C 2.044 3.480 -2.598 1.00 . A B . 35 HIS CB 1 1 1 484 1 1 35 HIS CD2 C 3.216 1.607 -1.264 1.00 . A B . 35 HIS CD2 1 1 1 485 1 1 35 HIS CE1 C 3.660 2.675 0.558 1.00 . A B . 35 HIS CE1 1 1 1 486 1 1 35 HIS CG C 2.756 2.867 -1.433 1.00 . A B . 35 HIS CG 1 1 1 487 1 1 35 HIS H H 0.632 1.434 -3.462 1.00 . A B . 35 HIS H 1 1 1 488 1 1 35 HIS HA H 0.193 3.578 -1.528 1.00 . A B . 35 HIS HA 1 1 1 489 1 1 35 HIS HB2 H 2.400 2.996 -3.498 1.00 . A B . 35 HIS HB2 1 1 1 490 1 1 35 HIS HB3 H 2.295 4.530 -2.633 1.00 . A B . 35 HIS HB3 1 1 1 491 1 1 35 HIS HD1 H 2.790 4.461 -0.046 1.00 . A B . 35 HIS HD1 1 1 1 492 1 1 35 HIS HD2 H 3.170 0.812 -1.996 1.00 . A B . 35 HIS HD2 1 1 1 493 1 1 35 HIS HE1 H 4.013 2.927 1.547 1.00 . A B . 35 HIS HE1 1 1 1 494 1 1 35 HIS N N 0.124 1.960 -2.809 1.00 . A B . 35 HIS N 1 1 1 495 1 1 35 HIS ND1 N 3.040 3.535 -0.262 1.00 . A B . 35 HIS ND1 1 1 1 496 1 1 35 HIS NE2 N 3.787 1.486 -0.005 1.00 . A B . 35 HIS NE2 1 1 1 497 1 1 35 HIS O O 0.010 5.510 -3.404 1.00 . A B . 35 HIS O 1 1 1 498 1 1 36 ILE C C -2.956 4.298 -5.590 1.00 . A B . 36 ILE C 1 1 1 499 1 1 36 ILE CA C -1.446 4.534 -5.536 1.00 . A B . 36 ILE CA 1 1 1 500 1 1 36 ILE CB C -0.842 4.186 -6.915 1.00 . A B . 36 ILE CB 1 1 1 501 1 1 36 ILE CD1 C 1.362 3.950 -8.178 1.00 . A B . 36 ILE CD1 1 1 1 502 1 1 36 ILE CG1 C 0.681 4.356 -6.888 1.00 . A B . 36 ILE CG1 1 1 1 503 1 1 36 ILE CG2 C -1.461 5.049 -8.005 1.00 . A B . 36 ILE CG2 1 1 1 504 1 1 36 ILE H H -0.952 2.763 -4.502 1.00 . A B . 36 ILE H 1 1 1 505 1 1 36 ILE HA H -1.245 5.570 -5.328 1.00 . A B . 36 ILE HA 1 1 1 506 1 1 36 ILE HB H -1.077 3.154 -7.131 1.00 . A B . 36 ILE HB 1 1 1 507 1 1 36 ILE HD11 H 0.977 4.546 -8.992 1.00 . A B . 36 ILE HD11 1 1 1 508 1 1 36 ILE HD12 H 1.170 2.904 -8.375 1.00 . A B . 36 ILE HD12 1 1 1 509 1 1 36 ILE HD13 H 2.426 4.109 -8.089 1.00 . A B . 36 ILE HD13 1 1 1 510 1 1 36 ILE HG12 H 0.918 5.391 -6.702 1.00 . A B . 36 ILE HG12 1 1 1 511 1 1 36 ILE HG13 H 1.089 3.749 -6.092 1.00 . A B . 36 ILE HG13 1 1 1 512 1 1 36 ILE HG21 H -1.267 6.091 -7.793 1.00 . A B . 36 ILE HG21 1 1 1 513 1 1 36 ILE HG22 H -2.528 4.882 -8.035 1.00 . A B . 36 ILE HG22 1 1 1 514 1 1 36 ILE HG23 H -1.029 4.788 -8.960 1.00 . A B . 36 ILE HG23 1 1 1 515 1 1 36 ILE N N -0.835 3.738 -4.488 1.00 . A B . 36 ILE N 1 1 1 516 1 1 36 ILE O O -3.395 3.166 -5.789 1.00 . A B . 36 ILE O 1 1 1 517 1 1 37 PRO C C -3.577 6.952 -3.531 1.00 . A B . 37 PRO C 1 1 1 518 1 1 37 PRO CA C -3.370 6.689 -5.027 1.00 . A B . 37 PRO CA 1 1 1 519 1 1 37 PRO CB C -4.333 7.562 -5.849 1.00 . A B . 37 PRO CB 1 1 1 520 1 1 37 PRO CD C -5.229 5.310 -5.615 1.00 . A B . 37 PRO CD 1 1 1 521 1 1 37 PRO CG C -5.509 6.682 -6.189 1.00 . A B . 37 PRO CG 1 1 1 522 1 1 37 PRO HA H -2.353 6.904 -5.305 1.00 . A B . 37 PRO HA 1 1 1 523 1 1 37 PRO HB2 H -4.643 8.413 -5.254 1.00 . A B . 37 PRO HB2 1 1 1 524 1 1 37 PRO HB3 H -3.832 7.911 -6.746 1.00 . A B . 37 PRO HB3 1 1 1 525 1 1 37 PRO HD2 H -5.752 5.175 -4.678 1.00 . A B . 37 PRO HD2 1 1 1 526 1 1 37 PRO HD3 H -5.503 4.537 -6.319 1.00 . A B . 37 PRO HD3 1 1 1 527 1 1 37 PRO HG2 H -6.408 7.090 -5.749 1.00 . A B . 37 PRO HG2 1 1 1 528 1 1 37 PRO HG3 H -5.618 6.622 -7.264 1.00 . A B . 37 PRO HG3 1 1 1 529 1 1 37 PRO N N -3.784 5.343 -5.407 1.00 . A B . 37 PRO N 1 1 1 530 1 1 37 PRO O O -4.493 6.394 -2.918 1.00 . A B . 37 PRO O 1 1 1 531 1 1 38 PRO C C -4.106 9.177 -1.428 1.00 . A B . 38 PRO C 1 1 1 532 1 1 38 PRO CA C -2.945 8.198 -1.526 1.00 . A B . 38 PRO CA 1 1 1 533 1 1 38 PRO CB C -1.629 8.887 -1.128 1.00 . A B . 38 PRO CB 1 1 1 534 1 1 38 PRO CD C -1.535 8.406 -3.481 1.00 . A B . 38 PRO CD 1 1 1 535 1 1 38 PRO CG C -0.681 8.654 -2.264 1.00 . A B . 38 PRO CG 1 1 1 536 1 1 38 PRO HA H -3.129 7.349 -0.886 1.00 . A B . 38 PRO HA 1 1 1 537 1 1 38 PRO HB2 H -1.809 9.942 -0.975 1.00 . A B . 38 PRO HB2 1 1 1 538 1 1 38 PRO HB3 H -1.258 8.450 -0.211 1.00 . A B . 38 PRO HB3 1 1 1 539 1 1 38 PRO HD2 H -1.774 9.336 -3.977 1.00 . A B . 38 PRO HD2 1 1 1 540 1 1 38 PRO HD3 H -1.041 7.725 -4.159 1.00 . A B . 38 PRO HD3 1 1 1 541 1 1 38 PRO HG2 H -0.064 9.530 -2.410 1.00 . A B . 38 PRO HG2 1 1 1 542 1 1 38 PRO HG3 H -0.064 7.791 -2.056 1.00 . A B . 38 PRO HG3 1 1 1 543 1 1 38 PRO N N -2.737 7.793 -2.909 1.00 . A B . 38 PRO N 1 1 1 544 1 1 38 PRO O O -4.161 10.155 -2.172 1.00 . A B . 38 PRO O 1 1 1 545 1 1 39 VAL C C -5.848 11.020 0.443 1.00 . A B . 39 VAL C 1 1 1 546 1 1 39 VAL CA C -6.198 9.770 -0.363 1.00 . A B . 39 VAL CA 1 1 1 547 1 1 39 VAL CB C -7.391 9.017 0.276 1.00 . A B . 39 VAL CB 1 1 1 548 1 1 39 VAL CG1 C -7.044 8.477 1.654 1.00 . A B . 39 VAL CG1 1 1 1 549 1 1 39 VAL CG2 C -8.622 9.908 0.339 1.00 . A B . 39 VAL CG2 1 1 1 550 1 1 39 VAL H H -4.936 8.126 0.050 1.00 . A B . 39 VAL H 1 1 1 551 1 1 39 VAL HA H -6.498 10.078 -1.352 1.00 . A B . 39 VAL HA 1 1 1 552 1 1 39 VAL HB H -7.626 8.175 -0.356 1.00 . A B . 39 VAL HB 1 1 1 553 1 1 39 VAL HG11 H -7.923 8.031 2.096 1.00 . A B . 39 VAL HG11 1 1 1 554 1 1 39 VAL HG12 H -6.697 9.286 2.280 1.00 . A B . 39 VAL HG12 1 1 1 555 1 1 39 VAL HG13 H -6.269 7.733 1.565 1.00 . A B . 39 VAL HG13 1 1 1 556 1 1 39 VAL HG21 H -8.400 10.786 0.927 1.00 . A B . 39 VAL HG21 1 1 1 557 1 1 39 VAL HG22 H -9.436 9.366 0.795 1.00 . A B . 39 VAL HG22 1 1 1 558 1 1 39 VAL HG23 H -8.902 10.205 -0.660 1.00 . A B . 39 VAL HG23 1 1 1 559 1 1 39 VAL N N -5.035 8.912 -0.522 1.00 . A B . 39 VAL N 1 1 1 560 1 1 39 VAL O O -5.356 10.935 1.569 1.00 . A B . 39 VAL O 1 1 1 561 1 1 40 GLU C C -7.050 14.095 1.038 1.00 . A B . 40 GLU C 1 1 1 562 1 1 40 GLU CA C -5.779 13.440 0.508 1.00 . A B . 40 GLU CA 1 1 1 563 1 1 40 GLU CB C -5.050 14.380 -0.453 1.00 . A B . 40 GLU CB 1 1 1 564 1 1 40 GLU CD C -3.498 15.279 1.319 1.00 . A B . 40 GLU CD 1 1 1 565 1 1 40 GLU CG C -4.493 15.617 0.228 1.00 . A B . 40 GLU CG 1 1 1 566 1 1 40 GLU H H -6.503 12.193 -1.034 1.00 . A B . 40 GLU H 1 1 1 567 1 1 40 GLU HA H -5.130 13.223 1.344 1.00 . A B . 40 GLU HA 1 1 1 568 1 1 40 GLU HB2 H -4.231 13.845 -0.910 1.00 . A B . 40 GLU HB2 1 1 1 569 1 1 40 GLU HB3 H -5.738 14.696 -1.222 1.00 . A B . 40 GLU HB3 1 1 1 570 1 1 40 GLU HG2 H -4.002 16.229 -0.513 1.00 . A B . 40 GLU HG2 1 1 1 571 1 1 40 GLU HG3 H -5.311 16.167 0.665 1.00 . A B . 40 GLU HG3 1 1 1 572 1 1 40 GLU N N -6.093 12.182 -0.142 1.00 . A B . 40 GLU N 1 1 1 573 1 1 40 GLU O O -7.447 15.180 0.608 1.00 . A B . 40 GLU O 1 1 1 574 1 1 40 GLU OE1 O -3.923 14.888 2.429 1.00 . A B . 40 GLU OE1 1 1 1 575 1 1 40 GLU OE2 O -2.279 15.400 1.076 1.00 . A B . 40 GLU OE2 1 1 1 576 1 1 41 ALA C C -9.150 13.135 3.877 1.00 . A B . 41 ALA C 1 1 1 577 1 1 41 ALA CA C -8.900 13.903 2.594 1.00 . A B . 41 ALA CA 1 1 1 578 1 1 41 ALA CB C -10.084 13.771 1.646 1.00 . A B . 41 ALA CB 1 1 1 579 1 1 41 ALA H H -7.330 12.544 2.245 1.00 . A B . 41 ALA H 1 1 1 580 1 1 41 ALA HA H -8.762 14.947 2.826 1.00 . A B . 41 ALA HA 1 1 1 581 1 1 41 ALA HB1 H -10.229 12.732 1.395 1.00 . A B . 41 ALA HB1 1 1 1 582 1 1 41 ALA HB2 H -9.888 14.334 0.745 1.00 . A B . 41 ALA HB2 1 1 1 583 1 1 41 ALA HB3 H -10.971 14.155 2.123 1.00 . A B . 41 ALA HB3 1 1 1 584 1 1 41 ALA N N -7.689 13.411 1.966 1.00 . A B . 41 ALA N 1 1 1 585 1 1 41 ALA O O -8.892 13.627 4.973 1.00 . A B . 41 ALA O 1 1 1 586 1 1 42 GLU C C -8.737 9.938 4.812 1.00 . A B . 42 GLU C 1 1 1 587 1 1 42 GLU CA C -9.805 11.017 4.851 1.00 . A B . 42 GLU CA 1 1 1 588 1 1 42 GLU CB C -11.195 10.387 4.817 1.00 . A B . 42 GLU CB 1 1 1 589 1 1 42 GLU CD C -12.268 12.297 6.064 1.00 . A B . 42 GLU CD 1 1 1 590 1 1 42 GLU CG C -12.316 11.407 4.840 1.00 . A B . 42 GLU CG 1 1 1 591 1 1 42 GLU H H -9.856 11.600 2.830 1.00 . A B . 42 GLU H 1 1 1 592 1 1 42 GLU HA H -9.699 11.593 5.758 1.00 . A B . 42 GLU HA 1 1 1 593 1 1 42 GLU HB2 H -11.290 9.797 3.918 1.00 . A B . 42 GLU HB2 1 1 1 594 1 1 42 GLU HB3 H -11.306 9.742 5.675 1.00 . A B . 42 GLU HB3 1 1 1 595 1 1 42 GLU HG2 H -12.233 12.028 3.960 1.00 . A B . 42 GLU HG2 1 1 1 596 1 1 42 GLU HG3 H -13.261 10.887 4.827 1.00 . A B . 42 GLU HG3 1 1 1 597 1 1 42 GLU N N -9.622 11.912 3.726 1.00 . A B . 42 GLU N 1 1 1 598 1 1 42 GLU O O -8.965 8.843 4.301 1.00 . A B . 42 GLU O 1 1 1 599 1 1 42 GLU OE1 O -12.570 11.810 7.172 1.00 . A B . 42 GLU OE1 1 1 1 600 1 1 42 GLU OE2 O -11.919 13.489 5.928 1.00 . A B . 42 GLU OE2 1 1 1 601 1 1 43 ARG C C -6.714 8.230 6.350 1.00 . A B . 43 ARG C 1 1 1 602 1 1 43 ARG CA C -6.447 9.336 5.341 1.00 . A B . 43 ARG CA 1 1 1 603 1 1 43 ARG CB C -5.140 10.046 5.688 1.00 . A B . 43 ARG CB 1 1 1 604 1 1 43 ARG CD C -3.344 11.659 5.039 1.00 . A B . 43 ARG CD 1 1 1 605 1 1 43 ARG CG C -4.712 11.103 4.681 1.00 . A B . 43 ARG CG 1 1 1 606 1 1 43 ARG CZ C -1.583 13.008 3.958 1.00 . A B . 43 ARG CZ 1 1 1 607 1 1 43 ARG H H -7.443 11.165 5.706 1.00 . A B . 43 ARG H 1 1 1 608 1 1 43 ARG HA H -6.361 8.897 4.359 1.00 . A B . 43 ARG HA 1 1 1 609 1 1 43 ARG HB2 H -5.253 10.525 6.648 1.00 . A B . 43 ARG HB2 1 1 1 610 1 1 43 ARG HB3 H -4.356 9.308 5.756 1.00 . A B . 43 ARG HB3 1 1 1 611 1 1 43 ARG HD2 H -3.399 12.108 6.018 1.00 . A B . 43 ARG HD2 1 1 1 612 1 1 43 ARG HD3 H -2.641 10.838 5.063 1.00 . A B . 43 ARG HD3 1 1 1 613 1 1 43 ARG HE H -3.537 13.099 3.507 1.00 . A B . 43 ARG HE 1 1 1 614 1 1 43 ARG HG2 H -4.668 10.656 3.699 1.00 . A B . 43 ARG HG2 1 1 1 615 1 1 43 ARG HG3 H -5.434 11.909 4.684 1.00 . A B . 43 ARG HG3 1 1 1 616 1 1 43 ARG HH11 H -0.920 11.745 5.401 1.00 . A B . 43 ARG HH11 1 1 1 617 1 1 43 ARG HH12 H 0.306 12.704 4.634 1.00 . A B . 43 ARG HH12 1 1 1 618 1 1 43 ARG HH21 H -1.913 14.367 2.481 1.00 . A B . 43 ARG HH21 1 1 1 619 1 1 43 ARG HH22 H -0.252 14.176 2.970 1.00 . A B . 43 ARG HH22 1 1 1 620 1 1 43 ARG N N -7.560 10.271 5.321 1.00 . A B . 43 ARG N 1 1 1 621 1 1 43 ARG NE N -2.867 12.661 4.084 1.00 . A B . 43 ARG NE 1 1 1 622 1 1 43 ARG NH1 N -0.659 12.438 4.725 1.00 . A B . 43 ARG NH1 1 1 1 623 1 1 43 ARG NH2 N -1.220 13.923 3.069 1.00 . A B . 43 ARG NH2 1 1 1 624 1 1 43 ARG O O -6.412 8.366 7.534 1.00 . A B . 43 ARG O 1 1 1 625 1 1 44 THR C C -6.742 4.830 6.440 1.00 . A B . 44 THR C 1 1 1 626 1 1 44 THR CA C -7.646 6.029 6.729 1.00 . A B . 44 THR CA 1 1 1 627 1 1 44 THR CB C -9.121 5.631 6.530 1.00 . A B . 44 THR CB 1 1 1 628 1 1 44 THR CG2 C -10.048 6.702 7.081 1.00 . A B . 44 THR CG2 1 1 1 629 1 1 44 THR H H -7.550 7.118 4.928 1.00 . A B . 44 THR H 1 1 1 630 1 1 44 THR HA H -7.511 6.335 7.755 1.00 . A B . 44 THR HA 1 1 1 631 1 1 44 THR HB H -9.302 4.707 7.058 1.00 . A B . 44 THR HB 1 1 1 632 1 1 44 THR HG1 H -8.779 4.788 4.776 1.00 . A B . 44 THR HG1 1 1 1 633 1 1 44 THR HG21 H -9.872 6.822 8.140 1.00 . A B . 44 THR HG21 1 1 1 634 1 1 44 THR HG22 H -11.075 6.412 6.916 1.00 . A B . 44 THR HG22 1 1 1 635 1 1 44 THR HG23 H -9.853 7.639 6.578 1.00 . A B . 44 THR HG23 1 1 1 636 1 1 44 THR N N -7.310 7.153 5.878 1.00 . A B . 44 THR N 1 1 1 637 1 1 44 THR O O -7.055 3.998 5.589 1.00 . A B . 44 THR O 1 1 1 638 1 1 44 THR OG1 O -9.391 5.443 5.133 1.00 . A B . 44 THR OG1 1 1 1 639 1 1 45 PRO C C -5.140 2.280 7.327 1.00 . A B . 45 PRO C 1 1 1 640 1 1 45 PRO CA C -4.618 3.659 6.924 1.00 . A B . 45 PRO CA 1 1 1 641 1 1 45 PRO CB C -3.431 4.057 7.814 1.00 . A B . 45 PRO CB 1 1 1 642 1 1 45 PRO CD C -5.177 5.642 8.212 1.00 . A B . 45 PRO CD 1 1 1 643 1 1 45 PRO CG C -3.685 5.476 8.207 1.00 . A B . 45 PRO CG 1 1 1 644 1 1 45 PRO HA H -4.302 3.629 5.893 1.00 . A B . 45 PRO HA 1 1 1 645 1 1 45 PRO HB2 H -3.396 3.408 8.678 1.00 . A B . 45 PRO HB2 1 1 1 646 1 1 45 PRO HB3 H -2.513 3.963 7.251 1.00 . A B . 45 PRO HB3 1 1 1 647 1 1 45 PRO HD2 H -5.592 5.348 9.168 1.00 . A B . 45 PRO HD2 1 1 1 648 1 1 45 PRO HD3 H -5.450 6.662 7.977 1.00 . A B . 45 PRO HD3 1 1 1 649 1 1 45 PRO HG2 H -3.282 5.661 9.192 1.00 . A B . 45 PRO HG2 1 1 1 650 1 1 45 PRO HG3 H -3.236 6.142 7.485 1.00 . A B . 45 PRO HG3 1 1 1 651 1 1 45 PRO N N -5.605 4.726 7.148 1.00 . A B . 45 PRO N 1 1 1 652 1 1 45 PRO O O -4.572 1.258 6.947 1.00 . A B . 45 PRO O 1 1 1 653 1 1 46 TRP C C -7.834 0.500 7.510 1.00 . A B . 46 TRP C 1 1 1 654 1 1 46 TRP CA C -6.821 1.003 8.534 1.00 . A B . 46 TRP CA 1 1 1 655 1 1 46 TRP CB C -7.486 1.167 9.909 1.00 . A B . 46 TRP CB 1 1 1 656 1 1 46 TRP CD1 C -9.818 2.211 9.656 1.00 . A B . 46 TRP CD1 1 1 1 657 1 1 46 TRP CD2 C -8.241 3.641 10.354 1.00 . A B . 46 TRP CD2 1 1 1 658 1 1 46 TRP CE2 C -9.464 4.331 10.256 1.00 . A B . 46 TRP CE2 1 1 1 659 1 1 46 TRP CE3 C -7.105 4.340 10.778 1.00 . A B . 46 TRP CE3 1 1 1 660 1 1 46 TRP CG C -8.488 2.284 9.965 1.00 . A B . 46 TRP CG 1 1 1 661 1 1 46 TRP CH2 C -8.454 6.341 10.974 1.00 . A B . 46 TRP CH2 1 1 1 662 1 1 46 TRP CZ2 C -9.583 5.683 10.565 1.00 . A B . 46 TRP CZ2 1 1 1 663 1 1 46 TRP CZ3 C -7.225 5.682 11.083 1.00 . A B . 46 TRP CZ3 1 1 1 664 1 1 46 TRP H H -6.629 3.106 8.366 1.00 . A B . 46 TRP H 1 1 1 665 1 1 46 TRP HA H -6.027 0.276 8.612 1.00 . A B . 46 TRP HA 1 1 1 666 1 1 46 TRP HB2 H -7.998 0.250 10.166 1.00 . A B . 46 TRP HB2 1 1 1 667 1 1 46 TRP HB3 H -6.723 1.364 10.649 1.00 . A B . 46 TRP HB3 1 1 1 668 1 1 46 TRP HD1 H -10.318 1.315 9.323 1.00 . A B . 46 TRP HD1 1 1 1 669 1 1 46 TRP HE1 H -11.360 3.638 9.671 1.00 . A B . 46 TRP HE1 1 1 1 670 1 1 46 TRP HE3 H -6.147 3.849 10.867 1.00 . A B . 46 TRP HE3 1 1 1 671 1 1 46 TRP HH2 H -8.497 7.391 11.220 1.00 . A B . 46 TRP HH2 1 1 1 672 1 1 46 TRP HZ2 H -10.524 6.204 10.487 1.00 . A B . 46 TRP HZ2 1 1 1 673 1 1 46 TRP HZ3 H -6.359 6.241 11.409 1.00 . A B . 46 TRP HZ3 1 1 1 674 1 1 46 TRP N N -6.222 2.259 8.093 1.00 . A B . 46 TRP N 1 1 1 675 1 1 46 TRP NE1 N -10.408 3.436 9.828 1.00 . A B . 46 TRP NE1 1 1 1 676 1 1 46 TRP O O -8.240 -0.663 7.544 1.00 . A B . 46 TRP O 1 1 1 677 1 1 47 ASN C C -8.394 0.489 4.350 1.00 . A B . 47 ASN C 1 1 1 678 1 1 47 ASN CA C -9.165 1.020 5.545 1.00 . A B . 47 ASN CA 1 1 1 679 1 1 47 ASN CB C -10.011 2.228 5.124 1.00 . A B . 47 ASN CB 1 1 1 680 1 1 47 ASN CG C -11.056 1.871 4.075 1.00 . A B . 47 ASN CG 1 1 1 681 1 1 47 ASN H H -7.840 2.279 6.614 1.00 . A B . 47 ASN H 1 1 1 682 1 1 47 ASN HA H -9.813 0.243 5.925 1.00 . A B . 47 ASN HA 1 1 1 683 1 1 47 ASN HB2 H -10.514 2.632 5.991 1.00 . A B . 47 ASN HB2 1 1 1 684 1 1 47 ASN HB3 H -9.360 2.985 4.708 1.00 . A B . 47 ASN HB3 1 1 1 685 1 1 47 ASN HD21 H -12.397 1.471 5.490 1.00 . A B . 47 ASN HD21 1 1 1 686 1 1 47 ASN HD22 H -12.938 1.269 3.856 1.00 . A B . 47 ASN HD22 1 1 1 687 1 1 47 ASN N N -8.222 1.378 6.598 1.00 . A B . 47 ASN N 1 1 1 688 1 1 47 ASN ND2 N -12.249 1.500 4.517 1.00 . A B . 47 ASN ND2 1 1 1 689 1 1 47 ASN O O -7.577 1.204 3.769 1.00 . A B . 47 ASN O 1 1 1 690 1 1 47 ASN OD1 O -10.794 1.933 2.873 1.00 . A B . 47 ASN OD1 1 1 1 691 1 1 48 CYS C C -8.640 -1.129 1.593 1.00 . A B . 48 CYS C 1 1 1 692 1 1 48 CYS CA C -7.889 -1.365 2.898 1.00 . A B . 48 CYS CA 1 1 1 693 1 1 48 CYS CB C -7.685 -2.870 3.130 1.00 . A B . 48 CYS CB 1 1 1 694 1 1 48 CYS H H -9.249 -1.311 4.517 1.00 . A B . 48 CYS H 1 1 1 695 1 1 48 CYS HA H -6.924 -0.882 2.837 1.00 . A B . 48 CYS HA 1 1 1 696 1 1 48 CYS HB2 H -7.217 -3.021 4.092 1.00 . A B . 48 CYS HB2 1 1 1 697 1 1 48 CYS HB3 H -8.645 -3.363 3.121 1.00 . A B . 48 CYS HB3 1 1 1 698 1 1 48 CYS N N -8.607 -0.771 4.008 1.00 . A B . 48 CYS N 1 1 1 699 1 1 48 CYS O O -9.794 -1.538 1.443 1.00 . A B . 48 CYS O 1 1 1 700 1 1 48 CYS SG S -6.644 -3.662 1.882 1.00 . A B . 48 CYS SG 1 1 1 701 1 1 49 ILE C C -8.591 -1.410 -1.555 1.00 . A B . 49 ILE C 1 1 1 702 1 1 49 ILE CA C -8.582 -0.188 -0.646 1.00 . A B . 49 ILE CA 1 1 1 703 1 1 49 ILE CB C -7.889 0.989 -1.374 1.00 . A B . 49 ILE CB 1 1 1 704 1 1 49 ILE CD1 C -5.670 1.799 -2.342 1.00 . A B . 49 ILE CD1 1 1 1 705 1 1 49 ILE CG1 C -6.380 0.750 -1.510 1.00 . A B . 49 ILE CG1 1 1 1 706 1 1 49 ILE CG2 C -8.162 2.296 -0.642 1.00 . A B . 49 ILE CG2 1 1 1 707 1 1 49 ILE H H -7.046 -0.198 0.812 1.00 . A B . 49 ILE H 1 1 1 708 1 1 49 ILE HA H -9.607 0.098 -0.454 1.00 . A B . 49 ILE HA 1 1 1 709 1 1 49 ILE HB H -8.320 1.067 -2.362 1.00 . A B . 49 ILE HB 1 1 1 710 1 1 49 ILE HD11 H -6.090 1.816 -3.337 1.00 . A B . 49 ILE HD11 1 1 1 711 1 1 49 ILE HD12 H -4.617 1.560 -2.400 1.00 . A B . 49 ILE HD12 1 1 1 712 1 1 49 ILE HD13 H -5.794 2.768 -1.882 1.00 . A B . 49 ILE HD13 1 1 1 713 1 1 49 ILE HG12 H -5.933 0.755 -0.530 1.00 . A B . 49 ILE HG12 1 1 1 714 1 1 49 ILE HG13 H -6.214 -0.212 -1.973 1.00 . A B . 49 ILE HG13 1 1 1 715 1 1 49 ILE HG21 H -7.813 2.220 0.375 1.00 . A B . 49 ILE HG21 1 1 1 716 1 1 49 ILE HG22 H -9.222 2.498 -0.645 1.00 . A B . 49 ILE HG22 1 1 1 717 1 1 49 ILE HG23 H -7.642 3.101 -1.140 1.00 . A B . 49 ILE HG23 1 1 1 718 1 1 49 ILE N N -7.970 -0.490 0.640 1.00 . A B . 49 ILE N 1 1 1 719 1 1 49 ILE O O -9.465 -1.542 -2.406 1.00 . A B . 49 ILE O 1 1 1 720 1 1 50 PHE C C -8.605 -4.534 -1.744 1.00 . A B . 50 PHE C 1 1 1 721 1 1 50 PHE CA C -7.561 -3.517 -2.185 1.00 . A B . 50 PHE CA 1 1 1 722 1 1 50 PHE CB C -6.160 -4.132 -2.181 1.00 . A B . 50 PHE CB 1 1 1 723 1 1 50 PHE CD1 C -5.753 -5.021 -4.494 1.00 . A B . 50 PHE CD1 1 1 1 724 1 1 50 PHE CD2 C -4.636 -3.018 -3.839 1.00 . A B . 50 PHE CD2 1 1 1 725 1 1 50 PHE CE1 C -5.158 -4.948 -5.738 1.00 . A B . 50 PHE CE1 1 1 1 726 1 1 50 PHE CE2 C -4.039 -2.943 -5.081 1.00 . A B . 50 PHE CE2 1 1 1 727 1 1 50 PHE CG C -5.499 -4.056 -3.529 1.00 . A B . 50 PHE CG 1 1 1 728 1 1 50 PHE CZ C -4.300 -3.909 -6.031 1.00 . A B . 50 PHE CZ 1 1 1 729 1 1 50 PHE H H -6.980 -2.175 -0.645 1.00 . A B . 50 PHE H 1 1 1 730 1 1 50 PHE HA H -7.800 -3.218 -3.199 1.00 . A B . 50 PHE HA 1 1 1 731 1 1 50 PHE HB2 H -5.536 -3.605 -1.471 1.00 . A B . 50 PHE HB2 1 1 1 732 1 1 50 PHE HB3 H -6.227 -5.173 -1.897 1.00 . A B . 50 PHE HB3 1 1 1 733 1 1 50 PHE HD1 H -6.423 -5.836 -4.269 1.00 . A B . 50 PHE HD1 1 1 1 734 1 1 50 PHE HD2 H -4.427 -2.259 -3.098 1.00 . A B . 50 PHE HD2 1 1 1 735 1 1 50 PHE HE1 H -5.364 -5.706 -6.481 1.00 . A B . 50 PHE HE1 1 1 1 736 1 1 50 PHE HE2 H -3.370 -2.127 -5.310 1.00 . A B . 50 PHE HE2 1 1 1 737 1 1 50 PHE HZ H -3.832 -3.850 -7.003 1.00 . A B . 50 PHE HZ 1 1 1 738 1 1 50 PHE N N -7.633 -2.312 -1.363 1.00 . A B . 50 PHE N 1 1 1 739 1 1 50 PHE O O -9.111 -5.310 -2.552 1.00 . A B . 50 PHE O 1 1 1 740 1 1 51 CYS C C -11.352 -4.774 -0.427 1.00 . A B . 51 CYS C 1 1 1 741 1 1 51 CYS CA C -10.024 -5.365 0.032 1.00 . A B . 51 CYS CA 1 1 1 742 1 1 51 CYS CB C -9.998 -5.497 1.558 1.00 . A B . 51 CYS CB 1 1 1 743 1 1 51 CYS H H -8.423 -3.975 0.171 1.00 . A B . 51 CYS H 1 1 1 744 1 1 51 CYS HA H -9.915 -6.346 -0.410 1.00 . A B . 51 CYS HA 1 1 1 745 1 1 51 CYS HB2 H -9.720 -4.550 1.992 1.00 . A B . 51 CYS HB2 1 1 1 746 1 1 51 CYS HB3 H -10.986 -5.767 1.905 1.00 . A B . 51 CYS HB3 1 1 1 747 1 1 51 CYS N N -8.924 -4.540 -0.455 1.00 . A B . 51 CYS N 1 1 1 748 1 1 51 CYS O O -12.235 -5.497 -0.885 1.00 . A B . 51 CYS O 1 1 1 749 1 1 51 CYS SG S -8.841 -6.743 2.174 1.00 . A B . 51 CYS SG 1 1 1 750 1 1 52 ARG C C -12.789 -2.810 -2.307 1.00 . A B . 52 ARG C 1 1 1 751 1 1 52 ARG CA C -12.656 -2.733 -0.782 1.00 . A B . 52 ARG CA 1 1 1 752 1 1 52 ARG CB C -12.571 -1.269 -0.339 1.00 . A B . 52 ARG CB 1 1 1 753 1 1 52 ARG CD C -14.840 -0.971 0.741 1.00 . A B . 52 ARG CD 1 1 1 754 1 1 52 ARG CG C -13.894 -0.511 -0.365 1.00 . A B . 52 ARG CG 1 1 1 755 1 1 52 ARG CZ C -15.113 -3.378 1.244 1.00 . A B . 52 ARG CZ 1 1 1 756 1 1 52 ARG H H -10.774 -2.943 0.145 1.00 . A B . 52 ARG H 1 1 1 757 1 1 52 ARG HA H -13.522 -3.192 -0.331 1.00 . A B . 52 ARG HA 1 1 1 758 1 1 52 ARG HB2 H -12.187 -1.236 0.669 1.00 . A B . 52 ARG HB2 1 1 1 759 1 1 52 ARG HB3 H -11.879 -0.754 -0.988 1.00 . A B . 52 ARG HB3 1 1 1 760 1 1 52 ARG HD2 H -14.303 -0.977 1.677 1.00 . A B . 52 ARG HD2 1 1 1 761 1 1 52 ARG HD3 H -15.658 -0.268 0.808 1.00 . A B . 52 ARG HD3 1 1 1 762 1 1 52 ARG HE H -16.009 -2.405 -0.270 1.00 . A B . 52 ARG HE 1 1 1 763 1 1 52 ARG HG2 H -13.693 0.542 -0.237 1.00 . A B . 52 ARG HG2 1 1 1 764 1 1 52 ARG HG3 H -14.369 -0.673 -1.323 1.00 . A B . 52 ARG HG3 1 1 1 765 1 1 52 ARG HH11 H -13.851 -2.411 2.506 1.00 . A B . 52 ARG HH11 1 1 1 766 1 1 52 ARG HH12 H -14.071 -4.100 2.831 1.00 . A B . 52 ARG HH12 1 1 1 767 1 1 52 ARG HH21 H -16.299 -4.617 0.155 1.00 . A B . 52 ARG HH21 1 1 1 768 1 1 52 ARG HH22 H -15.479 -5.356 1.503 1.00 . A B . 52 ARG HH22 1 1 1 769 1 1 52 ARG N N -11.474 -3.451 -0.316 1.00 . A B . 52 ARG N 1 1 1 770 1 1 52 ARG NE N -15.384 -2.306 0.499 1.00 . A B . 52 ARG NE 1 1 1 771 1 1 52 ARG NH1 N -14.280 -3.288 2.277 1.00 . A B . 52 ARG NH1 1 1 1 772 1 1 52 ARG NH2 N -15.672 -4.543 0.945 1.00 . A B . 52 ARG NH2 1 1 1 773 1 1 52 ARG O O -13.849 -2.526 -2.866 1.00 . A B . 52 ARG O 1 1 1 774 1 1 53 MET C C -12.481 -4.556 -4.839 1.00 . A B . 53 MET C 1 1 1 775 1 1 53 MET CA C -11.686 -3.327 -4.419 1.00 . A B . 53 MET CA 1 1 1 776 1 1 53 MET CB C -10.234 -3.410 -4.919 1.00 . A B . 53 MET CB 1 1 1 777 1 1 53 MET CE C -8.972 -6.142 -6.080 1.00 . A B . 53 MET CE 1 1 1 778 1 1 53 MET CG C -10.082 -3.607 -6.422 1.00 . A B . 53 MET CG 1 1 1 779 1 1 53 MET H H -10.899 -3.410 -2.455 1.00 . A B . 53 MET H 1 1 1 780 1 1 53 MET HA H -12.155 -2.450 -4.838 1.00 . A B . 53 MET HA 1 1 1 781 1 1 53 MET HB2 H -9.726 -2.494 -4.655 1.00 . A B . 53 MET HB2 1 1 1 782 1 1 53 MET HB3 H -9.746 -4.232 -4.420 1.00 . A B . 53 MET HB3 1 1 1 783 1 1 53 MET HE1 H -8.949 -7.186 -6.355 1.00 . A B . 53 MET HE1 1 1 1 784 1 1 53 MET HE2 H -9.130 -6.055 -5.016 1.00 . A B . 53 MET HE2 1 1 1 785 1 1 53 MET HE3 H -8.033 -5.680 -6.343 1.00 . A B . 53 MET HE3 1 1 1 786 1 1 53 MET HG2 H -10.815 -2.996 -6.924 1.00 . A B . 53 MET HG2 1 1 1 787 1 1 53 MET HG3 H -9.092 -3.285 -6.709 1.00 . A B . 53 MET HG3 1 1 1 788 1 1 53 MET N N -11.706 -3.195 -2.965 1.00 . A B . 53 MET N 1 1 1 789 1 1 53 MET O O -13.140 -4.568 -5.882 1.00 . A B . 53 MET O 1 1 1 790 1 1 53 MET SD S -10.306 -5.322 -6.953 1.00 . A B . 53 MET SD 1 1 1 791 1 1 54 LYS C C -14.567 -6.727 -3.705 1.00 . A B . 54 LYS C 1 1 1 792 1 1 54 LYS CA C -13.151 -6.817 -4.268 1.00 . A B . 54 LYS CA 1 1 1 793 1 1 54 LYS CB C -12.389 -7.998 -3.647 1.00 . A B . 54 LYS CB 1 1 1 794 1 1 54 LYS CD C -12.129 -10.484 -3.392 1.00 . A B . 54 LYS CD 1 1 1 795 1 1 54 LYS CE C -12.599 -11.851 -3.862 1.00 . A B . 54 LYS CE 1 1 1 796 1 1 54 LYS CG C -12.899 -9.366 -4.076 1.00 . A B . 54 LYS CG 1 1 1 797 1 1 54 LYS H H -11.970 -5.479 -3.149 1.00 . A B . 54 LYS H 1 1 1 798 1 1 54 LYS HA H -13.204 -6.944 -5.339 1.00 . A B . 54 LYS HA 1 1 1 799 1 1 54 LYS HB2 H -11.347 -7.924 -3.926 1.00 . A B . 54 LYS HB2 1 1 1 800 1 1 54 LYS HB3 H -12.466 -7.929 -2.571 1.00 . A B . 54 LYS HB3 1 1 1 801 1 1 54 LYS HD2 H -11.078 -10.377 -3.620 1.00 . A B . 54 LYS HD2 1 1 1 802 1 1 54 LYS HD3 H -12.278 -10.410 -2.325 1.00 . A B . 54 LYS HD3 1 1 1 803 1 1 54 LYS HE2 H -13.637 -11.973 -3.592 1.00 . A B . 54 LYS HE2 1 1 1 804 1 1 54 LYS HE3 H -12.501 -11.902 -4.936 1.00 . A B . 54 LYS HE3 1 1 1 805 1 1 54 LYS HG2 H -13.945 -9.450 -3.815 1.00 . A B . 54 LYS HG2 1 1 1 806 1 1 54 LYS HG3 H -12.784 -9.464 -5.146 1.00 . A B . 54 LYS HG3 1 1 1 807 1 1 54 LYS HZ1 H -12.191 -13.874 -3.557 1.00 . A B . 54 LYS HZ1 1 1 1 808 1 1 54 LYS HZ2 H -11.859 -12.902 -2.217 1.00 . A B . 54 LYS HZ2 1 1 1 809 1 1 54 LYS HZ3 H -10.814 -12.892 -3.549 1.00 . A B . 54 LYS HZ3 1 1 1 810 1 1 54 LYS N N -12.450 -5.575 -3.996 1.00 . A B . 54 LYS N 1 1 1 811 1 1 54 LYS NZ N -11.810 -12.955 -3.254 1.00 . A B . 54 LYS NZ 1 1 1 812 1 1 54 LYS O O -14.968 -7.505 -2.839 1.00 . A B . 54 LYS O 1 1 1 813 1 1 55 GLU C C -17.642 -6.469 -4.333 1.00 . A B . 55 GLU C 1 1 1 814 1 1 55 GLU CA C -16.655 -5.496 -3.703 1.00 . A B . 55 GLU CA 1 1 1 815 1 1 55 GLU CB C -17.068 -4.058 -4.006 1.00 . A B . 55 GLU CB 1 1 1 816 1 1 55 GLU CD C -17.707 -3.360 -1.677 1.00 . A B . 55 GLU CD 1 1 1 817 1 1 55 GLU CG C -18.177 -3.545 -3.104 1.00 . A B . 55 GLU CG 1 1 1 818 1 1 55 GLU H H -14.946 -5.178 -4.905 1.00 . A B . 55 GLU H 1 1 1 819 1 1 55 GLU HA H -16.648 -5.642 -2.634 1.00 . A B . 55 GLU HA 1 1 1 820 1 1 55 GLU HB2 H -16.208 -3.417 -3.882 1.00 . A B . 55 GLU HB2 1 1 1 821 1 1 55 GLU HB3 H -17.407 -4.000 -5.029 1.00 . A B . 55 GLU HB3 1 1 1 822 1 1 55 GLU HG2 H -18.521 -2.594 -3.482 1.00 . A B . 55 GLU HG2 1 1 1 823 1 1 55 GLU HG3 H -18.992 -4.253 -3.113 1.00 . A B . 55 GLU HG3 1 1 1 824 1 1 55 GLU N N -15.313 -5.748 -4.196 1.00 . A B . 55 GLU N 1 1 1 825 1 1 55 GLU O O -18.641 -6.844 -3.720 1.00 . A B . 55 GLU O 1 1 1 826 1 1 55 GLU OE1 O -17.734 -4.336 -0.895 1.00 . A B . 55 GLU OE1 1 1 1 827 1 1 55 GLU OE2 O -17.292 -2.236 -1.329 1.00 . A B . 55 GLU OE2 1 1 1 828 1 1 56 SER C C -17.459 -9.148 -6.437 1.00 . A B . 56 SER C 1 1 1 829 1 1 56 SER CA C -18.195 -7.824 -6.263 1.00 . A B . 56 SER CA 1 1 1 830 1 1 56 SER CB C -18.610 -7.244 -7.620 1.00 . A B . 56 SER CB 1 1 1 831 1 1 56 SER H H -16.530 -6.561 -5.988 1.00 . A B . 56 SER H 1 1 1 832 1 1 56 SER HA H -19.079 -7.992 -5.664 1.00 . A B . 56 SER HA 1 1 1 833 1 1 56 SER HB2 H -19.028 -6.259 -7.475 1.00 . A B . 56 SER HB2 1 1 1 834 1 1 56 SER HB3 H -17.743 -7.175 -8.259 1.00 . A B . 56 SER HB3 1 1 1 835 1 1 56 SER HG H -19.926 -7.592 -9.031 1.00 . A B . 56 SER HG 1 1 1 836 1 1 56 SER N N -17.348 -6.886 -5.555 1.00 . A B . 56 SER N 1 1 1 837 1 1 56 SER O O -17.743 -10.092 -5.669 1.00 . A B . 56 SER O 1 1 1 838 1 1 56 SER OXT O -16.578 -9.232 -7.323 1.00 . A B . 56 SER OXT 1 1 1 839 1 1 56 SER OG O -19.582 -8.057 -8.258 1.00 . A B . 56 SER OG 1 1 1 840 2 2 1 ZN ZN ZN -6.683 -5.955 2.096 1.00 . B B . 101 ZN ZN 1 1 1 841 3 2 1 ZN ZN ZN 5.756 1.172 0.059 1.00 . C B . 102 ZN ZN 1 1 2 842 1 1 1 GLY C C 13.810 -8.186 -4.070 1.00 . A B . 1 GLY C 1 1 2 843 1 1 1 GLY CA C 12.882 -6.994 -3.973 1.00 . A B . 1 GLY CA 1 1 2 844 1 1 1 GLY H1 H 13.449 -6.083 -5.760 1.00 . A B . 1 GLY H1 1 1 2 845 1 1 1 GLY H2 H 14.336 -5.569 -4.417 1.00 . A B . 1 GLY H2 1 1 2 846 1 1 1 GLY H3 H 12.752 -5.025 -4.641 1.00 . A B . 1 GLY H3 1 1 2 847 1 1 1 GLY HA2 H 12.785 -6.708 -2.936 1.00 . A B . 1 GLY HA2 1 1 2 848 1 1 1 GLY HA3 H 11.910 -7.274 -4.351 1.00 . A B . 1 GLY HA3 1 1 2 849 1 1 1 GLY N N 13.389 -5.836 -4.750 1.00 . A B . 1 GLY N 1 1 2 850 1 1 1 GLY O O 15.001 -8.019 -4.329 1.00 . A B . 1 GLY O 1 1 2 851 1 1 2 ALA C C 15.288 -10.570 -3.062 1.00 . A B . 2 ALA C 1 1 2 852 1 1 2 ALA CA C 14.031 -10.631 -3.931 1.00 . A B . 2 ALA CA 1 1 2 853 1 1 2 ALA CB C 14.393 -10.946 -5.380 1.00 . A B . 2 ALA CB 1 1 2 854 1 1 2 ALA H H 12.301 -9.437 -3.656 1.00 . A B . 2 ALA H 1 1 2 855 1 1 2 ALA HA H 13.400 -11.428 -3.567 1.00 . A B . 2 ALA HA 1 1 2 856 1 1 2 ALA HB1 H 15.049 -10.178 -5.763 1.00 . A B . 2 ALA HB1 1 1 2 857 1 1 2 ALA HB2 H 13.494 -10.981 -5.978 1.00 . A B . 2 ALA HB2 1 1 2 858 1 1 2 ALA HB3 H 14.894 -11.902 -5.428 1.00 . A B . 2 ALA HB3 1 1 2 859 1 1 2 ALA N N 13.261 -9.385 -3.857 1.00 . A B . 2 ALA N 1 1 2 860 1 1 2 ALA O O 16.373 -10.964 -3.493 1.00 . A B . 2 ALA O 1 1 2 861 1 1 3 MET C C 15.721 -9.575 0.471 1.00 . A B . 3 MET C 1 1 2 862 1 1 3 MET CA C 16.250 -9.929 -0.917 1.00 . A B . 3 MET CA 1 1 2 863 1 1 3 MET CB C 17.217 -8.847 -1.419 1.00 . A B . 3 MET CB 1 1 2 864 1 1 3 MET CE C 20.878 -7.446 0.012 1.00 . A B . 3 MET CE 1 1 2 865 1 1 3 MET CG C 18.483 -8.705 -0.588 1.00 . A B . 3 MET CG 1 1 2 866 1 1 3 MET H H 14.235 -9.804 -1.547 1.00 . A B . 3 MET H 1 1 2 867 1 1 3 MET HA H 16.769 -10.875 -0.866 1.00 . A B . 3 MET HA 1 1 2 868 1 1 3 MET HB2 H 17.505 -9.087 -2.432 1.00 . A B . 3 MET HB2 1 1 2 869 1 1 3 MET HB3 H 16.704 -7.897 -1.419 1.00 . A B . 3 MET HB3 1 1 2 870 1 1 3 MET HE1 H 21.352 -8.413 -0.034 1.00 . A B . 3 MET HE1 1 1 2 871 1 1 3 MET HE2 H 20.478 -7.287 1.002 1.00 . A B . 3 MET HE2 1 1 2 872 1 1 3 MET HE3 H 21.603 -6.678 -0.210 1.00 . A B . 3 MET HE3 1 1 2 873 1 1 3 MET HG2 H 18.208 -8.494 0.434 1.00 . A B . 3 MET HG2 1 1 2 874 1 1 3 MET HG3 H 19.033 -9.635 -0.628 1.00 . A B . 3 MET HG3 1 1 2 875 1 1 3 MET N N 15.132 -10.076 -1.840 1.00 . A B . 3 MET N 1 1 2 876 1 1 3 MET O O 15.762 -8.417 0.892 1.00 . A B . 3 MET O 1 1 2 877 1 1 3 MET SD S 19.547 -7.378 -1.186 1.00 . A B . 3 MET SD 1 1 2 878 1 1 4 GLY C C 13.108 -10.225 2.391 1.00 . A B . 4 GLY C 1 1 2 879 1 1 4 GLY CA C 14.616 -10.342 2.473 1.00 . A B . 4 GLY CA 1 1 2 880 1 1 4 GLY H H 15.213 -11.482 0.795 1.00 . A B . 4 GLY H 1 1 2 881 1 1 4 GLY HA2 H 14.873 -11.161 3.129 1.00 . A B . 4 GLY HA2 1 1 2 882 1 1 4 GLY HA3 H 15.017 -9.425 2.880 1.00 . A B . 4 GLY HA3 1 1 2 883 1 1 4 GLY N N 15.203 -10.575 1.170 1.00 . A B . 4 GLY N 1 1 2 884 1 1 4 GLY O O 12.526 -10.399 1.319 1.00 . A B . 4 GLY O 1 1 2 885 1 1 5 MET C C 10.622 -8.334 3.273 1.00 . A B . 5 MET C 1 1 2 886 1 1 5 MET CA C 11.022 -9.776 3.555 1.00 . A B . 5 MET CA 1 1 2 887 1 1 5 MET CB C 10.464 -10.222 4.912 1.00 . A B . 5 MET CB 1 1 2 888 1 1 5 MET CE C 7.910 -12.033 4.291 1.00 . A B . 5 MET CE 1 1 2 889 1 1 5 MET CG C 10.534 -11.726 5.144 1.00 . A B . 5 MET CG 1 1 2 890 1 1 5 MET H H 12.994 -9.767 4.328 1.00 . A B . 5 MET H 1 1 2 891 1 1 5 MET HA H 10.608 -10.405 2.780 1.00 . A B . 5 MET HA 1 1 2 892 1 1 5 MET HB2 H 11.023 -9.732 5.696 1.00 . A B . 5 MET HB2 1 1 2 893 1 1 5 MET HB3 H 9.430 -9.918 4.979 1.00 . A B . 5 MET HB3 1 1 2 894 1 1 5 MET HE1 H 7.668 -12.197 5.330 1.00 . A B . 5 MET HE1 1 1 2 895 1 1 5 MET HE2 H 7.193 -12.546 3.669 1.00 . A B . 5 MET HE2 1 1 2 896 1 1 5 MET HE3 H 7.881 -10.974 4.077 1.00 . A B . 5 MET HE3 1 1 2 897 1 1 5 MET HG2 H 11.563 -12.043 5.067 1.00 . A B . 5 MET HG2 1 1 2 898 1 1 5 MET HG3 H 10.168 -11.940 6.139 1.00 . A B . 5 MET HG3 1 1 2 899 1 1 5 MET N N 12.473 -9.919 3.511 1.00 . A B . 5 MET N 1 1 2 900 1 1 5 MET O O 10.005 -7.670 4.104 1.00 . A B . 5 MET O 1 1 2 901 1 1 5 MET SD S 9.553 -12.665 3.953 1.00 . A B . 5 MET SD 1 1 2 902 1 1 6 ARG C C 10.462 -6.391 0.205 1.00 . A B . 6 ARG C 1 1 2 903 1 1 6 ARG CA C 10.712 -6.487 1.702 1.00 . A B . 6 ARG CA 1 1 2 904 1 1 6 ARG CB C 11.882 -5.581 2.096 1.00 . A B . 6 ARG CB 1 1 2 905 1 1 6 ARG CD C 14.366 -5.175 2.009 1.00 . A B . 6 ARG CD 1 1 2 906 1 1 6 ARG CG C 13.240 -6.158 1.738 1.00 . A B . 6 ARG CG 1 1 2 907 1 1 6 ARG CZ C 16.765 -5.148 1.418 1.00 . A B . 6 ARG CZ 1 1 2 908 1 1 6 ARG H H 11.426 -8.456 1.456 1.00 . A B . 6 ARG H 1 1 2 909 1 1 6 ARG HA H 9.827 -6.163 2.226 1.00 . A B . 6 ARG HA 1 1 2 910 1 1 6 ARG HB2 H 11.773 -4.631 1.593 1.00 . A B . 6 ARG HB2 1 1 2 911 1 1 6 ARG HB3 H 11.852 -5.419 3.162 1.00 . A B . 6 ARG HB3 1 1 2 912 1 1 6 ARG HD2 H 14.273 -4.340 1.330 1.00 . A B . 6 ARG HD2 1 1 2 913 1 1 6 ARG HD3 H 14.285 -4.824 3.027 1.00 . A B . 6 ARG HD3 1 1 2 914 1 1 6 ARG HE H 15.749 -6.758 2.032 1.00 . A B . 6 ARG HE 1 1 2 915 1 1 6 ARG HG2 H 13.406 -7.047 2.326 1.00 . A B . 6 ARG HG2 1 1 2 916 1 1 6 ARG HG3 H 13.242 -6.414 0.690 1.00 . A B . 6 ARG HG3 1 1 2 917 1 1 6 ARG HH11 H 15.824 -3.381 1.111 1.00 . A B . 6 ARG HH11 1 1 2 918 1 1 6 ARG HH12 H 17.523 -3.386 0.774 1.00 . A B . 6 ARG HH12 1 1 2 919 1 1 6 ARG HH21 H 17.981 -6.759 1.579 1.00 . A B . 6 ARG HH21 1 1 2 920 1 1 6 ARG HH22 H 18.742 -5.303 1.020 1.00 . A B . 6 ARG HH22 1 1 2 921 1 1 6 ARG N N 10.978 -7.860 2.092 1.00 . A B . 6 ARG N 1 1 2 922 1 1 6 ARG NE N 15.676 -5.798 1.822 1.00 . A B . 6 ARG NE 1 1 2 923 1 1 6 ARG NH1 N 16.698 -3.871 1.074 1.00 . A B . 6 ARG NH1 1 1 2 924 1 1 6 ARG NH2 N 17.921 -5.787 1.334 1.00 . A B . 6 ARG NH2 1 1 2 925 1 1 6 ARG O O 11.171 -6.999 -0.597 1.00 . A B . 6 ARG O 1 1 2 926 1 1 7 ASN C C 9.049 -3.887 -1.796 1.00 . A B . 7 ASN C 1 1 2 927 1 1 7 ASN CA C 9.121 -5.392 -1.560 1.00 . A B . 7 ASN CA 1 1 2 928 1 1 7 ASN CB C 7.792 -6.063 -1.929 1.00 . A B . 7 ASN CB 1 1 2 929 1 1 7 ASN CG C 7.515 -6.048 -3.425 1.00 . A B . 7 ASN CG 1 1 2 930 1 1 7 ASN H H 8.875 -5.234 0.535 1.00 . A B . 7 ASN H 1 1 2 931 1 1 7 ASN HA H 9.915 -5.807 -2.162 1.00 . A B . 7 ASN HA 1 1 2 932 1 1 7 ASN HB2 H 7.814 -7.091 -1.601 1.00 . A B . 7 ASN HB2 1 1 2 933 1 1 7 ASN HB3 H 6.987 -5.547 -1.429 1.00 . A B . 7 ASN HB3 1 1 2 934 1 1 7 ASN HD21 H 9.442 -6.306 -3.824 1.00 . A B . 7 ASN HD21 1 1 2 935 1 1 7 ASN HD22 H 8.409 -6.159 -5.198 1.00 . A B . 7 ASN HD22 1 1 2 936 1 1 7 ASN N N 9.439 -5.637 -0.159 1.00 . A B . 7 ASN N 1 1 2 937 1 1 7 ASN ND2 N 8.560 -6.193 -4.228 1.00 . A B . 7 ASN ND2 1 1 2 938 1 1 7 ASN O O 8.521 -3.409 -2.799 1.00 . A B . 7 ASN O 1 1 2 939 1 1 7 ASN OD1 O 6.367 -5.927 -3.852 1.00 . A B . 7 ASN OD1 1 1 2 940 1 1 8 LEU C C 10.765 -1.054 -1.492 1.00 . A B . 8 LEU C 1 1 2 941 1 1 8 LEU CA C 9.530 -1.694 -0.873 1.00 . A B . 8 LEU CA 1 1 2 942 1 1 8 LEU CB C 9.300 -1.165 0.552 1.00 . A B . 8 LEU CB 1 1 2 943 1 1 8 LEU CD1 C 11.536 -0.826 1.673 1.00 . A B . 8 LEU CD1 1 1 2 944 1 1 8 LEU CD2 C 9.589 -1.699 2.981 1.00 . A B . 8 LEU CD2 1 1 2 945 1 1 8 LEU CG C 10.272 -1.675 1.623 1.00 . A B . 8 LEU CG 1 1 2 946 1 1 8 LEU H H 10.117 -3.590 -0.147 1.00 . A B . 8 LEU H 1 1 2 947 1 1 8 LEU HA H 8.677 -1.433 -1.477 1.00 . A B . 8 LEU HA 1 1 2 948 1 1 8 LEU HB2 H 9.368 -0.088 0.522 1.00 . A B . 8 LEU HB2 1 1 2 949 1 1 8 LEU HB3 H 8.298 -1.435 0.852 1.00 . A B . 8 LEU HB3 1 1 2 950 1 1 8 LEU HD11 H 12.219 -1.240 2.400 1.00 . A B . 8 LEU HD11 1 1 2 951 1 1 8 LEU HD12 H 11.279 0.185 1.954 1.00 . A B . 8 LEU HD12 1 1 2 952 1 1 8 LEU HD13 H 12.006 -0.821 0.700 1.00 . A B . 8 LEU HD13 1 1 2 953 1 1 8 LEU HD21 H 8.737 -2.361 2.944 1.00 . A B . 8 LEU HD21 1 1 2 954 1 1 8 LEU HD22 H 9.258 -0.702 3.235 1.00 . A B . 8 LEU HD22 1 1 2 955 1 1 8 LEU HD23 H 10.286 -2.048 3.728 1.00 . A B . 8 LEU HD23 1 1 2 956 1 1 8 LEU HG H 10.563 -2.686 1.381 1.00 . A B . 8 LEU HG 1 1 2 957 1 1 8 LEU N N 9.618 -3.147 -0.861 1.00 . A B . 8 LEU N 1 1 2 958 1 1 8 LEU O O 10.944 0.160 -1.424 1.00 . A B . 8 LEU O 1 1 2 959 1 1 9 ASP C C 12.522 -0.575 -3.978 1.00 . A B . 9 ASP C 1 1 2 960 1 1 9 ASP CA C 12.833 -1.372 -2.721 1.00 . A B . 9 ASP CA 1 1 2 961 1 1 9 ASP CB C 13.779 -2.531 -3.042 1.00 . A B . 9 ASP CB 1 1 2 962 1 1 9 ASP CG C 14.234 -3.260 -1.798 1.00 . A B . 9 ASP CG 1 1 2 963 1 1 9 ASP H H 11.402 -2.826 -2.154 1.00 . A B . 9 ASP H 1 1 2 964 1 1 9 ASP HA H 13.311 -0.718 -2.009 1.00 . A B . 9 ASP HA 1 1 2 965 1 1 9 ASP HB2 H 13.269 -3.236 -3.682 1.00 . A B . 9 ASP HB2 1 1 2 966 1 1 9 ASP HB3 H 14.648 -2.147 -3.554 1.00 . A B . 9 ASP HB3 1 1 2 967 1 1 9 ASP N N 11.604 -1.868 -2.110 1.00 . A B . 9 ASP N 1 1 2 968 1 1 9 ASP O O 13.217 0.382 -4.312 1.00 . A B . 9 ASP O 1 1 2 969 1 1 9 ASP OD1 O 13.552 -4.224 -1.388 1.00 . A B . 9 ASP OD1 1 1 2 970 1 1 9 ASP OD2 O 15.270 -2.869 -1.220 1.00 . A B . 9 ASP OD2 1 1 2 971 1 1 10 GLU C C 10.009 0.843 -5.443 1.00 . A B . 10 GLU C 1 1 2 972 1 1 10 GLU CA C 10.996 -0.244 -5.843 1.00 . A B . 10 GLU CA 1 1 2 973 1 1 10 GLU CB C 10.329 -1.197 -6.836 1.00 . A B . 10 GLU CB 1 1 2 974 1 1 10 GLU CD C 10.582 -3.117 -8.439 1.00 . A B . 10 GLU CD 1 1 2 975 1 1 10 GLU CG C 11.250 -2.279 -7.370 1.00 . A B . 10 GLU CG 1 1 2 976 1 1 10 GLU H H 10.977 -1.769 -4.370 1.00 . A B . 10 GLU H 1 1 2 977 1 1 10 GLU HA H 11.853 0.214 -6.311 1.00 . A B . 10 GLU HA 1 1 2 978 1 1 10 GLU HB2 H 9.491 -1.677 -6.349 1.00 . A B . 10 GLU HB2 1 1 2 979 1 1 10 GLU HB3 H 9.963 -0.623 -7.673 1.00 . A B . 10 GLU HB3 1 1 2 980 1 1 10 GLU HG2 H 12.128 -1.815 -7.791 1.00 . A B . 10 GLU HG2 1 1 2 981 1 1 10 GLU HG3 H 11.538 -2.925 -6.555 1.00 . A B . 10 GLU HG3 1 1 2 982 1 1 10 GLU N N 11.458 -0.967 -4.663 1.00 . A B . 10 GLU N 1 1 2 983 1 1 10 GLU O O 9.475 1.566 -6.287 1.00 . A B . 10 GLU O 1 1 2 984 1 1 10 GLU OE1 O 10.581 -2.702 -9.615 1.00 . A B . 10 GLU OE1 1 1 2 985 1 1 10 GLU OE2 O 10.072 -4.206 -8.115 1.00 . A B . 10 GLU OE2 1 1 2 986 1 1 11 CYS C C 9.495 3.078 -2.992 1.00 . A B . 11 CYS C 1 1 2 987 1 1 11 CYS CA C 8.793 1.879 -3.626 1.00 . A B . 11 CYS CA 1 1 2 988 1 1 11 CYS CB C 7.928 1.152 -2.595 1.00 . A B . 11 CYS CB 1 1 2 989 1 1 11 CYS H H 10.271 0.383 -3.526 1.00 . A B . 11 CYS H 1 1 2 990 1 1 11 CYS HA H 8.173 2.215 -4.441 1.00 . A B . 11 CYS HA 1 1 2 991 1 1 11 CYS HB2 H 7.506 0.274 -3.053 1.00 . A B . 11 CYS HB2 1 1 2 992 1 1 11 CYS HB3 H 8.557 0.849 -1.770 1.00 . A B . 11 CYS HB3 1 1 2 993 1 1 11 CYS N N 9.765 0.943 -4.149 1.00 . A B . 11 CYS N 1 1 2 994 1 1 11 CYS O O 9.804 3.071 -1.797 1.00 . A B . 11 CYS O 1 1 2 995 1 1 11 CYS SG S 6.566 2.118 -1.916 1.00 . A B . 11 CYS SG 1 1 2 996 1 1 12 GLU C C 9.378 6.058 -2.353 1.00 . A B . 12 GLU C 1 1 2 997 1 1 12 GLU CA C 10.337 5.337 -3.278 1.00 . A B . 12 GLU CA 1 1 2 998 1 1 12 GLU CB C 10.764 6.276 -4.406 1.00 . A B . 12 GLU CB 1 1 2 999 1 1 12 GLU CD C 12.516 6.836 -6.127 1.00 . A B . 12 GLU CD 1 1 2 1000 1 1 12 GLU CG C 11.923 5.759 -5.246 1.00 . A B . 12 GLU CG 1 1 2 1001 1 1 12 GLU H H 9.523 4.044 -4.743 1.00 . A B . 12 GLU H 1 1 2 1002 1 1 12 GLU HA H 11.210 5.060 -2.710 1.00 . A B . 12 GLU HA 1 1 2 1003 1 1 12 GLU HB2 H 9.919 6.439 -5.056 1.00 . A B . 12 GLU HB2 1 1 2 1004 1 1 12 GLU HB3 H 11.058 7.220 -3.974 1.00 . A B . 12 GLU HB3 1 1 2 1005 1 1 12 GLU HG2 H 12.695 5.391 -4.588 1.00 . A B . 12 GLU HG2 1 1 2 1006 1 1 12 GLU HG3 H 11.571 4.954 -5.874 1.00 . A B . 12 GLU HG3 1 1 2 1007 1 1 12 GLU N N 9.739 4.111 -3.790 1.00 . A B . 12 GLU N 1 1 2 1008 1 1 12 GLU O O 9.797 6.728 -1.410 1.00 . A B . 12 GLU O 1 1 2 1009 1 1 12 GLU OE1 O 11.884 7.199 -7.139 1.00 . A B . 12 GLU OE1 1 1 2 1010 1 1 12 GLU OE2 O 13.618 7.331 -5.812 1.00 . A B . 12 GLU OE2 1 1 2 1011 1 1 13 VAL C C 7.109 6.187 -0.379 1.00 . A B . 13 VAL C 1 1 2 1012 1 1 13 VAL CA C 7.071 6.602 -1.852 1.00 . A B . 13 VAL CA 1 1 2 1013 1 1 13 VAL CB C 5.658 6.403 -2.455 1.00 . A B . 13 VAL CB 1 1 2 1014 1 1 13 VAL CG1 C 5.237 4.950 -2.430 1.00 . A B . 13 VAL CG1 1 1 2 1015 1 1 13 VAL CG2 C 4.632 7.257 -1.734 1.00 . A B . 13 VAL CG2 1 1 2 1016 1 1 13 VAL H H 7.812 5.307 -3.345 1.00 . A B . 13 VAL H 1 1 2 1017 1 1 13 VAL HA H 7.307 7.653 -1.908 1.00 . A B . 13 VAL HA 1 1 2 1018 1 1 13 VAL HB H 5.689 6.717 -3.486 1.00 . A B . 13 VAL HB 1 1 2 1019 1 1 13 VAL HG11 H 5.963 4.353 -2.962 1.00 . A B . 13 VAL HG11 1 1 2 1020 1 1 13 VAL HG12 H 4.274 4.850 -2.906 1.00 . A B . 13 VAL HG12 1 1 2 1021 1 1 13 VAL HG13 H 5.171 4.612 -1.407 1.00 . A B . 13 VAL HG13 1 1 2 1022 1 1 13 VAL HG21 H 4.590 6.960 -0.699 1.00 . A B . 13 VAL HG21 1 1 2 1023 1 1 13 VAL HG22 H 3.661 7.115 -2.189 1.00 . A B . 13 VAL HG22 1 1 2 1024 1 1 13 VAL HG23 H 4.915 8.296 -1.801 1.00 . A B . 13 VAL HG23 1 1 2 1025 1 1 13 VAL N N 8.087 5.903 -2.614 1.00 . A B . 13 VAL N 1 1 2 1026 1 1 13 VAL O O 6.801 6.985 0.500 1.00 . A B . 13 VAL O 1 1 2 1027 1 1 14 CYS C C 8.824 5.317 1.940 1.00 . A B . 14 CYS C 1 1 2 1028 1 1 14 CYS CA C 7.719 4.510 1.275 1.00 . A B . 14 CYS CA 1 1 2 1029 1 1 14 CYS CB C 8.064 3.024 1.338 1.00 . A B . 14 CYS CB 1 1 2 1030 1 1 14 CYS H H 7.700 4.328 -0.844 1.00 . A B . 14 CYS H 1 1 2 1031 1 1 14 CYS HA H 6.797 4.679 1.808 1.00 . A B . 14 CYS HA 1 1 2 1032 1 1 14 CYS HB2 H 8.401 2.700 0.365 1.00 . A B . 14 CYS HB2 1 1 2 1033 1 1 14 CYS HB3 H 8.857 2.877 2.055 1.00 . A B . 14 CYS HB3 1 1 2 1034 1 1 14 CYS N N 7.526 4.952 -0.105 1.00 . A B . 14 CYS N 1 1 2 1035 1 1 14 CYS O O 8.715 5.713 3.099 1.00 . A B . 14 CYS O 1 1 2 1036 1 1 14 CYS SG S 6.681 1.968 1.819 1.00 . A B . 14 CYS SG 1 1 2 1037 1 1 15 ARG C C 10.635 7.798 1.850 1.00 . A B . 15 ARG C 1 1 2 1038 1 1 15 ARG CA C 11.015 6.337 1.673 1.00 . A B . 15 ARG CA 1 1 2 1039 1 1 15 ARG CB C 12.182 6.209 0.701 1.00 . A B . 15 ARG CB 1 1 2 1040 1 1 15 ARG CD C 13.611 4.656 -0.665 1.00 . A B . 15 ARG CD 1 1 2 1041 1 1 15 ARG CG C 12.622 4.772 0.480 1.00 . A B . 15 ARG CG 1 1 2 1042 1 1 15 ARG CZ C 15.935 5.297 -1.191 1.00 . A B . 15 ARG CZ 1 1 2 1043 1 1 15 ARG H H 9.865 5.267 0.248 1.00 . A B . 15 ARG H 1 1 2 1044 1 1 15 ARG HA H 11.298 5.930 2.627 1.00 . A B . 15 ARG HA 1 1 2 1045 1 1 15 ARG HB2 H 11.888 6.625 -0.253 1.00 . A B . 15 ARG HB2 1 1 2 1046 1 1 15 ARG HB3 H 13.021 6.767 1.085 1.00 . A B . 15 ARG HB3 1 1 2 1047 1 1 15 ARG HD2 H 13.817 3.612 -0.841 1.00 . A B . 15 ARG HD2 1 1 2 1048 1 1 15 ARG HD3 H 13.164 5.086 -1.550 1.00 . A B . 15 ARG HD3 1 1 2 1049 1 1 15 ARG HE H 14.927 5.873 0.443 1.00 . A B . 15 ARG HE 1 1 2 1050 1 1 15 ARG HG2 H 13.091 4.409 1.382 1.00 . A B . 15 ARG HG2 1 1 2 1051 1 1 15 ARG HG3 H 11.752 4.171 0.259 1.00 . A B . 15 ARG HG3 1 1 2 1052 1 1 15 ARG HH11 H 15.051 4.098 -2.568 1.00 . A B . 15 ARG HH11 1 1 2 1053 1 1 15 ARG HH12 H 16.687 4.552 -2.919 1.00 . A B . 15 ARG HH12 1 1 2 1054 1 1 15 ARG HH21 H 17.092 6.485 -0.021 1.00 . A B . 15 ARG HH21 1 1 2 1055 1 1 15 ARG HH22 H 17.846 5.915 -1.479 1.00 . A B . 15 ARG HH22 1 1 2 1056 1 1 15 ARG N N 9.872 5.580 1.179 1.00 . A B . 15 ARG N 1 1 2 1057 1 1 15 ARG NE N 14.872 5.347 -0.388 1.00 . A B . 15 ARG NE 1 1 2 1058 1 1 15 ARG NH1 N 15.887 4.593 -2.316 1.00 . A B . 15 ARG NH1 1 1 2 1059 1 1 15 ARG NH2 N 17.045 5.949 -0.871 1.00 . A B . 15 ARG NH2 1 1 2 1060 1 1 15 ARG O O 11.137 8.489 2.737 1.00 . A B . 15 ARG O 1 1 2 1061 1 1 16 ASP C C 8.271 9.765 2.257 1.00 . A B . 16 ASP C 1 1 2 1062 1 1 16 ASP CA C 9.200 9.604 1.050 1.00 . A B . 16 ASP CA 1 1 2 1063 1 1 16 ASP CB C 8.456 9.911 -0.254 1.00 . A B . 16 ASP CB 1 1 2 1064 1 1 16 ASP CG C 7.941 11.334 -0.338 1.00 . A B . 16 ASP CG 1 1 2 1065 1 1 16 ASP H H 9.484 7.670 0.236 1.00 . A B . 16 ASP H 1 1 2 1066 1 1 16 ASP HA H 10.029 10.289 1.155 1.00 . A B . 16 ASP HA 1 1 2 1067 1 1 16 ASP HB2 H 9.123 9.744 -1.084 1.00 . A B . 16 ASP HB2 1 1 2 1068 1 1 16 ASP HB3 H 7.615 9.239 -0.340 1.00 . A B . 16 ASP HB3 1 1 2 1069 1 1 16 ASP N N 9.743 8.252 0.985 1.00 . A B . 16 ASP N 1 1 2 1070 1 1 16 ASP O O 7.920 10.878 2.642 1.00 . A B . 16 ASP O 1 1 2 1071 1 1 16 ASP OD1 O 8.762 12.263 -0.475 1.00 . A B . 16 ASP OD1 1 1 2 1072 1 1 16 ASP OD2 O 6.708 11.530 -0.279 1.00 . A B . 16 ASP OD2 1 1 2 1073 1 1 17 GLY C C 5.586 8.410 3.720 1.00 . A B . 17 GLY C 1 1 2 1074 1 1 17 GLY CA C 7.042 8.685 4.041 1.00 . A B . 17 GLY CA 1 1 2 1075 1 1 17 GLY H H 8.222 7.784 2.527 1.00 . A B . 17 GLY H 1 1 2 1076 1 1 17 GLY HA2 H 7.388 7.944 4.749 1.00 . A B . 17 GLY HA2 1 1 2 1077 1 1 17 GLY HA3 H 7.120 9.664 4.494 1.00 . A B . 17 GLY HA3 1 1 2 1078 1 1 17 GLY N N 7.898 8.645 2.867 1.00 . A B . 17 GLY N 1 1 2 1079 1 1 17 GLY O O 4.699 8.707 4.522 1.00 . A B . 17 GLY O 1 1 2 1080 1 1 18 GLY C C 3.330 6.472 2.958 1.00 . A B . 18 GLY C 1 1 2 1081 1 1 18 GLY CA C 3.990 7.545 2.122 1.00 . A B . 18 GLY CA 1 1 2 1082 1 1 18 GLY H H 6.098 7.634 1.952 1.00 . A B . 18 GLY H 1 1 2 1083 1 1 18 GLY HA2 H 3.400 8.446 2.186 1.00 . A B . 18 GLY HA2 1 1 2 1084 1 1 18 GLY HA3 H 4.013 7.217 1.097 1.00 . A B . 18 GLY HA3 1 1 2 1085 1 1 18 GLY N N 5.343 7.844 2.546 1.00 . A B . 18 GLY N 1 1 2 1086 1 1 18 GLY O O 3.983 5.531 3.411 1.00 . A B . 18 GLY O 1 1 2 1087 1 1 19 GLU C C 0.721 4.541 3.085 1.00 . A B . 19 GLU C 1 1 2 1088 1 1 19 GLU CA C 1.254 5.681 3.941 1.00 . A B . 19 GLU CA 1 1 2 1089 1 1 19 GLU CB C 0.095 6.404 4.632 1.00 . A B . 19 GLU CB 1 1 2 1090 1 1 19 GLU CD C 1.108 6.332 6.946 1.00 . A B . 19 GLU CD 1 1 2 1091 1 1 19 GLU CG C 0.522 7.204 5.855 1.00 . A B . 19 GLU CG 1 1 2 1092 1 1 19 GLU H H 1.583 7.383 2.736 1.00 . A B . 19 GLU H 1 1 2 1093 1 1 19 GLU HA H 1.905 5.268 4.696 1.00 . A B . 19 GLU HA 1 1 2 1094 1 1 19 GLU HB2 H -0.358 7.085 3.924 1.00 . A B . 19 GLU HB2 1 1 2 1095 1 1 19 GLU HB3 H -0.642 5.675 4.937 1.00 . A B . 19 GLU HB3 1 1 2 1096 1 1 19 GLU HG2 H 1.268 7.924 5.555 1.00 . A B . 19 GLU HG2 1 1 2 1097 1 1 19 GLU HG3 H -0.339 7.724 6.253 1.00 . A B . 19 GLU HG3 1 1 2 1098 1 1 19 GLU N N 2.032 6.619 3.147 1.00 . A B . 19 GLU N 1 1 2 1099 1 1 19 GLU O O 0.696 4.626 1.855 1.00 . A B . 19 GLU O 1 1 2 1100 1 1 19 GLU OE1 O 0.331 5.741 7.727 1.00 . A B . 19 GLU OE1 1 1 2 1101 1 1 19 GLU OE2 O 2.350 6.229 7.030 1.00 . A B . 19 GLU OE2 1 1 2 1102 1 1 20 LEU C C -1.758 2.276 3.263 1.00 . A B . 20 LEU C 1 1 2 1103 1 1 20 LEU CA C -0.252 2.313 3.097 1.00 . A B . 20 LEU CA 1 1 2 1104 1 1 20 LEU CB C 0.354 1.040 3.683 1.00 . A B . 20 LEU CB 1 1 2 1105 1 1 20 LEU CD1 C 2.392 -0.370 4.010 1.00 . A B . 20 LEU CD1 1 1 2 1106 1 1 20 LEU CD2 C 1.509 0.019 1.715 1.00 . A B . 20 LEU CD2 1 1 2 1107 1 1 20 LEU CG C 1.701 0.626 3.096 1.00 . A B . 20 LEU CG 1 1 2 1108 1 1 20 LEU H H 0.351 3.493 4.733 1.00 . A B . 20 LEU H 1 1 2 1109 1 1 20 LEU HA H -0.009 2.371 2.048 1.00 . A B . 20 LEU HA 1 1 2 1110 1 1 20 LEU HB2 H 0.477 1.184 4.746 1.00 . A B . 20 LEU HB2 1 1 2 1111 1 1 20 LEU HB3 H -0.345 0.233 3.525 1.00 . A B . 20 LEU HB3 1 1 2 1112 1 1 20 LEU HD11 H 1.770 -1.246 4.118 1.00 . A B . 20 LEU HD11 1 1 2 1113 1 1 20 LEU HD12 H 2.556 0.080 4.977 1.00 . A B . 20 LEU HD12 1 1 2 1114 1 1 20 LEU HD13 H 3.341 -0.653 3.578 1.00 . A B . 20 LEU HD13 1 1 2 1115 1 1 20 LEU HD21 H 2.465 -0.313 1.333 1.00 . A B . 20 LEU HD21 1 1 2 1116 1 1 20 LEU HD22 H 1.094 0.758 1.046 1.00 . A B . 20 LEU HD22 1 1 2 1117 1 1 20 LEU HD23 H 0.840 -0.824 1.779 1.00 . A B . 20 LEU HD23 1 1 2 1118 1 1 20 LEU HG H 2.335 1.498 3.001 1.00 . A B . 20 LEU HG 1 1 2 1119 1 1 20 LEU N N 0.302 3.482 3.755 1.00 . A B . 20 LEU N 1 1 2 1120 1 1 20 LEU O O -2.274 2.461 4.365 1.00 . A B . 20 LEU O 1 1 2 1121 1 1 21 PHE C C -4.320 0.501 1.915 1.00 . A B . 21 PHE C 1 1 2 1122 1 1 21 PHE CA C -3.906 1.937 2.205 1.00 . A B . 21 PHE CA 1 1 2 1123 1 1 21 PHE CB C -4.522 2.924 1.203 1.00 . A B . 21 PHE CB 1 1 2 1124 1 1 21 PHE CD1 C -4.920 5.055 2.478 1.00 . A B . 21 PHE CD1 1 1 2 1125 1 1 21 PHE CD2 C -3.100 4.986 0.936 1.00 . A B . 21 PHE CD2 1 1 2 1126 1 1 21 PHE CE1 C -4.590 6.354 2.811 1.00 . A B . 21 PHE CE1 1 1 2 1127 1 1 21 PHE CE2 C -2.770 6.287 1.264 1.00 . A B . 21 PHE CE2 1 1 2 1128 1 1 21 PHE CG C -4.181 4.353 1.537 1.00 . A B . 21 PHE CG 1 1 2 1129 1 1 21 PHE CZ C -3.513 6.969 2.204 1.00 . A B . 21 PHE CZ 1 1 2 1130 1 1 21 PHE H H -1.995 1.918 1.312 1.00 . A B . 21 PHE H 1 1 2 1131 1 1 21 PHE HA H -4.229 2.199 3.204 1.00 . A B . 21 PHE HA 1 1 2 1132 1 1 21 PHE HB2 H -4.148 2.706 0.212 1.00 . A B . 21 PHE HB2 1 1 2 1133 1 1 21 PHE HB3 H -5.599 2.821 1.212 1.00 . A B . 21 PHE HB3 1 1 2 1134 1 1 21 PHE HD1 H -5.765 4.578 2.956 1.00 . A B . 21 PHE HD1 1 1 2 1135 1 1 21 PHE HD2 H -2.515 4.457 0.197 1.00 . A B . 21 PHE HD2 1 1 2 1136 1 1 21 PHE HE1 H -5.175 6.888 3.545 1.00 . A B . 21 PHE HE1 1 1 2 1137 1 1 21 PHE HE2 H -1.926 6.766 0.791 1.00 . A B . 21 PHE HE2 1 1 2 1138 1 1 21 PHE HZ H -3.252 7.983 2.465 1.00 . A B . 21 PHE HZ 1 1 2 1139 1 1 21 PHE N N -2.460 2.036 2.170 1.00 . A B . 21 PHE N 1 1 2 1140 1 1 21 PHE O O -5.218 0.230 1.118 1.00 . A B . 21 PHE O 1 1 2 1141 1 1 22 CYS C C -3.671 -2.576 3.730 1.00 . A B . 22 CYS C 1 1 2 1142 1 1 22 CYS CA C -3.870 -1.839 2.410 1.00 . A B . 22 CYS CA 1 1 2 1143 1 1 22 CYS CB C -2.938 -2.428 1.348 1.00 . A B . 22 CYS CB 1 1 2 1144 1 1 22 CYS H H -2.850 -0.129 3.104 1.00 . A B . 22 CYS H 1 1 2 1145 1 1 22 CYS HA H -4.891 -1.960 2.086 1.00 . A B . 22 CYS HA 1 1 2 1146 1 1 22 CYS HB2 H -2.019 -1.858 1.334 1.00 . A B . 22 CYS HB2 1 1 2 1147 1 1 22 CYS HB3 H -2.712 -3.454 1.601 1.00 . A B . 22 CYS HB3 1 1 2 1148 1 1 22 CYS N N -3.608 -0.418 2.552 1.00 . A B . 22 CYS N 1 1 2 1149 1 1 22 CYS O O -3.037 -2.061 4.651 1.00 . A B . 22 CYS O 1 1 2 1150 1 1 22 CYS SG S -3.620 -2.408 -0.337 1.00 . A B . 22 CYS SG 1 1 2 1151 1 1 23 CYS C C -2.567 -5.213 4.861 1.00 . A B . 23 CYS C 1 1 2 1152 1 1 23 CYS CA C -3.990 -4.671 4.946 1.00 . A B . 23 CYS CA 1 1 2 1153 1 1 23 CYS CB C -4.975 -5.844 4.924 1.00 . A B . 23 CYS CB 1 1 2 1154 1 1 23 CYS H H -4.788 -4.091 3.077 1.00 . A B . 23 CYS H 1 1 2 1155 1 1 23 CYS HA H -4.110 -4.103 5.858 1.00 . A B . 23 CYS HA 1 1 2 1156 1 1 23 CYS HB2 H -4.663 -6.552 4.170 1.00 . A B . 23 CYS HB2 1 1 2 1157 1 1 23 CYS HB3 H -4.968 -6.328 5.891 1.00 . A B . 23 CYS HB3 1 1 2 1158 1 1 23 CYS N N -4.224 -3.786 3.808 1.00 . A B . 23 CYS N 1 1 2 1159 1 1 23 CYS O O -1.946 -5.096 3.807 1.00 . A B . 23 CYS O 1 1 2 1160 1 1 23 CYS SG S -6.678 -5.380 4.555 1.00 . A B . 23 CYS SG 1 1 2 1161 1 1 24 ASP C C -0.517 -7.337 4.762 1.00 . A B . 24 ASP C 1 1 2 1162 1 1 24 ASP CA C -0.696 -6.354 5.915 1.00 . A B . 24 ASP CA 1 1 2 1163 1 1 24 ASP CB C -0.352 -7.043 7.237 1.00 . A B . 24 ASP CB 1 1 2 1164 1 1 24 ASP CG C 1.050 -7.620 7.227 1.00 . A B . 24 ASP CG 1 1 2 1165 1 1 24 ASP H H -2.594 -5.880 6.754 1.00 . A B . 24 ASP H 1 1 2 1166 1 1 24 ASP HA H -0.016 -5.528 5.768 1.00 . A B . 24 ASP HA 1 1 2 1167 1 1 24 ASP HB2 H -0.420 -6.324 8.041 1.00 . A B . 24 ASP HB2 1 1 2 1168 1 1 24 ASP HB3 H -1.051 -7.845 7.415 1.00 . A B . 24 ASP HB3 1 1 2 1169 1 1 24 ASP N N -2.057 -5.809 5.932 1.00 . A B . 24 ASP N 1 1 2 1170 1 1 24 ASP O O 0.451 -7.246 4.000 1.00 . A B . 24 ASP O 1 1 2 1171 1 1 24 ASP OD1 O 2.021 -6.839 7.325 1.00 . A B . 24 ASP OD1 1 1 2 1172 1 1 24 ASP OD2 O 1.189 -8.857 7.124 1.00 . A B . 24 ASP OD2 1 1 2 1173 1 1 25 THR C C -1.530 -8.560 2.182 1.00 . A B . 25 THR C 1 1 2 1174 1 1 25 THR CA C -1.425 -9.237 3.550 1.00 . A B . 25 THR CA 1 1 2 1175 1 1 25 THR CB C -2.558 -10.264 3.700 1.00 . A B . 25 THR CB 1 1 2 1176 1 1 25 THR CG2 C -2.360 -11.442 2.753 1.00 . A B . 25 THR CG2 1 1 2 1177 1 1 25 THR H H -2.218 -8.272 5.253 1.00 . A B . 25 THR H 1 1 2 1178 1 1 25 THR HA H -0.482 -9.757 3.615 1.00 . A B . 25 THR HA 1 1 2 1179 1 1 25 THR HB H -3.491 -9.782 3.461 1.00 . A B . 25 THR HB 1 1 2 1180 1 1 25 THR HG1 H -1.713 -10.980 5.336 1.00 . A B . 25 THR HG1 1 1 2 1181 1 1 25 THR HG21 H -3.171 -12.145 2.878 1.00 . A B . 25 THR HG21 1 1 2 1182 1 1 25 THR HG22 H -1.422 -11.930 2.978 1.00 . A B . 25 THR HG22 1 1 2 1183 1 1 25 THR HG23 H -2.346 -11.086 1.735 1.00 . A B . 25 THR HG23 1 1 2 1184 1 1 25 THR N N -1.469 -8.253 4.617 1.00 . A B . 25 THR N 1 1 2 1185 1 1 25 THR O O -0.753 -8.850 1.277 1.00 . A B . 25 THR O 1 1 2 1186 1 1 25 THR OG1 O -2.605 -10.738 5.053 1.00 . A B . 25 THR OG1 1 1 2 1187 1 1 26 CYS C C -1.463 -6.105 0.413 1.00 . A B . 26 CYS C 1 1 2 1188 1 1 26 CYS CA C -2.695 -6.934 0.786 1.00 . A B . 26 CYS CA 1 1 2 1189 1 1 26 CYS CB C -3.945 -6.046 0.885 1.00 . A B . 26 CYS CB 1 1 2 1190 1 1 26 CYS H H -3.062 -7.438 2.811 1.00 . A B . 26 CYS H 1 1 2 1191 1 1 26 CYS HA H -2.854 -7.680 0.019 1.00 . A B . 26 CYS HA 1 1 2 1192 1 1 26 CYS HB2 H -3.787 -5.295 1.640 1.00 . A B . 26 CYS HB2 1 1 2 1193 1 1 26 CYS HB3 H -4.119 -5.568 -0.069 1.00 . A B . 26 CYS HB3 1 1 2 1194 1 1 26 CYS N N -2.484 -7.641 2.047 1.00 . A B . 26 CYS N 1 1 2 1195 1 1 26 CYS O O -1.040 -6.087 -0.741 1.00 . A B . 26 CYS O 1 1 2 1196 1 1 26 CYS SG S -5.440 -6.961 1.329 1.00 . A B . 26 CYS SG 1 1 2 1197 1 1 27 SER C C 1.518 -5.535 0.864 1.00 . A B . 27 SER C 1 1 2 1198 1 1 27 SER CA C 0.325 -4.649 1.212 1.00 . A B . 27 SER CA 1 1 2 1199 1 1 27 SER CB C 0.627 -3.842 2.474 1.00 . A B . 27 SER CB 1 1 2 1200 1 1 27 SER H H -1.287 -5.490 2.301 1.00 . A B . 27 SER H 1 1 2 1201 1 1 27 SER HA H 0.144 -3.969 0.394 1.00 . A B . 27 SER HA 1 1 2 1202 1 1 27 SER HB2 H -0.188 -3.162 2.667 1.00 . A B . 27 SER HB2 1 1 2 1203 1 1 27 SER HB3 H 0.735 -4.518 3.310 1.00 . A B . 27 SER HB3 1 1 2 1204 1 1 27 SER HG H 2.152 -2.859 3.212 1.00 . A B . 27 SER HG 1 1 2 1205 1 1 27 SER N N -0.880 -5.447 1.407 1.00 . A B . 27 SER N 1 1 2 1206 1 1 27 SER O O 2.468 -5.097 0.223 1.00 . A B . 27 SER O 1 1 2 1207 1 1 27 SER OG O 1.822 -3.094 2.336 1.00 . A B . 27 SER OG 1 1 2 1208 1 1 28 ARG C C 2.457 -8.213 -0.422 1.00 . A B . 28 ARG C 1 1 2 1209 1 1 28 ARG CA C 2.537 -7.724 1.020 1.00 . A B . 28 ARG CA 1 1 2 1210 1 1 28 ARG CB C 2.454 -8.896 2.001 1.00 . A B . 28 ARG CB 1 1 2 1211 1 1 28 ARG CD C 3.333 -11.103 2.784 1.00 . A B . 28 ARG CD 1 1 2 1212 1 1 28 ARG CG C 3.465 -10.000 1.749 1.00 . A B . 28 ARG CG 1 1 2 1213 1 1 28 ARG CZ C 4.446 -13.228 3.345 1.00 . A B . 28 ARG CZ 1 1 2 1214 1 1 28 ARG H H 0.696 -7.080 1.823 1.00 . A B . 28 ARG H 1 1 2 1215 1 1 28 ARG HA H 3.475 -7.210 1.161 1.00 . A B . 28 ARG HA 1 1 2 1216 1 1 28 ARG HB2 H 2.609 -8.520 3.001 1.00 . A B . 28 ARG HB2 1 1 2 1217 1 1 28 ARG HB3 H 1.466 -9.325 1.941 1.00 . A B . 28 ARG HB3 1 1 2 1218 1 1 28 ARG HD2 H 3.643 -10.715 3.743 1.00 . A B . 28 ARG HD2 1 1 2 1219 1 1 28 ARG HD3 H 2.297 -11.404 2.839 1.00 . A B . 28 ARG HD3 1 1 2 1220 1 1 28 ARG HE H 4.479 -12.359 1.539 1.00 . A B . 28 ARG HE 1 1 2 1221 1 1 28 ARG HG2 H 3.292 -10.415 0.768 1.00 . A B . 28 ARG HG2 1 1 2 1222 1 1 28 ARG HG3 H 4.461 -9.585 1.799 1.00 . A B . 28 ARG HG3 1 1 2 1223 1 1 28 ARG HH11 H 3.532 -12.314 4.909 1.00 . A B . 28 ARG HH11 1 1 2 1224 1 1 28 ARG HH12 H 4.276 -13.838 5.274 1.00 . A B . 28 ARG HH12 1 1 2 1225 1 1 28 ARG HH21 H 5.451 -14.369 2.007 1.00 . A B . 28 ARG HH21 1 1 2 1226 1 1 28 ARG HH22 H 5.366 -15.015 3.616 1.00 . A B . 28 ARG HH22 1 1 2 1227 1 1 28 ARG N N 1.468 -6.783 1.297 1.00 . A B . 28 ARG N 1 1 2 1228 1 1 28 ARG NE N 4.151 -12.272 2.466 1.00 . A B . 28 ARG NE 1 1 2 1229 1 1 28 ARG NH1 N 4.054 -13.118 4.610 1.00 . A B . 28 ARG NH1 1 1 2 1230 1 1 28 ARG NH2 N 5.145 -14.287 2.960 1.00 . A B . 28 ARG NH2 1 1 2 1231 1 1 28 ARG O O 3.468 -8.565 -1.027 1.00 . A B . 28 ARG O 1 1 2 1232 1 1 29 VAL C C 1.094 -7.549 -3.351 1.00 . A B . 29 VAL C 1 1 2 1233 1 1 29 VAL CA C 1.048 -8.692 -2.337 1.00 . A B . 29 VAL CA 1 1 2 1234 1 1 29 VAL CB C -0.290 -9.451 -2.479 1.00 . A B . 29 VAL CB 1 1 2 1235 1 1 29 VAL CG1 C -0.435 -10.042 -3.873 1.00 . A B . 29 VAL CG1 1 1 2 1236 1 1 29 VAL CG2 C -0.403 -10.547 -1.432 1.00 . A B . 29 VAL CG2 1 1 2 1237 1 1 29 VAL H H 0.486 -7.879 -0.465 1.00 . A B . 29 VAL H 1 1 2 1238 1 1 29 VAL HA H 1.847 -9.381 -2.561 1.00 . A B . 29 VAL HA 1 1 2 1239 1 1 29 VAL HB H -1.097 -8.750 -2.320 1.00 . A B . 29 VAL HB 1 1 2 1240 1 1 29 VAL HG11 H -0.384 -9.252 -4.607 1.00 . A B . 29 VAL HG11 1 1 2 1241 1 1 29 VAL HG12 H -1.386 -10.547 -3.952 1.00 . A B . 29 VAL HG12 1 1 2 1242 1 1 29 VAL HG13 H 0.362 -10.748 -4.049 1.00 . A B . 29 VAL HG13 1 1 2 1243 1 1 29 VAL HG21 H -0.415 -10.107 -0.448 1.00 . A B . 29 VAL HG21 1 1 2 1244 1 1 29 VAL HG22 H 0.443 -11.212 -1.520 1.00 . A B . 29 VAL HG22 1 1 2 1245 1 1 29 VAL HG23 H -1.316 -11.102 -1.590 1.00 . A B . 29 VAL HG23 1 1 2 1246 1 1 29 VAL N N 1.253 -8.209 -0.979 1.00 . A B . 29 VAL N 1 1 2 1247 1 1 29 VAL O O 1.816 -7.625 -4.347 1.00 . A B . 29 VAL O 1 1 2 1248 1 1 30 PHE C C 0.833 -4.106 -3.482 1.00 . A B . 30 PHE C 1 1 2 1249 1 1 30 PHE CA C 0.214 -5.382 -4.038 1.00 . A B . 30 PHE CA 1 1 2 1250 1 1 30 PHE CB C -1.264 -5.109 -4.356 1.00 . A B . 30 PHE CB 1 1 2 1251 1 1 30 PHE CD1 C -1.878 -6.977 -5.933 1.00 . A B . 30 PHE CD1 1 1 2 1252 1 1 30 PHE CD2 C -3.034 -6.811 -3.851 1.00 . A B . 30 PHE CD2 1 1 2 1253 1 1 30 PHE CE1 C -2.631 -8.088 -6.263 1.00 . A B . 30 PHE CE1 1 1 2 1254 1 1 30 PHE CE2 C -3.787 -7.921 -4.178 1.00 . A B . 30 PHE CE2 1 1 2 1255 1 1 30 PHE CG C -2.069 -6.326 -4.722 1.00 . A B . 30 PHE CG 1 1 2 1256 1 1 30 PHE CZ C -3.585 -8.560 -5.384 1.00 . A B . 30 PHE CZ 1 1 2 1257 1 1 30 PHE H H -0.107 -6.417 -2.212 1.00 . A B . 30 PHE H 1 1 2 1258 1 1 30 PHE HA H 0.730 -5.659 -4.945 1.00 . A B . 30 PHE HA 1 1 2 1259 1 1 30 PHE HB2 H -1.728 -4.661 -3.489 1.00 . A B . 30 PHE HB2 1 1 2 1260 1 1 30 PHE HB3 H -1.320 -4.411 -5.183 1.00 . A B . 30 PHE HB3 1 1 2 1261 1 1 30 PHE HD1 H -1.132 -6.611 -6.623 1.00 . A B . 30 PHE HD1 1 1 2 1262 1 1 30 PHE HD2 H -3.197 -6.311 -2.908 1.00 . A B . 30 PHE HD2 1 1 2 1263 1 1 30 PHE HE1 H -2.473 -8.584 -7.209 1.00 . A B . 30 PHE HE1 1 1 2 1264 1 1 30 PHE HE2 H -4.532 -8.288 -3.490 1.00 . A B . 30 PHE HE2 1 1 2 1265 1 1 30 PHE HZ H -4.174 -9.427 -5.641 1.00 . A B . 30 PHE HZ 1 1 2 1266 1 1 30 PHE N N 0.349 -6.480 -3.083 1.00 . A B . 30 PHE N 1 1 2 1267 1 1 30 PHE O O 0.262 -3.031 -3.629 1.00 . A B . 30 PHE O 1 1 2 1268 1 1 31 HIS C C 2.663 -1.838 -3.008 1.00 . A B . 31 HIS C 1 1 2 1269 1 1 31 HIS CA C 2.642 -3.109 -2.165 1.00 . A B . 31 HIS CA 1 1 2 1270 1 1 31 HIS CB C 4.070 -3.489 -1.764 1.00 . A B . 31 HIS CB 1 1 2 1271 1 1 31 HIS CD2 C 5.832 -1.643 -1.259 1.00 . A B . 31 HIS CD2 1 1 2 1272 1 1 31 HIS CE1 C 5.368 -1.266 0.821 1.00 . A B . 31 HIS CE1 1 1 2 1273 1 1 31 HIS CG C 4.785 -2.451 -0.938 1.00 . A B . 31 HIS CG 1 1 2 1274 1 1 31 HIS H H 2.448 -5.104 -2.864 1.00 . A B . 31 HIS H 1 1 2 1275 1 1 31 HIS HA H 2.073 -2.914 -1.269 1.00 . A B . 31 HIS HA 1 1 2 1276 1 1 31 HIS HB2 H 4.038 -4.402 -1.188 1.00 . A B . 31 HIS HB2 1 1 2 1277 1 1 31 HIS HB3 H 4.649 -3.659 -2.661 1.00 . A B . 31 HIS HB3 1 1 2 1278 1 1 31 HIS HD1 H 3.777 -2.607 0.913 1.00 . A B . 31 HIS HD1 1 1 2 1279 1 1 31 HIS HD2 H 6.301 -1.570 -2.229 1.00 . A B . 31 HIS HD2 1 1 2 1280 1 1 31 HIS HE1 H 5.382 -0.868 1.826 1.00 . A B . 31 HIS HE1 1 1 2 1281 1 1 31 HIS N N 2.003 -4.230 -2.861 1.00 . A B . 31 HIS N 1 1 2 1282 1 1 31 HIS ND1 N 4.502 -2.197 0.385 1.00 . A B . 31 HIS ND1 1 1 2 1283 1 1 31 HIS NE2 N 6.199 -0.897 -0.140 1.00 . A B . 31 HIS NE2 1 1 2 1284 1 1 31 HIS O O 2.222 -0.790 -2.558 1.00 . A B . 31 HIS O 1 1 2 1285 1 1 32 GLU C C 1.995 -0.100 -5.415 1.00 . A B . 32 GLU C 1 1 2 1286 1 1 32 GLU CA C 3.318 -0.784 -5.095 1.00 . A B . 32 GLU CA 1 1 2 1287 1 1 32 GLU CB C 4.021 -1.185 -6.391 1.00 . A B . 32 GLU CB 1 1 2 1288 1 1 32 GLU CD C 6.054 -2.214 -7.473 1.00 . A B . 32 GLU CD 1 1 2 1289 1 1 32 GLU CG C 5.448 -1.674 -6.196 1.00 . A B . 32 GLU CG 1 1 2 1290 1 1 32 GLU H H 3.258 -2.848 -4.618 1.00 . A B . 32 GLU H 1 1 2 1291 1 1 32 GLU HA H 3.943 -0.090 -4.553 1.00 . A B . 32 GLU HA 1 1 2 1292 1 1 32 GLU HB2 H 3.454 -1.974 -6.860 1.00 . A B . 32 GLU HB2 1 1 2 1293 1 1 32 GLU HB3 H 4.042 -0.330 -7.051 1.00 . A B . 32 GLU HB3 1 1 2 1294 1 1 32 GLU HG2 H 6.055 -0.851 -5.850 1.00 . A B . 32 GLU HG2 1 1 2 1295 1 1 32 GLU HG3 H 5.449 -2.460 -5.455 1.00 . A B . 32 GLU HG3 1 1 2 1296 1 1 32 GLU N N 3.110 -1.954 -4.249 1.00 . A B . 32 GLU N 1 1 2 1297 1 1 32 GLU O O 1.898 1.127 -5.396 1.00 . A B . 32 GLU O 1 1 2 1298 1 1 32 GLU OE1 O 6.510 -1.413 -8.311 1.00 . A B . 32 GLU OE1 1 1 2 1299 1 1 32 GLU OE2 O 6.072 -3.451 -7.646 1.00 . A B . 32 GLU OE2 1 1 2 1300 1 1 33 ASP C C -1.075 0.099 -4.792 1.00 . A B . 33 ASP C 1 1 2 1301 1 1 33 ASP CA C -0.334 -0.371 -6.041 1.00 . A B . 33 ASP CA 1 1 2 1302 1 1 33 ASP CB C -1.154 -1.439 -6.766 1.00 . A B . 33 ASP CB 1 1 2 1303 1 1 33 ASP CG C -2.288 -0.851 -7.587 1.00 . A B . 33 ASP CG 1 1 2 1304 1 1 33 ASP H H 1.104 -1.871 -5.643 1.00 . A B . 33 ASP H 1 1 2 1305 1 1 33 ASP HA H -0.186 0.472 -6.700 1.00 . A B . 33 ASP HA 1 1 2 1306 1 1 33 ASP HB2 H -0.506 -1.993 -7.431 1.00 . A B . 33 ASP HB2 1 1 2 1307 1 1 33 ASP HB3 H -1.572 -2.116 -6.036 1.00 . A B . 33 ASP HB3 1 1 2 1308 1 1 33 ASP N N 0.976 -0.899 -5.684 1.00 . A B . 33 ASP N 1 1 2 1309 1 1 33 ASP O O -1.923 0.987 -4.855 1.00 . A B . 33 ASP O 1 1 2 1310 1 1 33 ASP OD1 O -3.367 -0.593 -7.009 1.00 . A B . 33 ASP OD1 1 1 2 1311 1 1 33 ASP OD2 O -2.115 -0.636 -8.804 1.00 . A B . 33 ASP OD2 1 1 2 1312 1 1 34 CYS C C -0.986 1.214 -1.859 1.00 . A B . 34 CYS C 1 1 2 1313 1 1 34 CYS CA C -1.365 -0.172 -2.377 1.00 . A B . 34 CYS CA 1 1 2 1314 1 1 34 CYS CB C -1.018 -1.240 -1.335 1.00 . A B . 34 CYS CB 1 1 2 1315 1 1 34 CYS H H 0.009 -1.149 -3.663 1.00 . A B . 34 CYS H 1 1 2 1316 1 1 34 CYS HA H -2.432 -0.193 -2.545 1.00 . A B . 34 CYS HA 1 1 2 1317 1 1 34 CYS HB2 H 0.025 -1.509 -1.437 1.00 . A B . 34 CYS HB2 1 1 2 1318 1 1 34 CYS HB3 H -1.186 -0.839 -0.346 1.00 . A B . 34 CYS HB3 1 1 2 1319 1 1 34 CYS N N -0.715 -0.482 -3.650 1.00 . A B . 34 CYS N 1 1 2 1320 1 1 34 CYS O O -1.531 1.686 -0.858 1.00 . A B . 34 CYS O 1 1 2 1321 1 1 34 CYS SG S -1.996 -2.770 -1.493 1.00 . A B . 34 CYS SG 1 1 2 1322 1 1 35 HIS C C -0.370 4.214 -3.116 1.00 . A B . 35 HIS C 1 1 2 1323 1 1 35 HIS CA C 0.333 3.225 -2.196 1.00 . A B . 35 HIS CA 1 1 2 1324 1 1 35 HIS CB C 1.844 3.418 -2.312 1.00 . A B . 35 HIS CB 1 1 2 1325 1 1 35 HIS CD2 C 3.094 1.472 -1.177 1.00 . A B . 35 HIS CD2 1 1 2 1326 1 1 35 HIS CE1 C 3.671 2.432 0.668 1.00 . A B . 35 HIS CE1 1 1 2 1327 1 1 35 HIS CG C 2.622 2.737 -1.234 1.00 . A B . 35 HIS CG 1 1 2 1328 1 1 35 HIS H H 0.420 1.396 -3.262 1.00 . A B . 35 HIS H 1 1 2 1329 1 1 35 HIS HA H 0.034 3.413 -1.175 1.00 . A B . 35 HIS HA 1 1 2 1330 1 1 35 HIS HB2 H 2.174 3.016 -3.260 1.00 . A B . 35 HIS HB2 1 1 2 1331 1 1 35 HIS HB3 H 2.070 4.475 -2.274 1.00 . A B . 35 HIS HB3 1 1 2 1332 1 1 35 HIS HD1 H 2.752 4.243 0.241 1.00 . A B . 35 HIS HD1 1 1 2 1333 1 1 35 HIS HD2 H 2.990 0.722 -1.950 1.00 . A B . 35 HIS HD2 1 1 2 1334 1 1 35 HIS HE1 H 4.098 2.624 1.641 1.00 . A B . 35 HIS HE1 1 1 2 1335 1 1 35 HIS N N -0.042 1.856 -2.530 1.00 . A B . 35 HIS N 1 1 2 1336 1 1 35 HIS ND1 N 2.989 3.335 -0.048 1.00 . A B . 35 HIS ND1 1 1 2 1337 1 1 35 HIS NE2 N 3.759 1.277 0.024 1.00 . A B . 35 HIS NE2 1 1 2 1338 1 1 35 HIS O O -0.379 5.416 -2.863 1.00 . A B . 35 HIS O 1 1 2 1339 1 1 36 ILE C C -3.049 4.432 -5.273 1.00 . A B . 36 ILE C 1 1 2 1340 1 1 36 ILE CA C -1.524 4.535 -5.228 1.00 . A B . 36 ILE CA 1 1 2 1341 1 1 36 ILE CB C -0.957 4.120 -6.606 1.00 . A B . 36 ILE CB 1 1 2 1342 1 1 36 ILE CD1 C 1.215 3.640 -7.859 1.00 . A B . 36 ILE CD1 1 1 2 1343 1 1 36 ILE CG1 C 0.575 4.165 -6.589 1.00 . A B . 36 ILE CG1 1 1 2 1344 1 1 36 ILE CG2 C -1.510 5.014 -7.709 1.00 . A B . 36 ILE CG2 1 1 2 1345 1 1 36 ILE H H -1.054 2.722 -4.253 1.00 . A B . 36 ILE H 1 1 2 1346 1 1 36 ILE HA H -1.237 5.551 -5.032 1.00 . A B . 36 ILE HA 1 1 2 1347 1 1 36 ILE HB H -1.275 3.108 -6.806 1.00 . A B . 36 ILE HB 1 1 2 1348 1 1 36 ILE HD11 H 0.884 4.231 -8.700 1.00 . A B . 36 ILE HD11 1 1 2 1349 1 1 36 ILE HD12 H 0.926 2.609 -8.008 1.00 . A B . 36 ILE HD12 1 1 2 1350 1 1 36 ILE HD13 H 2.290 3.705 -7.775 1.00 . A B . 36 ILE HD13 1 1 2 1351 1 1 36 ILE HG12 H 0.897 5.188 -6.456 1.00 . A B . 36 ILE HG12 1 1 2 1352 1 1 36 ILE HG13 H 0.935 3.570 -5.764 1.00 . A B . 36 ILE HG13 1 1 2 1353 1 1 36 ILE HG21 H -1.236 6.039 -7.513 1.00 . A B . 36 ILE HG21 1 1 2 1354 1 1 36 ILE HG22 H -2.587 4.929 -7.735 1.00 . A B . 36 ILE HG22 1 1 2 1355 1 1 36 ILE HG23 H -1.102 4.707 -8.660 1.00 . A B . 36 ILE HG23 1 1 2 1356 1 1 36 ILE N N -0.969 3.696 -4.178 1.00 . A B . 36 ILE N 1 1 2 1357 1 1 36 ILE O O -3.593 3.330 -5.312 1.00 . A B . 36 ILE O 1 1 2 1358 1 1 37 PRO C C -3.217 7.285 -3.562 1.00 . A B . 37 PRO C 1 1 2 1359 1 1 37 PRO CA C -3.205 6.896 -5.041 1.00 . A B . 37 PRO CA 1 1 2 1360 1 1 37 PRO CB C -4.168 7.779 -5.831 1.00 . A B . 37 PRO CB 1 1 2 1361 1 1 37 PRO CD C -5.229 5.634 -5.473 1.00 . A B . 37 PRO CD 1 1 2 1362 1 1 37 PRO CG C -5.498 7.109 -5.688 1.00 . A B . 37 PRO CG 1 1 2 1363 1 1 37 PRO HA H -2.208 6.985 -5.444 1.00 . A B . 37 PRO HA 1 1 2 1364 1 1 37 PRO HB2 H -4.175 8.777 -5.409 1.00 . A B . 37 PRO HB2 1 1 2 1365 1 1 37 PRO HB3 H -3.856 7.819 -6.868 1.00 . A B . 37 PRO HB3 1 1 2 1366 1 1 37 PRO HD2 H -5.767 5.273 -4.607 1.00 . A B . 37 PRO HD2 1 1 2 1367 1 1 37 PRO HD3 H -5.509 5.069 -6.352 1.00 . A B . 37 PRO HD3 1 1 2 1368 1 1 37 PRO HG2 H -6.022 7.522 -4.836 1.00 . A B . 37 PRO HG2 1 1 2 1369 1 1 37 PRO HG3 H -6.079 7.256 -6.589 1.00 . A B . 37 PRO HG3 1 1 2 1370 1 1 37 PRO N N -3.772 5.565 -5.251 1.00 . A B . 37 PRO N 1 1 2 1371 1 1 37 PRO O O -4.139 6.916 -2.829 1.00 . A B . 37 PRO O 1 1 2 1372 1 1 38 PRO C C -3.309 9.460 -1.439 1.00 . A B . 38 PRO C 1 1 2 1373 1 1 38 PRO CA C -2.170 8.481 -1.705 1.00 . A B . 38 PRO CA 1 1 2 1374 1 1 38 PRO CB C -0.814 9.188 -1.575 1.00 . A B . 38 PRO CB 1 1 2 1375 1 1 38 PRO CD C -0.983 8.388 -3.828 1.00 . A B . 38 PRO CD 1 1 2 1376 1 1 38 PRO CG C -0.001 8.694 -2.728 1.00 . A B . 38 PRO CG 1 1 2 1377 1 1 38 PRO HA H -2.224 7.660 -1.005 1.00 . A B . 38 PRO HA 1 1 2 1378 1 1 38 PRO HB2 H -0.960 10.259 -1.622 1.00 . A B . 38 PRO HB2 1 1 2 1379 1 1 38 PRO HB3 H -0.359 8.926 -0.630 1.00 . A B . 38 PRO HB3 1 1 2 1380 1 1 38 PRO HD2 H -1.163 9.266 -4.436 1.00 . A B . 38 PRO HD2 1 1 2 1381 1 1 38 PRO HD3 H -0.630 7.568 -4.439 1.00 . A B . 38 PRO HD3 1 1 2 1382 1 1 38 PRO HG2 H 0.696 9.457 -3.044 1.00 . A B . 38 PRO HG2 1 1 2 1383 1 1 38 PRO HG3 H 0.530 7.796 -2.440 1.00 . A B . 38 PRO HG3 1 1 2 1384 1 1 38 PRO N N -2.193 8.004 -3.086 1.00 . A B . 38 PRO N 1 1 2 1385 1 1 38 PRO O O -3.511 10.406 -2.203 1.00 . A B . 38 PRO O 1 1 2 1386 1 1 39 VAL C C -4.584 11.345 0.707 1.00 . A B . 39 VAL C 1 1 2 1387 1 1 39 VAL CA C -5.144 10.114 0.008 1.00 . A B . 39 VAL CA 1 1 2 1388 1 1 39 VAL CB C -6.171 9.420 0.928 1.00 . A B . 39 VAL CB 1 1 2 1389 1 1 39 VAL CG1 C -7.368 10.326 1.173 1.00 . A B . 39 VAL CG1 1 1 2 1390 1 1 39 VAL CG2 C -6.623 8.092 0.337 1.00 . A B . 39 VAL CG2 1 1 2 1391 1 1 39 VAL H H -3.867 8.440 0.185 1.00 . A B . 39 VAL H 1 1 2 1392 1 1 39 VAL HA H -5.647 10.423 -0.898 1.00 . A B . 39 VAL HA 1 1 2 1393 1 1 39 VAL HB H -5.696 9.225 1.876 1.00 . A B . 39 VAL HB 1 1 2 1394 1 1 39 VAL HG11 H -8.037 9.857 1.879 1.00 . A B . 39 VAL HG11 1 1 2 1395 1 1 39 VAL HG12 H -7.887 10.492 0.242 1.00 . A B . 39 VAL HG12 1 1 2 1396 1 1 39 VAL HG13 H -7.029 11.269 1.569 1.00 . A B . 39 VAL HG13 1 1 2 1397 1 1 39 VAL HG21 H -5.780 7.423 0.267 1.00 . A B . 39 VAL HG21 1 1 2 1398 1 1 39 VAL HG22 H -7.034 8.258 -0.647 1.00 . A B . 39 VAL HG22 1 1 2 1399 1 1 39 VAL HG23 H -7.380 7.655 0.973 1.00 . A B . 39 VAL HG23 1 1 2 1400 1 1 39 VAL N N -4.055 9.226 -0.366 1.00 . A B . 39 VAL N 1 1 2 1401 1 1 39 VAL O O -4.392 11.353 1.926 1.00 . A B . 39 VAL O 1 1 2 1402 1 1 40 GLU C C -4.666 14.483 1.132 1.00 . A B . 40 GLU C 1 1 2 1403 1 1 40 GLU CA C -3.665 13.574 0.432 1.00 . A B . 40 GLU CA 1 1 2 1404 1 1 40 GLU CB C -2.964 14.312 -0.706 1.00 . A B . 40 GLU CB 1 1 2 1405 1 1 40 GLU CD C -0.767 13.065 -0.546 1.00 . A B . 40 GLU CD 1 1 2 1406 1 1 40 GLU CG C -1.938 13.455 -1.429 1.00 . A B . 40 GLU CG 1 1 2 1407 1 1 40 GLU H H -4.561 12.330 -1.023 1.00 . A B . 40 GLU H 1 1 2 1408 1 1 40 GLU HA H -2.921 13.261 1.149 1.00 . A B . 40 GLU HA 1 1 2 1409 1 1 40 GLU HB2 H -3.705 14.633 -1.422 1.00 . A B . 40 GLU HB2 1 1 2 1410 1 1 40 GLU HB3 H -2.463 15.179 -0.304 1.00 . A B . 40 GLU HB3 1 1 2 1411 1 1 40 GLU HG2 H -2.421 12.555 -1.775 1.00 . A B . 40 GLU HG2 1 1 2 1412 1 1 40 GLU HG3 H -1.561 14.008 -2.275 1.00 . A B . 40 GLU HG3 1 1 2 1413 1 1 40 GLU N N -4.313 12.376 -0.075 1.00 . A B . 40 GLU N 1 1 2 1414 1 1 40 GLU O O -5.075 15.515 0.596 1.00 . A B . 40 GLU O 1 1 2 1415 1 1 40 GLU OE1 O -0.974 12.361 0.466 1.00 . A B . 40 GLU OE1 1 1 2 1416 1 1 40 GLU OE2 O 0.373 13.462 -0.861 1.00 . A B . 40 GLU OE2 1 1 2 1417 1 1 41 ALA C C -6.226 14.024 4.465 1.00 . A B . 41 ALA C 1 1 2 1418 1 1 41 ALA CA C -6.006 14.790 3.170 1.00 . A B . 41 ALA CA 1 1 2 1419 1 1 41 ALA CB C -7.332 14.976 2.447 1.00 . A B . 41 ALA CB 1 1 2 1420 1 1 41 ALA H H -4.668 13.231 2.678 1.00 . A B . 41 ALA H 1 1 2 1421 1 1 41 ALA HA H -5.593 15.760 3.395 1.00 . A B . 41 ALA HA 1 1 2 1422 1 1 41 ALA HB1 H -7.171 15.543 1.543 1.00 . A B . 41 ALA HB1 1 1 2 1423 1 1 41 ALA HB2 H -8.021 15.507 3.088 1.00 . A B . 41 ALA HB2 1 1 2 1424 1 1 41 ALA HB3 H -7.744 14.011 2.197 1.00 . A B . 41 ALA HB3 1 1 2 1425 1 1 41 ALA N N -5.051 14.066 2.334 1.00 . A B . 41 ALA N 1 1 2 1426 1 1 41 ALA O O -6.336 14.606 5.545 1.00 . A B . 41 ALA O 1 1 2 1427 1 1 42 GLU C C -5.858 10.460 5.172 1.00 . A B . 42 GLU C 1 1 2 1428 1 1 42 GLU CA C -6.487 11.819 5.463 1.00 . A B . 42 GLU CA 1 1 2 1429 1 1 42 GLU CB C -7.977 11.675 5.774 1.00 . A B . 42 GLU CB 1 1 2 1430 1 1 42 GLU CD C -10.293 11.232 4.884 1.00 . A B . 42 GLU CD 1 1 2 1431 1 1 42 GLU CG C -8.848 11.501 4.540 1.00 . A B . 42 GLU CG 1 1 2 1432 1 1 42 GLU H H -6.194 12.321 3.443 1.00 . A B . 42 GLU H 1 1 2 1433 1 1 42 GLU HA H -5.993 12.254 6.318 1.00 . A B . 42 GLU HA 1 1 2 1434 1 1 42 GLU HB2 H -8.117 10.813 6.410 1.00 . A B . 42 GLU HB2 1 1 2 1435 1 1 42 GLU HB3 H -8.309 12.557 6.300 1.00 . A B . 42 GLU HB3 1 1 2 1436 1 1 42 GLU HG2 H -8.797 12.406 3.953 1.00 . A B . 42 GLU HG2 1 1 2 1437 1 1 42 GLU HG3 H -8.469 10.675 3.959 1.00 . A B . 42 GLU HG3 1 1 2 1438 1 1 42 GLU N N -6.286 12.710 4.335 1.00 . A B . 42 GLU N 1 1 2 1439 1 1 42 GLU O O -6.533 9.517 4.751 1.00 . A B . 42 GLU O 1 1 2 1440 1 1 42 GLU OE1 O -11.059 12.205 5.050 1.00 . A B . 42 GLU OE1 1 1 2 1441 1 1 42 GLU OE2 O -10.677 10.047 4.980 1.00 . A B . 42 GLU OE2 1 1 2 1442 1 1 43 ARG C C -4.090 8.129 6.232 1.00 . A B . 43 ARG C 1 1 2 1443 1 1 43 ARG CA C -3.815 9.148 5.134 1.00 . A B . 43 ARG CA 1 1 2 1444 1 1 43 ARG CB C -2.316 9.420 5.048 1.00 . A B . 43 ARG CB 1 1 2 1445 1 1 43 ARG CD C -0.381 10.313 3.751 1.00 . A B . 43 ARG CD 1 1 2 1446 1 1 43 ARG CG C -1.894 10.237 3.839 1.00 . A B . 43 ARG CG 1 1 2 1447 1 1 43 ARG CZ C 1.365 10.928 2.131 1.00 . A B . 43 ARG CZ 1 1 2 1448 1 1 43 ARG H H -4.075 11.164 5.710 1.00 . A B . 43 ARG H 1 1 2 1449 1 1 43 ARG HA H -4.153 8.740 4.194 1.00 . A B . 43 ARG HA 1 1 2 1450 1 1 43 ARG HB2 H -2.010 9.954 5.934 1.00 . A B . 43 ARG HB2 1 1 2 1451 1 1 43 ARG HB3 H -1.798 8.475 5.013 1.00 . A B . 43 ARG HB3 1 1 2 1452 1 1 43 ARG HD2 H -0.016 10.912 4.571 1.00 . A B . 43 ARG HD2 1 1 2 1453 1 1 43 ARG HD3 H 0.017 9.312 3.837 1.00 . A B . 43 ARG HD3 1 1 2 1454 1 1 43 ARG HE H -0.595 11.283 1.886 1.00 . A B . 43 ARG HE 1 1 2 1455 1 1 43 ARG HG2 H -2.280 9.773 2.946 1.00 . A B . 43 ARG HG2 1 1 2 1456 1 1 43 ARG HG3 H -2.292 11.238 3.931 1.00 . A B . 43 ARG HG3 1 1 2 1457 1 1 43 ARG HH11 H 2.048 10.090 3.849 1.00 . A B . 43 ARG HH11 1 1 2 1458 1 1 43 ARG HH12 H 3.266 10.498 2.684 1.00 . A B . 43 ARG HH12 1 1 2 1459 1 1 43 ARG HH21 H 1.002 11.822 0.347 1.00 . A B . 43 ARG HH21 1 1 2 1460 1 1 43 ARG HH22 H 2.673 11.460 0.677 1.00 . A B . 43 ARG HH22 1 1 2 1461 1 1 43 ARG N N -4.554 10.376 5.376 1.00 . A B . 43 ARG N 1 1 2 1462 1 1 43 ARG NE N 0.086 10.898 2.497 1.00 . A B . 43 ARG NE 1 1 2 1463 1 1 43 ARG NH1 N 2.300 10.465 2.952 1.00 . A B . 43 ARG NH1 1 1 2 1464 1 1 43 ARG NH2 N 1.709 11.445 0.961 1.00 . A B . 43 ARG NH2 1 1 2 1465 1 1 43 ARG O O -3.267 7.911 7.119 1.00 . A B . 43 ARG O 1 1 2 1466 1 1 44 THR C C -5.365 5.120 6.671 1.00 . A B . 44 THR C 1 1 2 1467 1 1 44 THR CA C -5.672 6.540 7.142 1.00 . A B . 44 THR CA 1 1 2 1468 1 1 44 THR CB C -7.182 6.678 7.409 1.00 . A B . 44 THR CB 1 1 2 1469 1 1 44 THR CG2 C -7.498 8.018 8.063 1.00 . A B . 44 THR CG2 1 1 2 1470 1 1 44 THR H H -5.849 7.722 5.409 1.00 . A B . 44 THR H 1 1 2 1471 1 1 44 THR HA H -5.143 6.740 8.060 1.00 . A B . 44 THR HA 1 1 2 1472 1 1 44 THR HB H -7.492 5.886 8.071 1.00 . A B . 44 THR HB 1 1 2 1473 1 1 44 THR HG1 H -7.431 5.948 5.589 1.00 . A B . 44 THR HG1 1 1 2 1474 1 1 44 THR HG21 H -7.145 8.819 7.431 1.00 . A B . 44 THR HG21 1 1 2 1475 1 1 44 THR HG22 H -7.007 8.075 9.024 1.00 . A B . 44 THR HG22 1 1 2 1476 1 1 44 THR HG23 H -8.565 8.111 8.199 1.00 . A B . 44 THR HG23 1 1 2 1477 1 1 44 THR N N -5.250 7.510 6.155 1.00 . A B . 44 THR N 1 1 2 1478 1 1 44 THR O O -5.912 4.670 5.663 1.00 . A B . 44 THR O 1 1 2 1479 1 1 44 THR OG1 O -7.903 6.560 6.172 1.00 . A B . 44 THR OG1 1 1 2 1480 1 1 45 PRO C C -5.273 2.035 7.237 1.00 . A B . 45 PRO C 1 1 2 1481 1 1 45 PRO CA C -4.120 3.014 7.024 1.00 . A B . 45 PRO CA 1 1 2 1482 1 1 45 PRO CB C -2.957 2.673 7.968 1.00 . A B . 45 PRO CB 1 1 2 1483 1 1 45 PRO CD C -3.737 4.858 8.561 1.00 . A B . 45 PRO CD 1 1 2 1484 1 1 45 PRO CG C -2.520 3.977 8.552 1.00 . A B . 45 PRO CG 1 1 2 1485 1 1 45 PRO HA H -3.785 2.949 5.999 1.00 . A B . 45 PRO HA 1 1 2 1486 1 1 45 PRO HB2 H -3.304 1.994 8.734 1.00 . A B . 45 PRO HB2 1 1 2 1487 1 1 45 PRO HB3 H -2.159 2.209 7.405 1.00 . A B . 45 PRO HB3 1 1 2 1488 1 1 45 PRO HD2 H -4.311 4.707 9.466 1.00 . A B . 45 PRO HD2 1 1 2 1489 1 1 45 PRO HD3 H -3.456 5.897 8.457 1.00 . A B . 45 PRO HD3 1 1 2 1490 1 1 45 PRO HG2 H -2.157 3.825 9.558 1.00 . A B . 45 PRO HG2 1 1 2 1491 1 1 45 PRO HG3 H -1.747 4.413 7.937 1.00 . A B . 45 PRO HG3 1 1 2 1492 1 1 45 PRO N N -4.480 4.395 7.380 1.00 . A B . 45 PRO N 1 1 2 1493 1 1 45 PRO O O -5.194 0.871 6.849 1.00 . A B . 45 PRO O 1 1 2 1494 1 1 46 TRP C C -8.498 1.783 6.940 1.00 . A B . 46 TRP C 1 1 2 1495 1 1 46 TRP CA C -7.523 1.687 8.111 1.00 . A B . 46 TRP CA 1 1 2 1496 1 1 46 TRP CB C -8.224 2.125 9.406 1.00 . A B . 46 TRP CB 1 1 2 1497 1 1 46 TRP CD1 C -6.952 1.225 11.444 1.00 . A B . 46 TRP CD1 1 1 2 1498 1 1 46 TRP CD2 C -6.629 3.404 11.046 1.00 . A B . 46 TRP CD2 1 1 2 1499 1 1 46 TRP CE2 C -5.881 3.038 12.180 1.00 . A B . 46 TRP CE2 1 1 2 1500 1 1 46 TRP CE3 C -6.581 4.728 10.608 1.00 . A B . 46 TRP CE3 1 1 2 1501 1 1 46 TRP CG C -7.307 2.227 10.587 1.00 . A B . 46 TRP CG 1 1 2 1502 1 1 46 TRP CH2 C -5.067 5.240 12.425 1.00 . A B . 46 TRP CH2 1 1 2 1503 1 1 46 TRP CZ2 C -5.096 3.949 12.879 1.00 . A B . 46 TRP CZ2 1 1 2 1504 1 1 46 TRP CZ3 C -5.800 5.631 11.302 1.00 . A B . 46 TRP CZ3 1 1 2 1505 1 1 46 TRP H H -6.343 3.446 8.146 1.00 . A B . 46 TRP H 1 1 2 1506 1 1 46 TRP HA H -7.195 0.663 8.210 1.00 . A B . 46 TRP HA 1 1 2 1507 1 1 46 TRP HB2 H -8.678 3.093 9.253 1.00 . A B . 46 TRP HB2 1 1 2 1508 1 1 46 TRP HB3 H -9.000 1.409 9.648 1.00 . A B . 46 TRP HB3 1 1 2 1509 1 1 46 TRP HD1 H -7.301 0.207 11.370 1.00 . A B . 46 TRP HD1 1 1 2 1510 1 1 46 TRP HE1 H -5.699 1.178 13.129 1.00 . A B . 46 TRP HE1 1 1 2 1511 1 1 46 TRP HE3 H -7.141 5.049 9.744 1.00 . A B . 46 TRP HE3 1 1 2 1512 1 1 46 TRP HH2 H -4.470 5.981 12.934 1.00 . A B . 46 TRP HH2 1 1 2 1513 1 1 46 TRP HZ2 H -4.524 3.661 13.748 1.00 . A B . 46 TRP HZ2 1 1 2 1514 1 1 46 TRP HZ3 H -5.751 6.660 10.977 1.00 . A B . 46 TRP HZ3 1 1 2 1515 1 1 46 TRP N N -6.344 2.513 7.856 1.00 . A B . 46 TRP N 1 1 2 1516 1 1 46 TRP NE1 N -6.095 1.706 12.403 1.00 . A B . 46 TRP NE1 1 1 2 1517 1 1 46 TRP O O -9.710 1.864 7.131 1.00 . A B . 46 TRP O 1 1 2 1518 1 1 47 ASN C C -8.042 1.170 3.382 1.00 . A B . 47 ASN C 1 1 2 1519 1 1 47 ASN CA C -8.745 1.898 4.519 1.00 . A B . 47 ASN CA 1 1 2 1520 1 1 47 ASN CB C -8.954 3.377 4.157 1.00 . A B . 47 ASN CB 1 1 2 1521 1 1 47 ASN CG C -9.726 3.567 2.859 1.00 . A B . 47 ASN CG 1 1 2 1522 1 1 47 ASN H H -6.980 1.684 5.653 1.00 . A B . 47 ASN H 1 1 2 1523 1 1 47 ASN HA H -9.706 1.436 4.698 1.00 . A B . 47 ASN HA 1 1 2 1524 1 1 47 ASN HB2 H -9.501 3.860 4.953 1.00 . A B . 47 ASN HB2 1 1 2 1525 1 1 47 ASN HB3 H -7.989 3.852 4.053 1.00 . A B . 47 ASN HB3 1 1 2 1526 1 1 47 ASN HD21 H -8.779 5.280 2.513 1.00 . A B . 47 ASN HD21 1 1 2 1527 1 1 47 ASN HD22 H -9.937 4.808 1.318 1.00 . A B . 47 ASN HD22 1 1 2 1528 1 1 47 ASN N N -7.952 1.781 5.734 1.00 . A B . 47 ASN N 1 1 2 1529 1 1 47 ASN ND2 N -9.452 4.662 2.161 1.00 . A B . 47 ASN ND2 1 1 2 1530 1 1 47 ASN O O -7.151 1.723 2.743 1.00 . A B . 47 ASN O 1 1 2 1531 1 1 47 ASN OD1 O -10.558 2.743 2.485 1.00 . A B . 47 ASN OD1 1 1 2 1532 1 1 48 CYS C C -8.541 -0.701 0.804 1.00 . A B . 48 CYS C 1 1 2 1533 1 1 48 CYS CA C -7.796 -0.883 2.117 1.00 . A B . 48 CYS CA 1 1 2 1534 1 1 48 CYS CB C -7.791 -2.363 2.530 1.00 . A B . 48 CYS CB 1 1 2 1535 1 1 48 CYS H H -9.164 -0.459 3.673 1.00 . A B . 48 CYS H 1 1 2 1536 1 1 48 CYS HA H -6.779 -0.539 1.998 1.00 . A B . 48 CYS HA 1 1 2 1537 1 1 48 CYS HB2 H -7.307 -2.460 3.489 1.00 . A B . 48 CYS HB2 1 1 2 1538 1 1 48 CYS HB3 H -8.815 -2.702 2.621 1.00 . A B . 48 CYS HB3 1 1 2 1539 1 1 48 CYS N N -8.426 -0.079 3.151 1.00 . A B . 48 CYS N 1 1 2 1540 1 1 48 CYS O O -9.735 -0.988 0.711 1.00 . A B . 48 CYS O 1 1 2 1541 1 1 48 CYS SG S -6.944 -3.487 1.384 1.00 . A B . 48 CYS SG 1 1 2 1542 1 1 49 ILE C C -8.738 -1.288 -2.260 1.00 . A B . 49 ILE C 1 1 2 1543 1 1 49 ILE CA C -8.441 0.005 -1.511 1.00 . A B . 49 ILE CA 1 1 2 1544 1 1 49 ILE CB C -7.577 0.934 -2.397 1.00 . A B . 49 ILE CB 1 1 2 1545 1 1 49 ILE CD1 C -5.186 1.468 -3.101 1.00 . A B . 49 ILE CD1 1 1 2 1546 1 1 49 ILE CG1 C -6.085 0.639 -2.210 1.00 . A B . 49 ILE CG1 1 1 2 1547 1 1 49 ILE CG2 C -7.878 2.395 -2.092 1.00 . A B . 49 ILE CG2 1 1 2 1548 1 1 49 ILE H H -6.872 -0.067 -0.084 1.00 . A B . 49 ILE H 1 1 2 1549 1 1 49 ILE HA H -9.381 0.508 -1.323 1.00 . A B . 49 ILE HA 1 1 2 1550 1 1 49 ILE HB H -7.842 0.748 -3.426 1.00 . A B . 49 ILE HB 1 1 2 1551 1 1 49 ILE HD11 H -5.376 1.222 -4.135 1.00 . A B . 49 ILE HD11 1 1 2 1552 1 1 49 ILE HD12 H -4.154 1.262 -2.864 1.00 . A B . 49 ILE HD12 1 1 2 1553 1 1 49 ILE HD13 H -5.388 2.516 -2.938 1.00 . A B . 49 ILE HD13 1 1 2 1554 1 1 49 ILE HG12 H -5.813 0.851 -1.189 1.00 . A B . 49 ILE HG12 1 1 2 1555 1 1 49 ILE HG13 H -5.899 -0.403 -2.422 1.00 . A B . 49 ILE HG13 1 1 2 1556 1 1 49 ILE HG21 H -8.918 2.600 -2.298 1.00 . A B . 49 ILE HG21 1 1 2 1557 1 1 49 ILE HG22 H -7.258 3.026 -2.712 1.00 . A B . 49 ILE HG22 1 1 2 1558 1 1 49 ILE HG23 H -7.669 2.596 -1.051 1.00 . A B . 49 ILE HG23 1 1 2 1559 1 1 49 ILE N N -7.830 -0.251 -0.215 1.00 . A B . 49 ILE N 1 1 2 1560 1 1 49 ILE O O -9.621 -1.327 -3.112 1.00 . A B . 49 ILE O 1 1 2 1561 1 1 50 PHE C C -9.422 -4.359 -1.973 1.00 . A B . 50 PHE C 1 1 2 1562 1 1 50 PHE CA C -8.233 -3.630 -2.592 1.00 . A B . 50 PHE CA 1 1 2 1563 1 1 50 PHE CB C -6.969 -4.498 -2.573 1.00 . A B . 50 PHE CB 1 1 2 1564 1 1 50 PHE CD1 C -5.148 -3.012 -3.446 1.00 . A B . 50 PHE CD1 1 1 2 1565 1 1 50 PHE CD2 C -5.887 -4.817 -4.814 1.00 . A B . 50 PHE CD2 1 1 2 1566 1 1 50 PHE CE1 C -4.231 -2.650 -4.411 1.00 . A B . 50 PHE CE1 1 1 2 1567 1 1 50 PHE CE2 C -4.971 -4.462 -5.782 1.00 . A B . 50 PHE CE2 1 1 2 1568 1 1 50 PHE CG C -5.988 -4.097 -3.636 1.00 . A B . 50 PHE CG 1 1 2 1569 1 1 50 PHE CZ C -4.209 -3.335 -5.626 1.00 . A B . 50 PHE CZ 1 1 2 1570 1 1 50 PHE H H -7.370 -2.287 -1.200 1.00 . A B . 50 PHE H 1 1 2 1571 1 1 50 PHE HA H -8.481 -3.416 -3.623 1.00 . A B . 50 PHE HA 1 1 2 1572 1 1 50 PHE HB2 H -6.481 -4.407 -1.613 1.00 . A B . 50 PHE HB2 1 1 2 1573 1 1 50 PHE HB3 H -7.240 -5.532 -2.741 1.00 . A B . 50 PHE HB3 1 1 2 1574 1 1 50 PHE HD1 H -5.218 -2.443 -2.531 1.00 . A B . 50 PHE HD1 1 1 2 1575 1 1 50 PHE HD2 H -6.536 -5.664 -4.976 1.00 . A B . 50 PHE HD2 1 1 2 1576 1 1 50 PHE HE1 H -3.584 -1.801 -4.252 1.00 . A B . 50 PHE HE1 1 1 2 1577 1 1 50 PHE HE2 H -4.901 -5.035 -6.693 1.00 . A B . 50 PHE HE2 1 1 2 1578 1 1 50 PHE HZ H -3.518 -3.038 -6.401 1.00 . A B . 50 PHE HZ 1 1 2 1579 1 1 50 PHE N N -8.009 -2.347 -1.940 1.00 . A B . 50 PHE N 1 1 2 1580 1 1 50 PHE O O -10.223 -4.959 -2.678 1.00 . A B . 50 PHE O 1 1 2 1581 1 1 51 CYS C C -11.965 -4.273 -0.108 1.00 . A B . 51 CYS C 1 1 2 1582 1 1 51 CYS CA C -10.619 -4.974 0.060 1.00 . A B . 51 CYS CA 1 1 2 1583 1 1 51 CYS CB C -10.295 -5.137 1.545 1.00 . A B . 51 CYS CB 1 1 2 1584 1 1 51 CYS H H -8.888 -3.762 -0.140 1.00 . A B . 51 CYS H 1 1 2 1585 1 1 51 CYS HA H -10.705 -5.959 -0.378 1.00 . A B . 51 CYS HA 1 1 2 1586 1 1 51 CYS HB2 H -9.869 -4.220 1.919 1.00 . A B . 51 CYS HB2 1 1 2 1587 1 1 51 CYS HB3 H -11.206 -5.351 2.085 1.00 . A B . 51 CYS HB3 1 1 2 1588 1 1 51 CYS N N -9.537 -4.290 -0.650 1.00 . A B . 51 CYS N 1 1 2 1589 1 1 51 CYS O O -13.015 -4.905 0.024 1.00 . A B . 51 CYS O 1 1 2 1590 1 1 51 CYS SG S -9.125 -6.471 1.891 1.00 . A B . 51 CYS SG 1 1 2 1591 1 1 52 ARG C C -13.627 -2.036 -1.913 1.00 . A B . 52 ARG C 1 1 2 1592 1 1 52 ARG CA C -13.200 -2.224 -0.467 1.00 . A B . 52 ARG CA 1 1 2 1593 1 1 52 ARG CB C -13.050 -0.867 0.223 1.00 . A B . 52 ARG CB 1 1 2 1594 1 1 52 ARG CD C -12.726 0.386 2.376 1.00 . A B . 52 ARG CD 1 1 2 1595 1 1 52 ARG CG C -12.701 -0.972 1.698 1.00 . A B . 52 ARG CG 1 1 2 1596 1 1 52 ARG CZ C -12.612 1.261 4.683 1.00 . A B . 52 ARG CZ 1 1 2 1597 1 1 52 ARG H H -11.141 -2.565 -0.770 1.00 . A B . 52 ARG H 1 1 2 1598 1 1 52 ARG HA H -13.954 -2.804 0.042 1.00 . A B . 52 ARG HA 1 1 2 1599 1 1 52 ARG HB2 H -12.270 -0.307 -0.271 1.00 . A B . 52 ARG HB2 1 1 2 1600 1 1 52 ARG HB3 H -13.982 -0.328 0.132 1.00 . A B . 52 ARG HB3 1 1 2 1601 1 1 52 ARG HD2 H -11.991 1.025 1.907 1.00 . A B . 52 ARG HD2 1 1 2 1602 1 1 52 ARG HD3 H -13.708 0.817 2.258 1.00 . A B . 52 ARG HD3 1 1 2 1603 1 1 52 ARG HE H -12.053 -0.575 4.117 1.00 . A B . 52 ARG HE 1 1 2 1604 1 1 52 ARG HG2 H -13.416 -1.617 2.185 1.00 . A B . 52 ARG HG2 1 1 2 1605 1 1 52 ARG HG3 H -11.710 -1.393 1.793 1.00 . A B . 52 ARG HG3 1 1 2 1606 1 1 52 ARG HH11 H -13.364 2.568 3.333 1.00 . A B . 52 ARG HH11 1 1 2 1607 1 1 52 ARG HH12 H -13.265 3.162 4.958 1.00 . A B . 52 ARG HH12 1 1 2 1608 1 1 52 ARG HH21 H -11.914 0.193 6.256 1.00 . A B . 52 ARG HH21 1 1 2 1609 1 1 52 ARG HH22 H -12.430 1.807 6.624 1.00 . A B . 52 ARG HH22 1 1 2 1610 1 1 52 ARG N N -11.955 -2.984 -0.426 1.00 . A B . 52 ARG N 1 1 2 1611 1 1 52 ARG NE N -12.423 0.280 3.801 1.00 . A B . 52 ARG NE 1 1 2 1612 1 1 52 ARG NH1 N -13.120 2.423 4.294 1.00 . A B . 52 ARG NH1 1 1 2 1613 1 1 52 ARG NH2 N -12.294 1.071 5.956 1.00 . A B . 52 ARG NH2 1 1 2 1614 1 1 52 ARG O O -14.705 -1.520 -2.203 1.00 . A B . 52 ARG O 1 1 2 1615 1 1 53 MET C C -12.601 -3.800 -4.791 1.00 . A B . 53 MET C 1 1 2 1616 1 1 53 MET CA C -13.008 -2.450 -4.237 1.00 . A B . 53 MET CA 1 1 2 1617 1 1 53 MET CB C -12.209 -1.331 -4.915 1.00 . A B . 53 MET CB 1 1 2 1618 1 1 53 MET CE C -11.885 2.734 -4.050 1.00 . A B . 53 MET CE 1 1 2 1619 1 1 53 MET CG C -12.433 0.040 -4.298 1.00 . A B . 53 MET CG 1 1 2 1620 1 1 53 MET H H -11.923 -2.876 -2.487 1.00 . A B . 53 MET H 1 1 2 1621 1 1 53 MET HA H -14.066 -2.298 -4.398 1.00 . A B . 53 MET HA 1 1 2 1622 1 1 53 MET HB2 H -11.157 -1.565 -4.846 1.00 . A B . 53 MET HB2 1 1 2 1623 1 1 53 MET HB3 H -12.491 -1.285 -5.956 1.00 . A B . 53 MET HB3 1 1 2 1624 1 1 53 MET HE1 H -12.952 2.900 -4.073 1.00 . A B . 53 MET HE1 1 1 2 1625 1 1 53 MET HE2 H -11.376 3.617 -4.407 1.00 . A B . 53 MET HE2 1 1 2 1626 1 1 53 MET HE3 H -11.575 2.526 -3.036 1.00 . A B . 53 MET HE3 1 1 2 1627 1 1 53 MET HG2 H -13.481 0.286 -4.374 1.00 . A B . 53 MET HG2 1 1 2 1628 1 1 53 MET HG3 H -12.152 -0.005 -3.255 1.00 . A B . 53 MET HG3 1 1 2 1629 1 1 53 MET N N -12.758 -2.477 -2.806 1.00 . A B . 53 MET N 1 1 2 1630 1 1 53 MET O O -11.969 -3.907 -5.844 1.00 . A B . 53 MET O 1 1 2 1631 1 1 53 MET SD S -11.474 1.341 -5.098 1.00 . A B . 53 MET SD 1 1 2 1632 1 1 54 LYS C C -13.326 -6.801 -5.435 1.00 . A B . 54 LYS C 1 1 2 1633 1 1 54 LYS CA C -12.521 -6.189 -4.299 1.00 . A B . 54 LYS CA 1 1 2 1634 1 1 54 LYS CB C -12.661 -7.018 -3.015 1.00 . A B . 54 LYS CB 1 1 2 1635 1 1 54 LYS CD C -12.116 -9.085 -1.717 1.00 . A B . 54 LYS CD 1 1 2 1636 1 1 54 LYS CE C -11.481 -10.464 -1.734 1.00 . A B . 54 LYS CE 1 1 2 1637 1 1 54 LYS CG C -12.039 -8.404 -3.075 1.00 . A B . 54 LYS CG 1 1 2 1638 1 1 54 LYS H H -13.576 -4.673 -3.293 1.00 . A B . 54 LYS H 1 1 2 1639 1 1 54 LYS HA H -11.481 -6.151 -4.586 1.00 . A B . 54 LYS HA 1 1 2 1640 1 1 54 LYS HB2 H -12.195 -6.477 -2.202 1.00 . A B . 54 LYS HB2 1 1 2 1641 1 1 54 LYS HB3 H -13.712 -7.132 -2.793 1.00 . A B . 54 LYS HB3 1 1 2 1642 1 1 54 LYS HD2 H -11.601 -8.475 -0.993 1.00 . A B . 54 LYS HD2 1 1 2 1643 1 1 54 LYS HD3 H -13.154 -9.181 -1.434 1.00 . A B . 54 LYS HD3 1 1 2 1644 1 1 54 LYS HE2 H -11.998 -11.076 -2.458 1.00 . A B . 54 LYS HE2 1 1 2 1645 1 1 54 LYS HE3 H -10.443 -10.366 -2.016 1.00 . A B . 54 LYS HE3 1 1 2 1646 1 1 54 LYS HG2 H -12.576 -9.000 -3.800 1.00 . A B . 54 LYS HG2 1 1 2 1647 1 1 54 LYS HG3 H -11.002 -8.320 -3.368 1.00 . A B . 54 LYS HG3 1 1 2 1648 1 1 54 LYS HZ1 H -12.554 -11.233 -0.116 1.00 . A B . 54 LYS HZ1 1 1 2 1649 1 1 54 LYS HZ2 H -11.070 -10.543 0.309 1.00 . A B . 54 LYS HZ2 1 1 2 1650 1 1 54 LYS HZ3 H -11.113 -12.057 -0.437 1.00 . A B . 54 LYS HZ3 1 1 2 1651 1 1 54 LYS N N -12.965 -4.831 -4.042 1.00 . A B . 54 LYS N 1 1 2 1652 1 1 54 LYS NZ N -11.560 -11.119 -0.402 1.00 . A B . 54 LYS NZ 1 1 2 1653 1 1 54 LYS O O -14.275 -7.554 -5.214 1.00 . A B . 54 LYS O 1 1 2 1654 1 1 55 GLU C C -12.588 -7.332 -8.885 1.00 . A B . 55 GLU C 1 1 2 1655 1 1 55 GLU CA C -13.620 -6.928 -7.840 1.00 . A B . 55 GLU CA 1 1 2 1656 1 1 55 GLU CB C -14.558 -5.858 -8.401 1.00 . A B . 55 GLU CB 1 1 2 1657 1 1 55 GLU CD C -16.615 -4.434 -8.049 1.00 . A B . 55 GLU CD 1 1 2 1658 1 1 55 GLU CG C -15.747 -5.548 -7.504 1.00 . A B . 55 GLU CG 1 1 2 1659 1 1 55 GLU H H -12.190 -5.831 -6.747 1.00 . A B . 55 GLU H 1 1 2 1660 1 1 55 GLU HA H -14.199 -7.797 -7.569 1.00 . A B . 55 GLU HA 1 1 2 1661 1 1 55 GLU HB2 H -13.998 -4.948 -8.545 1.00 . A B . 55 GLU HB2 1 1 2 1662 1 1 55 GLU HB3 H -14.933 -6.194 -9.353 1.00 . A B . 55 GLU HB3 1 1 2 1663 1 1 55 GLU HG2 H -16.351 -6.437 -7.405 1.00 . A B . 55 GLU HG2 1 1 2 1664 1 1 55 GLU HG3 H -15.382 -5.254 -6.530 1.00 . A B . 55 GLU HG3 1 1 2 1665 1 1 55 GLU N N -12.951 -6.445 -6.649 1.00 . A B . 55 GLU N 1 1 2 1666 1 1 55 GLU O O -12.217 -6.531 -9.744 1.00 . A B . 55 GLU O 1 1 2 1667 1 1 55 GLU OE1 O -17.206 -4.612 -9.136 1.00 . A B . 55 GLU OE1 1 1 2 1668 1 1 55 GLU OE2 O -16.699 -3.366 -7.404 1.00 . A B . 55 GLU OE2 1 1 2 1669 1 1 56 SER C C -9.827 -8.309 -9.652 1.00 . A B . 56 SER C 1 1 2 1670 1 1 56 SER CA C -11.125 -9.125 -9.688 1.00 . A B . 56 SER CA 1 1 2 1671 1 1 56 SER CB C -11.695 -9.189 -11.106 1.00 . A B . 56 SER CB 1 1 2 1672 1 1 56 SER H H -12.468 -9.143 -8.063 1.00 . A B . 56 SER H 1 1 2 1673 1 1 56 SER HA H -10.904 -10.130 -9.357 1.00 . A B . 56 SER HA 1 1 2 1674 1 1 56 SER HB2 H -11.875 -8.187 -11.463 1.00 . A B . 56 SER HB2 1 1 2 1675 1 1 56 SER HB3 H -10.989 -9.684 -11.755 1.00 . A B . 56 SER HB3 1 1 2 1676 1 1 56 SER HG H -13.655 -9.284 -11.104 1.00 . A B . 56 SER HG 1 1 2 1677 1 1 56 SER N N -12.122 -8.573 -8.779 1.00 . A B . 56 SER N 1 1 2 1678 1 1 56 SER O O -9.571 -7.533 -10.597 1.00 . A B . 56 SER O 1 1 2 1679 1 1 56 SER OXT O -9.070 -8.441 -8.662 1.00 . A B . 56 SER OXT 1 1 2 1680 1 1 56 SER OG O -12.918 -9.908 -11.124 1.00 . A B . 56 SER OG 1 1 2 1681 2 2 1 ZN ZN ZN -7.040 -5.597 2.292 1.00 . B B . 101 ZN ZN 1 1 2 1682 3 2 1 ZN ZN ZN 5.737 1.052 -0.059 1.00 . C B . 102 ZN ZN 1 1 3 1683 1 1 1 GLY C C 15.615 -6.561 1.218 1.00 . A B . 1 GLY C 1 1 3 1684 1 1 1 GLY CA C 15.831 -6.903 2.676 1.00 . A B . 1 GLY CA 1 1 3 1685 1 1 1 GLY H1 H 16.737 -8.747 2.355 1.00 . A B . 1 GLY H1 1 1 3 1686 1 1 1 GLY H2 H 17.059 -8.077 3.873 1.00 . A B . 1 GLY H2 1 1 3 1687 1 1 1 GLY H3 H 17.825 -7.461 2.498 1.00 . A B . 1 GLY H3 1 1 3 1688 1 1 1 GLY HA2 H 14.923 -7.331 3.074 1.00 . A B . 1 GLY HA2 1 1 3 1689 1 1 1 GLY HA3 H 16.059 -5.997 3.219 1.00 . A B . 1 GLY HA3 1 1 3 1690 1 1 1 GLY N N 16.941 -7.864 2.864 1.00 . A B . 1 GLY N 1 1 3 1691 1 1 1 GLY O O 16.420 -6.940 0.364 1.00 . A B . 1 GLY O 1 1 3 1692 1 1 2 ALA C C 13.896 -6.531 -1.379 1.00 . A B . 2 ALA C 1 1 3 1693 1 1 2 ALA CA C 14.180 -5.387 -0.405 1.00 . A B . 2 ALA CA 1 1 3 1694 1 1 2 ALA CB C 15.288 -4.488 -0.941 1.00 . A B . 2 ALA CB 1 1 3 1695 1 1 2 ALA H H 13.882 -5.672 1.674 1.00 . A B . 2 ALA H 1 1 3 1696 1 1 2 ALA HA H 13.287 -4.787 -0.320 1.00 . A B . 2 ALA HA 1 1 3 1697 1 1 2 ALA HB1 H 16.187 -5.069 -1.084 1.00 . A B . 2 ALA HB1 1 1 3 1698 1 1 2 ALA HB2 H 15.484 -3.695 -0.233 1.00 . A B . 2 ALA HB2 1 1 3 1699 1 1 2 ALA HB3 H 14.982 -4.061 -1.884 1.00 . A B . 2 ALA HB3 1 1 3 1700 1 1 2 ALA N N 14.507 -5.868 0.940 1.00 . A B . 2 ALA N 1 1 3 1701 1 1 2 ALA O O 13.862 -6.328 -2.593 1.00 . A B . 2 ALA O 1 1 3 1702 1 1 3 MET C C 12.313 -9.747 -0.998 1.00 . A B . 3 MET C 1 1 3 1703 1 1 3 MET CA C 13.383 -8.896 -1.670 1.00 . A B . 3 MET CA 1 1 3 1704 1 1 3 MET CB C 14.649 -9.737 -1.909 1.00 . A B . 3 MET CB 1 1 3 1705 1 1 3 MET CE C 18.192 -8.957 -3.976 1.00 . A B . 3 MET CE 1 1 3 1706 1 1 3 MET CG C 15.700 -9.054 -2.775 1.00 . A B . 3 MET CG 1 1 3 1707 1 1 3 MET H H 13.696 -7.825 0.133 1.00 . A B . 3 MET H 1 1 3 1708 1 1 3 MET HA H 13.005 -8.547 -2.620 1.00 . A B . 3 MET HA 1 1 3 1709 1 1 3 MET HB2 H 15.099 -9.971 -0.955 1.00 . A B . 3 MET HB2 1 1 3 1710 1 1 3 MET HB3 H 14.364 -10.661 -2.392 1.00 . A B . 3 MET HB3 1 1 3 1711 1 1 3 MET HE1 H 17.678 -8.824 -4.916 1.00 . A B . 3 MET HE1 1 1 3 1712 1 1 3 MET HE2 H 19.155 -9.412 -4.153 1.00 . A B . 3 MET HE2 1 1 3 1713 1 1 3 MET HE3 H 18.329 -7.996 -3.504 1.00 . A B . 3 MET HE3 1 1 3 1714 1 1 3 MET HG2 H 15.294 -8.912 -3.767 1.00 . A B . 3 MET HG2 1 1 3 1715 1 1 3 MET HG3 H 15.935 -8.091 -2.344 1.00 . A B . 3 MET HG3 1 1 3 1716 1 1 3 MET N N 13.673 -7.725 -0.846 1.00 . A B . 3 MET N 1 1 3 1717 1 1 3 MET O O 12.507 -10.935 -0.743 1.00 . A B . 3 MET O 1 1 3 1718 1 1 3 MET SD S 17.219 -10.015 -2.908 1.00 . A B . 3 MET SD 1 1 3 1719 1 1 4 GLY C C 10.086 -9.389 1.477 1.00 . A B . 4 GLY C 1 1 3 1720 1 1 4 GLY CA C 10.130 -9.811 0.025 1.00 . A B . 4 GLY CA 1 1 3 1721 1 1 4 GLY H H 11.059 -8.192 -0.983 1.00 . A B . 4 GLY H 1 1 3 1722 1 1 4 GLY HA2 H 9.180 -9.587 -0.438 1.00 . A B . 4 GLY HA2 1 1 3 1723 1 1 4 GLY HA3 H 10.305 -10.874 -0.026 1.00 . A B . 4 GLY HA3 1 1 3 1724 1 1 4 GLY N N 11.183 -9.125 -0.699 1.00 . A B . 4 GLY N 1 1 3 1725 1 1 4 GLY O O 9.025 -9.086 2.014 1.00 . A B . 4 GLY O 1 1 3 1726 1 1 5 MET C C 11.669 -7.413 3.485 1.00 . A B . 5 MET C 1 1 3 1727 1 1 5 MET CA C 11.352 -8.899 3.485 1.00 . A B . 5 MET CA 1 1 3 1728 1 1 5 MET CB C 12.441 -9.666 4.244 1.00 . A B . 5 MET CB 1 1 3 1729 1 1 5 MET CE C 13.099 -13.742 4.799 1.00 . A B . 5 MET CE 1 1 3 1730 1 1 5 MET CG C 12.225 -11.171 4.286 1.00 . A B . 5 MET CG 1 1 3 1731 1 1 5 MET H H 12.058 -9.642 1.632 1.00 . A B . 5 MET H 1 1 3 1732 1 1 5 MET HA H 10.397 -9.059 3.966 1.00 . A B . 5 MET HA 1 1 3 1733 1 1 5 MET HB2 H 13.393 -9.474 3.775 1.00 . A B . 5 MET HB2 1 1 3 1734 1 1 5 MET HB3 H 12.475 -9.302 5.260 1.00 . A B . 5 MET HB3 1 1 3 1735 1 1 5 MET HE1 H 13.025 -13.950 3.742 1.00 . A B . 5 MET HE1 1 1 3 1736 1 1 5 MET HE2 H 12.137 -13.895 5.264 1.00 . A B . 5 MET HE2 1 1 3 1737 1 1 5 MET HE3 H 13.824 -14.404 5.246 1.00 . A B . 5 MET HE3 1 1 3 1738 1 1 5 MET HG2 H 11.334 -11.380 4.861 1.00 . A B . 5 MET HG2 1 1 3 1739 1 1 5 MET HG3 H 12.094 -11.536 3.278 1.00 . A B . 5 MET HG3 1 1 3 1740 1 1 5 MET N N 11.247 -9.361 2.108 1.00 . A B . 5 MET N 1 1 3 1741 1 1 5 MET O O 12.755 -7.010 3.063 1.00 . A B . 5 MET O 1 1 3 1742 1 1 5 MET SD S 13.612 -12.043 5.037 1.00 . A B . 5 MET SD 1 1 3 1743 1 1 6 ARG C C 11.125 -4.736 2.426 1.00 . A B . 6 ARG C 1 1 3 1744 1 1 6 ARG CA C 10.824 -5.153 3.861 1.00 . A B . 6 ARG CA 1 1 3 1745 1 1 6 ARG CB C 11.911 -4.624 4.801 1.00 . A B . 6 ARG CB 1 1 3 1746 1 1 6 ARG CD C 12.754 -4.336 7.146 1.00 . A B . 6 ARG CD 1 1 3 1747 1 1 6 ARG CG C 11.682 -4.956 6.265 1.00 . A B . 6 ARG CG 1 1 3 1748 1 1 6 ARG CZ C 15.092 -5.025 7.562 1.00 . A B . 6 ARG CZ 1 1 3 1749 1 1 6 ARG H H 9.910 -7.000 4.341 1.00 . A B . 6 ARG H 1 1 3 1750 1 1 6 ARG HA H 9.872 -4.734 4.150 1.00 . A B . 6 ARG HA 1 1 3 1751 1 1 6 ARG HB2 H 12.859 -5.048 4.505 1.00 . A B . 6 ARG HB2 1 1 3 1752 1 1 6 ARG HB3 H 11.961 -3.551 4.701 1.00 . A B . 6 ARG HB3 1 1 3 1753 1 1 6 ARG HD2 H 12.665 -3.260 7.098 1.00 . A B . 6 ARG HD2 1 1 3 1754 1 1 6 ARG HD3 H 12.599 -4.662 8.163 1.00 . A B . 6 ARG HD3 1 1 3 1755 1 1 6 ARG HE H 14.283 -4.731 5.755 1.00 . A B . 6 ARG HE 1 1 3 1756 1 1 6 ARG HG2 H 10.718 -4.575 6.566 1.00 . A B . 6 ARG HG2 1 1 3 1757 1 1 6 ARG HG3 H 11.704 -6.029 6.388 1.00 . A B . 6 ARG HG3 1 1 3 1758 1 1 6 ARG HH11 H 13.971 -4.837 9.240 1.00 . A B . 6 ARG HH11 1 1 3 1759 1 1 6 ARG HH12 H 15.626 -5.280 9.501 1.00 . A B . 6 ARG HH12 1 1 3 1760 1 1 6 ARG HH21 H 16.460 -5.319 6.096 1.00 . A B . 6 ARG HH21 1 1 3 1761 1 1 6 ARG HH22 H 17.039 -5.560 7.715 1.00 . A B . 6 ARG HH22 1 1 3 1762 1 1 6 ARG N N 10.714 -6.605 3.938 1.00 . A B . 6 ARG N 1 1 3 1763 1 1 6 ARG NE N 14.102 -4.719 6.724 1.00 . A B . 6 ARG NE 1 1 3 1764 1 1 6 ARG NH1 N 14.879 -5.050 8.872 1.00 . A B . 6 ARG NH1 1 1 3 1765 1 1 6 ARG NH2 N 16.293 -5.324 7.087 1.00 . A B . 6 ARG NH2 1 1 3 1766 1 1 6 ARG O O 12.168 -4.153 2.134 1.00 . A B . 6 ARG O 1 1 3 1767 1 1 7 ASN C C 10.143 -3.294 -0.165 1.00 . A B . 7 ASN C 1 1 3 1768 1 1 7 ASN CA C 10.397 -4.772 0.110 1.00 . A B . 7 ASN CA 1 1 3 1769 1 1 7 ASN CB C 9.469 -5.646 -0.734 1.00 . A B . 7 ASN CB 1 1 3 1770 1 1 7 ASN CG C 9.969 -5.821 -2.154 1.00 . A B . 7 ASN CG 1 1 3 1771 1 1 7 ASN H H 9.370 -5.473 1.831 1.00 . A B . 7 ASN H 1 1 3 1772 1 1 7 ASN HA H 11.420 -5.003 -0.137 1.00 . A B . 7 ASN HA 1 1 3 1773 1 1 7 ASN HB2 H 9.391 -6.624 -0.279 1.00 . A B . 7 ASN HB2 1 1 3 1774 1 1 7 ASN HB3 H 8.492 -5.191 -0.767 1.00 . A B . 7 ASN HB3 1 1 3 1775 1 1 7 ASN HD21 H 8.926 -4.247 -2.776 1.00 . A B . 7 ASN HD21 1 1 3 1776 1 1 7 ASN HD22 H 9.855 -5.055 -3.986 1.00 . A B . 7 ASN HD22 1 1 3 1777 1 1 7 ASN N N 10.205 -5.050 1.530 1.00 . A B . 7 ASN N 1 1 3 1778 1 1 7 ASN ND2 N 9.541 -4.954 -3.061 1.00 . A B . 7 ASN ND2 1 1 3 1779 1 1 7 ASN O O 10.349 -2.797 -1.274 1.00 . A B . 7 ASN O 1 1 3 1780 1 1 7 ASN OD1 O 10.739 -6.740 -2.432 1.00 . A B . 7 ASN OD1 1 1 3 1781 1 1 8 LEU C C 10.703 -0.328 0.690 1.00 . A B . 8 LEU C 1 1 3 1782 1 1 8 LEU CA C 9.432 -1.172 0.821 1.00 . A B . 8 LEU CA 1 1 3 1783 1 1 8 LEU CB C 8.633 -0.755 2.067 1.00 . A B . 8 LEU CB 1 1 3 1784 1 1 8 LEU CD1 C 10.313 -0.463 3.942 1.00 . A B . 8 LEU CD1 1 1 3 1785 1 1 8 LEU CD2 C 8.019 -1.331 4.431 1.00 . A B . 8 LEU CD2 1 1 3 1786 1 1 8 LEU CG C 9.149 -1.292 3.414 1.00 . A B . 8 LEU CG 1 1 3 1787 1 1 8 LEU H H 9.577 -3.073 1.721 1.00 . A B . 8 LEU H 1 1 3 1788 1 1 8 LEU HA H 8.820 -1.003 -0.050 1.00 . A B . 8 LEU HA 1 1 3 1789 1 1 8 LEU HB2 H 8.632 0.325 2.116 1.00 . A B . 8 LEU HB2 1 1 3 1790 1 1 8 LEU HB3 H 7.614 -1.089 1.940 1.00 . A B . 8 LEU HB3 1 1 3 1791 1 1 8 LEU HD11 H 11.097 -0.426 3.200 1.00 . A B . 8 LEU HD11 1 1 3 1792 1 1 8 LEU HD12 H 10.695 -0.916 4.845 1.00 . A B . 8 LEU HD12 1 1 3 1793 1 1 8 LEU HD13 H 9.973 0.537 4.158 1.00 . A B . 8 LEU HD13 1 1 3 1794 1 1 8 LEU HD21 H 7.621 -0.336 4.567 1.00 . A B . 8 LEU HD21 1 1 3 1795 1 1 8 LEU HD22 H 8.396 -1.699 5.374 1.00 . A B . 8 LEU HD22 1 1 3 1796 1 1 8 LEU HD23 H 7.238 -1.985 4.076 1.00 . A B . 8 LEU HD23 1 1 3 1797 1 1 8 LEU HG H 9.503 -2.300 3.276 1.00 . A B . 8 LEU HG 1 1 3 1798 1 1 8 LEU N N 9.719 -2.600 0.878 1.00 . A B . 8 LEU N 1 1 3 1799 1 1 8 LEU O O 10.637 0.901 0.669 1.00 . A B . 8 LEU O 1 1 3 1800 1 1 9 ASP C C 13.288 0.287 -0.934 1.00 . A B . 9 ASP C 1 1 3 1801 1 1 9 ASP CA C 13.123 -0.284 0.471 1.00 . A B . 9 ASP CA 1 1 3 1802 1 1 9 ASP CB C 14.285 -1.220 0.810 1.00 . A B . 9 ASP CB 1 1 3 1803 1 1 9 ASP CG C 15.628 -0.518 0.772 1.00 . A B . 9 ASP CG 1 1 3 1804 1 1 9 ASP H H 11.838 -1.965 0.594 1.00 . A B . 9 ASP H 1 1 3 1805 1 1 9 ASP HA H 13.113 0.533 1.174 1.00 . A B . 9 ASP HA 1 1 3 1806 1 1 9 ASP HB2 H 14.138 -1.621 1.801 1.00 . A B . 9 ASP HB2 1 1 3 1807 1 1 9 ASP HB3 H 14.302 -2.033 0.100 1.00 . A B . 9 ASP HB3 1 1 3 1808 1 1 9 ASP N N 11.850 -0.986 0.590 1.00 . A B . 9 ASP N 1 1 3 1809 1 1 9 ASP O O 13.778 1.401 -1.111 1.00 . A B . 9 ASP O 1 1 3 1810 1 1 9 ASP OD1 O 15.938 0.238 1.717 1.00 . A B . 9 ASP OD1 1 1 3 1811 1 1 9 ASP OD2 O 16.382 -0.713 -0.207 1.00 . A B . 9 ASP OD2 1 1 3 1812 1 1 10 GLU C C 11.786 0.980 -3.587 1.00 . A B . 10 GLU C 1 1 3 1813 1 1 10 GLU CA C 12.899 -0.029 -3.323 1.00 . A B . 10 GLU CA 1 1 3 1814 1 1 10 GLU CB C 12.768 -1.214 -4.283 1.00 . A B . 10 GLU CB 1 1 3 1815 1 1 10 GLU CD C 15.217 -1.538 -4.806 1.00 . A B . 10 GLU CD 1 1 3 1816 1 1 10 GLU CG C 13.953 -2.166 -4.250 1.00 . A B . 10 GLU CG 1 1 3 1817 1 1 10 GLU H H 12.537 -1.384 -1.727 1.00 . A B . 10 GLU H 1 1 3 1818 1 1 10 GLU HA H 13.851 0.454 -3.487 1.00 . A B . 10 GLU HA 1 1 3 1819 1 1 10 GLU HB2 H 11.879 -1.773 -4.031 1.00 . A B . 10 GLU HB2 1 1 3 1820 1 1 10 GLU HB3 H 12.670 -0.835 -5.289 1.00 . A B . 10 GLU HB3 1 1 3 1821 1 1 10 GLU HG2 H 14.135 -2.457 -3.227 1.00 . A B . 10 GLU HG2 1 1 3 1822 1 1 10 GLU HG3 H 13.712 -3.040 -4.836 1.00 . A B . 10 GLU HG3 1 1 3 1823 1 1 10 GLU N N 12.862 -0.482 -1.931 1.00 . A B . 10 GLU N 1 1 3 1824 1 1 10 GLU O O 11.879 1.813 -4.488 1.00 . A B . 10 GLU O 1 1 3 1825 1 1 10 GLU OE1 O 15.331 -1.406 -6.042 1.00 . A B . 10 GLU OE1 1 1 3 1826 1 1 10 GLU OE2 O 16.107 -1.175 -4.008 1.00 . A B . 10 GLU OE2 1 1 3 1827 1 1 11 CYS C C 10.002 3.177 -2.391 1.00 . A B . 11 CYS C 1 1 3 1828 1 1 11 CYS CA C 9.597 1.788 -2.869 1.00 . A B . 11 CYS CA 1 1 3 1829 1 1 11 CYS CB C 8.471 1.218 -2.009 1.00 . A B . 11 CYS CB 1 1 3 1830 1 1 11 CYS H H 10.693 0.147 -2.151 1.00 . A B . 11 CYS H 1 1 3 1831 1 1 11 CYS HA H 9.270 1.845 -3.896 1.00 . A B . 11 CYS HA 1 1 3 1832 1 1 11 CYS HB2 H 8.176 0.268 -2.420 1.00 . A B . 11 CYS HB2 1 1 3 1833 1 1 11 CYS HB3 H 8.855 1.057 -1.012 1.00 . A B . 11 CYS HB3 1 1 3 1834 1 1 11 CYS N N 10.727 0.877 -2.799 1.00 . A B . 11 CYS N 1 1 3 1835 1 1 11 CYS O O 10.051 3.449 -1.187 1.00 . A B . 11 CYS O 1 1 3 1836 1 1 11 CYS SG S 6.965 2.214 -1.851 1.00 . A B . 11 CYS SG 1 1 3 1837 1 1 12 GLU C C 9.559 6.147 -2.310 1.00 . A B . 12 GLU C 1 1 3 1838 1 1 12 GLU CA C 10.671 5.427 -3.050 1.00 . A B . 12 GLU CA 1 1 3 1839 1 1 12 GLU CB C 11.004 6.182 -4.332 1.00 . A B . 12 GLU CB 1 1 3 1840 1 1 12 GLU CD C 13.467 5.671 -4.204 1.00 . A B . 12 GLU CD 1 1 3 1841 1 1 12 GLU CG C 12.220 5.637 -5.060 1.00 . A B . 12 GLU CG 1 1 3 1842 1 1 12 GLU H H 10.239 3.764 -4.281 1.00 . A B . 12 GLU H 1 1 3 1843 1 1 12 GLU HA H 11.545 5.400 -2.421 1.00 . A B . 12 GLU HA 1 1 3 1844 1 1 12 GLU HB2 H 10.154 6.127 -4.995 1.00 . A B . 12 GLU HB2 1 1 3 1845 1 1 12 GLU HB3 H 11.192 7.216 -4.087 1.00 . A B . 12 GLU HB3 1 1 3 1846 1 1 12 GLU HG2 H 12.026 4.615 -5.343 1.00 . A B . 12 GLU HG2 1 1 3 1847 1 1 12 GLU HG3 H 12.391 6.230 -5.947 1.00 . A B . 12 GLU HG3 1 1 3 1848 1 1 12 GLU N N 10.286 4.054 -3.346 1.00 . A B . 12 GLU N 1 1 3 1849 1 1 12 GLU O O 9.800 7.109 -1.583 1.00 . A B . 12 GLU O 1 1 3 1850 1 1 12 GLU OE1 O 13.940 6.781 -3.879 1.00 . A B . 12 GLU OE1 1 1 3 1851 1 1 12 GLU OE2 O 13.982 4.587 -3.851 1.00 . A B . 12 GLU OE2 1 1 3 1852 1 1 13 VAL C C 7.273 6.027 -0.339 1.00 . A B . 13 VAL C 1 1 3 1853 1 1 13 VAL CA C 7.189 6.243 -1.841 1.00 . A B . 13 VAL CA 1 1 3 1854 1 1 13 VAL CB C 5.882 5.638 -2.376 1.00 . A B . 13 VAL CB 1 1 3 1855 1 1 13 VAL CG1 C 4.679 6.315 -1.746 1.00 . A B . 13 VAL CG1 1 1 3 1856 1 1 13 VAL CG2 C 5.823 5.740 -3.886 1.00 . A B . 13 VAL CG2 1 1 3 1857 1 1 13 VAL H H 8.218 4.876 -3.063 1.00 . A B . 13 VAL H 1 1 3 1858 1 1 13 VAL HA H 7.189 7.300 -2.048 1.00 . A B . 13 VAL HA 1 1 3 1859 1 1 13 VAL HB H 5.861 4.593 -2.108 1.00 . A B . 13 VAL HB 1 1 3 1860 1 1 13 VAL HG11 H 4.630 6.052 -0.702 1.00 . A B . 13 VAL HG11 1 1 3 1861 1 1 13 VAL HG12 H 3.782 5.991 -2.244 1.00 . A B . 13 VAL HG12 1 1 3 1862 1 1 13 VAL HG13 H 4.779 7.385 -1.844 1.00 . A B . 13 VAL HG13 1 1 3 1863 1 1 13 VAL HG21 H 5.915 6.775 -4.178 1.00 . A B . 13 VAL HG21 1 1 3 1864 1 1 13 VAL HG22 H 4.879 5.349 -4.237 1.00 . A B . 13 VAL HG22 1 1 3 1865 1 1 13 VAL HG23 H 6.632 5.171 -4.315 1.00 . A B . 13 VAL HG23 1 1 3 1866 1 1 13 VAL N N 8.342 5.660 -2.489 1.00 . A B . 13 VAL N 1 1 3 1867 1 1 13 VAL O O 7.086 6.955 0.442 1.00 . A B . 13 VAL O 1 1 3 1868 1 1 14 CYS C C 8.919 5.247 2.065 1.00 . A B . 14 CYS C 1 1 3 1869 1 1 14 CYS CA C 7.751 4.474 1.468 1.00 . A B . 14 CYS CA 1 1 3 1870 1 1 14 CYS CB C 7.963 2.976 1.660 1.00 . A B . 14 CYS CB 1 1 3 1871 1 1 14 CYS H H 7.718 4.098 -0.618 1.00 . A B . 14 CYS H 1 1 3 1872 1 1 14 CYS HA H 6.847 4.768 1.978 1.00 . A B . 14 CYS HA 1 1 3 1873 1 1 14 CYS HB2 H 8.486 2.584 0.802 1.00 . A B . 14 CYS HB2 1 1 3 1874 1 1 14 CYS HB3 H 8.562 2.818 2.544 1.00 . A B . 14 CYS HB3 1 1 3 1875 1 1 14 CYS N N 7.586 4.799 0.057 1.00 . A B . 14 CYS N 1 1 3 1876 1 1 14 CYS O O 8.873 5.670 3.219 1.00 . A B . 14 CYS O 1 1 3 1877 1 1 14 CYS SG S 6.433 2.033 1.852 1.00 . A B . 14 CYS SG 1 1 3 1878 1 1 15 ARG C C 10.749 7.654 1.930 1.00 . A B . 15 ARG C 1 1 3 1879 1 1 15 ARG CA C 11.122 6.197 1.709 1.00 . A B . 15 ARG CA 1 1 3 1880 1 1 15 ARG CB C 12.254 6.100 0.687 1.00 . A B . 15 ARG CB 1 1 3 1881 1 1 15 ARG CD C 13.843 4.641 -0.604 1.00 . A B . 15 ARG CD 1 1 3 1882 1 1 15 ARG CG C 12.755 4.684 0.458 1.00 . A B . 15 ARG CG 1 1 3 1883 1 1 15 ARG CZ C 16.124 5.531 -0.959 1.00 . A B . 15 ARG CZ 1 1 3 1884 1 1 15 ARG H H 9.928 5.077 0.354 1.00 . A B . 15 ARG H 1 1 3 1885 1 1 15 ARG HA H 11.450 5.775 2.644 1.00 . A B . 15 ARG HA 1 1 3 1886 1 1 15 ARG HB2 H 11.904 6.491 -0.256 1.00 . A B . 15 ARG HB2 1 1 3 1887 1 1 15 ARG HB3 H 13.083 6.700 1.030 1.00 . A B . 15 ARG HB3 1 1 3 1888 1 1 15 ARG HD2 H 14.057 3.610 -0.839 1.00 . A B . 15 ARG HD2 1 1 3 1889 1 1 15 ARG HD3 H 13.481 5.144 -1.489 1.00 . A B . 15 ARG HD3 1 1 3 1890 1 1 15 ARG HE H 15.139 5.544 0.789 1.00 . A B . 15 ARG HE 1 1 3 1891 1 1 15 ARG HG2 H 13.158 4.302 1.384 1.00 . A B . 15 ARG HG2 1 1 3 1892 1 1 15 ARG HG3 H 11.926 4.068 0.143 1.00 . A B . 15 ARG HG3 1 1 3 1893 1 1 15 ARG HH11 H 15.201 4.888 -2.654 1.00 . A B . 15 ARG HH11 1 1 3 1894 1 1 15 ARG HH12 H 16.838 5.443 -2.852 1.00 . A B . 15 ARG HH12 1 1 3 1895 1 1 15 ARG HH21 H 17.295 6.287 0.516 1.00 . A B . 15 ARG HH21 1 1 3 1896 1 1 15 ARG HH22 H 18.021 6.237 -1.058 1.00 . A B . 15 ARG HH22 1 1 3 1897 1 1 15 ARG N N 9.956 5.446 1.263 1.00 . A B . 15 ARG N 1 1 3 1898 1 1 15 ARG NE N 15.079 5.292 -0.162 1.00 . A B . 15 ARG NE 1 1 3 1899 1 1 15 ARG NH1 N 16.052 5.266 -2.256 1.00 . A B . 15 ARG NH1 1 1 3 1900 1 1 15 ARG NH2 N 17.235 6.061 -0.461 1.00 . A B . 15 ARG NH2 1 1 3 1901 1 1 15 ARG O O 11.227 8.301 2.860 1.00 . A B . 15 ARG O 1 1 3 1902 1 1 16 ASP C C 8.405 9.655 2.355 1.00 . A B . 16 ASP C 1 1 3 1903 1 1 16 ASP CA C 9.377 9.518 1.181 1.00 . A B . 16 ASP CA 1 1 3 1904 1 1 16 ASP CB C 8.701 9.923 -0.132 1.00 . A B . 16 ASP CB 1 1 3 1905 1 1 16 ASP CG C 8.182 11.344 -0.119 1.00 . A B . 16 ASP CG 1 1 3 1906 1 1 16 ASP H H 9.641 7.621 0.275 1.00 . A B . 16 ASP H 1 1 3 1907 1 1 16 ASP HA H 10.219 10.168 1.355 1.00 . A B . 16 ASP HA 1 1 3 1908 1 1 16 ASP HB2 H 9.416 9.834 -0.933 1.00 . A B . 16 ASP HB2 1 1 3 1909 1 1 16 ASP HB3 H 7.873 9.258 -0.324 1.00 . A B . 16 ASP HB3 1 1 3 1910 1 1 16 ASP N N 9.886 8.157 1.063 1.00 . A B . 16 ASP N 1 1 3 1911 1 1 16 ASP O O 8.113 10.762 2.808 1.00 . A B . 16 ASP O 1 1 3 1912 1 1 16 ASP OD1 O 9.005 12.282 -0.134 1.00 . A B . 16 ASP OD1 1 1 3 1913 1 1 16 ASP OD2 O 6.949 11.532 -0.115 1.00 . A B . 16 ASP OD2 1 1 3 1914 1 1 17 GLY C C 5.575 8.297 3.572 1.00 . A B . 17 GLY C 1 1 3 1915 1 1 17 GLY CA C 7.011 8.550 3.988 1.00 . A B . 17 GLY CA 1 1 3 1916 1 1 17 GLY H H 8.224 7.669 2.489 1.00 . A B . 17 GLY H 1 1 3 1917 1 1 17 GLY HA2 H 7.307 7.791 4.698 1.00 . A B . 17 GLY HA2 1 1 3 1918 1 1 17 GLY HA3 H 7.071 9.517 4.467 1.00 . A B . 17 GLY HA3 1 1 3 1919 1 1 17 GLY N N 7.934 8.526 2.867 1.00 . A B . 17 GLY N 1 1 3 1920 1 1 17 GLY O O 4.642 8.560 4.337 1.00 . A B . 17 GLY O 1 1 3 1921 1 1 18 GLY C C 3.382 6.406 2.678 1.00 . A B . 18 GLY C 1 1 3 1922 1 1 18 GLY CA C 4.069 7.480 1.861 1.00 . A B . 18 GLY CA 1 1 3 1923 1 1 18 GLY H H 6.178 7.653 1.779 1.00 . A B . 18 GLY H 1 1 3 1924 1 1 18 GLY HA2 H 3.465 8.373 1.885 1.00 . A B . 18 GLY HA2 1 1 3 1925 1 1 18 GLY HA3 H 4.149 7.143 0.841 1.00 . A B . 18 GLY HA3 1 1 3 1926 1 1 18 GLY N N 5.395 7.797 2.355 1.00 . A B . 18 GLY N 1 1 3 1927 1 1 18 GLY O O 4.033 5.497 3.202 1.00 . A B . 18 GLY O 1 1 3 1928 1 1 19 GLU C C 0.728 4.444 2.758 1.00 . A B . 19 GLU C 1 1 3 1929 1 1 19 GLU CA C 1.281 5.593 3.592 1.00 . A B . 19 GLU CA 1 1 3 1930 1 1 19 GLU CB C 0.137 6.353 4.268 1.00 . A B . 19 GLU CB 1 1 3 1931 1 1 19 GLU CD C -0.531 7.998 6.064 1.00 . A B . 19 GLU CD 1 1 3 1932 1 1 19 GLU CG C 0.603 7.426 5.242 1.00 . A B . 19 GLU CG 1 1 3 1933 1 1 19 GLU H H 1.605 7.199 2.260 1.00 . A B . 19 GLU H 1 1 3 1934 1 1 19 GLU HA H 1.931 5.187 4.351 1.00 . A B . 19 GLU HA 1 1 3 1935 1 1 19 GLU HB2 H -0.456 6.830 3.502 1.00 . A B . 19 GLU HB2 1 1 3 1936 1 1 19 GLU HB3 H -0.484 5.649 4.804 1.00 . A B . 19 GLU HB3 1 1 3 1937 1 1 19 GLU HG2 H 1.332 6.998 5.916 1.00 . A B . 19 GLU HG2 1 1 3 1938 1 1 19 GLU HG3 H 1.062 8.229 4.683 1.00 . A B . 19 GLU HG3 1 1 3 1939 1 1 19 GLU N N 2.066 6.504 2.771 1.00 . A B . 19 GLU N 1 1 3 1940 1 1 19 GLU O O 0.745 4.489 1.528 1.00 . A B . 19 GLU O 1 1 3 1941 1 1 19 GLU OE1 O -1.188 8.952 5.593 1.00 . A B . 19 GLU OE1 1 1 3 1942 1 1 19 GLU OE2 O -0.782 7.494 7.180 1.00 . A B . 19 GLU OE2 1 1 3 1943 1 1 20 LEU C C -1.821 2.185 3.013 1.00 . A B . 20 LEU C 1 1 3 1944 1 1 20 LEU CA C -0.317 2.242 2.798 1.00 . A B . 20 LEU CA 1 1 3 1945 1 1 20 LEU CB C 0.324 0.973 3.356 1.00 . A B . 20 LEU CB 1 1 3 1946 1 1 20 LEU CD1 C 2.385 -0.409 3.644 1.00 . A B . 20 LEU CD1 1 1 3 1947 1 1 20 LEU CD2 C 1.519 0.072 1.350 1.00 . A B . 20 LEU CD2 1 1 3 1948 1 1 20 LEU CG C 1.684 0.613 2.765 1.00 . A B . 20 LEU CG 1 1 3 1949 1 1 20 LEU H H 0.269 3.452 4.424 1.00 . A B . 20 LEU H 1 1 3 1950 1 1 20 LEU HA H -0.112 2.308 1.741 1.00 . A B . 20 LEU HA 1 1 3 1951 1 1 20 LEU HB2 H 0.440 1.096 4.423 1.00 . A B . 20 LEU HB2 1 1 3 1952 1 1 20 LEU HB3 H -0.351 0.150 3.179 1.00 . A B . 20 LEU HB3 1 1 3 1953 1 1 20 LEU HD11 H 3.288 -0.744 3.157 1.00 . A B . 20 LEU HD11 1 1 3 1954 1 1 20 LEU HD12 H 1.730 -1.249 3.813 1.00 . A B . 20 LEU HD12 1 1 3 1955 1 1 20 LEU HD13 H 2.636 0.045 4.592 1.00 . A B . 20 LEU HD13 1 1 3 1956 1 1 20 LEU HD21 H 1.179 0.862 0.696 1.00 . A B . 20 LEU HD21 1 1 3 1957 1 1 20 LEU HD22 H 0.796 -0.727 1.351 1.00 . A B . 20 LEU HD22 1 1 3 1958 1 1 20 LEU HD23 H 2.469 -0.303 0.995 1.00 . A B . 20 LEU HD23 1 1 3 1959 1 1 20 LEU HG H 2.300 1.500 2.720 1.00 . A B . 20 LEU HG 1 1 3 1960 1 1 20 LEU N N 0.249 3.417 3.444 1.00 . A B . 20 LEU N 1 1 3 1961 1 1 20 LEU O O -2.299 2.360 4.131 1.00 . A B . 20 LEU O 1 1 3 1962 1 1 21 PHE C C -4.494 0.436 1.879 1.00 . A B . 21 PHE C 1 1 3 1963 1 1 21 PHE CA C -4.013 1.880 2.018 1.00 . A B . 21 PHE CA 1 1 3 1964 1 1 21 PHE CB C -4.608 2.769 0.916 1.00 . A B . 21 PHE CB 1 1 3 1965 1 1 21 PHE CD1 C -4.136 5.061 1.827 1.00 . A B . 21 PHE CD1 1 1 3 1966 1 1 21 PHE CD2 C -3.133 4.444 -0.246 1.00 . A B . 21 PHE CD2 1 1 3 1967 1 1 21 PHE CE1 C -3.549 6.308 1.741 1.00 . A B . 21 PHE CE1 1 1 3 1968 1 1 21 PHE CE2 C -2.541 5.686 -0.333 1.00 . A B . 21 PHE CE2 1 1 3 1969 1 1 21 PHE CG C -3.935 4.113 0.836 1.00 . A B . 21 PHE CG 1 1 3 1970 1 1 21 PHE CZ C -2.635 6.566 0.714 1.00 . A B . 21 PHE CZ 1 1 3 1971 1 1 21 PHE H H -2.115 1.795 1.078 1.00 . A B . 21 PHE H 1 1 3 1972 1 1 21 PHE HA H -4.313 2.258 2.986 1.00 . A B . 21 PHE HA 1 1 3 1973 1 1 21 PHE HB2 H -4.486 2.279 -0.041 1.00 . A B . 21 PHE HB2 1 1 3 1974 1 1 21 PHE HB3 H -5.662 2.928 1.107 1.00 . A B . 21 PHE HB3 1 1 3 1975 1 1 21 PHE HD1 H -4.755 4.816 2.677 1.00 . A B . 21 PHE HD1 1 1 3 1976 1 1 21 PHE HD2 H -2.964 3.716 -1.026 1.00 . A B . 21 PHE HD2 1 1 3 1977 1 1 21 PHE HE1 H -3.714 7.037 2.521 1.00 . A B . 21 PHE HE1 1 1 3 1978 1 1 21 PHE HE2 H -1.919 5.930 -1.181 1.00 . A B . 21 PHE HE2 1 1 3 1979 1 1 21 PHE HZ H -2.129 7.520 0.669 1.00 . A B . 21 PHE HZ 1 1 3 1980 1 1 21 PHE N N -2.559 1.932 1.946 1.00 . A B . 21 PHE N 1 1 3 1981 1 1 21 PHE O O -5.495 0.153 1.218 1.00 . A B . 21 PHE O 1 1 3 1982 1 1 22 CYS C C -3.777 -2.634 3.718 1.00 . A B . 22 CYS C 1 1 3 1983 1 1 22 CYS CA C -4.042 -1.901 2.396 1.00 . A B . 22 CYS CA 1 1 3 1984 1 1 22 CYS CB C -3.185 -2.497 1.277 1.00 . A B . 22 CYS CB 1 1 3 1985 1 1 22 CYS H H -2.969 -0.181 3.005 1.00 . A B . 22 CYS H 1 1 3 1986 1 1 22 CYS HA H -5.081 -2.011 2.135 1.00 . A B . 22 CYS HA 1 1 3 1987 1 1 22 CYS HB2 H -2.180 -2.100 1.361 1.00 . A B . 22 CYS HB2 1 1 3 1988 1 1 22 CYS HB3 H -3.148 -3.568 1.385 1.00 . A B . 22 CYS HB3 1 1 3 1989 1 1 22 CYS N N -3.752 -0.476 2.498 1.00 . A B . 22 CYS N 1 1 3 1990 1 1 22 CYS O O -3.163 -2.079 4.633 1.00 . A B . 22 CYS O 1 1 3 1991 1 1 22 CYS SG S -3.776 -2.123 -0.401 1.00 . A B . 22 CYS SG 1 1 3 1992 1 1 23 CYS C C -2.547 -5.213 4.936 1.00 . A B . 23 CYS C 1 1 3 1993 1 1 23 CYS CA C -3.999 -4.740 4.973 1.00 . A B . 23 CYS CA 1 1 3 1994 1 1 23 CYS CB C -4.909 -5.977 4.954 1.00 . A B . 23 CYS CB 1 1 3 1995 1 1 23 CYS H H -4.821 -4.220 3.090 1.00 . A B . 23 CYS H 1 1 3 1996 1 1 23 CYS HA H -4.173 -4.172 5.876 1.00 . A B . 23 CYS HA 1 1 3 1997 1 1 23 CYS HB2 H -4.557 -6.659 4.191 1.00 . A B . 23 CYS HB2 1 1 3 1998 1 1 23 CYS HB3 H -4.857 -6.469 5.917 1.00 . A B . 23 CYS HB3 1 1 3 1999 1 1 23 CYS N N -4.268 -3.877 3.815 1.00 . A B . 23 CYS N 1 1 3 2000 1 1 23 CYS O O -1.895 -5.071 3.909 1.00 . A B . 23 CYS O 1 1 3 2001 1 1 23 CYS SG S -6.645 -5.639 4.606 1.00 . A B . 23 CYS SG 1 1 3 2002 1 1 24 ASP C C -0.422 -7.228 4.866 1.00 . A B . 24 ASP C 1 1 3 2003 1 1 24 ASP CA C -0.687 -6.332 6.071 1.00 . A B . 24 ASP CA 1 1 3 2004 1 1 24 ASP CB C -0.441 -7.132 7.356 1.00 . A B . 24 ASP CB 1 1 3 2005 1 1 24 ASP CG C -0.317 -6.258 8.584 1.00 . A B . 24 ASP CG 1 1 3 2006 1 1 24 ASP H H -2.602 -5.825 6.846 1.00 . A B . 24 ASP H 1 1 3 2007 1 1 24 ASP HA H 0.001 -5.501 6.041 1.00 . A B . 24 ASP HA 1 1 3 2008 1 1 24 ASP HB2 H -1.261 -7.816 7.511 1.00 . A B . 24 ASP HB2 1 1 3 2009 1 1 24 ASP HB3 H 0.473 -7.697 7.246 1.00 . A B . 24 ASP HB3 1 1 3 2010 1 1 24 ASP N N -2.052 -5.785 6.034 1.00 . A B . 24 ASP N 1 1 3 2011 1 1 24 ASP O O 0.523 -7.003 4.109 1.00 . A B . 24 ASP O 1 1 3 2012 1 1 24 ASP OD1 O -1.356 -5.845 9.135 1.00 . A B . 24 ASP OD1 1 1 3 2013 1 1 24 ASP OD2 O 0.821 -5.972 9.004 1.00 . A B . 24 ASP OD2 1 1 3 2014 1 1 25 THR C C -1.271 -8.446 2.232 1.00 . A B . 25 THR C 1 1 3 2015 1 1 25 THR CA C -1.134 -9.161 3.579 1.00 . A B . 25 THR CA 1 1 3 2016 1 1 25 THR CB C -2.185 -10.282 3.679 1.00 . A B . 25 THR CB 1 1 3 2017 1 1 25 THR CG2 C -1.992 -11.321 2.585 1.00 . A B . 25 THR CG2 1 1 3 2018 1 1 25 THR H H -2.007 -8.350 5.325 1.00 . A B . 25 THR H 1 1 3 2019 1 1 25 THR HA H -0.155 -9.606 3.643 1.00 . A B . 25 THR HA 1 1 3 2020 1 1 25 THR HB H -3.166 -9.845 3.574 1.00 . A B . 25 THR HB 1 1 3 2021 1 1 25 THR HG1 H -1.224 -10.733 5.344 1.00 . A B . 25 THR HG1 1 1 3 2022 1 1 25 THR HG21 H -2.076 -10.846 1.619 1.00 . A B . 25 THR HG21 1 1 3 2023 1 1 25 THR HG22 H -2.750 -12.086 2.677 1.00 . A B . 25 THR HG22 1 1 3 2024 1 1 25 THR HG23 H -1.015 -11.768 2.682 1.00 . A B . 25 THR HG23 1 1 3 2025 1 1 25 THR N N -1.272 -8.229 4.686 1.00 . A B . 25 THR N 1 1 3 2026 1 1 25 THR O O -0.425 -8.595 1.350 1.00 . A B . 25 THR O 1 1 3 2027 1 1 25 THR OG1 O -2.092 -10.914 4.963 1.00 . A B . 25 THR OG1 1 1 3 2028 1 1 26 CYS C C -1.472 -6.015 0.447 1.00 . A B . 26 CYS C 1 1 3 2029 1 1 26 CYS CA C -2.610 -6.965 0.839 1.00 . A B . 26 CYS CA 1 1 3 2030 1 1 26 CYS CB C -3.936 -6.203 0.952 1.00 . A B . 26 CYS CB 1 1 3 2031 1 1 26 CYS H H -2.915 -7.505 2.860 1.00 . A B . 26 CYS H 1 1 3 2032 1 1 26 CYS HA H -2.705 -7.721 0.074 1.00 . A B . 26 CYS HA 1 1 3 2033 1 1 26 CYS HB2 H -3.835 -5.432 1.696 1.00 . A B . 26 CYS HB2 1 1 3 2034 1 1 26 CYS HB3 H -4.172 -5.754 -0.002 1.00 . A B . 26 CYS HB3 1 1 3 2035 1 1 26 CYS N N -2.321 -7.645 2.096 1.00 . A B . 26 CYS N 1 1 3 2036 1 1 26 CYS O O -1.068 -5.964 -0.713 1.00 . A B . 26 CYS O 1 1 3 2037 1 1 26 CYS SG S -5.337 -7.235 1.441 1.00 . A B . 26 CYS SG 1 1 3 2038 1 1 27 SER C C 1.425 -5.022 0.773 1.00 . A B . 27 SER C 1 1 3 2039 1 1 27 SER CA C 0.136 -4.336 1.202 1.00 . A B . 27 SER CA 1 1 3 2040 1 1 27 SER CB C 0.406 -3.530 2.470 1.00 . A B . 27 SER CB 1 1 3 2041 1 1 27 SER H H -1.311 -5.396 2.336 1.00 . A B . 27 SER H 1 1 3 2042 1 1 27 SER HA H -0.176 -3.664 0.419 1.00 . A B . 27 SER HA 1 1 3 2043 1 1 27 SER HB2 H 0.577 -4.209 3.291 1.00 . A B . 27 SER HB2 1 1 3 2044 1 1 27 SER HB3 H 1.282 -2.921 2.321 1.00 . A B . 27 SER HB3 1 1 3 2045 1 1 27 SER HG H -0.518 -2.274 3.650 1.00 . A B . 27 SER HG 1 1 3 2046 1 1 27 SER N N -0.946 -5.291 1.429 1.00 . A B . 27 SER N 1 1 3 2047 1 1 27 SER O O 2.251 -4.427 0.092 1.00 . A B . 27 SER O 1 1 3 2048 1 1 27 SER OG O -0.686 -2.693 2.799 1.00 . A B . 27 SER OG 1 1 3 2049 1 1 28 ARG C C 2.715 -7.709 -0.449 1.00 . A B . 28 ARG C 1 1 3 2050 1 1 28 ARG CA C 2.829 -6.980 0.886 1.00 . A B . 28 ARG CA 1 1 3 2051 1 1 28 ARG CB C 3.182 -7.923 2.035 1.00 . A B . 28 ARG CB 1 1 3 2052 1 1 28 ARG CD C 3.737 -8.054 4.505 1.00 . A B . 28 ARG CD 1 1 3 2053 1 1 28 ARG CG C 3.595 -7.161 3.287 1.00 . A B . 28 ARG CG 1 1 3 2054 1 1 28 ARG CZ C 3.659 -7.631 6.941 1.00 . A B . 28 ARG CZ 1 1 3 2055 1 1 28 ARG H H 0.921 -6.687 1.746 1.00 . A B . 28 ARG H 1 1 3 2056 1 1 28 ARG HA H 3.616 -6.246 0.795 1.00 . A B . 28 ARG HA 1 1 3 2057 1 1 28 ARG HB2 H 2.321 -8.532 2.268 1.00 . A B . 28 ARG HB2 1 1 3 2058 1 1 28 ARG HB3 H 4.002 -8.560 1.735 1.00 . A B . 28 ARG HB3 1 1 3 2059 1 1 28 ARG HD2 H 2.821 -8.609 4.641 1.00 . A B . 28 ARG HD2 1 1 3 2060 1 1 28 ARG HD3 H 4.556 -8.739 4.345 1.00 . A B . 28 ARG HD3 1 1 3 2061 1 1 28 ARG HE H 4.439 -6.390 5.579 1.00 . A B . 28 ARG HE 1 1 3 2062 1 1 28 ARG HG2 H 4.543 -6.679 3.103 1.00 . A B . 28 ARG HG2 1 1 3 2063 1 1 28 ARG HG3 H 2.848 -6.407 3.495 1.00 . A B . 28 ARG HG3 1 1 3 2064 1 1 28 ARG HH11 H 2.925 -9.437 6.384 1.00 . A B . 28 ARG HH11 1 1 3 2065 1 1 28 ARG HH12 H 2.823 -9.089 8.079 1.00 . A B . 28 ARG HH12 1 1 3 2066 1 1 28 ARG HH21 H 4.324 -5.924 7.813 1.00 . A B . 28 ARG HH21 1 1 3 2067 1 1 28 ARG HH22 H 3.625 -7.087 8.892 1.00 . A B . 28 ARG HH22 1 1 3 2068 1 1 28 ARG N N 1.611 -6.256 1.198 1.00 . A B . 28 ARG N 1 1 3 2069 1 1 28 ARG NE N 4.001 -7.262 5.708 1.00 . A B . 28 ARG NE 1 1 3 2070 1 1 28 ARG NH1 N 3.092 -8.815 7.153 1.00 . A B . 28 ARG NH1 1 1 3 2071 1 1 28 ARG NH2 N 3.891 -6.817 7.964 1.00 . A B . 28 ARG NH2 1 1 3 2072 1 1 28 ARG O O 3.724 -8.113 -1.033 1.00 . A B . 28 ARG O 1 1 3 2073 1 1 29 VAL C C 1.142 -7.399 -3.309 1.00 . A B . 29 VAL C 1 1 3 2074 1 1 29 VAL CA C 1.264 -8.485 -2.233 1.00 . A B . 29 VAL CA 1 1 3 2075 1 1 29 VAL CB C 0.001 -9.380 -2.249 1.00 . A B . 29 VAL CB 1 1 3 2076 1 1 29 VAL CG1 C -0.204 -10.007 -3.620 1.00 . A B . 29 VAL CG1 1 1 3 2077 1 1 29 VAL CG2 C 0.098 -10.463 -1.186 1.00 . A B . 29 VAL CG2 1 1 3 2078 1 1 29 VAL H H 0.712 -7.668 -0.364 1.00 . A B . 29 VAL H 1 1 3 2079 1 1 29 VAL HA H 2.116 -9.105 -2.464 1.00 . A B . 29 VAL HA 1 1 3 2080 1 1 29 VAL HB H -0.856 -8.763 -2.026 1.00 . A B . 29 VAL HB 1 1 3 2081 1 1 29 VAL HG11 H 0.656 -10.611 -3.871 1.00 . A B . 29 VAL HG11 1 1 3 2082 1 1 29 VAL HG12 H -0.326 -9.229 -4.358 1.00 . A B . 29 VAL HG12 1 1 3 2083 1 1 29 VAL HG13 H -1.086 -10.629 -3.601 1.00 . A B . 29 VAL HG13 1 1 3 2084 1 1 29 VAL HG21 H 0.972 -11.070 -1.372 1.00 . A B . 29 VAL HG21 1 1 3 2085 1 1 29 VAL HG22 H -0.786 -11.082 -1.223 1.00 . A B . 29 VAL HG22 1 1 3 2086 1 1 29 VAL HG23 H 0.179 -10.006 -0.212 1.00 . A B . 29 VAL HG23 1 1 3 2087 1 1 29 VAL N N 1.488 -7.899 -0.918 1.00 . A B . 29 VAL N 1 1 3 2088 1 1 29 VAL O O 1.771 -7.489 -4.365 1.00 . A B . 29 VAL O 1 1 3 2089 1 1 30 PHE C C 0.725 -3.989 -3.525 1.00 . A B . 30 PHE C 1 1 3 2090 1 1 30 PHE CA C 0.118 -5.301 -4.010 1.00 . A B . 30 PHE CA 1 1 3 2091 1 1 30 PHE CB C -1.387 -5.091 -4.251 1.00 . A B . 30 PHE CB 1 1 3 2092 1 1 30 PHE CD1 C -1.957 -7.053 -5.725 1.00 . A B . 30 PHE CD1 1 1 3 2093 1 1 30 PHE CD2 C -3.110 -6.814 -3.650 1.00 . A B . 30 PHE CD2 1 1 3 2094 1 1 30 PHE CE1 C -2.680 -8.199 -5.995 1.00 . A B . 30 PHE CE1 1 1 3 2095 1 1 30 PHE CE2 C -3.834 -7.961 -3.915 1.00 . A B . 30 PHE CE2 1 1 3 2096 1 1 30 PHE CG C -2.162 -6.347 -4.548 1.00 . A B . 30 PHE CG 1 1 3 2097 1 1 30 PHE CZ C -3.617 -8.655 -5.089 1.00 . A B . 30 PHE CZ 1 1 3 2098 1 1 30 PHE H H -0.082 -6.309 -2.150 1.00 . A B . 30 PHE H 1 1 3 2099 1 1 30 PHE HA H 0.593 -5.588 -4.936 1.00 . A B . 30 PHE HA 1 1 3 2100 1 1 30 PHE HB2 H -1.821 -4.640 -3.369 1.00 . A B . 30 PHE HB2 1 1 3 2101 1 1 30 PHE HB3 H -1.514 -4.416 -5.087 1.00 . A B . 30 PHE HB3 1 1 3 2102 1 1 30 PHE HD1 H -1.224 -6.702 -6.434 1.00 . A B . 30 PHE HD1 1 1 3 2103 1 1 30 PHE HD2 H -3.284 -6.271 -2.733 1.00 . A B . 30 PHE HD2 1 1 3 2104 1 1 30 PHE HE1 H -2.511 -8.739 -6.915 1.00 . A B . 30 PHE HE1 1 1 3 2105 1 1 30 PHE HE2 H -4.566 -8.314 -3.204 1.00 . A B . 30 PHE HE2 1 1 3 2106 1 1 30 PHE HZ H -4.183 -9.552 -5.301 1.00 . A B . 30 PHE HZ 1 1 3 2107 1 1 30 PHE N N 0.353 -6.365 -3.033 1.00 . A B . 30 PHE N 1 1 3 2108 1 1 30 PHE O O 0.090 -2.944 -3.614 1.00 . A B . 30 PHE O 1 1 3 2109 1 1 31 HIS C C 2.546 -1.643 -3.247 1.00 . A B . 31 HIS C 1 1 3 2110 1 1 31 HIS CA C 2.595 -2.900 -2.386 1.00 . A B . 31 HIS CA 1 1 3 2111 1 1 31 HIS CB C 4.047 -3.247 -2.053 1.00 . A B . 31 HIS CB 1 1 3 2112 1 1 31 HIS CD2 C 5.821 -1.458 -1.418 1.00 . A B . 31 HIS CD2 1 1 3 2113 1 1 31 HIS CE1 C 5.281 -1.140 0.653 1.00 . A B . 31 HIS CE1 1 1 3 2114 1 1 31 HIS CG C 4.748 -2.253 -1.168 1.00 . A B . 31 HIS CG 1 1 3 2115 1 1 31 HIS H H 2.456 -4.888 -3.111 1.00 . A B . 31 HIS H 1 1 3 2116 1 1 31 HIS HA H 2.064 -2.708 -1.467 1.00 . A B . 31 HIS HA 1 1 3 2117 1 1 31 HIS HB2 H 4.066 -4.201 -1.548 1.00 . A B . 31 HIS HB2 1 1 3 2118 1 1 31 HIS HB3 H 4.605 -3.325 -2.975 1.00 . A B . 31 HIS HB3 1 1 3 2119 1 1 31 HIS HD1 H 3.677 -2.466 0.635 1.00 . A B . 31 HIS HD1 1 1 3 2120 1 1 31 HIS HD2 H 6.323 -1.352 -2.369 1.00 . A B . 31 HIS HD2 1 1 3 2121 1 1 31 HIS HE1 H 5.263 -0.779 1.671 1.00 . A B . 31 HIS HE1 1 1 3 2122 1 1 31 HIS N N 1.957 -4.048 -3.036 1.00 . A B . 31 HIS N 1 1 3 2123 1 1 31 HIS ND1 N 4.417 -2.038 0.150 1.00 . A B . 31 HIS ND1 1 1 3 2124 1 1 31 HIS NE2 N 6.159 -0.757 -0.257 1.00 . A B . 31 HIS NE2 1 1 3 2125 1 1 31 HIS O O 2.077 -0.604 -2.804 1.00 . A B . 31 HIS O 1 1 3 2126 1 1 32 GLU C C 1.736 -0.031 -5.718 1.00 . A B . 32 GLU C 1 1 3 2127 1 1 32 GLU CA C 3.099 -0.611 -5.375 1.00 . A B . 32 GLU CA 1 1 3 2128 1 1 32 GLU CB C 3.830 -1.012 -6.652 1.00 . A B . 32 GLU CB 1 1 3 2129 1 1 32 GLU CD C 5.850 -2.147 -7.628 1.00 . A B . 32 GLU CD 1 1 3 2130 1 1 32 GLU CG C 5.260 -1.465 -6.419 1.00 . A B . 32 GLU CG 1 1 3 2131 1 1 32 GLU H H 3.160 -2.659 -4.843 1.00 . A B . 32 GLU H 1 1 3 2132 1 1 32 GLU HA H 3.678 0.138 -4.856 1.00 . A B . 32 GLU HA 1 1 3 2133 1 1 32 GLU HB2 H 3.289 -1.822 -7.119 1.00 . A B . 32 GLU HB2 1 1 3 2134 1 1 32 GLU HB3 H 3.846 -0.167 -7.323 1.00 . A B . 32 GLU HB3 1 1 3 2135 1 1 32 GLU HG2 H 5.864 -0.601 -6.183 1.00 . A B . 32 GLU HG2 1 1 3 2136 1 1 32 GLU HG3 H 5.281 -2.153 -5.589 1.00 . A B . 32 GLU HG3 1 1 3 2137 1 1 32 GLU N N 2.964 -1.767 -4.495 1.00 . A B . 32 GLU N 1 1 3 2138 1 1 32 GLU O O 1.580 1.181 -5.867 1.00 . A B . 32 GLU O 1 1 3 2139 1 1 32 GLU OE1 O 6.434 -1.449 -8.485 1.00 . A B . 32 GLU OE1 1 1 3 2140 1 1 32 GLU OE2 O 5.729 -3.386 -7.734 1.00 . A B . 32 GLU OE2 1 1 3 2141 1 1 33 ASP C C -1.287 0.064 -4.911 1.00 . A B . 33 ASP C 1 1 3 2142 1 1 33 ASP CA C -0.604 -0.482 -6.156 1.00 . A B . 33 ASP CA 1 1 3 2143 1 1 33 ASP CB C -1.417 -1.643 -6.740 1.00 . A B . 33 ASP CB 1 1 3 2144 1 1 33 ASP CG C -0.890 -2.119 -8.082 1.00 . A B . 33 ASP CG 1 1 3 2145 1 1 33 ASP H H 0.947 -1.856 -5.710 1.00 . A B . 33 ASP H 1 1 3 2146 1 1 33 ASP HA H -0.538 0.308 -6.892 1.00 . A B . 33 ASP HA 1 1 3 2147 1 1 33 ASP HB2 H -1.390 -2.474 -6.050 1.00 . A B . 33 ASP HB2 1 1 3 2148 1 1 33 ASP HB3 H -2.440 -1.324 -6.871 1.00 . A B . 33 ASP HB3 1 1 3 2149 1 1 33 ASP N N 0.753 -0.904 -5.840 1.00 . A B . 33 ASP N 1 1 3 2150 1 1 33 ASP O O -2.188 0.892 -4.998 1.00 . A B . 33 ASP O 1 1 3 2151 1 1 33 ASP OD1 O 0.053 -2.936 -8.102 1.00 . A B . 33 ASP OD1 1 1 3 2152 1 1 33 ASP OD2 O -1.418 -1.681 -9.124 1.00 . A B . 33 ASP OD2 1 1 3 2153 1 1 34 CYS C C -0.896 1.388 -2.027 1.00 . A B . 34 CYS C 1 1 3 2154 1 1 34 CYS CA C -1.414 0.023 -2.478 1.00 . A B . 34 CYS CA 1 1 3 2155 1 1 34 CYS CB C -1.135 -1.037 -1.408 1.00 . A B . 34 CYS CB 1 1 3 2156 1 1 34 CYS H H -0.082 -1.026 -3.748 1.00 . A B . 34 CYS H 1 1 3 2157 1 1 34 CYS HA H -2.484 0.096 -2.621 1.00 . A B . 34 CYS HA 1 1 3 2158 1 1 34 CYS HB2 H -0.101 -1.350 -1.484 1.00 . A B . 34 CYS HB2 1 1 3 2159 1 1 34 CYS HB3 H -1.310 -0.613 -0.432 1.00 . A B . 34 CYS HB3 1 1 3 2160 1 1 34 CYS N N -0.831 -0.386 -3.752 1.00 . A B . 34 CYS N 1 1 3 2161 1 1 34 CYS O O -1.256 1.872 -0.954 1.00 . A B . 34 CYS O 1 1 3 2162 1 1 34 CYS SG S -2.168 -2.531 -1.565 1.00 . A B . 34 CYS SG 1 1 3 2163 1 1 35 HIS C C -0.339 4.351 -3.482 1.00 . A B . 35 HIS C 1 1 3 2164 1 1 35 HIS CA C 0.410 3.366 -2.591 1.00 . A B . 35 HIS CA 1 1 3 2165 1 1 35 HIS CB C 1.922 3.493 -2.811 1.00 . A B . 35 HIS CB 1 1 3 2166 1 1 35 HIS CD2 C 3.259 1.635 -1.619 1.00 . A B . 35 HIS CD2 1 1 3 2167 1 1 35 HIS CE1 C 3.562 2.584 0.297 1.00 . A B . 35 HIS CE1 1 1 3 2168 1 1 35 HIS CG C 2.716 2.869 -1.707 1.00 . A B . 35 HIS CG 1 1 3 2169 1 1 35 HIS H H 0.303 1.515 -3.621 1.00 . A B . 35 HIS H 1 1 3 2170 1 1 35 HIS HA H 0.190 3.596 -1.557 1.00 . A B . 35 HIS HA 1 1 3 2171 1 1 35 HIS HB2 H 2.188 2.998 -3.737 1.00 . A B . 35 HIS HB2 1 1 3 2172 1 1 35 HIS HB3 H 2.184 4.536 -2.873 1.00 . A B . 35 HIS HB3 1 1 3 2173 1 1 35 HIS HD1 H 2.587 4.346 -0.200 1.00 . A B . 35 HIS HD1 1 1 3 2174 1 1 35 HIS HD2 H 3.292 0.901 -2.411 1.00 . A B . 35 HIS HD2 1 1 3 2175 1 1 35 HIS HE1 H 3.872 2.782 1.313 1.00 . A B . 35 HIS HE1 1 1 3 2176 1 1 35 HIS N N -0.042 2.000 -2.842 1.00 . A B . 35 HIS N 1 1 3 2177 1 1 35 HIS ND1 N 2.917 3.462 -0.478 1.00 . A B . 35 HIS ND1 1 1 3 2178 1 1 35 HIS NE2 N 3.788 1.451 -0.349 1.00 . A B . 35 HIS NE2 1 1 3 2179 1 1 35 HIS O O -0.043 5.547 -3.494 1.00 . A B . 35 HIS O 1 1 3 2180 1 1 36 ILE C C -3.594 4.501 -4.744 1.00 . A B . 36 ILE C 1 1 3 2181 1 1 36 ILE CA C -2.118 4.648 -5.121 1.00 . A B . 36 ILE CA 1 1 3 2182 1 1 36 ILE CB C -1.925 4.219 -6.596 1.00 . A B . 36 ILE CB 1 1 3 2183 1 1 36 ILE CD1 C -0.156 3.700 -8.360 1.00 . A B . 36 ILE CD1 1 1 3 2184 1 1 36 ILE CG1 C -0.435 4.168 -6.947 1.00 . A B . 36 ILE CG1 1 1 3 2185 1 1 36 ILE CG2 C -2.658 5.166 -7.537 1.00 . A B . 36 ILE CG2 1 1 3 2186 1 1 36 ILE H H -1.476 2.871 -4.184 1.00 . A B . 36 ILE H 1 1 3 2187 1 1 36 ILE HA H -1.819 5.680 -5.013 1.00 . A B . 36 ILE HA 1 1 3 2188 1 1 36 ILE HB H -2.350 3.233 -6.715 1.00 . A B . 36 ILE HB 1 1 3 2189 1 1 36 ILE HD11 H 0.912 3.659 -8.522 1.00 . A B . 36 ILE HD11 1 1 3 2190 1 1 36 ILE HD12 H -0.599 4.391 -9.062 1.00 . A B . 36 ILE HD12 1 1 3 2191 1 1 36 ILE HD13 H -0.580 2.718 -8.506 1.00 . A B . 36 ILE HD13 1 1 3 2192 1 1 36 ILE HG12 H -0.014 5.154 -6.838 1.00 . A B . 36 ILE HG12 1 1 3 2193 1 1 36 ILE HG13 H 0.063 3.491 -6.269 1.00 . A B . 36 ILE HG13 1 1 3 2194 1 1 36 ILE HG21 H -2.551 4.820 -8.554 1.00 . A B . 36 ILE HG21 1 1 3 2195 1 1 36 ILE HG22 H -2.238 6.156 -7.449 1.00 . A B . 36 ILE HG22 1 1 3 2196 1 1 36 ILE HG23 H -3.705 5.195 -7.274 1.00 . A B . 36 ILE HG23 1 1 3 2197 1 1 36 ILE N N -1.303 3.834 -4.232 1.00 . A B . 36 ILE N 1 1 3 2198 1 1 36 ILE O O -4.058 3.386 -4.508 1.00 . A B . 36 ILE O 1 1 3 2199 1 1 37 PRO C C -2.989 7.502 -3.835 1.00 . A B . 37 PRO C 1 1 3 2200 1 1 37 PRO CA C -3.872 6.962 -4.958 1.00 . A B . 37 PRO CA 1 1 3 2201 1 1 37 PRO CB C -5.162 7.799 -5.069 1.00 . A B . 37 PRO CB 1 1 3 2202 1 1 37 PRO CD C -5.780 5.612 -4.326 1.00 . A B . 37 PRO CD 1 1 3 2203 1 1 37 PRO CG C -6.287 6.813 -5.069 1.00 . A B . 37 PRO CG 1 1 3 2204 1 1 37 PRO HA H -3.326 7.000 -5.890 1.00 . A B . 37 PRO HA 1 1 3 2205 1 1 37 PRO HB2 H -5.229 8.469 -4.220 1.00 . A B . 37 PRO HB2 1 1 3 2206 1 1 37 PRO HB3 H -5.144 8.375 -5.986 1.00 . A B . 37 PRO HB3 1 1 3 2207 1 1 37 PRO HD2 H -5.915 5.737 -3.260 1.00 . A B . 37 PRO HD2 1 1 3 2208 1 1 37 PRO HD3 H -6.270 4.711 -4.671 1.00 . A B . 37 PRO HD3 1 1 3 2209 1 1 37 PRO HG2 H -7.145 7.234 -4.561 1.00 . A B . 37 PRO HG2 1 1 3 2210 1 1 37 PRO HG3 H -6.542 6.548 -6.085 1.00 . A B . 37 PRO HG3 1 1 3 2211 1 1 37 PRO N N -4.359 5.604 -4.678 1.00 . A B . 37 PRO N 1 1 3 2212 1 1 37 PRO O O -3.271 7.287 -2.657 1.00 . A B . 37 PRO O 1 1 3 2213 1 1 38 PRO C C -1.538 9.655 -2.186 1.00 . A B . 38 PRO C 1 1 3 2214 1 1 38 PRO CA C -0.923 8.741 -3.243 1.00 . A B . 38 PRO CA 1 1 3 2215 1 1 38 PRO CB C 0.062 9.531 -4.114 1.00 . A B . 38 PRO CB 1 1 3 2216 1 1 38 PRO CD C -1.580 8.595 -5.586 1.00 . A B . 38 PRO CD 1 1 3 2217 1 1 38 PRO CG C -0.645 9.761 -5.409 1.00 . A B . 38 PRO CG 1 1 3 2218 1 1 38 PRO HA H -0.399 7.936 -2.753 1.00 . A B . 38 PRO HA 1 1 3 2219 1 1 38 PRO HB2 H 0.302 10.466 -3.626 1.00 . A B . 38 PRO HB2 1 1 3 2220 1 1 38 PRO HB3 H 0.966 8.954 -4.253 1.00 . A B . 38 PRO HB3 1 1 3 2221 1 1 38 PRO HD2 H -2.469 8.899 -6.127 1.00 . A B . 38 PRO HD2 1 1 3 2222 1 1 38 PRO HD3 H -1.085 7.780 -6.098 1.00 . A B . 38 PRO HD3 1 1 3 2223 1 1 38 PRO HG2 H -1.201 10.687 -5.359 1.00 . A B . 38 PRO HG2 1 1 3 2224 1 1 38 PRO HG3 H 0.071 9.796 -6.219 1.00 . A B . 38 PRO HG3 1 1 3 2225 1 1 38 PRO N N -1.913 8.223 -4.202 1.00 . A B . 38 PRO N 1 1 3 2226 1 1 38 PRO O O -2.621 10.218 -2.381 1.00 . A B . 38 PRO O 1 1 3 2227 1 1 39 VAL C C -1.493 12.059 -0.388 1.00 . A B . 39 VAL C 1 1 3 2228 1 1 39 VAL CA C -1.278 10.615 0.051 1.00 . A B . 39 VAL CA 1 1 3 2229 1 1 39 VAL CB C -0.266 10.578 1.219 1.00 . A B . 39 VAL CB 1 1 3 2230 1 1 39 VAL CG1 C -0.690 11.512 2.342 1.00 . A B . 39 VAL CG1 1 1 3 2231 1 1 39 VAL CG2 C -0.103 9.160 1.746 1.00 . A B . 39 VAL CG2 1 1 3 2232 1 1 39 VAL H H 0.041 9.342 -1.002 1.00 . A B . 39 VAL H 1 1 3 2233 1 1 39 VAL HA H -2.215 10.210 0.403 1.00 . A B . 39 VAL HA 1 1 3 2234 1 1 39 VAL HB H 0.687 10.911 0.848 1.00 . A B . 39 VAL HB 1 1 3 2235 1 1 39 VAL HG11 H -0.750 12.523 1.968 1.00 . A B . 39 VAL HG11 1 1 3 2236 1 1 39 VAL HG12 H 0.037 11.466 3.140 1.00 . A B . 39 VAL HG12 1 1 3 2237 1 1 39 VAL HG13 H -1.656 11.209 2.718 1.00 . A B . 39 VAL HG13 1 1 3 2238 1 1 39 VAL HG21 H 0.623 9.157 2.544 1.00 . A B . 39 VAL HG21 1 1 3 2239 1 1 39 VAL HG22 H 0.235 8.515 0.950 1.00 . A B . 39 VAL HG22 1 1 3 2240 1 1 39 VAL HG23 H -1.051 8.804 2.122 1.00 . A B . 39 VAL HG23 1 1 3 2241 1 1 39 VAL N N -0.827 9.796 -1.069 1.00 . A B . 39 VAL N 1 1 3 2242 1 1 39 VAL O O -0.564 12.720 -0.857 1.00 . A B . 39 VAL O 1 1 3 2243 1 1 40 GLU C C -4.290 14.353 0.144 1.00 . A B . 40 GLU C 1 1 3 2244 1 1 40 GLU CA C -3.098 13.863 -0.667 1.00 . A B . 40 GLU CA 1 1 3 2245 1 1 40 GLU CB C -3.446 13.843 -2.160 1.00 . A B . 40 GLU CB 1 1 3 2246 1 1 40 GLU CD C -2.542 16.147 -2.623 1.00 . A B . 40 GLU CD 1 1 3 2247 1 1 40 GLU CG C -3.731 15.218 -2.738 1.00 . A B . 40 GLU CG 1 1 3 2248 1 1 40 GLU H H -3.386 11.980 0.230 1.00 . A B . 40 GLU H 1 1 3 2249 1 1 40 GLU HA H -2.264 14.526 -0.505 1.00 . A B . 40 GLU HA 1 1 3 2250 1 1 40 GLU HB2 H -2.621 13.411 -2.705 1.00 . A B . 40 GLU HB2 1 1 3 2251 1 1 40 GLU HB3 H -4.321 13.227 -2.305 1.00 . A B . 40 GLU HB3 1 1 3 2252 1 1 40 GLU HG2 H -3.988 15.113 -3.781 1.00 . A B . 40 GLU HG2 1 1 3 2253 1 1 40 GLU HG3 H -4.561 15.651 -2.203 1.00 . A B . 40 GLU HG3 1 1 3 2254 1 1 40 GLU N N -2.719 12.535 -0.226 1.00 . A B . 40 GLU N 1 1 3 2255 1 1 40 GLU O O -4.164 15.251 0.979 1.00 . A B . 40 GLU O 1 1 3 2256 1 1 40 GLU OE1 O -1.551 15.946 -3.354 1.00 . A B . 40 GLU OE1 1 1 3 2257 1 1 40 GLU OE2 O -2.605 17.096 -1.817 1.00 . A B . 40 GLU OE2 1 1 3 2258 1 1 41 ALA C C -7.643 12.919 0.521 1.00 . A B . 41 ALA C 1 1 3 2259 1 1 41 ALA CA C -6.661 14.075 0.616 1.00 . A B . 41 ALA CA 1 1 3 2260 1 1 41 ALA CB C -7.280 15.344 0.050 1.00 . A B . 41 ALA CB 1 1 3 2261 1 1 41 ALA H H -5.478 13.050 -0.789 1.00 . A B . 41 ALA H 1 1 3 2262 1 1 41 ALA HA H -6.408 14.249 1.650 1.00 . A B . 41 ALA HA 1 1 3 2263 1 1 41 ALA HB1 H -7.488 15.204 -1.001 1.00 . A B . 41 ALA HB1 1 1 3 2264 1 1 41 ALA HB2 H -6.595 16.167 0.174 1.00 . A B . 41 ALA HB2 1 1 3 2265 1 1 41 ALA HB3 H -8.200 15.559 0.572 1.00 . A B . 41 ALA HB3 1 1 3 2266 1 1 41 ALA N N -5.442 13.743 -0.100 1.00 . A B . 41 ALA N 1 1 3 2267 1 1 41 ALA O O -7.665 12.211 -0.489 1.00 . A B . 41 ALA O 1 1 3 2268 1 1 42 GLU C C -8.889 10.277 1.462 1.00 . A B . 42 GLU C 1 1 3 2269 1 1 42 GLU CA C -9.471 11.684 1.593 1.00 . A B . 42 GLU CA 1 1 3 2270 1 1 42 GLU CB C -10.486 11.943 0.479 1.00 . A B . 42 GLU CB 1 1 3 2271 1 1 42 GLU CD C -12.250 13.120 1.837 1.00 . A B . 42 GLU CD 1 1 3 2272 1 1 42 GLU CG C -11.282 13.219 0.678 1.00 . A B . 42 GLU CG 1 1 3 2273 1 1 42 GLU H H -8.324 13.290 2.366 1.00 . A B . 42 GLU H 1 1 3 2274 1 1 42 GLU HA H -9.981 11.753 2.541 1.00 . A B . 42 GLU HA 1 1 3 2275 1 1 42 GLU HB2 H -9.959 12.013 -0.460 1.00 . A B . 42 GLU HB2 1 1 3 2276 1 1 42 GLU HB3 H -11.175 11.114 0.435 1.00 . A B . 42 GLU HB3 1 1 3 2277 1 1 42 GLU HG2 H -10.592 14.028 0.873 1.00 . A B . 42 GLU HG2 1 1 3 2278 1 1 42 GLU HG3 H -11.837 13.428 -0.224 1.00 . A B . 42 GLU HG3 1 1 3 2279 1 1 42 GLU N N -8.432 12.717 1.574 1.00 . A B . 42 GLU N 1 1 3 2280 1 1 42 GLU O O -9.593 9.335 1.096 1.00 . A B . 42 GLU O 1 1 3 2281 1 1 42 GLU OE1 O -11.816 13.303 2.993 1.00 . A B . 42 GLU OE1 1 1 3 2282 1 1 42 GLU OE2 O -13.452 12.870 1.605 1.00 . A B . 42 GLU OE2 1 1 3 2283 1 1 43 ARG C C -7.124 8.123 3.037 1.00 . A B . 43 ARG C 1 1 3 2284 1 1 43 ARG CA C -6.959 8.837 1.703 1.00 . A B . 43 ARG CA 1 1 3 2285 1 1 43 ARG CB C -5.473 8.984 1.376 1.00 . A B . 43 ARG CB 1 1 3 2286 1 1 43 ARG CD C -5.829 9.273 -1.110 1.00 . A B . 43 ARG CD 1 1 3 2287 1 1 43 ARG CG C -5.173 9.824 0.143 1.00 . A B . 43 ARG CG 1 1 3 2288 1 1 43 ARG CZ C -6.190 10.515 -3.222 1.00 . A B . 43 ARG CZ 1 1 3 2289 1 1 43 ARG H H -7.093 10.920 2.041 1.00 . A B . 43 ARG H 1 1 3 2290 1 1 43 ARG HA H -7.439 8.254 0.931 1.00 . A B . 43 ARG HA 1 1 3 2291 1 1 43 ARG HB2 H -4.978 9.441 2.219 1.00 . A B . 43 ARG HB2 1 1 3 2292 1 1 43 ARG HB3 H -5.054 8.000 1.221 1.00 . A B . 43 ARG HB3 1 1 3 2293 1 1 43 ARG HD2 H -5.574 8.227 -1.209 1.00 . A B . 43 ARG HD2 1 1 3 2294 1 1 43 ARG HD3 H -6.900 9.375 -1.018 1.00 . A B . 43 ARG HD3 1 1 3 2295 1 1 43 ARG HE H -4.401 10.090 -2.419 1.00 . A B . 43 ARG HE 1 1 3 2296 1 1 43 ARG HG2 H -5.531 10.830 0.309 1.00 . A B . 43 ARG HG2 1 1 3 2297 1 1 43 ARG HG3 H -4.105 9.846 -0.005 1.00 . A B . 43 ARG HG3 1 1 3 2298 1 1 43 ARG HH11 H -7.912 9.904 -2.332 1.00 . A B . 43 ARG HH11 1 1 3 2299 1 1 43 ARG HH12 H -8.115 10.785 -3.812 1.00 . A B . 43 ARG HH12 1 1 3 2300 1 1 43 ARG HH21 H -4.679 11.255 -4.359 1.00 . A B . 43 ARG HH21 1 1 3 2301 1 1 43 ARG HH22 H -6.280 11.555 -4.960 1.00 . A B . 43 ARG HH22 1 1 3 2302 1 1 43 ARG N N -7.608 10.136 1.763 1.00 . A B . 43 ARG N 1 1 3 2303 1 1 43 ARG NE N -5.379 9.992 -2.301 1.00 . A B . 43 ARG NE 1 1 3 2304 1 1 43 ARG NH1 N -7.510 10.392 -3.112 1.00 . A B . 43 ARG NH1 1 1 3 2305 1 1 43 ARG NH2 N -5.676 11.158 -4.262 1.00 . A B . 43 ARG NH2 1 1 3 2306 1 1 43 ARG O O -7.072 8.755 4.097 1.00 . A B . 43 ARG O 1 1 3 2307 1 1 44 THR C C -6.510 4.966 4.390 1.00 . A B . 44 THR C 1 1 3 2308 1 1 44 THR CA C -7.571 6.050 4.198 1.00 . A B . 44 THR CA 1 1 3 2309 1 1 44 THR CB C -8.968 5.400 4.155 1.00 . A B . 44 THR CB 1 1 3 2310 1 1 44 THR CG2 C -10.060 6.458 4.222 1.00 . A B . 44 THR CG2 1 1 3 2311 1 1 44 THR H H -7.341 6.364 2.121 1.00 . A B . 44 THR H 1 1 3 2312 1 1 44 THR HA H -7.539 6.730 5.037 1.00 . A B . 44 THR HA 1 1 3 2313 1 1 44 THR HB H -9.069 4.742 5.006 1.00 . A B . 44 THR HB 1 1 3 2314 1 1 44 THR HG1 H -8.435 3.950 2.921 1.00 . A B . 44 THR HG1 1 1 3 2315 1 1 44 THR HG21 H -9.955 7.135 3.386 1.00 . A B . 44 THR HG21 1 1 3 2316 1 1 44 THR HG22 H -9.971 7.011 5.144 1.00 . A B . 44 THR HG22 1 1 3 2317 1 1 44 THR HG23 H -11.027 5.979 4.179 1.00 . A B . 44 THR HG23 1 1 3 2318 1 1 44 THR N N -7.334 6.821 2.990 1.00 . A B . 44 THR N 1 1 3 2319 1 1 44 THR O O -6.659 3.853 3.896 1.00 . A B . 44 THR O 1 1 3 2320 1 1 44 THR OG1 O -9.117 4.636 2.949 1.00 . A B . 44 THR OG1 1 1 3 2321 1 1 45 PRO C C -4.759 3.198 6.307 1.00 . A B . 45 PRO C 1 1 3 2322 1 1 45 PRO CA C -4.332 4.319 5.363 1.00 . A B . 45 PRO CA 1 1 3 2323 1 1 45 PRO CB C -3.227 5.171 6.009 1.00 . A B . 45 PRO CB 1 1 3 2324 1 1 45 PRO CD C -5.137 6.584 5.714 1.00 . A B . 45 PRO CD 1 1 3 2325 1 1 45 PRO CG C -3.638 6.591 5.786 1.00 . A B . 45 PRO CG 1 1 3 2326 1 1 45 PRO HA H -3.966 3.887 4.444 1.00 . A B . 45 PRO HA 1 1 3 2327 1 1 45 PRO HB2 H -3.162 4.939 7.063 1.00 . A B . 45 PRO HB2 1 1 3 2328 1 1 45 PRO HB3 H -2.282 4.957 5.531 1.00 . A B . 45 PRO HB3 1 1 3 2329 1 1 45 PRO HD2 H -5.566 6.657 6.705 1.00 . A B . 45 PRO HD2 1 1 3 2330 1 1 45 PRO HD3 H -5.495 7.387 5.083 1.00 . A B . 45 PRO HD3 1 1 3 2331 1 1 45 PRO HG2 H -3.304 7.203 6.611 1.00 . A B . 45 PRO HG2 1 1 3 2332 1 1 45 PRO HG3 H -3.219 6.951 4.858 1.00 . A B . 45 PRO HG3 1 1 3 2333 1 1 45 PRO N N -5.418 5.278 5.110 1.00 . A B . 45 PRO N 1 1 3 2334 1 1 45 PRO O O -4.148 2.128 6.347 1.00 . A B . 45 PRO O 1 1 3 2335 1 1 46 TRP C C -7.493 1.677 7.347 1.00 . A B . 46 TRP C 1 1 3 2336 1 1 46 TRP CA C -6.353 2.459 7.989 1.00 . A B . 46 TRP CA 1 1 3 2337 1 1 46 TRP CB C -6.840 3.145 9.274 1.00 . A B . 46 TRP CB 1 1 3 2338 1 1 46 TRP CD1 C -9.139 4.210 8.858 1.00 . A B . 46 TRP CD1 1 1 3 2339 1 1 46 TRP CD2 C -7.442 5.672 8.900 1.00 . A B . 46 TRP CD2 1 1 3 2340 1 1 46 TRP CE2 C -8.636 6.375 8.660 1.00 . A B . 46 TRP CE2 1 1 3 2341 1 1 46 TRP CE3 C -6.243 6.387 8.970 1.00 . A B . 46 TRP CE3 1 1 3 2342 1 1 46 TRP CG C -7.784 4.285 9.021 1.00 . A B . 46 TRP CG 1 1 3 2343 1 1 46 TRP CH2 C -7.477 8.429 8.564 1.00 . A B . 46 TRP CH2 1 1 3 2344 1 1 46 TRP CZ2 C -8.666 7.756 8.489 1.00 . A B . 46 TRP CZ2 1 1 3 2345 1 1 46 TRP CZ3 C -6.274 7.759 8.802 1.00 . A B . 46 TRP CZ3 1 1 3 2346 1 1 46 TRP H H -6.255 4.323 6.990 1.00 . A B . 46 TRP H 1 1 3 2347 1 1 46 TRP HA H -5.556 1.772 8.233 1.00 . A B . 46 TRP HA 1 1 3 2348 1 1 46 TRP HB2 H -7.354 2.419 9.888 1.00 . A B . 46 TRP HB2 1 1 3 2349 1 1 46 TRP HB3 H -5.987 3.529 9.818 1.00 . A B . 46 TRP HB3 1 1 3 2350 1 1 46 TRP HD1 H -9.707 3.294 8.893 1.00 . A B . 46 TRP HD1 1 1 3 2351 1 1 46 TRP HE1 H -10.606 5.668 8.487 1.00 . A B . 46 TRP HE1 1 1 3 2352 1 1 46 TRP HE3 H -5.305 5.887 9.155 1.00 . A B . 46 TRP HE3 1 1 3 2353 1 1 46 TRP HH2 H -7.452 9.500 8.436 1.00 . A B . 46 TRP HH2 1 1 3 2354 1 1 46 TRP HZ2 H -9.586 8.287 8.305 1.00 . A B . 46 TRP HZ2 1 1 3 2355 1 1 46 TRP HZ3 H -5.358 8.329 8.853 1.00 . A B . 46 TRP HZ3 1 1 3 2356 1 1 46 TRP N N -5.820 3.448 7.060 1.00 . A B . 46 TRP N 1 1 3 2357 1 1 46 TRP NE1 N -9.656 5.462 8.636 1.00 . A B . 46 TRP NE1 1 1 3 2358 1 1 46 TRP O O -8.279 1.025 8.036 1.00 . A B . 46 TRP O 1 1 3 2359 1 1 47 ASN C C -8.089 0.523 3.984 1.00 . A B . 47 ASN C 1 1 3 2360 1 1 47 ASN CA C -8.639 1.065 5.297 1.00 . A B . 47 ASN CA 1 1 3 2361 1 1 47 ASN CB C -9.811 2.017 5.032 1.00 . A B . 47 ASN CB 1 1 3 2362 1 1 47 ASN CG C -10.992 1.318 4.378 1.00 . A B . 47 ASN CG 1 1 3 2363 1 1 47 ASN H H -6.903 2.242 5.525 1.00 . A B . 47 ASN H 1 1 3 2364 1 1 47 ASN HA H -8.982 0.238 5.903 1.00 . A B . 47 ASN HA 1 1 3 2365 1 1 47 ASN HB2 H -10.137 2.452 5.966 1.00 . A B . 47 ASN HB2 1 1 3 2366 1 1 47 ASN HB3 H -9.478 2.807 4.374 1.00 . A B . 47 ASN HB3 1 1 3 2367 1 1 47 ASN HD21 H -11.735 0.805 6.151 1.00 . A B . 47 ASN HD21 1 1 3 2368 1 1 47 ASN HD22 H -12.649 0.290 4.773 1.00 . A B . 47 ASN HD22 1 1 3 2369 1 1 47 ASN N N -7.582 1.744 6.028 1.00 . A B . 47 ASN N 1 1 3 2370 1 1 47 ASN ND2 N -11.880 0.750 5.182 1.00 . A B . 47 ASN ND2 1 1 3 2371 1 1 47 ASN O O -7.278 1.174 3.334 1.00 . A B . 47 ASN O 1 1 3 2372 1 1 47 ASN OD1 O -11.103 1.288 3.154 1.00 . A B . 47 ASN OD1 1 1 3 2373 1 1 48 CYS C C -8.925 -1.108 1.236 1.00 . A B . 48 CYS C 1 1 3 2374 1 1 48 CYS CA C -7.999 -1.329 2.425 1.00 . A B . 48 CYS CA 1 1 3 2375 1 1 48 CYS CB C -7.859 -2.817 2.727 1.00 . A B . 48 CYS CB 1 1 3 2376 1 1 48 CYS H H -9.204 -1.119 4.147 1.00 . A B . 48 CYS H 1 1 3 2377 1 1 48 CYS HA H -7.027 -0.912 2.205 1.00 . A B . 48 CYS HA 1 1 3 2378 1 1 48 CYS HB2 H -7.292 -2.934 3.639 1.00 . A B . 48 CYS HB2 1 1 3 2379 1 1 48 CYS HB3 H -8.846 -3.229 2.881 1.00 . A B . 48 CYS HB3 1 1 3 2380 1 1 48 CYS N N -8.520 -0.668 3.610 1.00 . A B . 48 CYS N 1 1 3 2381 1 1 48 CYS O O -10.104 -1.452 1.281 1.00 . A B . 48 CYS O 1 1 3 2382 1 1 48 CYS SG S -7.046 -3.830 1.465 1.00 . A B . 48 CYS SG 1 1 3 2383 1 1 49 ILE C C -9.413 -1.527 -1.852 1.00 . A B . 49 ILE C 1 1 3 2384 1 1 49 ILE CA C -9.153 -0.263 -1.033 1.00 . A B . 49 ILE CA 1 1 3 2385 1 1 49 ILE CB C -8.475 0.806 -1.925 1.00 . A B . 49 ILE CB 1 1 3 2386 1 1 49 ILE CD1 C -6.260 1.486 -2.998 1.00 . A B . 49 ILE CD1 1 1 3 2387 1 1 49 ILE CG1 C -6.969 0.549 -2.041 1.00 . A B . 49 ILE CG1 1 1 3 2388 1 1 49 ILE CG2 C -8.740 2.204 -1.378 1.00 . A B . 49 ILE CG2 1 1 3 2389 1 1 49 ILE H H -7.432 -0.279 0.206 1.00 . A B . 49 ILE H 1 1 3 2390 1 1 49 ILE HA H -10.107 0.131 -0.713 1.00 . A B . 49 ILE HA 1 1 3 2391 1 1 49 ILE HB H -8.915 0.744 -2.908 1.00 . A B . 49 ILE HB 1 1 3 2392 1 1 49 ILE HD11 H -6.688 1.387 -3.985 1.00 . A B . 49 ILE HD11 1 1 3 2393 1 1 49 ILE HD12 H -5.210 1.235 -3.034 1.00 . A B . 49 ILE HD12 1 1 3 2394 1 1 49 ILE HD13 H -6.375 2.503 -2.655 1.00 . A B . 49 ILE HD13 1 1 3 2395 1 1 49 ILE HG12 H -6.519 0.674 -1.071 1.00 . A B . 49 ILE HG12 1 1 3 2396 1 1 49 ILE HG13 H -6.807 -0.463 -2.383 1.00 . A B . 49 ILE HG13 1 1 3 2397 1 1 49 ILE HG21 H -9.801 2.406 -1.397 1.00 . A B . 49 ILE HG21 1 1 3 2398 1 1 49 ILE HG22 H -8.224 2.931 -1.987 1.00 . A B . 49 ILE HG22 1 1 3 2399 1 1 49 ILE HG23 H -8.380 2.268 -0.362 1.00 . A B . 49 ILE HG23 1 1 3 2400 1 1 49 ILE N N -8.377 -0.543 0.171 1.00 . A B . 49 ILE N 1 1 3 2401 1 1 49 ILE O O -10.428 -1.624 -2.540 1.00 . A B . 49 ILE O 1 1 3 2402 1 1 50 PHE C C -9.724 -4.645 -1.872 1.00 . A B . 50 PHE C 1 1 3 2403 1 1 50 PHE CA C -8.672 -3.748 -2.513 1.00 . A B . 50 PHE CA 1 1 3 2404 1 1 50 PHE CB C -7.330 -4.477 -2.652 1.00 . A B . 50 PHE CB 1 1 3 2405 1 1 50 PHE CD1 C -5.596 -2.759 -3.234 1.00 . A B . 50 PHE CD1 1 1 3 2406 1 1 50 PHE CD2 C -6.348 -4.237 -4.945 1.00 . A B . 50 PHE CD2 1 1 3 2407 1 1 50 PHE CE1 C -4.752 -2.141 -4.135 1.00 . A B . 50 PHE CE1 1 1 3 2408 1 1 50 PHE CE2 C -5.508 -3.622 -5.851 1.00 . A B . 50 PHE CE2 1 1 3 2409 1 1 50 PHE CG C -6.402 -3.813 -3.628 1.00 . A B . 50 PHE CG 1 1 3 2410 1 1 50 PHE CZ C -4.708 -2.573 -5.445 1.00 . A B . 50 PHE CZ 1 1 3 2411 1 1 50 PHE H H -7.824 -2.454 -1.063 1.00 . A B . 50 PHE H 1 1 3 2412 1 1 50 PHE HA H -9.022 -3.470 -3.500 1.00 . A B . 50 PHE HA 1 1 3 2413 1 1 50 PHE HB2 H -6.837 -4.506 -1.690 1.00 . A B . 50 PHE HB2 1 1 3 2414 1 1 50 PHE HB3 H -7.505 -5.489 -2.995 1.00 . A B . 50 PHE HB3 1 1 3 2415 1 1 50 PHE HD1 H -5.630 -2.421 -2.209 1.00 . A B . 50 PHE HD1 1 1 3 2416 1 1 50 PHE HD2 H -6.973 -5.058 -5.264 1.00 . A B . 50 PHE HD2 1 1 3 2417 1 1 50 PHE HE1 H -4.128 -1.321 -3.813 1.00 . A B . 50 PHE HE1 1 1 3 2418 1 1 50 PHE HE2 H -5.474 -3.963 -6.875 1.00 . A B . 50 PHE HE2 1 1 3 2419 1 1 50 PHE HZ H -4.052 -2.090 -6.151 1.00 . A B . 50 PHE HZ 1 1 3 2420 1 1 50 PHE N N -8.528 -2.515 -1.740 1.00 . A B . 50 PHE N 1 1 3 2421 1 1 50 PHE O O -10.565 -5.227 -2.556 1.00 . A B . 50 PHE O 1 1 3 2422 1 1 51 CYS C C -12.056 -4.697 0.090 1.00 . A B . 51 CYS C 1 1 3 2423 1 1 51 CYS CA C -10.716 -5.417 0.228 1.00 . A B . 51 CYS CA 1 1 3 2424 1 1 51 CYS CB C -10.325 -5.558 1.704 1.00 . A B . 51 CYS CB 1 1 3 2425 1 1 51 CYS H H -8.920 -4.332 -0.072 1.00 . A B . 51 CYS H 1 1 3 2426 1 1 51 CYS HA H -10.826 -6.408 -0.197 1.00 . A B . 51 CYS HA 1 1 3 2427 1 1 51 CYS HB2 H -9.902 -4.627 2.047 1.00 . A B . 51 CYS HB2 1 1 3 2428 1 1 51 CYS HB3 H -11.211 -5.778 2.284 1.00 . A B . 51 CYS HB3 1 1 3 2429 1 1 51 CYS N N -9.680 -4.732 -0.546 1.00 . A B . 51 CYS N 1 1 3 2430 1 1 51 CYS O O -13.113 -5.265 0.369 1.00 . A B . 51 CYS O 1 1 3 2431 1 1 51 CYS SG S -9.115 -6.870 2.024 1.00 . A B . 51 CYS SG 1 1 3 2432 1 1 52 ARG C C -13.746 -2.783 -1.900 1.00 . A B . 52 ARG C 1 1 3 2433 1 1 52 ARG CA C -13.212 -2.641 -0.477 1.00 . A B . 52 ARG CA 1 1 3 2434 1 1 52 ARG CB C -12.939 -1.160 -0.175 1.00 . A B . 52 ARG CB 1 1 3 2435 1 1 52 ARG CD C -13.875 1.177 -0.378 1.00 . A B . 52 ARG CD 1 1 3 2436 1 1 52 ARG CG C -14.193 -0.298 -0.188 1.00 . A B . 52 ARG CG 1 1 3 2437 1 1 52 ARG CZ C -12.949 3.030 0.957 1.00 . A B . 52 ARG CZ 1 1 3 2438 1 1 52 ARG H H -11.174 -3.108 -0.738 1.00 . A B . 52 ARG H 1 1 3 2439 1 1 52 ARG HA H -13.943 -3.024 0.217 1.00 . A B . 52 ARG HA 1 1 3 2440 1 1 52 ARG HB2 H -12.483 -1.082 0.802 1.00 . A B . 52 ARG HB2 1 1 3 2441 1 1 52 ARG HB3 H -12.254 -0.772 -0.914 1.00 . A B . 52 ARG HB3 1 1 3 2442 1 1 52 ARG HD2 H -13.344 1.297 -1.310 1.00 . A B . 52 ARG HD2 1 1 3 2443 1 1 52 ARG HD3 H -14.803 1.724 -0.424 1.00 . A B . 52 ARG HD3 1 1 3 2444 1 1 52 ARG HE H -12.547 1.090 1.253 1.00 . A B . 52 ARG HE 1 1 3 2445 1 1 52 ARG HG2 H -14.830 -0.622 -0.998 1.00 . A B . 52 ARG HG2 1 1 3 2446 1 1 52 ARG HG3 H -14.713 -0.425 0.751 1.00 . A B . 52 ARG HG3 1 1 3 2447 1 1 52 ARG HH11 H -14.278 3.598 -0.465 1.00 . A B . 52 ARG HH11 1 1 3 2448 1 1 52 ARG HH12 H -13.572 4.892 0.448 1.00 . A B . 52 ARG HH12 1 1 3 2449 1 1 52 ARG HH21 H -11.618 2.781 2.463 1.00 . A B . 52 ARG HH21 1 1 3 2450 1 1 52 ARG HH22 H -12.069 4.427 2.131 1.00 . A B . 52 ARG HH22 1 1 3 2451 1 1 52 ARG N N -12.006 -3.442 -0.349 1.00 . A B . 52 ARG N 1 1 3 2452 1 1 52 ARG NE N -13.055 1.726 0.700 1.00 . A B . 52 ARG NE 1 1 3 2453 1 1 52 ARG NH1 N -13.656 3.911 0.258 1.00 . A B . 52 ARG NH1 1 1 3 2454 1 1 52 ARG NH2 N -12.148 3.449 1.926 1.00 . A B . 52 ARG NH2 1 1 3 2455 1 1 52 ARG O O -14.908 -2.492 -2.184 1.00 . A B . 52 ARG O 1 1 3 2456 1 1 53 MET C C -13.633 -2.139 -4.843 1.00 . A B . 53 MET C 1 1 3 2457 1 1 53 MET CA C -13.137 -3.435 -4.213 1.00 . A B . 53 MET CA 1 1 3 2458 1 1 53 MET CB C -14.145 -4.562 -4.444 1.00 . A B . 53 MET CB 1 1 3 2459 1 1 53 MET CE C -13.861 -8.670 -3.806 1.00 . A B . 53 MET CE 1 1 3 2460 1 1 53 MET CG C -13.614 -5.930 -4.055 1.00 . A B . 53 MET CG 1 1 3 2461 1 1 53 MET H H -11.982 -3.542 -2.441 1.00 . A B . 53 MET H 1 1 3 2462 1 1 53 MET HA H -12.206 -3.705 -4.691 1.00 . A B . 53 MET HA 1 1 3 2463 1 1 53 MET HB2 H -15.031 -4.362 -3.861 1.00 . A B . 53 MET HB2 1 1 3 2464 1 1 53 MET HB3 H -14.409 -4.586 -5.492 1.00 . A B . 53 MET HB3 1 1 3 2465 1 1 53 MET HE1 H -12.991 -8.756 -4.438 1.00 . A B . 53 MET HE1 1 1 3 2466 1 1 53 MET HE2 H -14.464 -9.561 -3.902 1.00 . A B . 53 MET HE2 1 1 3 2467 1 1 53 MET HE3 H -13.550 -8.554 -2.779 1.00 . A B . 53 MET HE3 1 1 3 2468 1 1 53 MET HG2 H -12.741 -6.146 -4.653 1.00 . A B . 53 MET HG2 1 1 3 2469 1 1 53 MET HG3 H -13.336 -5.909 -3.011 1.00 . A B . 53 MET HG3 1 1 3 2470 1 1 53 MET N N -12.864 -3.277 -2.778 1.00 . A B . 53 MET N 1 1 3 2471 1 1 53 MET O O -14.357 -2.151 -5.840 1.00 . A B . 53 MET O 1 1 3 2472 1 1 53 MET SD S -14.822 -7.243 -4.304 1.00 . A B . 53 MET SD 1 1 3 2473 1 1 54 LYS C C -12.408 1.243 -4.575 1.00 . A B . 54 LYS C 1 1 3 2474 1 1 54 LYS CA C -13.575 0.284 -4.771 1.00 . A B . 54 LYS CA 1 1 3 2475 1 1 54 LYS CB C -14.819 0.817 -4.054 1.00 . A B . 54 LYS CB 1 1 3 2476 1 1 54 LYS CD C -15.932 1.862 -6.050 1.00 . A B . 54 LYS CD 1 1 3 2477 1 1 54 LYS CE C -16.561 3.121 -6.627 1.00 . A B . 54 LYS CE 1 1 3 2478 1 1 54 LYS CG C -15.373 2.100 -4.658 1.00 . A B . 54 LYS CG 1 1 3 2479 1 1 54 LYS H H -12.683 -1.091 -3.445 1.00 . A B . 54 LYS H 1 1 3 2480 1 1 54 LYS HA H -13.786 0.189 -5.825 1.00 . A B . 54 LYS HA 1 1 3 2481 1 1 54 LYS HB2 H -15.592 0.064 -4.090 1.00 . A B . 54 LYS HB2 1 1 3 2482 1 1 54 LYS HB3 H -14.566 1.010 -3.022 1.00 . A B . 54 LYS HB3 1 1 3 2483 1 1 54 LYS HD2 H -15.130 1.543 -6.698 1.00 . A B . 54 LYS HD2 1 1 3 2484 1 1 54 LYS HD3 H -16.682 1.087 -5.995 1.00 . A B . 54 LYS HD3 1 1 3 2485 1 1 54 LYS HE2 H -17.041 2.870 -7.561 1.00 . A B . 54 LYS HE2 1 1 3 2486 1 1 54 LYS HE3 H -17.303 3.484 -5.931 1.00 . A B . 54 LYS HE3 1 1 3 2487 1 1 54 LYS HG2 H -16.163 2.473 -4.025 1.00 . A B . 54 LYS HG2 1 1 3 2488 1 1 54 LYS HG3 H -14.581 2.833 -4.718 1.00 . A B . 54 LYS HG3 1 1 3 2489 1 1 54 LYS HZ1 H -16.028 5.018 -7.310 1.00 . A B . 54 LYS HZ1 1 1 3 2490 1 1 54 LYS HZ2 H -14.822 3.856 -7.520 1.00 . A B . 54 LYS HZ2 1 1 3 2491 1 1 54 LYS HZ3 H -15.117 4.499 -5.979 1.00 . A B . 54 LYS HZ3 1 1 3 2492 1 1 54 LYS N N -13.224 -1.024 -4.260 1.00 . A B . 54 LYS N 1 1 3 2493 1 1 54 LYS NZ N -15.562 4.196 -6.875 1.00 . A B . 54 LYS NZ 1 1 3 2494 1 1 54 LYS O O -12.133 1.676 -3.455 1.00 . A B . 54 LYS O 1 1 3 2495 1 1 55 GLU C C -11.087 3.914 -5.546 1.00 . A B . 55 GLU C 1 1 3 2496 1 1 55 GLU CA C -10.587 2.474 -5.601 1.00 . A B . 55 GLU CA 1 1 3 2497 1 1 55 GLU CB C -9.679 2.284 -6.813 1.00 . A B . 55 GLU CB 1 1 3 2498 1 1 55 GLU CD C -7.689 3.151 -8.079 1.00 . A B . 55 GLU CD 1 1 3 2499 1 1 55 GLU CG C -8.399 3.100 -6.749 1.00 . A B . 55 GLU CG 1 1 3 2500 1 1 55 GLU H H -11.959 1.150 -6.517 1.00 . A B . 55 GLU H 1 1 3 2501 1 1 55 GLU HA H -10.026 2.261 -4.703 1.00 . A B . 55 GLU HA 1 1 3 2502 1 1 55 GLU HB2 H -9.411 1.242 -6.885 1.00 . A B . 55 GLU HB2 1 1 3 2503 1 1 55 GLU HB3 H -10.219 2.572 -7.701 1.00 . A B . 55 GLU HB3 1 1 3 2504 1 1 55 GLU HG2 H -8.644 4.108 -6.451 1.00 . A B . 55 GLU HG2 1 1 3 2505 1 1 55 GLU HG3 H -7.737 2.658 -6.018 1.00 . A B . 55 GLU HG3 1 1 3 2506 1 1 55 GLU N N -11.713 1.553 -5.657 1.00 . A B . 55 GLU N 1 1 3 2507 1 1 55 GLU O O -11.161 4.593 -6.574 1.00 . A B . 55 GLU O 1 1 3 2508 1 1 55 GLU OE1 O -7.090 2.133 -8.483 1.00 . A B . 55 GLU OE1 1 1 3 2509 1 1 55 GLU OE2 O -7.740 4.208 -8.739 1.00 . A B . 55 GLU OE2 1 1 3 2510 1 1 56 SER C C -13.066 6.054 -5.100 1.00 . A B . 56 SER C 1 1 3 2511 1 1 56 SER CA C -11.960 5.702 -4.097 1.00 . A B . 56 SER CA 1 1 3 2512 1 1 56 SER CB C -10.830 6.749 -4.108 1.00 . A B . 56 SER CB 1 1 3 2513 1 1 56 SER H H -11.318 3.756 -3.576 1.00 . A B . 56 SER H 1 1 3 2514 1 1 56 SER HA H -12.401 5.690 -3.110 1.00 . A B . 56 SER HA 1 1 3 2515 1 1 56 SER HB2 H -11.260 7.737 -4.088 1.00 . A B . 56 SER HB2 1 1 3 2516 1 1 56 SER HB3 H -10.211 6.611 -3.233 1.00 . A B . 56 SER HB3 1 1 3 2517 1 1 56 SER HG H -10.420 6.011 -5.879 1.00 . A B . 56 SER HG 1 1 3 2518 1 1 56 SER N N -11.426 4.360 -4.339 1.00 . A B . 56 SER N 1 1 3 2519 1 1 56 SER O O -14.176 5.486 -4.984 1.00 . A B . 56 SER O 1 1 3 2520 1 1 56 SER OXT O -12.830 6.892 -5.995 1.00 . A B . 56 SER OXT 1 1 3 2521 1 1 56 SER OG O -10.011 6.637 -5.263 1.00 . A B . 56 SER OG 1 1 3 2522 2 2 1 ZN ZN ZN -7.029 -5.942 2.355 1.00 . B B . 101 ZN ZN 1 1 3 2523 3 2 1 ZN ZN ZN 5.759 1.203 -0.179 1.00 . C B . 102 ZN ZN 1 1 4 2524 1 1 1 GLY C C 14.729 -13.485 3.897 1.00 . A B . 1 GLY C 1 1 4 2525 1 1 1 GLY CA C 15.610 -12.385 3.348 1.00 . A B . 1 GLY CA 1 1 4 2526 1 1 1 GLY H1 H 15.951 -13.283 1.502 1.00 . A B . 1 GLY H1 1 1 4 2527 1 1 1 GLY H2 H 17.135 -13.623 2.658 1.00 . A B . 1 GLY H2 1 1 4 2528 1 1 1 GLY H3 H 17.093 -12.108 1.914 1.00 . A B . 1 GLY H3 1 1 4 2529 1 1 1 GLY HA2 H 16.206 -11.981 4.150 1.00 . A B . 1 GLY HA2 1 1 4 2530 1 1 1 GLY HA3 H 14.986 -11.601 2.943 1.00 . A B . 1 GLY HA3 1 1 4 2531 1 1 1 GLY N N 16.510 -12.883 2.283 1.00 . A B . 1 GLY N 1 1 4 2532 1 1 1 GLY O O 13.964 -14.103 3.155 1.00 . A B . 1 GLY O 1 1 4 2533 1 1 2 ALA C C 13.671 -14.369 7.249 1.00 . A B . 2 ALA C 1 1 4 2534 1 1 2 ALA CA C 14.060 -14.787 5.837 1.00 . A B . 2 ALA CA 1 1 4 2535 1 1 2 ALA CB C 14.836 -16.099 5.861 1.00 . A B . 2 ALA CB 1 1 4 2536 1 1 2 ALA H H 15.467 -13.209 5.735 1.00 . A B . 2 ALA H 1 1 4 2537 1 1 2 ALA HA H 13.162 -14.937 5.257 1.00 . A B . 2 ALA HA 1 1 4 2538 1 1 2 ALA HB1 H 15.074 -16.397 4.850 1.00 . A B . 2 ALA HB1 1 1 4 2539 1 1 2 ALA HB2 H 14.236 -16.864 6.329 1.00 . A B . 2 ALA HB2 1 1 4 2540 1 1 2 ALA HB3 H 15.750 -15.967 6.421 1.00 . A B . 2 ALA HB3 1 1 4 2541 1 1 2 ALA N N 14.842 -13.742 5.193 1.00 . A B . 2 ALA N 1 1 4 2542 1 1 2 ALA O O 13.809 -15.140 8.199 1.00 . A B . 2 ALA O 1 1 4 2543 1 1 3 MET C C 11.620 -11.642 8.472 1.00 . A B . 3 MET C 1 1 4 2544 1 1 3 MET CA C 12.777 -12.618 8.674 1.00 . A B . 3 MET CA 1 1 4 2545 1 1 3 MET CB C 13.958 -11.939 9.387 1.00 . A B . 3 MET CB 1 1 4 2546 1 1 3 MET CE C 16.362 -12.205 11.485 1.00 . A B . 3 MET CE 1 1 4 2547 1 1 3 MET CG C 13.711 -11.662 10.865 1.00 . A B . 3 MET CG 1 1 4 2548 1 1 3 MET H H 13.137 -12.560 6.588 1.00 . A B . 3 MET H 1 1 4 2549 1 1 3 MET HA H 12.432 -13.450 9.270 1.00 . A B . 3 MET HA 1 1 4 2550 1 1 3 MET HB2 H 14.825 -12.579 9.304 1.00 . A B . 3 MET HB2 1 1 4 2551 1 1 3 MET HB3 H 14.168 -11.000 8.895 1.00 . A B . 3 MET HB3 1 1 4 2552 1 1 3 MET HE1 H 16.560 -12.356 10.435 1.00 . A B . 3 MET HE1 1 1 4 2553 1 1 3 MET HE2 H 15.991 -13.124 11.916 1.00 . A B . 3 MET HE2 1 1 4 2554 1 1 3 MET HE3 H 17.275 -11.916 11.986 1.00 . A B . 3 MET HE3 1 1 4 2555 1 1 3 MET HG2 H 12.870 -10.990 10.955 1.00 . A B . 3 MET HG2 1 1 4 2556 1 1 3 MET HG3 H 13.478 -12.594 11.359 1.00 . A B . 3 MET HG3 1 1 4 2557 1 1 3 MET N N 13.202 -13.138 7.381 1.00 . A B . 3 MET N 1 1 4 2558 1 1 3 MET O O 11.445 -10.681 9.223 1.00 . A B . 3 MET O 1 1 4 2559 1 1 3 MET SD S 15.136 -10.913 11.686 1.00 . A B . 3 MET SD 1 1 4 2560 1 1 4 GLY C C 9.727 -10.624 5.671 1.00 . A B . 4 GLY C 1 1 4 2561 1 1 4 GLY CA C 9.711 -11.050 7.122 1.00 . A B . 4 GLY CA 1 1 4 2562 1 1 4 GLY H H 11.003 -12.707 6.899 1.00 . A B . 4 GLY H 1 1 4 2563 1 1 4 GLY HA2 H 8.791 -11.578 7.325 1.00 . A B . 4 GLY HA2 1 1 4 2564 1 1 4 GLY HA3 H 9.755 -10.170 7.746 1.00 . A B . 4 GLY HA3 1 1 4 2565 1 1 4 GLY N N 10.829 -11.909 7.447 1.00 . A B . 4 GLY N 1 1 4 2566 1 1 4 GLY O O 10.711 -10.849 4.965 1.00 . A B . 4 GLY O 1 1 4 2567 1 1 5 MET C C 8.804 -8.030 3.813 1.00 . A B . 5 MET C 1 1 4 2568 1 1 5 MET CA C 8.554 -9.532 3.850 1.00 . A B . 5 MET CA 1 1 4 2569 1 1 5 MET CB C 7.185 -9.867 3.242 1.00 . A B . 5 MET CB 1 1 4 2570 1 1 5 MET CE C 7.978 -11.599 0.647 1.00 . A B . 5 MET CE 1 1 4 2571 1 1 5 MET CG C 6.974 -9.300 1.840 1.00 . A B . 5 MET CG 1 1 4 2572 1 1 5 MET H H 7.879 -9.890 5.823 1.00 . A B . 5 MET H 1 1 4 2573 1 1 5 MET HA H 9.324 -10.027 3.276 1.00 . A B . 5 MET HA 1 1 4 2574 1 1 5 MET HB2 H 7.079 -10.941 3.190 1.00 . A B . 5 MET HB2 1 1 4 2575 1 1 5 MET HB3 H 6.412 -9.471 3.885 1.00 . A B . 5 MET HB3 1 1 4 2576 1 1 5 MET HE1 H 6.971 -11.811 0.317 1.00 . A B . 5 MET HE1 1 1 4 2577 1 1 5 MET HE2 H 8.121 -11.992 1.641 1.00 . A B . 5 MET HE2 1 1 4 2578 1 1 5 MET HE3 H 8.683 -12.062 -0.027 1.00 . A B . 5 MET HE3 1 1 4 2579 1 1 5 MET HG2 H 6.013 -9.625 1.476 1.00 . A B . 5 MET HG2 1 1 4 2580 1 1 5 MET HG3 H 6.987 -8.220 1.900 1.00 . A B . 5 MET HG3 1 1 4 2581 1 1 5 MET N N 8.641 -10.020 5.219 1.00 . A B . 5 MET N 1 1 4 2582 1 1 5 MET O O 7.886 -7.228 4.002 1.00 . A B . 5 MET O 1 1 4 2583 1 1 5 MET SD S 8.239 -9.826 0.664 1.00 . A B . 5 MET SD 1 1 4 2584 1 1 6 ARG C C 10.938 -5.909 2.123 1.00 . A B . 6 ARG C 1 1 4 2585 1 1 6 ARG CA C 10.425 -6.250 3.515 1.00 . A B . 6 ARG CA 1 1 4 2586 1 1 6 ARG CB C 11.501 -5.915 4.552 1.00 . A B . 6 ARG CB 1 1 4 2587 1 1 6 ARG CD C 12.142 -5.618 6.953 1.00 . A B . 6 ARG CD 1 1 4 2588 1 1 6 ARG CG C 11.045 -6.053 5.996 1.00 . A B . 6 ARG CG 1 1 4 2589 1 1 6 ARG CZ C 12.406 -5.102 9.348 1.00 . A B . 6 ARG CZ 1 1 4 2590 1 1 6 ARG H H 10.747 -8.340 3.472 1.00 . A B . 6 ARG H 1 1 4 2591 1 1 6 ARG HA H 9.543 -5.662 3.718 1.00 . A B . 6 ARG HA 1 1 4 2592 1 1 6 ARG HB2 H 12.343 -6.573 4.402 1.00 . A B . 6 ARG HB2 1 1 4 2593 1 1 6 ARG HB3 H 11.824 -4.895 4.396 1.00 . A B . 6 ARG HB3 1 1 4 2594 1 1 6 ARG HD2 H 12.986 -6.280 6.836 1.00 . A B . 6 ARG HD2 1 1 4 2595 1 1 6 ARG HD3 H 12.441 -4.612 6.703 1.00 . A B . 6 ARG HD3 1 1 4 2596 1 1 6 ARG HE H 10.854 -6.094 8.549 1.00 . A B . 6 ARG HE 1 1 4 2597 1 1 6 ARG HG2 H 10.174 -5.433 6.153 1.00 . A B . 6 ARG HG2 1 1 4 2598 1 1 6 ARG HG3 H 10.796 -7.086 6.189 1.00 . A B . 6 ARG HG3 1 1 4 2599 1 1 6 ARG HH11 H 13.930 -4.475 8.167 1.00 . A B . 6 ARG HH11 1 1 4 2600 1 1 6 ARG HH12 H 14.089 -4.092 9.849 1.00 . A B . 6 ARG HH12 1 1 4 2601 1 1 6 ARG HH21 H 11.067 -5.598 10.784 1.00 . A B . 6 ARG HH21 1 1 4 2602 1 1 6 ARG HH22 H 12.471 -4.748 11.341 1.00 . A B . 6 ARG HH22 1 1 4 2603 1 1 6 ARG N N 10.053 -7.654 3.592 1.00 . A B . 6 ARG N 1 1 4 2604 1 1 6 ARG NE N 11.710 -5.648 8.350 1.00 . A B . 6 ARG NE 1 1 4 2605 1 1 6 ARG NH1 N 13.568 -4.511 9.103 1.00 . A B . 6 ARG NH1 1 1 4 2606 1 1 6 ARG NH2 N 11.944 -5.152 10.590 1.00 . A B . 6 ARG NH2 1 1 4 2607 1 1 6 ARG O O 12.049 -6.290 1.754 1.00 . A B . 6 ARG O 1 1 4 2608 1 1 7 ASN C C 10.069 -3.311 -0.182 1.00 . A B . 7 ASN C 1 1 4 2609 1 1 7 ASN CA C 10.561 -4.733 0.041 1.00 . A B . 7 ASN CA 1 1 4 2610 1 1 7 ASN CB C 10.073 -5.647 -1.085 1.00 . A B . 7 ASN CB 1 1 4 2611 1 1 7 ASN CG C 10.840 -5.416 -2.386 1.00 . A B . 7 ASN CG 1 1 4 2612 1 1 7 ASN H H 9.218 -5.010 1.652 1.00 . A B . 7 ASN H 1 1 4 2613 1 1 7 ASN HA H 11.642 -4.726 0.041 1.00 . A B . 7 ASN HA 1 1 4 2614 1 1 7 ASN HB2 H 10.200 -6.676 -0.783 1.00 . A B . 7 ASN HB2 1 1 4 2615 1 1 7 ASN HB3 H 9.025 -5.453 -1.262 1.00 . A B . 7 ASN HB3 1 1 4 2616 1 1 7 ASN HD21 H 10.514 -7.293 -2.969 1.00 . A B . 7 ASN HD21 1 1 4 2617 1 1 7 ASN HD22 H 11.432 -6.312 -4.060 1.00 . A B . 7 ASN HD22 1 1 4 2618 1 1 7 ASN N N 10.126 -5.211 1.345 1.00 . A B . 7 ASN N 1 1 4 2619 1 1 7 ASN ND2 N 10.936 -6.443 -3.221 1.00 . A B . 7 ASN ND2 1 1 4 2620 1 1 7 ASN O O 9.377 -3.013 -1.155 1.00 . A B . 7 ASN O 1 1 4 2621 1 1 7 ASN OD1 O 11.342 -4.321 -2.643 1.00 . A B . 7 ASN OD1 1 1 4 2622 1 1 8 LEU C C 11.345 -0.313 0.035 1.00 . A B . 8 LEU C 1 1 4 2623 1 1 8 LEU CA C 10.124 -1.023 0.593 1.00 . A B . 8 LEU CA 1 1 4 2624 1 1 8 LEU CB C 9.664 -0.400 1.923 1.00 . A B . 8 LEU CB 1 1 4 2625 1 1 8 LEU CD1 C 11.739 0.327 3.175 1.00 . A B . 8 LEU CD1 1 1 4 2626 1 1 8 LEU CD2 C 9.750 -0.533 4.425 1.00 . A B . 8 LEU CD2 1 1 4 2627 1 1 8 LEU CG C 10.564 -0.643 3.144 1.00 . A B . 8 LEU CG 1 1 4 2628 1 1 8 LEU H H 10.885 -2.751 1.542 1.00 . A B . 8 LEU H 1 1 4 2629 1 1 8 LEU HA H 9.327 -0.938 -0.128 1.00 . A B . 8 LEU HA 1 1 4 2630 1 1 8 LEU HB2 H 9.582 0.667 1.779 1.00 . A B . 8 LEU HB2 1 1 4 2631 1 1 8 LEU HB3 H 8.680 -0.787 2.150 1.00 . A B . 8 LEU HB3 1 1 4 2632 1 1 8 LEU HD11 H 12.367 0.106 4.026 1.00 . A B . 8 LEU HD11 1 1 4 2633 1 1 8 LEU HD12 H 11.369 1.339 3.258 1.00 . A B . 8 LEU HD12 1 1 4 2634 1 1 8 LEU HD13 H 12.314 0.229 2.267 1.00 . A B . 8 LEU HD13 1 1 4 2635 1 1 8 LEU HD21 H 10.393 -0.706 5.275 1.00 . A B . 8 LEU HD21 1 1 4 2636 1 1 8 LEU HD22 H 8.961 -1.271 4.414 1.00 . A B . 8 LEU HD22 1 1 4 2637 1 1 8 LEU HD23 H 9.319 0.455 4.495 1.00 . A B . 8 LEU HD23 1 1 4 2638 1 1 8 LEU HG H 10.964 -1.644 3.090 1.00 . A B . 8 LEU HG 1 1 4 2639 1 1 8 LEU N N 10.416 -2.438 0.743 1.00 . A B . 8 LEU N 1 1 4 2640 1 1 8 LEU O O 11.363 0.907 -0.119 1.00 . A B . 8 LEU O 1 1 4 2641 1 1 9 ASP C C 13.384 -0.132 -2.275 1.00 . A B . 9 ASP C 1 1 4 2642 1 1 9 ASP CA C 13.598 -0.590 -0.846 1.00 . A B . 9 ASP CA 1 1 4 2643 1 1 9 ASP CB C 14.704 -1.649 -0.802 1.00 . A B . 9 ASP CB 1 1 4 2644 1 1 9 ASP CG C 15.123 -2.008 0.609 1.00 . A B . 9 ASP CG 1 1 4 2645 1 1 9 ASP H H 12.250 -2.072 -0.173 1.00 . A B . 9 ASP H 1 1 4 2646 1 1 9 ASP HA H 13.896 0.256 -0.250 1.00 . A B . 9 ASP HA 1 1 4 2647 1 1 9 ASP HB2 H 14.351 -2.546 -1.286 1.00 . A B . 9 ASP HB2 1 1 4 2648 1 1 9 ASP HB3 H 15.569 -1.277 -1.330 1.00 . A B . 9 ASP HB3 1 1 4 2649 1 1 9 ASP N N 12.355 -1.108 -0.296 1.00 . A B . 9 ASP N 1 1 4 2650 1 1 9 ASP O O 13.987 0.840 -2.724 1.00 . A B . 9 ASP O 1 1 4 2651 1 1 9 ASP OD1 O 15.661 -1.129 1.318 1.00 . A B . 9 ASP OD1 1 1 4 2652 1 1 9 ASP OD2 O 14.902 -3.163 1.023 1.00 . A B . 9 ASP OD2 1 1 4 2653 1 1 10 GLU C C 10.967 0.438 -4.376 1.00 . A B . 10 GLU C 1 1 4 2654 1 1 10 GLU CA C 12.182 -0.477 -4.358 1.00 . A B . 10 GLU CA 1 1 4 2655 1 1 10 GLU CB C 11.914 -1.730 -5.192 1.00 . A B . 10 GLU CB 1 1 4 2656 1 1 10 GLU CD C 12.822 -3.900 -6.104 1.00 . A B . 10 GLU CD 1 1 4 2657 1 1 10 GLU CG C 13.105 -2.668 -5.272 1.00 . A B . 10 GLU CG 1 1 4 2658 1 1 10 GLU H H 12.101 -1.627 -2.578 1.00 . A B . 10 GLU H 1 1 4 2659 1 1 10 GLU HA H 13.023 0.051 -4.777 1.00 . A B . 10 GLU HA 1 1 4 2660 1 1 10 GLU HB2 H 11.086 -2.271 -4.755 1.00 . A B . 10 GLU HB2 1 1 4 2661 1 1 10 GLU HB3 H 11.649 -1.429 -6.194 1.00 . A B . 10 GLU HB3 1 1 4 2662 1 1 10 GLU HG2 H 13.936 -2.137 -5.713 1.00 . A B . 10 GLU HG2 1 1 4 2663 1 1 10 GLU HG3 H 13.367 -2.978 -4.271 1.00 . A B . 10 GLU HG3 1 1 4 2664 1 1 10 GLU N N 12.518 -0.838 -2.986 1.00 . A B . 10 GLU N 1 1 4 2665 1 1 10 GLU O O 10.467 0.821 -5.435 1.00 . A B . 10 GLU O 1 1 4 2666 1 1 10 GLU OE1 O 12.989 -3.840 -7.339 1.00 . A B . 10 GLU OE1 1 1 4 2667 1 1 10 GLU OE2 O 12.433 -4.936 -5.529 1.00 . A B . 10 GLU OE2 1 1 4 2668 1 1 11 CYS C C 9.803 3.042 -2.633 1.00 . A B . 11 CYS C 1 1 4 2669 1 1 11 CYS CA C 9.351 1.641 -3.028 1.00 . A B . 11 CYS CA 1 1 4 2670 1 1 11 CYS CB C 8.439 1.037 -1.965 1.00 . A B . 11 CYS CB 1 1 4 2671 1 1 11 CYS H H 10.992 0.491 -2.394 1.00 . A B . 11 CYS H 1 1 4 2672 1 1 11 CYS HA H 8.828 1.686 -3.969 1.00 . A B . 11 CYS HA 1 1 4 2673 1 1 11 CYS HB2 H 8.238 0.012 -2.226 1.00 . A B . 11 CYS HB2 1 1 4 2674 1 1 11 CYS HB3 H 8.956 1.060 -1.015 1.00 . A B . 11 CYS HB3 1 1 4 2675 1 1 11 CYS N N 10.510 0.789 -3.189 1.00 . A B . 11 CYS N 1 1 4 2676 1 1 11 CYS O O 9.993 3.341 -1.452 1.00 . A B . 11 CYS O 1 1 4 2677 1 1 11 CYS SG S 6.847 1.859 -1.740 1.00 . A B . 11 CYS SG 1 1 4 2678 1 1 12 GLU C C 9.488 6.030 -2.542 1.00 . A B . 12 GLU C 1 1 4 2679 1 1 12 GLU CA C 10.454 5.254 -3.413 1.00 . A B . 12 GLU CA 1 1 4 2680 1 1 12 GLU CB C 10.631 5.965 -4.750 1.00 . A B . 12 GLU CB 1 1 4 2681 1 1 12 GLU CD C 13.048 5.347 -5.087 1.00 . A B . 12 GLU CD 1 1 4 2682 1 1 12 GLU CG C 11.648 5.295 -5.657 1.00 . A B . 12 GLU CG 1 1 4 2683 1 1 12 GLU H H 9.795 3.599 -4.547 1.00 . A B . 12 GLU H 1 1 4 2684 1 1 12 GLU HA H 11.407 5.200 -2.913 1.00 . A B . 12 GLU HA 1 1 4 2685 1 1 12 GLU HB2 H 9.679 5.989 -5.261 1.00 . A B . 12 GLU HB2 1 1 4 2686 1 1 12 GLU HB3 H 10.956 6.977 -4.566 1.00 . A B . 12 GLU HB3 1 1 4 2687 1 1 12 GLU HG2 H 11.366 4.261 -5.789 1.00 . A B . 12 GLU HG2 1 1 4 2688 1 1 12 GLU HG3 H 11.643 5.793 -6.615 1.00 . A B . 12 GLU HG3 1 1 4 2689 1 1 12 GLU N N 9.977 3.895 -3.632 1.00 . A B . 12 GLU N 1 1 4 2690 1 1 12 GLU O O 9.894 6.804 -1.673 1.00 . A B . 12 GLU O 1 1 4 2691 1 1 12 GLU OE1 O 13.401 4.454 -4.290 1.00 . A B . 12 GLU OE1 1 1 4 2692 1 1 12 GLU OE2 O 13.813 6.265 -5.442 1.00 . A B . 12 GLU OE2 1 1 4 2693 1 1 13 VAL C C 7.198 6.153 -0.545 1.00 . A B . 13 VAL C 1 1 4 2694 1 1 13 VAL CA C 7.169 6.489 -2.038 1.00 . A B . 13 VAL CA 1 1 4 2695 1 1 13 VAL CB C 5.780 6.198 -2.651 1.00 . A B . 13 VAL CB 1 1 4 2696 1 1 13 VAL CG1 C 5.499 4.711 -2.690 1.00 . A B . 13 VAL CG1 1 1 4 2697 1 1 13 VAL CG2 C 4.686 6.925 -1.890 1.00 . A B . 13 VAL CG2 1 1 4 2698 1 1 13 VAL H H 7.955 5.094 -3.403 1.00 . A B . 13 VAL H 1 1 4 2699 1 1 13 VAL HA H 7.366 7.542 -2.152 1.00 . A B . 13 VAL HA 1 1 4 2700 1 1 13 VAL HB H 5.781 6.561 -3.668 1.00 . A B . 13 VAL HB 1 1 4 2701 1 1 13 VAL HG11 H 6.317 4.202 -3.174 1.00 . A B . 13 VAL HG11 1 1 4 2702 1 1 13 VAL HG12 H 4.592 4.535 -3.245 1.00 . A B . 13 VAL HG12 1 1 4 2703 1 1 13 VAL HG13 H 5.386 4.340 -1.684 1.00 . A B . 13 VAL HG13 1 1 4 2704 1 1 13 VAL HG21 H 3.742 6.778 -2.389 1.00 . A B . 13 VAL HG21 1 1 4 2705 1 1 13 VAL HG22 H 4.915 7.980 -1.847 1.00 . A B . 13 VAL HG22 1 1 4 2706 1 1 13 VAL HG23 H 4.629 6.527 -0.888 1.00 . A B . 13 VAL HG23 1 1 4 2707 1 1 13 VAL N N 8.208 5.781 -2.752 1.00 . A B . 13 VAL N 1 1 4 2708 1 1 13 VAL O O 6.821 6.975 0.288 1.00 . A B . 13 VAL O 1 1 4 2709 1 1 14 CYS C C 8.890 5.478 1.865 1.00 . A B . 14 CYS C 1 1 4 2710 1 1 14 CYS CA C 7.844 4.596 1.204 1.00 . A B . 14 CYS CA 1 1 4 2711 1 1 14 CYS CB C 8.248 3.131 1.356 1.00 . A B . 14 CYS CB 1 1 4 2712 1 1 14 CYS H H 7.972 4.338 -0.901 1.00 . A B . 14 CYS H 1 1 4 2713 1 1 14 CYS HA H 6.896 4.754 1.694 1.00 . A B . 14 CYS HA 1 1 4 2714 1 1 14 CYS HB2 H 8.561 2.752 0.396 1.00 . A B . 14 CYS HB2 1 1 4 2715 1 1 14 CYS HB3 H 9.074 3.066 2.048 1.00 . A B . 14 CYS HB3 1 1 4 2716 1 1 14 CYS N N 7.690 4.966 -0.200 1.00 . A B . 14 CYS N 1 1 4 2717 1 1 14 CYS O O 8.708 5.945 2.988 1.00 . A B . 14 CYS O 1 1 4 2718 1 1 14 CYS SG S 6.931 2.059 1.971 1.00 . A B . 14 CYS SG 1 1 4 2719 1 1 15 ARG C C 10.671 7.988 1.753 1.00 . A B . 15 ARG C 1 1 4 2720 1 1 15 ARG CA C 11.068 6.519 1.683 1.00 . A B . 15 ARG CA 1 1 4 2721 1 1 15 ARG CB C 12.335 6.336 0.848 1.00 . A B . 15 ARG CB 1 1 4 2722 1 1 15 ARG CD C 14.275 4.802 0.329 1.00 . A B . 15 ARG CD 1 1 4 2723 1 1 15 ARG CG C 12.856 4.906 0.868 1.00 . A B . 15 ARG CG 1 1 4 2724 1 1 15 ARG CZ C 15.482 5.423 -1.730 1.00 . A B . 15 ARG CZ 1 1 4 2725 1 1 15 ARG H H 10.039 5.354 0.239 1.00 . A B . 15 ARG H 1 1 4 2726 1 1 15 ARG HA H 11.261 6.173 2.684 1.00 . A B . 15 ARG HA 1 1 4 2727 1 1 15 ARG HB2 H 12.120 6.608 -0.175 1.00 . A B . 15 ARG HB2 1 1 4 2728 1 1 15 ARG HB3 H 13.106 6.985 1.234 1.00 . A B . 15 ARG HB3 1 1 4 2729 1 1 15 ARG HD2 H 14.892 5.523 0.839 1.00 . A B . 15 ARG HD2 1 1 4 2730 1 1 15 ARG HD3 H 14.646 3.809 0.533 1.00 . A B . 15 ARG HD3 1 1 4 2731 1 1 15 ARG HE H 13.550 4.896 -1.648 1.00 . A B . 15 ARG HE 1 1 4 2732 1 1 15 ARG HG2 H 12.847 4.544 1.886 1.00 . A B . 15 ARG HG2 1 1 4 2733 1 1 15 ARG HG3 H 12.206 4.293 0.264 1.00 . A B . 15 ARG HG3 1 1 4 2734 1 1 15 ARG HH11 H 16.576 5.573 -0.026 1.00 . A B . 15 ARG HH11 1 1 4 2735 1 1 15 ARG HH12 H 17.428 5.946 -1.492 1.00 . A B . 15 ARG HH12 1 1 4 2736 1 1 15 ARG HH21 H 14.669 5.356 -3.592 1.00 . A B . 15 ARG HH21 1 1 4 2737 1 1 15 ARG HH22 H 16.340 5.844 -3.515 1.00 . A B . 15 ARG HH22 1 1 4 2738 1 1 15 ARG N N 9.978 5.719 1.149 1.00 . A B . 15 ARG N 1 1 4 2739 1 1 15 ARG NE N 14.360 5.048 -1.111 1.00 . A B . 15 ARG NE 1 1 4 2740 1 1 15 ARG NH1 N 16.582 5.668 -1.027 1.00 . A B . 15 ARG NH1 1 1 4 2741 1 1 15 ARG NH2 N 15.503 5.550 -3.048 1.00 . A B . 15 ARG NH2 1 1 4 2742 1 1 15 ARG O O 11.201 8.752 2.564 1.00 . A B . 15 ARG O 1 1 4 2743 1 1 16 ASP C C 8.089 9.830 2.021 1.00 . A B . 16 ASP C 1 1 4 2744 1 1 16 ASP CA C 9.163 9.718 0.942 1.00 . A B . 16 ASP CA 1 1 4 2745 1 1 16 ASP CB C 8.580 10.111 -0.416 1.00 . A B . 16 ASP CB 1 1 4 2746 1 1 16 ASP CG C 9.640 10.590 -1.386 1.00 . A B . 16 ASP CG 1 1 4 2747 1 1 16 ASP H H 9.470 7.761 0.179 1.00 . A B . 16 ASP H 1 1 4 2748 1 1 16 ASP HA H 9.962 10.402 1.186 1.00 . A B . 16 ASP HA 1 1 4 2749 1 1 16 ASP HB2 H 8.085 9.255 -0.847 1.00 . A B . 16 ASP HB2 1 1 4 2750 1 1 16 ASP HB3 H 7.861 10.904 -0.275 1.00 . A B . 16 ASP HB3 1 1 4 2751 1 1 16 ASP N N 9.739 8.377 0.895 1.00 . A B . 16 ASP N 1 1 4 2752 1 1 16 ASP O O 7.408 10.850 2.126 1.00 . A B . 16 ASP O 1 1 4 2753 1 1 16 ASP OD1 O 10.020 11.777 -1.329 1.00 . A B . 16 ASP OD1 1 1 4 2754 1 1 16 ASP OD2 O 10.100 9.778 -2.214 1.00 . A B . 16 ASP OD2 1 1 4 2755 1 1 17 GLY C C 5.578 8.582 3.530 1.00 . A B . 17 GLY C 1 1 4 2756 1 1 17 GLY CA C 7.019 8.813 3.938 1.00 . A B . 17 GLY CA 1 1 4 2757 1 1 17 GLY H H 8.457 7.964 2.636 1.00 . A B . 17 GLY H 1 1 4 2758 1 1 17 GLY HA2 H 7.307 8.051 4.647 1.00 . A B . 17 GLY HA2 1 1 4 2759 1 1 17 GLY HA3 H 7.096 9.779 4.414 1.00 . A B . 17 GLY HA3 1 1 4 2760 1 1 17 GLY N N 7.939 8.777 2.815 1.00 . A B . 17 GLY N 1 1 4 2761 1 1 17 GLY O O 4.652 9.062 4.193 1.00 . A B . 17 GLY O 1 1 4 2762 1 1 18 GLY C C 3.310 6.612 2.882 1.00 . A B . 18 GLY C 1 1 4 2763 1 1 18 GLY CA C 4.061 7.546 1.958 1.00 . A B . 18 GLY CA 1 1 4 2764 1 1 18 GLY H H 6.175 7.553 1.924 1.00 . A B . 18 GLY H 1 1 4 2765 1 1 18 GLY HA2 H 3.499 8.461 1.861 1.00 . A B . 18 GLY HA2 1 1 4 2766 1 1 18 GLY HA3 H 4.140 7.080 0.989 1.00 . A B . 18 GLY HA3 1 1 4 2767 1 1 18 GLY N N 5.392 7.862 2.433 1.00 . A B . 18 GLY N 1 1 4 2768 1 1 18 GLY O O 3.907 5.925 3.716 1.00 . A B . 18 GLY O 1 1 4 2769 1 1 19 GLU C C 0.609 4.563 2.809 1.00 . A B . 19 GLU C 1 1 4 2770 1 1 19 GLU CA C 1.143 5.767 3.571 1.00 . A B . 19 GLU CA 1 1 4 2771 1 1 19 GLU CB C -0.022 6.599 4.108 1.00 . A B . 19 GLU CB 1 1 4 2772 1 1 19 GLU CD C -0.740 8.303 5.824 1.00 . A B . 19 GLU CD 1 1 4 2773 1 1 19 GLU CG C 0.408 7.741 5.016 1.00 . A B . 19 GLU CG 1 1 4 2774 1 1 19 GLU H H 1.590 7.118 2.013 1.00 . A B . 19 GLU H 1 1 4 2775 1 1 19 GLU HA H 1.736 5.413 4.401 1.00 . A B . 19 GLU HA 1 1 4 2776 1 1 19 GLU HB2 H -0.554 7.020 3.270 1.00 . A B . 19 GLU HB2 1 1 4 2777 1 1 19 GLU HB3 H -0.692 5.953 4.660 1.00 . A B . 19 GLU HB3 1 1 4 2778 1 1 19 GLU HG2 H 1.164 7.382 5.699 1.00 . A B . 19 GLU HG2 1 1 4 2779 1 1 19 GLU HG3 H 0.821 8.533 4.409 1.00 . A B . 19 GLU HG3 1 1 4 2780 1 1 19 GLU N N 1.998 6.581 2.725 1.00 . A B . 19 GLU N 1 1 4 2781 1 1 19 GLU O O 0.517 4.581 1.579 1.00 . A B . 19 GLU O 1 1 4 2782 1 1 19 GLU OE1 O -1.452 9.186 5.305 1.00 . A B . 19 GLU OE1 1 1 4 2783 1 1 19 GLU OE2 O -0.948 7.857 6.972 1.00 . A B . 19 GLU OE2 1 1 4 2784 1 1 20 LEU C C -1.822 2.342 3.172 1.00 . A B . 20 LEU C 1 1 4 2785 1 1 20 LEU CA C -0.316 2.322 2.985 1.00 . A B . 20 LEU CA 1 1 4 2786 1 1 20 LEU CB C 0.259 1.071 3.652 1.00 . A B . 20 LEU CB 1 1 4 2787 1 1 20 LEU CD1 C 2.230 -0.404 4.098 1.00 . A B . 20 LEU CD1 1 1 4 2788 1 1 20 LEU CD2 C 1.524 0.038 1.748 1.00 . A B . 20 LEU CD2 1 1 4 2789 1 1 20 LEU CG C 1.633 0.625 3.151 1.00 . A B . 20 LEU CG 1 1 4 2790 1 1 20 LEU H H 0.415 3.567 4.523 1.00 . A B . 20 LEU H 1 1 4 2791 1 1 20 LEU HA H -0.087 2.302 1.932 1.00 . A B . 20 LEU HA 1 1 4 2792 1 1 20 LEU HB2 H 0.335 1.260 4.713 1.00 . A B . 20 LEU HB2 1 1 4 2793 1 1 20 LEU HB3 H -0.436 0.260 3.498 1.00 . A B . 20 LEU HB3 1 1 4 2794 1 1 20 LEU HD11 H 2.341 0.032 5.080 1.00 . A B . 20 LEU HD11 1 1 4 2795 1 1 20 LEU HD12 H 3.196 -0.715 3.730 1.00 . A B . 20 LEU HD12 1 1 4 2796 1 1 20 LEU HD13 H 1.574 -1.261 4.157 1.00 . A B . 20 LEU HD13 1 1 4 2797 1 1 20 LEU HD21 H 1.164 0.791 1.064 1.00 . A B . 20 LEU HD21 1 1 4 2798 1 1 20 LEU HD22 H 0.838 -0.796 1.758 1.00 . A B . 20 LEU HD22 1 1 4 2799 1 1 20 LEU HD23 H 2.496 -0.305 1.427 1.00 . A B . 20 LEU HD23 1 1 4 2800 1 1 20 LEU HG H 2.296 1.479 3.111 1.00 . A B . 20 LEU HG 1 1 4 2801 1 1 20 LEU N N 0.274 3.522 3.553 1.00 . A B . 20 LEU N 1 1 4 2802 1 1 20 LEU O O -2.314 2.568 4.280 1.00 . A B . 20 LEU O 1 1 4 2803 1 1 21 PHE C C -4.505 0.652 2.007 1.00 . A B . 21 PHE C 1 1 4 2804 1 1 21 PHE CA C -4.007 2.085 2.162 1.00 . A B . 21 PHE CA 1 1 4 2805 1 1 21 PHE CB C -4.594 2.995 1.077 1.00 . A B . 21 PHE CB 1 1 4 2806 1 1 21 PHE CD1 C -4.414 5.293 2.091 1.00 . A B . 21 PHE CD1 1 1 4 2807 1 1 21 PHE CD2 C -3.120 4.808 0.144 1.00 . A B . 21 PHE CD2 1 1 4 2808 1 1 21 PHE CE1 C -3.908 6.576 2.109 1.00 . A B . 21 PHE CE1 1 1 4 2809 1 1 21 PHE CE2 C -2.611 6.092 0.162 1.00 . A B . 21 PHE CE2 1 1 4 2810 1 1 21 PHE CG C -4.026 4.390 1.108 1.00 . A B . 21 PHE CG 1 1 4 2811 1 1 21 PHE CZ C -2.949 6.953 1.189 1.00 . A B . 21 PHE CZ 1 1 4 2812 1 1 21 PHE H H -2.111 1.935 1.235 1.00 . A B . 21 PHE H 1 1 4 2813 1 1 21 PHE HA H -4.299 2.455 3.136 1.00 . A B . 21 PHE HA 1 1 4 2814 1 1 21 PHE HB2 H -4.381 2.569 0.106 1.00 . A B . 21 PHE HB2 1 1 4 2815 1 1 21 PHE HB3 H -5.665 3.065 1.209 1.00 . A B . 21 PHE HB3 1 1 4 2816 1 1 21 PHE HD1 H -5.116 4.986 2.851 1.00 . A B . 21 PHE HD1 1 1 4 2817 1 1 21 PHE HD2 H -2.806 4.121 -0.627 1.00 . A B . 21 PHE HD2 1 1 4 2818 1 1 21 PHE HE1 H -4.218 7.267 2.877 1.00 . A B . 21 PHE HE1 1 1 4 2819 1 1 21 PHE HE2 H -1.907 6.403 -0.594 1.00 . A B . 21 PHE HE2 1 1 4 2820 1 1 21 PHE HZ H -2.532 7.948 1.221 1.00 . A B . 21 PHE HZ 1 1 4 2821 1 1 21 PHE N N -2.554 2.105 2.098 1.00 . A B . 21 PHE N 1 1 4 2822 1 1 21 PHE O O -5.577 0.393 1.457 1.00 . A B . 21 PHE O 1 1 4 2823 1 1 22 CYS C C -3.764 -2.397 3.716 1.00 . A B . 22 CYS C 1 1 4 2824 1 1 22 CYS CA C -4.002 -1.695 2.394 1.00 . A B . 22 CYS CA 1 1 4 2825 1 1 22 CYS CB C -3.127 -2.347 1.324 1.00 . A B . 22 CYS CB 1 1 4 2826 1 1 22 CYS H H -2.879 -0.001 2.951 1.00 . A B . 22 CYS H 1 1 4 2827 1 1 22 CYS HA H -5.039 -1.801 2.117 1.00 . A B . 22 CYS HA 1 1 4 2828 1 1 22 CYS HB2 H -2.133 -1.923 1.379 1.00 . A B . 22 CYS HB2 1 1 4 2829 1 1 22 CYS HB3 H -3.069 -3.411 1.511 1.00 . A B . 22 CYS HB3 1 1 4 2830 1 1 22 CYS N N -3.703 -0.279 2.499 1.00 . A B . 22 CYS N 1 1 4 2831 1 1 22 CYS O O -3.020 -1.910 4.567 1.00 . A B . 22 CYS O 1 1 4 2832 1 1 22 CYS SG S -3.721 -2.119 -0.376 1.00 . A B . 22 CYS SG 1 1 4 2833 1 1 23 CYS C C -2.891 -5.199 4.767 1.00 . A B . 23 CYS C 1 1 4 2834 1 1 23 CYS CA C -4.161 -4.391 5.021 1.00 . A B . 23 CYS CA 1 1 4 2835 1 1 23 CYS CB C -5.366 -5.314 5.263 1.00 . A B . 23 CYS CB 1 1 4 2836 1 1 23 CYS H H -5.019 -3.845 3.178 1.00 . A B . 23 CYS H 1 1 4 2837 1 1 23 CYS HA H -4.010 -3.754 5.883 1.00 . A B . 23 CYS HA 1 1 4 2838 1 1 23 CYS HB2 H -5.298 -5.731 6.259 1.00 . A B . 23 CYS HB2 1 1 4 2839 1 1 23 CYS HB3 H -6.275 -4.733 5.181 1.00 . A B . 23 CYS HB3 1 1 4 2840 1 1 23 CYS N N -4.395 -3.550 3.870 1.00 . A B . 23 CYS N 1 1 4 2841 1 1 23 CYS O O -2.402 -5.219 3.633 1.00 . A B . 23 CYS O 1 1 4 2842 1 1 23 CYS SG S -5.494 -6.697 4.104 1.00 . A B . 23 CYS SG 1 1 4 2843 1 1 24 ASP C C -1.046 -7.500 4.489 1.00 . A B . 24 ASP C 1 1 4 2844 1 1 24 ASP CA C -1.093 -6.575 5.698 1.00 . A B . 24 ASP CA 1 1 4 2845 1 1 24 ASP CB C -0.832 -7.393 6.964 1.00 . A B . 24 ASP CB 1 1 4 2846 1 1 24 ASP CG C -0.727 -6.531 8.200 1.00 . A B . 24 ASP CG 1 1 4 2847 1 1 24 ASP H H -2.861 -5.874 6.649 1.00 . A B . 24 ASP H 1 1 4 2848 1 1 24 ASP HA H -0.313 -5.837 5.599 1.00 . A B . 24 ASP HA 1 1 4 2849 1 1 24 ASP HB2 H -1.640 -8.093 7.106 1.00 . A B . 24 ASP HB2 1 1 4 2850 1 1 24 ASP HB3 H 0.094 -7.938 6.847 1.00 . A B . 24 ASP HB3 1 1 4 2851 1 1 24 ASP N N -2.374 -5.862 5.795 1.00 . A B . 24 ASP N 1 1 4 2852 1 1 24 ASP O O -0.106 -7.449 3.695 1.00 . A B . 24 ASP O 1 1 4 2853 1 1 24 ASP OD1 O 0.384 -6.040 8.489 1.00 . A B . 24 ASP OD1 1 1 4 2854 1 1 24 ASP OD2 O -1.751 -6.342 8.889 1.00 . A B . 24 ASP OD2 1 1 4 2855 1 1 25 THR C C -2.044 -8.702 1.902 1.00 . A B . 25 THR C 1 1 4 2856 1 1 25 THR CA C -2.121 -9.325 3.298 1.00 . A B . 25 THR CA 1 1 4 2857 1 1 25 THR CB C -3.394 -10.179 3.436 1.00 . A B . 25 THR CB 1 1 4 2858 1 1 25 THR CG2 C -3.393 -11.336 2.450 1.00 . A B . 25 THR CG2 1 1 4 2859 1 1 25 THR H H -2.833 -8.239 4.961 1.00 . A B . 25 THR H 1 1 4 2860 1 1 25 THR HA H -1.267 -9.974 3.431 1.00 . A B . 25 THR HA 1 1 4 2861 1 1 25 THR HB H -4.252 -9.553 3.241 1.00 . A B . 25 THR HB 1 1 4 2862 1 1 25 THR HG1 H -2.598 -10.974 5.061 1.00 . A B . 25 THR HG1 1 1 4 2863 1 1 25 THR HG21 H -3.338 -10.952 1.442 1.00 . A B . 25 THR HG21 1 1 4 2864 1 1 25 THR HG22 H -4.302 -11.908 2.567 1.00 . A B . 25 THR HG22 1 1 4 2865 1 1 25 THR HG23 H -2.542 -11.970 2.642 1.00 . A B . 25 THR HG23 1 1 4 2866 1 1 25 THR N N -2.077 -8.317 4.343 1.00 . A B . 25 THR N 1 1 4 2867 1 1 25 THR O O -1.236 -9.117 1.074 1.00 . A B . 25 THR O 1 1 4 2868 1 1 25 THR OG1 O -3.478 -10.689 4.777 1.00 . A B . 25 THR OG1 1 1 4 2869 1 1 26 CYS C C -1.614 -6.219 0.104 1.00 . A B . 26 CYS C 1 1 4 2870 1 1 26 CYS CA C -2.877 -7.046 0.339 1.00 . A B . 26 CYS CA 1 1 4 2871 1 1 26 CYS CB C -4.112 -6.160 0.178 1.00 . A B . 26 CYS CB 1 1 4 2872 1 1 26 CYS H H -3.445 -7.353 2.362 1.00 . A B . 26 CYS H 1 1 4 2873 1 1 26 CYS HA H -2.913 -7.833 -0.400 1.00 . A B . 26 CYS HA 1 1 4 2874 1 1 26 CYS HB2 H -4.074 -5.373 0.913 1.00 . A B . 26 CYS HB2 1 1 4 2875 1 1 26 CYS HB3 H -4.107 -5.721 -0.807 1.00 . A B . 26 CYS HB3 1 1 4 2876 1 1 26 CYS N N -2.855 -7.682 1.653 1.00 . A B . 26 CYS N 1 1 4 2877 1 1 26 CYS O O -1.108 -6.161 -1.013 1.00 . A B . 26 CYS O 1 1 4 2878 1 1 26 CYS SG S -5.684 -7.022 0.392 1.00 . A B . 26 CYS SG 1 1 4 2879 1 1 27 SER C C 1.307 -5.565 0.667 1.00 . A B . 27 SER C 1 1 4 2880 1 1 27 SER CA C 0.079 -4.748 1.055 1.00 . A B . 27 SER CA 1 1 4 2881 1 1 27 SER CB C 0.328 -4.027 2.383 1.00 . A B . 27 SER CB 1 1 4 2882 1 1 27 SER H H -1.512 -5.723 2.046 1.00 . A B . 27 SER H 1 1 4 2883 1 1 27 SER HA H -0.109 -4.015 0.286 1.00 . A B . 27 SER HA 1 1 4 2884 1 1 27 SER HB2 H -0.528 -3.414 2.622 1.00 . A B . 27 SER HB2 1 1 4 2885 1 1 27 SER HB3 H 0.473 -4.758 3.164 1.00 . A B . 27 SER HB3 1 1 4 2886 1 1 27 SER HG H 1.986 -3.297 3.131 1.00 . A B . 27 SER HG 1 1 4 2887 1 1 27 SER N N -1.100 -5.600 1.163 1.00 . A B . 27 SER N 1 1 4 2888 1 1 27 SER O O 2.169 -5.099 -0.067 1.00 . A B . 27 SER O 1 1 4 2889 1 1 27 SER OG O 1.472 -3.196 2.319 1.00 . A B . 27 SER OG 1 1 4 2890 1 1 28 ARG C C 2.441 -8.219 -0.546 1.00 . A B . 28 ARG C 1 1 4 2891 1 1 28 ARG CA C 2.514 -7.654 0.871 1.00 . A B . 28 ARG CA 1 1 4 2892 1 1 28 ARG CB C 2.597 -8.775 1.912 1.00 . A B . 28 ARG CB 1 1 4 2893 1 1 28 ARG CD C 2.820 -9.352 4.362 1.00 . A B . 28 ARG CD 1 1 4 2894 1 1 28 ARG CG C 2.919 -8.261 3.308 1.00 . A B . 28 ARG CG 1 1 4 2895 1 1 28 ARG CZ C 3.094 -9.536 6.813 1.00 . A B . 28 ARG CZ 1 1 4 2896 1 1 28 ARG H H 0.658 -7.122 1.736 1.00 . A B . 28 ARG H 1 1 4 2897 1 1 28 ARG HA H 3.403 -7.047 0.947 1.00 . A B . 28 ARG HA 1 1 4 2898 1 1 28 ARG HB2 H 1.647 -9.289 1.948 1.00 . A B . 28 ARG HB2 1 1 4 2899 1 1 28 ARG HB3 H 3.367 -9.472 1.619 1.00 . A B . 28 ARG HB3 1 1 4 2900 1 1 28 ARG HD2 H 1.863 -9.842 4.269 1.00 . A B . 28 ARG HD2 1 1 4 2901 1 1 28 ARG HD3 H 3.612 -10.069 4.200 1.00 . A B . 28 ARG HD3 1 1 4 2902 1 1 28 ARG HE H 2.902 -7.822 5.798 1.00 . A B . 28 ARG HE 1 1 4 2903 1 1 28 ARG HG2 H 3.924 -7.869 3.312 1.00 . A B . 28 ARG HG2 1 1 4 2904 1 1 28 ARG HG3 H 2.226 -7.472 3.559 1.00 . A B . 28 ARG HG3 1 1 4 2905 1 1 28 ARG HH11 H 3.064 -11.321 5.850 1.00 . A B . 28 ARG HH11 1 1 4 2906 1 1 28 ARG HH12 H 3.256 -11.411 7.572 1.00 . A B . 28 ARG HH12 1 1 4 2907 1 1 28 ARG HH21 H 3.143 -7.935 8.057 1.00 . A B . 28 ARG HH21 1 1 4 2908 1 1 28 ARG HH22 H 3.304 -9.483 8.828 1.00 . A B . 28 ARG HH22 1 1 4 2909 1 1 28 ARG N N 1.377 -6.793 1.154 1.00 . A B . 28 ARG N 1 1 4 2910 1 1 28 ARG NE N 2.944 -8.803 5.710 1.00 . A B . 28 ARG NE 1 1 4 2911 1 1 28 ARG NH1 N 3.142 -10.861 6.739 1.00 . A B . 28 ARG NH1 1 1 4 2912 1 1 28 ARG NH2 N 3.186 -8.937 7.992 1.00 . A B . 28 ARG NH2 1 1 4 2913 1 1 28 ARG O O 3.447 -8.675 -1.092 1.00 . A B . 28 ARG O 1 1 4 2914 1 1 29 VAL C C 1.142 -7.516 -3.512 1.00 . A B . 29 VAL C 1 1 4 2915 1 1 29 VAL CA C 1.073 -8.668 -2.503 1.00 . A B . 29 VAL CA 1 1 4 2916 1 1 29 VAL CB C -0.267 -9.423 -2.672 1.00 . A B . 29 VAL CB 1 1 4 2917 1 1 29 VAL CG1 C -0.412 -9.962 -4.087 1.00 . A B . 29 VAL CG1 1 1 4 2918 1 1 29 VAL CG2 C -0.375 -10.556 -1.667 1.00 . A B . 29 VAL CG2 1 1 4 2919 1 1 29 VAL H H 0.481 -7.837 -0.646 1.00 . A B . 29 VAL H 1 1 4 2920 1 1 29 VAL HA H 1.874 -9.357 -2.714 1.00 . A B . 29 VAL HA 1 1 4 2921 1 1 29 VAL HB H -1.072 -8.730 -2.486 1.00 . A B . 29 VAL HB 1 1 4 2922 1 1 29 VAL HG11 H -0.370 -9.145 -4.791 1.00 . A B . 29 VAL HG11 1 1 4 2923 1 1 29 VAL HG12 H -1.360 -10.472 -4.182 1.00 . A B . 29 VAL HG12 1 1 4 2924 1 1 29 VAL HG13 H 0.391 -10.655 -4.291 1.00 . A B . 29 VAL HG13 1 1 4 2925 1 1 29 VAL HG21 H 0.457 -11.232 -1.798 1.00 . A B . 29 VAL HG21 1 1 4 2926 1 1 29 VAL HG22 H -1.301 -11.090 -1.827 1.00 . A B . 29 VAL HG22 1 1 4 2927 1 1 29 VAL HG23 H -0.360 -10.154 -0.665 1.00 . A B . 29 VAL HG23 1 1 4 2928 1 1 29 VAL N N 1.253 -8.189 -1.138 1.00 . A B . 29 VAL N 1 1 4 2929 1 1 29 VAL O O 1.757 -7.645 -4.571 1.00 . A B . 29 VAL O 1 1 4 2930 1 1 30 PHE C C 1.060 -4.006 -3.406 1.00 . A B . 30 PHE C 1 1 4 2931 1 1 30 PHE CA C 0.481 -5.243 -4.081 1.00 . A B . 30 PHE CA 1 1 4 2932 1 1 30 PHE CB C -0.964 -4.939 -4.506 1.00 . A B . 30 PHE CB 1 1 4 2933 1 1 30 PHE CD1 C -1.409 -6.623 -6.323 1.00 . A B . 30 PHE CD1 1 1 4 2934 1 1 30 PHE CD2 C -2.762 -6.682 -4.360 1.00 . A B . 30 PHE CD2 1 1 4 2935 1 1 30 PHE CE1 C -2.119 -7.688 -6.844 1.00 . A B . 30 PHE CE1 1 1 4 2936 1 1 30 PHE CE2 C -3.473 -7.748 -4.876 1.00 . A B . 30 PHE CE2 1 1 4 2937 1 1 30 PHE CG C -1.721 -6.108 -5.074 1.00 . A B . 30 PHE CG 1 1 4 2938 1 1 30 PHE CZ C -3.150 -8.252 -6.119 1.00 . A B . 30 PHE CZ 1 1 4 2939 1 1 30 PHE H H 0.119 -6.307 -2.284 1.00 . A B . 30 PHE H 1 1 4 2940 1 1 30 PHE HA H 1.070 -5.478 -4.953 1.00 . A B . 30 PHE HA 1 1 4 2941 1 1 30 PHE HB2 H -1.513 -4.584 -3.645 1.00 . A B . 30 PHE HB2 1 1 4 2942 1 1 30 PHE HB3 H -0.949 -4.158 -5.256 1.00 . A B . 30 PHE HB3 1 1 4 2943 1 1 30 PHE HD1 H -0.602 -6.187 -6.894 1.00 . A B . 30 PHE HD1 1 1 4 2944 1 1 30 PHE HD2 H -3.020 -6.287 -3.388 1.00 . A B . 30 PHE HD2 1 1 4 2945 1 1 30 PHE HE1 H -1.866 -8.079 -7.818 1.00 . A B . 30 PHE HE1 1 1 4 2946 1 1 30 PHE HE2 H -4.280 -8.187 -4.306 1.00 . A B . 30 PHE HE2 1 1 4 2947 1 1 30 PHE HZ H -3.704 -9.085 -6.526 1.00 . A B . 30 PHE HZ 1 1 4 2948 1 1 30 PHE N N 0.532 -6.387 -3.174 1.00 . A B . 30 PHE N 1 1 4 2949 1 1 30 PHE O O 0.425 -2.955 -3.392 1.00 . A B . 30 PHE O 1 1 4 2950 1 1 31 HIS C C 2.904 -1.744 -2.857 1.00 . A B . 31 HIS C 1 1 4 2951 1 1 31 HIS CA C 2.868 -3.052 -2.077 1.00 . A B . 31 HIS CA 1 1 4 2952 1 1 31 HIS CB C 4.283 -3.447 -1.639 1.00 . A B . 31 HIS CB 1 1 4 2953 1 1 31 HIS CD2 C 6.048 -1.685 -0.905 1.00 . A B . 31 HIS CD2 1 1 4 2954 1 1 31 HIS CE1 C 5.345 -1.284 1.101 1.00 . A B . 31 HIS CE1 1 1 4 2955 1 1 31 HIS CG C 4.946 -2.459 -0.716 1.00 . A B . 31 HIS CG 1 1 4 2956 1 1 31 HIS H H 2.750 -4.974 -2.969 1.00 . A B . 31 HIS H 1 1 4 2957 1 1 31 HIS HA H 2.261 -2.908 -1.196 1.00 . A B . 31 HIS HA 1 1 4 2958 1 1 31 HIS HB2 H 4.235 -4.397 -1.126 1.00 . A B . 31 HIS HB2 1 1 4 2959 1 1 31 HIS HB3 H 4.903 -3.552 -2.519 1.00 . A B . 31 HIS HB3 1 1 4 2960 1 1 31 HIS HD1 H 3.729 -2.593 1.004 1.00 . A B . 31 HIS HD1 1 1 4 2961 1 1 31 HIS HD2 H 6.633 -1.630 -1.810 1.00 . A B . 31 HIS HD2 1 1 4 2962 1 1 31 HIS HE1 H 5.251 -0.888 2.100 1.00 . A B . 31 HIS HE1 1 1 4 2963 1 1 31 HIS N N 2.261 -4.132 -2.857 1.00 . A B . 31 HIS N 1 1 4 2964 1 1 31 HIS ND1 N 4.514 -2.193 0.564 1.00 . A B . 31 HIS ND1 1 1 4 2965 1 1 31 HIS NE2 N 6.295 -0.941 0.250 1.00 . A B . 31 HIS NE2 1 1 4 2966 1 1 31 HIS O O 2.439 -0.719 -2.374 1.00 . A B . 31 HIS O 1 1 4 2967 1 1 32 GLU C C 2.268 0.082 -5.208 1.00 . A B . 32 GLU C 1 1 4 2968 1 1 32 GLU CA C 3.597 -0.593 -4.883 1.00 . A B . 32 GLU CA 1 1 4 2969 1 1 32 GLU CB C 4.335 -0.933 -6.175 1.00 . A B . 32 GLU CB 1 1 4 2970 1 1 32 GLU CD C 6.365 -1.950 -7.262 1.00 . A B . 32 GLU CD 1 1 4 2971 1 1 32 GLU CG C 5.707 -1.551 -5.960 1.00 . A B . 32 GLU CG 1 1 4 2972 1 1 32 GLU H H 3.570 -2.676 -4.485 1.00 . A B . 32 GLU H 1 1 4 2973 1 1 32 GLU HA H 4.198 0.090 -4.300 1.00 . A B . 32 GLU HA 1 1 4 2974 1 1 32 GLU HB2 H 3.736 -1.630 -6.742 1.00 . A B . 32 GLU HB2 1 1 4 2975 1 1 32 GLU HB3 H 4.459 -0.029 -6.752 1.00 . A B . 32 GLU HB3 1 1 4 2976 1 1 32 GLU HG2 H 6.337 -0.833 -5.459 1.00 . A B . 32 GLU HG2 1 1 4 2977 1 1 32 GLU HG3 H 5.603 -2.431 -5.343 1.00 . A B . 32 GLU HG3 1 1 4 2978 1 1 32 GLU N N 3.387 -1.800 -4.088 1.00 . A B . 32 GLU N 1 1 4 2979 1 1 32 GLU O O 2.159 1.310 -5.183 1.00 . A B . 32 GLU O 1 1 4 2980 1 1 32 GLU OE1 O 7.034 -1.096 -7.880 1.00 . A B . 32 GLU OE1 1 1 4 2981 1 1 32 GLU OE2 O 6.207 -3.118 -7.678 1.00 . A B . 32 GLU OE2 1 1 4 2982 1 1 33 ASP C C -0.843 0.200 -4.637 1.00 . A B . 33 ASP C 1 1 4 2983 1 1 33 ASP CA C -0.055 -0.231 -5.866 1.00 . A B . 33 ASP CA 1 1 4 2984 1 1 33 ASP CB C -0.843 -1.289 -6.644 1.00 . A B . 33 ASP CB 1 1 4 2985 1 1 33 ASP CG C -0.342 -1.463 -8.063 1.00 . A B . 33 ASP CG 1 1 4 2986 1 1 33 ASP H H 1.419 -1.701 -5.463 1.00 . A B . 33 ASP H 1 1 4 2987 1 1 33 ASP HA H 0.090 0.631 -6.500 1.00 . A B . 33 ASP HA 1 1 4 2988 1 1 33 ASP HB2 H -0.757 -2.236 -6.135 1.00 . A B . 33 ASP HB2 1 1 4 2989 1 1 33 ASP HB3 H -1.883 -1.000 -6.683 1.00 . A B . 33 ASP HB3 1 1 4 2990 1 1 33 ASP N N 1.264 -0.731 -5.499 1.00 . A B . 33 ASP N 1 1 4 2991 1 1 33 ASP O O -1.727 1.047 -4.726 1.00 . A B . 33 ASP O 1 1 4 2992 1 1 33 ASP OD1 O -0.790 -0.717 -8.960 1.00 . A B . 33 ASP OD1 1 1 4 2993 1 1 33 ASP OD2 O 0.507 -2.349 -8.289 1.00 . A B . 33 ASP OD2 1 1 4 2994 1 1 34 CYS C C -0.770 1.271 -1.660 1.00 . A B . 34 CYS C 1 1 4 2995 1 1 34 CYS CA C -1.205 -0.071 -2.244 1.00 . A B . 34 CYS CA 1 1 4 2996 1 1 34 CYS CB C -0.987 -1.196 -1.234 1.00 . A B . 34 CYS CB 1 1 4 2997 1 1 34 CYS H H 0.214 -1.040 -3.482 1.00 . A B . 34 CYS H 1 1 4 2998 1 1 34 CYS HA H -2.263 -0.013 -2.470 1.00 . A B . 34 CYS HA 1 1 4 2999 1 1 34 CYS HB2 H 0.031 -1.559 -1.318 1.00 . A B . 34 CYS HB2 1 1 4 3000 1 1 34 CYS HB3 H -1.150 -0.816 -0.236 1.00 . A B . 34 CYS HB3 1 1 4 3001 1 1 34 CYS N N -0.511 -0.375 -3.492 1.00 . A B . 34 CYS N 1 1 4 3002 1 1 34 CYS O O -1.273 1.704 -0.620 1.00 . A B . 34 CYS O 1 1 4 3003 1 1 34 CYS SG S -2.098 -2.617 -1.483 1.00 . A B . 34 CYS SG 1 1 4 3004 1 1 35 HIS C C -0.170 4.272 -2.867 1.00 . A B . 35 HIS C 1 1 4 3005 1 1 35 HIS CA C 0.563 3.280 -1.978 1.00 . A B . 35 HIS CA 1 1 4 3006 1 1 35 HIS CB C 2.069 3.469 -2.131 1.00 . A B . 35 HIS CB 1 1 4 3007 1 1 35 HIS CD2 C 3.318 1.537 -0.969 1.00 . A B . 35 HIS CD2 1 1 4 3008 1 1 35 HIS CE1 C 3.875 2.513 0.872 1.00 . A B . 35 HIS CE1 1 1 4 3009 1 1 35 HIS CG C 2.860 2.804 -1.050 1.00 . A B . 35 HIS CG 1 1 4 3010 1 1 35 HIS H H 0.636 1.462 -3.060 1.00 . A B . 35 HIS H 1 1 4 3011 1 1 35 HIS HA H 0.288 3.454 -0.947 1.00 . A B . 35 HIS HA 1 1 4 3012 1 1 35 HIS HB2 H 2.379 3.048 -3.078 1.00 . A B . 35 HIS HB2 1 1 4 3013 1 1 35 HIS HB3 H 2.293 4.525 -2.116 1.00 . A B . 35 HIS HB3 1 1 4 3014 1 1 35 HIS HD1 H 2.994 4.334 0.397 1.00 . A B . 35 HIS HD1 1 1 4 3015 1 1 35 HIS HD2 H 3.223 0.781 -1.737 1.00 . A B . 35 HIS HD2 1 1 4 3016 1 1 35 HIS HE1 H 4.281 2.713 1.853 1.00 . A B . 35 HIS HE1 1 1 4 3017 1 1 35 HIS N N 0.176 1.918 -2.324 1.00 . A B . 35 HIS N 1 1 4 3018 1 1 35 HIS ND1 N 3.217 3.415 0.131 1.00 . A B . 35 HIS ND1 1 1 4 3019 1 1 35 HIS NE2 N 3.960 1.350 0.247 1.00 . A B . 35 HIS NE2 1 1 4 3020 1 1 35 HIS O O -0.066 5.487 -2.686 1.00 . A B . 35 HIS O 1 1 4 3021 1 1 36 ILE C C -3.107 4.304 -4.719 1.00 . A B . 36 ILE C 1 1 4 3022 1 1 36 ILE CA C -1.601 4.544 -4.815 1.00 . A B . 36 ILE CA 1 1 4 3023 1 1 36 ILE CB C -1.108 4.195 -6.241 1.00 . A B . 36 ILE CB 1 1 4 3024 1 1 36 ILE CD1 C 1.002 3.933 -7.658 1.00 . A B . 36 ILE CD1 1 1 4 3025 1 1 36 ILE CG1 C 0.417 4.333 -6.318 1.00 . A B . 36 ILE CG1 1 1 4 3026 1 1 36 ILE CG2 C -1.776 5.078 -7.287 1.00 . A B . 36 ILE CG2 1 1 4 3027 1 1 36 ILE H H -1.004 2.763 -3.868 1.00 . A B . 36 ILE H 1 1 4 3028 1 1 36 ILE HA H -1.388 5.582 -4.617 1.00 . A B . 36 ILE HA 1 1 4 3029 1 1 36 ILE HB H -1.378 3.170 -6.445 1.00 . A B . 36 ILE HB 1 1 4 3030 1 1 36 ILE HD11 H 2.075 4.046 -7.629 1.00 . A B . 36 ILE HD11 1 1 4 3031 1 1 36 ILE HD12 H 0.594 4.565 -8.433 1.00 . A B . 36 ILE HD12 1 1 4 3032 1 1 36 ILE HD13 H 0.756 2.903 -7.867 1.00 . A B . 36 ILE HD13 1 1 4 3033 1 1 36 ILE HG12 H 0.690 5.360 -6.132 1.00 . A B . 36 ILE HG12 1 1 4 3034 1 1 36 ILE HG13 H 0.865 3.705 -5.562 1.00 . A B . 36 ILE HG13 1 1 4 3035 1 1 36 ILE HG21 H -1.511 6.110 -7.112 1.00 . A B . 36 ILE HG21 1 1 4 3036 1 1 36 ILE HG22 H -2.848 4.966 -7.220 1.00 . A B . 36 ILE HG22 1 1 4 3037 1 1 36 ILE HG23 H -1.444 4.784 -8.270 1.00 . A B . 36 ILE HG23 1 1 4 3038 1 1 36 ILE N N -0.908 3.737 -3.828 1.00 . A B . 36 ILE N 1 1 4 3039 1 1 36 ILE O O -3.547 3.166 -4.568 1.00 . A B . 36 ILE O 1 1 4 3040 1 1 37 PRO C C -3.140 7.385 -3.586 1.00 . A B . 37 PRO C 1 1 4 3041 1 1 37 PRO CA C -3.457 6.741 -4.936 1.00 . A B . 37 PRO CA 1 1 4 3042 1 1 37 PRO CB C -4.654 7.453 -5.603 1.00 . A B . 37 PRO CB 1 1 4 3043 1 1 37 PRO CD C -5.380 5.309 -4.785 1.00 . A B . 37 PRO CD 1 1 4 3044 1 1 37 PRO CG C -5.733 6.416 -5.738 1.00 . A B . 37 PRO CG 1 1 4 3045 1 1 37 PRO HA H -2.592 6.804 -5.579 1.00 . A B . 37 PRO HA 1 1 4 3046 1 1 37 PRO HB2 H -4.978 8.270 -4.974 1.00 . A B . 37 PRO HB2 1 1 4 3047 1 1 37 PRO HB3 H -4.355 7.836 -6.571 1.00 . A B . 37 PRO HB3 1 1 4 3048 1 1 37 PRO HD2 H -5.771 5.512 -3.796 1.00 . A B . 37 PRO HD2 1 1 4 3049 1 1 37 PRO HD3 H -5.735 4.354 -5.151 1.00 . A B . 37 PRO HD3 1 1 4 3050 1 1 37 PRO HG2 H -6.690 6.845 -5.473 1.00 . A B . 37 PRO HG2 1 1 4 3051 1 1 37 PRO HG3 H -5.758 6.043 -6.753 1.00 . A B . 37 PRO HG3 1 1 4 3052 1 1 37 PRO N N -3.922 5.363 -4.796 1.00 . A B . 37 PRO N 1 1 4 3053 1 1 37 PRO O O -3.898 7.238 -2.624 1.00 . A B . 37 PRO O 1 1 4 3054 1 1 38 PRO C C -2.646 9.854 -1.873 1.00 . A B . 38 PRO C 1 1 4 3055 1 1 38 PRO CA C -1.606 8.815 -2.281 1.00 . A B . 38 PRO CA 1 1 4 3056 1 1 38 PRO CB C -0.285 9.496 -2.665 1.00 . A B . 38 PRO CB 1 1 4 3057 1 1 38 PRO CD C -1.039 8.290 -4.595 1.00 . A B . 38 PRO CD 1 1 4 3058 1 1 38 PRO CG C -0.264 9.505 -4.159 1.00 . A B . 38 PRO CG 1 1 4 3059 1 1 38 PRO HA H -1.440 8.132 -1.464 1.00 . A B . 38 PRO HA 1 1 4 3060 1 1 38 PRO HB2 H -0.268 10.499 -2.263 1.00 . A B . 38 PRO HB2 1 1 4 3061 1 1 38 PRO HB3 H 0.543 8.931 -2.261 1.00 . A B . 38 PRO HB3 1 1 4 3062 1 1 38 PRO HD2 H -1.547 8.479 -5.532 1.00 . A B . 38 PRO HD2 1 1 4 3063 1 1 38 PRO HD3 H -0.387 7.431 -4.682 1.00 . A B . 38 PRO HD3 1 1 4 3064 1 1 38 PRO HG2 H -0.739 10.405 -4.524 1.00 . A B . 38 PRO HG2 1 1 4 3065 1 1 38 PRO HG3 H 0.757 9.449 -4.513 1.00 . A B . 38 PRO HG3 1 1 4 3066 1 1 38 PRO N N -2.008 8.106 -3.502 1.00 . A B . 38 PRO N 1 1 4 3067 1 1 38 PRO O O -3.318 10.437 -2.726 1.00 . A B . 38 PRO O 1 1 4 3068 1 1 39 VAL C C -3.629 12.401 -0.561 1.00 . A B . 39 VAL C 1 1 4 3069 1 1 39 VAL CA C -3.820 10.969 -0.059 1.00 . A B . 39 VAL CA 1 1 4 3070 1 1 39 VAL CB C -3.909 10.944 1.487 1.00 . A B . 39 VAL CB 1 1 4 3071 1 1 39 VAL CG1 C -2.610 11.396 2.140 1.00 . A B . 39 VAL CG1 1 1 4 3072 1 1 39 VAL CG2 C -5.080 11.789 1.971 1.00 . A B . 39 VAL CG2 1 1 4 3073 1 1 39 VAL H H -2.166 9.648 0.060 1.00 . A B . 39 VAL H 1 1 4 3074 1 1 39 VAL HA H -4.760 10.604 -0.443 1.00 . A B . 39 VAL HA 1 1 4 3075 1 1 39 VAL HB H -4.089 9.925 1.790 1.00 . A B . 39 VAL HB 1 1 4 3076 1 1 39 VAL HG11 H -2.335 12.368 1.757 1.00 . A B . 39 VAL HG11 1 1 4 3077 1 1 39 VAL HG12 H -1.830 10.688 1.919 1.00 . A B . 39 VAL HG12 1 1 4 3078 1 1 39 VAL HG13 H -2.747 11.457 3.209 1.00 . A B . 39 VAL HG13 1 1 4 3079 1 1 39 VAL HG21 H -4.924 12.818 1.683 1.00 . A B . 39 VAL HG21 1 1 4 3080 1 1 39 VAL HG22 H -5.154 11.722 3.046 1.00 . A B . 39 VAL HG22 1 1 4 3081 1 1 39 VAL HG23 H -5.994 11.425 1.523 1.00 . A B . 39 VAL HG23 1 1 4 3082 1 1 39 VAL N N -2.782 10.082 -0.569 1.00 . A B . 39 VAL N 1 1 4 3083 1 1 39 VAL O O -2.605 13.041 -0.309 1.00 . A B . 39 VAL O 1 1 4 3084 1 1 40 GLU C C -5.871 14.970 -1.480 1.00 . A B . 40 GLU C 1 1 4 3085 1 1 40 GLU CA C -4.582 14.232 -1.835 1.00 . A B . 40 GLU CA 1 1 4 3086 1 1 40 GLU CB C -4.381 14.194 -3.355 1.00 . A B . 40 GLU CB 1 1 4 3087 1 1 40 GLU CD C -3.983 15.492 -5.483 1.00 . A B . 40 GLU CD 1 1 4 3088 1 1 40 GLU CG C -4.203 15.564 -3.986 1.00 . A B . 40 GLU CG 1 1 4 3089 1 1 40 GLU H H -5.379 12.307 -1.505 1.00 . A B . 40 GLU H 1 1 4 3090 1 1 40 GLU HA H -3.750 14.747 -1.381 1.00 . A B . 40 GLU HA 1 1 4 3091 1 1 40 GLU HB2 H -3.502 13.605 -3.575 1.00 . A B . 40 GLU HB2 1 1 4 3092 1 1 40 GLU HB3 H -5.240 13.722 -3.809 1.00 . A B . 40 GLU HB3 1 1 4 3093 1 1 40 GLU HG2 H -5.090 16.150 -3.795 1.00 . A B . 40 GLU HG2 1 1 4 3094 1 1 40 GLU HG3 H -3.349 16.048 -3.534 1.00 . A B . 40 GLU HG3 1 1 4 3095 1 1 40 GLU N N -4.614 12.881 -1.303 1.00 . A B . 40 GLU N 1 1 4 3096 1 1 40 GLU O O -5.865 16.178 -1.241 1.00 . A B . 40 GLU O 1 1 4 3097 1 1 40 GLU OE1 O -2.851 15.176 -5.907 1.00 . A B . 40 GLU OE1 1 1 4 3098 1 1 40 GLU OE2 O -4.940 15.751 -6.241 1.00 . A B . 40 GLU OE2 1 1 4 3099 1 1 41 ALA C C -8.897 14.063 0.087 1.00 . A B . 41 ALA C 1 1 4 3100 1 1 41 ALA CA C -8.264 14.811 -1.083 1.00 . A B . 41 ALA CA 1 1 4 3101 1 1 41 ALA CB C -9.192 14.811 -2.290 1.00 . A B . 41 ALA CB 1 1 4 3102 1 1 41 ALA H H -6.925 13.279 -1.658 1.00 . A B . 41 ALA H 1 1 4 3103 1 1 41 ALA HA H -8.097 15.835 -0.789 1.00 . A B . 41 ALA HA 1 1 4 3104 1 1 41 ALA HB1 H -10.135 15.263 -2.020 1.00 . A B . 41 ALA HB1 1 1 4 3105 1 1 41 ALA HB2 H -9.360 13.796 -2.618 1.00 . A B . 41 ALA HB2 1 1 4 3106 1 1 41 ALA HB3 H -8.739 15.376 -3.091 1.00 . A B . 41 ALA HB3 1 1 4 3107 1 1 41 ALA N N -6.976 14.233 -1.436 1.00 . A B . 41 ALA N 1 1 4 3108 1 1 41 ALA O O -9.336 14.674 1.060 1.00 . A B . 41 ALA O 1 1 4 3109 1 1 42 GLU C C -9.146 10.433 0.793 1.00 . A B . 42 GLU C 1 1 4 3110 1 1 42 GLU CA C -9.522 11.896 1.016 1.00 . A B . 42 GLU CA 1 1 4 3111 1 1 42 GLU CB C -11.044 12.062 1.029 1.00 . A B . 42 GLU CB 1 1 4 3112 1 1 42 GLU CD C -13.172 12.208 -0.311 1.00 . A B . 42 GLU CD 1 1 4 3113 1 1 42 GLU CG C -11.686 11.937 -0.341 1.00 . A B . 42 GLU CG 1 1 4 3114 1 1 42 GLU H H -8.534 12.313 -0.798 1.00 . A B . 42 GLU H 1 1 4 3115 1 1 42 GLU HA H -9.128 12.213 1.968 1.00 . A B . 42 GLU HA 1 1 4 3116 1 1 42 GLU HB2 H -11.469 11.306 1.673 1.00 . A B . 42 GLU HB2 1 1 4 3117 1 1 42 GLU HB3 H -11.282 13.037 1.427 1.00 . A B . 42 GLU HB3 1 1 4 3118 1 1 42 GLU HG2 H -11.218 12.646 -1.006 1.00 . A B . 42 GLU HG2 1 1 4 3119 1 1 42 GLU HG3 H -11.522 10.935 -0.711 1.00 . A B . 42 GLU HG3 1 1 4 3120 1 1 42 GLU N N -8.926 12.739 -0.011 1.00 . A B . 42 GLU N 1 1 4 3121 1 1 42 GLU O O -9.525 9.824 -0.208 1.00 . A B . 42 GLU O 1 1 4 3122 1 1 42 GLU OE1 O -13.561 13.390 -0.204 1.00 . A B . 42 GLU OE1 1 1 4 3123 1 1 42 GLU OE2 O -13.961 11.245 -0.404 1.00 . A B . 42 GLU OE2 1 1 4 3124 1 1 43 ARG C C -7.917 7.873 3.028 1.00 . A B . 43 ARG C 1 1 4 3125 1 1 43 ARG CA C -7.950 8.489 1.639 1.00 . A B . 43 ARG CA 1 1 4 3126 1 1 43 ARG CB C -6.574 8.383 0.973 1.00 . A B . 43 ARG CB 1 1 4 3127 1 1 43 ARG CD C -7.301 7.375 -1.209 1.00 . A B . 43 ARG CD 1 1 4 3128 1 1 43 ARG CG C -6.610 8.552 -0.537 1.00 . A B . 43 ARG CG 1 1 4 3129 1 1 43 ARG CZ C -8.454 6.896 -3.336 1.00 . A B . 43 ARG CZ 1 1 4 3130 1 1 43 ARG H H -8.098 10.416 2.490 1.00 . A B . 43 ARG H 1 1 4 3131 1 1 43 ARG HA H -8.674 7.956 1.042 1.00 . A B . 43 ARG HA 1 1 4 3132 1 1 43 ARG HB2 H -5.933 9.150 1.381 1.00 . A B . 43 ARG HB2 1 1 4 3133 1 1 43 ARG HB3 H -6.149 7.415 1.196 1.00 . A B . 43 ARG HB3 1 1 4 3134 1 1 43 ARG HD2 H -6.654 6.512 -1.152 1.00 . A B . 43 ARG HD2 1 1 4 3135 1 1 43 ARG HD3 H -8.219 7.167 -0.683 1.00 . A B . 43 ARG HD3 1 1 4 3136 1 1 43 ARG HE H -7.177 8.415 -3.034 1.00 . A B . 43 ARG HE 1 1 4 3137 1 1 43 ARG HG2 H -7.152 9.456 -0.772 1.00 . A B . 43 ARG HG2 1 1 4 3138 1 1 43 ARG HG3 H -5.598 8.629 -0.908 1.00 . A B . 43 ARG HG3 1 1 4 3139 1 1 43 ARG HH11 H -8.848 5.577 -1.846 1.00 . A B . 43 ARG HH11 1 1 4 3140 1 1 43 ARG HH12 H -9.678 5.269 -3.345 1.00 . A B . 43 ARG HH12 1 1 4 3141 1 1 43 ARG HH21 H -8.286 8.025 -5.012 1.00 . A B . 43 ARG HH21 1 1 4 3142 1 1 43 ARG HH22 H -9.341 6.656 -5.142 1.00 . A B . 43 ARG HH22 1 1 4 3143 1 1 43 ARG N N -8.379 9.879 1.719 1.00 . A B . 43 ARG N 1 1 4 3144 1 1 43 ARG NE N -7.612 7.638 -2.613 1.00 . A B . 43 ARG NE 1 1 4 3145 1 1 43 ARG NH1 N -9.037 5.831 -2.797 1.00 . A B . 43 ARG NH1 1 1 4 3146 1 1 43 ARG NH2 N -8.716 7.219 -4.595 1.00 . A B . 43 ARG NH2 1 1 4 3147 1 1 43 ARG O O -7.598 8.551 4.003 1.00 . A B . 43 ARG O 1 1 4 3148 1 1 44 THR C C -7.205 4.907 4.565 1.00 . A B . 44 THR C 1 1 4 3149 1 1 44 THR CA C -8.339 5.920 4.397 1.00 . A B . 44 THR CA 1 1 4 3150 1 1 44 THR CB C -9.691 5.198 4.538 1.00 . A B . 44 THR CB 1 1 4 3151 1 1 44 THR CG2 C -10.834 6.195 4.656 1.00 . A B . 44 THR CG2 1 1 4 3152 1 1 44 THR H H -8.478 6.102 2.301 1.00 . A B . 44 THR H 1 1 4 3153 1 1 44 THR HA H -8.269 6.664 5.176 1.00 . A B . 44 THR HA 1 1 4 3154 1 1 44 THR HB H -9.666 4.590 5.434 1.00 . A B . 44 THR HB 1 1 4 3155 1 1 44 THR HG1 H -9.171 3.732 3.318 1.00 . A B . 44 THR HG1 1 1 4 3156 1 1 44 THR HG21 H -11.770 5.664 4.733 1.00 . A B . 44 THR HG21 1 1 4 3157 1 1 44 THR HG22 H -10.850 6.828 3.780 1.00 . A B . 44 THR HG22 1 1 4 3158 1 1 44 THR HG23 H -10.692 6.805 5.535 1.00 . A B . 44 THR HG23 1 1 4 3159 1 1 44 THR N N -8.261 6.600 3.118 1.00 . A B . 44 THR N 1 1 4 3160 1 1 44 THR O O -7.258 3.816 4.005 1.00 . A B . 44 THR O 1 1 4 3161 1 1 44 THR OG1 O -9.911 4.350 3.400 1.00 . A B . 44 THR OG1 1 1 4 3162 1 1 45 PRO C C -5.442 3.217 6.558 1.00 . A B . 45 PRO C 1 1 4 3163 1 1 45 PRO CA C -5.044 4.340 5.602 1.00 . A B . 45 PRO CA 1 1 4 3164 1 1 45 PRO CB C -3.970 5.235 6.241 1.00 . A B . 45 PRO CB 1 1 4 3165 1 1 45 PRO CD C -5.956 6.558 5.971 1.00 . A B . 45 PRO CD 1 1 4 3166 1 1 45 PRO CG C -4.460 6.641 6.077 1.00 . A B . 45 PRO CG 1 1 4 3167 1 1 45 PRO HA H -4.660 3.910 4.689 1.00 . A B . 45 PRO HA 1 1 4 3168 1 1 45 PRO HB2 H -3.859 4.977 7.285 1.00 . A B . 45 PRO HB2 1 1 4 3169 1 1 45 PRO HB3 H -3.028 5.087 5.730 1.00 . A B . 45 PRO HB3 1 1 4 3170 1 1 45 PRO HD2 H -6.411 6.582 6.953 1.00 . A B . 45 PRO HD2 1 1 4 3171 1 1 45 PRO HD3 H -6.342 7.357 5.351 1.00 . A B . 45 PRO HD3 1 1 4 3172 1 1 45 PRO HG2 H -4.176 7.230 6.939 1.00 . A B . 45 PRO HG2 1 1 4 3173 1 1 45 PRO HG3 H -4.043 7.068 5.176 1.00 . A B . 45 PRO HG3 1 1 4 3174 1 1 45 PRO N N -6.159 5.254 5.331 1.00 . A B . 45 PRO N 1 1 4 3175 1 1 45 PRO O O -4.822 2.152 6.584 1.00 . A B . 45 PRO O 1 1 4 3176 1 1 46 TRP C C -8.101 1.628 7.712 1.00 . A B . 46 TRP C 1 1 4 3177 1 1 46 TRP CA C -6.977 2.474 8.303 1.00 . A B . 46 TRP CA 1 1 4 3178 1 1 46 TRP CB C -7.456 3.170 9.586 1.00 . A B . 46 TRP CB 1 1 4 3179 1 1 46 TRP CD1 C -9.774 4.196 9.175 1.00 . A B . 46 TRP CD1 1 1 4 3180 1 1 46 TRP CD2 C -8.103 5.688 9.224 1.00 . A B . 46 TRP CD2 1 1 4 3181 1 1 46 TRP CE2 C -9.310 6.372 8.991 1.00 . A B . 46 TRP CE2 1 1 4 3182 1 1 46 TRP CE3 C -6.914 6.424 9.298 1.00 . A B . 46 TRP CE3 1 1 4 3183 1 1 46 TRP CG C -8.421 4.294 9.337 1.00 . A B . 46 TRP CG 1 1 4 3184 1 1 46 TRP CH2 C -8.185 8.446 8.906 1.00 . A B . 46 TRP CH2 1 1 4 3185 1 1 46 TRP CZ2 C -9.363 7.753 8.831 1.00 . A B . 46 TRP CZ2 1 1 4 3186 1 1 46 TRP CZ3 C -6.969 7.796 9.138 1.00 . A B . 46 TRP CZ3 1 1 4 3187 1 1 46 TRP H H -6.956 4.317 7.255 1.00 . A B . 46 TRP H 1 1 4 3188 1 1 46 TRP HA H -6.151 1.822 8.545 1.00 . A B . 46 TRP HA 1 1 4 3189 1 1 46 TRP HB2 H -7.950 2.445 10.217 1.00 . A B . 46 TRP HB2 1 1 4 3190 1 1 46 TRP HB3 H -6.602 3.572 10.112 1.00 . A B . 46 TRP HB3 1 1 4 3191 1 1 46 TRP HD1 H -10.327 3.269 9.204 1.00 . A B . 46 TRP HD1 1 1 4 3192 1 1 46 TRP HE1 H -11.268 5.631 8.821 1.00 . A B . 46 TRP HE1 1 1 4 3193 1 1 46 TRP HE3 H -5.967 5.938 9.476 1.00 . A B . 46 TRP HE3 1 1 4 3194 1 1 46 TRP HH2 H -8.178 9.519 8.785 1.00 . A B . 46 TRP HH2 1 1 4 3195 1 1 46 TRP HZ2 H -10.292 8.271 8.653 1.00 . A B . 46 TRP HZ2 1 1 4 3196 1 1 46 TRP HZ3 H -6.064 8.382 9.190 1.00 . A B . 46 TRP HZ3 1 1 4 3197 1 1 46 TRP N N -6.492 3.456 7.335 1.00 . A B . 46 TRP N 1 1 4 3198 1 1 46 TRP NE1 N -10.314 5.441 8.964 1.00 . A B . 46 TRP NE1 1 1 4 3199 1 1 46 TRP O O -8.884 1.017 8.440 1.00 . A B . 46 TRP O 1 1 4 3200 1 1 47 ASN C C -8.529 0.290 4.394 1.00 . A B . 47 ASN C 1 1 4 3201 1 1 47 ASN CA C -9.151 0.782 5.689 1.00 . A B . 47 ASN CA 1 1 4 3202 1 1 47 ASN CB C -10.430 1.579 5.399 1.00 . A B . 47 ASN CB 1 1 4 3203 1 1 47 ASN CG C -11.507 0.732 4.731 1.00 . A B . 47 ASN CG 1 1 4 3204 1 1 47 ASN H H -7.532 2.123 5.867 1.00 . A B . 47 ASN H 1 1 4 3205 1 1 47 ASN HA H -9.388 -0.067 6.313 1.00 . A B . 47 ASN HA 1 1 4 3206 1 1 47 ASN HB2 H -10.821 1.973 6.327 1.00 . A B . 47 ASN HB2 1 1 4 3207 1 1 47 ASN HB3 H -10.190 2.401 4.742 1.00 . A B . 47 ASN HB3 1 1 4 3208 1 1 47 ASN HD21 H -12.146 0.063 6.498 1.00 . A B . 47 ASN HD21 1 1 4 3209 1 1 47 ASN HD22 H -12.992 -0.537 5.111 1.00 . A B . 47 ASN HD22 1 1 4 3210 1 1 47 ASN N N -8.172 1.598 6.393 1.00 . A B . 47 ASN N 1 1 4 3211 1 1 47 ASN ND2 N -12.294 0.016 5.525 1.00 . A B . 47 ASN ND2 1 1 4 3212 1 1 47 ASN O O -7.885 1.058 3.685 1.00 . A B . 47 ASN O 1 1 4 3213 1 1 47 ASN OD1 O -11.624 0.712 3.507 1.00 . A B . 47 ASN OD1 1 1 4 3214 1 1 48 CYS C C -8.820 -1.342 1.671 1.00 . A B . 48 CYS C 1 1 4 3215 1 1 48 CYS CA C -8.018 -1.565 2.950 1.00 . A B . 48 CYS CA 1 1 4 3216 1 1 48 CYS CB C -7.789 -3.064 3.186 1.00 . A B . 48 CYS CB 1 1 4 3217 1 1 48 CYS H H -9.317 -1.533 4.618 1.00 . A B . 48 CYS H 1 1 4 3218 1 1 48 CYS HA H -7.063 -1.071 2.854 1.00 . A B . 48 CYS HA 1 1 4 3219 1 1 48 CYS HB2 H -7.326 -3.204 4.152 1.00 . A B . 48 CYS HB2 1 1 4 3220 1 1 48 CYS HB3 H -8.741 -3.575 3.173 1.00 . A B . 48 CYS HB3 1 1 4 3221 1 1 48 CYS N N -8.702 -0.984 4.087 1.00 . A B . 48 CYS N 1 1 4 3222 1 1 48 CYS O O -9.963 -1.785 1.555 1.00 . A B . 48 CYS O 1 1 4 3223 1 1 48 CYS SG S -6.726 -3.852 1.954 1.00 . A B . 48 CYS SG 1 1 4 3224 1 1 49 ILE C C -8.921 -1.581 -1.487 1.00 . A B . 49 ILE C 1 1 4 3225 1 1 49 ILE CA C -8.882 -0.373 -0.553 1.00 . A B . 49 ILE CA 1 1 4 3226 1 1 49 ILE CB C -8.241 0.833 -1.285 1.00 . A B . 49 ILE CB 1 1 4 3227 1 1 49 ILE CD1 C -6.092 1.676 -2.374 1.00 . A B . 49 ILE CD1 1 1 4 3228 1 1 49 ILE CG1 C -6.732 0.643 -1.467 1.00 . A B . 49 ILE CG1 1 1 4 3229 1 1 49 ILE CG2 C -8.533 2.127 -0.531 1.00 . A B . 49 ILE CG2 1 1 4 3230 1 1 49 ILE H H -7.279 -0.378 0.833 1.00 . A B . 49 ILE H 1 1 4 3231 1 1 49 ILE HA H -9.899 -0.105 -0.307 1.00 . A B . 49 ILE HA 1 1 4 3232 1 1 49 ILE HB H -8.701 0.907 -2.258 1.00 . A B . 49 ILE HB 1 1 4 3233 1 1 49 ILE HD11 H -6.528 1.613 -3.361 1.00 . A B . 49 ILE HD11 1 1 4 3234 1 1 49 ILE HD12 H -5.028 1.494 -2.438 1.00 . A B . 49 ILE HD12 1 1 4 3235 1 1 49 ILE HD13 H -6.262 2.664 -1.971 1.00 . A B . 49 ILE HD13 1 1 4 3236 1 1 49 ILE HG12 H -6.254 0.714 -0.505 1.00 . A B . 49 ILE HG12 1 1 4 3237 1 1 49 ILE HG13 H -6.544 -0.334 -1.890 1.00 . A B . 49 ILE HG13 1 1 4 3238 1 1 49 ILE HG21 H -8.032 2.949 -1.023 1.00 . A B . 49 ILE HG21 1 1 4 3239 1 1 49 ILE HG22 H -8.175 2.044 0.483 1.00 . A B . 49 ILE HG22 1 1 4 3240 1 1 49 ILE HG23 H -9.597 2.310 -0.523 1.00 . A B . 49 ILE HG23 1 1 4 3241 1 1 49 ILE N N -8.204 -0.683 0.698 1.00 . A B . 49 ILE N 1 1 4 3242 1 1 49 ILE O O -9.840 -1.719 -2.299 1.00 . A B . 49 ILE O 1 1 4 3243 1 1 50 PHE C C -8.853 -4.722 -1.726 1.00 . A B . 50 PHE C 1 1 4 3244 1 1 50 PHE CA C -7.875 -3.657 -2.201 1.00 . A B . 50 PHE CA 1 1 4 3245 1 1 50 PHE CB C -6.451 -4.218 -2.292 1.00 . A B . 50 PHE CB 1 1 4 3246 1 1 50 PHE CD1 C -5.142 -2.373 -3.381 1.00 . A B . 50 PHE CD1 1 1 4 3247 1 1 50 PHE CD2 C -5.503 -4.381 -4.609 1.00 . A B . 50 PHE CD2 1 1 4 3248 1 1 50 PHE CE1 C -4.445 -1.840 -4.446 1.00 . A B . 50 PHE CE1 1 1 4 3249 1 1 50 PHE CE2 C -4.808 -3.854 -5.682 1.00 . A B . 50 PHE CE2 1 1 4 3250 1 1 50 PHE CG C -5.677 -3.647 -3.448 1.00 . A B . 50 PHE CG 1 1 4 3251 1 1 50 PHE CZ C -4.278 -2.582 -5.600 1.00 . A B . 50 PHE CZ 1 1 4 3252 1 1 50 PHE H H -7.269 -2.338 -0.654 1.00 . A B . 50 PHE H 1 1 4 3253 1 1 50 PHE HA H -8.181 -3.350 -3.193 1.00 . A B . 50 PHE HA 1 1 4 3254 1 1 50 PHE HB2 H -5.913 -3.989 -1.383 1.00 . A B . 50 PHE HB2 1 1 4 3255 1 1 50 PHE HB3 H -6.498 -5.292 -2.420 1.00 . A B . 50 PHE HB3 1 1 4 3256 1 1 50 PHE HD1 H -5.270 -1.794 -2.480 1.00 . A B . 50 PHE HD1 1 1 4 3257 1 1 50 PHE HD2 H -5.917 -5.378 -4.675 1.00 . A B . 50 PHE HD2 1 1 4 3258 1 1 50 PHE HE1 H -4.033 -0.844 -4.377 1.00 . A B . 50 PHE HE1 1 1 4 3259 1 1 50 PHE HE2 H -4.678 -4.437 -6.581 1.00 . A B . 50 PHE HE2 1 1 4 3260 1 1 50 PHE HZ H -3.736 -2.167 -6.438 1.00 . A B . 50 PHE HZ 1 1 4 3261 1 1 50 PHE N N -7.938 -2.466 -1.358 1.00 . A B . 50 PHE N 1 1 4 3262 1 1 50 PHE O O -9.383 -5.479 -2.531 1.00 . A B . 50 PHE O 1 1 4 3263 1 1 51 CYS C C -11.468 -5.450 -0.395 1.00 . A B . 51 CYS C 1 1 4 3264 1 1 51 CYS CA C -10.059 -5.734 0.123 1.00 . A B . 51 CYS CA 1 1 4 3265 1 1 51 CYS CB C -10.042 -5.712 1.654 1.00 . A B . 51 CYS CB 1 1 4 3266 1 1 51 CYS H H -8.653 -4.148 0.184 1.00 . A B . 51 CYS H 1 1 4 3267 1 1 51 CYS HA H -9.761 -6.717 -0.216 1.00 . A B . 51 CYS HA 1 1 4 3268 1 1 51 CYS HB2 H -9.758 -4.726 1.986 1.00 . A B . 51 CYS HB2 1 1 4 3269 1 1 51 CYS HB3 H -11.034 -5.936 2.022 1.00 . A B . 51 CYS HB3 1 1 4 3270 1 1 51 CYS N N -9.104 -4.775 -0.420 1.00 . A B . 51 CYS N 1 1 4 3271 1 1 51 CYS O O -12.227 -6.374 -0.699 1.00 . A B . 51 CYS O 1 1 4 3272 1 1 51 CYS SG S -8.895 -6.894 2.401 1.00 . A B . 51 CYS SG 1 1 4 3273 1 1 52 ARG C C -13.153 -3.991 -2.558 1.00 . A B . 52 ARG C 1 1 4 3274 1 1 52 ARG CA C -13.118 -3.782 -1.043 1.00 . A B . 52 ARG CA 1 1 4 3275 1 1 52 ARG CB C -13.429 -2.316 -0.710 1.00 . A B . 52 ARG CB 1 1 4 3276 1 1 52 ARG CD C -13.507 -0.496 1.044 1.00 . A B . 52 ARG CD 1 1 4 3277 1 1 52 ARG CG C -13.049 -1.911 0.712 1.00 . A B . 52 ARG CG 1 1 4 3278 1 1 52 ARG CZ C -12.661 1.609 0.040 1.00 . A B . 52 ARG CZ 1 1 4 3279 1 1 52 ARG H H -11.214 -3.475 -0.173 1.00 . A B . 52 ARG H 1 1 4 3280 1 1 52 ARG HA H -13.865 -4.413 -0.590 1.00 . A B . 52 ARG HA 1 1 4 3281 1 1 52 ARG HB2 H -12.890 -1.681 -1.397 1.00 . A B . 52 ARG HB2 1 1 4 3282 1 1 52 ARG HB3 H -14.488 -2.150 -0.837 1.00 . A B . 52 ARG HB3 1 1 4 3283 1 1 52 ARG HD2 H -14.560 -0.520 1.282 1.00 . A B . 52 ARG HD2 1 1 4 3284 1 1 52 ARG HD3 H -12.955 -0.149 1.906 1.00 . A B . 52 ARG HD3 1 1 4 3285 1 1 52 ARG HE H -13.689 0.194 -0.932 1.00 . A B . 52 ARG HE 1 1 4 3286 1 1 52 ARG HG2 H -13.510 -2.597 1.405 1.00 . A B . 52 ARG HG2 1 1 4 3287 1 1 52 ARG HG3 H -11.975 -1.964 0.814 1.00 . A B . 52 ARG HG3 1 1 4 3288 1 1 52 ARG HH11 H -12.063 1.340 1.967 1.00 . A B . 52 ARG HH11 1 1 4 3289 1 1 52 ARG HH12 H -11.594 2.847 1.240 1.00 . A B . 52 ARG HH12 1 1 4 3290 1 1 52 ARG HH21 H -13.059 2.163 -1.867 1.00 . A B . 52 ARG HH21 1 1 4 3291 1 1 52 ARG HH22 H -12.152 3.311 -0.936 1.00 . A B . 52 ARG HH22 1 1 4 3292 1 1 52 ARG N N -11.818 -4.171 -0.502 1.00 . A B . 52 ARG N 1 1 4 3293 1 1 52 ARG NE N -13.293 0.437 -0.064 1.00 . A B . 52 ARG NE 1 1 4 3294 1 1 52 ARG NH1 N -12.056 1.959 1.169 1.00 . A B . 52 ARG NH1 1 1 4 3295 1 1 52 ARG NH2 N -12.619 2.424 -1.005 1.00 . A B . 52 ARG NH2 1 1 4 3296 1 1 52 ARG O O -14.217 -3.997 -3.178 1.00 . A B . 52 ARG O 1 1 4 3297 1 1 53 MET C C -12.455 -3.312 -5.388 1.00 . A B . 53 MET C 1 1 4 3298 1 1 53 MET CA C -11.761 -4.390 -4.565 1.00 . A B . 53 MET CA 1 1 4 3299 1 1 53 MET CB C -12.260 -5.775 -4.994 1.00 . A B . 53 MET CB 1 1 4 3300 1 1 53 MET CE C -13.680 -8.567 -4.245 1.00 . A B . 53 MET CE 1 1 4 3301 1 1 53 MET CG C -11.451 -6.927 -4.416 1.00 . A B . 53 MET CG 1 1 4 3302 1 1 53 MET H H -11.180 -4.250 -2.531 1.00 . A B . 53 MET H 1 1 4 3303 1 1 53 MET HA H -10.700 -4.334 -4.759 1.00 . A B . 53 MET HA 1 1 4 3304 1 1 53 MET HB2 H -13.285 -5.888 -4.670 1.00 . A B . 53 MET HB2 1 1 4 3305 1 1 53 MET HB3 H -12.224 -5.840 -6.071 1.00 . A B . 53 MET HB3 1 1 4 3306 1 1 53 MET HE1 H -13.606 -8.447 -3.175 1.00 . A B . 53 MET HE1 1 1 4 3307 1 1 53 MET HE2 H -14.157 -9.509 -4.470 1.00 . A B . 53 MET HE2 1 1 4 3308 1 1 53 MET HE3 H -14.267 -7.760 -4.658 1.00 . A B . 53 MET HE3 1 1 4 3309 1 1 53 MET HG2 H -10.420 -6.813 -4.721 1.00 . A B . 53 MET HG2 1 1 4 3310 1 1 53 MET HG3 H -11.511 -6.886 -3.339 1.00 . A B . 53 MET HG3 1 1 4 3311 1 1 53 MET N N -11.958 -4.192 -3.123 1.00 . A B . 53 MET N 1 1 4 3312 1 1 53 MET O O -12.881 -3.556 -6.516 1.00 . A B . 53 MET O 1 1 4 3313 1 1 53 MET SD S -12.039 -8.542 -4.964 1.00 . A B . 53 MET SD 1 1 4 3314 1 1 54 LYS C C -12.254 0.019 -6.007 1.00 . A B . 54 LYS C 1 1 4 3315 1 1 54 LYS CA C -13.241 -1.030 -5.512 1.00 . A B . 54 LYS CA 1 1 4 3316 1 1 54 LYS CB C -14.286 -0.394 -4.589 1.00 . A B . 54 LYS CB 1 1 4 3317 1 1 54 LYS CD C -16.020 -0.058 -6.377 1.00 . A B . 54 LYS CD 1 1 4 3318 1 1 54 LYS CE C -16.873 0.946 -7.134 1.00 . A B . 54 LYS CE 1 1 4 3319 1 1 54 LYS CG C -15.188 0.611 -5.293 1.00 . A B . 54 LYS CG 1 1 4 3320 1 1 54 LYS H H -12.132 -1.953 -3.964 1.00 . A B . 54 LYS H 1 1 4 3321 1 1 54 LYS HA H -13.745 -1.454 -6.369 1.00 . A B . 54 LYS HA 1 1 4 3322 1 1 54 LYS HB2 H -14.907 -1.175 -4.176 1.00 . A B . 54 LYS HB2 1 1 4 3323 1 1 54 LYS HB3 H -13.777 0.113 -3.782 1.00 . A B . 54 LYS HB3 1 1 4 3324 1 1 54 LYS HD2 H -15.357 -0.545 -7.077 1.00 . A B . 54 LYS HD2 1 1 4 3325 1 1 54 LYS HD3 H -16.665 -0.792 -5.919 1.00 . A B . 54 LYS HD3 1 1 4 3326 1 1 54 LYS HE2 H -16.228 1.707 -7.545 1.00 . A B . 54 LYS HE2 1 1 4 3327 1 1 54 LYS HE3 H -17.376 0.431 -7.936 1.00 . A B . 54 LYS HE3 1 1 4 3328 1 1 54 LYS HG2 H -15.850 1.057 -4.568 1.00 . A B . 54 LYS HG2 1 1 4 3329 1 1 54 LYS HG3 H -14.574 1.376 -5.745 1.00 . A B . 54 LYS HG3 1 1 4 3330 1 1 54 LYS HZ1 H -17.424 2.133 -5.507 1.00 . A B . 54 LYS HZ1 1 1 4 3331 1 1 54 LYS HZ2 H -18.505 0.876 -5.835 1.00 . A B . 54 LYS HZ2 1 1 4 3332 1 1 54 LYS HZ3 H -18.475 2.244 -6.827 1.00 . A B . 54 LYS HZ3 1 1 4 3333 1 1 54 LYS N N -12.547 -2.112 -4.836 1.00 . A B . 54 LYS N 1 1 4 3334 1 1 54 LYS NZ N -17.888 1.595 -6.265 1.00 . A B . 54 LYS NZ 1 1 4 3335 1 1 54 LYS O O -12.561 0.802 -6.899 1.00 . A B . 54 LYS O 1 1 4 3336 1 1 55 GLU C C -8.991 0.183 -6.684 1.00 . A B . 55 GLU C 1 1 4 3337 1 1 55 GLU CA C -10.025 0.949 -5.874 1.00 . A B . 55 GLU CA 1 1 4 3338 1 1 55 GLU CB C -9.360 1.621 -4.672 1.00 . A B . 55 GLU CB 1 1 4 3339 1 1 55 GLU CD C -11.280 3.187 -4.089 1.00 . A B . 55 GLU CD 1 1 4 3340 1 1 55 GLU CG C -10.336 2.107 -3.605 1.00 . A B . 55 GLU CG 1 1 4 3341 1 1 55 GLU H H -10.858 -0.619 -4.730 1.00 . A B . 55 GLU H 1 1 4 3342 1 1 55 GLU HA H -10.483 1.698 -6.497 1.00 . A B . 55 GLU HA 1 1 4 3343 1 1 55 GLU HB2 H -8.683 0.918 -4.216 1.00 . A B . 55 GLU HB2 1 1 4 3344 1 1 55 GLU HB3 H -8.796 2.471 -5.024 1.00 . A B . 55 GLU HB3 1 1 4 3345 1 1 55 GLU HG2 H -10.925 1.268 -3.269 1.00 . A B . 55 GLU HG2 1 1 4 3346 1 1 55 GLU HG3 H -9.767 2.498 -2.774 1.00 . A B . 55 GLU HG3 1 1 4 3347 1 1 55 GLU N N -11.059 0.022 -5.440 1.00 . A B . 55 GLU N 1 1 4 3348 1 1 55 GLU O O -7.842 0.604 -6.832 1.00 . A B . 55 GLU O 1 1 4 3349 1 1 55 GLU OE1 O -10.889 4.370 -4.085 1.00 . A B . 55 GLU OE1 1 1 4 3350 1 1 55 GLU OE2 O -12.408 2.848 -4.510 1.00 . A B . 55 GLU OE2 1 1 4 3351 1 1 56 SER C C -8.999 -2.008 -9.361 1.00 . A B . 56 SER C 1 1 4 3352 1 1 56 SER CA C -8.548 -1.864 -7.910 1.00 . A B . 56 SER CA 1 1 4 3353 1 1 56 SER CB C -8.553 -3.226 -7.208 1.00 . A B . 56 SER CB 1 1 4 3354 1 1 56 SER H H -10.372 -1.177 -7.116 1.00 . A B . 56 SER H 1 1 4 3355 1 1 56 SER HA H -7.549 -1.457 -7.889 1.00 . A B . 56 SER HA 1 1 4 3356 1 1 56 SER HB2 H -9.488 -3.729 -7.404 1.00 . A B . 56 SER HB2 1 1 4 3357 1 1 56 SER HB3 H -7.737 -3.824 -7.582 1.00 . A B . 56 SER HB3 1 1 4 3358 1 1 56 SER HG H -7.499 -3.289 -5.552 1.00 . A B . 56 SER HG 1 1 4 3359 1 1 56 SER N N -9.424 -0.952 -7.203 1.00 . A B . 56 SER N 1 1 4 3360 1 1 56 SER O O -8.566 -1.197 -10.203 1.00 . A B . 56 SER O 1 1 4 3361 1 1 56 SER OXT O -9.805 -2.915 -9.653 1.00 . A B . 56 SER OXT 1 1 4 3362 1 1 56 SER OG O -8.403 -3.073 -5.802 1.00 . A B . 56 SER OG 1 1 4 3363 2 2 1 ZN ZN ZN -6.726 -6.135 2.234 1.00 . B B . 101 ZN ZN 1 1 4 3364 3 2 1 ZN ZN ZN 5.929 1.027 0.190 1.00 . C B . 102 ZN ZN 1 1 5 3365 1 1 1 GLY C C 4.782 -13.810 -6.347 1.00 . A B . 1 GLY C 1 1 5 3366 1 1 1 GLY CA C 5.640 -14.990 -6.755 1.00 . A B . 1 GLY CA 1 1 5 3367 1 1 1 GLY H1 H 7.280 -14.475 -5.578 1.00 . A B . 1 GLY H1 1 1 5 3368 1 1 1 GLY H2 H 7.381 -13.927 -7.172 1.00 . A B . 1 GLY H2 1 1 5 3369 1 1 1 GLY H3 H 7.644 -15.559 -6.823 1.00 . A B . 1 GLY H3 1 1 5 3370 1 1 1 GLY HA2 H 5.455 -15.213 -7.795 1.00 . A B . 1 GLY HA2 1 1 5 3371 1 1 1 GLY HA3 H 5.365 -15.846 -6.158 1.00 . A B . 1 GLY HA3 1 1 5 3372 1 1 1 GLY N N 7.087 -14.719 -6.571 1.00 . A B . 1 GLY N 1 1 5 3373 1 1 1 GLY O O 4.392 -12.995 -7.185 1.00 . A B . 1 GLY O 1 1 5 3374 1 1 2 ALA C C 4.026 -12.357 -3.069 1.00 . A B . 2 ALA C 1 1 5 3375 1 1 2 ALA CA C 3.679 -12.631 -4.529 1.00 . A B . 2 ALA CA 1 1 5 3376 1 1 2 ALA CB C 2.200 -12.971 -4.668 1.00 . A B . 2 ALA CB 1 1 5 3377 1 1 2 ALA H H 4.840 -14.393 -4.437 1.00 . A B . 2 ALA H 1 1 5 3378 1 1 2 ALA HA H 3.881 -11.744 -5.111 1.00 . A B . 2 ALA HA 1 1 5 3379 1 1 2 ALA HB1 H 1.605 -12.153 -4.294 1.00 . A B . 2 ALA HB1 1 1 5 3380 1 1 2 ALA HB2 H 1.980 -13.864 -4.101 1.00 . A B . 2 ALA HB2 1 1 5 3381 1 1 2 ALA HB3 H 1.966 -13.139 -5.709 1.00 . A B . 2 ALA HB3 1 1 5 3382 1 1 2 ALA N N 4.495 -13.713 -5.056 1.00 . A B . 2 ALA N 1 1 5 3383 1 1 2 ALA O O 3.213 -11.827 -2.311 1.00 . A B . 2 ALA O 1 1 5 3384 1 1 3 MET C C 6.977 -11.761 -1.240 1.00 . A B . 3 MET C 1 1 5 3385 1 1 3 MET CA C 5.678 -12.545 -1.303 1.00 . A B . 3 MET CA 1 1 5 3386 1 1 3 MET CB C 5.835 -13.899 -0.601 1.00 . A B . 3 MET CB 1 1 5 3387 1 1 3 MET CE C 3.074 -16.383 1.295 1.00 . A B . 3 MET CE 1 1 5 3388 1 1 3 MET CG C 4.520 -14.491 -0.114 1.00 . A B . 3 MET CG 1 1 5 3389 1 1 3 MET H H 5.874 -13.079 -3.343 1.00 . A B . 3 MET H 1 1 5 3390 1 1 3 MET HA H 4.915 -11.980 -0.791 1.00 . A B . 3 MET HA 1 1 5 3391 1 1 3 MET HB2 H 6.289 -14.598 -1.289 1.00 . A B . 3 MET HB2 1 1 5 3392 1 1 3 MET HB3 H 6.488 -13.774 0.251 1.00 . A B . 3 MET HB3 1 1 5 3393 1 1 3 MET HE1 H 3.039 -17.332 1.808 1.00 . A B . 3 MET HE1 1 1 5 3394 1 1 3 MET HE2 H 2.375 -16.392 0.472 1.00 . A B . 3 MET HE2 1 1 5 3395 1 1 3 MET HE3 H 2.808 -15.593 1.983 1.00 . A B . 3 MET HE3 1 1 5 3396 1 1 3 MET HG2 H 4.078 -13.813 0.604 1.00 . A B . 3 MET HG2 1 1 5 3397 1 1 3 MET HG3 H 3.853 -14.600 -0.957 1.00 . A B . 3 MET HG3 1 1 5 3398 1 1 3 MET N N 5.242 -12.714 -2.681 1.00 . A B . 3 MET N 1 1 5 3399 1 1 3 MET O O 8.014 -12.276 -0.810 1.00 . A B . 3 MET O 1 1 5 3400 1 1 3 MET SD S 4.729 -16.101 0.670 1.00 . A B . 3 MET SD 1 1 5 3401 1 1 4 GLY C C 8.324 -9.168 -0.190 1.00 . A B . 4 GLY C 1 1 5 3402 1 1 4 GLY CA C 8.068 -9.642 -1.607 1.00 . A B . 4 GLY CA 1 1 5 3403 1 1 4 GLY H H 6.076 -10.183 -2.076 1.00 . A B . 4 GLY H 1 1 5 3404 1 1 4 GLY HA2 H 8.936 -10.177 -1.961 1.00 . A B . 4 GLY HA2 1 1 5 3405 1 1 4 GLY HA3 H 7.904 -8.781 -2.239 1.00 . A B . 4 GLY HA3 1 1 5 3406 1 1 4 GLY N N 6.916 -10.514 -1.685 1.00 . A B . 4 GLY N 1 1 5 3407 1 1 4 GLY O O 7.879 -8.086 0.204 1.00 . A B . 4 GLY O 1 1 5 3408 1 1 5 MET C C 10.380 -8.498 1.968 1.00 . A B . 5 MET C 1 1 5 3409 1 1 5 MET CA C 9.372 -9.640 1.953 1.00 . A B . 5 MET CA 1 1 5 3410 1 1 5 MET CB C 9.924 -10.862 2.699 1.00 . A B . 5 MET CB 1 1 5 3411 1 1 5 MET CE C 10.230 -13.979 3.036 1.00 . A B . 5 MET CE 1 1 5 3412 1 1 5 MET CG C 11.080 -11.556 1.992 1.00 . A B . 5 MET CG 1 1 5 3413 1 1 5 MET H H 9.294 -10.860 0.225 1.00 . A B . 5 MET H 1 1 5 3414 1 1 5 MET HA H 8.470 -9.310 2.448 1.00 . A B . 5 MET HA 1 1 5 3415 1 1 5 MET HB2 H 10.269 -10.545 3.673 1.00 . A B . 5 MET HB2 1 1 5 3416 1 1 5 MET HB3 H 9.126 -11.578 2.828 1.00 . A B . 5 MET HB3 1 1 5 3417 1 1 5 MET HE1 H 10.473 -14.918 3.510 1.00 . A B . 5 MET HE1 1 1 5 3418 1 1 5 MET HE2 H 9.839 -14.165 2.048 1.00 . A B . 5 MET HE2 1 1 5 3419 1 1 5 MET HE3 H 9.489 -13.460 3.625 1.00 . A B . 5 MET HE3 1 1 5 3420 1 1 5 MET HG2 H 10.742 -11.898 1.026 1.00 . A B . 5 MET HG2 1 1 5 3421 1 1 5 MET HG3 H 11.883 -10.846 1.859 1.00 . A B . 5 MET HG3 1 1 5 3422 1 1 5 MET N N 9.018 -9.989 0.584 1.00 . A B . 5 MET N 1 1 5 3423 1 1 5 MET O O 11.452 -8.601 1.368 1.00 . A B . 5 MET O 1 1 5 3424 1 1 5 MET SD S 11.708 -12.973 2.914 1.00 . A B . 5 MET SD 1 1 5 3425 1 1 6 ARG C C 11.137 -5.654 1.306 1.00 . A B . 6 ARG C 1 1 5 3426 1 1 6 ARG CA C 10.842 -6.201 2.699 1.00 . A B . 6 ARG CA 1 1 5 3427 1 1 6 ARG CB C 12.155 -6.482 3.429 1.00 . A B . 6 ARG CB 1 1 5 3428 1 1 6 ARG CD C 11.573 -5.473 5.672 1.00 . A B . 6 ARG CD 1 1 5 3429 1 1 6 ARG CG C 12.005 -6.727 4.924 1.00 . A B . 6 ARG CG 1 1 5 3430 1 1 6 ARG CZ C 9.627 -3.954 5.640 1.00 . A B . 6 ARG CZ 1 1 5 3431 1 1 6 ARG H H 9.160 -7.413 3.126 1.00 . A B . 6 ARG H 1 1 5 3432 1 1 6 ARG HA H 10.290 -5.455 3.249 1.00 . A B . 6 ARG HA 1 1 5 3433 1 1 6 ARG HB2 H 12.612 -7.356 2.991 1.00 . A B . 6 ARG HB2 1 1 5 3434 1 1 6 ARG HB3 H 12.813 -5.638 3.289 1.00 . A B . 6 ARG HB3 1 1 5 3435 1 1 6 ARG HD2 H 11.764 -5.615 6.724 1.00 . A B . 6 ARG HD2 1 1 5 3436 1 1 6 ARG HD3 H 12.157 -4.639 5.314 1.00 . A B . 6 ARG HD3 1 1 5 3437 1 1 6 ARG HE H 9.558 -5.923 5.272 1.00 . A B . 6 ARG HE 1 1 5 3438 1 1 6 ARG HG2 H 11.262 -7.495 5.076 1.00 . A B . 6 ARG HG2 1 1 5 3439 1 1 6 ARG HG3 H 12.953 -7.061 5.318 1.00 . A B . 6 ARG HG3 1 1 5 3440 1 1 6 ARG HH11 H 11.398 -3.030 5.998 1.00 . A B . 6 ARG HH11 1 1 5 3441 1 1 6 ARG HH12 H 10.006 -1.999 6.018 1.00 . A B . 6 ARG HH12 1 1 5 3442 1 1 6 ARG HH21 H 7.723 -4.562 5.311 1.00 . A B . 6 ARG HH21 1 1 5 3443 1 1 6 ARG HH22 H 7.918 -2.868 5.626 1.00 . A B . 6 ARG HH22 1 1 5 3444 1 1 6 ARG N N 10.013 -7.405 2.639 1.00 . A B . 6 ARG N 1 1 5 3445 1 1 6 ARG NE N 10.154 -5.169 5.490 1.00 . A B . 6 ARG NE 1 1 5 3446 1 1 6 ARG NH1 N 10.406 -2.911 5.907 1.00 . A B . 6 ARG NH1 1 1 5 3447 1 1 6 ARG NH2 N 8.318 -3.780 5.515 1.00 . A B . 6 ARG NH2 1 1 5 3448 1 1 6 ARG O O 12.153 -4.991 1.092 1.00 . A B . 6 ARG O 1 1 5 3449 1 1 7 ASN C C 9.853 -4.092 -1.199 1.00 . A B . 7 ASN C 1 1 5 3450 1 1 7 ASN CA C 10.444 -5.477 -1.006 1.00 . A B . 7 ASN CA 1 1 5 3451 1 1 7 ASN CB C 9.835 -6.461 -2.005 1.00 . A B . 7 ASN CB 1 1 5 3452 1 1 7 ASN CG C 10.156 -6.097 -3.446 1.00 . A B . 7 ASN CG 1 1 5 3453 1 1 7 ASN H H 9.429 -6.406 0.604 1.00 . A B . 7 ASN H 1 1 5 3454 1 1 7 ASN HA H 11.507 -5.422 -1.174 1.00 . A B . 7 ASN HA 1 1 5 3455 1 1 7 ASN HB2 H 10.220 -7.449 -1.810 1.00 . A B . 7 ASN HB2 1 1 5 3456 1 1 7 ASN HB3 H 8.762 -6.465 -1.884 1.00 . A B . 7 ASN HB3 1 1 5 3457 1 1 7 ASN HD21 H 11.941 -5.405 -2.918 1.00 . A B . 7 ASN HD21 1 1 5 3458 1 1 7 ASN HD22 H 11.549 -5.258 -4.597 1.00 . A B . 7 ASN HD22 1 1 5 3459 1 1 7 ASN N N 10.244 -5.918 0.366 1.00 . A B . 7 ASN N 1 1 5 3460 1 1 7 ASN ND2 N 11.337 -5.542 -3.676 1.00 . A B . 7 ASN ND2 1 1 5 3461 1 1 7 ASN O O 8.774 -3.926 -1.774 1.00 . A B . 7 ASN O 1 1 5 3462 1 1 7 ASN OD1 O 9.353 -6.334 -4.348 1.00 . A B . 7 ASN OD1 1 1 5 3463 1 1 8 LEU C C 11.350 -0.822 -1.048 1.00 . A B . 8 LEU C 1 1 5 3464 1 1 8 LEU CA C 10.149 -1.718 -0.796 1.00 . A B . 8 LEU CA 1 1 5 3465 1 1 8 LEU CB C 9.396 -1.282 0.466 1.00 . A B . 8 LEU CB 1 1 5 3466 1 1 8 LEU CD1 C 11.224 -1.235 2.211 1.00 . A B . 8 LEU CD1 1 1 5 3467 1 1 8 LEU CD2 C 8.859 -1.704 2.873 1.00 . A B . 8 LEU CD2 1 1 5 3468 1 1 8 LEU CG C 9.908 -1.871 1.787 1.00 . A B . 8 LEU CG 1 1 5 3469 1 1 8 LEU H H 11.382 -3.322 -0.194 1.00 . A B . 8 LEU H 1 1 5 3470 1 1 8 LEU HA H 9.486 -1.646 -1.644 1.00 . A B . 8 LEU HA 1 1 5 3471 1 1 8 LEU HB2 H 9.451 -0.206 0.532 1.00 . A B . 8 LEU HB2 1 1 5 3472 1 1 8 LEU HB3 H 8.360 -1.564 0.354 1.00 . A B . 8 LEU HB3 1 1 5 3473 1 1 8 LEU HD11 H 11.077 -0.178 2.374 1.00 . A B . 8 LEU HD11 1 1 5 3474 1 1 8 LEU HD12 H 11.960 -1.380 1.434 1.00 . A B . 8 LEU HD12 1 1 5 3475 1 1 8 LEU HD13 H 11.569 -1.696 3.124 1.00 . A B . 8 LEU HD13 1 1 5 3476 1 1 8 LEU HD21 H 9.229 -2.120 3.799 1.00 . A B . 8 LEU HD21 1 1 5 3477 1 1 8 LEU HD22 H 7.956 -2.220 2.583 1.00 . A B . 8 LEU HD22 1 1 5 3478 1 1 8 LEU HD23 H 8.647 -0.654 3.010 1.00 . A B . 8 LEU HD23 1 1 5 3479 1 1 8 LEU HG H 10.083 -2.928 1.652 1.00 . A B . 8 LEU HG 1 1 5 3480 1 1 8 LEU N N 10.559 -3.106 -0.682 1.00 . A B . 8 LEU N 1 1 5 3481 1 1 8 LEU O O 11.330 0.372 -0.744 1.00 . A B . 8 LEU O 1 1 5 3482 1 1 9 ASP C C 13.462 0.144 -3.162 1.00 . A B . 9 ASP C 1 1 5 3483 1 1 9 ASP CA C 13.620 -0.673 -1.892 1.00 . A B . 9 ASP CA 1 1 5 3484 1 1 9 ASP CB C 14.800 -1.635 -2.020 1.00 . A B . 9 ASP CB 1 1 5 3485 1 1 9 ASP CG C 16.140 -0.932 -1.908 1.00 . A B . 9 ASP CG 1 1 5 3486 1 1 9 ASP H H 12.300 -2.337 -1.916 1.00 . A B . 9 ASP H 1 1 5 3487 1 1 9 ASP HA H 13.794 -0.004 -1.065 1.00 . A B . 9 ASP HA 1 1 5 3488 1 1 9 ASP HB2 H 14.738 -2.373 -1.237 1.00 . A B . 9 ASP HB2 1 1 5 3489 1 1 9 ASP HB3 H 14.751 -2.128 -2.978 1.00 . A B . 9 ASP HB3 1 1 5 3490 1 1 9 ASP N N 12.386 -1.403 -1.630 1.00 . A B . 9 ASP N 1 1 5 3491 1 1 9 ASP O O 14.043 1.219 -3.311 1.00 . A B . 9 ASP O 1 1 5 3492 1 1 9 ASP OD1 O 16.564 -0.302 -2.902 1.00 . A B . 9 ASP OD1 1 1 5 3493 1 1 9 ASP OD2 O 16.774 -0.998 -0.837 1.00 . A B . 9 ASP OD2 1 1 5 3494 1 1 10 GLU C C 11.032 1.117 -5.123 1.00 . A B . 10 GLU C 1 1 5 3495 1 1 10 GLU CA C 12.319 0.320 -5.300 1.00 . A B . 10 GLU CA 1 1 5 3496 1 1 10 GLU CB C 12.192 -0.665 -6.474 1.00 . A B . 10 GLU CB 1 1 5 3497 1 1 10 GLU CD C 11.429 -2.751 -5.253 1.00 . A B . 10 GLU CD 1 1 5 3498 1 1 10 GLU CG C 11.105 -1.721 -6.314 1.00 . A B . 10 GLU CG 1 1 5 3499 1 1 10 GLU H H 12.254 -1.263 -3.899 1.00 . A B . 10 GLU H 1 1 5 3500 1 1 10 GLU HA H 13.121 1.011 -5.506 1.00 . A B . 10 GLU HA 1 1 5 3501 1 1 10 GLU HB2 H 11.983 -0.104 -7.371 1.00 . A B . 10 GLU HB2 1 1 5 3502 1 1 10 GLU HB3 H 13.137 -1.175 -6.595 1.00 . A B . 10 GLU HB3 1 1 5 3503 1 1 10 GLU HG2 H 10.183 -1.231 -6.043 1.00 . A B . 10 GLU HG2 1 1 5 3504 1 1 10 GLU HG3 H 10.973 -2.229 -7.258 1.00 . A B . 10 GLU HG3 1 1 5 3505 1 1 10 GLU N N 12.646 -0.373 -4.067 1.00 . A B . 10 GLU N 1 1 5 3506 1 1 10 GLU O O 10.446 1.609 -6.088 1.00 . A B . 10 GLU O 1 1 5 3507 1 1 10 GLU OE1 O 12.106 -3.749 -5.571 1.00 . A B . 10 GLU OE1 1 1 5 3508 1 1 10 GLU OE2 O 11.014 -2.561 -4.092 1.00 . A B . 10 GLU OE2 1 1 5 3509 1 1 11 CYS C C 9.858 3.340 -2.939 1.00 . A B . 11 CYS C 1 1 5 3510 1 1 11 CYS CA C 9.424 2.012 -3.545 1.00 . A B . 11 CYS CA 1 1 5 3511 1 1 11 CYS CB C 8.546 1.229 -2.566 1.00 . A B . 11 CYS CB 1 1 5 3512 1 1 11 CYS H H 11.115 0.820 -3.156 1.00 . A B . 11 CYS H 1 1 5 3513 1 1 11 CYS HA H 8.873 2.197 -4.455 1.00 . A B . 11 CYS HA 1 1 5 3514 1 1 11 CYS HB2 H 8.349 0.256 -2.983 1.00 . A B . 11 CYS HB2 1 1 5 3515 1 1 11 CYS HB3 H 9.081 1.112 -1.635 1.00 . A B . 11 CYS HB3 1 1 5 3516 1 1 11 CYS N N 10.602 1.238 -3.875 1.00 . A B . 11 CYS N 1 1 5 3517 1 1 11 CYS O O 10.058 3.452 -1.727 1.00 . A B . 11 CYS O 1 1 5 3518 1 1 11 CYS SG S 6.948 1.995 -2.190 1.00 . A B . 11 CYS SG 1 1 5 3519 1 1 12 GLU C C 9.502 6.316 -2.421 1.00 . A B . 12 GLU C 1 1 5 3520 1 1 12 GLU CA C 10.483 5.648 -3.366 1.00 . A B . 12 GLU CA 1 1 5 3521 1 1 12 GLU CB C 10.745 6.543 -4.575 1.00 . A B . 12 GLU CB 1 1 5 3522 1 1 12 GLU CD C 13.212 6.049 -4.702 1.00 . A B . 12 GLU CD 1 1 5 3523 1 1 12 GLU CG C 11.895 6.069 -5.446 1.00 . A B . 12 GLU CG 1 1 5 3524 1 1 12 GLU H H 9.772 4.203 -4.734 1.00 . A B . 12 GLU H 1 1 5 3525 1 1 12 GLU HA H 11.412 5.496 -2.841 1.00 . A B . 12 GLU HA 1 1 5 3526 1 1 12 GLU HB2 H 9.853 6.580 -5.180 1.00 . A B . 12 GLU HB2 1 1 5 3527 1 1 12 GLU HB3 H 10.973 7.538 -4.224 1.00 . A B . 12 GLU HB3 1 1 5 3528 1 1 12 GLU HG2 H 11.684 5.071 -5.796 1.00 . A B . 12 GLU HG2 1 1 5 3529 1 1 12 GLU HG3 H 11.988 6.733 -6.290 1.00 . A B . 12 GLU HG3 1 1 5 3530 1 1 12 GLU N N 9.997 4.344 -3.790 1.00 . A B . 12 GLU N 1 1 5 3531 1 1 12 GLU O O 9.897 7.058 -1.520 1.00 . A B . 12 GLU O 1 1 5 3532 1 1 12 GLU OE1 O 13.531 5.016 -4.075 1.00 . A B . 12 GLU OE1 1 1 5 3533 1 1 12 GLU OE2 O 13.937 7.062 -4.737 1.00 . A B . 12 GLU OE2 1 1 5 3534 1 1 13 VAL C C 7.235 6.098 -0.367 1.00 . A B . 13 VAL C 1 1 5 3535 1 1 13 VAL CA C 7.186 6.629 -1.802 1.00 . A B . 13 VAL CA 1 1 5 3536 1 1 13 VAL CB C 5.791 6.407 -2.430 1.00 . A B . 13 VAL CB 1 1 5 3537 1 1 13 VAL CG1 C 5.466 4.932 -2.546 1.00 . A B . 13 VAL CG1 1 1 5 3538 1 1 13 VAL CG2 C 4.718 7.126 -1.638 1.00 . A B . 13 VAL CG2 1 1 5 3539 1 1 13 VAL H H 7.971 5.406 -3.326 1.00 . A B . 13 VAL H 1 1 5 3540 1 1 13 VAL HA H 7.373 7.692 -1.777 1.00 . A B . 13 VAL HA 1 1 5 3541 1 1 13 VAL HB H 5.806 6.820 -3.426 1.00 . A B . 13 VAL HB 1 1 5 3542 1 1 13 VAL HG11 H 6.218 4.441 -3.142 1.00 . A B . 13 VAL HG11 1 1 5 3543 1 1 13 VAL HG12 H 4.503 4.818 -3.017 1.00 . A B . 13 VAL HG12 1 1 5 3544 1 1 13 VAL HG13 H 5.439 4.491 -1.560 1.00 . A B . 13 VAL HG13 1 1 5 3545 1 1 13 VAL HG21 H 3.762 6.990 -2.123 1.00 . A B . 13 VAL HG21 1 1 5 3546 1 1 13 VAL HG22 H 4.952 8.179 -1.586 1.00 . A B . 13 VAL HG22 1 1 5 3547 1 1 13 VAL HG23 H 4.678 6.715 -0.642 1.00 . A B . 13 VAL HG23 1 1 5 3548 1 1 13 VAL N N 8.226 6.032 -2.613 1.00 . A B . 13 VAL N 1 1 5 3549 1 1 13 VAL O O 6.861 6.797 0.570 1.00 . A B . 13 VAL O 1 1 5 3550 1 1 14 CYS C C 8.986 5.117 1.893 1.00 . A B . 14 CYS C 1 1 5 3551 1 1 14 CYS CA C 7.914 4.335 1.156 1.00 . A B . 14 CYS CA 1 1 5 3552 1 1 14 CYS CB C 8.300 2.858 1.114 1.00 . A B . 14 CYS CB 1 1 5 3553 1 1 14 CYS H H 8.010 4.349 -0.967 1.00 . A B . 14 CYS H 1 1 5 3554 1 1 14 CYS HA H 6.980 4.442 1.683 1.00 . A B . 14 CYS HA 1 1 5 3555 1 1 14 CYS HB2 H 8.632 2.609 0.117 1.00 . A B . 14 CYS HB2 1 1 5 3556 1 1 14 CYS HB3 H 9.107 2.686 1.810 1.00 . A B . 14 CYS HB3 1 1 5 3557 1 1 14 CYS N N 7.737 4.879 -0.187 1.00 . A B . 14 CYS N 1 1 5 3558 1 1 14 CYS O O 8.866 5.403 3.081 1.00 . A B . 14 CYS O 1 1 5 3559 1 1 14 CYS SG S 6.954 1.736 1.543 1.00 . A B . 14 CYS SG 1 1 5 3560 1 1 15 ARG C C 10.708 7.649 2.032 1.00 . A B . 15 ARG C 1 1 5 3561 1 1 15 ARG CA C 11.139 6.226 1.703 1.00 . A B . 15 ARG CA 1 1 5 3562 1 1 15 ARG CB C 12.288 6.227 0.700 1.00 . A B . 15 ARG CB 1 1 5 3563 1 1 15 ARG CD C 13.652 4.854 -0.908 1.00 . A B . 15 ARG CD 1 1 5 3564 1 1 15 ARG CG C 12.684 4.828 0.260 1.00 . A B . 15 ARG CG 1 1 5 3565 1 1 15 ARG CZ C 15.960 5.574 -1.382 1.00 . A B . 15 ARG CZ 1 1 5 3566 1 1 15 ARG H H 10.020 5.241 0.203 1.00 . A B . 15 ARG H 1 1 5 3567 1 1 15 ARG HA H 11.456 5.736 2.606 1.00 . A B . 15 ARG HA 1 1 5 3568 1 1 15 ARG HB2 H 11.988 6.788 -0.173 1.00 . A B . 15 ARG HB2 1 1 5 3569 1 1 15 ARG HB3 H 13.147 6.699 1.148 1.00 . A B . 15 ARG HB3 1 1 5 3570 1 1 15 ARG HD2 H 13.779 3.847 -1.275 1.00 . A B . 15 ARG HD2 1 1 5 3571 1 1 15 ARG HD3 H 13.234 5.471 -1.690 1.00 . A B . 15 ARG HD3 1 1 5 3572 1 1 15 ARG HE H 15.094 5.599 0.421 1.00 . A B . 15 ARG HE 1 1 5 3573 1 1 15 ARG HG2 H 13.154 4.324 1.090 1.00 . A B . 15 ARG HG2 1 1 5 3574 1 1 15 ARG HG3 H 11.793 4.290 -0.031 1.00 . A B . 15 ARG HG3 1 1 5 3575 1 1 15 ARG HH11 H 14.898 5.031 -3.031 1.00 . A B . 15 ARG HH11 1 1 5 3576 1 1 15 ARG HH12 H 16.558 5.475 -3.317 1.00 . A B . 15 ARG HH12 1 1 5 3577 1 1 15 ARG HH21 H 17.259 6.216 0.032 1.00 . A B . 15 ARG HH21 1 1 5 3578 1 1 15 ARG HH22 H 17.892 6.143 -1.582 1.00 . A B . 15 ARG HH22 1 1 5 3579 1 1 15 ARG N N 10.018 5.481 1.153 1.00 . A B . 15 ARG N 1 1 5 3580 1 1 15 ARG NE N 14.955 5.388 -0.530 1.00 . A B . 15 ARG NE 1 1 5 3581 1 1 15 ARG NH1 N 15.793 5.343 -2.678 1.00 . A B . 15 ARG NH1 1 1 5 3582 1 1 15 ARG NH2 N 17.128 6.015 -0.942 1.00 . A B . 15 ARG NH2 1 1 5 3583 1 1 15 ARG O O 11.231 8.281 2.952 1.00 . A B . 15 ARG O 1 1 5 3584 1 1 16 ASP C C 8.284 9.452 2.758 1.00 . A B . 16 ASP C 1 1 5 3585 1 1 16 ASP CA C 9.150 9.453 1.497 1.00 . A B . 16 ASP CA 1 1 5 3586 1 1 16 ASP CB C 8.309 9.861 0.279 1.00 . A B . 16 ASP CB 1 1 5 3587 1 1 16 ASP CG C 7.540 11.153 0.483 1.00 . A B . 16 ASP CG 1 1 5 3588 1 1 16 ASP H H 9.460 7.618 0.483 1.00 . A B . 16 ASP H 1 1 5 3589 1 1 16 ASP HA H 9.953 10.162 1.626 1.00 . A B . 16 ASP HA 1 1 5 3590 1 1 16 ASP HB2 H 8.963 9.990 -0.570 1.00 . A B . 16 ASP HB2 1 1 5 3591 1 1 16 ASP HB3 H 7.602 9.074 0.061 1.00 . A B . 16 ASP HB3 1 1 5 3592 1 1 16 ASP N N 9.745 8.140 1.264 1.00 . A B . 16 ASP N 1 1 5 3593 1 1 16 ASP O O 7.954 10.506 3.301 1.00 . A B . 16 ASP O 1 1 5 3594 1 1 16 ASP OD1 O 8.162 12.235 0.458 1.00 . A B . 16 ASP OD1 1 1 5 3595 1 1 16 ASP OD2 O 6.309 11.093 0.685 1.00 . A B . 16 ASP OD2 1 1 5 3596 1 1 17 GLY C C 5.625 8.014 3.963 1.00 . A B . 17 GLY C 1 1 5 3597 1 1 17 GLY CA C 7.073 8.143 4.384 1.00 . A B . 17 GLY CA 1 1 5 3598 1 1 17 GLY H H 8.347 7.458 2.835 1.00 . A B . 17 GLY H 1 1 5 3599 1 1 17 GLY HA2 H 7.353 7.270 4.955 1.00 . A B . 17 GLY HA2 1 1 5 3600 1 1 17 GLY HA3 H 7.181 9.021 5.004 1.00 . A B . 17 GLY HA3 1 1 5 3601 1 1 17 GLY N N 7.959 8.263 3.242 1.00 . A B . 17 GLY N 1 1 5 3602 1 1 17 GLY O O 4.713 8.363 4.718 1.00 . A B . 17 GLY O 1 1 5 3603 1 1 18 GLY C C 3.238 6.386 3.002 1.00 . A B . 18 GLY C 1 1 5 3604 1 1 18 GLY CA C 4.086 7.354 2.212 1.00 . A B . 18 GLY CA 1 1 5 3605 1 1 18 GLY H H 6.193 7.259 2.203 1.00 . A B . 18 GLY H 1 1 5 3606 1 1 18 GLY HA2 H 3.599 8.314 2.204 1.00 . A B . 18 GLY HA2 1 1 5 3607 1 1 18 GLY HA3 H 4.165 6.996 1.200 1.00 . A B . 18 GLY HA3 1 1 5 3608 1 1 18 GLY N N 5.421 7.514 2.750 1.00 . A B . 18 GLY N 1 1 5 3609 1 1 18 GLY O O 3.744 5.413 3.571 1.00 . A B . 18 GLY O 1 1 5 3610 1 1 19 GLU C C 0.401 4.760 2.883 1.00 . A B . 19 GLU C 1 1 5 3611 1 1 19 GLU CA C 1.007 5.836 3.769 1.00 . A B . 19 GLU CA 1 1 5 3612 1 1 19 GLU CB C -0.094 6.718 4.358 1.00 . A B . 19 GLU CB 1 1 5 3613 1 1 19 GLU CD C -0.665 8.591 5.961 1.00 . A B . 19 GLU CD 1 1 5 3614 1 1 19 GLU CG C 0.433 7.781 5.307 1.00 . A B . 19 GLU CG 1 1 5 3615 1 1 19 GLU H H 1.606 7.411 2.508 1.00 . A B . 19 GLU H 1 1 5 3616 1 1 19 GLU HA H 1.548 5.360 4.573 1.00 . A B . 19 GLU HA 1 1 5 3617 1 1 19 GLU HB2 H -0.606 7.213 3.547 1.00 . A B . 19 GLU HB2 1 1 5 3618 1 1 19 GLU HB3 H -0.799 6.097 4.893 1.00 . A B . 19 GLU HB3 1 1 5 3619 1 1 19 GLU HG2 H 1.011 7.302 6.081 1.00 . A B . 19 GLU HG2 1 1 5 3620 1 1 19 GLU HG3 H 1.070 8.452 4.749 1.00 . A B . 19 GLU HG3 1 1 5 3621 1 1 19 GLU N N 1.945 6.648 3.022 1.00 . A B . 19 GLU N 1 1 5 3622 1 1 19 GLU O O 0.024 5.016 1.739 1.00 . A B . 19 GLU O 1 1 5 3623 1 1 19 GLU OE1 O -1.222 9.489 5.296 1.00 . A B . 19 GLU OE1 1 1 5 3624 1 1 19 GLU OE2 O -0.988 8.324 7.137 1.00 . A B . 19 GLU OE2 1 1 5 3625 1 1 20 LEU C C -1.782 2.451 2.864 1.00 . A B . 20 LEU C 1 1 5 3626 1 1 20 LEU CA C -0.269 2.438 2.703 1.00 . A B . 20 LEU CA 1 1 5 3627 1 1 20 LEU CB C 0.306 1.118 3.222 1.00 . A B . 20 LEU CB 1 1 5 3628 1 1 20 LEU CD1 C 2.318 -0.354 3.481 1.00 . A B . 20 LEU CD1 1 1 5 3629 1 1 20 LEU CD2 C 1.473 0.192 1.206 1.00 . A B . 20 LEU CD2 1 1 5 3630 1 1 20 LEU CG C 1.655 0.710 2.625 1.00 . A B . 20 LEU CG 1 1 5 3631 1 1 20 LEU H H 0.656 3.418 4.326 1.00 . A B . 20 LEU H 1 1 5 3632 1 1 20 LEU HA H -0.024 2.543 1.656 1.00 . A B . 20 LEU HA 1 1 5 3633 1 1 20 LEU HB2 H 0.422 1.200 4.292 1.00 . A B . 20 LEU HB2 1 1 5 3634 1 1 20 LEU HB3 H -0.407 0.335 3.013 1.00 . A B . 20 LEU HB3 1 1 5 3635 1 1 20 LEU HD11 H 1.619 -1.157 3.658 1.00 . A B . 20 LEU HD11 1 1 5 3636 1 1 20 LEU HD12 H 2.620 0.076 4.423 1.00 . A B . 20 LEU HD12 1 1 5 3637 1 1 20 LEU HD13 H 3.186 -0.739 2.966 1.00 . A B . 20 LEU HD13 1 1 5 3638 1 1 20 LEU HD21 H 1.111 0.987 0.571 1.00 . A B . 20 LEU HD21 1 1 5 3639 1 1 20 LEU HD22 H 0.764 -0.619 1.207 1.00 . A B . 20 LEU HD22 1 1 5 3640 1 1 20 LEU HD23 H 2.421 -0.164 0.831 1.00 . A B . 20 LEU HD23 1 1 5 3641 1 1 20 LEU HG H 2.308 1.574 2.591 1.00 . A B . 20 LEU HG 1 1 5 3642 1 1 20 LEU N N 0.320 3.556 3.417 1.00 . A B . 20 LEU N 1 1 5 3643 1 1 20 LEU O O -2.294 2.681 3.959 1.00 . A B . 20 LEU O 1 1 5 3644 1 1 21 PHE C C -4.472 0.787 1.705 1.00 . A B . 21 PHE C 1 1 5 3645 1 1 21 PHE CA C -3.953 2.217 1.811 1.00 . A B . 21 PHE CA 1 1 5 3646 1 1 21 PHE CB C -4.496 3.098 0.677 1.00 . A B . 21 PHE CB 1 1 5 3647 1 1 21 PHE CD1 C -3.999 5.381 1.606 1.00 . A B . 21 PHE CD1 1 1 5 3648 1 1 21 PHE CD2 C -2.993 4.763 -0.467 1.00 . A B . 21 PHE CD2 1 1 5 3649 1 1 21 PHE CE1 C -3.394 6.621 1.531 1.00 . A B . 21 PHE CE1 1 1 5 3650 1 1 21 PHE CE2 C -2.384 5.999 -0.544 1.00 . A B . 21 PHE CE2 1 1 5 3651 1 1 21 PHE CG C -3.806 4.436 0.609 1.00 . A B . 21 PHE CG 1 1 5 3652 1 1 21 PHE CZ C -2.483 6.880 0.514 1.00 . A B . 21 PHE CZ 1 1 5 3653 1 1 21 PHE H H -2.037 2.034 0.924 1.00 . A B . 21 PHE H 1 1 5 3654 1 1 21 PHE HA H -4.260 2.629 2.763 1.00 . A B . 21 PHE HA 1 1 5 3655 1 1 21 PHE HB2 H -4.343 2.594 -0.270 1.00 . A B . 21 PHE HB2 1 1 5 3656 1 1 21 PHE HB3 H -5.554 3.268 0.827 1.00 . A B . 21 PHE HB3 1 1 5 3657 1 1 21 PHE HD1 H -4.627 5.141 2.452 1.00 . A B . 21 PHE HD1 1 1 5 3658 1 1 21 PHE HD2 H -2.831 4.039 -1.252 1.00 . A B . 21 PHE HD2 1 1 5 3659 1 1 21 PHE HE1 H -3.554 7.349 2.313 1.00 . A B . 21 PHE HE1 1 1 5 3660 1 1 21 PHE HE2 H -1.752 6.238 -1.386 1.00 . A B . 21 PHE HE2 1 1 5 3661 1 1 21 PHE HZ H -1.966 7.828 0.479 1.00 . A B . 21 PHE HZ 1 1 5 3662 1 1 21 PHE N N -2.496 2.214 1.776 1.00 . A B . 21 PHE N 1 1 5 3663 1 1 21 PHE O O -5.524 0.514 1.125 1.00 . A B . 21 PHE O 1 1 5 3664 1 1 22 CYS C C -3.748 -2.157 3.615 1.00 . A B . 22 CYS C 1 1 5 3665 1 1 22 CYS CA C -4.019 -1.537 2.256 1.00 . A B . 22 CYS CA 1 1 5 3666 1 1 22 CYS CB C -3.182 -2.253 1.197 1.00 . A B . 22 CYS CB 1 1 5 3667 1 1 22 CYS H H -2.892 0.171 2.744 1.00 . A B . 22 CYS H 1 1 5 3668 1 1 22 CYS HA H -5.064 -1.646 2.017 1.00 . A B . 22 CYS HA 1 1 5 3669 1 1 22 CYS HB2 H -2.162 -1.892 1.253 1.00 . A B . 22 CYS HB2 1 1 5 3670 1 1 22 CYS HB3 H -3.189 -3.315 1.397 1.00 . A B . 22 CYS HB3 1 1 5 3671 1 1 22 CYS N N -3.703 -0.123 2.280 1.00 . A B . 22 CYS N 1 1 5 3672 1 1 22 CYS O O -3.046 -1.575 4.444 1.00 . A B . 22 CYS O 1 1 5 3673 1 1 22 CYS SG S -3.748 -2.010 -0.512 1.00 . A B . 22 CYS SG 1 1 5 3674 1 1 23 CYS C C -2.780 -4.883 4.893 1.00 . A B . 23 CYS C 1 1 5 3675 1 1 23 CYS CA C -4.057 -4.067 5.062 1.00 . A B . 23 CYS CA 1 1 5 3676 1 1 23 CYS CB C -5.245 -4.978 5.384 1.00 . A B . 23 CYS CB 1 1 5 3677 1 1 23 CYS H H -4.874 -3.729 3.148 1.00 . A B . 23 CYS H 1 1 5 3678 1 1 23 CYS HA H -3.918 -3.350 5.862 1.00 . A B . 23 CYS HA 1 1 5 3679 1 1 23 CYS HB2 H -5.180 -5.293 6.417 1.00 . A B . 23 CYS HB2 1 1 5 3680 1 1 23 CYS HB3 H -6.162 -4.424 5.238 1.00 . A B . 23 CYS HB3 1 1 5 3681 1 1 23 CYS N N -4.302 -3.337 3.837 1.00 . A B . 23 CYS N 1 1 5 3682 1 1 23 CYS O O -2.289 -5.014 3.770 1.00 . A B . 23 CYS O 1 1 5 3683 1 1 23 CYS SG S -5.333 -6.469 4.366 1.00 . A B . 23 CYS SG 1 1 5 3684 1 1 24 ASP C C -0.888 -7.156 4.823 1.00 . A B . 24 ASP C 1 1 5 3685 1 1 24 ASP CA C -0.986 -6.161 5.974 1.00 . A B . 24 ASP CA 1 1 5 3686 1 1 24 ASP CB C -0.750 -6.889 7.299 1.00 . A B . 24 ASP CB 1 1 5 3687 1 1 24 ASP CG C -0.049 -6.023 8.322 1.00 . A B . 24 ASP CG 1 1 5 3688 1 1 24 ASP H H -2.780 -5.394 6.822 1.00 . A B . 24 ASP H 1 1 5 3689 1 1 24 ASP HA H -0.209 -5.424 5.847 1.00 . A B . 24 ASP HA 1 1 5 3690 1 1 24 ASP HB2 H -1.698 -7.202 7.708 1.00 . A B . 24 ASP HB2 1 1 5 3691 1 1 24 ASP HB3 H -0.139 -7.760 7.114 1.00 . A B . 24 ASP HB3 1 1 5 3692 1 1 24 ASP N N -2.270 -5.445 5.985 1.00 . A B . 24 ASP N 1 1 5 3693 1 1 24 ASP O O 0.060 -7.110 4.042 1.00 . A B . 24 ASP O 1 1 5 3694 1 1 24 ASP OD1 O -0.694 -5.093 8.855 1.00 . A B . 24 ASP OD1 1 1 5 3695 1 1 24 ASP OD2 O 1.143 -6.270 8.606 1.00 . A B . 24 ASP OD2 1 1 5 3696 1 1 25 THR C C -1.768 -8.493 2.281 1.00 . A B . 25 THR C 1 1 5 3697 1 1 25 THR CA C -1.865 -9.074 3.695 1.00 . A B . 25 THR CA 1 1 5 3698 1 1 25 THR CB C -3.123 -9.956 3.811 1.00 . A B . 25 THR CB 1 1 5 3699 1 1 25 THR CG2 C -3.077 -11.118 2.828 1.00 . A B . 25 THR CG2 1 1 5 3700 1 1 25 THR H H -2.637 -7.973 5.330 1.00 . A B . 25 THR H 1 1 5 3701 1 1 25 THR HA H -1.001 -9.698 3.873 1.00 . A B . 25 THR HA 1 1 5 3702 1 1 25 THR HB H -3.987 -9.349 3.590 1.00 . A B . 25 THR HB 1 1 5 3703 1 1 25 THR HG1 H -2.856 -11.352 5.183 1.00 . A B . 25 THR HG1 1 1 5 3704 1 1 25 THR HG21 H -3.021 -10.736 1.820 1.00 . A B . 25 THR HG21 1 1 5 3705 1 1 25 THR HG22 H -3.968 -11.718 2.937 1.00 . A B . 25 THR HG22 1 1 5 3706 1 1 25 THR HG23 H -2.207 -11.726 3.030 1.00 . A B . 25 THR HG23 1 1 5 3707 1 1 25 THR N N -1.876 -8.030 4.709 1.00 . A B . 25 THR N 1 1 5 3708 1 1 25 THR O O -0.907 -8.889 1.498 1.00 . A B . 25 THR O 1 1 5 3709 1 1 25 THR OG1 O -3.237 -10.464 5.146 1.00 . A B . 25 THR OG1 1 1 5 3710 1 1 26 CYS C C -1.466 -6.094 0.319 1.00 . A B . 26 CYS C 1 1 5 3711 1 1 26 CYS CA C -2.676 -6.982 0.613 1.00 . A B . 26 CYS CA 1 1 5 3712 1 1 26 CYS CB C -3.964 -6.188 0.400 1.00 . A B . 26 CYS CB 1 1 5 3713 1 1 26 CYS H H -3.235 -7.188 2.652 1.00 . A B . 26 CYS H 1 1 5 3714 1 1 26 CYS HA H -2.664 -7.815 -0.072 1.00 . A B . 26 CYS HA 1 1 5 3715 1 1 26 CYS HB2 H -3.972 -5.347 1.070 1.00 . A B . 26 CYS HB2 1 1 5 3716 1 1 26 CYS HB3 H -3.997 -5.829 -0.617 1.00 . A B . 26 CYS HB3 1 1 5 3717 1 1 26 CYS N N -2.627 -7.531 1.966 1.00 . A B . 26 CYS N 1 1 5 3718 1 1 26 CYS O O -0.960 -6.084 -0.800 1.00 . A B . 26 CYS O 1 1 5 3719 1 1 26 CYS SG S -5.475 -7.126 0.703 1.00 . A B . 26 CYS SG 1 1 5 3720 1 1 27 SER C C 1.398 -5.179 0.768 1.00 . A B . 27 SER C 1 1 5 3721 1 1 27 SER CA C 0.123 -4.443 1.158 1.00 . A B . 27 SER CA 1 1 5 3722 1 1 27 SER CB C 0.370 -3.660 2.447 1.00 . A B . 27 SER CB 1 1 5 3723 1 1 27 SER H H -1.420 -5.439 2.214 1.00 . A B . 27 SER H 1 1 5 3724 1 1 27 SER HA H -0.133 -3.752 0.371 1.00 . A B . 27 SER HA 1 1 5 3725 1 1 27 SER HB2 H 0.573 -4.352 3.249 1.00 . A B . 27 SER HB2 1 1 5 3726 1 1 27 SER HB3 H 1.218 -3.010 2.309 1.00 . A B . 27 SER HB3 1 1 5 3727 1 1 27 SER HG H -0.759 -2.733 3.753 1.00 . A B . 27 SER HG 1 1 5 3728 1 1 27 SER N N -0.998 -5.363 1.329 1.00 . A B . 27 SER N 1 1 5 3729 1 1 27 SER O O 2.276 -4.616 0.119 1.00 . A B . 27 SER O 1 1 5 3730 1 1 27 SER OG O -0.755 -2.877 2.801 1.00 . A B . 27 SER OG 1 1 5 3731 1 1 28 ARG C C 2.567 -7.865 -0.499 1.00 . A B . 28 ARG C 1 1 5 3732 1 1 28 ARG CA C 2.680 -7.228 0.884 1.00 . A B . 28 ARG CA 1 1 5 3733 1 1 28 ARG CB C 2.851 -8.295 1.961 1.00 . A B . 28 ARG CB 1 1 5 3734 1 1 28 ARG CD C 2.942 -8.788 4.431 1.00 . A B . 28 ARG CD 1 1 5 3735 1 1 28 ARG CG C 2.941 -7.710 3.359 1.00 . A B . 28 ARG CG 1 1 5 3736 1 1 28 ARG CZ C 3.205 -8.779 6.885 1.00 . A B . 28 ARG CZ 1 1 5 3737 1 1 28 ARG H H 0.799 -6.812 1.744 1.00 . A B . 28 ARG H 1 1 5 3738 1 1 28 ARG HA H 3.537 -6.574 0.898 1.00 . A B . 28 ARG HA 1 1 5 3739 1 1 28 ARG HB2 H 2.003 -8.964 1.926 1.00 . A B . 28 ARG HB2 1 1 5 3740 1 1 28 ARG HB3 H 3.753 -8.854 1.765 1.00 . A B . 28 ARG HB3 1 1 5 3741 1 1 28 ARG HD2 H 2.140 -9.484 4.228 1.00 . A B . 28 ARG HD2 1 1 5 3742 1 1 28 ARG HD3 H 3.886 -9.310 4.402 1.00 . A B . 28 ARG HD3 1 1 5 3743 1 1 28 ARG HE H 2.230 -7.387 5.828 1.00 . A B . 28 ARG HE 1 1 5 3744 1 1 28 ARG HG2 H 3.853 -7.139 3.440 1.00 . A B . 28 ARG HG2 1 1 5 3745 1 1 28 ARG HG3 H 2.094 -7.059 3.517 1.00 . A B . 28 ARG HG3 1 1 5 3746 1 1 28 ARG HH11 H 4.167 -10.293 5.945 1.00 . A B . 28 ARG HH11 1 1 5 3747 1 1 28 ARG HH12 H 4.287 -10.303 7.671 1.00 . A B . 28 ARG HH12 1 1 5 3748 1 1 28 ARG HH21 H 2.365 -7.391 8.113 1.00 . A B . 28 ARG HH21 1 1 5 3749 1 1 28 ARG HH22 H 3.276 -8.642 8.906 1.00 . A B . 28 ARG HH22 1 1 5 3750 1 1 28 ARG N N 1.508 -6.427 1.187 1.00 . A B . 28 ARG N 1 1 5 3751 1 1 28 ARG NE N 2.749 -8.222 5.766 1.00 . A B . 28 ARG NE 1 1 5 3752 1 1 28 ARG NH1 N 3.946 -9.879 6.829 1.00 . A B . 28 ARG NH1 1 1 5 3753 1 1 28 ARG NH2 N 2.927 -8.229 8.060 1.00 . A B . 28 ARG NH2 1 1 5 3754 1 1 28 ARG O O 3.575 -8.199 -1.125 1.00 . A B . 28 ARG O 1 1 5 3755 1 1 29 VAL C C 1.024 -7.601 -3.390 1.00 . A B . 29 VAL C 1 1 5 3756 1 1 29 VAL CA C 1.086 -8.640 -2.268 1.00 . A B . 29 VAL CA 1 1 5 3757 1 1 29 VAL CB C -0.224 -9.462 -2.244 1.00 . A B . 29 VAL CB 1 1 5 3758 1 1 29 VAL CG1 C -0.495 -10.100 -3.596 1.00 . A B . 29 VAL CG1 1 1 5 3759 1 1 29 VAL CG2 C -0.167 -10.531 -1.167 1.00 . A B . 29 VAL CG2 1 1 5 3760 1 1 29 VAL H H 0.577 -7.694 -0.449 1.00 . A B . 29 VAL H 1 1 5 3761 1 1 29 VAL HA H 1.902 -9.317 -2.467 1.00 . A B . 29 VAL HA 1 1 5 3762 1 1 29 VAL HB H -1.040 -8.796 -2.014 1.00 . A B . 29 VAL HB 1 1 5 3763 1 1 29 VAL HG11 H -0.599 -9.329 -4.345 1.00 . A B . 29 VAL HG11 1 1 5 3764 1 1 29 VAL HG12 H -1.405 -10.678 -3.544 1.00 . A B . 29 VAL HG12 1 1 5 3765 1 1 29 VAL HG13 H 0.327 -10.746 -3.857 1.00 . A B . 29 VAL HG13 1 1 5 3766 1 1 29 VAL HG21 H 0.690 -11.166 -1.336 1.00 . A B . 29 VAL HG21 1 1 5 3767 1 1 29 VAL HG22 H -1.069 -11.125 -1.204 1.00 . A B . 29 VAL HG22 1 1 5 3768 1 1 29 VAL HG23 H -0.084 -10.064 -0.198 1.00 . A B . 29 VAL HG23 1 1 5 3769 1 1 29 VAL N N 1.337 -8.013 -0.977 1.00 . A B . 29 VAL N 1 1 5 3770 1 1 29 VAL O O 1.606 -7.798 -4.457 1.00 . A B . 29 VAL O 1 1 5 3771 1 1 30 PHE C C 0.790 -4.148 -3.635 1.00 . A B . 30 PHE C 1 1 5 3772 1 1 30 PHE CA C 0.179 -5.445 -4.150 1.00 . A B . 30 PHE CA 1 1 5 3773 1 1 30 PHE CB C -1.301 -5.203 -4.481 1.00 . A B . 30 PHE CB 1 1 5 3774 1 1 30 PHE CD1 C -1.899 -7.046 -6.091 1.00 . A B . 30 PHE CD1 1 1 5 3775 1 1 30 PHE CD2 C -2.983 -6.986 -3.967 1.00 . A B . 30 PHE CD2 1 1 5 3776 1 1 30 PHE CE1 C -2.620 -8.176 -6.427 1.00 . A B . 30 PHE CE1 1 1 5 3777 1 1 30 PHE CE2 C -3.705 -8.114 -4.297 1.00 . A B . 30 PHE CE2 1 1 5 3778 1 1 30 PHE CG C -2.072 -6.439 -4.855 1.00 . A B . 30 PHE CG 1 1 5 3779 1 1 30 PHE CZ C -3.524 -8.711 -5.528 1.00 . A B . 30 PHE CZ 1 1 5 3780 1 1 30 PHE H H -0.083 -6.372 -2.260 1.00 . A B . 30 PHE H 1 1 5 3781 1 1 30 PHE HA H 0.704 -5.754 -5.043 1.00 . A B . 30 PHE HA 1 1 5 3782 1 1 30 PHE HB2 H -1.785 -4.767 -3.618 1.00 . A B . 30 PHE HB2 1 1 5 3783 1 1 30 PHE HB3 H -1.366 -4.507 -5.308 1.00 . A B . 30 PHE HB3 1 1 5 3784 1 1 30 PHE HD1 H -1.194 -6.631 -6.796 1.00 . A B . 30 PHE HD1 1 1 5 3785 1 1 30 PHE HD2 H -3.130 -6.519 -3.006 1.00 . A B . 30 PHE HD2 1 1 5 3786 1 1 30 PHE HE1 H -2.478 -8.640 -7.393 1.00 . A B . 30 PHE HE1 1 1 5 3787 1 1 30 PHE HE2 H -4.410 -8.530 -3.592 1.00 . A B . 30 PHE HE2 1 1 5 3788 1 1 30 PHE HZ H -4.088 -9.593 -5.789 1.00 . A B . 30 PHE HZ 1 1 5 3789 1 1 30 PHE N N 0.331 -6.495 -3.146 1.00 . A B . 30 PHE N 1 1 5 3790 1 1 30 PHE O O 0.155 -3.097 -3.675 1.00 . A B . 30 PHE O 1 1 5 3791 1 1 31 HIS C C 2.636 -1.838 -3.323 1.00 . A B . 31 HIS C 1 1 5 3792 1 1 31 HIS CA C 2.687 -3.118 -2.494 1.00 . A B . 31 HIS CA 1 1 5 3793 1 1 31 HIS CB C 4.138 -3.497 -2.195 1.00 . A B . 31 HIS CB 1 1 5 3794 1 1 31 HIS CD2 C 5.947 -1.717 -1.654 1.00 . A B . 31 HIS CD2 1 1 5 3795 1 1 31 HIS CE1 C 5.536 -1.418 0.449 1.00 . A B . 31 HIS CE1 1 1 5 3796 1 1 31 HIS CG C 4.888 -2.509 -1.346 1.00 . A B . 31 HIS CG 1 1 5 3797 1 1 31 HIS H H 2.514 -5.078 -3.273 1.00 . A B . 31 HIS H 1 1 5 3798 1 1 31 HIS HA H 2.175 -2.944 -1.560 1.00 . A B . 31 HIS HA 1 1 5 3799 1 1 31 HIS HB2 H 4.149 -4.446 -1.679 1.00 . A B . 31 HIS HB2 1 1 5 3800 1 1 31 HIS HB3 H 4.668 -3.600 -3.131 1.00 . A B . 31 HIS HB3 1 1 5 3801 1 1 31 HIS HD1 H 3.927 -2.734 0.518 1.00 . A B . 31 HIS HD1 1 1 5 3802 1 1 31 HIS HD2 H 6.388 -1.606 -2.632 1.00 . A B . 31 HIS HD2 1 1 5 3803 1 1 31 HIS HE1 H 5.575 -1.059 1.468 1.00 . A B . 31 HIS HE1 1 1 5 3804 1 1 31 HIS N N 2.026 -4.234 -3.164 1.00 . A B . 31 HIS N 1 1 5 3805 1 1 31 HIS ND1 N 4.639 -2.305 -0.008 1.00 . A B . 31 HIS ND1 1 1 5 3806 1 1 31 HIS NE2 N 6.361 -1.032 -0.512 1.00 . A B . 31 HIS NE2 1 1 5 3807 1 1 31 HIS O O 2.207 -0.799 -2.835 1.00 . A B . 31 HIS O 1 1 5 3808 1 1 32 GLU C C 1.778 -0.137 -5.724 1.00 . A B . 32 GLU C 1 1 5 3809 1 1 32 GLU CA C 3.138 -0.754 -5.435 1.00 . A B . 32 GLU CA 1 1 5 3810 1 1 32 GLU CB C 3.835 -1.102 -6.747 1.00 . A B . 32 GLU CB 1 1 5 3811 1 1 32 GLU CD C 5.931 -1.870 -7.902 1.00 . A B . 32 GLU CD 1 1 5 3812 1 1 32 GLU CG C 5.279 -1.544 -6.579 1.00 . A B . 32 GLU CG 1 1 5 3813 1 1 32 GLU H H 3.149 -2.823 -4.977 1.00 . A B . 32 GLU H 1 1 5 3814 1 1 32 GLU HA H 3.737 -0.033 -4.900 1.00 . A B . 32 GLU HA 1 1 5 3815 1 1 32 GLU HB2 H 3.291 -1.901 -7.226 1.00 . A B . 32 GLU HB2 1 1 5 3816 1 1 32 GLU HB3 H 3.820 -0.235 -7.389 1.00 . A B . 32 GLU HB3 1 1 5 3817 1 1 32 GLU HG2 H 5.836 -0.749 -6.108 1.00 . A B . 32 GLU HG2 1 1 5 3818 1 1 32 GLU HG3 H 5.306 -2.424 -5.954 1.00 . A B . 32 GLU HG3 1 1 5 3819 1 1 32 GLU N N 3.006 -1.936 -4.590 1.00 . A B . 32 GLU N 1 1 5 3820 1 1 32 GLU O O 1.636 1.085 -5.768 1.00 . A B . 32 GLU O 1 1 5 3821 1 1 32 GLU OE1 O 6.484 -0.949 -8.539 1.00 . A B . 32 GLU OE1 1 1 5 3822 1 1 32 GLU OE2 O 5.888 -3.049 -8.312 1.00 . A B . 32 GLU OE2 1 1 5 3823 1 1 33 ASP C C -1.224 0.006 -4.918 1.00 . A B . 33 ASP C 1 1 5 3824 1 1 33 ASP CA C -0.574 -0.535 -6.183 1.00 . A B . 33 ASP CA 1 1 5 3825 1 1 33 ASP CB C -1.428 -1.669 -6.758 1.00 . A B . 33 ASP CB 1 1 5 3826 1 1 33 ASP CG C -1.057 -2.028 -8.181 1.00 . A B . 33 ASP CG 1 1 5 3827 1 1 33 ASP H H 0.963 -1.954 -5.849 1.00 . A B . 33 ASP H 1 1 5 3828 1 1 33 ASP HA H -0.513 0.261 -6.909 1.00 . A B . 33 ASP HA 1 1 5 3829 1 1 33 ASP HB2 H -1.300 -2.547 -6.144 1.00 . A B . 33 ASP HB2 1 1 5 3830 1 1 33 ASP HB3 H -2.468 -1.373 -6.739 1.00 . A B . 33 ASP HB3 1 1 5 3831 1 1 33 ASP N N 0.782 -0.990 -5.906 1.00 . A B . 33 ASP N 1 1 5 3832 1 1 33 ASP O O -2.132 0.831 -4.979 1.00 . A B . 33 ASP O 1 1 5 3833 1 1 33 ASP OD1 O -0.119 -2.835 -8.373 1.00 . A B . 33 ASP OD1 1 1 5 3834 1 1 33 ASP OD2 O -1.696 -1.505 -9.118 1.00 . A B . 33 ASP OD2 1 1 5 3835 1 1 34 CYS C C -0.750 1.304 -2.036 1.00 . A B . 34 CYS C 1 1 5 3836 1 1 34 CYS CA C -1.296 -0.049 -2.489 1.00 . A B . 34 CYS CA 1 1 5 3837 1 1 34 CYS CB C -1.022 -1.130 -1.445 1.00 . A B . 34 CYS CB 1 1 5 3838 1 1 34 CYS H H -0.004 -1.103 -3.794 1.00 . A B . 34 CYS H 1 1 5 3839 1 1 34 CYS HA H -2.367 0.044 -2.613 1.00 . A B . 34 CYS HA 1 1 5 3840 1 1 34 CYS HB2 H -0.004 -1.485 -1.561 1.00 . A B . 34 CYS HB2 1 1 5 3841 1 1 34 CYS HB3 H -1.146 -0.711 -0.458 1.00 . A B . 34 CYS HB3 1 1 5 3842 1 1 34 CYS N N -0.746 -0.456 -3.775 1.00 . A B . 34 CYS N 1 1 5 3843 1 1 34 CYS O O -1.146 1.827 -0.992 1.00 . A B . 34 CYS O 1 1 5 3844 1 1 34 CYS SG S -2.127 -2.569 -1.591 1.00 . A B . 34 CYS SG 1 1 5 3845 1 1 35 HIS C C -0.042 4.170 -3.585 1.00 . A B . 35 HIS C 1 1 5 3846 1 1 35 HIS CA C 0.641 3.224 -2.605 1.00 . A B . 35 HIS CA 1 1 5 3847 1 1 35 HIS CB C 2.158 3.309 -2.778 1.00 . A B . 35 HIS CB 1 1 5 3848 1 1 35 HIS CD2 C 3.393 1.402 -1.551 1.00 . A B . 35 HIS CD2 1 1 5 3849 1 1 35 HIS CE1 C 3.928 2.428 0.271 1.00 . A B . 35 HIS CE1 1 1 5 3850 1 1 35 HIS CG C 2.923 2.666 -1.665 1.00 . A B . 35 HIS CG 1 1 5 3851 1 1 35 HIS H H 0.546 1.332 -3.556 1.00 . A B . 35 HIS H 1 1 5 3852 1 1 35 HIS HA H 0.383 3.513 -1.595 1.00 . A B . 35 HIS HA 1 1 5 3853 1 1 35 HIS HB2 H 2.431 2.815 -3.699 1.00 . A B . 35 HIS HB2 1 1 5 3854 1 1 35 HIS HB3 H 2.449 4.348 -2.831 1.00 . A B . 35 HIS HB3 1 1 5 3855 1 1 35 HIS HD1 H 3.030 4.233 -0.248 1.00 . A B . 35 HIS HD1 1 1 5 3856 1 1 35 HIS HD2 H 3.305 0.624 -2.298 1.00 . A B . 35 HIS HD2 1 1 5 3857 1 1 35 HIS HE1 H 4.324 2.652 1.251 1.00 . A B . 35 HIS HE1 1 1 5 3858 1 1 35 HIS N N 0.167 1.858 -2.819 1.00 . A B . 35 HIS N 1 1 5 3859 1 1 35 HIS ND1 N 3.266 3.307 -0.495 1.00 . A B . 35 HIS ND1 1 1 5 3860 1 1 35 HIS NE2 N 4.031 1.249 -0.327 1.00 . A B . 35 HIS NE2 1 1 5 3861 1 1 35 HIS O O 0.318 5.343 -3.699 1.00 . A B . 35 HIS O 1 1 5 3862 1 1 36 ILE C C -3.246 4.314 -5.041 1.00 . A B . 36 ILE C 1 1 5 3863 1 1 36 ILE CA C -1.742 4.387 -5.314 1.00 . A B . 36 ILE CA 1 1 5 3864 1 1 36 ILE CB C -1.442 3.827 -6.726 1.00 . A B . 36 ILE CB 1 1 5 3865 1 1 36 ILE CD1 C 0.464 3.281 -8.341 1.00 . A B . 36 ILE CD1 1 1 5 3866 1 1 36 ILE CG1 C 0.067 3.853 -6.995 1.00 . A B . 36 ILE CG1 1 1 5 3867 1 1 36 ILE CG2 C -2.192 4.611 -7.797 1.00 . A B . 36 ILE CG2 1 1 5 3868 1 1 36 ILE H H -1.256 2.698 -4.156 1.00 . A B . 36 ILE H 1 1 5 3869 1 1 36 ILE HA H -1.419 5.415 -5.271 1.00 . A B . 36 ILE HA 1 1 5 3870 1 1 36 ILE HB H -1.787 2.806 -6.760 1.00 . A B . 36 ILE HB 1 1 5 3871 1 1 36 ILE HD11 H 0.153 2.249 -8.402 1.00 . A B . 36 ILE HD11 1 1 5 3872 1 1 36 ILE HD12 H 1.536 3.340 -8.456 1.00 . A B . 36 ILE HD12 1 1 5 3873 1 1 36 ILE HD13 H -0.013 3.846 -9.127 1.00 . A B . 36 ILE HD13 1 1 5 3874 1 1 36 ILE HG12 H 0.415 4.874 -6.956 1.00 . A B . 36 ILE HG12 1 1 5 3875 1 1 36 ILE HG13 H 0.568 3.279 -6.230 1.00 . A B . 36 ILE HG13 1 1 5 3876 1 1 36 ILE HG21 H -3.251 4.580 -7.592 1.00 . A B . 36 ILE HG21 1 1 5 3877 1 1 36 ILE HG22 H -2.000 4.170 -8.764 1.00 . A B . 36 ILE HG22 1 1 5 3878 1 1 36 ILE HG23 H -1.854 5.637 -7.796 1.00 . A B . 36 ILE HG23 1 1 5 3879 1 1 36 ILE N N -1.017 3.635 -4.306 1.00 . A B . 36 ILE N 1 1 5 3880 1 1 36 ILE O O -3.770 3.246 -4.730 1.00 . A B . 36 ILE O 1 1 5 3881 1 1 37 PRO C C -2.824 7.428 -4.193 1.00 . A B . 37 PRO C 1 1 5 3882 1 1 37 PRO CA C -3.395 6.755 -5.437 1.00 . A B . 37 PRO CA 1 1 5 3883 1 1 37 PRO CB C -4.599 7.559 -5.970 1.00 . A B . 37 PRO CB 1 1 5 3884 1 1 37 PRO CD C -5.412 5.530 -4.959 1.00 . A B . 37 PRO CD 1 1 5 3885 1 1 37 PRO CG C -5.780 6.633 -5.911 1.00 . A B . 37 PRO CG 1 1 5 3886 1 1 37 PRO HA H -2.630 6.689 -6.198 1.00 . A B . 37 PRO HA 1 1 5 3887 1 1 37 PRO HB2 H -4.754 8.427 -5.340 1.00 . A B . 37 PRO HB2 1 1 5 3888 1 1 37 PRO HB3 H -4.400 7.880 -6.986 1.00 . A B . 37 PRO HB3 1 1 5 3889 1 1 37 PRO HD2 H -5.667 5.803 -3.943 1.00 . A B . 37 PRO HD2 1 1 5 3890 1 1 37 PRO HD3 H -5.895 4.604 -5.240 1.00 . A B . 37 PRO HD3 1 1 5 3891 1 1 37 PRO HG2 H -6.648 7.166 -5.549 1.00 . A B . 37 PRO HG2 1 1 5 3892 1 1 37 PRO HG3 H -5.975 6.229 -6.896 1.00 . A B . 37 PRO HG3 1 1 5 3893 1 1 37 PRO N N -3.964 5.442 -5.132 1.00 . A B . 37 PRO N 1 1 5 3894 1 1 37 PRO O O -3.404 7.335 -3.111 1.00 . A B . 37 PRO O 1 1 5 3895 1 1 38 PRO C C -1.973 9.952 -2.728 1.00 . A B . 38 PRO C 1 1 5 3896 1 1 38 PRO CA C -1.056 8.845 -3.231 1.00 . A B . 38 PRO CA 1 1 5 3897 1 1 38 PRO CB C 0.222 9.435 -3.840 1.00 . A B . 38 PRO CB 1 1 5 3898 1 1 38 PRO CD C -0.894 8.212 -5.577 1.00 . A B . 38 PRO CD 1 1 5 3899 1 1 38 PRO CG C 0.013 9.388 -5.317 1.00 . A B . 38 PRO CG 1 1 5 3900 1 1 38 PRO HA H -0.802 8.188 -2.413 1.00 . A B . 38 PRO HA 1 1 5 3901 1 1 38 PRO HB2 H 0.351 10.449 -3.490 1.00 . A B . 38 PRO HB2 1 1 5 3902 1 1 38 PRO HB3 H 1.073 8.838 -3.540 1.00 . A B . 38 PRO HB3 1 1 5 3903 1 1 38 PRO HD2 H -1.543 8.409 -6.420 1.00 . A B . 38 PRO HD2 1 1 5 3904 1 1 38 PRO HD3 H -0.317 7.312 -5.746 1.00 . A B . 38 PRO HD3 1 1 5 3905 1 1 38 PRO HG2 H -0.456 10.305 -5.647 1.00 . A B . 38 PRO HG2 1 1 5 3906 1 1 38 PRO HG3 H 0.961 9.250 -5.820 1.00 . A B . 38 PRO HG3 1 1 5 3907 1 1 38 PRO N N -1.674 8.107 -4.334 1.00 . A B . 38 PRO N 1 1 5 3908 1 1 38 PRO O O -2.622 10.635 -3.525 1.00 . A B . 38 PRO O 1 1 5 3909 1 1 39 VAL C C -2.874 12.450 -1.360 1.00 . A B . 39 VAL C 1 1 5 3910 1 1 39 VAL CA C -2.961 11.037 -0.774 1.00 . A B . 39 VAL CA 1 1 5 3911 1 1 39 VAL CB C -2.777 11.073 0.763 1.00 . A B . 39 VAL CB 1 1 5 3912 1 1 39 VAL CG1 C -1.383 11.535 1.158 1.00 . A B . 39 VAL CG1 1 1 5 3913 1 1 39 VAL CG2 C -3.842 11.947 1.411 1.00 . A B . 39 VAL CG2 1 1 5 3914 1 1 39 VAL H H -1.409 9.598 -0.845 1.00 . A B . 39 VAL H 1 1 5 3915 1 1 39 VAL HA H -3.950 10.658 -0.970 1.00 . A B . 39 VAL HA 1 1 5 3916 1 1 39 VAL HB H -2.906 10.068 1.132 1.00 . A B . 39 VAL HB 1 1 5 3917 1 1 39 VAL HG11 H -1.305 11.566 2.234 1.00 . A B . 39 VAL HG11 1 1 5 3918 1 1 39 VAL HG12 H -1.204 12.521 0.755 1.00 . A B . 39 VAL HG12 1 1 5 3919 1 1 39 VAL HG13 H -0.650 10.847 0.764 1.00 . A B . 39 VAL HG13 1 1 5 3920 1 1 39 VAL HG21 H -3.704 11.946 2.482 1.00 . A B . 39 VAL HG21 1 1 5 3921 1 1 39 VAL HG22 H -4.820 11.558 1.173 1.00 . A B . 39 VAL HG22 1 1 5 3922 1 1 39 VAL HG23 H -3.754 12.955 1.037 1.00 . A B . 39 VAL HG23 1 1 5 3923 1 1 39 VAL N N -2.024 10.116 -1.409 1.00 . A B . 39 VAL N 1 1 5 3924 1 1 39 VAL O O -1.828 13.104 -1.317 1.00 . A B . 39 VAL O 1 1 5 3925 1 1 40 GLU C C -5.459 14.801 -2.331 1.00 . A B . 40 GLU C 1 1 5 3926 1 1 40 GLU CA C -4.062 14.218 -2.537 1.00 . A B . 40 GLU CA 1 1 5 3927 1 1 40 GLU CB C -3.731 14.152 -4.030 1.00 . A B . 40 GLU CB 1 1 5 3928 1 1 40 GLU CD C -2.246 16.181 -4.064 1.00 . A B . 40 GLU CD 1 1 5 3929 1 1 40 GLU CG C -3.469 15.511 -4.651 1.00 . A B . 40 GLU CG 1 1 5 3930 1 1 40 GLU H H -4.764 12.306 -1.983 1.00 . A B . 40 GLU H 1 1 5 3931 1 1 40 GLU HA H -3.342 14.851 -2.042 1.00 . A B . 40 GLU HA 1 1 5 3932 1 1 40 GLU HB2 H -2.850 13.543 -4.165 1.00 . A B . 40 GLU HB2 1 1 5 3933 1 1 40 GLU HB3 H -4.558 13.695 -4.553 1.00 . A B . 40 GLU HB3 1 1 5 3934 1 1 40 GLU HG2 H -3.321 15.388 -5.713 1.00 . A B . 40 GLU HG2 1 1 5 3935 1 1 40 GLU HG3 H -4.327 16.144 -4.475 1.00 . A B . 40 GLU HG3 1 1 5 3936 1 1 40 GLU N N -3.980 12.893 -1.944 1.00 . A B . 40 GLU N 1 1 5 3937 1 1 40 GLU O O -5.614 15.974 -1.981 1.00 . A B . 40 GLU O 1 1 5 3938 1 1 40 GLU OE1 O -1.121 15.860 -4.505 1.00 . A B . 40 GLU OE1 1 1 5 3939 1 1 40 GLU OE2 O -2.395 17.030 -3.163 1.00 . A B . 40 GLU OE2 1 1 5 3940 1 1 41 ALA C C -8.365 13.839 -1.010 1.00 . A B . 41 ALA C 1 1 5 3941 1 1 41 ALA CA C -7.852 14.387 -2.336 1.00 . A B . 41 ALA CA 1 1 5 3942 1 1 41 ALA CB C -8.733 13.924 -3.488 1.00 . A B . 41 ALA CB 1 1 5 3943 1 1 41 ALA H H -6.293 13.064 -2.859 1.00 . A B . 41 ALA H 1 1 5 3944 1 1 41 ALA HA H -7.878 15.465 -2.301 1.00 . A B . 41 ALA HA 1 1 5 3945 1 1 41 ALA HB1 H -8.716 12.846 -3.543 1.00 . A B . 41 ALA HB1 1 1 5 3946 1 1 41 ALA HB2 H -8.362 14.338 -4.414 1.00 . A B . 41 ALA HB2 1 1 5 3947 1 1 41 ALA HB3 H -9.747 14.260 -3.324 1.00 . A B . 41 ALA HB3 1 1 5 3948 1 1 41 ALA N N -6.474 13.976 -2.548 1.00 . A B . 41 ALA N 1 1 5 3949 1 1 41 ALA O O -8.553 14.586 -0.048 1.00 . A B . 41 ALA O 1 1 5 3950 1 1 42 GLU C C -8.573 10.402 0.244 1.00 . A B . 42 GLU C 1 1 5 3951 1 1 42 GLU CA C -9.005 11.866 0.255 1.00 . A B . 42 GLU CA 1 1 5 3952 1 1 42 GLU CB C -10.522 11.974 0.412 1.00 . A B . 42 GLU CB 1 1 5 3953 1 1 42 GLU CD C -12.788 11.441 -0.552 1.00 . A B . 42 GLU CD 1 1 5 3954 1 1 42 GLU CG C -11.298 11.512 -0.806 1.00 . A B . 42 GLU CG 1 1 5 3955 1 1 42 GLU H H -8.410 11.993 -1.764 1.00 . A B . 42 GLU H 1 1 5 3956 1 1 42 GLU HA H -8.532 12.361 1.087 1.00 . A B . 42 GLU HA 1 1 5 3957 1 1 42 GLU HB2 H -10.828 11.374 1.255 1.00 . A B . 42 GLU HB2 1 1 5 3958 1 1 42 GLU HB3 H -10.778 13.006 0.604 1.00 . A B . 42 GLU HB3 1 1 5 3959 1 1 42 GLU HG2 H -11.117 12.203 -1.616 1.00 . A B . 42 GLU HG2 1 1 5 3960 1 1 42 GLU HG3 H -10.947 10.529 -1.087 1.00 . A B . 42 GLU HG3 1 1 5 3961 1 1 42 GLU N N -8.564 12.532 -0.959 1.00 . A B . 42 GLU N 1 1 5 3962 1 1 42 GLU O O -8.818 9.679 -0.721 1.00 . A B . 42 GLU O 1 1 5 3963 1 1 42 GLU OE1 O -13.488 12.452 -0.775 1.00 . A B . 42 GLU OE1 1 1 5 3964 1 1 42 GLU OE2 O -13.269 10.369 -0.133 1.00 . A B . 42 GLU OE2 1 1 5 3965 1 1 43 ARG C C -7.568 8.117 2.850 1.00 . A B . 43 ARG C 1 1 5 3966 1 1 43 ARG CA C -7.424 8.609 1.419 1.00 . A B . 43 ARG CA 1 1 5 3967 1 1 43 ARG CB C -5.953 8.522 1.005 1.00 . A B . 43 ARG CB 1 1 5 3968 1 1 43 ARG CD C -6.104 7.493 -1.302 1.00 . A B . 43 ARG CD 1 1 5 3969 1 1 43 ARG CG C -5.687 8.708 -0.483 1.00 . A B . 43 ARG CG 1 1 5 3970 1 1 43 ARG CZ C -8.179 6.320 -1.934 1.00 . A B . 43 ARG CZ 1 1 5 3971 1 1 43 ARG H H -7.739 10.603 2.045 1.00 . A B . 43 ARG H 1 1 5 3972 1 1 43 ARG HA H -8.017 7.985 0.767 1.00 . A B . 43 ARG HA 1 1 5 3973 1 1 43 ARG HB2 H -5.404 9.284 1.537 1.00 . A B . 43 ARG HB2 1 1 5 3974 1 1 43 ARG HB3 H -5.571 7.555 1.295 1.00 . A B . 43 ARG HB3 1 1 5 3975 1 1 43 ARG HD2 H -5.640 7.554 -2.276 1.00 . A B . 43 ARG HD2 1 1 5 3976 1 1 43 ARG HD3 H -5.758 6.601 -0.799 1.00 . A B . 43 ARG HD3 1 1 5 3977 1 1 43 ARG HE H -8.084 8.211 -1.265 1.00 . A B . 43 ARG HE 1 1 5 3978 1 1 43 ARG HG2 H -6.244 9.566 -0.829 1.00 . A B . 43 ARG HG2 1 1 5 3979 1 1 43 ARG HG3 H -4.631 8.884 -0.628 1.00 . A B . 43 ARG HG3 1 1 5 3980 1 1 43 ARG HH11 H -6.503 5.189 -2.063 1.00 . A B . 43 ARG HH11 1 1 5 3981 1 1 43 ARG HH12 H -7.965 4.403 -2.564 1.00 . A B . 43 ARG HH12 1 1 5 3982 1 1 43 ARG HH21 H -10.014 7.175 -1.918 1.00 . A B . 43 ARG HH21 1 1 5 3983 1 1 43 ARG HH22 H -9.969 5.528 -2.458 1.00 . A B . 43 ARG HH22 1 1 5 3984 1 1 43 ARG N N -7.908 9.978 1.307 1.00 . A B . 43 ARG N 1 1 5 3985 1 1 43 ARG NE N -7.552 7.403 -1.477 1.00 . A B . 43 ARG NE 1 1 5 3986 1 1 43 ARG NH1 N -7.493 5.214 -2.204 1.00 . A B . 43 ARG NH1 1 1 5 3987 1 1 43 ARG NH2 N -9.491 6.343 -2.119 1.00 . A B . 43 ARG NH2 1 1 5 3988 1 1 43 ARG O O -7.355 8.875 3.795 1.00 . A B . 43 ARG O 1 1 5 3989 1 1 44 THR C C -6.963 5.180 4.503 1.00 . A B . 44 THR C 1 1 5 3990 1 1 44 THR CA C -8.035 6.257 4.328 1.00 . A B . 44 THR CA 1 1 5 3991 1 1 44 THR CB C -9.429 5.640 4.553 1.00 . A B . 44 THR CB 1 1 5 3992 1 1 44 THR CG2 C -10.496 6.722 4.631 1.00 . A B . 44 THR CG2 1 1 5 3993 1 1 44 THR H H -8.156 6.318 2.219 1.00 . A B . 44 THR H 1 1 5 3994 1 1 44 THR HA H -7.881 7.035 5.061 1.00 . A B . 44 THR HA 1 1 5 3995 1 1 44 THR HB H -9.418 5.096 5.487 1.00 . A B . 44 THR HB 1 1 5 3996 1 1 44 THR HG1 H -9.019 4.099 3.389 1.00 . A B . 44 THR HG1 1 1 5 3997 1 1 44 THR HG21 H -11.464 6.264 4.768 1.00 . A B . 44 THR HG21 1 1 5 3998 1 1 44 THR HG22 H -10.495 7.292 3.713 1.00 . A B . 44 THR HG22 1 1 5 3999 1 1 44 THR HG23 H -10.286 7.378 5.462 1.00 . A B . 44 THR HG23 1 1 5 4000 1 1 44 THR N N -7.936 6.858 3.008 1.00 . A B . 44 THR N 1 1 5 4001 1 1 44 THR O O -7.131 4.054 4.040 1.00 . A B . 44 THR O 1 1 5 4002 1 1 44 THR OG1 O -9.742 4.736 3.487 1.00 . A B . 44 THR OG1 1 1 5 4003 1 1 45 PRO C C -5.063 3.420 6.279 1.00 . A B . 45 PRO C 1 1 5 4004 1 1 45 PRO CA C -4.721 4.581 5.342 1.00 . A B . 45 PRO CA 1 1 5 4005 1 1 45 PRO CB C -3.603 5.447 5.945 1.00 . A B . 45 PRO CB 1 1 5 4006 1 1 45 PRO CD C -5.563 6.821 5.772 1.00 . A B . 45 PRO CD 1 1 5 4007 1 1 45 PRO CG C -4.061 6.863 5.795 1.00 . A B . 45 PRO CG 1 1 5 4008 1 1 45 PRO HA H -4.393 4.180 4.395 1.00 . A B . 45 PRO HA 1 1 5 4009 1 1 45 PRO HB2 H -3.465 5.186 6.984 1.00 . A B . 45 PRO HB2 1 1 5 4010 1 1 45 PRO HB3 H -2.682 5.272 5.404 1.00 . A B . 45 PRO HB3 1 1 5 4011 1 1 45 PRO HD2 H -5.962 6.872 6.777 1.00 . A B . 45 PRO HD2 1 1 5 4012 1 1 45 PRO HD3 H -5.958 7.623 5.164 1.00 . A B . 45 PRO HD3 1 1 5 4013 1 1 45 PRO HG2 H -3.715 7.451 6.634 1.00 . A B . 45 PRO HG2 1 1 5 4014 1 1 45 PRO HG3 H -3.682 7.275 4.869 1.00 . A B . 45 PRO HG3 1 1 5 4015 1 1 45 PRO N N -5.841 5.514 5.162 1.00 . A B . 45 PRO N 1 1 5 4016 1 1 45 PRO O O -4.438 2.364 6.227 1.00 . A B . 45 PRO O 1 1 5 4017 1 1 46 TRP C C -7.622 1.739 7.490 1.00 . A B . 46 TRP C 1 1 5 4018 1 1 46 TRP CA C -6.482 2.579 8.069 1.00 . A B . 46 TRP CA 1 1 5 4019 1 1 46 TRP CB C -6.906 3.210 9.403 1.00 . A B . 46 TRP CB 1 1 5 4020 1 1 46 TRP CD1 C -9.332 4.025 9.236 1.00 . A B . 46 TRP CD1 1 1 5 4021 1 1 46 TRP CD2 C -7.809 5.662 9.115 1.00 . A B . 46 TRP CD2 1 1 5 4022 1 1 46 TRP CE2 C -9.091 6.229 9.007 1.00 . A B . 46 TRP CE2 1 1 5 4023 1 1 46 TRP CE3 C -6.694 6.506 9.066 1.00 . A B . 46 TRP CE3 1 1 5 4024 1 1 46 TRP CG C -7.985 4.245 9.257 1.00 . A B . 46 TRP CG 1 1 5 4025 1 1 46 TRP CH2 C -8.182 8.398 8.810 1.00 . A B . 46 TRP CH2 1 1 5 4026 1 1 46 TRP CZ2 C -9.289 7.597 8.854 1.00 . A B . 46 TRP CZ2 1 1 5 4027 1 1 46 TRP CZ3 C -6.894 7.865 8.915 1.00 . A B . 46 TRP CZ3 1 1 5 4028 1 1 46 TRP H H -6.544 4.471 7.111 1.00 . A B . 46 TRP H 1 1 5 4029 1 1 46 TRP HA H -5.633 1.932 8.238 1.00 . A B . 46 TRP HA 1 1 5 4030 1 1 46 TRP HB2 H -7.277 2.435 10.059 1.00 . A B . 46 TRP HB2 1 1 5 4031 1 1 46 TRP HB3 H -6.049 3.682 9.862 1.00 . A B . 46 TRP HB3 1 1 5 4032 1 1 46 TRP HD1 H -9.790 3.051 9.322 1.00 . A B . 46 TRP HD1 1 1 5 4033 1 1 46 TRP HE1 H -10.978 5.309 9.034 1.00 . A B . 46 TRP HE1 1 1 5 4034 1 1 46 TRP HE3 H -5.692 6.113 9.145 1.00 . A B . 46 TRP HE3 1 1 5 4035 1 1 46 TRP HH2 H -8.287 9.465 8.691 1.00 . A B . 46 TRP HH2 1 1 5 4036 1 1 46 TRP HZ2 H -10.278 8.024 8.774 1.00 . A B . 46 TRP HZ2 1 1 5 4037 1 1 46 TRP HZ3 H -6.047 8.534 8.875 1.00 . A B . 46 TRP HZ3 1 1 5 4038 1 1 46 TRP N N -6.068 3.614 7.123 1.00 . A B . 46 TRP N 1 1 5 4039 1 1 46 TRP NE1 N -10.001 5.209 9.081 1.00 . A B . 46 TRP NE1 1 1 5 4040 1 1 46 TRP O O -8.366 1.083 8.220 1.00 . A B . 46 TRP O 1 1 5 4041 1 1 47 ASN C C -8.238 0.431 4.213 1.00 . A B . 47 ASN C 1 1 5 4042 1 1 47 ASN CA C -8.806 1.040 5.487 1.00 . A B . 47 ASN CA 1 1 5 4043 1 1 47 ASN CB C -9.957 1.999 5.154 1.00 . A B . 47 ASN CB 1 1 5 4044 1 1 47 ASN CG C -11.217 1.293 4.680 1.00 . A B . 47 ASN CG 1 1 5 4045 1 1 47 ASN H H -7.081 2.243 5.641 1.00 . A B . 47 ASN H 1 1 5 4046 1 1 47 ASN HA H -9.164 0.254 6.135 1.00 . A B . 47 ASN HA 1 1 5 4047 1 1 47 ASN HB2 H -10.204 2.572 6.037 1.00 . A B . 47 ASN HB2 1 1 5 4048 1 1 47 ASN HB3 H -9.634 2.676 4.376 1.00 . A B . 47 ASN HB3 1 1 5 4049 1 1 47 ASN HD21 H -10.946 -0.185 5.983 1.00 . A B . 47 ASN HD21 1 1 5 4050 1 1 47 ASN HD22 H -12.360 -0.306 4.992 1.00 . A B . 47 ASN HD22 1 1 5 4051 1 1 47 ASN N N -7.743 1.755 6.175 1.00 . A B . 47 ASN N 1 1 5 4052 1 1 47 ASN ND2 N -11.535 0.151 5.274 1.00 . A B . 47 ASN ND2 1 1 5 4053 1 1 47 ASN O O -7.516 1.103 3.479 1.00 . A B . 47 ASN O 1 1 5 4054 1 1 47 ASN OD1 O -11.920 1.791 3.799 1.00 . A B . 47 ASN OD1 1 1 5 4055 1 1 48 CYS C C -8.801 -1.388 1.576 1.00 . A B . 48 CYS C 1 1 5 4056 1 1 48 CYS CA C -7.933 -1.516 2.823 1.00 . A B . 48 CYS CA 1 1 5 4057 1 1 48 CYS CB C -7.702 -2.997 3.161 1.00 . A B . 48 CYS CB 1 1 5 4058 1 1 48 CYS H H -9.202 -1.300 4.505 1.00 . A B . 48 CYS H 1 1 5 4059 1 1 48 CYS HA H -6.982 -1.044 2.634 1.00 . A B . 48 CYS HA 1 1 5 4060 1 1 48 CYS HB2 H -7.214 -3.070 4.121 1.00 . A B . 48 CYS HB2 1 1 5 4061 1 1 48 CYS HB3 H -8.657 -3.503 3.208 1.00 . A B . 48 CYS HB3 1 1 5 4062 1 1 48 CYS N N -8.545 -0.830 3.949 1.00 . A B . 48 CYS N 1 1 5 4063 1 1 48 CYS O O -9.964 -1.792 1.574 1.00 . A B . 48 CYS O 1 1 5 4064 1 1 48 CYS SG S -6.675 -3.874 1.958 1.00 . A B . 48 CYS SG 1 1 5 4065 1 1 49 ILE C C -8.891 -1.972 -1.579 1.00 . A B . 49 ILE C 1 1 5 4066 1 1 49 ILE CA C -8.939 -0.689 -0.750 1.00 . A B . 49 ILE CA 1 1 5 4067 1 1 49 ILE CB C -8.398 0.492 -1.600 1.00 . A B . 49 ILE CB 1 1 5 4068 1 1 49 ILE CD1 C -6.312 1.420 -2.747 1.00 . A B . 49 ILE CD1 1 1 5 4069 1 1 49 ILE CG1 C -6.876 0.404 -1.771 1.00 . A B . 49 ILE CG1 1 1 5 4070 1 1 49 ILE CG2 C -8.788 1.826 -0.975 1.00 . A B . 49 ILE CG2 1 1 5 4071 1 1 49 ILE H H -7.299 -0.514 0.582 1.00 . A B . 49 ILE H 1 1 5 4072 1 1 49 ILE HA H -9.970 -0.479 -0.509 1.00 . A B . 49 ILE HA 1 1 5 4073 1 1 49 ILE HB H -8.858 0.435 -2.575 1.00 . A B . 49 ILE HB 1 1 5 4074 1 1 49 ILE HD11 H -6.739 1.257 -3.724 1.00 . A B . 49 ILE HD11 1 1 5 4075 1 1 49 ILE HD12 H -5.237 1.313 -2.799 1.00 . A B . 49 ILE HD12 1 1 5 4076 1 1 49 ILE HD13 H -6.557 2.417 -2.410 1.00 . A B . 49 ILE HD13 1 1 5 4077 1 1 49 ILE HG12 H -6.407 0.576 -0.816 1.00 . A B . 49 ILE HG12 1 1 5 4078 1 1 49 ILE HG13 H -6.614 -0.581 -2.127 1.00 . A B . 49 ILE HG13 1 1 5 4079 1 1 49 ILE HG21 H -9.864 1.910 -0.942 1.00 . A B . 49 ILE HG21 1 1 5 4080 1 1 49 ILE HG22 H -8.384 2.633 -1.569 1.00 . A B . 49 ILE HG22 1 1 5 4081 1 1 49 ILE HG23 H -8.392 1.886 0.027 1.00 . A B . 49 ILE HG23 1 1 5 4082 1 1 49 ILE N N -8.223 -0.841 0.511 1.00 . A B . 49 ILE N 1 1 5 4083 1 1 49 ILE O O -9.800 -2.254 -2.353 1.00 . A B . 49 ILE O 1 1 5 4084 1 1 50 PHE C C -8.513 -5.119 -1.714 1.00 . A B . 50 PHE C 1 1 5 4085 1 1 50 PHE CA C -7.649 -3.963 -2.199 1.00 . A B . 50 PHE CA 1 1 5 4086 1 1 50 PHE CB C -6.177 -4.366 -2.299 1.00 . A B . 50 PHE CB 1 1 5 4087 1 1 50 PHE CD1 C -5.626 -4.759 -4.712 1.00 . A B . 50 PHE CD1 1 1 5 4088 1 1 50 PHE CD2 C -4.983 -2.681 -3.736 1.00 . A B . 50 PHE CD2 1 1 5 4089 1 1 50 PHE CE1 C -5.102 -4.356 -5.924 1.00 . A B . 50 PHE CE1 1 1 5 4090 1 1 50 PHE CE2 C -4.452 -2.276 -4.943 1.00 . A B . 50 PHE CE2 1 1 5 4091 1 1 50 PHE CG C -5.573 -3.928 -3.604 1.00 . A B . 50 PHE CG 1 1 5 4092 1 1 50 PHE CZ C -4.514 -3.113 -6.039 1.00 . A B . 50 PHE CZ 1 1 5 4093 1 1 50 PHE H H -7.212 -2.556 -0.673 1.00 . A B . 50 PHE H 1 1 5 4094 1 1 50 PHE HA H -7.987 -3.714 -3.196 1.00 . A B . 50 PHE HA 1 1 5 4095 1 1 50 PHE HB2 H -5.618 -3.908 -1.494 1.00 . A B . 50 PHE HB2 1 1 5 4096 1 1 50 PHE HB3 H -6.095 -5.441 -2.233 1.00 . A B . 50 PHE HB3 1 1 5 4097 1 1 50 PHE HD1 H -6.084 -5.733 -4.623 1.00 . A B . 50 PHE HD1 1 1 5 4098 1 1 50 PHE HD2 H -4.930 -2.025 -2.882 1.00 . A B . 50 PHE HD2 1 1 5 4099 1 1 50 PHE HE1 H -5.150 -5.013 -6.779 1.00 . A B . 50 PHE HE1 1 1 5 4100 1 1 50 PHE HE2 H -3.995 -1.302 -5.031 1.00 . A B . 50 PHE HE2 1 1 5 4101 1 1 50 PHE HZ H -4.104 -2.795 -6.986 1.00 . A B . 50 PHE HZ 1 1 5 4102 1 1 50 PHE N N -7.839 -2.758 -1.398 1.00 . A B . 50 PHE N 1 1 5 4103 1 1 50 PHE O O -8.883 -5.985 -2.499 1.00 . A B . 50 PHE O 1 1 5 4104 1 1 51 CYS C C -11.023 -6.279 -0.538 1.00 . A B . 51 CYS C 1 1 5 4105 1 1 51 CYS CA C -9.654 -6.209 0.141 1.00 . A B . 51 CYS CA 1 1 5 4106 1 1 51 CYS CB C -9.838 -6.018 1.645 1.00 . A B . 51 CYS CB 1 1 5 4107 1 1 51 CYS H H -8.496 -4.429 0.166 1.00 . A B . 51 CYS H 1 1 5 4108 1 1 51 CYS HA H -9.142 -7.146 -0.029 1.00 . A B . 51 CYS HA 1 1 5 4109 1 1 51 CYS HB2 H -9.691 -4.976 1.887 1.00 . A B . 51 CYS HB2 1 1 5 4110 1 1 51 CYS HB3 H -10.843 -6.306 1.917 1.00 . A B . 51 CYS HB3 1 1 5 4111 1 1 51 CYS N N -8.821 -5.145 -0.420 1.00 . A B . 51 CYS N 1 1 5 4112 1 1 51 CYS O O -11.637 -7.343 -0.600 1.00 . A B . 51 CYS O 1 1 5 4113 1 1 51 CYS SG S -8.692 -6.981 2.657 1.00 . A B . 51 CYS SG 1 1 5 4114 1 1 52 ARG C C -12.608 -5.389 -3.227 1.00 . A B . 52 ARG C 1 1 5 4115 1 1 52 ARG CA C -12.784 -5.123 -1.734 1.00 . A B . 52 ARG CA 1 1 5 4116 1 1 52 ARG CB C -13.486 -3.781 -1.506 1.00 . A B . 52 ARG CB 1 1 5 4117 1 1 52 ARG CD C -13.356 -1.277 -1.696 1.00 . A B . 52 ARG CD 1 1 5 4118 1 1 52 ARG CG C -12.812 -2.606 -2.194 1.00 . A B . 52 ARG CG 1 1 5 4119 1 1 52 ARG CZ C -12.655 0.042 0.272 1.00 . A B . 52 ARG CZ 1 1 5 4120 1 1 52 ARG H H -10.965 -4.333 -0.989 1.00 . A B . 52 ARG H 1 1 5 4121 1 1 52 ARG HA H -13.390 -5.910 -1.313 1.00 . A B . 52 ARG HA 1 1 5 4122 1 1 52 ARG HB2 H -14.499 -3.853 -1.874 1.00 . A B . 52 ARG HB2 1 1 5 4123 1 1 52 ARG HB3 H -13.513 -3.580 -0.445 1.00 . A B . 52 ARG HB3 1 1 5 4124 1 1 52 ARG HD2 H -12.881 -0.478 -2.246 1.00 . A B . 52 ARG HD2 1 1 5 4125 1 1 52 ARG HD3 H -14.422 -1.249 -1.868 1.00 . A B . 52 ARG HD3 1 1 5 4126 1 1 52 ARG HE H -13.271 -1.860 0.323 1.00 . A B . 52 ARG HE 1 1 5 4127 1 1 52 ARG HG2 H -11.752 -2.645 -1.994 1.00 . A B . 52 ARG HG2 1 1 5 4128 1 1 52 ARG HG3 H -12.982 -2.680 -3.258 1.00 . A B . 52 ARG HG3 1 1 5 4129 1 1 52 ARG HH11 H -12.584 1.063 -1.477 1.00 . A B . 52 ARG HH11 1 1 5 4130 1 1 52 ARG HH12 H -12.090 1.954 -0.073 1.00 . A B . 52 ARG HH12 1 1 5 4131 1 1 52 ARG HH21 H -12.634 -0.678 2.163 1.00 . A B . 52 ARG HH21 1 1 5 4132 1 1 52 ARG HH22 H -12.107 0.966 1.992 1.00 . A B . 52 ARG HH22 1 1 5 4133 1 1 52 ARG N N -11.495 -5.153 -1.058 1.00 . A B . 52 ARG N 1 1 5 4134 1 1 52 ARG NE N -13.099 -1.092 -0.268 1.00 . A B . 52 ARG NE 1 1 5 4135 1 1 52 ARG NH1 N -12.424 1.103 -0.488 1.00 . A B . 52 ARG NH1 1 1 5 4136 1 1 52 ARG NH2 N -12.451 0.116 1.579 1.00 . A B . 52 ARG NH2 1 1 5 4137 1 1 52 ARG O O -13.570 -5.375 -3.993 1.00 . A B . 52 ARG O 1 1 5 4138 1 1 53 MET C C -10.637 -7.379 -5.174 1.00 . A B . 53 MET C 1 1 5 4139 1 1 53 MET CA C -11.039 -5.919 -5.016 1.00 . A B . 53 MET CA 1 1 5 4140 1 1 53 MET CB C -9.892 -5.018 -5.481 1.00 . A B . 53 MET CB 1 1 5 4141 1 1 53 MET CE C -9.438 -0.870 -5.560 1.00 . A B . 53 MET CE 1 1 5 4142 1 1 53 MET CG C -10.192 -3.531 -5.381 1.00 . A B . 53 MET CG 1 1 5 4143 1 1 53 MET H H -10.648 -5.667 -2.960 1.00 . A B . 53 MET H 1 1 5 4144 1 1 53 MET HA H -11.915 -5.725 -5.618 1.00 . A B . 53 MET HA 1 1 5 4145 1 1 53 MET HB2 H -9.021 -5.227 -4.878 1.00 . A B . 53 MET HB2 1 1 5 4146 1 1 53 MET HB3 H -9.666 -5.248 -6.510 1.00 . A B . 53 MET HB3 1 1 5 4147 1 1 53 MET HE1 H -9.683 -0.779 -4.511 1.00 . A B . 53 MET HE1 1 1 5 4148 1 1 53 MET HE2 H -10.327 -0.711 -6.153 1.00 . A B . 53 MET HE2 1 1 5 4149 1 1 53 MET HE3 H -8.694 -0.133 -5.820 1.00 . A B . 53 MET HE3 1 1 5 4150 1 1 53 MET HG2 H -11.030 -3.304 -6.022 1.00 . A B . 53 MET HG2 1 1 5 4151 1 1 53 MET HG3 H -10.447 -3.294 -4.358 1.00 . A B . 53 MET HG3 1 1 5 4152 1 1 53 MET N N -11.371 -5.647 -3.625 1.00 . A B . 53 MET N 1 1 5 4153 1 1 53 MET O O -9.811 -7.721 -6.020 1.00 . A B . 53 MET O 1 1 5 4154 1 1 53 MET SD S -8.792 -2.510 -5.879 1.00 . A B . 53 MET SD 1 1 5 4155 1 1 54 LYS C C -11.285 -10.278 -5.673 1.00 . A B . 54 LYS C 1 1 5 4156 1 1 54 LYS CA C -10.910 -9.647 -4.336 1.00 . A B . 54 LYS CA 1 1 5 4157 1 1 54 LYS CB C -11.653 -10.351 -3.193 1.00 . A B . 54 LYS CB 1 1 5 4158 1 1 54 LYS CD C -12.143 -12.486 -1.957 1.00 . A B . 54 LYS CD 1 1 5 4159 1 1 54 LYS CE C -11.803 -13.960 -1.796 1.00 . A B . 54 LYS CE 1 1 5 4160 1 1 54 LYS CG C -11.340 -11.838 -3.073 1.00 . A B . 54 LYS CG 1 1 5 4161 1 1 54 LYS H H -11.884 -7.885 -3.707 1.00 . A B . 54 LYS H 1 1 5 4162 1 1 54 LYS HA H -9.845 -9.750 -4.185 1.00 . A B . 54 LYS HA 1 1 5 4163 1 1 54 LYS HB2 H -11.396 -9.873 -2.257 1.00 . A B . 54 LYS HB2 1 1 5 4164 1 1 54 LYS HB3 H -12.715 -10.245 -3.357 1.00 . A B . 54 LYS HB3 1 1 5 4165 1 1 54 LYS HD2 H -11.929 -11.975 -1.031 1.00 . A B . 54 LYS HD2 1 1 5 4166 1 1 54 LYS HD3 H -13.195 -12.392 -2.185 1.00 . A B . 54 LYS HD3 1 1 5 4167 1 1 54 LYS HE2 H -10.752 -14.050 -1.565 1.00 . A B . 54 LYS HE2 1 1 5 4168 1 1 54 LYS HE3 H -12.384 -14.360 -0.979 1.00 . A B . 54 LYS HE3 1 1 5 4169 1 1 54 LYS HG2 H -11.583 -12.321 -4.007 1.00 . A B . 54 LYS HG2 1 1 5 4170 1 1 54 LYS HG3 H -10.288 -11.962 -2.865 1.00 . A B . 54 LYS HG3 1 1 5 4171 1 1 54 LYS HZ1 H -11.992 -15.758 -2.840 1.00 . A B . 54 LYS HZ1 1 1 5 4172 1 1 54 LYS HZ2 H -11.433 -14.478 -3.790 1.00 . A B . 54 LYS HZ2 1 1 5 4173 1 1 54 LYS HZ3 H -13.066 -14.558 -3.353 1.00 . A B . 54 LYS HZ3 1 1 5 4174 1 1 54 LYS N N -11.222 -8.227 -4.338 1.00 . A B . 54 LYS N 1 1 5 4175 1 1 54 LYS NZ N -12.095 -14.742 -3.028 1.00 . A B . 54 LYS NZ 1 1 5 4176 1 1 54 LYS O O -12.417 -10.129 -6.145 1.00 . A B . 54 LYS O 1 1 5 4177 1 1 55 GLU C C -9.890 -12.995 -7.556 1.00 . A B . 55 GLU C 1 1 5 4178 1 1 55 GLU CA C -10.543 -11.618 -7.561 1.00 . A B . 55 GLU CA 1 1 5 4179 1 1 55 GLU CB C -9.982 -10.757 -8.694 1.00 . A B . 55 GLU CB 1 1 5 4180 1 1 55 GLU CD C -9.659 -10.456 -11.177 1.00 . A B . 55 GLU CD 1 1 5 4181 1 1 55 GLU CG C -10.175 -11.356 -10.076 1.00 . A B . 55 GLU CG 1 1 5 4182 1 1 55 GLU H H -9.447 -11.045 -5.850 1.00 . A B . 55 GLU H 1 1 5 4183 1 1 55 GLU HA H -11.607 -11.734 -7.701 1.00 . A B . 55 GLU HA 1 1 5 4184 1 1 55 GLU HB2 H -10.474 -9.797 -8.673 1.00 . A B . 55 GLU HB2 1 1 5 4185 1 1 55 GLU HB3 H -8.925 -10.614 -8.531 1.00 . A B . 55 GLU HB3 1 1 5 4186 1 1 55 GLU HG2 H -9.649 -12.298 -10.124 1.00 . A B . 55 GLU HG2 1 1 5 4187 1 1 55 GLU HG3 H -11.230 -11.527 -10.235 1.00 . A B . 55 GLU HG3 1 1 5 4188 1 1 55 GLU N N -10.329 -10.966 -6.281 1.00 . A B . 55 GLU N 1 1 5 4189 1 1 55 GLU O O -8.671 -13.122 -7.696 1.00 . A B . 55 GLU O 1 1 5 4190 1 1 55 GLU OE1 O -8.425 -10.381 -11.361 1.00 . A B . 55 GLU OE1 1 1 5 4191 1 1 55 GLU OE2 O -10.483 -9.822 -11.870 1.00 . A B . 55 GLU OE2 1 1 5 4192 1 1 56 SER C C -10.818 -16.227 -8.406 1.00 . A B . 56 SER C 1 1 5 4193 1 1 56 SER CA C -10.205 -15.376 -7.295 1.00 . A B . 56 SER CA 1 1 5 4194 1 1 56 SER CB C -10.525 -15.962 -5.918 1.00 . A B . 56 SER CB 1 1 5 4195 1 1 56 SER H H -11.665 -13.857 -7.295 1.00 . A B . 56 SER H 1 1 5 4196 1 1 56 SER HA H -9.133 -15.347 -7.427 1.00 . A B . 56 SER HA 1 1 5 4197 1 1 56 SER HB2 H -11.590 -16.115 -5.830 1.00 . A B . 56 SER HB2 1 1 5 4198 1 1 56 SER HB3 H -10.014 -16.906 -5.803 1.00 . A B . 56 SER HB3 1 1 5 4199 1 1 56 SER HG H -9.133 -15.045 -4.879 1.00 . A B . 56 SER HG 1 1 5 4200 1 1 56 SER N N -10.702 -14.018 -7.372 1.00 . A B . 56 SER N 1 1 5 4201 1 1 56 SER O O -11.763 -16.995 -8.128 1.00 . A B . 56 SER O 1 1 5 4202 1 1 56 SER OXT O -10.363 -16.106 -9.562 1.00 . A B . 56 SER OXT 1 1 5 4203 1 1 56 SER OG O -10.099 -15.085 -4.884 1.00 . A B . 56 SER OG 1 1 5 4204 2 2 1 ZN ZN ZN -6.569 -6.121 2.453 1.00 . B B . 101 ZN ZN 1 1 5 4205 3 2 1 ZN ZN ZN 6.002 0.935 -0.382 1.00 . C B . 102 ZN ZN 1 1 6 4206 1 1 1 GLY C C 13.301 -10.665 0.215 1.00 . A B . 1 GLY C 1 1 6 4207 1 1 1 GLY CA C 12.268 -9.571 0.069 1.00 . A B . 1 GLY CA 1 1 6 4208 1 1 1 GLY H1 H 11.046 -10.553 -1.301 1.00 . A B . 1 GLY H1 1 1 6 4209 1 1 1 GLY H2 H 10.254 -9.352 -0.414 1.00 . A B . 1 GLY H2 1 1 6 4210 1 1 1 GLY H3 H 10.629 -10.829 0.312 1.00 . A B . 1 GLY H3 1 1 6 4211 1 1 1 GLY HA2 H 12.614 -8.858 -0.664 1.00 . A B . 1 GLY HA2 1 1 6 4212 1 1 1 GLY HA3 H 12.146 -9.070 1.019 1.00 . A B . 1 GLY HA3 1 1 6 4213 1 1 1 GLY N N 10.958 -10.112 -0.363 1.00 . A B . 1 GLY N 1 1 6 4214 1 1 1 GLY O O 12.950 -11.846 0.272 1.00 . A B . 1 GLY O 1 1 6 4215 1 1 2 ALA C C 15.578 -11.909 1.798 1.00 . A B . 2 ALA C 1 1 6 4216 1 1 2 ALA CA C 15.652 -11.240 0.435 1.00 . A B . 2 ALA CA 1 1 6 4217 1 1 2 ALA CB C 16.996 -10.554 0.251 1.00 . A B . 2 ALA CB 1 1 6 4218 1 1 2 ALA H H 14.782 -9.325 0.221 1.00 . A B . 2 ALA H 1 1 6 4219 1 1 2 ALA HA H 15.547 -11.993 -0.330 1.00 . A B . 2 ALA HA 1 1 6 4220 1 1 2 ALA HB1 H 17.052 -10.124 -0.737 1.00 . A B . 2 ALA HB1 1 1 6 4221 1 1 2 ALA HB2 H 17.789 -11.277 0.376 1.00 . A B . 2 ALA HB2 1 1 6 4222 1 1 2 ALA HB3 H 17.106 -9.773 0.990 1.00 . A B . 2 ALA HB3 1 1 6 4223 1 1 2 ALA N N 14.569 -10.281 0.278 1.00 . A B . 2 ALA N 1 1 6 4224 1 1 2 ALA O O 15.837 -13.106 1.932 1.00 . A B . 2 ALA O 1 1 6 4225 1 1 3 MET C C 14.131 -10.733 4.949 1.00 . A B . 3 MET C 1 1 6 4226 1 1 3 MET CA C 15.073 -11.633 4.157 1.00 . A B . 3 MET CA 1 1 6 4227 1 1 3 MET CB C 16.442 -11.708 4.839 1.00 . A B . 3 MET CB 1 1 6 4228 1 1 3 MET CE C 15.898 -14.658 7.738 1.00 . A B . 3 MET CE 1 1 6 4229 1 1 3 MET CG C 16.414 -12.433 6.177 1.00 . A B . 3 MET CG 1 1 6 4230 1 1 3 MET H H 15.016 -10.183 2.623 1.00 . A B . 3 MET H 1 1 6 4231 1 1 3 MET HA H 14.650 -12.625 4.103 1.00 . A B . 3 MET HA 1 1 6 4232 1 1 3 MET HB2 H 17.128 -12.228 4.185 1.00 . A B . 3 MET HB2 1 1 6 4233 1 1 3 MET HB3 H 16.806 -10.705 5.002 1.00 . A B . 3 MET HB3 1 1 6 4234 1 1 3 MET HE1 H 15.253 -14.026 8.331 1.00 . A B . 3 MET HE1 1 1 6 4235 1 1 3 MET HE2 H 16.912 -14.582 8.101 1.00 . A B . 3 MET HE2 1 1 6 4236 1 1 3 MET HE3 H 15.564 -15.682 7.812 1.00 . A B . 3 MET HE3 1 1 6 4237 1 1 3 MET HG2 H 17.414 -12.443 6.586 1.00 . A B . 3 MET HG2 1 1 6 4238 1 1 3 MET HG3 H 15.757 -11.900 6.849 1.00 . A B . 3 MET HG3 1 1 6 4239 1 1 3 MET N N 15.209 -11.130 2.801 1.00 . A B . 3 MET N 1 1 6 4240 1 1 3 MET O O 14.570 -9.838 5.673 1.00 . A B . 3 MET O 1 1 6 4241 1 1 3 MET SD S 15.835 -14.133 6.027 1.00 . A B . 3 MET SD 1 1 6 4242 1 1 4 GLY C C 10.536 -10.116 4.717 1.00 . A B . 4 GLY C 1 1 6 4243 1 1 4 GLY CA C 11.848 -10.151 5.467 1.00 . A B . 4 GLY CA 1 1 6 4244 1 1 4 GLY H H 12.540 -11.680 4.188 1.00 . A B . 4 GLY H 1 1 6 4245 1 1 4 GLY HA2 H 11.682 -10.561 6.453 1.00 . A B . 4 GLY HA2 1 1 6 4246 1 1 4 GLY HA3 H 12.224 -9.144 5.565 1.00 . A B . 4 GLY HA3 1 1 6 4247 1 1 4 GLY N N 12.836 -10.956 4.784 1.00 . A B . 4 GLY N 1 1 6 4248 1 1 4 GLY O O 10.431 -10.664 3.619 1.00 . A B . 4 GLY O 1 1 6 4249 1 1 5 MET C C 7.787 -7.932 4.545 1.00 . A B . 5 MET C 1 1 6 4250 1 1 5 MET CA C 8.214 -9.388 4.691 1.00 . A B . 5 MET CA 1 1 6 4251 1 1 5 MET CB C 7.184 -10.165 5.520 1.00 . A B . 5 MET CB 1 1 6 4252 1 1 5 MET CE C 6.598 -11.921 8.178 1.00 . A B . 5 MET CE 1 1 6 4253 1 1 5 MET CG C 7.421 -11.670 5.539 1.00 . A B . 5 MET CG 1 1 6 4254 1 1 5 MET H H 9.686 -9.046 6.174 1.00 . A B . 5 MET H 1 1 6 4255 1 1 5 MET HA H 8.280 -9.828 3.708 1.00 . A B . 5 MET HA 1 1 6 4256 1 1 5 MET HB2 H 7.214 -9.803 6.538 1.00 . A B . 5 MET HB2 1 1 6 4257 1 1 5 MET HB3 H 6.199 -9.982 5.112 1.00 . A B . 5 MET HB3 1 1 6 4258 1 1 5 MET HE1 H 6.447 -10.852 8.191 1.00 . A B . 5 MET HE1 1 1 6 4259 1 1 5 MET HE2 H 7.625 -12.143 8.422 1.00 . A B . 5 MET HE2 1 1 6 4260 1 1 5 MET HE3 H 5.947 -12.383 8.906 1.00 . A B . 5 MET HE3 1 1 6 4261 1 1 5 MET HG2 H 7.364 -12.043 4.528 1.00 . A B . 5 MET HG2 1 1 6 4262 1 1 5 MET HG3 H 8.410 -11.860 5.933 1.00 . A B . 5 MET HG3 1 1 6 4263 1 1 5 MET N N 9.534 -9.474 5.304 1.00 . A B . 5 MET N 1 1 6 4264 1 1 5 MET O O 6.608 -7.595 4.682 1.00 . A B . 5 MET O 1 1 6 4265 1 1 5 MET SD S 6.218 -12.561 6.548 1.00 . A B . 5 MET SD 1 1 6 4266 1 1 6 ARG C C 9.360 -5.095 2.978 1.00 . A B . 6 ARG C 1 1 6 4267 1 1 6 ARG CA C 8.504 -5.650 4.113 1.00 . A B . 6 ARG CA 1 1 6 4268 1 1 6 ARG CB C 8.810 -4.920 5.426 1.00 . A B . 6 ARG CB 1 1 6 4269 1 1 6 ARG CD C 6.794 -3.397 5.443 1.00 . A B . 6 ARG CD 1 1 6 4270 1 1 6 ARG CG C 8.315 -3.482 5.484 1.00 . A B . 6 ARG CG 1 1 6 4271 1 1 6 ARG CZ C 5.055 -1.705 5.925 1.00 . A B . 6 ARG CZ 1 1 6 4272 1 1 6 ARG H H 9.675 -7.411 4.162 1.00 . A B . 6 ARG H 1 1 6 4273 1 1 6 ARG HA H 7.462 -5.518 3.866 1.00 . A B . 6 ARG HA 1 1 6 4274 1 1 6 ARG HB2 H 8.355 -5.465 6.240 1.00 . A B . 6 ARG HB2 1 1 6 4275 1 1 6 ARG HB3 H 9.881 -4.913 5.568 1.00 . A B . 6 ARG HB3 1 1 6 4276 1 1 6 ARG HD2 H 6.451 -3.743 4.479 1.00 . A B . 6 ARG HD2 1 1 6 4277 1 1 6 ARG HD3 H 6.389 -4.031 6.217 1.00 . A B . 6 ARG HD3 1 1 6 4278 1 1 6 ARG HE H 6.991 -1.307 5.606 1.00 . A B . 6 ARG HE 1 1 6 4279 1 1 6 ARG HG2 H 8.664 -3.029 6.400 1.00 . A B . 6 ARG HG2 1 1 6 4280 1 1 6 ARG HG3 H 8.718 -2.941 4.640 1.00 . A B . 6 ARG HG3 1 1 6 4281 1 1 6 ARG HH11 H 4.357 -3.608 5.846 1.00 . A B . 6 ARG HH11 1 1 6 4282 1 1 6 ARG HH12 H 3.177 -2.400 6.223 1.00 . A B . 6 ARG HH12 1 1 6 4283 1 1 6 ARG HH21 H 5.430 0.280 6.077 1.00 . A B . 6 ARG HH21 1 1 6 4284 1 1 6 ARG HH22 H 3.777 -0.182 6.334 1.00 . A B . 6 ARG HH22 1 1 6 4285 1 1 6 ARG N N 8.755 -7.074 4.268 1.00 . A B . 6 ARG N 1 1 6 4286 1 1 6 ARG NE N 6.321 -2.028 5.654 1.00 . A B . 6 ARG NE 1 1 6 4287 1 1 6 ARG NH1 N 4.121 -2.645 5.997 1.00 . A B . 6 ARG NH1 1 1 6 4288 1 1 6 ARG NH2 N 4.727 -0.435 6.127 1.00 . A B . 6 ARG NH2 1 1 6 4289 1 1 6 ARG O O 10.245 -4.260 3.191 1.00 . A B . 6 ARG O 1 1 6 4290 1 1 7 ASN C C 9.408 -3.780 0.141 1.00 . A B . 7 ASN C 1 1 6 4291 1 1 7 ASN CA C 9.864 -5.158 0.599 1.00 . A B . 7 ASN CA 1 1 6 4292 1 1 7 ASN CB C 9.713 -6.170 -0.541 1.00 . A B . 7 ASN CB 1 1 6 4293 1 1 7 ASN CG C 10.502 -5.804 -1.791 1.00 . A B . 7 ASN CG 1 1 6 4294 1 1 7 ASN H H 8.386 -6.241 1.668 1.00 . A B . 7 ASN H 1 1 6 4295 1 1 7 ASN HA H 10.904 -5.101 0.883 1.00 . A B . 7 ASN HA 1 1 6 4296 1 1 7 ASN HB2 H 10.057 -7.135 -0.201 1.00 . A B . 7 ASN HB2 1 1 6 4297 1 1 7 ASN HB3 H 8.669 -6.241 -0.810 1.00 . A B . 7 ASN HB3 1 1 6 4298 1 1 7 ASN HD21 H 11.973 -4.999 -0.710 1.00 . A B . 7 ASN HD21 1 1 6 4299 1 1 7 ASN HD22 H 12.188 -4.966 -2.427 1.00 . A B . 7 ASN HD22 1 1 6 4300 1 1 7 ASN N N 9.105 -5.582 1.773 1.00 . A B . 7 ASN N 1 1 6 4301 1 1 7 ASN ND2 N 11.668 -5.193 -1.625 1.00 . A B . 7 ASN ND2 1 1 6 4302 1 1 7 ASN O O 8.485 -3.647 -0.661 1.00 . A B . 7 ASN O 1 1 6 4303 1 1 7 ASN OD1 O 10.073 -6.093 -2.907 1.00 . A B . 7 ASN OD1 1 1 6 4304 1 1 8 LEU C C 11.004 -0.747 -0.329 1.00 . A B . 8 LEU C 1 1 6 4305 1 1 8 LEU CA C 9.776 -1.382 0.304 1.00 . A B . 8 LEU CA 1 1 6 4306 1 1 8 LEU CB C 9.311 -0.582 1.529 1.00 . A B . 8 LEU CB 1 1 6 4307 1 1 8 LEU CD1 C 11.487 -0.157 2.751 1.00 . A B . 8 LEU CD1 1 1 6 4308 1 1 8 LEU CD2 C 9.337 -0.253 4.013 1.00 . A B . 8 LEU CD2 1 1 6 4309 1 1 8 LEU CG C 10.109 -0.799 2.825 1.00 . A B . 8 LEU CG 1 1 6 4310 1 1 8 LEU H H 10.748 -2.943 1.349 1.00 . A B . 8 LEU H 1 1 6 4311 1 1 8 LEU HA H 8.984 -1.399 -0.426 1.00 . A B . 8 LEU HA 1 1 6 4312 1 1 8 LEU HB2 H 9.360 0.467 1.278 1.00 . A B . 8 LEU HB2 1 1 6 4313 1 1 8 LEU HB3 H 8.280 -0.837 1.726 1.00 . A B . 8 LEU HB3 1 1 6 4314 1 1 8 LEU HD11 H 12.034 -0.573 1.918 1.00 . A B . 8 LEU HD11 1 1 6 4315 1 1 8 LEU HD12 H 12.025 -0.352 3.667 1.00 . A B . 8 LEU HD12 1 1 6 4316 1 1 8 LEU HD13 H 11.381 0.908 2.616 1.00 . A B . 8 LEU HD13 1 1 6 4317 1 1 8 LEU HD21 H 9.190 0.810 3.890 1.00 . A B . 8 LEU HD21 1 1 6 4318 1 1 8 LEU HD22 H 9.895 -0.436 4.921 1.00 . A B . 8 LEU HD22 1 1 6 4319 1 1 8 LEU HD23 H 8.377 -0.744 4.074 1.00 . A B . 8 LEU HD23 1 1 6 4320 1 1 8 LEU HG H 10.247 -1.859 2.978 1.00 . A B . 8 LEU HG 1 1 6 4321 1 1 8 LEU N N 10.057 -2.761 0.675 1.00 . A B . 8 LEU N 1 1 6 4322 1 1 8 LEU O O 11.075 0.466 -0.515 1.00 . A B . 8 LEU O 1 1 6 4323 1 1 9 ASP C C 13.123 -0.527 -2.552 1.00 . A B . 9 ASP C 1 1 6 4324 1 1 9 ASP CA C 13.252 -1.169 -1.177 1.00 . A B . 9 ASP CA 1 1 6 4325 1 1 9 ASP CB C 14.193 -2.376 -1.249 1.00 . A B . 9 ASP CB 1 1 6 4326 1 1 9 ASP CG C 14.199 -3.185 0.033 1.00 . A B . 9 ASP CG 1 1 6 4327 1 1 9 ASP H H 11.771 -2.559 -0.606 1.00 . A B . 9 ASP H 1 1 6 4328 1 1 9 ASP HA H 13.655 -0.448 -0.485 1.00 . A B . 9 ASP HA 1 1 6 4329 1 1 9 ASP HB2 H 13.879 -3.020 -2.056 1.00 . A B . 9 ASP HB2 1 1 6 4330 1 1 9 ASP HB3 H 15.198 -2.029 -1.442 1.00 . A B . 9 ASP HB3 1 1 6 4331 1 1 9 ASP N N 11.952 -1.599 -0.681 1.00 . A B . 9 ASP N 1 1 6 4332 1 1 9 ASP O O 13.869 0.389 -2.900 1.00 . A B . 9 ASP O 1 1 6 4333 1 1 9 ASP OD1 O 13.234 -3.949 0.260 1.00 . A B . 9 ASP OD1 1 1 6 4334 1 1 9 ASP OD2 O 15.165 -3.072 0.816 1.00 . A B . 9 ASP OD2 1 1 6 4335 1 1 10 GLU C C 10.772 0.508 -4.617 1.00 . A B . 10 GLU C 1 1 6 4336 1 1 10 GLU CA C 11.918 -0.494 -4.662 1.00 . A B . 10 GLU CA 1 1 6 4337 1 1 10 GLU CB C 11.591 -1.628 -5.629 1.00 . A B . 10 GLU CB 1 1 6 4338 1 1 10 GLU CD C 12.334 -3.815 -6.638 1.00 . A B . 10 GLU CD 1 1 6 4339 1 1 10 GLU CG C 12.722 -2.629 -5.784 1.00 . A B . 10 GLU CG 1 1 6 4340 1 1 10 GLU H H 11.681 -1.812 -3.014 1.00 . A B . 10 GLU H 1 1 6 4341 1 1 10 GLU HA H 12.809 0.009 -4.999 1.00 . A B . 10 GLU HA 1 1 6 4342 1 1 10 GLU HB2 H 10.719 -2.154 -5.269 1.00 . A B . 10 GLU HB2 1 1 6 4343 1 1 10 GLU HB3 H 11.374 -1.208 -6.599 1.00 . A B . 10 GLU HB3 1 1 6 4344 1 1 10 GLU HG2 H 13.563 -2.133 -6.246 1.00 . A B . 10 GLU HG2 1 1 6 4345 1 1 10 GLU HG3 H 13.008 -2.984 -4.806 1.00 . A B . 10 GLU HG3 1 1 6 4346 1 1 10 GLU N N 12.184 -1.031 -3.333 1.00 . A B . 10 GLU N 1 1 6 4347 1 1 10 GLU O O 10.309 0.997 -5.651 1.00 . A B . 10 GLU O 1 1 6 4348 1 1 10 GLU OE1 O 11.650 -4.724 -6.125 1.00 . A B . 10 GLU OE1 1 1 6 4349 1 1 10 GLU OE2 O 12.707 -3.837 -7.828 1.00 . A B . 10 GLU OE2 1 1 6 4350 1 1 11 CYS C C 9.739 3.066 -2.710 1.00 . A B . 11 CYS C 1 1 6 4351 1 1 11 CYS CA C 9.218 1.719 -3.202 1.00 . A B . 11 CYS CA 1 1 6 4352 1 1 11 CYS CB C 8.266 1.097 -2.185 1.00 . A B . 11 CYS CB 1 1 6 4353 1 1 11 CYS H H 10.773 0.420 -2.633 1.00 . A B . 11 CYS H 1 1 6 4354 1 1 11 CYS HA H 8.705 1.854 -4.142 1.00 . A B . 11 CYS HA 1 1 6 4355 1 1 11 CYS HB2 H 8.011 0.104 -2.514 1.00 . A B . 11 CYS HB2 1 1 6 4356 1 1 11 CYS HB3 H 8.777 1.030 -1.236 1.00 . A B . 11 CYS HB3 1 1 6 4357 1 1 11 CYS N N 10.325 0.808 -3.412 1.00 . A B . 11 CYS N 1 1 6 4358 1 1 11 CYS O O 9.900 3.282 -1.506 1.00 . A B . 11 CYS O 1 1 6 4359 1 1 11 CYS SG S 6.720 1.985 -1.908 1.00 . A B . 11 CYS SG 1 1 6 4360 1 1 12 GLU C C 9.513 6.103 -2.512 1.00 . A B . 12 GLU C 1 1 6 4361 1 1 12 GLU CA C 10.517 5.293 -3.316 1.00 . A B . 12 GLU CA 1 1 6 4362 1 1 12 GLU CB C 10.897 6.050 -4.586 1.00 . A B . 12 GLU CB 1 1 6 4363 1 1 12 GLU CD C 13.390 5.671 -4.443 1.00 . A B . 12 GLU CD 1 1 6 4364 1 1 12 GLU CG C 12.138 5.510 -5.280 1.00 . A B . 12 GLU CG 1 1 6 4365 1 1 12 GLU H H 9.814 3.749 -4.583 1.00 . A B . 12 GLU H 1 1 6 4366 1 1 12 GLU HA H 11.402 5.151 -2.718 1.00 . A B . 12 GLU HA 1 1 6 4367 1 1 12 GLU HB2 H 10.071 6.000 -5.280 1.00 . A B . 12 GLU HB2 1 1 6 4368 1 1 12 GLU HB3 H 11.078 7.082 -4.330 1.00 . A B . 12 GLU HB3 1 1 6 4369 1 1 12 GLU HG2 H 11.997 4.460 -5.484 1.00 . A B . 12 GLU HG2 1 1 6 4370 1 1 12 GLU HG3 H 12.275 6.039 -6.210 1.00 . A B . 12 GLU HG3 1 1 6 4371 1 1 12 GLU N N 9.988 3.973 -3.643 1.00 . A B . 12 GLU N 1 1 6 4372 1 1 12 GLU O O 9.885 7.007 -1.765 1.00 . A B . 12 GLU O 1 1 6 4373 1 1 12 GLU OE1 O 13.849 6.819 -4.265 1.00 . A B . 12 GLU OE1 1 1 6 4374 1 1 12 GLU OE2 O 13.926 4.654 -3.962 1.00 . A B . 12 GLU OE2 1 1 6 4375 1 1 13 VAL C C 7.264 6.088 -0.430 1.00 . A B . 13 VAL C 1 1 6 4376 1 1 13 VAL CA C 7.211 6.474 -1.913 1.00 . A B . 13 VAL CA 1 1 6 4377 1 1 13 VAL CB C 5.807 6.246 -2.525 1.00 . A B . 13 VAL CB 1 1 6 4378 1 1 13 VAL CG1 C 5.496 4.775 -2.679 1.00 . A B . 13 VAL CG1 1 1 6 4379 1 1 13 VAL CG2 C 4.733 6.927 -1.698 1.00 . A B . 13 VAL CG2 1 1 6 4380 1 1 13 VAL H H 7.991 5.065 -3.277 1.00 . A B . 13 VAL H 1 1 6 4381 1 1 13 VAL HA H 7.432 7.530 -1.985 1.00 . A B . 13 VAL HA 1 1 6 4382 1 1 13 VAL HB H 5.801 6.687 -3.510 1.00 . A B . 13 VAL HB 1 1 6 4383 1 1 13 VAL HG11 H 4.546 4.662 -3.174 1.00 . A B . 13 VAL HG11 1 1 6 4384 1 1 13 VAL HG12 H 5.452 4.313 -1.704 1.00 . A B . 13 VAL HG12 1 1 6 4385 1 1 13 VAL HG13 H 6.266 4.303 -3.269 1.00 . A B . 13 VAL HG13 1 1 6 4386 1 1 13 VAL HG21 H 4.981 7.971 -1.575 1.00 . A B . 13 VAL HG21 1 1 6 4387 1 1 13 VAL HG22 H 4.675 6.451 -0.731 1.00 . A B . 13 VAL HG22 1 1 6 4388 1 1 13 VAL HG23 H 3.782 6.837 -2.202 1.00 . A B . 13 VAL HG23 1 1 6 4389 1 1 13 VAL N N 8.241 5.780 -2.657 1.00 . A B . 13 VAL N 1 1 6 4390 1 1 13 VAL O O 6.979 6.907 0.437 1.00 . A B . 13 VAL O 1 1 6 4391 1 1 14 CYS C C 9.140 5.166 1.807 1.00 . A B . 14 CYS C 1 1 6 4392 1 1 14 CYS CA C 7.924 4.445 1.247 1.00 . A B . 14 CYS CA 1 1 6 4393 1 1 14 CYS CB C 8.139 2.940 1.350 1.00 . A B . 14 CYS CB 1 1 6 4394 1 1 14 CYS H H 7.816 4.208 -0.864 1.00 . A B . 14 CYS H 1 1 6 4395 1 1 14 CYS HA H 7.059 4.717 1.829 1.00 . A B . 14 CYS HA 1 1 6 4396 1 1 14 CYS HB2 H 8.466 2.568 0.392 1.00 . A B . 14 CYS HB2 1 1 6 4397 1 1 14 CYS HB3 H 8.903 2.745 2.087 1.00 . A B . 14 CYS HB3 1 1 6 4398 1 1 14 CYS N N 7.678 4.854 -0.138 1.00 . A B . 14 CYS N 1 1 6 4399 1 1 14 CYS O O 9.231 5.423 3.004 1.00 . A B . 14 CYS O 1 1 6 4400 1 1 14 CYS SG S 6.662 2.018 1.825 1.00 . A B . 14 CYS SG 1 1 6 4401 1 1 15 ARG C C 10.869 7.627 1.760 1.00 . A B . 15 ARG C 1 1 6 4402 1 1 15 ARG CA C 11.262 6.231 1.289 1.00 . A B . 15 ARG CA 1 1 6 4403 1 1 15 ARG CB C 12.193 6.300 0.079 1.00 . A B . 15 ARG CB 1 1 6 4404 1 1 15 ARG CD C 14.352 6.992 -0.951 1.00 . A B . 15 ARG CD 1 1 6 4405 1 1 15 ARG CG C 13.545 6.937 0.337 1.00 . A B . 15 ARG CG 1 1 6 4406 1 1 15 ARG CZ C 16.577 7.685 -1.743 1.00 . A B . 15 ARG CZ 1 1 6 4407 1 1 15 ARG H H 9.943 5.206 -0.010 1.00 . A B . 15 ARG H 1 1 6 4408 1 1 15 ARG HA H 11.753 5.711 2.092 1.00 . A B . 15 ARG HA 1 1 6 4409 1 1 15 ARG HB2 H 12.363 5.297 -0.278 1.00 . A B . 15 ARG HB2 1 1 6 4410 1 1 15 ARG HB3 H 11.698 6.865 -0.699 1.00 . A B . 15 ARG HB3 1 1 6 4411 1 1 15 ARG HD2 H 14.428 5.993 -1.351 1.00 . A B . 15 ARG HD2 1 1 6 4412 1 1 15 ARG HD3 H 13.828 7.619 -1.656 1.00 . A B . 15 ARG HD3 1 1 6 4413 1 1 15 ARG HE H 15.963 7.759 0.162 1.00 . A B . 15 ARG HE 1 1 6 4414 1 1 15 ARG HG2 H 13.399 7.939 0.708 1.00 . A B . 15 ARG HG2 1 1 6 4415 1 1 15 ARG HG3 H 14.083 6.350 1.065 1.00 . A B . 15 ARG HG3 1 1 6 4416 1 1 15 ARG HH11 H 15.318 7.035 -3.207 1.00 . A B . 15 ARG HH11 1 1 6 4417 1 1 15 ARG HH12 H 16.905 7.506 -3.738 1.00 . A B . 15 ARG HH12 1 1 6 4418 1 1 15 ARG HH21 H 18.043 8.382 -0.534 1.00 . A B . 15 ARG HH21 1 1 6 4419 1 1 15 ARG HH22 H 18.461 8.266 -2.213 1.00 . A B . 15 ARG HH22 1 1 6 4420 1 1 15 ARG N N 10.068 5.485 0.921 1.00 . A B . 15 ARG N 1 1 6 4421 1 1 15 ARG NE N 15.697 7.523 -0.756 1.00 . A B . 15 ARG NE 1 1 6 4422 1 1 15 ARG NH1 N 16.242 7.387 -2.996 1.00 . A B . 15 ARG NH1 1 1 6 4423 1 1 15 ARG NH2 N 17.791 8.150 -1.477 1.00 . A B . 15 ARG NH2 1 1 6 4424 1 1 15 ARG O O 11.453 8.178 2.693 1.00 . A B . 15 ARG O 1 1 6 4425 1 1 16 ASP C C 8.375 9.310 2.732 1.00 . A B . 16 ASP C 1 1 6 4426 1 1 16 ASP CA C 9.271 9.460 1.499 1.00 . A B . 16 ASP CA 1 1 6 4427 1 1 16 ASP CB C 8.476 10.043 0.323 1.00 . A B . 16 ASP CB 1 1 6 4428 1 1 16 ASP CG C 7.773 11.346 0.662 1.00 . A B . 16 ASP CG 1 1 6 4429 1 1 16 ASP H H 9.529 7.734 0.294 1.00 . A B . 16 ASP H 1 1 6 4430 1 1 16 ASP HA H 10.082 10.129 1.741 1.00 . A B . 16 ASP HA 1 1 6 4431 1 1 16 ASP HB2 H 9.151 10.229 -0.498 1.00 . A B . 16 ASP HB2 1 1 6 4432 1 1 16 ASP HB3 H 7.733 9.322 0.011 1.00 . A B . 16 ASP HB3 1 1 6 4433 1 1 16 ASP N N 9.855 8.178 1.105 1.00 . A B . 16 ASP N 1 1 6 4434 1 1 16 ASP O O 7.962 10.295 3.342 1.00 . A B . 16 ASP O 1 1 6 4435 1 1 16 ASP OD1 O 8.460 12.385 0.805 1.00 . A B . 16 ASP OD1 1 1 6 4436 1 1 16 ASP OD2 O 6.530 11.340 0.782 1.00 . A B . 16 ASP OD2 1 1 6 4437 1 1 17 GLY C C 5.770 7.815 3.855 1.00 . A B . 17 GLY C 1 1 6 4438 1 1 17 GLY CA C 7.233 7.820 4.251 1.00 . A B . 17 GLY CA 1 1 6 4439 1 1 17 GLY H H 8.520 7.321 2.643 1.00 . A B . 17 GLY H 1 1 6 4440 1 1 17 GLY HA2 H 7.486 6.860 4.681 1.00 . A B . 17 GLY HA2 1 1 6 4441 1 1 17 GLY HA3 H 7.391 8.590 4.992 1.00 . A B . 17 GLY HA3 1 1 6 4442 1 1 17 GLY N N 8.105 8.072 3.116 1.00 . A B . 17 GLY N 1 1 6 4443 1 1 17 GLY O O 4.895 8.134 4.664 1.00 . A B . 17 GLY O 1 1 6 4444 1 1 18 GLY C C 3.265 6.449 2.837 1.00 . A B . 18 GLY C 1 1 6 4445 1 1 18 GLY CA C 4.161 7.409 2.087 1.00 . A B . 18 GLY CA 1 1 6 4446 1 1 18 GLY H H 6.263 7.232 2.011 1.00 . A B . 18 GLY H 1 1 6 4447 1 1 18 GLY HA2 H 3.733 8.397 2.146 1.00 . A B . 18 GLY HA2 1 1 6 4448 1 1 18 GLY HA3 H 4.197 7.109 1.052 1.00 . A B . 18 GLY HA3 1 1 6 4449 1 1 18 GLY N N 5.513 7.456 2.603 1.00 . A B . 18 GLY N 1 1 6 4450 1 1 18 GLY O O 3.732 5.480 3.437 1.00 . A B . 18 GLY O 1 1 6 4451 1 1 19 GLU C C 0.458 4.781 2.722 1.00 . A B . 19 GLU C 1 1 6 4452 1 1 19 GLU CA C 0.993 5.958 3.530 1.00 . A B . 19 GLU CA 1 1 6 4453 1 1 19 GLU CB C -0.155 6.881 3.941 1.00 . A B . 19 GLU CB 1 1 6 4454 1 1 19 GLU CD C -0.887 8.864 5.323 1.00 . A B . 19 GLU CD 1 1 6 4455 1 1 19 GLU CG C 0.273 8.006 4.875 1.00 . A B . 19 GLU CG 1 1 6 4456 1 1 19 GLU H H 1.666 7.431 2.184 1.00 . A B . 19 GLU H 1 1 6 4457 1 1 19 GLU HA H 1.474 5.580 4.418 1.00 . A B . 19 GLU HA 1 1 6 4458 1 1 19 GLU HB2 H -0.571 7.326 3.049 1.00 . A B . 19 GLU HB2 1 1 6 4459 1 1 19 GLU HB3 H -0.920 6.297 4.432 1.00 . A B . 19 GLU HB3 1 1 6 4460 1 1 19 GLU HG2 H 0.741 7.579 5.750 1.00 . A B . 19 GLU HG2 1 1 6 4461 1 1 19 GLU HG3 H 0.985 8.636 4.361 1.00 . A B . 19 GLU HG3 1 1 6 4462 1 1 19 GLU N N 1.974 6.711 2.774 1.00 . A B . 19 GLU N 1 1 6 4463 1 1 19 GLU O O 0.451 4.807 1.489 1.00 . A B . 19 GLU O 1 1 6 4464 1 1 19 GLU OE1 O -1.223 9.836 4.615 1.00 . A B . 19 GLU OE1 1 1 6 4465 1 1 19 GLU OE2 O -1.466 8.572 6.392 1.00 . A B . 19 GLU OE2 1 1 6 4466 1 1 20 LEU C C -2.062 2.570 2.956 1.00 . A B . 20 LEU C 1 1 6 4467 1 1 20 LEU CA C -0.547 2.566 2.817 1.00 . A B . 20 LEU CA 1 1 6 4468 1 1 20 LEU CB C 0.024 1.307 3.471 1.00 . A B . 20 LEU CB 1 1 6 4469 1 1 20 LEU CD1 C 2.020 -0.128 3.931 1.00 . A B . 20 LEU CD1 1 1 6 4470 1 1 20 LEU CD2 C 1.300 0.266 1.581 1.00 . A B . 20 LEU CD2 1 1 6 4471 1 1 20 LEU CG C 1.404 0.876 2.973 1.00 . A B . 20 LEU CG 1 1 6 4472 1 1 20 LEU H H 0.075 3.800 4.412 1.00 . A B . 20 LEU H 1 1 6 4473 1 1 20 LEU HA H -0.285 2.571 1.772 1.00 . A B . 20 LEU HA 1 1 6 4474 1 1 20 LEU HB2 H 0.090 1.481 4.535 1.00 . A B . 20 LEU HB2 1 1 6 4475 1 1 20 LEU HB3 H -0.666 0.496 3.300 1.00 . A B . 20 LEU HB3 1 1 6 4476 1 1 20 LEU HD11 H 1.359 -0.974 4.035 1.00 . A B . 20 LEU HD11 1 1 6 4477 1 1 20 LEU HD12 H 2.169 0.335 4.895 1.00 . A B . 20 LEU HD12 1 1 6 4478 1 1 20 LEU HD13 H 2.970 -0.461 3.539 1.00 . A B . 20 LEU HD13 1 1 6 4479 1 1 20 LEU HD21 H 2.273 -0.084 1.268 1.00 . A B . 20 LEU HD21 1 1 6 4480 1 1 20 LEU HD22 H 0.946 1.011 0.883 1.00 . A B . 20 LEU HD22 1 1 6 4481 1 1 20 LEU HD23 H 0.610 -0.564 1.601 1.00 . A B . 20 LEU HD23 1 1 6 4482 1 1 20 LEU HG H 2.054 1.739 2.921 1.00 . A B . 20 LEU HG 1 1 6 4483 1 1 20 LEU N N 0.023 3.754 3.433 1.00 . A B . 20 LEU N 1 1 6 4484 1 1 20 LEU O O -2.595 2.890 4.020 1.00 . A B . 20 LEU O 1 1 6 4485 1 1 21 PHE C C -4.675 0.722 1.785 1.00 . A B . 21 PHE C 1 1 6 4486 1 1 21 PHE CA C -4.209 2.167 1.895 1.00 . A B . 21 PHE CA 1 1 6 4487 1 1 21 PHE CB C -4.761 3.017 0.746 1.00 . A B . 21 PHE CB 1 1 6 4488 1 1 21 PHE CD1 C -4.593 5.374 1.599 1.00 . A B . 21 PHE CD1 1 1 6 4489 1 1 21 PHE CD2 C -3.177 4.716 -0.204 1.00 . A B . 21 PHE CD2 1 1 6 4490 1 1 21 PHE CE1 C -4.067 6.649 1.551 1.00 . A B . 21 PHE CE1 1 1 6 4491 1 1 21 PHE CE2 C -2.644 5.987 -0.250 1.00 . A B . 21 PHE CE2 1 1 6 4492 1 1 21 PHE CG C -4.155 4.392 0.723 1.00 . A B . 21 PHE CG 1 1 6 4493 1 1 21 PHE CZ C -2.983 6.908 0.735 1.00 . A B . 21 PHE CZ 1 1 6 4494 1 1 21 PHE H H -2.274 1.980 1.056 1.00 . A B . 21 PHE H 1 1 6 4495 1 1 21 PHE HA H -4.547 2.574 2.840 1.00 . A B . 21 PHE HA 1 1 6 4496 1 1 21 PHE HB2 H -4.539 2.531 -0.195 1.00 . A B . 21 PHE HB2 1 1 6 4497 1 1 21 PHE HB3 H -5.833 3.119 0.854 1.00 . A B . 21 PHE HB3 1 1 6 4498 1 1 21 PHE HD1 H -5.351 5.137 2.331 1.00 . A B . 21 PHE HD1 1 1 6 4499 1 1 21 PHE HD2 H -2.823 3.963 -0.894 1.00 . A B . 21 PHE HD2 1 1 6 4500 1 1 21 PHE HE1 H -4.418 7.404 2.237 1.00 . A B . 21 PHE HE1 1 1 6 4501 1 1 21 PHE HE2 H -1.881 6.226 -0.974 1.00 . A B . 21 PHE HE2 1 1 6 4502 1 1 21 PHE HZ H -2.525 7.886 0.742 1.00 . A B . 21 PHE HZ 1 1 6 4503 1 1 21 PHE N N -2.753 2.214 1.886 1.00 . A B . 21 PHE N 1 1 6 4504 1 1 21 PHE O O -5.700 0.411 1.177 1.00 . A B . 21 PHE O 1 1 6 4505 1 1 22 CYS C C -3.921 -2.200 3.712 1.00 . A B . 22 CYS C 1 1 6 4506 1 1 22 CYS CA C -4.162 -1.581 2.350 1.00 . A B . 22 CYS CA 1 1 6 4507 1 1 22 CYS CB C -3.267 -2.268 1.320 1.00 . A B . 22 CYS CB 1 1 6 4508 1 1 22 CYS H H -3.106 0.164 2.870 1.00 . A B . 22 CYS H 1 1 6 4509 1 1 22 CYS HA H -5.195 -1.722 2.075 1.00 . A B . 22 CYS HA 1 1 6 4510 1 1 22 CYS HB2 H -2.268 -1.858 1.395 1.00 . A B . 22 CYS HB2 1 1 6 4511 1 1 22 CYS HB3 H -3.230 -3.327 1.533 1.00 . A B . 22 CYS HB3 1 1 6 4512 1 1 22 CYS N N -3.893 -0.158 2.384 1.00 . A B . 22 CYS N 1 1 6 4513 1 1 22 CYS O O -3.321 -1.577 4.593 1.00 . A B . 22 CYS O 1 1 6 4514 1 1 22 CYS SG S -3.801 -2.071 -0.404 1.00 . A B . 22 CYS SG 1 1 6 4515 1 1 23 CYS C C -2.782 -4.906 4.865 1.00 . A B . 23 CYS C 1 1 6 4516 1 1 23 CYS CA C -4.115 -4.190 5.070 1.00 . A B . 23 CYS CA 1 1 6 4517 1 1 23 CYS CB C -5.242 -5.197 5.334 1.00 . A B . 23 CYS CB 1 1 6 4518 1 1 23 CYS H H -4.958 -3.812 3.180 1.00 . A B . 23 CYS H 1 1 6 4519 1 1 23 CYS HA H -4.029 -3.508 5.906 1.00 . A B . 23 CYS HA 1 1 6 4520 1 1 23 CYS HB2 H -5.152 -5.570 6.345 1.00 . A B . 23 CYS HB2 1 1 6 4521 1 1 23 CYS HB3 H -6.194 -4.695 5.224 1.00 . A B . 23 CYS HB3 1 1 6 4522 1 1 23 CYS N N -4.402 -3.420 3.881 1.00 . A B . 23 CYS N 1 1 6 4523 1 1 23 CYS O O -2.321 -4.995 3.723 1.00 . A B . 23 CYS O 1 1 6 4524 1 1 23 CYS SG S -5.242 -6.624 4.226 1.00 . A B . 23 CYS SG 1 1 6 4525 1 1 24 ASP C C -0.701 -7.055 4.780 1.00 . A B . 24 ASP C 1 1 6 4526 1 1 24 ASP CA C -0.820 -5.969 5.847 1.00 . A B . 24 ASP CA 1 1 6 4527 1 1 24 ASP CB C -0.355 -6.514 7.199 1.00 . A B . 24 ASP CB 1 1 6 4528 1 1 24 ASP CG C -0.023 -5.411 8.182 1.00 . A B . 24 ASP CG 1 1 6 4529 1 1 24 ASP H H -2.666 -5.458 6.782 1.00 . A B . 24 ASP H 1 1 6 4530 1 1 24 ASP HA H -0.168 -5.156 5.566 1.00 . A B . 24 ASP HA 1 1 6 4531 1 1 24 ASP HB2 H -1.136 -7.126 7.622 1.00 . A B . 24 ASP HB2 1 1 6 4532 1 1 24 ASP HB3 H 0.529 -7.118 7.050 1.00 . A B . 24 ASP HB3 1 1 6 4533 1 1 24 ASP N N -2.181 -5.423 5.929 1.00 . A B . 24 ASP N 1 1 6 4534 1 1 24 ASP O O 0.286 -7.102 4.039 1.00 . A B . 24 ASP O 1 1 6 4535 1 1 24 ASP OD1 O -0.932 -4.971 8.921 1.00 . A B . 24 ASP OD1 1 1 6 4536 1 1 24 ASP OD2 O 1.149 -4.976 8.223 1.00 . A B . 24 ASP OD2 1 1 6 4537 1 1 25 THR C C -1.632 -8.447 2.277 1.00 . A B . 25 THR C 1 1 6 4538 1 1 25 THR CA C -1.711 -8.983 3.708 1.00 . A B . 25 THR CA 1 1 6 4539 1 1 25 THR CB C -2.961 -9.865 3.859 1.00 . A B . 25 THR CB 1 1 6 4540 1 1 25 THR CG2 C -2.909 -11.055 2.915 1.00 . A B . 25 THR CG2 1 1 6 4541 1 1 25 THR H H -2.489 -7.794 5.277 1.00 . A B . 25 THR H 1 1 6 4542 1 1 25 THR HA H -0.842 -9.593 3.897 1.00 . A B . 25 THR HA 1 1 6 4543 1 1 25 THR HB H -3.831 -9.272 3.622 1.00 . A B . 25 THR HB 1 1 6 4544 1 1 25 THR HG1 H -2.398 -9.893 5.753 1.00 . A B . 25 THR HG1 1 1 6 4545 1 1 25 THR HG21 H -2.826 -10.703 1.897 1.00 . A B . 25 THR HG21 1 1 6 4546 1 1 25 THR HG22 H -3.813 -11.638 3.022 1.00 . A B . 25 THR HG22 1 1 6 4547 1 1 25 THR HG23 H -2.054 -11.669 3.154 1.00 . A B . 25 THR HG23 1 1 6 4548 1 1 25 THR N N -1.717 -7.900 4.679 1.00 . A B . 25 THR N 1 1 6 4549 1 1 25 THR O O -0.783 -8.873 1.494 1.00 . A B . 25 THR O 1 1 6 4550 1 1 25 THR OG1 O -3.064 -10.331 5.210 1.00 . A B . 25 THR OG1 1 1 6 4551 1 1 26 CYS C C -1.327 -6.040 0.329 1.00 . A B . 26 CYS C 1 1 6 4552 1 1 26 CYS CA C -2.524 -6.952 0.589 1.00 . A B . 26 CYS CA 1 1 6 4553 1 1 26 CYS CB C -3.823 -6.188 0.326 1.00 . A B . 26 CYS CB 1 1 6 4554 1 1 26 CYS H H -3.101 -7.133 2.625 1.00 . A B . 26 CYS H 1 1 6 4555 1 1 26 CYS HA H -2.471 -7.790 -0.091 1.00 . A B . 26 CYS HA 1 1 6 4556 1 1 26 CYS HB2 H -3.873 -5.349 0.997 1.00 . A B . 26 CYS HB2 1 1 6 4557 1 1 26 CYS HB3 H -3.820 -5.824 -0.690 1.00 . A B . 26 CYS HB3 1 1 6 4558 1 1 26 CYS N N -2.491 -7.489 1.945 1.00 . A B . 26 CYS N 1 1 6 4559 1 1 26 CYS O O -0.835 -5.968 -0.796 1.00 . A B . 26 CYS O 1 1 6 4560 1 1 26 CYS SG S -5.329 -7.155 0.563 1.00 . A B . 26 CYS SG 1 1 6 4561 1 1 27 SER C C 1.564 -5.202 0.885 1.00 . A B . 27 SER C 1 1 6 4562 1 1 27 SER CA C 0.282 -4.445 1.220 1.00 . A B . 27 SER CA 1 1 6 4563 1 1 27 SER CB C 0.477 -3.599 2.485 1.00 . A B . 27 SER CB 1 1 6 4564 1 1 27 SER H H -1.267 -5.459 2.254 1.00 . A B . 27 SER H 1 1 6 4565 1 1 27 SER HA H 0.053 -3.786 0.395 1.00 . A B . 27 SER HA 1 1 6 4566 1 1 27 SER HB2 H 1.390 -3.030 2.393 1.00 . A B . 27 SER HB2 1 1 6 4567 1 1 27 SER HB3 H -0.357 -2.922 2.593 1.00 . A B . 27 SER HB3 1 1 6 4568 1 1 27 SER HG H 0.994 -5.235 3.443 1.00 . A B . 27 SER HG 1 1 6 4569 1 1 27 SER N N -0.847 -5.357 1.369 1.00 . A B . 27 SER N 1 1 6 4570 1 1 27 SER O O 2.534 -4.617 0.410 1.00 . A B . 27 SER O 1 1 6 4571 1 1 27 SER OG O 0.563 -4.398 3.651 1.00 . A B . 27 SER OG 1 1 6 4572 1 1 28 ARG C C 2.573 -7.821 -0.657 1.00 . A B . 28 ARG C 1 1 6 4573 1 1 28 ARG CA C 2.701 -7.341 0.786 1.00 . A B . 28 ARG CA 1 1 6 4574 1 1 28 ARG CB C 2.804 -8.544 1.721 1.00 . A B . 28 ARG CB 1 1 6 4575 1 1 28 ARG CD C 3.333 -9.451 3.993 1.00 . A B . 28 ARG CD 1 1 6 4576 1 1 28 ARG CG C 3.252 -8.201 3.134 1.00 . A B . 28 ARG CG 1 1 6 4577 1 1 28 ARG CZ C 4.093 -11.764 3.597 1.00 . A B . 28 ARG CZ 1 1 6 4578 1 1 28 ARG H H 0.839 -6.892 1.678 1.00 . A B . 28 ARG H 1 1 6 4579 1 1 28 ARG HA H 3.599 -6.751 0.875 1.00 . A B . 28 ARG HA 1 1 6 4580 1 1 28 ARG HB2 H 1.834 -9.015 1.784 1.00 . A B . 28 ARG HB2 1 1 6 4581 1 1 28 ARG HB3 H 3.509 -9.249 1.305 1.00 . A B . 28 ARG HB3 1 1 6 4582 1 1 28 ARG HD2 H 3.718 -9.183 4.964 1.00 . A B . 28 ARG HD2 1 1 6 4583 1 1 28 ARG HD3 H 2.342 -9.867 4.099 1.00 . A B . 28 ARG HD3 1 1 6 4584 1 1 28 ARG HE H 4.920 -10.132 2.795 1.00 . A B . 28 ARG HE 1 1 6 4585 1 1 28 ARG HG2 H 4.228 -7.739 3.093 1.00 . A B . 28 ARG HG2 1 1 6 4586 1 1 28 ARG HG3 H 2.542 -7.515 3.573 1.00 . A B . 28 ARG HG3 1 1 6 4587 1 1 28 ARG HH11 H 2.531 -11.607 4.884 1.00 . A B . 28 ARG HH11 1 1 6 4588 1 1 28 ARG HH12 H 3.071 -13.222 4.565 1.00 . A B . 28 ARG HH12 1 1 6 4589 1 1 28 ARG HH21 H 5.627 -12.248 2.364 1.00 . A B . 28 ARG HH21 1 1 6 4590 1 1 28 ARG HH22 H 4.841 -13.590 3.133 1.00 . A B . 28 ARG HH22 1 1 6 4591 1 1 28 ARG N N 1.578 -6.499 1.164 1.00 . A B . 28 ARG N 1 1 6 4592 1 1 28 ARG NE N 4.208 -10.455 3.394 1.00 . A B . 28 ARG NE 1 1 6 4593 1 1 28 ARG NH1 N 3.157 -12.236 4.413 1.00 . A B . 28 ARG NH1 1 1 6 4594 1 1 28 ARG NH2 N 4.917 -12.601 2.982 1.00 . A B . 28 ARG NH2 1 1 6 4595 1 1 28 ARG O O 3.573 -8.030 -1.343 1.00 . A B . 28 ARG O 1 1 6 4596 1 1 29 VAL C C 1.062 -7.441 -3.511 1.00 . A B . 29 VAL C 1 1 6 4597 1 1 29 VAL CA C 1.093 -8.534 -2.442 1.00 . A B . 29 VAL CA 1 1 6 4598 1 1 29 VAL CB C -0.223 -9.343 -2.484 1.00 . A B . 29 VAL CB 1 1 6 4599 1 1 29 VAL CG1 C -0.409 -10.006 -3.840 1.00 . A B . 29 VAL CG1 1 1 6 4600 1 1 29 VAL CG2 C -0.251 -10.388 -1.380 1.00 . A B . 29 VAL CG2 1 1 6 4601 1 1 29 VAL H H 0.585 -7.687 -0.565 1.00 . A B . 29 VAL H 1 1 6 4602 1 1 29 VAL HA H 1.906 -9.207 -2.664 1.00 . A B . 29 VAL HA 1 1 6 4603 1 1 29 VAL HB H -1.044 -8.663 -2.324 1.00 . A B . 29 VAL HB 1 1 6 4604 1 1 29 VAL HG11 H 0.412 -10.681 -4.025 1.00 . A B . 29 VAL HG11 1 1 6 4605 1 1 29 VAL HG12 H -0.435 -9.250 -4.611 1.00 . A B . 29 VAL HG12 1 1 6 4606 1 1 29 VAL HG13 H -1.337 -10.559 -3.844 1.00 . A B . 29 VAL HG13 1 1 6 4607 1 1 29 VAL HG21 H -1.150 -10.979 -1.467 1.00 . A B . 29 VAL HG21 1 1 6 4608 1 1 29 VAL HG22 H -0.234 -9.899 -0.418 1.00 . A B . 29 VAL HG22 1 1 6 4609 1 1 29 VAL HG23 H 0.612 -11.032 -1.473 1.00 . A B . 29 VAL HG23 1 1 6 4610 1 1 29 VAL N N 1.341 -7.973 -1.120 1.00 . A B . 29 VAL N 1 1 6 4611 1 1 29 VAL O O 1.675 -7.581 -4.567 1.00 . A B . 29 VAL O 1 1 6 4612 1 1 30 PHE C C 0.797 -3.976 -3.584 1.00 . A B . 30 PHE C 1 1 6 4613 1 1 30 PHE CA C 0.236 -5.254 -4.186 1.00 . A B . 30 PHE CA 1 1 6 4614 1 1 30 PHE CB C -1.234 -5.034 -4.568 1.00 . A B . 30 PHE CB 1 1 6 4615 1 1 30 PHE CD1 C -1.675 -6.814 -6.293 1.00 . A B . 30 PHE CD1 1 1 6 4616 1 1 30 PHE CD2 C -2.893 -6.883 -4.243 1.00 . A B . 30 PHE CD2 1 1 6 4617 1 1 30 PHE CE1 C -2.338 -7.945 -6.724 1.00 . A B . 30 PHE CE1 1 1 6 4618 1 1 30 PHE CE2 C -3.557 -8.013 -4.670 1.00 . A B . 30 PHE CE2 1 1 6 4619 1 1 30 PHE CG C -1.943 -6.270 -5.045 1.00 . A B . 30 PHE CG 1 1 6 4620 1 1 30 PHE CZ C -3.279 -8.546 -5.912 1.00 . A B . 30 PHE CZ 1 1 6 4621 1 1 30 PHE H H -0.055 -6.261 -2.342 1.00 . A B . 30 PHE H 1 1 6 4622 1 1 30 PHE HA H 0.804 -5.510 -5.069 1.00 . A B . 30 PHE HA 1 1 6 4623 1 1 30 PHE HB2 H -1.768 -4.665 -3.703 1.00 . A B . 30 PHE HB2 1 1 6 4624 1 1 30 PHE HB3 H -1.285 -4.296 -5.356 1.00 . A B . 30 PHE HB3 1 1 6 4625 1 1 30 PHE HD1 H -0.938 -6.347 -6.930 1.00 . A B . 30 PHE HD1 1 1 6 4626 1 1 30 PHE HD2 H -3.114 -6.466 -3.274 1.00 . A B . 30 PHE HD2 1 1 6 4627 1 1 30 PHE HE1 H -2.121 -8.361 -7.697 1.00 . A B . 30 PHE HE1 1 1 6 4628 1 1 30 PHE HE2 H -4.293 -8.480 -4.032 1.00 . A B . 30 PHE HE2 1 1 6 4629 1 1 30 PHE HZ H -3.797 -9.430 -6.248 1.00 . A B . 30 PHE HZ 1 1 6 4630 1 1 30 PHE N N 0.369 -6.347 -3.227 1.00 . A B . 30 PHE N 1 1 6 4631 1 1 30 PHE O O 0.157 -2.927 -3.626 1.00 . A B . 30 PHE O 1 1 6 4632 1 1 31 HIS C C 2.579 -1.670 -3.035 1.00 . A B . 31 HIS C 1 1 6 4633 1 1 31 HIS CA C 2.612 -2.991 -2.276 1.00 . A B . 31 HIS CA 1 1 6 4634 1 1 31 HIS CB C 4.054 -3.360 -1.918 1.00 . A B . 31 HIS CB 1 1 6 4635 1 1 31 HIS CD2 C 5.826 -1.611 -1.198 1.00 . A B . 31 HIS CD2 1 1 6 4636 1 1 31 HIS CE1 C 5.167 -1.242 0.828 1.00 . A B . 31 HIS CE1 1 1 6 4637 1 1 31 HIS CG C 4.731 -2.385 -0.998 1.00 . A B . 31 HIS CG 1 1 6 4638 1 1 31 HIS H H 2.493 -4.917 -3.146 1.00 . A B . 31 HIS H 1 1 6 4639 1 1 31 HIS HA H 2.049 -2.873 -1.362 1.00 . A B . 31 HIS HA 1 1 6 4640 1 1 31 HIS HB2 H 4.057 -4.326 -1.432 1.00 . A B . 31 HIS HB2 1 1 6 4641 1 1 31 HIS HB3 H 4.635 -3.420 -2.827 1.00 . A B . 31 HIS HB3 1 1 6 4642 1 1 31 HIS HD1 H 3.551 -2.547 0.742 1.00 . A B . 31 HIS HD1 1 1 6 4643 1 1 31 HIS HD2 H 6.394 -1.542 -2.113 1.00 . A B . 31 HIS HD2 1 1 6 4644 1 1 31 HIS HE1 H 5.092 -0.859 1.835 1.00 . A B . 31 HIS HE1 1 1 6 4645 1 1 31 HIS N N 1.999 -4.078 -3.035 1.00 . A B . 31 HIS N 1 1 6 4646 1 1 31 HIS ND1 N 4.325 -2.141 0.293 1.00 . A B . 31 HIS ND1 1 1 6 4647 1 1 31 HIS NE2 N 6.099 -0.889 -0.038 1.00 . A B . 31 HIS NE2 1 1 6 4648 1 1 31 HIS O O 2.104 -0.668 -2.514 1.00 . A B . 31 HIS O 1 1 6 4649 1 1 32 GLU C C 1.786 0.159 -5.349 1.00 . A B . 32 GLU C 1 1 6 4650 1 1 32 GLU CA C 3.150 -0.458 -5.058 1.00 . A B . 32 GLU CA 1 1 6 4651 1 1 32 GLU CB C 3.896 -0.716 -6.365 1.00 . A B . 32 GLU CB 1 1 6 4652 1 1 32 GLU CD C 6.116 -1.167 -7.478 1.00 . A B . 32 GLU CD 1 1 6 4653 1 1 32 GLU CG C 5.342 -1.155 -6.178 1.00 . A B . 32 GLU CG 1 1 6 4654 1 1 32 GLU H H 3.236 -2.547 -4.699 1.00 . A B . 32 GLU H 1 1 6 4655 1 1 32 GLU HA H 3.718 0.242 -4.464 1.00 . A B . 32 GLU HA 1 1 6 4656 1 1 32 GLU HB2 H 3.376 -1.487 -6.913 1.00 . A B . 32 GLU HB2 1 1 6 4657 1 1 32 GLU HB3 H 3.892 0.192 -6.950 1.00 . A B . 32 GLU HB3 1 1 6 4658 1 1 32 GLU HG2 H 5.830 -0.474 -5.498 1.00 . A B . 32 GLU HG2 1 1 6 4659 1 1 32 GLU HG3 H 5.355 -2.151 -5.760 1.00 . A B . 32 GLU HG3 1 1 6 4660 1 1 32 GLU N N 3.019 -1.687 -4.283 1.00 . A B . 32 GLU N 1 1 6 4661 1 1 32 GLU O O 1.625 1.380 -5.309 1.00 . A B . 32 GLU O 1 1 6 4662 1 1 32 GLU OE1 O 6.696 -0.121 -7.844 1.00 . A B . 32 GLU OE1 1 1 6 4663 1 1 32 GLU OE2 O 6.141 -2.223 -8.145 1.00 . A B . 32 GLU OE2 1 1 6 4664 1 1 33 ASP C C -1.217 0.270 -4.643 1.00 . A B . 33 ASP C 1 1 6 4665 1 1 33 ASP CA C -0.550 -0.231 -5.912 1.00 . A B . 33 ASP CA 1 1 6 4666 1 1 33 ASP CB C -1.396 -1.358 -6.510 1.00 . A B . 33 ASP CB 1 1 6 4667 1 1 33 ASP CG C -1.006 -1.717 -7.926 1.00 . A B . 33 ASP CG 1 1 6 4668 1 1 33 ASP H H 0.995 -1.651 -5.636 1.00 . A B . 33 ASP H 1 1 6 4669 1 1 33 ASP HA H -0.485 0.580 -6.620 1.00 . A B . 33 ASP HA 1 1 6 4670 1 1 33 ASP HB2 H -1.284 -2.239 -5.898 1.00 . A B . 33 ASP HB2 1 1 6 4671 1 1 33 ASP HB3 H -2.434 -1.058 -6.509 1.00 . A B . 33 ASP HB3 1 1 6 4672 1 1 33 ASP N N 0.807 -0.690 -5.627 1.00 . A B . 33 ASP N 1 1 6 4673 1 1 33 ASP O O -2.082 1.139 -4.685 1.00 . A B . 33 ASP O 1 1 6 4674 1 1 33 ASP OD1 O -0.085 -2.547 -8.104 1.00 . A B . 33 ASP OD1 1 1 6 4675 1 1 33 ASP OD2 O -1.600 -1.163 -8.870 1.00 . A B . 33 ASP OD2 1 1 6 4676 1 1 34 CYS C C -0.921 1.395 -1.694 1.00 . A B . 34 CYS C 1 1 6 4677 1 1 34 CYS CA C -1.390 0.044 -2.227 1.00 . A B . 34 CYS CA 1 1 6 4678 1 1 34 CYS CB C -1.081 -1.067 -1.228 1.00 . A B . 34 CYS CB 1 1 6 4679 1 1 34 CYS H H -0.051 -0.922 -3.549 1.00 . A B . 34 CYS H 1 1 6 4680 1 1 34 CYS HA H -2.461 0.089 -2.371 1.00 . A B . 34 CYS HA 1 1 6 4681 1 1 34 CYS HB2 H -0.049 -1.376 -1.348 1.00 . A B . 34 CYS HB2 1 1 6 4682 1 1 34 CYS HB3 H -1.229 -0.697 -0.225 1.00 . A B . 34 CYS HB3 1 1 6 4683 1 1 34 CYS N N -0.791 -0.275 -3.515 1.00 . A B . 34 CYS N 1 1 6 4684 1 1 34 CYS O O -1.324 1.822 -0.609 1.00 . A B . 34 CYS O 1 1 6 4685 1 1 34 CYS SG S -2.124 -2.545 -1.440 1.00 . A B . 34 CYS SG 1 1 6 4686 1 1 35 HIS C C -0.409 4.424 -2.981 1.00 . A B . 35 HIS C 1 1 6 4687 1 1 35 HIS CA C 0.356 3.418 -2.130 1.00 . A B . 35 HIS CA 1 1 6 4688 1 1 35 HIS CB C 1.863 3.585 -2.341 1.00 . A B . 35 HIS CB 1 1 6 4689 1 1 35 HIS CD2 C 3.122 1.619 -1.236 1.00 . A B . 35 HIS CD2 1 1 6 4690 1 1 35 HIS CE1 C 3.695 2.554 0.624 1.00 . A B . 35 HIS CE1 1 1 6 4691 1 1 35 HIS CG C 2.678 2.897 -1.290 1.00 . A B . 35 HIS CG 1 1 6 4692 1 1 35 HIS H H 0.307 1.619 -3.250 1.00 . A B . 35 HIS H 1 1 6 4693 1 1 35 HIS HA H 0.128 3.593 -1.090 1.00 . A B . 35 HIS HA 1 1 6 4694 1 1 35 HIS HB2 H 2.132 3.167 -3.301 1.00 . A B . 35 HIS HB2 1 1 6 4695 1 1 35 HIS HB3 H 2.107 4.636 -2.324 1.00 . A B . 35 HIS HB3 1 1 6 4696 1 1 35 HIS HD1 H 2.841 4.395 0.187 1.00 . A B . 35 HIS HD1 1 1 6 4697 1 1 35 HIS HD2 H 3.014 0.880 -2.017 1.00 . A B . 35 HIS HD2 1 1 6 4698 1 1 35 HIS HE1 H 4.109 2.730 1.607 1.00 . A B . 35 HIS HE1 1 1 6 4699 1 1 35 HIS N N -0.063 2.060 -2.455 1.00 . A B . 35 HIS N 1 1 6 4700 1 1 35 HIS ND1 N 3.048 3.478 -0.099 1.00 . A B . 35 HIS ND1 1 1 6 4701 1 1 35 HIS NE2 N 3.762 1.399 -0.023 1.00 . A B . 35 HIS NE2 1 1 6 4702 1 1 35 HIS O O -0.264 5.637 -2.817 1.00 . A B . 35 HIS O 1 1 6 4703 1 1 36 ILE C C -3.486 4.470 -4.632 1.00 . A B . 36 ILE C 1 1 6 4704 1 1 36 ILE CA C -1.990 4.730 -4.811 1.00 . A B . 36 ILE CA 1 1 6 4705 1 1 36 ILE CB C -1.589 4.409 -6.271 1.00 . A B . 36 ILE CB 1 1 6 4706 1 1 36 ILE CD1 C 0.428 4.072 -7.806 1.00 . A B . 36 ILE CD1 1 1 6 4707 1 1 36 ILE CG1 C -0.068 4.498 -6.437 1.00 . A B . 36 ILE CG1 1 1 6 4708 1 1 36 ILE CG2 C -2.287 5.346 -7.247 1.00 . A B . 36 ILE CG2 1 1 6 4709 1 1 36 ILE H H -1.337 2.932 -3.927 1.00 . A B . 36 ILE H 1 1 6 4710 1 1 36 ILE HA H -1.774 5.766 -4.606 1.00 . A B . 36 ILE HA 1 1 6 4711 1 1 36 ILE HB H -1.907 3.402 -6.490 1.00 . A B . 36 ILE HB 1 1 6 4712 1 1 36 ILE HD11 H 0.167 3.038 -7.979 1.00 . A B . 36 ILE HD11 1 1 6 4713 1 1 36 ILE HD12 H 1.501 4.184 -7.850 1.00 . A B . 36 ILE HD12 1 1 6 4714 1 1 36 ILE HD13 H -0.031 4.691 -8.564 1.00 . A B . 36 ILE HD13 1 1 6 4715 1 1 36 ILE HG12 H 0.247 5.517 -6.274 1.00 . A B . 36 ILE HG12 1 1 6 4716 1 1 36 ILE HG13 H 0.402 3.862 -5.702 1.00 . A B . 36 ILE HG13 1 1 6 4717 1 1 36 ILE HG21 H -3.357 5.263 -7.123 1.00 . A B . 36 ILE HG21 1 1 6 4718 1 1 36 ILE HG22 H -2.021 5.076 -8.257 1.00 . A B . 36 ILE HG22 1 1 6 4719 1 1 36 ILE HG23 H -1.980 6.363 -7.054 1.00 . A B . 36 ILE HG23 1 1 6 4720 1 1 36 ILE N N -1.230 3.906 -3.884 1.00 . A B . 36 ILE N 1 1 6 4721 1 1 36 ILE O O -3.904 3.319 -4.513 1.00 . A B . 36 ILE O 1 1 6 4722 1 1 37 PRO C C -3.550 7.516 -3.347 1.00 . A B . 37 PRO C 1 1 6 4723 1 1 37 PRO CA C -3.909 6.918 -4.709 1.00 . A B . 37 PRO CA 1 1 6 4724 1 1 37 PRO CB C -5.160 7.621 -5.278 1.00 . A B . 37 PRO CB 1 1 6 4725 1 1 37 PRO CD C -5.778 5.423 -4.511 1.00 . A B . 37 PRO CD 1 1 6 4726 1 1 37 PRO CG C -6.228 6.569 -5.372 1.00 . A B . 37 PRO CG 1 1 6 4727 1 1 37 PRO HA H -3.079 7.039 -5.389 1.00 . A B . 37 PRO HA 1 1 6 4728 1 1 37 PRO HB2 H -5.458 8.418 -4.608 1.00 . A B . 37 PRO HB2 1 1 6 4729 1 1 37 PRO HB3 H -4.930 8.034 -6.253 1.00 . A B . 37 PRO HB3 1 1 6 4730 1 1 37 PRO HD2 H -6.108 5.559 -3.490 1.00 . A B . 37 PRO HD2 1 1 6 4731 1 1 37 PRO HD3 H -6.132 4.481 -4.906 1.00 . A B . 37 PRO HD3 1 1 6 4732 1 1 37 PRO HG2 H -7.166 6.966 -5.007 1.00 . A B . 37 PRO HG2 1 1 6 4733 1 1 37 PRO HG3 H -6.335 6.247 -6.401 1.00 . A B . 37 PRO HG3 1 1 6 4734 1 1 37 PRO N N -4.326 5.519 -4.609 1.00 . A B . 37 PRO N 1 1 6 4735 1 1 37 PRO O O -4.237 7.263 -2.354 1.00 . A B . 37 PRO O 1 1 6 4736 1 1 38 PRO C C -3.115 9.950 -1.536 1.00 . A B . 38 PRO C 1 1 6 4737 1 1 38 PRO CA C -2.040 8.998 -2.057 1.00 . A B . 38 PRO CA 1 1 6 4738 1 1 38 PRO CB C -0.800 9.791 -2.486 1.00 . A B . 38 PRO CB 1 1 6 4739 1 1 38 PRO CD C -1.543 8.579 -4.407 1.00 . A B . 38 PRO CD 1 1 6 4740 1 1 38 PRO CG C -0.313 9.107 -3.718 1.00 . A B . 38 PRO CG 1 1 6 4741 1 1 38 PRO HA H -1.773 8.297 -1.282 1.00 . A B . 38 PRO HA 1 1 6 4742 1 1 38 PRO HB2 H -1.078 10.818 -2.683 1.00 . A B . 38 PRO HB2 1 1 6 4743 1 1 38 PRO HB3 H -0.062 9.760 -1.697 1.00 . A B . 38 PRO HB3 1 1 6 4744 1 1 38 PRO HD2 H -1.958 9.325 -5.072 1.00 . A B . 38 PRO HD2 1 1 6 4745 1 1 38 PRO HD3 H -1.315 7.671 -4.950 1.00 . A B . 38 PRO HD3 1 1 6 4746 1 1 38 PRO HG2 H 0.205 9.813 -4.353 1.00 . A B . 38 PRO HG2 1 1 6 4747 1 1 38 PRO HG3 H 0.345 8.291 -3.449 1.00 . A B . 38 PRO HG3 1 1 6 4748 1 1 38 PRO N N -2.461 8.306 -3.286 1.00 . A B . 38 PRO N 1 1 6 4749 1 1 38 PRO O O -4.017 10.348 -2.276 1.00 . A B . 38 PRO O 1 1 6 4750 1 1 39 VAL C C -3.982 12.577 -0.212 1.00 . A B . 39 VAL C 1 1 6 4751 1 1 39 VAL CA C -3.993 11.173 0.387 1.00 . A B . 39 VAL CA 1 1 6 4752 1 1 39 VAL CB C -3.760 11.268 1.913 1.00 . A B . 39 VAL CB 1 1 6 4753 1 1 39 VAL CG1 C -4.762 12.210 2.558 1.00 . A B . 39 VAL CG1 1 1 6 4754 1 1 39 VAL CG2 C -3.846 9.897 2.562 1.00 . A B . 39 VAL CG2 1 1 6 4755 1 1 39 VAL H H -2.241 9.998 0.262 1.00 . A B . 39 VAL H 1 1 6 4756 1 1 39 VAL HA H -4.965 10.738 0.225 1.00 . A B . 39 VAL HA 1 1 6 4757 1 1 39 VAL HB H -2.770 11.659 2.081 1.00 . A B . 39 VAL HB 1 1 6 4758 1 1 39 VAL HG11 H -4.559 12.283 3.616 1.00 . A B . 39 VAL HG11 1 1 6 4759 1 1 39 VAL HG12 H -5.760 11.827 2.407 1.00 . A B . 39 VAL HG12 1 1 6 4760 1 1 39 VAL HG13 H -4.680 13.187 2.105 1.00 . A B . 39 VAL HG13 1 1 6 4761 1 1 39 VAL HG21 H -3.069 9.262 2.169 1.00 . A B . 39 VAL HG21 1 1 6 4762 1 1 39 VAL HG22 H -4.809 9.458 2.353 1.00 . A B . 39 VAL HG22 1 1 6 4763 1 1 39 VAL HG23 H -3.722 9.997 3.629 1.00 . A B . 39 VAL HG23 1 1 6 4764 1 1 39 VAL N N -3.008 10.312 -0.259 1.00 . A B . 39 VAL N 1 1 6 4765 1 1 39 VAL O O -3.192 13.438 0.187 1.00 . A B . 39 VAL O 1 1 6 4766 1 1 40 GLU C C -6.474 14.549 -1.566 1.00 . A B . 40 GLU C 1 1 6 4767 1 1 40 GLU CA C -5.033 14.103 -1.778 1.00 . A B . 40 GLU CA 1 1 6 4768 1 1 40 GLU CB C -4.693 14.087 -3.272 1.00 . A B . 40 GLU CB 1 1 6 4769 1 1 40 GLU CD C -3.002 13.524 -5.061 1.00 . A B . 40 GLU CD 1 1 6 4770 1 1 40 GLU CG C -3.320 13.510 -3.582 1.00 . A B . 40 GLU CG 1 1 6 4771 1 1 40 GLU H H -5.354 12.028 -1.549 1.00 . A B . 40 GLU H 1 1 6 4772 1 1 40 GLU HA H -4.375 14.791 -1.268 1.00 . A B . 40 GLU HA 1 1 6 4773 1 1 40 GLU HB2 H -5.433 13.496 -3.792 1.00 . A B . 40 GLU HB2 1 1 6 4774 1 1 40 GLU HB3 H -4.726 15.098 -3.648 1.00 . A B . 40 GLU HB3 1 1 6 4775 1 1 40 GLU HG2 H -2.572 14.091 -3.064 1.00 . A B . 40 GLU HG2 1 1 6 4776 1 1 40 GLU HG3 H -3.286 12.488 -3.232 1.00 . A B . 40 GLU HG3 1 1 6 4777 1 1 40 GLU N N -4.843 12.787 -1.193 1.00 . A B . 40 GLU N 1 1 6 4778 1 1 40 GLU O O -6.745 15.731 -1.344 1.00 . A B . 40 GLU O 1 1 6 4779 1 1 40 GLU OE1 O -3.735 12.879 -5.838 1.00 . A B . 40 GLU OE1 1 1 6 4780 1 1 40 GLU OE2 O -2.024 14.188 -5.458 1.00 . A B . 40 GLU OE2 1 1 6 4781 1 1 41 ALA C C -9.555 12.563 -1.084 1.00 . A B . 41 ALA C 1 1 6 4782 1 1 41 ALA CA C -8.803 13.854 -1.395 1.00 . A B . 41 ALA CA 1 1 6 4783 1 1 41 ALA CB C -9.425 14.542 -2.598 1.00 . A B . 41 ALA CB 1 1 6 4784 1 1 41 ALA H H -7.115 12.678 -1.854 1.00 . A B . 41 ALA H 1 1 6 4785 1 1 41 ALA HA H -8.881 14.519 -0.547 1.00 . A B . 41 ALA HA 1 1 6 4786 1 1 41 ALA HB1 H -10.457 14.775 -2.386 1.00 . A B . 41 ALA HB1 1 1 6 4787 1 1 41 ALA HB2 H -9.373 13.885 -3.453 1.00 . A B . 41 ALA HB2 1 1 6 4788 1 1 41 ALA HB3 H -8.886 15.453 -2.812 1.00 . A B . 41 ALA HB3 1 1 6 4789 1 1 41 ALA N N -7.393 13.590 -1.631 1.00 . A B . 41 ALA N 1 1 6 4790 1 1 41 ALA O O -9.593 11.645 -1.904 1.00 . A B . 41 ALA O 1 1 6 4791 1 1 42 GLU C C -10.269 10.044 0.423 1.00 . A B . 42 GLU C 1 1 6 4792 1 1 42 GLU CA C -10.982 11.395 0.544 1.00 . A B . 42 GLU CA 1 1 6 4793 1 1 42 GLU CB C -12.289 11.397 -0.250 1.00 . A B . 42 GLU CB 1 1 6 4794 1 1 42 GLU CD C -14.378 12.695 -0.853 1.00 . A B . 42 GLU CD 1 1 6 4795 1 1 42 GLU CG C -13.044 12.712 -0.141 1.00 . A B . 42 GLU CG 1 1 6 4796 1 1 42 GLU H H -9.980 13.250 0.739 1.00 . A B . 42 GLU H 1 1 6 4797 1 1 42 GLU HA H -11.217 11.555 1.586 1.00 . A B . 42 GLU HA 1 1 6 4798 1 1 42 GLU HB2 H -12.067 11.218 -1.291 1.00 . A B . 42 GLU HB2 1 1 6 4799 1 1 42 GLU HB3 H -12.926 10.607 0.119 1.00 . A B . 42 GLU HB3 1 1 6 4800 1 1 42 GLU HG2 H -13.216 12.927 0.903 1.00 . A B . 42 GLU HG2 1 1 6 4801 1 1 42 GLU HG3 H -12.433 13.494 -0.570 1.00 . A B . 42 GLU HG3 1 1 6 4802 1 1 42 GLU N N -10.133 12.508 0.113 1.00 . A B . 42 GLU N 1 1 6 4803 1 1 42 GLU O O -10.722 9.142 -0.287 1.00 . A B . 42 GLU O 1 1 6 4804 1 1 42 GLU OE1 O -14.407 12.935 -2.081 1.00 . A B . 42 GLU OE1 1 1 6 4805 1 1 42 GLU OE2 O -15.406 12.422 -0.198 1.00 . A B . 42 GLU OE2 1 1 6 4806 1 1 43 ARG C C -8.355 8.166 2.619 1.00 . A B . 43 ARG C 1 1 6 4807 1 1 43 ARG CA C -8.411 8.662 1.181 1.00 . A B . 43 ARG CA 1 1 6 4808 1 1 43 ARG CB C -6.992 8.832 0.631 1.00 . A B . 43 ARG CB 1 1 6 4809 1 1 43 ARG CD C -7.332 7.886 -1.689 1.00 . A B . 43 ARG CD 1 1 6 4810 1 1 43 ARG CG C -6.929 9.103 -0.867 1.00 . A B . 43 ARG CG 1 1 6 4811 1 1 43 ARG CZ C -9.324 6.453 -1.980 1.00 . A B . 43 ARG CZ 1 1 6 4812 1 1 43 ARG H H -8.799 10.700 1.603 1.00 . A B . 43 ARG H 1 1 6 4813 1 1 43 ARG HA H -8.938 7.935 0.581 1.00 . A B . 43 ARG HA 1 1 6 4814 1 1 43 ARG HB2 H -6.521 9.658 1.142 1.00 . A B . 43 ARG HB2 1 1 6 4815 1 1 43 ARG HB3 H -6.432 7.931 0.835 1.00 . A B . 43 ARG HB3 1 1 6 4816 1 1 43 ARG HD2 H -7.075 8.063 -2.724 1.00 . A B . 43 ARG HD2 1 1 6 4817 1 1 43 ARG HD3 H -6.781 7.028 -1.329 1.00 . A B . 43 ARG HD3 1 1 6 4818 1 1 43 ARG HE H -9.347 8.318 -1.252 1.00 . A B . 43 ARG HE 1 1 6 4819 1 1 43 ARG HG2 H -7.601 9.914 -1.101 1.00 . A B . 43 ARG HG2 1 1 6 4820 1 1 43 ARG HG3 H -5.918 9.387 -1.128 1.00 . A B . 43 ARG HG3 1 1 6 4821 1 1 43 ARG HH11 H -7.579 5.569 -2.498 1.00 . A B . 43 ARG HH11 1 1 6 4822 1 1 43 ARG HH12 H -8.996 4.601 -2.745 1.00 . A B . 43 ARG HH12 1 1 6 4823 1 1 43 ARG HH21 H -11.210 7.041 -1.531 1.00 . A B . 43 ARG HH21 1 1 6 4824 1 1 43 ARG HH22 H -11.066 5.434 -2.173 1.00 . A B . 43 ARG HH22 1 1 6 4825 1 1 43 ARG N N -9.146 9.919 1.116 1.00 . A B . 43 ARG N 1 1 6 4826 1 1 43 ARG NE N -8.765 7.600 -1.602 1.00 . A B . 43 ARG NE 1 1 6 4827 1 1 43 ARG NH1 N -8.571 5.460 -2.439 1.00 . A B . 43 ARG NH1 1 1 6 4828 1 1 43 ARG NH2 N -10.638 6.297 -1.885 1.00 . A B . 43 ARG NH2 1 1 6 4829 1 1 43 ARG O O -8.039 8.928 3.534 1.00 . A B . 43 ARG O 1 1 6 4830 1 1 44 THR C C -7.735 5.183 4.335 1.00 . A B . 44 THR C 1 1 6 4831 1 1 44 THR CA C -8.726 6.336 4.161 1.00 . A B . 44 THR CA 1 1 6 4832 1 1 44 THR CB C -10.151 5.840 4.483 1.00 . A B . 44 THR CB 1 1 6 4833 1 1 44 THR CG2 C -11.137 6.999 4.484 1.00 . A B . 44 THR CG2 1 1 6 4834 1 1 44 THR H H -8.849 6.313 2.051 1.00 . A B . 44 THR H 1 1 6 4835 1 1 44 THR HA H -8.478 7.121 4.858 1.00 . A B . 44 THR HA 1 1 6 4836 1 1 44 THR HB H -10.147 5.386 5.464 1.00 . A B . 44 THR HB 1 1 6 4837 1 1 44 THR HG1 H -9.789 4.378 3.202 1.00 . A B . 44 THR HG1 1 1 6 4838 1 1 44 THR HG21 H -11.145 7.465 3.509 1.00 . A B . 44 THR HG21 1 1 6 4839 1 1 44 THR HG22 H -10.838 7.726 5.224 1.00 . A B . 44 THR HG22 1 1 6 4840 1 1 44 THR HG23 H -12.125 6.633 4.715 1.00 . A B . 44 THR HG23 1 1 6 4841 1 1 44 THR N N -8.662 6.893 2.822 1.00 . A B . 44 THR N 1 1 6 4842 1 1 44 THR O O -7.969 4.076 3.850 1.00 . A B . 44 THR O 1 1 6 4843 1 1 44 THR OG1 O -10.564 4.865 3.515 1.00 . A B . 44 THR OG1 1 1 6 4844 1 1 45 PRO C C -6.089 3.264 6.155 1.00 . A B . 45 PRO C 1 1 6 4845 1 1 45 PRO CA C -5.588 4.398 5.257 1.00 . A B . 45 PRO CA 1 1 6 4846 1 1 45 PRO CB C -4.443 5.160 5.942 1.00 . A B . 45 PRO CB 1 1 6 4847 1 1 45 PRO CD C -6.217 6.727 5.588 1.00 . A B . 45 PRO CD 1 1 6 4848 1 1 45 PRO CG C -4.723 6.606 5.698 1.00 . A B . 45 PRO CG 1 1 6 4849 1 1 45 PRO HA H -5.233 3.979 4.327 1.00 . A B . 45 PRO HA 1 1 6 4850 1 1 45 PRO HB2 H -4.438 4.931 6.999 1.00 . A B . 45 PRO HB2 1 1 6 4851 1 1 45 PRO HB3 H -3.500 4.863 5.504 1.00 . A B . 45 PRO HB3 1 1 6 4852 1 1 45 PRO HD2 H -6.660 6.870 6.565 1.00 . A B . 45 PRO HD2 1 1 6 4853 1 1 45 PRO HD3 H -6.488 7.539 4.925 1.00 . A B . 45 PRO HD3 1 1 6 4854 1 1 45 PRO HG2 H -4.357 7.196 6.527 1.00 . A B . 45 PRO HG2 1 1 6 4855 1 1 45 PRO HG3 H -4.252 6.920 4.777 1.00 . A B . 45 PRO HG3 1 1 6 4856 1 1 45 PRO N N -6.608 5.429 5.018 1.00 . A B . 45 PRO N 1 1 6 4857 1 1 45 PRO O O -5.526 2.167 6.156 1.00 . A B . 45 PRO O 1 1 6 4858 1 1 46 TRP C C -8.791 1.680 7.118 1.00 . A B . 46 TRP C 1 1 6 4859 1 1 46 TRP CA C -7.714 2.517 7.812 1.00 . A B . 46 TRP CA 1 1 6 4860 1 1 46 TRP CB C -8.274 3.179 9.080 1.00 . A B . 46 TRP CB 1 1 6 4861 1 1 46 TRP CD1 C -10.666 4.039 8.750 1.00 . A B . 46 TRP CD1 1 1 6 4862 1 1 46 TRP CD2 C -9.095 5.625 8.592 1.00 . A B . 46 TRP CD2 1 1 6 4863 1 1 46 TRP CE2 C -10.355 6.220 8.397 1.00 . A B . 46 TRP CE2 1 1 6 4864 1 1 46 TRP CE3 C -7.955 6.431 8.535 1.00 . A B . 46 TRP CE3 1 1 6 4865 1 1 46 TRP CG C -9.316 4.227 8.817 1.00 . A B . 46 TRP CG 1 1 6 4866 1 1 46 TRP CH2 C -9.371 8.344 8.101 1.00 . A B . 46 TRP CH2 1 1 6 4867 1 1 46 TRP CZ2 C -10.505 7.581 8.152 1.00 . A B . 46 TRP CZ2 1 1 6 4868 1 1 46 TRP CZ3 C -8.106 7.781 8.288 1.00 . A B . 46 TRP CZ3 1 1 6 4869 1 1 46 TRP H H -7.583 4.402 6.844 1.00 . A B . 46 TRP H 1 1 6 4870 1 1 46 TRP HA H -6.905 1.857 8.092 1.00 . A B . 46 TRP HA 1 1 6 4871 1 1 46 TRP HB2 H -8.723 2.419 9.703 1.00 . A B . 46 TRP HB2 1 1 6 4872 1 1 46 TRP HB3 H -7.463 3.644 9.623 1.00 . A B . 46 TRP HB3 1 1 6 4873 1 1 46 TRP HD1 H -11.155 3.086 8.876 1.00 . A B . 46 TRP HD1 1 1 6 4874 1 1 46 TRP HE1 H -12.266 5.355 8.412 1.00 . A B . 46 TRP HE1 1 1 6 4875 1 1 46 TRP HE3 H -6.969 6.015 8.681 1.00 . A B . 46 TRP HE3 1 1 6 4876 1 1 46 TRP HH2 H -9.436 9.403 7.906 1.00 . A B . 46 TRP HH2 1 1 6 4877 1 1 46 TRP HZ2 H -11.476 8.030 8.007 1.00 . A B . 46 TRP HZ2 1 1 6 4878 1 1 46 TRP HZ3 H -7.237 8.421 8.239 1.00 . A B . 46 TRP HZ3 1 1 6 4879 1 1 46 TRP N N -7.158 3.520 6.903 1.00 . A B . 46 TRP N 1 1 6 4880 1 1 46 TRP NE1 N -11.296 5.232 8.500 1.00 . A B . 46 TRP NE1 1 1 6 4881 1 1 46 TRP O O -9.666 1.099 7.762 1.00 . A B . 46 TRP O 1 1 6 4882 1 1 47 ASN C C -8.808 0.211 3.849 1.00 . A B . 47 ASN C 1 1 6 4883 1 1 47 ASN CA C -9.604 0.792 5.002 1.00 . A B . 47 ASN CA 1 1 6 4884 1 1 47 ASN CB C -10.802 1.594 4.473 1.00 . A B . 47 ASN CB 1 1 6 4885 1 1 47 ASN CG C -11.713 0.761 3.575 1.00 . A B . 47 ASN CG 1 1 6 4886 1 1 47 ASN H H -8.033 2.157 5.341 1.00 . A B . 47 ASN H 1 1 6 4887 1 1 47 ASN HA H -9.958 -0.012 5.630 1.00 . A B . 47 ASN HA 1 1 6 4888 1 1 47 ASN HB2 H -11.379 1.967 5.307 1.00 . A B . 47 ASN HB2 1 1 6 4889 1 1 47 ASN HB3 H -10.436 2.433 3.897 1.00 . A B . 47 ASN HB3 1 1 6 4890 1 1 47 ASN HD21 H -12.666 0.009 5.157 1.00 . A B . 47 ASN HD21 1 1 6 4891 1 1 47 ASN HD22 H -13.213 -0.547 3.609 1.00 . A B . 47 ASN HD22 1 1 6 4892 1 1 47 ASN N N -8.719 1.628 5.800 1.00 . A B . 47 ASN N 1 1 6 4893 1 1 47 ASN ND2 N -12.622 0.000 4.174 1.00 . A B . 47 ASN ND2 1 1 6 4894 1 1 47 ASN O O -8.065 0.935 3.186 1.00 . A B . 47 ASN O 1 1 6 4895 1 1 47 ASN OD1 O -11.589 0.790 2.350 1.00 . A B . 47 ASN OD1 1 1 6 4896 1 1 48 CYS C C -8.872 -1.672 1.253 1.00 . A B . 48 CYS C 1 1 6 4897 1 1 48 CYS CA C -8.136 -1.719 2.588 1.00 . A B . 48 CYS CA 1 1 6 4898 1 1 48 CYS CB C -7.811 -3.170 2.982 1.00 . A B . 48 CYS CB 1 1 6 4899 1 1 48 CYS H H -9.601 -1.611 4.108 1.00 . A B . 48 CYS H 1 1 6 4900 1 1 48 CYS HA H -7.218 -1.158 2.499 1.00 . A B . 48 CYS HA 1 1 6 4901 1 1 48 CYS HB2 H -7.412 -3.183 3.986 1.00 . A B . 48 CYS HB2 1 1 6 4902 1 1 48 CYS HB3 H -8.716 -3.757 2.954 1.00 . A B . 48 CYS HB3 1 1 6 4903 1 1 48 CYS N N -8.937 -1.085 3.612 1.00 . A B . 48 CYS N 1 1 6 4904 1 1 48 CYS O O -9.972 -2.213 1.117 1.00 . A B . 48 CYS O 1 1 6 4905 1 1 48 CYS SG S -6.598 -3.963 1.900 1.00 . A B . 48 CYS SG 1 1 6 4906 1 1 49 ILE C C -8.840 -2.165 -1.859 1.00 . A B . 49 ILE C 1 1 6 4907 1 1 49 ILE CA C -8.873 -0.879 -1.045 1.00 . A B . 49 ILE CA 1 1 6 4908 1 1 49 ILE CB C -8.245 0.275 -1.869 1.00 . A B . 49 ILE CB 1 1 6 4909 1 1 49 ILE CD1 C -6.058 1.175 -2.831 1.00 . A B . 49 ILE CD1 1 1 6 4910 1 1 49 ILE CG1 C -6.715 0.177 -1.896 1.00 . A B . 49 ILE CG1 1 1 6 4911 1 1 49 ILE CG2 C -8.685 1.626 -1.316 1.00 . A B . 49 ILE CG2 1 1 6 4912 1 1 49 ILE H H -7.346 -0.685 0.412 1.00 . A B . 49 ILE H 1 1 6 4913 1 1 49 ILE HA H -9.907 -0.625 -0.864 1.00 . A B . 49 ILE HA 1 1 6 4914 1 1 49 ILE HB H -8.614 0.195 -2.880 1.00 . A B . 49 ILE HB 1 1 6 4915 1 1 49 ILE HD11 H -4.985 1.060 -2.785 1.00 . A B . 49 ILE HD11 1 1 6 4916 1 1 49 ILE HD12 H -6.325 2.178 -2.533 1.00 . A B . 49 ILE HD12 1 1 6 4917 1 1 49 ILE HD13 H -6.395 0.999 -3.842 1.00 . A B . 49 ILE HD13 1 1 6 4918 1 1 49 ILE HG12 H -6.336 0.364 -0.904 1.00 . A B . 49 ILE HG12 1 1 6 4919 1 1 49 ILE HG13 H -6.427 -0.815 -2.209 1.00 . A B . 49 ILE HG13 1 1 6 4920 1 1 49 ILE HG21 H -8.413 1.695 -0.273 1.00 . A B . 49 ILE HG21 1 1 6 4921 1 1 49 ILE HG22 H -9.755 1.727 -1.415 1.00 . A B . 49 ILE HG22 1 1 6 4922 1 1 49 ILE HG23 H -8.196 2.417 -1.866 1.00 . A B . 49 ILE HG23 1 1 6 4923 1 1 49 ILE N N -8.244 -1.051 0.259 1.00 . A B . 49 ILE N 1 1 6 4924 1 1 49 ILE O O -9.729 -2.413 -2.665 1.00 . A B . 49 ILE O 1 1 6 4925 1 1 50 PHE C C -8.627 -5.316 -1.809 1.00 . A B . 50 PHE C 1 1 6 4926 1 1 50 PHE CA C -7.712 -4.240 -2.379 1.00 . A B . 50 PHE CA 1 1 6 4927 1 1 50 PHE CB C -6.261 -4.712 -2.481 1.00 . A B . 50 PHE CB 1 1 6 4928 1 1 50 PHE CD1 C -4.969 -2.860 -3.579 1.00 . A B . 50 PHE CD1 1 1 6 4929 1 1 50 PHE CD2 C -5.551 -4.767 -4.883 1.00 . A B . 50 PHE CD2 1 1 6 4930 1 1 50 PHE CE1 C -4.362 -2.290 -4.680 1.00 . A B . 50 PHE CE1 1 1 6 4931 1 1 50 PHE CE2 C -4.949 -4.201 -5.989 1.00 . A B . 50 PHE CE2 1 1 6 4932 1 1 50 PHE CG C -5.569 -4.104 -3.666 1.00 . A B . 50 PHE CG 1 1 6 4933 1 1 50 PHE CZ C -4.352 -2.961 -5.888 1.00 . A B . 50 PHE CZ 1 1 6 4934 1 1 50 PHE H H -7.207 -2.801 -0.906 1.00 . A B . 50 PHE H 1 1 6 4935 1 1 50 PHE HA H -8.061 -4.026 -3.383 1.00 . A B . 50 PHE HA 1 1 6 4936 1 1 50 PHE HB2 H -5.722 -4.428 -1.587 1.00 . A B . 50 PHE HB2 1 1 6 4937 1 1 50 PHE HB3 H -6.238 -5.788 -2.591 1.00 . A B . 50 PHE HB3 1 1 6 4938 1 1 50 PHE HD1 H -4.973 -2.334 -2.638 1.00 . A B . 50 PHE HD1 1 1 6 4939 1 1 50 PHE HD2 H -6.015 -5.739 -4.964 1.00 . A B . 50 PHE HD2 1 1 6 4940 1 1 50 PHE HE1 H -3.899 -1.318 -4.597 1.00 . A B . 50 PHE HE1 1 1 6 4941 1 1 50 PHE HE2 H -4.942 -4.729 -6.933 1.00 . A B . 50 PHE HE2 1 1 6 4942 1 1 50 PHE HZ H -3.884 -2.515 -6.752 1.00 . A B . 50 PHE HZ 1 1 6 4943 1 1 50 PHE N N -7.830 -2.993 -1.635 1.00 . A B . 50 PHE N 1 1 6 4944 1 1 50 PHE O O -9.123 -6.169 -2.541 1.00 . A B . 50 PHE O 1 1 6 4945 1 1 51 CYS C C -11.208 -5.990 -0.418 1.00 . A B . 51 CYS C 1 1 6 4946 1 1 51 CYS CA C -9.798 -6.205 0.122 1.00 . A B . 51 CYS CA 1 1 6 4947 1 1 51 CYS CB C -9.797 -6.071 1.649 1.00 . A B . 51 CYS CB 1 1 6 4948 1 1 51 CYS H H -8.409 -4.599 0.047 1.00 . A B . 51 CYS H 1 1 6 4949 1 1 51 CYS HA H -9.481 -7.206 -0.141 1.00 . A B . 51 CYS HA 1 1 6 4950 1 1 51 CYS HB2 H -9.589 -5.047 1.914 1.00 . A B . 51 CYS HB2 1 1 6 4951 1 1 51 CYS HB3 H -10.774 -6.339 2.024 1.00 . A B . 51 CYS HB3 1 1 6 4952 1 1 51 CYS N N -8.861 -5.273 -0.500 1.00 . A B . 51 CYS N 1 1 6 4953 1 1 51 CYS O O -11.924 -6.946 -0.705 1.00 . A B . 51 CYS O 1 1 6 4954 1 1 51 CYS SG S -8.582 -7.115 2.486 1.00 . A B . 51 CYS SG 1 1 6 4955 1 1 52 ARG C C -12.984 -4.607 -2.624 1.00 . A B . 52 ARG C 1 1 6 4956 1 1 52 ARG CA C -12.918 -4.409 -1.108 1.00 . A B . 52 ARG CA 1 1 6 4957 1 1 52 ARG CB C -13.304 -2.975 -0.728 1.00 . A B . 52 ARG CB 1 1 6 4958 1 1 52 ARG CD C -12.650 -0.549 -0.723 1.00 . A B . 52 ARG CD 1 1 6 4959 1 1 52 ARG CG C -12.424 -1.912 -1.358 1.00 . A B . 52 ARG CG 1 1 6 4960 1 1 52 ARG CZ C -14.580 0.857 -0.115 1.00 . A B . 52 ARG CZ 1 1 6 4961 1 1 52 ARG H H -10.991 -4.001 -0.346 1.00 . A B . 52 ARG H 1 1 6 4962 1 1 52 ARG HA H -13.617 -5.089 -0.646 1.00 . A B . 52 ARG HA 1 1 6 4963 1 1 52 ARG HB2 H -14.322 -2.797 -1.036 1.00 . A B . 52 ARG HB2 1 1 6 4964 1 1 52 ARG HB3 H -13.241 -2.873 0.345 1.00 . A B . 52 ARG HB3 1 1 6 4965 1 1 52 ARG HD2 H -12.409 -0.612 0.327 1.00 . A B . 52 ARG HD2 1 1 6 4966 1 1 52 ARG HD3 H -11.997 0.167 -1.200 1.00 . A B . 52 ARG HD3 1 1 6 4967 1 1 52 ARG HE H -14.577 -0.525 -1.566 1.00 . A B . 52 ARG HE 1 1 6 4968 1 1 52 ARG HG2 H -11.389 -2.191 -1.228 1.00 . A B . 52 ARG HG2 1 1 6 4969 1 1 52 ARG HG3 H -12.650 -1.850 -2.413 1.00 . A B . 52 ARG HG3 1 1 6 4970 1 1 52 ARG HH11 H -12.924 1.156 1.022 1.00 . A B . 52 ARG HH11 1 1 6 4971 1 1 52 ARG HH12 H -14.286 2.157 1.411 1.00 . A B . 52 ARG HH12 1 1 6 4972 1 1 52 ARG HH21 H -16.381 0.787 -1.046 1.00 . A B . 52 ARG HH21 1 1 6 4973 1 1 52 ARG HH22 H -16.252 1.943 0.243 1.00 . A B . 52 ARG HH22 1 1 6 4974 1 1 52 ARG N N -11.595 -4.731 -0.592 1.00 . A B . 52 ARG N 1 1 6 4975 1 1 52 ARG NE N -14.032 -0.098 -0.865 1.00 . A B . 52 ARG NE 1 1 6 4976 1 1 52 ARG NH1 N -13.875 1.436 0.850 1.00 . A B . 52 ARG NH1 1 1 6 4977 1 1 52 ARG NH2 N -15.838 1.226 -0.322 1.00 . A B . 52 ARG NH2 1 1 6 4978 1 1 52 ARG O O -13.994 -4.309 -3.260 1.00 . A B . 52 ARG O 1 1 6 4979 1 1 53 MET C C -12.120 -6.952 -4.795 1.00 . A B . 53 MET C 1 1 6 4980 1 1 53 MET CA C -11.863 -5.462 -4.611 1.00 . A B . 53 MET CA 1 1 6 4981 1 1 53 MET CB C -10.521 -5.069 -5.236 1.00 . A B . 53 MET CB 1 1 6 4982 1 1 53 MET CE C -8.648 -3.954 -7.585 1.00 . A B . 53 MET CE 1 1 6 4983 1 1 53 MET CG C -10.354 -3.568 -5.421 1.00 . A B . 53 MET CG 1 1 6 4984 1 1 53 MET H H -11.121 -5.324 -2.633 1.00 . A B . 53 MET H 1 1 6 4985 1 1 53 MET HA H -12.655 -4.915 -5.099 1.00 . A B . 53 MET HA 1 1 6 4986 1 1 53 MET HB2 H -9.723 -5.424 -4.599 1.00 . A B . 53 MET HB2 1 1 6 4987 1 1 53 MET HB3 H -10.435 -5.541 -6.203 1.00 . A B . 53 MET HB3 1 1 6 4988 1 1 53 MET HE1 H -7.712 -3.734 -8.076 1.00 . A B . 53 MET HE1 1 1 6 4989 1 1 53 MET HE2 H -9.467 -3.619 -8.204 1.00 . A B . 53 MET HE2 1 1 6 4990 1 1 53 MET HE3 H -8.729 -5.018 -7.425 1.00 . A B . 53 MET HE3 1 1 6 4991 1 1 53 MET HG2 H -11.082 -3.226 -6.141 1.00 . A B . 53 MET HG2 1 1 6 4992 1 1 53 MET HG3 H -10.532 -3.082 -4.473 1.00 . A B . 53 MET HG3 1 1 6 4993 1 1 53 MET N N -11.902 -5.128 -3.194 1.00 . A B . 53 MET N 1 1 6 4994 1 1 53 MET O O -12.261 -7.442 -5.918 1.00 . A B . 53 MET O 1 1 6 4995 1 1 53 MET SD S -8.708 -3.108 -6.007 1.00 . A B . 53 MET SD 1 1 6 4996 1 1 54 LYS C C -13.905 -9.240 -4.312 1.00 . A B . 54 LYS C 1 1 6 4997 1 1 54 LYS CA C -12.534 -9.078 -3.667 1.00 . A B . 54 LYS CA 1 1 6 4998 1 1 54 LYS CB C -12.569 -9.617 -2.232 1.00 . A B . 54 LYS CB 1 1 6 4999 1 1 54 LYS CD C -11.453 -11.857 -2.550 1.00 . A B . 54 LYS CD 1 1 6 5000 1 1 54 LYS CE C -10.329 -11.616 -1.551 1.00 . A B . 54 LYS CE 1 1 6 5001 1 1 54 LYS CG C -12.728 -11.128 -2.146 1.00 . A B . 54 LYS CG 1 1 6 5002 1 1 54 LYS H H -11.882 -7.247 -2.833 1.00 . A B . 54 LYS H 1 1 6 5003 1 1 54 LYS HA H -11.805 -9.628 -4.241 1.00 . A B . 54 LYS HA 1 1 6 5004 1 1 54 LYS HB2 H -11.650 -9.345 -1.733 1.00 . A B . 54 LYS HB2 1 1 6 5005 1 1 54 LYS HB3 H -13.398 -9.158 -1.711 1.00 . A B . 54 LYS HB3 1 1 6 5006 1 1 54 LYS HD2 H -11.656 -12.916 -2.597 1.00 . A B . 54 LYS HD2 1 1 6 5007 1 1 54 LYS HD3 H -11.141 -11.504 -3.522 1.00 . A B . 54 LYS HD3 1 1 6 5008 1 1 54 LYS HE2 H -10.130 -10.557 -1.500 1.00 . A B . 54 LYS HE2 1 1 6 5009 1 1 54 LYS HE3 H -10.645 -11.969 -0.580 1.00 . A B . 54 LYS HE3 1 1 6 5010 1 1 54 LYS HG2 H -12.975 -11.394 -1.130 1.00 . A B . 54 LYS HG2 1 1 6 5011 1 1 54 LYS HG3 H -13.530 -11.433 -2.803 1.00 . A B . 54 LYS HG3 1 1 6 5012 1 1 54 LYS HZ1 H -8.355 -12.198 -1.202 1.00 . A B . 54 LYS HZ1 1 1 6 5013 1 1 54 LYS HZ2 H -8.714 -11.938 -2.832 1.00 . A B . 54 LYS HZ2 1 1 6 5014 1 1 54 LYS HZ3 H -9.264 -13.336 -2.060 1.00 . A B . 54 LYS HZ3 1 1 6 5015 1 1 54 LYS N N -12.155 -7.671 -3.673 1.00 . A B . 54 LYS N 1 1 6 5016 1 1 54 LYS NZ N -9.080 -12.321 -1.938 1.00 . A B . 54 LYS NZ 1 1 6 5017 1 1 54 LYS O O -14.106 -10.108 -5.164 1.00 . A B . 54 LYS O 1 1 6 5018 1 1 55 GLU C C -16.089 -7.732 -5.887 1.00 . A B . 55 GLU C 1 1 6 5019 1 1 55 GLU CA C -16.163 -8.353 -4.498 1.00 . A B . 55 GLU CA 1 1 6 5020 1 1 55 GLU CB C -17.127 -7.560 -3.613 1.00 . A B . 55 GLU CB 1 1 6 5021 1 1 55 GLU CD C -19.471 -6.686 -3.278 1.00 . A B . 55 GLU CD 1 1 6 5022 1 1 55 GLU CG C -18.552 -7.522 -4.142 1.00 . A B . 55 GLU CG 1 1 6 5023 1 1 55 GLU H H -14.627 -7.761 -3.182 1.00 . A B . 55 GLU H 1 1 6 5024 1 1 55 GLU HA H -16.515 -9.368 -4.583 1.00 . A B . 55 GLU HA 1 1 6 5025 1 1 55 GLU HB2 H -17.144 -8.009 -2.633 1.00 . A B . 55 GLU HB2 1 1 6 5026 1 1 55 GLU HB3 H -16.770 -6.546 -3.530 1.00 . A B . 55 GLU HB3 1 1 6 5027 1 1 55 GLU HG2 H -18.542 -7.104 -5.137 1.00 . A B . 55 GLU HG2 1 1 6 5028 1 1 55 GLU HG3 H -18.935 -8.531 -4.179 1.00 . A B . 55 GLU HG3 1 1 6 5029 1 1 55 GLU N N -14.838 -8.386 -3.903 1.00 . A B . 55 GLU N 1 1 6 5030 1 1 55 GLU O O -16.269 -6.525 -6.056 1.00 . A B . 55 GLU O 1 1 6 5031 1 1 55 GLU OE1 O -20.083 -7.237 -2.336 1.00 . A B . 55 GLU OE1 1 1 6 5032 1 1 55 GLU OE2 O -19.588 -5.472 -3.535 1.00 . A B . 55 GLU OE2 1 1 6 5033 1 1 56 SER C C -17.039 -8.276 -8.934 1.00 . A B . 56 SER C 1 1 6 5034 1 1 56 SER CA C -15.693 -8.106 -8.243 1.00 . A B . 56 SER CA 1 1 6 5035 1 1 56 SER CB C -14.603 -8.886 -8.978 1.00 . A B . 56 SER CB 1 1 6 5036 1 1 56 SER H H -15.624 -9.505 -6.664 1.00 . A B . 56 SER H 1 1 6 5037 1 1 56 SER HA H -15.434 -7.059 -8.233 1.00 . A B . 56 SER HA 1 1 6 5038 1 1 56 SER HB2 H -14.903 -9.918 -9.083 1.00 . A B . 56 SER HB2 1 1 6 5039 1 1 56 SER HB3 H -14.449 -8.453 -9.955 1.00 . A B . 56 SER HB3 1 1 6 5040 1 1 56 SER HG H -13.571 -8.666 -7.323 1.00 . A B . 56 SER HG 1 1 6 5041 1 1 56 SER N N -15.784 -8.557 -6.870 1.00 . A B . 56 SER N 1 1 6 5042 1 1 56 SER O O -17.811 -7.295 -8.973 1.00 . A B . 56 SER O 1 1 6 5043 1 1 56 SER OXT O -17.335 -9.394 -9.403 1.00 . A B . 56 SER OXT 1 1 6 5044 1 1 56 SER OG O -13.381 -8.831 -8.256 1.00 . A B . 56 SER OG 1 1 6 5045 2 2 1 ZN ZN ZN -6.470 -6.223 2.320 1.00 . B B . 101 ZN ZN 1 1 6 5046 3 2 1 ZN ZN ZN 5.734 1.081 -0.046 1.00 . C B . 102 ZN ZN 1 1 7 5047 1 1 1 GLY C C 10.932 -3.415 12.214 1.00 . A B . 1 GLY C 1 1 7 5048 1 1 1 GLY CA C 10.076 -3.539 13.455 1.00 . A B . 1 GLY CA 1 1 7 5049 1 1 1 GLY H1 H 9.485 -1.545 13.521 1.00 . A B . 1 GLY H1 1 1 7 5050 1 1 1 GLY H2 H 8.473 -2.589 14.382 1.00 . A B . 1 GLY H2 1 1 7 5051 1 1 1 GLY H3 H 8.411 -2.553 12.693 1.00 . A B . 1 GLY H3 1 1 7 5052 1 1 1 GLY HA2 H 10.709 -3.462 14.326 1.00 . A B . 1 GLY HA2 1 1 7 5053 1 1 1 GLY HA3 H 9.594 -4.505 13.456 1.00 . A B . 1 GLY HA3 1 1 7 5054 1 1 1 GLY N N 9.039 -2.484 13.518 1.00 . A B . 1 GLY N 1 1 7 5055 1 1 1 GLY O O 10.469 -3.690 11.106 1.00 . A B . 1 GLY O 1 1 7 5056 1 1 2 ALA C C 13.607 -4.126 10.744 1.00 . A B . 2 ALA C 1 1 7 5057 1 1 2 ALA CA C 13.084 -2.796 11.275 1.00 . A B . 2 ALA CA 1 1 7 5058 1 1 2 ALA CB C 14.239 -1.892 11.679 1.00 . A B . 2 ALA CB 1 1 7 5059 1 1 2 ALA H H 12.490 -2.803 13.307 1.00 . A B . 2 ALA H 1 1 7 5060 1 1 2 ALA HA H 12.532 -2.303 10.488 1.00 . A B . 2 ALA HA 1 1 7 5061 1 1 2 ALA HB1 H 13.851 -0.980 12.109 1.00 . A B . 2 ALA HB1 1 1 7 5062 1 1 2 ALA HB2 H 14.834 -1.655 10.809 1.00 . A B . 2 ALA HB2 1 1 7 5063 1 1 2 ALA HB3 H 14.855 -2.399 12.408 1.00 . A B . 2 ALA HB3 1 1 7 5064 1 1 2 ALA N N 12.176 -2.993 12.395 1.00 . A B . 2 ALA N 1 1 7 5065 1 1 2 ALA O O 13.997 -4.231 9.583 1.00 . A B . 2 ALA O 1 1 7 5066 1 1 3 MET C C 12.943 -7.369 10.823 1.00 . A B . 3 MET C 1 1 7 5067 1 1 3 MET CA C 14.100 -6.459 11.210 1.00 . A B . 3 MET CA 1 1 7 5068 1 1 3 MET CB C 14.913 -7.091 12.344 1.00 . A B . 3 MET CB 1 1 7 5069 1 1 3 MET CE C 17.433 -8.776 13.363 1.00 . A B . 3 MET CE 1 1 7 5070 1 1 3 MET CG C 16.233 -6.385 12.612 1.00 . A B . 3 MET CG 1 1 7 5071 1 1 3 MET H H 13.263 -5.003 12.504 1.00 . A B . 3 MET H 1 1 7 5072 1 1 3 MET HA H 14.741 -6.330 10.351 1.00 . A B . 3 MET HA 1 1 7 5073 1 1 3 MET HB2 H 14.325 -7.068 13.251 1.00 . A B . 3 MET HB2 1 1 7 5074 1 1 3 MET HB3 H 15.123 -8.119 12.090 1.00 . A B . 3 MET HB3 1 1 7 5075 1 1 3 MET HE1 H 16.485 -9.268 13.207 1.00 . A B . 3 MET HE1 1 1 7 5076 1 1 3 MET HE2 H 18.014 -9.334 14.082 1.00 . A B . 3 MET HE2 1 1 7 5077 1 1 3 MET HE3 H 17.971 -8.725 12.427 1.00 . A B . 3 MET HE3 1 1 7 5078 1 1 3 MET HG2 H 16.842 -6.439 11.722 1.00 . A B . 3 MET HG2 1 1 7 5079 1 1 3 MET HG3 H 16.032 -5.351 12.846 1.00 . A B . 3 MET HG3 1 1 7 5080 1 1 3 MET N N 13.610 -5.141 11.597 1.00 . A B . 3 MET N 1 1 7 5081 1 1 3 MET O O 12.709 -8.405 11.449 1.00 . A B . 3 MET O 1 1 7 5082 1 1 3 MET SD S 17.154 -7.117 13.980 1.00 . A B . 3 MET SD 1 1 7 5083 1 1 4 GLY C C 10.989 -7.780 7.824 1.00 . A B . 4 GLY C 1 1 7 5084 1 1 4 GLY CA C 11.100 -7.769 9.331 1.00 . A B . 4 GLY CA 1 1 7 5085 1 1 4 GLY H H 12.464 -6.157 9.310 1.00 . A B . 4 GLY H 1 1 7 5086 1 1 4 GLY HA2 H 11.218 -8.784 9.683 1.00 . A B . 4 GLY HA2 1 1 7 5087 1 1 4 GLY HA3 H 10.192 -7.357 9.745 1.00 . A B . 4 GLY HA3 1 1 7 5088 1 1 4 GLY N N 12.223 -6.982 9.784 1.00 . A B . 4 GLY N 1 1 7 5089 1 1 4 GLY O O 11.855 -7.247 7.131 1.00 . A B . 4 GLY O 1 1 7 5090 1 1 5 MET C C 9.185 -7.151 5.335 1.00 . A B . 5 MET C 1 1 7 5091 1 1 5 MET CA C 9.693 -8.479 5.886 1.00 . A B . 5 MET CA 1 1 7 5092 1 1 5 MET CB C 8.686 -9.593 5.586 1.00 . A B . 5 MET CB 1 1 7 5093 1 1 5 MET CE C 5.758 -10.359 4.673 1.00 . A B . 5 MET CE 1 1 7 5094 1 1 5 MET CG C 8.407 -9.785 4.100 1.00 . A B . 5 MET CG 1 1 7 5095 1 1 5 MET H H 9.258 -8.758 7.932 1.00 . A B . 5 MET H 1 1 7 5096 1 1 5 MET HA H 10.636 -8.716 5.414 1.00 . A B . 5 MET HA 1 1 7 5097 1 1 5 MET HB2 H 9.064 -10.523 5.982 1.00 . A B . 5 MET HB2 1 1 7 5098 1 1 5 MET HB3 H 7.753 -9.358 6.076 1.00 . A B . 5 MET HB3 1 1 7 5099 1 1 5 MET HE1 H 5.521 -9.381 4.280 1.00 . A B . 5 MET HE1 1 1 7 5100 1 1 5 MET HE2 H 6.006 -10.278 5.719 1.00 . A B . 5 MET HE2 1 1 7 5101 1 1 5 MET HE3 H 4.904 -11.010 4.555 1.00 . A B . 5 MET HE3 1 1 7 5102 1 1 5 MET HG2 H 8.065 -8.847 3.690 1.00 . A B . 5 MET HG2 1 1 7 5103 1 1 5 MET HG3 H 9.324 -10.077 3.610 1.00 . A B . 5 MET HG3 1 1 7 5104 1 1 5 MET N N 9.922 -8.378 7.320 1.00 . A B . 5 MET N 1 1 7 5105 1 1 5 MET O O 7.977 -6.929 5.225 1.00 . A B . 5 MET O 1 1 7 5106 1 1 5 MET SD S 7.154 -11.040 3.779 1.00 . A B . 5 MET SD 1 1 7 5107 1 1 6 ARG C C 10.621 -4.671 3.238 1.00 . A B . 6 ARG C 1 1 7 5108 1 1 6 ARG CA C 9.761 -4.965 4.457 1.00 . A B . 6 ARG CA 1 1 7 5109 1 1 6 ARG CB C 9.978 -3.855 5.487 1.00 . A B . 6 ARG CB 1 1 7 5110 1 1 6 ARG CD C 9.700 -2.994 7.817 1.00 . A B . 6 ARG CD 1 1 7 5111 1 1 6 ARG CG C 9.415 -4.147 6.869 1.00 . A B . 6 ARG CG 1 1 7 5112 1 1 6 ARG CZ C 11.600 -1.526 8.390 1.00 . A B . 6 ARG CZ 1 1 7 5113 1 1 6 ARG H H 11.059 -6.485 5.149 1.00 . A B . 6 ARG H 1 1 7 5114 1 1 6 ARG HA H 8.722 -4.988 4.166 1.00 . A B . 6 ARG HA 1 1 7 5115 1 1 6 ARG HB2 H 11.038 -3.685 5.591 1.00 . A B . 6 ARG HB2 1 1 7 5116 1 1 6 ARG HB3 H 9.515 -2.951 5.121 1.00 . A B . 6 ARG HB3 1 1 7 5117 1 1 6 ARG HD2 H 9.091 -2.148 7.531 1.00 . A B . 6 ARG HD2 1 1 7 5118 1 1 6 ARG HD3 H 9.447 -3.297 8.823 1.00 . A B . 6 ARG HD3 1 1 7 5119 1 1 6 ARG HE H 11.722 -3.164 7.253 1.00 . A B . 6 ARG HE 1 1 7 5120 1 1 6 ARG HG2 H 8.346 -4.288 6.793 1.00 . A B . 6 ARG HG2 1 1 7 5121 1 1 6 ARG HG3 H 9.876 -5.044 7.254 1.00 . A B . 6 ARG HG3 1 1 7 5122 1 1 6 ARG HH11 H 9.836 -0.967 9.213 1.00 . A B . 6 ARG HH11 1 1 7 5123 1 1 6 ARG HH12 H 11.187 0.051 9.589 1.00 . A B . 6 ARG HH12 1 1 7 5124 1 1 6 ARG HH21 H 13.490 -1.806 7.713 1.00 . A B . 6 ARG HH21 1 1 7 5125 1 1 6 ARG HH22 H 13.256 -0.415 8.725 1.00 . A B . 6 ARG HH22 1 1 7 5126 1 1 6 ARG N N 10.110 -6.262 5.011 1.00 . A B . 6 ARG N 1 1 7 5127 1 1 6 ARG NE N 11.109 -2.600 7.780 1.00 . A B . 6 ARG NE 1 1 7 5128 1 1 6 ARG NH1 N 10.811 -0.751 9.120 1.00 . A B . 6 ARG NH1 1 1 7 5129 1 1 6 ARG NH2 N 12.883 -1.223 8.268 1.00 . A B . 6 ARG NH2 1 1 7 5130 1 1 6 ARG O O 11.776 -4.261 3.369 1.00 . A B . 6 ARG O 1 1 7 5131 1 1 7 ASN C C 10.412 -3.136 0.398 1.00 . A B . 7 ASN C 1 1 7 5132 1 1 7 ASN CA C 10.796 -4.542 0.835 1.00 . A B . 7 ASN CA 1 1 7 5133 1 1 7 ASN CB C 10.520 -5.541 -0.289 1.00 . A B . 7 ASN CB 1 1 7 5134 1 1 7 ASN CG C 11.375 -5.266 -1.519 1.00 . A B . 7 ASN CG 1 1 7 5135 1 1 7 ASN H H 9.181 -5.281 1.996 1.00 . A B . 7 ASN H 1 1 7 5136 1 1 7 ASN HA H 11.852 -4.554 1.064 1.00 . A B . 7 ASN HA 1 1 7 5137 1 1 7 ASN HB2 H 10.736 -6.539 0.063 1.00 . A B . 7 ASN HB2 1 1 7 5138 1 1 7 ASN HB3 H 9.482 -5.476 -0.572 1.00 . A B . 7 ASN HB3 1 1 7 5139 1 1 7 ASN HD21 H 9.955 -5.965 -2.722 1.00 . A B . 7 ASN HD21 1 1 7 5140 1 1 7 ASN HD22 H 11.396 -5.405 -3.504 1.00 . A B . 7 ASN HD22 1 1 7 5141 1 1 7 ASN N N 10.078 -4.887 2.054 1.00 . A B . 7 ASN N 1 1 7 5142 1 1 7 ASN ND2 N 10.856 -5.578 -2.696 1.00 . A B . 7 ASN ND2 1 1 7 5143 1 1 7 ASN O O 9.739 -2.939 -0.613 1.00 . A B . 7 ASN O 1 1 7 5144 1 1 7 ASN OD1 O 12.494 -4.763 -1.408 1.00 . A B . 7 ASN OD1 1 1 7 5145 1 1 8 LEU C C 11.730 -0.071 0.300 1.00 . A B . 8 LEU C 1 1 7 5146 1 1 8 LEU CA C 10.523 -0.769 0.909 1.00 . A B . 8 LEU CA 1 1 7 5147 1 1 8 LEU CB C 10.056 -0.037 2.180 1.00 . A B . 8 LEU CB 1 1 7 5148 1 1 8 LEU CD1 C 10.545 1.132 4.344 1.00 . A B . 8 LEU CD1 1 1 7 5149 1 1 8 LEU CD2 C 11.752 -0.974 3.805 1.00 . A B . 8 LEU CD2 1 1 7 5150 1 1 8 LEU CG C 11.134 0.289 3.226 1.00 . A B . 8 LEU CG 1 1 7 5151 1 1 8 LEU H H 11.368 -2.390 1.974 1.00 . A B . 8 LEU H 1 1 7 5152 1 1 8 LEU HA H 9.724 -0.759 0.185 1.00 . A B . 8 LEU HA 1 1 7 5153 1 1 8 LEU HB2 H 9.596 0.894 1.880 1.00 . A B . 8 LEU HB2 1 1 7 5154 1 1 8 LEU HB3 H 9.301 -0.646 2.656 1.00 . A B . 8 LEU HB3 1 1 7 5155 1 1 8 LEU HD11 H 10.199 2.073 3.943 1.00 . A B . 8 LEU HD11 1 1 7 5156 1 1 8 LEU HD12 H 11.301 1.317 5.094 1.00 . A B . 8 LEU HD12 1 1 7 5157 1 1 8 LEU HD13 H 9.715 0.606 4.793 1.00 . A B . 8 LEU HD13 1 1 7 5158 1 1 8 LEU HD21 H 12.430 -0.711 4.604 1.00 . A B . 8 LEU HD21 1 1 7 5159 1 1 8 LEU HD22 H 12.294 -1.495 3.031 1.00 . A B . 8 LEU HD22 1 1 7 5160 1 1 8 LEU HD23 H 10.971 -1.612 4.191 1.00 . A B . 8 LEU HD23 1 1 7 5161 1 1 8 LEU HG H 11.920 0.863 2.755 1.00 . A B . 8 LEU HG 1 1 7 5162 1 1 8 LEU N N 10.833 -2.163 1.185 1.00 . A B . 8 LEU N 1 1 7 5163 1 1 8 LEU O O 11.723 1.139 0.085 1.00 . A B . 8 LEU O 1 1 7 5164 1 1 9 ASP C C 13.735 0.061 -2.041 1.00 . A B . 9 ASP C 1 1 7 5165 1 1 9 ASP CA C 13.976 -0.328 -0.589 1.00 . A B . 9 ASP CA 1 1 7 5166 1 1 9 ASP CB C 15.102 -1.362 -0.496 1.00 . A B . 9 ASP CB 1 1 7 5167 1 1 9 ASP CG C 15.491 -1.672 0.935 1.00 . A B . 9 ASP CG 1 1 7 5168 1 1 9 ASP H H 12.675 -1.816 0.167 1.00 . A B . 9 ASP H 1 1 7 5169 1 1 9 ASP HA H 14.258 0.552 -0.035 1.00 . A B . 9 ASP HA 1 1 7 5170 1 1 9 ASP HB2 H 14.778 -2.278 -0.966 1.00 . A B . 9 ASP HB2 1 1 7 5171 1 1 9 ASP HB3 H 15.970 -0.983 -1.013 1.00 . A B . 9 ASP HB3 1 1 7 5172 1 1 9 ASP N N 12.751 -0.855 -0.003 1.00 . A B . 9 ASP N 1 1 7 5173 1 1 9 ASP O O 14.359 0.983 -2.569 1.00 . A B . 9 ASP O 1 1 7 5174 1 1 9 ASP OD1 O 16.271 -0.896 1.526 1.00 . A B . 9 ASP OD1 1 1 7 5175 1 1 9 ASP OD2 O 15.016 -2.688 1.481 1.00 . A B . 9 ASP OD2 1 1 7 5176 1 1 10 GLU C C 11.258 0.623 -4.077 1.00 . A B . 10 GLU C 1 1 7 5177 1 1 10 GLU CA C 12.431 -0.349 -4.052 1.00 . A B . 10 GLU CA 1 1 7 5178 1 1 10 GLU CB C 12.056 -1.633 -4.796 1.00 . A B . 10 GLU CB 1 1 7 5179 1 1 10 GLU CD C 12.762 -3.926 -5.577 1.00 . A B . 10 GLU CD 1 1 7 5180 1 1 10 GLU CG C 13.177 -2.658 -4.859 1.00 . A B . 10 GLU CG 1 1 7 5181 1 1 10 GLU H H 12.389 -1.395 -2.209 1.00 . A B . 10 GLU H 1 1 7 5182 1 1 10 GLU HA H 13.275 0.109 -4.540 1.00 . A B . 10 GLU HA 1 1 7 5183 1 1 10 GLU HB2 H 11.208 -2.086 -4.304 1.00 . A B . 10 GLU HB2 1 1 7 5184 1 1 10 GLU HB3 H 11.776 -1.376 -5.807 1.00 . A B . 10 GLU HB3 1 1 7 5185 1 1 10 GLU HG2 H 14.015 -2.224 -5.384 1.00 . A B . 10 GLU HG2 1 1 7 5186 1 1 10 GLU HG3 H 13.474 -2.910 -3.852 1.00 . A B . 10 GLU HG3 1 1 7 5187 1 1 10 GLU N N 12.813 -0.646 -2.677 1.00 . A B . 10 GLU N 1 1 7 5188 1 1 10 GLU O O 10.800 1.039 -5.138 1.00 . A B . 10 GLU O 1 1 7 5189 1 1 10 GLU OE1 O 12.892 -3.986 -6.818 1.00 . A B . 10 GLU OE1 1 1 7 5190 1 1 10 GLU OE2 O 12.309 -4.877 -4.905 1.00 . A B . 10 GLU OE2 1 1 7 5191 1 1 11 CYS C C 10.052 3.253 -2.371 1.00 . A B . 11 CYS C 1 1 7 5192 1 1 11 CYS CA C 9.630 1.848 -2.778 1.00 . A B . 11 CYS CA 1 1 7 5193 1 1 11 CYS CB C 8.653 1.283 -1.758 1.00 . A B . 11 CYS CB 1 1 7 5194 1 1 11 CYS H H 11.251 0.694 -2.091 1.00 . A B . 11 CYS H 1 1 7 5195 1 1 11 CYS HA H 9.147 1.891 -3.741 1.00 . A B . 11 CYS HA 1 1 7 5196 1 1 11 CYS HB2 H 8.443 0.256 -2.006 1.00 . A B . 11 CYS HB2 1 1 7 5197 1 1 11 CYS HB3 H 9.107 1.325 -0.780 1.00 . A B . 11 CYS HB3 1 1 7 5198 1 1 11 CYS N N 10.783 0.982 -2.898 1.00 . A B . 11 CYS N 1 1 7 5199 1 1 11 CYS O O 10.247 3.536 -1.185 1.00 . A B . 11 CYS O 1 1 7 5200 1 1 11 CYS SG S 7.078 2.167 -1.670 1.00 . A B . 11 CYS SG 1 1 7 5201 1 1 12 GLU C C 9.432 6.208 -2.302 1.00 . A B . 12 GLU C 1 1 7 5202 1 1 12 GLU CA C 10.534 5.517 -3.083 1.00 . A B . 12 GLU CA 1 1 7 5203 1 1 12 GLU CB C 10.802 6.276 -4.381 1.00 . A B . 12 GLU CB 1 1 7 5204 1 1 12 GLU CD C 13.305 6.312 -4.097 1.00 . A B . 12 GLU CD 1 1 7 5205 1 1 12 GLU CG C 12.147 5.957 -5.009 1.00 . A B . 12 GLU CG 1 1 7 5206 1 1 12 GLU H H 10.032 3.840 -4.274 1.00 . A B . 12 GLU H 1 1 7 5207 1 1 12 GLU HA H 11.431 5.520 -2.485 1.00 . A B . 12 GLU HA 1 1 7 5208 1 1 12 GLU HB2 H 10.027 6.033 -5.093 1.00 . A B . 12 GLU HB2 1 1 7 5209 1 1 12 GLU HB3 H 10.769 7.335 -4.174 1.00 . A B . 12 GLU HB3 1 1 7 5210 1 1 12 GLU HG2 H 12.188 4.901 -5.228 1.00 . A B . 12 GLU HG2 1 1 7 5211 1 1 12 GLU HG3 H 12.244 6.519 -5.926 1.00 . A B . 12 GLU HG3 1 1 7 5212 1 1 12 GLU N N 10.183 4.130 -3.349 1.00 . A B . 12 GLU N 1 1 7 5213 1 1 12 GLU O O 9.683 7.161 -1.569 1.00 . A B . 12 GLU O 1 1 7 5214 1 1 12 GLU OE1 O 13.444 7.503 -3.749 1.00 . A B . 12 GLU OE1 1 1 7 5215 1 1 12 GLU OE2 O 14.079 5.403 -3.724 1.00 . A B . 12 GLU OE2 1 1 7 5216 1 1 13 VAL C C 7.159 6.060 -0.257 1.00 . A B . 13 VAL C 1 1 7 5217 1 1 13 VAL CA C 7.087 6.316 -1.756 1.00 . A B . 13 VAL CA 1 1 7 5218 1 1 13 VAL CB C 5.751 5.814 -2.326 1.00 . A B . 13 VAL CB 1 1 7 5219 1 1 13 VAL CG1 C 4.586 6.448 -1.592 1.00 . A B . 13 VAL CG1 1 1 7 5220 1 1 13 VAL CG2 C 5.670 6.111 -3.811 1.00 . A B . 13 VAL CG2 1 1 7 5221 1 1 13 VAL H H 8.065 4.915 -2.991 1.00 . A B . 13 VAL H 1 1 7 5222 1 1 13 VAL HA H 7.141 7.379 -1.923 1.00 . A B . 13 VAL HA 1 1 7 5223 1 1 13 VAL HB H 5.703 4.744 -2.189 1.00 . A B . 13 VAL HB 1 1 7 5224 1 1 13 VAL HG11 H 4.750 7.513 -1.510 1.00 . A B . 13 VAL HG11 1 1 7 5225 1 1 13 VAL HG12 H 4.506 6.015 -0.608 1.00 . A B . 13 VAL HG12 1 1 7 5226 1 1 13 VAL HG13 H 3.675 6.267 -2.140 1.00 . A B . 13 VAL HG13 1 1 7 5227 1 1 13 VAL HG21 H 5.735 7.177 -3.966 1.00 . A B . 13 VAL HG21 1 1 7 5228 1 1 13 VAL HG22 H 4.731 5.746 -4.199 1.00 . A B . 13 VAL HG22 1 1 7 5229 1 1 13 VAL HG23 H 6.486 5.622 -4.319 1.00 . A B . 13 VAL HG23 1 1 7 5230 1 1 13 VAL N N 8.214 5.712 -2.434 1.00 . A B . 13 VAL N 1 1 7 5231 1 1 13 VAL O O 7.033 6.988 0.533 1.00 . A B . 13 VAL O 1 1 7 5232 1 1 14 CYS C C 8.803 5.249 2.087 1.00 . A B . 14 CYS C 1 1 7 5233 1 1 14 CYS CA C 7.596 4.493 1.552 1.00 . A B . 14 CYS CA 1 1 7 5234 1 1 14 CYS CB C 7.804 2.995 1.772 1.00 . A B . 14 CYS CB 1 1 7 5235 1 1 14 CYS H H 7.462 4.096 -0.538 1.00 . A B . 14 CYS H 1 1 7 5236 1 1 14 CYS HA H 6.717 4.811 2.090 1.00 . A B . 14 CYS HA 1 1 7 5237 1 1 14 CYS HB2 H 8.346 2.596 0.929 1.00 . A B . 14 CYS HB2 1 1 7 5238 1 1 14 CYS HB3 H 8.389 2.852 2.668 1.00 . A B . 14 CYS HB3 1 1 7 5239 1 1 14 CYS N N 7.400 4.811 0.136 1.00 . A B . 14 CYS N 1 1 7 5240 1 1 14 CYS O O 8.837 5.666 3.245 1.00 . A B . 14 CYS O 1 1 7 5241 1 1 14 CYS SG S 6.284 2.031 1.945 1.00 . A B . 14 CYS SG 1 1 7 5242 1 1 15 ARG C C 10.724 7.608 1.838 1.00 . A B . 15 ARG C 1 1 7 5243 1 1 15 ARG CA C 11.007 6.132 1.560 1.00 . A B . 15 ARG CA 1 1 7 5244 1 1 15 ARG CB C 12.002 5.974 0.412 1.00 . A B . 15 ARG CB 1 1 7 5245 1 1 15 ARG CD C 14.277 6.353 -0.529 1.00 . A B . 15 ARG CD 1 1 7 5246 1 1 15 ARG CG C 13.362 6.592 0.658 1.00 . A B . 15 ARG CG 1 1 7 5247 1 1 15 ARG CZ C 16.569 6.890 -1.238 1.00 . A B . 15 ARG CZ 1 1 7 5248 1 1 15 ARG H H 9.663 5.095 0.301 1.00 . A B . 15 ARG H 1 1 7 5249 1 1 15 ARG HA H 11.410 5.678 2.448 1.00 . A B . 15 ARG HA 1 1 7 5250 1 1 15 ARG HB2 H 12.143 4.921 0.222 1.00 . A B . 15 ARG HB2 1 1 7 5251 1 1 15 ARG HB3 H 11.580 6.432 -0.470 1.00 . A B . 15 ARG HB3 1 1 7 5252 1 1 15 ARG HD2 H 14.386 5.289 -0.673 1.00 . A B . 15 ARG HD2 1 1 7 5253 1 1 15 ARG HD3 H 13.824 6.789 -1.407 1.00 . A B . 15 ARG HD3 1 1 7 5254 1 1 15 ARG HE H 15.764 7.393 0.523 1.00 . A B . 15 ARG HE 1 1 7 5255 1 1 15 ARG HG2 H 13.243 7.654 0.804 1.00 . A B . 15 ARG HG2 1 1 7 5256 1 1 15 ARG HG3 H 13.801 6.147 1.539 1.00 . A B . 15 ARG HG3 1 1 7 5257 1 1 15 ARG HH11 H 15.469 5.910 -2.644 1.00 . A B . 15 ARG HH11 1 1 7 5258 1 1 15 ARG HH12 H 17.111 6.275 -3.093 1.00 . A B . 15 ARG HH12 1 1 7 5259 1 1 15 ARG HH21 H 17.897 7.880 -0.074 1.00 . A B . 15 ARG HH21 1 1 7 5260 1 1 15 ARG HH22 H 18.484 7.406 -1.639 1.00 . A B . 15 ARG HH22 1 1 7 5261 1 1 15 ARG N N 9.778 5.438 1.213 1.00 . A B . 15 ARG N 1 1 7 5262 1 1 15 ARG NE N 15.594 6.938 -0.336 1.00 . A B . 15 ARG NE 1 1 7 5263 1 1 15 ARG NH1 N 16.368 6.313 -2.419 1.00 . A B . 15 ARG NH1 1 1 7 5264 1 1 15 ARG NH2 N 17.744 7.433 -0.962 1.00 . A B . 15 ARG NH2 1 1 7 5265 1 1 15 ARG O O 11.300 8.202 2.748 1.00 . A B . 15 ARG O 1 1 7 5266 1 1 16 ASP C C 8.320 9.644 2.390 1.00 . A B . 16 ASP C 1 1 7 5267 1 1 16 ASP CA C 9.370 9.562 1.283 1.00 . A B . 16 ASP CA 1 1 7 5268 1 1 16 ASP CB C 8.806 10.171 -0.006 1.00 . A B . 16 ASP CB 1 1 7 5269 1 1 16 ASP CG C 9.886 10.681 -0.943 1.00 . A B . 16 ASP CG 1 1 7 5270 1 1 16 ASP H H 9.508 7.706 0.260 1.00 . A B . 16 ASP H 1 1 7 5271 1 1 16 ASP HA H 10.231 10.137 1.587 1.00 . A B . 16 ASP HA 1 1 7 5272 1 1 16 ASP HB2 H 8.232 9.418 -0.528 1.00 . A B . 16 ASP HB2 1 1 7 5273 1 1 16 ASP HB3 H 8.157 10.996 0.249 1.00 . A B . 16 ASP HB3 1 1 7 5274 1 1 16 ASP N N 9.820 8.188 1.057 1.00 . A B . 16 ASP N 1 1 7 5275 1 1 16 ASP O O 7.787 10.718 2.667 1.00 . A B . 16 ASP O 1 1 7 5276 1 1 16 ASP OD1 O 10.490 11.735 -0.652 1.00 . A B . 16 ASP OD1 1 1 7 5277 1 1 16 ASP OD2 O 10.151 10.017 -1.968 1.00 . A B . 16 ASP OD2 1 1 7 5278 1 1 17 GLY C C 5.622 8.412 3.621 1.00 . A B . 17 GLY C 1 1 7 5279 1 1 17 GLY CA C 7.058 8.499 4.108 1.00 . A B . 17 GLY CA 1 1 7 5280 1 1 17 GLY H H 8.474 7.685 2.749 1.00 . A B . 17 GLY H 1 1 7 5281 1 1 17 GLY HA2 H 7.264 7.649 4.743 1.00 . A B . 17 GLY HA2 1 1 7 5282 1 1 17 GLY HA3 H 7.176 9.404 4.687 1.00 . A B . 17 GLY HA3 1 1 7 5283 1 1 17 GLY N N 8.025 8.515 3.020 1.00 . A B . 17 GLY N 1 1 7 5284 1 1 17 GLY O O 4.707 8.932 4.263 1.00 . A B . 17 GLY O 1 1 7 5285 1 1 18 GLY C C 3.207 6.743 2.814 1.00 . A B . 18 GLY C 1 1 7 5286 1 1 18 GLY CA C 4.108 7.573 1.920 1.00 . A B . 18 GLY CA 1 1 7 5287 1 1 18 GLY H H 6.224 7.480 1.969 1.00 . A B . 18 GLY H 1 1 7 5288 1 1 18 GLY HA2 H 3.645 8.534 1.762 1.00 . A B . 18 GLY HA2 1 1 7 5289 1 1 18 GLY HA3 H 4.204 7.076 0.969 1.00 . A B . 18 GLY HA3 1 1 7 5290 1 1 18 GLY N N 5.435 7.779 2.472 1.00 . A B . 18 GLY N 1 1 7 5291 1 1 18 GLY O O 3.676 6.021 3.700 1.00 . A B . 18 GLY O 1 1 7 5292 1 1 19 GLU C C 0.411 4.889 2.689 1.00 . A B . 19 GLU C 1 1 7 5293 1 1 19 GLU CA C 0.913 6.155 3.379 1.00 . A B . 19 GLU CA 1 1 7 5294 1 1 19 GLU CB C -0.257 7.101 3.649 1.00 . A B . 19 GLU CB 1 1 7 5295 1 1 19 GLU CD C 0.028 7.820 6.052 1.00 . A B . 19 GLU CD 1 1 7 5296 1 1 19 GLU CG C 0.082 8.240 4.600 1.00 . A B . 19 GLU CG 1 1 7 5297 1 1 19 GLU H H 1.611 7.377 1.807 1.00 . A B . 19 GLU H 1 1 7 5298 1 1 19 GLU HA H 1.371 5.884 4.317 1.00 . A B . 19 GLU HA 1 1 7 5299 1 1 19 GLU HB2 H -0.576 7.529 2.712 1.00 . A B . 19 GLU HB2 1 1 7 5300 1 1 19 GLU HB3 H -1.074 6.534 4.074 1.00 . A B . 19 GLU HB3 1 1 7 5301 1 1 19 GLU HG2 H 1.081 8.589 4.383 1.00 . A B . 19 GLU HG2 1 1 7 5302 1 1 19 GLU HG3 H -0.621 9.047 4.447 1.00 . A B . 19 GLU HG3 1 1 7 5303 1 1 19 GLU N N 1.911 6.835 2.568 1.00 . A B . 19 GLU N 1 1 7 5304 1 1 19 GLU O O 0.312 4.834 1.463 1.00 . A B . 19 GLU O 1 1 7 5305 1 1 19 GLU OE1 O 0.957 7.118 6.499 1.00 . A B . 19 GLU OE1 1 1 7 5306 1 1 19 GLU OE2 O -0.936 8.188 6.755 1.00 . A B . 19 GLU OE2 1 1 7 5307 1 1 20 LEU C C -1.927 2.531 3.262 1.00 . A B . 20 LEU C 1 1 7 5308 1 1 20 LEU CA C -0.435 2.628 2.973 1.00 . A B . 20 LEU CA 1 1 7 5309 1 1 20 LEU CB C 0.292 1.435 3.600 1.00 . A B . 20 LEU CB 1 1 7 5310 1 1 20 LEU CD1 C 2.408 0.127 3.902 1.00 . A B . 20 LEU CD1 1 1 7 5311 1 1 20 LEU CD2 C 1.528 0.522 1.609 1.00 . A B . 20 LEU CD2 1 1 7 5312 1 1 20 LEU CG C 1.669 1.107 3.009 1.00 . A B . 20 LEU CG 1 1 7 5313 1 1 20 LEU H H 0.220 3.985 4.452 1.00 . A B . 20 LEU H 1 1 7 5314 1 1 20 LEU HA H -0.282 2.612 1.906 1.00 . A B . 20 LEU HA 1 1 7 5315 1 1 20 LEU HB2 H 0.418 1.638 4.654 1.00 . A B . 20 LEU HB2 1 1 7 5316 1 1 20 LEU HB3 H -0.337 0.565 3.494 1.00 . A B . 20 LEU HB3 1 1 7 5317 1 1 20 LEU HD11 H 2.538 0.559 4.883 1.00 . A B . 20 LEU HD11 1 1 7 5318 1 1 20 LEU HD12 H 3.375 -0.092 3.473 1.00 . A B . 20 LEU HD12 1 1 7 5319 1 1 20 LEU HD13 H 1.836 -0.786 3.984 1.00 . A B . 20 LEU HD13 1 1 7 5320 1 1 20 LEU HD21 H 2.502 0.230 1.243 1.00 . A B . 20 LEU HD21 1 1 7 5321 1 1 20 LEU HD22 H 1.102 1.260 0.946 1.00 . A B . 20 LEU HD22 1 1 7 5322 1 1 20 LEU HD23 H 0.884 -0.345 1.643 1.00 . A B . 20 LEU HD23 1 1 7 5323 1 1 20 LEU HG H 2.254 2.015 2.940 1.00 . A B . 20 LEU HG 1 1 7 5324 1 1 20 LEU N N 0.100 3.880 3.485 1.00 . A B . 20 LEU N 1 1 7 5325 1 1 20 LEU O O -2.359 2.701 4.402 1.00 . A B . 20 LEU O 1 1 7 5326 1 1 21 PHE C C -4.576 0.683 2.194 1.00 . A B . 21 PHE C 1 1 7 5327 1 1 21 PHE CA C -4.159 2.139 2.382 1.00 . A B . 21 PHE CA 1 1 7 5328 1 1 21 PHE CB C -4.884 3.034 1.367 1.00 . A B . 21 PHE CB 1 1 7 5329 1 1 21 PHE CD1 C -4.679 5.294 2.456 1.00 . A B . 21 PHE CD1 1 1 7 5330 1 1 21 PHE CD2 C -3.697 4.982 0.303 1.00 . A B . 21 PHE CD2 1 1 7 5331 1 1 21 PHE CE1 C -4.249 6.607 2.466 1.00 . A B . 21 PHE CE1 1 1 7 5332 1 1 21 PHE CE2 C -3.266 6.295 0.309 1.00 . A B . 21 PHE CE2 1 1 7 5333 1 1 21 PHE CG C -4.409 4.464 1.376 1.00 . A B . 21 PHE CG 1 1 7 5334 1 1 21 PHE CZ C -3.520 7.100 1.394 1.00 . A B . 21 PHE CZ 1 1 7 5335 1 1 21 PHE H H -2.312 2.141 1.340 1.00 . A B . 21 PHE H 1 1 7 5336 1 1 21 PHE HA H -4.415 2.451 3.386 1.00 . A B . 21 PHE HA 1 1 7 5337 1 1 21 PHE HB2 H -4.728 2.637 0.375 1.00 . A B . 21 PHE HB2 1 1 7 5338 1 1 21 PHE HB3 H -5.945 3.033 1.588 1.00 . A B . 21 PHE HB3 1 1 7 5339 1 1 21 PHE HD1 H -5.232 4.908 3.301 1.00 . A B . 21 PHE HD1 1 1 7 5340 1 1 21 PHE HD2 H -3.477 4.351 -0.546 1.00 . A B . 21 PHE HD2 1 1 7 5341 1 1 21 PHE HE1 H -4.466 7.242 3.312 1.00 . A B . 21 PHE HE1 1 1 7 5342 1 1 21 PHE HE2 H -2.712 6.684 -0.532 1.00 . A B . 21 PHE HE2 1 1 7 5343 1 1 21 PHE HZ H -3.178 8.126 1.401 1.00 . A B . 21 PHE HZ 1 1 7 5344 1 1 21 PHE N N -2.713 2.263 2.229 1.00 . A B . 21 PHE N 1 1 7 5345 1 1 21 PHE O O -5.663 0.379 1.698 1.00 . A B . 21 PHE O 1 1 7 5346 1 1 22 CYS C C -3.691 -2.383 3.703 1.00 . A B . 22 CYS C 1 1 7 5347 1 1 22 CYS CA C -3.902 -1.634 2.395 1.00 . A B . 22 CYS CA 1 1 7 5348 1 1 22 CYS CB C -2.923 -2.145 1.333 1.00 . A B . 22 CYS CB 1 1 7 5349 1 1 22 CYS H H -2.879 0.089 3.048 1.00 . A B . 22 CYS H 1 1 7 5350 1 1 22 CYS HA H -4.916 -1.784 2.055 1.00 . A B . 22 CYS HA 1 1 7 5351 1 1 22 CYS HB2 H -1.912 -2.046 1.707 1.00 . A B . 22 CYS HB2 1 1 7 5352 1 1 22 CYS HB3 H -3.126 -3.189 1.131 1.00 . A B . 22 CYS HB3 1 1 7 5353 1 1 22 CYS N N -3.695 -0.214 2.596 1.00 . A B . 22 CYS N 1 1 7 5354 1 1 22 CYS O O -3.019 -1.886 4.610 1.00 . A B . 22 CYS O 1 1 7 5355 1 1 22 CYS SG S -3.012 -1.248 -0.245 1.00 . A B . 22 CYS SG 1 1 7 5356 1 1 23 CYS C C -2.775 -5.170 4.809 1.00 . A B . 23 CYS C 1 1 7 5357 1 1 23 CYS CA C -4.073 -4.397 4.983 1.00 . A B . 23 CYS CA 1 1 7 5358 1 1 23 CYS CB C -5.244 -5.363 5.189 1.00 . A B . 23 CYS CB 1 1 7 5359 1 1 23 CYS H H -4.871 -3.879 3.099 1.00 . A B . 23 CYS H 1 1 7 5360 1 1 23 CYS HA H -3.982 -3.747 5.844 1.00 . A B . 23 CYS HA 1 1 7 5361 1 1 23 CYS HB2 H -5.196 -5.771 6.191 1.00 . A B . 23 CYS HB2 1 1 7 5362 1 1 23 CYS HB3 H -6.172 -4.825 5.071 1.00 . A B . 23 CYS HB3 1 1 7 5363 1 1 23 CYS N N -4.284 -3.564 3.814 1.00 . A B . 23 CYS N 1 1 7 5364 1 1 23 CYS O O -2.264 -5.255 3.690 1.00 . A B . 23 CYS O 1 1 7 5365 1 1 23 CYS SG S -5.268 -6.757 4.042 1.00 . A B . 23 CYS SG 1 1 7 5366 1 1 24 ASP C C -0.820 -7.382 4.707 1.00 . A B . 24 ASP C 1 1 7 5367 1 1 24 ASP CA C -0.954 -6.411 5.875 1.00 . A B . 24 ASP CA 1 1 7 5368 1 1 24 ASP CB C -0.722 -7.158 7.188 1.00 . A B . 24 ASP CB 1 1 7 5369 1 1 24 ASP CG C -0.688 -6.227 8.378 1.00 . A B . 24 ASP CG 1 1 7 5370 1 1 24 ASP H H -2.776 -5.722 6.729 1.00 . A B . 24 ASP H 1 1 7 5371 1 1 24 ASP HA H -0.197 -5.649 5.776 1.00 . A B . 24 ASP HA 1 1 7 5372 1 1 24 ASP HB2 H -1.518 -7.871 7.335 1.00 . A B . 24 ASP HB2 1 1 7 5373 1 1 24 ASP HB3 H 0.221 -7.684 7.137 1.00 . A B . 24 ASP HB3 1 1 7 5374 1 1 24 ASP N N -2.261 -5.742 5.891 1.00 . A B . 24 ASP N 1 1 7 5375 1 1 24 ASP O O 0.212 -7.419 4.034 1.00 . A B . 24 ASP O 1 1 7 5376 1 1 24 ASP OD1 O 0.383 -5.654 8.656 1.00 . A B . 24 ASP OD1 1 1 7 5377 1 1 24 ASP OD2 O -1.731 -6.048 9.033 1.00 . A B . 24 ASP OD2 1 1 7 5378 1 1 25 THR C C -1.775 -8.477 2.019 1.00 . A B . 25 THR C 1 1 7 5379 1 1 25 THR CA C -1.881 -9.133 3.396 1.00 . A B . 25 THR CA 1 1 7 5380 1 1 25 THR CB C -3.156 -9.987 3.464 1.00 . A B . 25 THR CB 1 1 7 5381 1 1 25 THR CG2 C -3.086 -11.158 2.493 1.00 . A B . 25 THR CG2 1 1 7 5382 1 1 25 THR H H -2.678 -8.031 5.011 1.00 . A B . 25 THR H 1 1 7 5383 1 1 25 THR HA H -1.030 -9.782 3.542 1.00 . A B . 25 THR HA 1 1 7 5384 1 1 25 THR HB H -3.998 -9.368 3.199 1.00 . A B . 25 THR HB 1 1 7 5385 1 1 25 THR HG1 H -2.581 -11.029 5.039 1.00 . A B . 25 THR HG1 1 1 7 5386 1 1 25 THR HG21 H -2.969 -10.784 1.487 1.00 . A B . 25 THR HG21 1 1 7 5387 1 1 25 THR HG22 H -3.997 -11.734 2.560 1.00 . A B . 25 THR HG22 1 1 7 5388 1 1 25 THR HG23 H -2.244 -11.784 2.746 1.00 . A B . 25 THR HG23 1 1 7 5389 1 1 25 THR N N -1.877 -8.142 4.459 1.00 . A B . 25 THR N 1 1 7 5390 1 1 25 THR O O -0.902 -8.822 1.224 1.00 . A B . 25 THR O 1 1 7 5391 1 1 25 THR OG1 O -3.336 -10.478 4.797 1.00 . A B . 25 THR OG1 1 1 7 5392 1 1 26 CYS C C -1.452 -6.006 0.196 1.00 . A B . 26 CYS C 1 1 7 5393 1 1 26 CYS CA C -2.678 -6.882 0.430 1.00 . A B . 26 CYS CA 1 1 7 5394 1 1 26 CYS CB C -3.949 -6.057 0.241 1.00 . A B . 26 CYS CB 1 1 7 5395 1 1 26 CYS H H -3.262 -7.206 2.447 1.00 . A B . 26 CYS H 1 1 7 5396 1 1 26 CYS HA H -2.671 -7.678 -0.302 1.00 . A B . 26 CYS HA 1 1 7 5397 1 1 26 CYS HB2 H -3.989 -5.298 1.004 1.00 . A B . 26 CYS HB2 1 1 7 5398 1 1 26 CYS HB3 H -3.921 -5.582 -0.728 1.00 . A B . 26 CYS HB3 1 1 7 5399 1 1 26 CYS N N -2.643 -7.508 1.747 1.00 . A B . 26 CYS N 1 1 7 5400 1 1 26 CYS O O -0.990 -5.882 -0.932 1.00 . A B . 26 CYS O 1 1 7 5401 1 1 26 CYS SG S -5.480 -7.008 0.343 1.00 . A B . 26 CYS SG 1 1 7 5402 1 1 27 SER C C 1.474 -5.457 0.756 1.00 . A B . 27 SER C 1 1 7 5403 1 1 27 SER CA C 0.280 -4.589 1.145 1.00 . A B . 27 SER CA 1 1 7 5404 1 1 27 SER CB C 0.562 -3.878 2.469 1.00 . A B . 27 SER CB 1 1 7 5405 1 1 27 SER H H -1.352 -5.503 2.136 1.00 . A B . 27 SER H 1 1 7 5406 1 1 27 SER HA H 0.117 -3.850 0.374 1.00 . A B . 27 SER HA 1 1 7 5407 1 1 27 SER HB2 H 0.759 -4.614 3.233 1.00 . A B . 27 SER HB2 1 1 7 5408 1 1 27 SER HB3 H 1.423 -3.237 2.354 1.00 . A B . 27 SER HB3 1 1 7 5409 1 1 27 SER HG H -0.270 -2.499 3.584 1.00 . A B . 27 SER HG 1 1 7 5410 1 1 27 SER N N -0.924 -5.404 1.256 1.00 . A B . 27 SER N 1 1 7 5411 1 1 27 SER O O 2.405 -4.995 0.102 1.00 . A B . 27 SER O 1 1 7 5412 1 1 27 SER OG O -0.542 -3.090 2.872 1.00 . A B . 27 SER OG 1 1 7 5413 1 1 28 ARG C C 2.423 -8.062 -0.634 1.00 . A B . 28 ARG C 1 1 7 5414 1 1 28 ARG CA C 2.485 -7.671 0.843 1.00 . A B . 28 ARG CA 1 1 7 5415 1 1 28 ARG CB C 2.342 -8.915 1.726 1.00 . A B . 28 ARG CB 1 1 7 5416 1 1 28 ARG CD C 3.092 -11.249 2.267 1.00 . A B . 28 ARG CD 1 1 7 5417 1 1 28 ARG CG C 3.352 -10.008 1.427 1.00 . A B . 28 ARG CG 1 1 7 5418 1 1 28 ARG CZ C 4.326 -13.309 2.853 1.00 . A B . 28 ARG CZ 1 1 7 5419 1 1 28 ARG H H 0.696 -7.006 1.746 1.00 . A B . 28 ARG H 1 1 7 5420 1 1 28 ARG HA H 3.437 -7.204 1.041 1.00 . A B . 28 ARG HA 1 1 7 5421 1 1 28 ARG HB2 H 2.459 -8.621 2.759 1.00 . A B . 28 ARG HB2 1 1 7 5422 1 1 28 ARG HB3 H 1.351 -9.323 1.590 1.00 . A B . 28 ARG HB3 1 1 7 5423 1 1 28 ARG HD2 H 3.116 -10.974 3.311 1.00 . A B . 28 ARG HD2 1 1 7 5424 1 1 28 ARG HD3 H 2.113 -11.636 2.022 1.00 . A B . 28 ARG HD3 1 1 7 5425 1 1 28 ARG HE H 4.622 -12.216 1.200 1.00 . A B . 28 ARG HE 1 1 7 5426 1 1 28 ARG HG2 H 3.282 -10.271 0.383 1.00 . A B . 28 ARG HG2 1 1 7 5427 1 1 28 ARG HG3 H 4.343 -9.640 1.643 1.00 . A B . 28 ARG HG3 1 1 7 5428 1 1 28 ARG HH11 H 2.886 -12.793 4.184 1.00 . A B . 28 ARG HH11 1 1 7 5429 1 1 28 ARG HH12 H 3.793 -14.217 4.587 1.00 . A B . 28 ARG HH12 1 1 7 5430 1 1 28 ARG HH21 H 5.820 -14.089 1.725 1.00 . A B . 28 ARG HH21 1 1 7 5431 1 1 28 ARG HH22 H 5.457 -14.960 3.180 1.00 . A B . 28 ARG HH22 1 1 7 5432 1 1 28 ARG N N 1.439 -6.716 1.175 1.00 . A B . 28 ARG N 1 1 7 5433 1 1 28 ARG NE N 4.091 -12.289 2.026 1.00 . A B . 28 ARG NE 1 1 7 5434 1 1 28 ARG NH1 N 3.610 -13.452 3.962 1.00 . A B . 28 ARG NH1 1 1 7 5435 1 1 28 ARG NH2 N 5.276 -14.189 2.564 1.00 . A B . 28 ARG NH2 1 1 7 5436 1 1 28 ARG O O 3.453 -8.267 -1.278 1.00 . A B . 28 ARG O 1 1 7 5437 1 1 29 VAL C C 1.024 -7.423 -3.519 1.00 . A B . 29 VAL C 1 1 7 5438 1 1 29 VAL CA C 1.020 -8.597 -2.540 1.00 . A B . 29 VAL CA 1 1 7 5439 1 1 29 VAL CB C -0.296 -9.392 -2.695 1.00 . A B . 29 VAL CB 1 1 7 5440 1 1 29 VAL CG1 C -0.432 -9.944 -4.107 1.00 . A B . 29 VAL CG1 1 1 7 5441 1 1 29 VAL CG2 C -0.366 -10.521 -1.679 1.00 . A B . 29 VAL CG2 1 1 7 5442 1 1 29 VAL H H 0.436 -7.885 -0.632 1.00 . A B . 29 VAL H 1 1 7 5443 1 1 29 VAL HA H 1.840 -9.253 -2.787 1.00 . A B . 29 VAL HA 1 1 7 5444 1 1 29 VAL HB H -1.121 -8.721 -2.513 1.00 . A B . 29 VAL HB 1 1 7 5445 1 1 29 VAL HG11 H -1.370 -10.470 -4.198 1.00 . A B . 29 VAL HG11 1 1 7 5446 1 1 29 VAL HG12 H 0.381 -10.626 -4.305 1.00 . A B . 29 VAL HG12 1 1 7 5447 1 1 29 VAL HG13 H -0.402 -9.132 -4.817 1.00 . A B . 29 VAL HG13 1 1 7 5448 1 1 29 VAL HG21 H -1.249 -11.115 -1.864 1.00 . A B . 29 VAL HG21 1 1 7 5449 1 1 29 VAL HG22 H -0.414 -10.108 -0.683 1.00 . A B . 29 VAL HG22 1 1 7 5450 1 1 29 VAL HG23 H 0.512 -11.143 -1.771 1.00 . A B . 29 VAL HG23 1 1 7 5451 1 1 29 VAL N N 1.214 -8.144 -1.169 1.00 . A B . 29 VAL N 1 1 7 5452 1 1 29 VAL O O 1.682 -7.471 -4.558 1.00 . A B . 29 VAL O 1 1 7 5453 1 1 30 PHE C C 0.772 -3.971 -3.444 1.00 . A B . 30 PHE C 1 1 7 5454 1 1 30 PHE CA C 0.151 -5.220 -4.057 1.00 . A B . 30 PHE CA 1 1 7 5455 1 1 30 PHE CB C -1.333 -4.947 -4.346 1.00 . A B . 30 PHE CB 1 1 7 5456 1 1 30 PHE CD1 C -1.813 -6.533 -6.228 1.00 . A B . 30 PHE CD1 1 1 7 5457 1 1 30 PHE CD2 C -3.061 -6.774 -4.209 1.00 . A B . 30 PHE CD2 1 1 7 5458 1 1 30 PHE CE1 C -2.494 -7.599 -6.781 1.00 . A B . 30 PHE CE1 1 1 7 5459 1 1 30 PHE CE2 C -3.745 -7.840 -4.759 1.00 . A B . 30 PHE CE2 1 1 7 5460 1 1 30 PHE CG C -2.087 -6.107 -4.938 1.00 . A B . 30 PHE CG 1 1 7 5461 1 1 30 PHE CZ C -3.498 -8.245 -6.015 1.00 . A B . 30 PHE CZ 1 1 7 5462 1 1 30 PHE H H -0.103 -6.331 -2.277 1.00 . A B . 30 PHE H 1 1 7 5463 1 1 30 PHE HA H 0.657 -5.447 -4.983 1.00 . A B . 30 PHE HA 1 1 7 5464 1 1 30 PHE HB2 H -1.824 -4.677 -3.422 1.00 . A B . 30 PHE HB2 1 1 7 5465 1 1 30 PHE HB3 H -1.406 -4.119 -5.035 1.00 . A B . 30 PHE HB3 1 1 7 5466 1 1 30 PHE HD1 H -1.055 -6.026 -6.803 1.00 . A B . 30 PHE HD1 1 1 7 5467 1 1 30 PHE HD2 H -3.287 -6.456 -3.202 1.00 . A B . 30 PHE HD2 1 1 7 5468 1 1 30 PHE HE1 H -2.270 -7.919 -7.788 1.00 . A B . 30 PHE HE1 1 1 7 5469 1 1 30 PHE HE2 H -4.501 -8.353 -4.182 1.00 . A B . 30 PHE HE2 1 1 7 5470 1 1 30 PHE HZ H -4.046 -9.076 -6.432 1.00 . A B . 30 PHE HZ 1 1 7 5471 1 1 30 PHE N N 0.310 -6.361 -3.169 1.00 . A B . 30 PHE N 1 1 7 5472 1 1 30 PHE O O 0.134 -2.922 -3.389 1.00 . A B . 30 PHE O 1 1 7 5473 1 1 31 HIS C C 2.812 -1.793 -3.339 1.00 . A B . 31 HIS C 1 1 7 5474 1 1 31 HIS CA C 2.695 -2.955 -2.357 1.00 . A B . 31 HIS CA 1 1 7 5475 1 1 31 HIS CB C 4.081 -3.382 -1.865 1.00 . A B . 31 HIS CB 1 1 7 5476 1 1 31 HIS CD2 C 5.822 -1.547 -1.275 1.00 . A B . 31 HIS CD2 1 1 7 5477 1 1 31 HIS CE1 C 5.335 -1.235 0.811 1.00 . A B . 31 HIS CE1 1 1 7 5478 1 1 31 HIS CG C 4.781 -2.370 -0.994 1.00 . A B . 31 HIS CG 1 1 7 5479 1 1 31 HIS H H 2.475 -4.944 -3.059 1.00 . A B . 31 HIS H 1 1 7 5480 1 1 31 HIS HA H 2.103 -2.639 -1.513 1.00 . A B . 31 HIS HA 1 1 7 5481 1 1 31 HIS HB2 H 3.982 -4.293 -1.292 1.00 . A B . 31 HIS HB2 1 1 7 5482 1 1 31 HIS HB3 H 4.710 -3.573 -2.722 1.00 . A B . 31 HIS HB3 1 1 7 5483 1 1 31 HIS HD1 H 3.772 -2.613 0.841 1.00 . A B . 31 HIS HD1 1 1 7 5484 1 1 31 HIS HD2 H 6.295 -1.435 -2.239 1.00 . A B . 31 HIS HD2 1 1 7 5485 1 1 31 HIS HE1 H 5.341 -0.871 1.829 1.00 . A B . 31 HIS HE1 1 1 7 5486 1 1 31 HIS N N 2.010 -4.084 -2.981 1.00 . A B . 31 HIS N 1 1 7 5487 1 1 31 HIS ND1 N 4.482 -2.163 0.335 1.00 . A B . 31 HIS ND1 1 1 7 5488 1 1 31 HIS NE2 N 6.172 -0.830 -0.126 1.00 . A B . 31 HIS NE2 1 1 7 5489 1 1 31 HIS O O 2.421 -0.677 -3.032 1.00 . A B . 31 HIS O 1 1 7 5490 1 1 32 GLU C C 2.176 -0.378 -5.921 1.00 . A B . 32 GLU C 1 1 7 5491 1 1 32 GLU CA C 3.495 -1.052 -5.558 1.00 . A B . 32 GLU CA 1 1 7 5492 1 1 32 GLU CB C 4.122 -1.667 -6.810 1.00 . A B . 32 GLU CB 1 1 7 5493 1 1 32 GLU CD C 6.570 -1.099 -6.563 1.00 . A B . 32 GLU CD 1 1 7 5494 1 1 32 GLU CG C 5.531 -2.197 -6.599 1.00 . A B . 32 GLU CG 1 1 7 5495 1 1 32 GLU H H 3.469 -3.015 -4.765 1.00 . A B . 32 GLU H 1 1 7 5496 1 1 32 GLU HA H 4.169 -0.315 -5.149 1.00 . A B . 32 GLU HA 1 1 7 5497 1 1 32 GLU HB2 H 3.500 -2.483 -7.143 1.00 . A B . 32 GLU HB2 1 1 7 5498 1 1 32 GLU HB3 H 4.156 -0.915 -7.584 1.00 . A B . 32 GLU HB3 1 1 7 5499 1 1 32 GLU HG2 H 5.563 -2.728 -5.661 1.00 . A B . 32 GLU HG2 1 1 7 5500 1 1 32 GLU HG3 H 5.772 -2.876 -7.404 1.00 . A B . 32 GLU HG3 1 1 7 5501 1 1 32 GLU N N 3.284 -2.082 -4.544 1.00 . A B . 32 GLU N 1 1 7 5502 1 1 32 GLU O O 2.093 0.844 -6.029 1.00 . A B . 32 GLU O 1 1 7 5503 1 1 32 GLU OE1 O 6.673 -0.408 -5.524 1.00 . A B . 32 GLU OE1 1 1 7 5504 1 1 32 GLU OE2 O 7.279 -0.910 -7.568 1.00 . A B . 32 GLU OE2 1 1 7 5505 1 1 33 ASP C C -0.823 0.046 -5.285 1.00 . A B . 33 ASP C 1 1 7 5506 1 1 33 ASP CA C -0.184 -0.703 -6.443 1.00 . A B . 33 ASP CA 1 1 7 5507 1 1 33 ASP CB C -1.096 -1.850 -6.879 1.00 . A B . 33 ASP CB 1 1 7 5508 1 1 33 ASP CG C -0.811 -2.308 -8.290 1.00 . A B . 33 ASP CG 1 1 7 5509 1 1 33 ASP H H 1.288 -2.156 -5.966 1.00 . A B . 33 ASP H 1 1 7 5510 1 1 33 ASP HA H -0.067 -0.019 -7.272 1.00 . A B . 33 ASP HA 1 1 7 5511 1 1 33 ASP HB2 H -0.951 -2.686 -6.214 1.00 . A B . 33 ASP HB2 1 1 7 5512 1 1 33 ASP HB3 H -2.124 -1.526 -6.825 1.00 . A B . 33 ASP HB3 1 1 7 5513 1 1 33 ASP N N 1.145 -1.193 -6.087 1.00 . A B . 33 ASP N 1 1 7 5514 1 1 33 ASP O O -1.695 0.890 -5.486 1.00 . A B . 33 ASP O 1 1 7 5515 1 1 33 ASP OD1 O 0.151 -3.081 -8.481 1.00 . A B . 33 ASP OD1 1 1 7 5516 1 1 33 ASP OD2 O -1.560 -1.920 -9.210 1.00 . A B . 33 ASP OD2 1 1 7 5517 1 1 34 CYS C C -0.455 1.844 -2.840 1.00 . A B . 34 CYS C 1 1 7 5518 1 1 34 CYS CA C -0.915 0.388 -2.883 1.00 . A B . 34 CYS CA 1 1 7 5519 1 1 34 CYS CB C -0.460 -0.342 -1.611 1.00 . A B . 34 CYS CB 1 1 7 5520 1 1 34 CYS H H 0.293 -0.971 -3.974 1.00 . A B . 34 CYS H 1 1 7 5521 1 1 34 CYS HA H -1.994 0.367 -2.940 1.00 . A B . 34 CYS HA 1 1 7 5522 1 1 34 CYS HB2 H -0.507 -1.413 -1.767 1.00 . A B . 34 CYS HB2 1 1 7 5523 1 1 34 CYS HB3 H 0.560 -0.062 -1.392 1.00 . A B . 34 CYS HB3 1 1 7 5524 1 1 34 CYS N N -0.390 -0.269 -4.073 1.00 . A B . 34 CYS N 1 1 7 5525 1 1 34 CYS O O -1.080 2.689 -2.198 1.00 . A B . 34 CYS O 1 1 7 5526 1 1 34 CYS SG S -1.459 0.053 -0.138 1.00 . A B . 34 CYS SG 1 1 7 5527 1 1 35 HIS C C 0.855 4.154 -4.896 1.00 . A B . 35 HIS C 1 1 7 5528 1 1 35 HIS CA C 1.184 3.480 -3.572 1.00 . A B . 35 HIS CA 1 1 7 5529 1 1 35 HIS CB C 2.699 3.451 -3.387 1.00 . A B . 35 HIS CB 1 1 7 5530 1 1 35 HIS CD2 C 3.502 1.565 -1.832 1.00 . A B . 35 HIS CD2 1 1 7 5531 1 1 35 HIS CE1 C 3.680 2.651 0.022 1.00 . A B . 35 HIS CE1 1 1 7 5532 1 1 35 HIS CG C 3.139 2.837 -2.095 1.00 . A B . 35 HIS CG 1 1 7 5533 1 1 35 HIS H H 1.090 1.418 -4.034 1.00 . A B . 35 HIS H 1 1 7 5534 1 1 35 HIS HA H 0.740 4.043 -2.767 1.00 . A B . 35 HIS HA 1 1 7 5535 1 1 35 HIS HB2 H 3.138 2.874 -4.189 1.00 . A B . 35 HIS HB2 1 1 7 5536 1 1 35 HIS HB3 H 3.079 4.459 -3.427 1.00 . A B . 35 HIS HB3 1 1 7 5537 1 1 35 HIS HD1 H 3.007 4.461 -0.747 1.00 . A B . 35 HIS HD1 1 1 7 5538 1 1 35 HIS HD2 H 3.536 0.755 -2.549 1.00 . A B . 35 HIS HD2 1 1 7 5539 1 1 35 HIS HE1 H 3.872 2.906 1.056 1.00 . A B . 35 HIS HE1 1 1 7 5540 1 1 35 HIS N N 0.638 2.131 -3.535 1.00 . A B . 35 HIS N 1 1 7 5541 1 1 35 HIS ND1 N 3.248 3.519 -0.902 1.00 . A B . 35 HIS ND1 1 1 7 5542 1 1 35 HIS NE2 N 3.847 1.445 -0.496 1.00 . A B . 35 HIS NE2 1 1 7 5543 1 1 35 HIS O O 0.836 5.377 -4.995 1.00 . A B . 35 HIS O 1 1 7 5544 1 1 36 ILE C C -0.836 3.132 -7.876 1.00 . A B . 36 ILE C 1 1 7 5545 1 1 36 ILE CA C 0.362 3.847 -7.254 1.00 . A B . 36 ILE CA 1 1 7 5546 1 1 36 ILE CB C 1.588 3.626 -8.169 1.00 . A B . 36 ILE CB 1 1 7 5547 1 1 36 ILE CD1 C 4.125 3.900 -8.295 1.00 . A B . 36 ILE CD1 1 1 7 5548 1 1 36 ILE CG1 C 2.856 4.182 -7.515 1.00 . A B . 36 ILE CG1 1 1 7 5549 1 1 36 ILE CG2 C 1.361 4.274 -9.530 1.00 . A B . 36 ILE CG2 1 1 7 5550 1 1 36 ILE H H 0.621 2.377 -5.766 1.00 . A B . 36 ILE H 1 1 7 5551 1 1 36 ILE HA H 0.166 4.903 -7.189 1.00 . A B . 36 ILE HA 1 1 7 5552 1 1 36 ILE HB H 1.706 2.564 -8.319 1.00 . A B . 36 ILE HB 1 1 7 5553 1 1 36 ILE HD11 H 4.270 2.832 -8.374 1.00 . A B . 36 ILE HD11 1 1 7 5554 1 1 36 ILE HD12 H 4.968 4.342 -7.785 1.00 . A B . 36 ILE HD12 1 1 7 5555 1 1 36 ILE HD13 H 4.040 4.325 -9.285 1.00 . A B . 36 ILE HD13 1 1 7 5556 1 1 36 ILE HG12 H 2.760 5.252 -7.413 1.00 . A B . 36 ILE HG12 1 1 7 5557 1 1 36 ILE HG13 H 2.963 3.742 -6.533 1.00 . A B . 36 ILE HG13 1 1 7 5558 1 1 36 ILE HG21 H 2.214 4.086 -10.165 1.00 . A B . 36 ILE HG21 1 1 7 5559 1 1 36 ILE HG22 H 1.234 5.340 -9.405 1.00 . A B . 36 ILE HG22 1 1 7 5560 1 1 36 ILE HG23 H 0.475 3.858 -9.984 1.00 . A B . 36 ILE HG23 1 1 7 5561 1 1 36 ILE N N 0.618 3.344 -5.916 1.00 . A B . 36 ILE N 1 1 7 5562 1 1 36 ILE O O -0.763 1.931 -8.143 1.00 . A B . 36 ILE O 1 1 7 5563 1 1 37 PRO C C -2.848 5.351 -6.363 1.00 . A B . 37 PRO C 1 1 7 5564 1 1 37 PRO CA C -2.178 5.227 -7.738 1.00 . A B . 37 PRO CA 1 1 7 5565 1 1 37 PRO CB C -3.134 5.738 -8.837 1.00 . A B . 37 PRO CB 1 1 7 5566 1 1 37 PRO CD C -3.113 3.327 -8.850 1.00 . A B . 37 PRO CD 1 1 7 5567 1 1 37 PRO CG C -3.521 4.533 -9.649 1.00 . A B . 37 PRO CG 1 1 7 5568 1 1 37 PRO HA H -1.265 5.799 -7.756 1.00 . A B . 37 PRO HA 1 1 7 5569 1 1 37 PRO HB2 H -4.003 6.188 -8.374 1.00 . A B . 37 PRO HB2 1 1 7 5570 1 1 37 PRO HB3 H -2.626 6.477 -9.448 1.00 . A B . 37 PRO HB3 1 1 7 5571 1 1 37 PRO HD2 H -3.903 3.031 -8.172 1.00 . A B . 37 PRO HD2 1 1 7 5572 1 1 37 PRO HD3 H -2.836 2.507 -9.498 1.00 . A B . 37 PRO HD3 1 1 7 5573 1 1 37 PRO HG2 H -4.590 4.528 -9.812 1.00 . A B . 37 PRO HG2 1 1 7 5574 1 1 37 PRO HG3 H -2.999 4.548 -10.597 1.00 . A B . 37 PRO HG3 1 1 7 5575 1 1 37 PRO N N -1.958 3.832 -8.119 1.00 . A B . 37 PRO N 1 1 7 5576 1 1 37 PRO O O -3.711 4.541 -6.011 1.00 . A B . 37 PRO O 1 1 7 5577 1 1 38 PRO C C -4.464 7.177 -4.342 1.00 . A B . 38 PRO C 1 1 7 5578 1 1 38 PRO CA C -3.060 6.588 -4.248 1.00 . A B . 38 PRO CA 1 1 7 5579 1 1 38 PRO CB C -2.118 7.598 -3.574 1.00 . A B . 38 PRO CB 1 1 7 5580 1 1 38 PRO CD C -1.456 7.373 -5.883 1.00 . A B . 38 PRO CD 1 1 7 5581 1 1 38 PRO CG C -0.972 7.795 -4.519 1.00 . A B . 38 PRO CG 1 1 7 5582 1 1 38 PRO HA H -3.088 5.677 -3.671 1.00 . A B . 38 PRO HA 1 1 7 5583 1 1 38 PRO HB2 H -2.651 8.522 -3.400 1.00 . A B . 38 PRO HB2 1 1 7 5584 1 1 38 PRO HB3 H -1.781 7.195 -2.628 1.00 . A B . 38 PRO HB3 1 1 7 5585 1 1 38 PRO HD2 H -1.893 8.211 -6.411 1.00 . A B . 38 PRO HD2 1 1 7 5586 1 1 38 PRO HD3 H -0.646 6.943 -6.454 1.00 . A B . 38 PRO HD3 1 1 7 5587 1 1 38 PRO HG2 H -0.682 8.837 -4.529 1.00 . A B . 38 PRO HG2 1 1 7 5588 1 1 38 PRO HG3 H -0.137 7.179 -4.210 1.00 . A B . 38 PRO HG3 1 1 7 5589 1 1 38 PRO N N -2.471 6.364 -5.568 1.00 . A B . 38 PRO N 1 1 7 5590 1 1 38 PRO O O -4.709 8.091 -5.131 1.00 . A B . 38 PRO O 1 1 7 5591 1 1 39 VAL C C -6.721 8.423 -2.573 1.00 . A B . 39 VAL C 1 1 7 5592 1 1 39 VAL CA C -6.731 7.192 -3.476 1.00 . A B . 39 VAL CA 1 1 7 5593 1 1 39 VAL CB C -7.753 6.158 -2.948 1.00 . A B . 39 VAL CB 1 1 7 5594 1 1 39 VAL CG1 C -7.824 4.950 -3.868 1.00 . A B . 39 VAL CG1 1 1 7 5595 1 1 39 VAL CG2 C -7.419 5.737 -1.526 1.00 . A B . 39 VAL CG2 1 1 7 5596 1 1 39 VAL H H -5.159 5.854 -3.017 1.00 . A B . 39 VAL H 1 1 7 5597 1 1 39 VAL HA H -7.029 7.491 -4.470 1.00 . A B . 39 VAL HA 1 1 7 5598 1 1 39 VAL HB H -8.723 6.623 -2.939 1.00 . A B . 39 VAL HB 1 1 7 5599 1 1 39 VAL HG11 H -8.553 4.250 -3.485 1.00 . A B . 39 VAL HG11 1 1 7 5600 1 1 39 VAL HG12 H -6.857 4.475 -3.913 1.00 . A B . 39 VAL HG12 1 1 7 5601 1 1 39 VAL HG13 H -8.116 5.268 -4.858 1.00 . A B . 39 VAL HG13 1 1 7 5602 1 1 39 VAL HG21 H -7.465 6.601 -0.880 1.00 . A B . 39 VAL HG21 1 1 7 5603 1 1 39 VAL HG22 H -6.425 5.317 -1.499 1.00 . A B . 39 VAL HG22 1 1 7 5604 1 1 39 VAL HG23 H -8.134 5.000 -1.191 1.00 . A B . 39 VAL HG23 1 1 7 5605 1 1 39 VAL N N -5.387 6.637 -3.558 1.00 . A B . 39 VAL N 1 1 7 5606 1 1 39 VAL O O -5.928 8.498 -1.634 1.00 . A B . 39 VAL O 1 1 7 5607 1 1 40 GLU C C -8.919 10.935 -1.453 1.00 . A B . 40 GLU C 1 1 7 5608 1 1 40 GLU CA C -7.571 10.644 -2.108 1.00 . A B . 40 GLU CA 1 1 7 5609 1 1 40 GLU CB C -7.176 11.810 -3.018 1.00 . A B . 40 GLU CB 1 1 7 5610 1 1 40 GLU CD C -5.383 12.864 -4.437 1.00 . A B . 40 GLU CD 1 1 7 5611 1 1 40 GLU CG C -5.843 11.613 -3.725 1.00 . A B . 40 GLU CG 1 1 7 5612 1 1 40 GLU H H -8.215 9.275 -3.594 1.00 . A B . 40 GLU H 1 1 7 5613 1 1 40 GLU HA H -6.832 10.546 -1.330 1.00 . A B . 40 GLU HA 1 1 7 5614 1 1 40 GLU HB2 H -7.940 11.940 -3.768 1.00 . A B . 40 GLU HB2 1 1 7 5615 1 1 40 GLU HB3 H -7.112 12.709 -2.421 1.00 . A B . 40 GLU HB3 1 1 7 5616 1 1 40 GLU HG2 H -5.096 11.338 -2.997 1.00 . A B . 40 GLU HG2 1 1 7 5617 1 1 40 GLU HG3 H -5.946 10.819 -4.451 1.00 . A B . 40 GLU HG3 1 1 7 5618 1 1 40 GLU N N -7.579 9.394 -2.860 1.00 . A B . 40 GLU N 1 1 7 5619 1 1 40 GLU O O -8.985 11.620 -0.434 1.00 . A B . 40 GLU O 1 1 7 5620 1 1 40 GLU OE1 O -4.707 13.695 -3.796 1.00 . A B . 40 GLU OE1 1 1 7 5621 1 1 40 GLU OE2 O -5.702 13.029 -5.636 1.00 . A B . 40 GLU OE2 1 1 7 5622 1 1 41 ALA C C -11.612 9.772 -0.302 1.00 . A B . 41 ALA C 1 1 7 5623 1 1 41 ALA CA C -11.324 10.664 -1.502 1.00 . A B . 41 ALA CA 1 1 7 5624 1 1 41 ALA CB C -12.378 10.466 -2.584 1.00 . A B . 41 ALA CB 1 1 7 5625 1 1 41 ALA H H -9.879 9.836 -2.810 1.00 . A B . 41 ALA H 1 1 7 5626 1 1 41 ALA HA H -11.363 11.693 -1.184 1.00 . A B . 41 ALA HA 1 1 7 5627 1 1 41 ALA HB1 H -12.393 9.431 -2.889 1.00 . A B . 41 ALA HB1 1 1 7 5628 1 1 41 ALA HB2 H -12.141 11.088 -3.435 1.00 . A B . 41 ALA HB2 1 1 7 5629 1 1 41 ALA HB3 H -13.348 10.741 -2.196 1.00 . A B . 41 ALA HB3 1 1 7 5630 1 1 41 ALA N N -9.988 10.410 -2.027 1.00 . A B . 41 ALA N 1 1 7 5631 1 1 41 ALA O O -12.238 10.197 0.668 1.00 . A B . 41 ALA O 1 1 7 5632 1 1 42 GLU C C -9.989 7.039 1.173 1.00 . A B . 42 GLU C 1 1 7 5633 1 1 42 GLU CA C -11.332 7.581 0.708 1.00 . A B . 42 GLU CA 1 1 7 5634 1 1 42 GLU CB C -12.232 6.437 0.245 1.00 . A B . 42 GLU CB 1 1 7 5635 1 1 42 GLU CD C -14.473 5.745 -0.677 1.00 . A B . 42 GLU CD 1 1 7 5636 1 1 42 GLU CG C -13.614 6.891 -0.188 1.00 . A B . 42 GLU CG 1 1 7 5637 1 1 42 GLU H H -10.648 8.259 -1.172 1.00 . A B . 42 GLU H 1 1 7 5638 1 1 42 GLU HA H -11.807 8.097 1.530 1.00 . A B . 42 GLU HA 1 1 7 5639 1 1 42 GLU HB2 H -11.760 5.939 -0.589 1.00 . A B . 42 GLU HB2 1 1 7 5640 1 1 42 GLU HB3 H -12.345 5.735 1.055 1.00 . A B . 42 GLU HB3 1 1 7 5641 1 1 42 GLU HG2 H -14.106 7.355 0.653 1.00 . A B . 42 GLU HG2 1 1 7 5642 1 1 42 GLU HG3 H -13.508 7.611 -0.986 1.00 . A B . 42 GLU HG3 1 1 7 5643 1 1 42 GLU N N -11.139 8.538 -0.370 1.00 . A B . 42 GLU N 1 1 7 5644 1 1 42 GLU O O -9.814 5.833 1.354 1.00 . A B . 42 GLU O 1 1 7 5645 1 1 42 GLU OE1 O -15.145 5.104 0.158 1.00 . A B . 42 GLU OE1 1 1 7 5646 1 1 42 GLU OE2 O -14.482 5.482 -1.897 1.00 . A B . 42 GLU OE2 1 1 7 5647 1 1 43 ARG C C -7.610 7.297 3.257 1.00 . A B . 43 ARG C 1 1 7 5648 1 1 43 ARG CA C -7.693 7.583 1.759 1.00 . A B . 43 ARG CA 1 1 7 5649 1 1 43 ARG CB C -6.701 8.680 1.370 1.00 . A B . 43 ARG CB 1 1 7 5650 1 1 43 ARG CD C -5.915 11.033 1.745 1.00 . A B . 43 ARG CD 1 1 7 5651 1 1 43 ARG CG C -7.094 10.077 1.823 1.00 . A B . 43 ARG CG 1 1 7 5652 1 1 43 ARG CZ C -3.597 11.107 2.608 1.00 . A B . 43 ARG CZ 1 1 7 5653 1 1 43 ARG H H -9.270 8.891 1.242 1.00 . A B . 43 ARG H 1 1 7 5654 1 1 43 ARG HA H -7.433 6.680 1.229 1.00 . A B . 43 ARG HA 1 1 7 5655 1 1 43 ARG HB2 H -5.741 8.445 1.803 1.00 . A B . 43 ARG HB2 1 1 7 5656 1 1 43 ARG HB3 H -6.605 8.689 0.294 1.00 . A B . 43 ARG HB3 1 1 7 5657 1 1 43 ARG HD2 H -5.515 11.008 0.742 1.00 . A B . 43 ARG HD2 1 1 7 5658 1 1 43 ARG HD3 H -6.259 12.030 1.971 1.00 . A B . 43 ARG HD3 1 1 7 5659 1 1 43 ARG HE H -5.100 10.068 3.425 1.00 . A B . 43 ARG HE 1 1 7 5660 1 1 43 ARG HG2 H -7.885 10.442 1.183 1.00 . A B . 43 ARG HG2 1 1 7 5661 1 1 43 ARG HG3 H -7.446 10.029 2.842 1.00 . A B . 43 ARG HG3 1 1 7 5662 1 1 43 ARG HH11 H -3.890 12.209 0.930 1.00 . A B . 43 ARG HH11 1 1 7 5663 1 1 43 ARG HH12 H -2.278 12.245 1.570 1.00 . A B . 43 ARG HH12 1 1 7 5664 1 1 43 ARG HH21 H -2.974 10.127 4.273 1.00 . A B . 43 ARG HH21 1 1 7 5665 1 1 43 ARG HH22 H -1.757 11.060 3.457 1.00 . A B . 43 ARG HH22 1 1 7 5666 1 1 43 ARG N N -9.045 7.947 1.362 1.00 . A B . 43 ARG N 1 1 7 5667 1 1 43 ARG NE N -4.855 10.668 2.687 1.00 . A B . 43 ARG NE 1 1 7 5668 1 1 43 ARG NH1 N -3.226 11.918 1.623 1.00 . A B . 43 ARG NH1 1 1 7 5669 1 1 43 ARG NH2 N -2.706 10.736 3.520 1.00 . A B . 43 ARG NH2 1 1 7 5670 1 1 43 ARG O O -7.067 8.086 4.037 1.00 . A B . 43 ARG O 1 1 7 5671 1 1 44 THR C C -7.170 4.607 5.277 1.00 . A B . 44 THR C 1 1 7 5672 1 1 44 THR CA C -8.154 5.753 5.039 1.00 . A B . 44 THR CA 1 1 7 5673 1 1 44 THR CB C -9.567 5.315 5.464 1.00 . A B . 44 THR CB 1 1 7 5674 1 1 44 THR CG2 C -10.541 6.481 5.384 1.00 . A B . 44 THR CG2 1 1 7 5675 1 1 44 THR H H -8.549 5.569 2.975 1.00 . A B . 44 THR H 1 1 7 5676 1 1 44 THR HA H -7.863 6.603 5.638 1.00 . A B . 44 THR HA 1 1 7 5677 1 1 44 THR HB H -9.530 4.961 6.485 1.00 . A B . 44 THR HB 1 1 7 5678 1 1 44 THR HG1 H -9.306 3.621 4.485 1.00 . A B . 44 THR HG1 1 1 7 5679 1 1 44 THR HG21 H -11.521 6.155 5.698 1.00 . A B . 44 THR HG21 1 1 7 5680 1 1 44 THR HG22 H -10.589 6.838 4.365 1.00 . A B . 44 THR HG22 1 1 7 5681 1 1 44 THR HG23 H -10.202 7.279 6.028 1.00 . A B . 44 THR HG23 1 1 7 5682 1 1 44 THR N N -8.143 6.157 3.647 1.00 . A B . 44 THR N 1 1 7 5683 1 1 44 THR O O -7.425 3.475 4.869 1.00 . A B . 44 THR O 1 1 7 5684 1 1 44 THR OG1 O -10.024 4.258 4.613 1.00 . A B . 44 THR OG1 1 1 7 5685 1 1 45 PRO C C -5.470 2.760 7.130 1.00 . A B . 45 PRO C 1 1 7 5686 1 1 45 PRO CA C -4.994 3.867 6.187 1.00 . A B . 45 PRO CA 1 1 7 5687 1 1 45 PRO CB C -3.846 4.661 6.830 1.00 . A B . 45 PRO CB 1 1 7 5688 1 1 45 PRO CD C -5.632 6.201 6.445 1.00 . A B . 45 PRO CD 1 1 7 5689 1 1 45 PRO CG C -4.136 6.091 6.519 1.00 . A B . 45 PRO CG 1 1 7 5690 1 1 45 PRO HA H -4.649 3.419 5.267 1.00 . A B . 45 PRO HA 1 1 7 5691 1 1 45 PRO HB2 H -3.834 4.481 7.895 1.00 . A B . 45 PRO HB2 1 1 7 5692 1 1 45 PRO HB3 H -2.904 4.346 6.397 1.00 . A B . 45 PRO HB3 1 1 7 5693 1 1 45 PRO HD2 H -6.051 6.374 7.428 1.00 . A B . 45 PRO HD2 1 1 7 5694 1 1 45 PRO HD3 H -5.924 6.987 5.762 1.00 . A B . 45 PRO HD3 1 1 7 5695 1 1 45 PRO HG2 H -3.748 6.724 7.305 1.00 . A B . 45 PRO HG2 1 1 7 5696 1 1 45 PRO HG3 H -3.692 6.357 5.570 1.00 . A B . 45 PRO HG3 1 1 7 5697 1 1 45 PRO N N -6.027 4.882 5.928 1.00 . A B . 45 PRO N 1 1 7 5698 1 1 45 PRO O O -4.914 1.660 7.142 1.00 . A B . 45 PRO O 1 1 7 5699 1 1 46 TRP C C -8.135 1.214 8.209 1.00 . A B . 46 TRP C 1 1 7 5700 1 1 46 TRP CA C -7.049 2.072 8.857 1.00 . A B . 46 TRP CA 1 1 7 5701 1 1 46 TRP CB C -7.599 2.773 10.109 1.00 . A B . 46 TRP CB 1 1 7 5702 1 1 46 TRP CD1 C -10.001 3.614 9.757 1.00 . A B . 46 TRP CD1 1 1 7 5703 1 1 46 TRP CD2 C -8.436 5.207 9.583 1.00 . A B . 46 TRP CD2 1 1 7 5704 1 1 46 TRP CE2 C -9.700 5.792 9.377 1.00 . A B . 46 TRP CE2 1 1 7 5705 1 1 46 TRP CE3 C -7.299 6.020 9.521 1.00 . A B . 46 TRP CE3 1 1 7 5706 1 1 46 TRP CG C -8.650 3.810 9.825 1.00 . A B . 46 TRP CG 1 1 7 5707 1 1 46 TRP CH2 C -8.727 7.921 9.061 1.00 . A B . 46 TRP CH2 1 1 7 5708 1 1 46 TRP CZ2 C -9.857 7.150 9.115 1.00 . A B . 46 TRP CZ2 1 1 7 5709 1 1 46 TRP CZ3 C -7.459 7.368 9.260 1.00 . A B . 46 TRP CZ3 1 1 7 5710 1 1 46 TRP H H -6.931 3.930 7.836 1.00 . A B . 46 TRP H 1 1 7 5711 1 1 46 TRP HA H -6.236 1.423 9.150 1.00 . A B . 46 TRP HA 1 1 7 5712 1 1 46 TRP HB2 H -8.038 2.031 10.761 1.00 . A B . 46 TRP HB2 1 1 7 5713 1 1 46 TRP HB3 H -6.786 3.258 10.628 1.00 . A B . 46 TRP HB3 1 1 7 5714 1 1 46 TRP HD1 H -10.485 2.659 9.894 1.00 . A B . 46 TRP HD1 1 1 7 5715 1 1 46 TRP HE1 H -11.609 4.917 9.393 1.00 . A B . 46 TRP HE1 1 1 7 5716 1 1 46 TRP HE3 H -6.311 5.610 9.671 1.00 . A B . 46 TRP HE3 1 1 7 5717 1 1 46 TRP HH2 H -8.799 8.978 8.859 1.00 . A B . 46 TRP HH2 1 1 7 5718 1 1 46 TRP HZ2 H -10.830 7.593 8.963 1.00 . A B . 46 TRP HZ2 1 1 7 5719 1 1 46 TRP HZ3 H -6.593 8.012 9.209 1.00 . A B . 46 TRP HZ3 1 1 7 5720 1 1 46 TRP N N -6.512 3.046 7.907 1.00 . A B . 46 TRP N 1 1 7 5721 1 1 46 TRP NE1 N -10.637 4.800 9.487 1.00 . A B . 46 TRP NE1 1 1 7 5722 1 1 46 TRP O O -8.948 0.590 8.894 1.00 . A B . 46 TRP O 1 1 7 5723 1 1 47 ASN C C -8.425 -0.088 4.850 1.00 . A B . 47 ASN C 1 1 7 5724 1 1 47 ASN CA C -9.095 0.397 6.126 1.00 . A B . 47 ASN CA 1 1 7 5725 1 1 47 ASN CB C -10.337 1.235 5.787 1.00 . A B . 47 ASN CB 1 1 7 5726 1 1 47 ASN CG C -11.385 0.451 5.007 1.00 . A B . 47 ASN CG 1 1 7 5727 1 1 47 ASN H H -7.459 1.700 6.399 1.00 . A B . 47 ASN H 1 1 7 5728 1 1 47 ASN HA H -9.385 -0.454 6.725 1.00 . A B . 47 ASN HA 1 1 7 5729 1 1 47 ASN HB2 H -10.785 1.593 6.702 1.00 . A B . 47 ASN HB2 1 1 7 5730 1 1 47 ASN HB3 H -10.035 2.083 5.190 1.00 . A B . 47 ASN HB3 1 1 7 5731 1 1 47 ASN HD21 H -12.248 -0.161 6.692 1.00 . A B . 47 ASN HD21 1 1 7 5732 1 1 47 ASN HD22 H -12.978 -0.719 5.224 1.00 . A B . 47 ASN HD22 1 1 7 5733 1 1 47 ASN N N -8.137 1.185 6.888 1.00 . A B . 47 ASN N 1 1 7 5734 1 1 47 ASN ND2 N -12.294 -0.208 5.712 1.00 . A B . 47 ASN ND2 1 1 7 5735 1 1 47 ASN O O -7.645 0.644 4.246 1.00 . A B . 47 ASN O 1 1 7 5736 1 1 47 ASN OD1 O -11.377 0.442 3.777 1.00 . A B . 47 ASN OD1 1 1 7 5737 1 1 48 CYS C C -8.992 -1.608 2.049 1.00 . A B . 48 CYS C 1 1 7 5738 1 1 48 CYS CA C -8.084 -1.846 3.246 1.00 . A B . 48 CYS CA 1 1 7 5739 1 1 48 CYS CB C -7.790 -3.342 3.388 1.00 . A B . 48 CYS CB 1 1 7 5740 1 1 48 CYS H H -9.305 -1.881 4.973 1.00 . A B . 48 CYS H 1 1 7 5741 1 1 48 CYS HA H -7.155 -1.315 3.090 1.00 . A B . 48 CYS HA 1 1 7 5742 1 1 48 CYS HB2 H -7.199 -3.504 4.274 1.00 . A B . 48 CYS HB2 1 1 7 5743 1 1 48 CYS HB3 H -8.723 -3.881 3.478 1.00 . A B . 48 CYS HB3 1 1 7 5744 1 1 48 CYS N N -8.692 -1.322 4.452 1.00 . A B . 48 CYS N 1 1 7 5745 1 1 48 CYS O O -10.132 -2.073 2.017 1.00 . A B . 48 CYS O 1 1 7 5746 1 1 48 CYS SG S -6.885 -4.036 1.986 1.00 . A B . 48 CYS SG 1 1 7 5747 1 1 49 ILE C C -9.184 -1.831 -1.112 1.00 . A B . 49 ILE C 1 1 7 5748 1 1 49 ILE CA C -9.234 -0.643 -0.159 1.00 . A B . 49 ILE CA 1 1 7 5749 1 1 49 ILE CB C -8.756 0.631 -0.899 1.00 . A B . 49 ILE CB 1 1 7 5750 1 1 49 ILE CD1 C -6.734 1.723 -2.005 1.00 . A B . 49 ILE CD1 1 1 7 5751 1 1 49 ILE CG1 C -7.237 0.622 -1.095 1.00 . A B . 49 ILE CG1 1 1 7 5752 1 1 49 ILE CG2 C -9.189 1.883 -0.142 1.00 . A B . 49 ILE CG2 1 1 7 5753 1 1 49 ILE H H -7.565 -0.539 1.144 1.00 . A B . 49 ILE H 1 1 7 5754 1 1 49 ILE HA H -10.262 -0.490 0.136 1.00 . A B . 49 ILE HA 1 1 7 5755 1 1 49 ILE HB H -9.231 0.648 -1.868 1.00 . A B . 49 ILE HB 1 1 7 5756 1 1 49 ILE HD11 H -5.658 1.658 -2.092 1.00 . A B . 49 ILE HD11 1 1 7 5757 1 1 49 ILE HD12 H -7.003 2.684 -1.591 1.00 . A B . 49 ILE HD12 1 1 7 5758 1 1 49 ILE HD13 H -7.180 1.617 -2.983 1.00 . A B . 49 ILE HD13 1 1 7 5759 1 1 49 ILE HG12 H -6.763 0.750 -0.135 1.00 . A B . 49 ILE HG12 1 1 7 5760 1 1 49 ILE HG13 H -6.939 -0.326 -1.519 1.00 . A B . 49 ILE HG13 1 1 7 5761 1 1 49 ILE HG21 H -8.789 1.856 0.860 1.00 . A B . 49 ILE HG21 1 1 7 5762 1 1 49 ILE HG22 H -10.268 1.925 -0.098 1.00 . A B . 49 ILE HG22 1 1 7 5763 1 1 49 ILE HG23 H -8.817 2.759 -0.653 1.00 . A B . 49 ILE HG23 1 1 7 5764 1 1 49 ILE N N -8.472 -0.907 1.052 1.00 . A B . 49 ILE N 1 1 7 5765 1 1 49 ILE O O -10.096 -2.018 -1.907 1.00 . A B . 49 ILE O 1 1 7 5766 1 1 50 PHE C C -8.889 -4.942 -1.536 1.00 . A B . 50 PHE C 1 1 7 5767 1 1 50 PHE CA C -7.978 -3.785 -1.922 1.00 . A B . 50 PHE CA 1 1 7 5768 1 1 50 PHE CB C -6.519 -4.246 -1.999 1.00 . A B . 50 PHE CB 1 1 7 5769 1 1 50 PHE CD1 C -5.126 -2.243 -2.567 1.00 . A B . 50 PHE CD1 1 1 7 5770 1 1 50 PHE CD2 C -5.510 -3.871 -4.265 1.00 . A B . 50 PHE CD2 1 1 7 5771 1 1 50 PHE CE1 C -4.369 -1.498 -3.447 1.00 . A B . 50 PHE CE1 1 1 7 5772 1 1 50 PHE CE2 C -4.753 -3.130 -5.150 1.00 . A B . 50 PHE CE2 1 1 7 5773 1 1 50 PHE CG C -5.706 -3.436 -2.966 1.00 . A B . 50 PHE CG 1 1 7 5774 1 1 50 PHE CZ C -4.221 -1.938 -4.770 1.00 . A B . 50 PHE CZ 1 1 7 5775 1 1 50 PHE H H -7.487 -2.507 -0.296 1.00 . A B . 50 PHE H 1 1 7 5776 1 1 50 PHE HA H -8.276 -3.444 -2.904 1.00 . A B . 50 PHE HA 1 1 7 5777 1 1 50 PHE HB2 H -6.061 -4.162 -1.024 1.00 . A B . 50 PHE HB2 1 1 7 5778 1 1 50 PHE HB3 H -6.491 -5.278 -2.320 1.00 . A B . 50 PHE HB3 1 1 7 5779 1 1 50 PHE HD1 H -5.272 -1.894 -1.556 1.00 . A B . 50 PHE HD1 1 1 7 5780 1 1 50 PHE HD2 H -5.959 -4.799 -4.586 1.00 . A B . 50 PHE HD2 1 1 7 5781 1 1 50 PHE HE1 H -3.923 -0.569 -3.125 1.00 . A B . 50 PHE HE1 1 1 7 5782 1 1 50 PHE HE2 H -4.607 -3.480 -6.161 1.00 . A B . 50 PHE HE2 1 1 7 5783 1 1 50 PHE HZ H -3.644 -1.353 -5.469 1.00 . A B . 50 PHE HZ 1 1 7 5784 1 1 50 PHE N N -8.137 -2.648 -1.014 1.00 . A B . 50 PHE N 1 1 7 5785 1 1 50 PHE O O -9.406 -5.643 -2.404 1.00 . A B . 50 PHE O 1 1 7 5786 1 1 51 CYS C C -11.433 -5.859 -0.244 1.00 . A B . 51 CYS C 1 1 7 5787 1 1 51 CYS CA C -10.016 -6.171 0.224 1.00 . A B . 51 CYS CA 1 1 7 5788 1 1 51 CYS CB C -9.975 -6.307 1.753 1.00 . A B . 51 CYS CB 1 1 7 5789 1 1 51 CYS H H -8.649 -4.558 0.414 1.00 . A B . 51 CYS H 1 1 7 5790 1 1 51 CYS HA H -9.703 -7.106 -0.222 1.00 . A B . 51 CYS HA 1 1 7 5791 1 1 51 CYS HB2 H -9.843 -5.330 2.193 1.00 . A B . 51 CYS HB2 1 1 7 5792 1 1 51 CYS HB3 H -10.914 -6.720 2.095 1.00 . A B . 51 CYS HB3 1 1 7 5793 1 1 51 CYS N N -9.099 -5.134 -0.238 1.00 . A B . 51 CYS N 1 1 7 5794 1 1 51 CYS O O -12.129 -6.717 -0.785 1.00 . A B . 51 CYS O 1 1 7 5795 1 1 51 CYS SG S -8.648 -7.369 2.374 1.00 . A B . 51 CYS SG 1 1 7 5796 1 1 52 ARG C C -13.207 -3.922 -1.994 1.00 . A B . 52 ARG C 1 1 7 5797 1 1 52 ARG CA C -13.151 -4.149 -0.475 1.00 . A B . 52 ARG CA 1 1 7 5798 1 1 52 ARG CB C -13.490 -2.875 0.309 1.00 . A B . 52 ARG CB 1 1 7 5799 1 1 52 ARG CD C -15.100 -1.018 0.794 1.00 . A B . 52 ARG CD 1 1 7 5800 1 1 52 ARG CG C -14.693 -2.099 -0.196 1.00 . A B . 52 ARG CG 1 1 7 5801 1 1 52 ARG CZ C -13.440 0.813 0.876 1.00 . A B . 52 ARG CZ 1 1 7 5802 1 1 52 ARG H H -11.240 -3.980 0.396 1.00 . A B . 52 ARG H 1 1 7 5803 1 1 52 ARG HA H -13.860 -4.918 -0.215 1.00 . A B . 52 ARG HA 1 1 7 5804 1 1 52 ARG HB2 H -13.683 -3.145 1.336 1.00 . A B . 52 ARG HB2 1 1 7 5805 1 1 52 ARG HB3 H -12.633 -2.218 0.282 1.00 . A B . 52 ARG HB3 1 1 7 5806 1 1 52 ARG HD2 H -15.727 -0.300 0.288 1.00 . A B . 52 ARG HD2 1 1 7 5807 1 1 52 ARG HD3 H -15.656 -1.477 1.597 1.00 . A B . 52 ARG HD3 1 1 7 5808 1 1 52 ARG HE H -13.522 -0.724 2.153 1.00 . A B . 52 ARG HE 1 1 7 5809 1 1 52 ARG HG2 H -14.437 -1.634 -1.138 1.00 . A B . 52 ARG HG2 1 1 7 5810 1 1 52 ARG HG3 H -15.520 -2.779 -0.338 1.00 . A B . 52 ARG HG3 1 1 7 5811 1 1 52 ARG HH11 H -14.746 0.953 -0.668 1.00 . A B . 52 ARG HH11 1 1 7 5812 1 1 52 ARG HH12 H -13.580 2.231 -0.566 1.00 . A B . 52 ARG HH12 1 1 7 5813 1 1 52 ARG HH21 H -11.996 0.956 2.296 1.00 . A B . 52 ARG HH21 1 1 7 5814 1 1 52 ARG HH22 H -12.023 2.240 1.124 1.00 . A B . 52 ARG HH22 1 1 7 5815 1 1 52 ARG N N -11.835 -4.610 -0.059 1.00 . A B . 52 ARG N 1 1 7 5816 1 1 52 ARG NE N -13.940 -0.323 1.357 1.00 . A B . 52 ARG NE 1 1 7 5817 1 1 52 ARG NH1 N -13.965 1.377 -0.204 1.00 . A B . 52 ARG NH1 1 1 7 5818 1 1 52 ARG NH2 N -12.403 1.381 1.476 1.00 . A B . 52 ARG NH2 1 1 7 5819 1 1 52 ARG O O -14.284 -3.795 -2.577 1.00 . A B . 52 ARG O 1 1 7 5820 1 1 53 MET C C -12.430 -4.975 -4.801 1.00 . A B . 53 MET C 1 1 7 5821 1 1 53 MET CA C -11.964 -3.721 -4.080 1.00 . A B . 53 MET CA 1 1 7 5822 1 1 53 MET CB C -10.538 -3.373 -4.516 1.00 . A B . 53 MET CB 1 1 7 5823 1 1 53 MET CE C -11.029 -1.262 -8.073 1.00 . A B . 53 MET CE 1 1 7 5824 1 1 53 MET CG C -10.431 -2.959 -5.973 1.00 . A B . 53 MET CG 1 1 7 5825 1 1 53 MET H H -11.223 -4.065 -2.117 1.00 . A B . 53 MET H 1 1 7 5826 1 1 53 MET HA H -12.622 -2.907 -4.339 1.00 . A B . 53 MET HA 1 1 7 5827 1 1 53 MET HB2 H -10.175 -2.561 -3.905 1.00 . A B . 53 MET HB2 1 1 7 5828 1 1 53 MET HB3 H -9.906 -4.237 -4.364 1.00 . A B . 53 MET HB3 1 1 7 5829 1 1 53 MET HE1 H -11.583 -0.422 -8.457 1.00 . A B . 53 MET HE1 1 1 7 5830 1 1 53 MET HE2 H -11.259 -2.143 -8.655 1.00 . A B . 53 MET HE2 1 1 7 5831 1 1 53 MET HE3 H -9.971 -1.056 -8.138 1.00 . A B . 53 MET HE3 1 1 7 5832 1 1 53 MET HG2 H -9.404 -2.699 -6.187 1.00 . A B . 53 MET HG2 1 1 7 5833 1 1 53 MET HG3 H -10.728 -3.791 -6.593 1.00 . A B . 53 MET HG3 1 1 7 5834 1 1 53 MET N N -12.042 -3.917 -2.631 1.00 . A B . 53 MET N 1 1 7 5835 1 1 53 MET O O -13.066 -4.905 -5.851 1.00 . A B . 53 MET O 1 1 7 5836 1 1 53 MET SD S -11.477 -1.543 -6.365 1.00 . A B . 53 MET SD 1 1 7 5837 1 1 54 LYS C C -13.658 -7.966 -3.885 1.00 . A B . 54 LYS C 1 1 7 5838 1 1 54 LYS CA C -12.546 -7.401 -4.753 1.00 . A B . 54 LYS CA 1 1 7 5839 1 1 54 LYS CB C -11.369 -8.381 -4.838 1.00 . A B . 54 LYS CB 1 1 7 5840 1 1 54 LYS CD C -11.027 -8.173 -7.322 1.00 . A B . 54 LYS CD 1 1 7 5841 1 1 54 LYS CE C -10.065 -7.794 -8.436 1.00 . A B . 54 LYS CE 1 1 7 5842 1 1 54 LYS CG C -10.376 -8.062 -5.950 1.00 . A B . 54 LYS CG 1 1 7 5843 1 1 54 LYS H H -11.620 -6.100 -3.372 1.00 . A B . 54 LYS H 1 1 7 5844 1 1 54 LYS HA H -12.938 -7.228 -5.745 1.00 . A B . 54 LYS HA 1 1 7 5845 1 1 54 LYS HB2 H -10.839 -8.370 -3.897 1.00 . A B . 54 LYS HB2 1 1 7 5846 1 1 54 LYS HB3 H -11.756 -9.377 -5.007 1.00 . A B . 54 LYS HB3 1 1 7 5847 1 1 54 LYS HD2 H -11.352 -9.191 -7.475 1.00 . A B . 54 LYS HD2 1 1 7 5848 1 1 54 LYS HD3 H -11.880 -7.513 -7.359 1.00 . A B . 54 LYS HD3 1 1 7 5849 1 1 54 LYS HE2 H -10.579 -7.879 -9.382 1.00 . A B . 54 LYS HE2 1 1 7 5850 1 1 54 LYS HE3 H -9.754 -6.771 -8.290 1.00 . A B . 54 LYS HE3 1 1 7 5851 1 1 54 LYS HG2 H -10.006 -7.056 -5.821 1.00 . A B . 54 LYS HG2 1 1 7 5852 1 1 54 LYS HG3 H -9.555 -8.761 -5.894 1.00 . A B . 54 LYS HG3 1 1 7 5853 1 1 54 LYS HZ1 H -8.315 -8.551 -7.584 1.00 . A B . 54 LYS HZ1 1 1 7 5854 1 1 54 LYS HZ2 H -8.255 -8.413 -9.266 1.00 . A B . 54 LYS HZ2 1 1 7 5855 1 1 54 LYS HZ3 H -9.142 -9.662 -8.557 1.00 . A B . 54 LYS HZ3 1 1 7 5856 1 1 54 LYS N N -12.121 -6.119 -4.214 1.00 . A B . 54 LYS N 1 1 7 5857 1 1 54 LYS NZ N -8.862 -8.666 -8.462 1.00 . A B . 54 LYS NZ 1 1 7 5858 1 1 54 LYS O O -13.618 -9.119 -3.456 1.00 . A B . 54 LYS O 1 1 7 5859 1 1 55 GLU C C -17.064 -7.321 -3.543 1.00 . A B . 55 GLU C 1 1 7 5860 1 1 55 GLU CA C -15.762 -7.496 -2.776 1.00 . A B . 55 GLU CA 1 1 7 5861 1 1 55 GLU CB C -15.764 -6.618 -1.522 1.00 . A B . 55 GLU CB 1 1 7 5862 1 1 55 GLU CD C -16.624 -8.302 0.137 1.00 . A B . 55 GLU CD 1 1 7 5863 1 1 55 GLU CG C -16.853 -6.964 -0.524 1.00 . A B . 55 GLU CG 1 1 7 5864 1 1 55 GLU H H -14.639 -6.242 -4.042 1.00 . A B . 55 GLU H 1 1 7 5865 1 1 55 GLU HA H -15.648 -8.529 -2.490 1.00 . A B . 55 GLU HA 1 1 7 5866 1 1 55 GLU HB2 H -14.812 -6.725 -1.025 1.00 . A B . 55 GLU HB2 1 1 7 5867 1 1 55 GLU HB3 H -15.890 -5.588 -1.818 1.00 . A B . 55 GLU HB3 1 1 7 5868 1 1 55 GLU HG2 H -16.880 -6.201 0.240 1.00 . A B . 55 GLU HG2 1 1 7 5869 1 1 55 GLU HG3 H -17.802 -6.990 -1.041 1.00 . A B . 55 GLU HG3 1 1 7 5870 1 1 55 GLU N N -14.648 -7.132 -3.627 1.00 . A B . 55 GLU N 1 1 7 5871 1 1 55 GLU O O -17.286 -6.282 -4.165 1.00 . A B . 55 GLU O 1 1 7 5872 1 1 55 GLU OE1 O -15.880 -8.352 1.137 1.00 . A B . 55 GLU OE1 1 1 7 5873 1 1 55 GLU OE2 O -17.185 -9.312 -0.338 1.00 . A B . 55 GLU OE2 1 1 7 5874 1 1 56 SER C C -20.216 -7.649 -3.241 1.00 . A B . 56 SER C 1 1 7 5875 1 1 56 SER CA C -19.191 -8.250 -4.196 1.00 . A B . 56 SER CA 1 1 7 5876 1 1 56 SER CB C -19.638 -9.634 -4.683 1.00 . A B . 56 SER CB 1 1 7 5877 1 1 56 SER H H -17.670 -9.154 -3.042 1.00 . A B . 56 SER H 1 1 7 5878 1 1 56 SER HA H -19.078 -7.591 -5.045 1.00 . A B . 56 SER HA 1 1 7 5879 1 1 56 SER HB2 H -18.833 -10.098 -5.230 1.00 . A B . 56 SER HB2 1 1 7 5880 1 1 56 SER HB3 H -19.889 -10.245 -3.830 1.00 . A B . 56 SER HB3 1 1 7 5881 1 1 56 SER HG H -21.303 -8.781 -5.286 1.00 . A B . 56 SER HG 1 1 7 5882 1 1 56 SER N N -17.908 -8.335 -3.525 1.00 . A B . 56 SER N 1 1 7 5883 1 1 56 SER O O -20.799 -8.406 -2.438 1.00 . A B . 56 SER O 1 1 7 5884 1 1 56 SER OXT O -20.412 -6.416 -3.279 1.00 . A B . 56 SER OXT 1 1 7 5885 1 1 56 SER OG O -20.774 -9.549 -5.533 1.00 . A B . 56 SER OG 1 1 7 5886 2 2 1 ZN ZN ZN -6.606 -6.311 2.220 1.00 . B B . 101 ZN ZN 1 1 7 5887 3 2 1 ZN ZN ZN 5.771 1.134 -0.098 1.00 . C B . 102 ZN ZN 1 1 8 5888 1 1 1 GLY C C 13.861 -3.682 10.558 1.00 . A B . 1 GLY C 1 1 8 5889 1 1 1 GLY CA C 13.243 -3.106 11.816 1.00 . A B . 1 GLY CA 1 1 8 5890 1 1 1 GLY H1 H 13.473 -3.174 13.885 1.00 . A B . 1 GLY H1 1 1 8 5891 1 1 1 GLY H2 H 14.921 -3.334 13.029 1.00 . A B . 1 GLY H2 1 1 8 5892 1 1 1 GLY H3 H 13.838 -4.631 13.106 1.00 . A B . 1 GLY H3 1 1 8 5893 1 1 1 GLY HA2 H 12.201 -3.387 11.852 1.00 . A B . 1 GLY HA2 1 1 8 5894 1 1 1 GLY HA3 H 13.316 -2.029 11.781 1.00 . A B . 1 GLY HA3 1 1 8 5895 1 1 1 GLY N N 13.915 -3.595 13.045 1.00 . A B . 1 GLY N 1 1 8 5896 1 1 1 GLY O O 15.071 -3.913 10.512 1.00 . A B . 1 GLY O 1 1 8 5897 1 1 2 ALA C C 14.262 -5.737 8.409 1.00 . A B . 2 ALA C 1 1 8 5898 1 1 2 ALA CA C 13.460 -4.444 8.254 1.00 . A B . 2 ALA CA 1 1 8 5899 1 1 2 ALA CB C 14.266 -3.397 7.496 1.00 . A B . 2 ALA CB 1 1 8 5900 1 1 2 ALA H H 12.069 -3.728 9.677 1.00 . A B . 2 ALA H 1 1 8 5901 1 1 2 ALA HA H 12.574 -4.660 7.676 1.00 . A B . 2 ALA HA 1 1 8 5902 1 1 2 ALA HB1 H 13.676 -2.498 7.382 1.00 . A B . 2 ALA HB1 1 1 8 5903 1 1 2 ALA HB2 H 14.528 -3.779 6.520 1.00 . A B . 2 ALA HB2 1 1 8 5904 1 1 2 ALA HB3 H 15.167 -3.169 8.047 1.00 . A B . 2 ALA HB3 1 1 8 5905 1 1 2 ALA N N 13.023 -3.918 9.547 1.00 . A B . 2 ALA N 1 1 8 5906 1 1 2 ALA O O 15.448 -5.793 8.073 1.00 . A B . 2 ALA O 1 1 8 5907 1 1 3 MET C C 13.331 -9.197 8.675 1.00 . A B . 3 MET C 1 1 8 5908 1 1 3 MET CA C 14.258 -8.069 9.107 1.00 . A B . 3 MET CA 1 1 8 5909 1 1 3 MET CB C 14.669 -8.260 10.574 1.00 . A B . 3 MET CB 1 1 8 5910 1 1 3 MET CE C 16.599 -9.277 12.882 1.00 . A B . 3 MET CE 1 1 8 5911 1 1 3 MET CG C 15.827 -7.371 11.016 1.00 . A B . 3 MET CG 1 1 8 5912 1 1 3 MET H H 12.655 -6.680 9.136 1.00 . A B . 3 MET H 1 1 8 5913 1 1 3 MET HA H 15.142 -8.091 8.487 1.00 . A B . 3 MET HA 1 1 8 5914 1 1 3 MET HB2 H 13.819 -8.046 11.205 1.00 . A B . 3 MET HB2 1 1 8 5915 1 1 3 MET HB3 H 14.960 -9.290 10.720 1.00 . A B . 3 MET HB3 1 1 8 5916 1 1 3 MET HE1 H 16.882 -9.519 13.895 1.00 . A B . 3 MET HE1 1 1 8 5917 1 1 3 MET HE2 H 17.418 -9.500 12.215 1.00 . A B . 3 MET HE2 1 1 8 5918 1 1 3 MET HE3 H 15.737 -9.863 12.601 1.00 . A B . 3 MET HE3 1 1 8 5919 1 1 3 MET HG2 H 16.706 -7.641 10.452 1.00 . A B . 3 MET HG2 1 1 8 5920 1 1 3 MET HG3 H 15.573 -6.340 10.811 1.00 . A B . 3 MET HG3 1 1 8 5921 1 1 3 MET N N 13.609 -6.776 8.907 1.00 . A B . 3 MET N 1 1 8 5922 1 1 3 MET O O 13.243 -10.234 9.332 1.00 . A B . 3 MET O 1 1 8 5923 1 1 3 MET SD S 16.198 -7.533 12.776 1.00 . A B . 3 MET SD 1 1 8 5924 1 1 4 GLY C C 11.064 -9.568 5.774 1.00 . A B . 4 GLY C 1 1 8 5925 1 1 4 GLY CA C 11.715 -9.986 7.074 1.00 . A B . 4 GLY CA 1 1 8 5926 1 1 4 GLY H H 12.747 -8.139 7.080 1.00 . A B . 4 GLY H 1 1 8 5927 1 1 4 GLY HA2 H 12.255 -10.908 6.915 1.00 . A B . 4 GLY HA2 1 1 8 5928 1 1 4 GLY HA3 H 10.948 -10.154 7.813 1.00 . A B . 4 GLY HA3 1 1 8 5929 1 1 4 GLY N N 12.633 -8.984 7.570 1.00 . A B . 4 GLY N 1 1 8 5930 1 1 4 GLY O O 11.673 -9.665 4.709 1.00 . A B . 4 GLY O 1 1 8 5931 1 1 5 MET C C 8.757 -7.183 4.774 1.00 . A B . 5 MET C 1 1 8 5932 1 1 5 MET CA C 9.096 -8.664 4.677 1.00 . A B . 5 MET CA 1 1 8 5933 1 1 5 MET CB C 7.820 -9.492 4.497 1.00 . A B . 5 MET CB 1 1 8 5934 1 1 5 MET CE C 7.219 -13.531 3.653 1.00 . A B . 5 MET CE 1 1 8 5935 1 1 5 MET CG C 8.080 -10.958 4.185 1.00 . A B . 5 MET CG 1 1 8 5936 1 1 5 MET H H 9.403 -9.016 6.737 1.00 . A B . 5 MET H 1 1 8 5937 1 1 5 MET HA H 9.736 -8.815 3.821 1.00 . A B . 5 MET HA 1 1 8 5938 1 1 5 MET HB2 H 7.237 -9.436 5.405 1.00 . A B . 5 MET HB2 1 1 8 5939 1 1 5 MET HB3 H 7.243 -9.069 3.686 1.00 . A B . 5 MET HB3 1 1 8 5940 1 1 5 MET HE1 H 6.405 -14.230 3.527 1.00 . A B . 5 MET HE1 1 1 8 5941 1 1 5 MET HE2 H 7.856 -13.863 4.460 1.00 . A B . 5 MET HE2 1 1 8 5942 1 1 5 MET HE3 H 7.792 -13.477 2.740 1.00 . A B . 5 MET HE3 1 1 8 5943 1 1 5 MET HG2 H 8.620 -11.024 3.253 1.00 . A B . 5 MET HG2 1 1 8 5944 1 1 5 MET HG3 H 8.680 -11.381 4.978 1.00 . A B . 5 MET HG3 1 1 8 5945 1 1 5 MET N N 9.831 -9.093 5.858 1.00 . A B . 5 MET N 1 1 8 5946 1 1 5 MET O O 7.589 -6.793 4.812 1.00 . A B . 5 MET O 1 1 8 5947 1 1 5 MET SD S 6.560 -11.912 4.040 1.00 . A B . 5 MET SD 1 1 8 5948 1 1 6 ARG C C 10.255 -4.287 3.667 1.00 . A B . 6 ARG C 1 1 8 5949 1 1 6 ARG CA C 9.621 -4.925 4.896 1.00 . A B . 6 ARG CA 1 1 8 5950 1 1 6 ARG CB C 10.275 -4.374 6.168 1.00 . A B . 6 ARG CB 1 1 8 5951 1 1 6 ARG CD C 8.590 -2.980 7.436 1.00 . A B . 6 ARG CD 1 1 8 5952 1 1 6 ARG CG C 9.824 -2.969 6.540 1.00 . A B . 6 ARG CG 1 1 8 5953 1 1 6 ARG CZ C 6.246 -3.264 6.703 1.00 . A B . 6 ARG CZ 1 1 8 5954 1 1 6 ARG H H 10.697 -6.740 4.819 1.00 . A B . 6 ARG H 1 1 8 5955 1 1 6 ARG HA H 8.564 -4.706 4.908 1.00 . A B . 6 ARG HA 1 1 8 5956 1 1 6 ARG HB2 H 10.043 -5.032 6.990 1.00 . A B . 6 ARG HB2 1 1 8 5957 1 1 6 ARG HB3 H 11.344 -4.357 6.024 1.00 . A B . 6 ARG HB3 1 1 8 5958 1 1 6 ARG HD2 H 8.857 -3.416 8.385 1.00 . A B . 6 ARG HD2 1 1 8 5959 1 1 6 ARG HD3 H 8.268 -1.962 7.592 1.00 . A B . 6 ARG HD3 1 1 8 5960 1 1 6 ARG HE H 7.658 -4.685 6.631 1.00 . A B . 6 ARG HE 1 1 8 5961 1 1 6 ARG HG2 H 10.629 -2.472 7.062 1.00 . A B . 6 ARG HG2 1 1 8 5962 1 1 6 ARG HG3 H 9.595 -2.425 5.635 1.00 . A B . 6 ARG HG3 1 1 8 5963 1 1 6 ARG HH11 H 6.697 -1.380 7.316 1.00 . A B . 6 ARG HH11 1 1 8 5964 1 1 6 ARG HH12 H 5.045 -1.637 6.859 1.00 . A B . 6 ARG HH12 1 1 8 5965 1 1 6 ARG HH21 H 5.474 -5.019 6.043 1.00 . A B . 6 ARG HH21 1 1 8 5966 1 1 6 ARG HH22 H 4.350 -3.700 6.134 1.00 . A B . 6 ARG HH22 1 1 8 5967 1 1 6 ARG N N 9.790 -6.364 4.829 1.00 . A B . 6 ARG N 1 1 8 5968 1 1 6 ARG NE N 7.480 -3.745 6.867 1.00 . A B . 6 ARG NE 1 1 8 5969 1 1 6 ARG NH1 N 5.976 -1.991 6.980 1.00 . A B . 6 ARG NH1 1 1 8 5970 1 1 6 ARG NH2 N 5.280 -4.056 6.256 1.00 . A B . 6 ARG NH2 1 1 8 5971 1 1 6 ARG O O 11.077 -3.377 3.781 1.00 . A B . 6 ARG O 1 1 8 5972 1 1 7 ASN C C 9.898 -2.930 0.878 1.00 . A B . 7 ASN C 1 1 8 5973 1 1 7 ASN CA C 10.464 -4.295 1.244 1.00 . A B . 7 ASN CA 1 1 8 5974 1 1 7 ASN CB C 10.220 -5.279 0.099 1.00 . A B . 7 ASN CB 1 1 8 5975 1 1 7 ASN CG C 10.809 -4.800 -1.221 1.00 . A B . 7 ASN CG 1 1 8 5976 1 1 7 ASN H H 9.221 -5.505 2.468 1.00 . A B . 7 ASN H 1 1 8 5977 1 1 7 ASN HA H 11.529 -4.196 1.392 1.00 . A B . 7 ASN HA 1 1 8 5978 1 1 7 ASN HB2 H 10.671 -6.228 0.349 1.00 . A B . 7 ASN HB2 1 1 8 5979 1 1 7 ASN HB3 H 9.159 -5.412 -0.028 1.00 . A B . 7 ASN HB3 1 1 8 5980 1 1 7 ASN HD21 H 9.285 -5.588 -2.231 1.00 . A B . 7 ASN HD21 1 1 8 5981 1 1 7 ASN HD22 H 10.494 -4.805 -3.184 1.00 . A B . 7 ASN HD22 1 1 8 5982 1 1 7 ASN N N 9.890 -4.786 2.495 1.00 . A B . 7 ASN N 1 1 8 5983 1 1 7 ASN ND2 N 10.126 -5.091 -2.321 1.00 . A B . 7 ASN ND2 1 1 8 5984 1 1 7 ASN O O 8.943 -2.818 0.113 1.00 . A B . 7 ASN O 1 1 8 5985 1 1 7 ASN OD1 O 11.860 -4.154 -1.249 1.00 . A B . 7 ASN OD1 1 1 8 5986 1 1 8 LEU C C 11.375 0.229 0.662 1.00 . A B . 8 LEU C 1 1 8 5987 1 1 8 LEU CA C 10.137 -0.529 1.115 1.00 . A B . 8 LEU CA 1 1 8 5988 1 1 8 LEU CB C 9.453 0.160 2.308 1.00 . A B . 8 LEU CB 1 1 8 5989 1 1 8 LEU CD1 C 11.358 0.970 3.760 1.00 . A B . 8 LEU CD1 1 1 8 5990 1 1 8 LEU CD2 C 9.189 0.295 4.798 1.00 . A B . 8 LEU CD2 1 1 8 5991 1 1 8 LEU CG C 10.165 0.031 3.664 1.00 . A B . 8 LEU CG 1 1 8 5992 1 1 8 LEU H H 11.181 -2.062 2.126 1.00 . A B . 8 LEU H 1 1 8 5993 1 1 8 LEU HA H 9.444 -0.568 0.291 1.00 . A B . 8 LEU HA 1 1 8 5994 1 1 8 LEU HB2 H 9.358 1.209 2.078 1.00 . A B . 8 LEU HB2 1 1 8 5995 1 1 8 LEU HB3 H 8.462 -0.256 2.412 1.00 . A B . 8 LEU HB3 1 1 8 5996 1 1 8 LEU HD11 H 11.870 0.807 4.696 1.00 . A B . 8 LEU HD11 1 1 8 5997 1 1 8 LEU HD12 H 11.016 1.993 3.710 1.00 . A B . 8 LEU HD12 1 1 8 5998 1 1 8 LEU HD13 H 12.033 0.777 2.940 1.00 . A B . 8 LEU HD13 1 1 8 5999 1 1 8 LEU HD21 H 8.802 1.301 4.713 1.00 . A B . 8 LEU HD21 1 1 8 6000 1 1 8 LEU HD22 H 9.696 0.184 5.744 1.00 . A B . 8 LEU HD22 1 1 8 6001 1 1 8 LEU HD23 H 8.372 -0.409 4.742 1.00 . A B . 8 LEU HD23 1 1 8 6002 1 1 8 LEU HG H 10.532 -0.979 3.771 1.00 . A B . 8 LEU HG 1 1 8 6003 1 1 8 LEU N N 10.491 -1.897 1.448 1.00 . A B . 8 LEU N 1 1 8 6004 1 1 8 LEU O O 11.362 1.451 0.513 1.00 . A B . 8 LEU O 1 1 8 6005 1 1 9 ASP C C 13.666 0.432 -1.465 1.00 . A B . 9 ASP C 1 1 8 6006 1 1 9 ASP CA C 13.712 0.052 0.007 1.00 . A B . 9 ASP CA 1 1 8 6007 1 1 9 ASP CB C 14.846 -0.940 0.273 1.00 . A B . 9 ASP CB 1 1 8 6008 1 1 9 ASP CG C 16.214 -0.369 -0.033 1.00 . A B . 9 ASP CG 1 1 8 6009 1 1 9 ASP H H 12.348 -1.494 0.501 1.00 . A B . 9 ASP H 1 1 8 6010 1 1 9 ASP HA H 13.877 0.942 0.592 1.00 . A B . 9 ASP HA 1 1 8 6011 1 1 9 ASP HB2 H 14.827 -1.226 1.312 1.00 . A B . 9 ASP HB2 1 1 8 6012 1 1 9 ASP HB3 H 14.697 -1.817 -0.338 1.00 . A B . 9 ASP HB3 1 1 8 6013 1 1 9 ASP N N 12.437 -0.522 0.415 1.00 . A B . 9 ASP N 1 1 8 6014 1 1 9 ASP O O 14.311 1.382 -1.898 1.00 . A B . 9 ASP O 1 1 8 6015 1 1 9 ASP OD1 O 16.662 0.537 0.696 1.00 . A B . 9 ASP OD1 1 1 8 6016 1 1 9 ASP OD2 O 16.838 -0.806 -1.024 1.00 . A B . 9 ASP OD2 1 1 8 6017 1 1 10 GLU C C 11.499 0.865 -3.872 1.00 . A B . 10 GLU C 1 1 8 6018 1 1 10 GLU CA C 12.684 -0.063 -3.647 1.00 . A B . 10 GLU CA 1 1 8 6019 1 1 10 GLU CB C 12.448 -1.382 -4.379 1.00 . A B . 10 GLU CB 1 1 8 6020 1 1 10 GLU CD C 14.804 -1.962 -5.042 1.00 . A B . 10 GLU CD 1 1 8 6021 1 1 10 GLU CG C 13.592 -2.367 -4.236 1.00 . A B . 10 GLU CG 1 1 8 6022 1 1 10 GLU H H 12.418 -1.078 -1.806 1.00 . A B . 10 GLU H 1 1 8 6023 1 1 10 GLU HA H 13.578 0.404 -4.028 1.00 . A B . 10 GLU HA 1 1 8 6024 1 1 10 GLU HB2 H 11.552 -1.842 -3.992 1.00 . A B . 10 GLU HB2 1 1 8 6025 1 1 10 GLU HB3 H 12.310 -1.175 -5.430 1.00 . A B . 10 GLU HB3 1 1 8 6026 1 1 10 GLU HG2 H 13.874 -2.422 -3.196 1.00 . A B . 10 GLU HG2 1 1 8 6027 1 1 10 GLU HG3 H 13.262 -3.338 -4.571 1.00 . A B . 10 GLU HG3 1 1 8 6028 1 1 10 GLU N N 12.875 -0.317 -2.221 1.00 . A B . 10 GLU N 1 1 8 6029 1 1 10 GLU O O 11.173 1.230 -5.004 1.00 . A B . 10 GLU O 1 1 8 6030 1 1 10 GLU OE1 O 15.596 -1.138 -4.544 1.00 . A B . 10 GLU OE1 1 1 8 6031 1 1 10 GLU OE2 O 14.972 -2.456 -6.174 1.00 . A B . 10 GLU OE2 1 1 8 6032 1 1 11 CYS C C 9.995 3.478 -2.412 1.00 . A B . 11 CYS C 1 1 8 6033 1 1 11 CYS CA C 9.664 2.050 -2.828 1.00 . A B . 11 CYS CA 1 1 8 6034 1 1 11 CYS CB C 8.613 1.442 -1.910 1.00 . A B . 11 CYS CB 1 1 8 6035 1 1 11 CYS H H 11.241 1.002 -1.912 1.00 . A B . 11 CYS H 1 1 8 6036 1 1 11 CYS HA H 9.296 2.051 -3.842 1.00 . A B . 11 CYS HA 1 1 8 6037 1 1 11 CYS HB2 H 8.558 0.383 -2.100 1.00 . A B . 11 CYS HB2 1 1 8 6038 1 1 11 CYS HB3 H 8.918 1.597 -0.886 1.00 . A B . 11 CYS HB3 1 1 8 6039 1 1 11 CYS N N 10.861 1.239 -2.780 1.00 . A B . 11 CYS N 1 1 8 6040 1 1 11 CYS O O 10.012 3.801 -1.223 1.00 . A B . 11 CYS O 1 1 8 6041 1 1 11 CYS SG S 6.947 2.112 -2.094 1.00 . A B . 11 CYS SG 1 1 8 6042 1 1 12 GLU C C 9.583 6.501 -2.456 1.00 . A B . 12 GLU C 1 1 8 6043 1 1 12 GLU CA C 10.683 5.695 -3.131 1.00 . A B . 12 GLU CA 1 1 8 6044 1 1 12 GLU CB C 11.126 6.378 -4.423 1.00 . A B . 12 GLU CB 1 1 8 6045 1 1 12 GLU CD C 13.574 5.899 -4.041 1.00 . A B . 12 GLU CD 1 1 8 6046 1 1 12 GLU CG C 12.407 5.802 -5.004 1.00 . A B . 12 GLU CG 1 1 8 6047 1 1 12 GLU H H 10.152 4.029 -4.320 1.00 . A B . 12 GLU H 1 1 8 6048 1 1 12 GLU HA H 11.526 5.649 -2.461 1.00 . A B . 12 GLU HA 1 1 8 6049 1 1 12 GLU HB2 H 10.342 6.275 -5.157 1.00 . A B . 12 GLU HB2 1 1 8 6050 1 1 12 GLU HB3 H 11.286 7.426 -4.223 1.00 . A B . 12 GLU HB3 1 1 8 6051 1 1 12 GLU HG2 H 12.248 4.763 -5.248 1.00 . A B . 12 GLU HG2 1 1 8 6052 1 1 12 GLU HG3 H 12.655 6.348 -5.903 1.00 . A B . 12 GLU HG3 1 1 8 6053 1 1 12 GLU N N 10.258 4.325 -3.393 1.00 . A B . 12 GLU N 1 1 8 6054 1 1 12 GLU O O 9.858 7.472 -1.751 1.00 . A B . 12 GLU O 1 1 8 6055 1 1 12 GLU OE1 O 14.250 6.947 -4.027 1.00 . A B . 12 GLU OE1 1 1 8 6056 1 1 12 GLU OE2 O 13.824 4.932 -3.297 1.00 . A B . 12 GLU OE2 1 1 8 6057 1 1 13 VAL C C 7.210 6.404 -0.509 1.00 . A B . 13 VAL C 1 1 8 6058 1 1 13 VAL CA C 7.231 6.764 -1.997 1.00 . A B . 13 VAL CA 1 1 8 6059 1 1 13 VAL CB C 5.878 6.444 -2.671 1.00 . A B . 13 VAL CB 1 1 8 6060 1 1 13 VAL CG1 C 5.601 4.960 -2.679 1.00 . A B . 13 VAL CG1 1 1 8 6061 1 1 13 VAL CG2 C 4.744 7.193 -1.992 1.00 . A B . 13 VAL CG2 1 1 8 6062 1 1 13 VAL H H 8.156 5.357 -3.274 1.00 . A B . 13 VAL H 1 1 8 6063 1 1 13 VAL HA H 7.399 7.826 -2.083 1.00 . A B . 13 VAL HA 1 1 8 6064 1 1 13 VAL HB H 5.930 6.774 -3.698 1.00 . A B . 13 VAL HB 1 1 8 6065 1 1 13 VAL HG11 H 4.649 4.777 -3.151 1.00 . A B . 13 VAL HG11 1 1 8 6066 1 1 13 VAL HG12 H 5.576 4.594 -1.663 1.00 . A B . 13 VAL HG12 1 1 8 6067 1 1 13 VAL HG13 H 6.377 4.449 -3.227 1.00 . A B . 13 VAL HG13 1 1 8 6068 1 1 13 VAL HG21 H 4.674 6.877 -0.963 1.00 . A B . 13 VAL HG21 1 1 8 6069 1 1 13 VAL HG22 H 3.816 6.977 -2.501 1.00 . A B . 13 VAL HG22 1 1 8 6070 1 1 13 VAL HG23 H 4.939 8.255 -2.032 1.00 . A B . 13 VAL HG23 1 1 8 6071 1 1 13 VAL N N 8.338 6.105 -2.662 1.00 . A B . 13 VAL N 1 1 8 6072 1 1 13 VAL O O 6.990 7.265 0.337 1.00 . A B . 13 VAL O 1 1 8 6073 1 1 14 CYS C C 8.839 5.404 1.830 1.00 . A B . 14 CYS C 1 1 8 6074 1 1 14 CYS CA C 7.624 4.725 1.210 1.00 . A B . 14 CYS CA 1 1 8 6075 1 1 14 CYS CB C 7.766 3.209 1.331 1.00 . A B . 14 CYS CB 1 1 8 6076 1 1 14 CYS H H 7.566 4.470 -0.900 1.00 . A B . 14 CYS H 1 1 8 6077 1 1 14 CYS HA H 6.740 5.038 1.741 1.00 . A B . 14 CYS HA 1 1 8 6078 1 1 14 CYS HB2 H 8.239 2.834 0.438 1.00 . A B . 14 CYS HB2 1 1 8 6079 1 1 14 CYS HB3 H 8.390 2.986 2.182 1.00 . A B . 14 CYS HB3 1 1 8 6080 1 1 14 CYS N N 7.475 5.137 -0.186 1.00 . A B . 14 CYS N 1 1 8 6081 1 1 14 CYS O O 8.853 5.721 3.019 1.00 . A B . 14 CYS O 1 1 8 6082 1 1 14 CYS SG S 6.204 2.319 1.540 1.00 . A B . 14 CYS SG 1 1 8 6083 1 1 15 ARG C C 10.719 7.771 1.797 1.00 . A B . 15 ARG C 1 1 8 6084 1 1 15 ARG CA C 11.056 6.332 1.419 1.00 . A B . 15 ARG CA 1 1 8 6085 1 1 15 ARG CB C 12.073 6.304 0.275 1.00 . A B . 15 ARG CB 1 1 8 6086 1 1 15 ARG CD C 14.327 6.930 -0.612 1.00 . A B . 15 ARG CD 1 1 8 6087 1 1 15 ARG CG C 13.387 7.000 0.579 1.00 . A B . 15 ARG CG 1 1 8 6088 1 1 15 ARG CZ C 16.647 7.535 -1.196 1.00 . A B . 15 ARG CZ 1 1 8 6089 1 1 15 ARG H H 9.777 5.303 0.078 1.00 . A B . 15 ARG H 1 1 8 6090 1 1 15 ARG HA H 11.465 5.826 2.275 1.00 . A B . 15 ARG HA 1 1 8 6091 1 1 15 ARG HB2 H 12.287 5.277 0.027 1.00 . A B . 15 ARG HB2 1 1 8 6092 1 1 15 ARG HB3 H 11.630 6.785 -0.585 1.00 . A B . 15 ARG HB3 1 1 8 6093 1 1 15 ARG HD2 H 14.468 5.894 -0.883 1.00 . A B . 15 ARG HD2 1 1 8 6094 1 1 15 ARG HD3 H 13.872 7.456 -1.438 1.00 . A B . 15 ARG HD3 1 1 8 6095 1 1 15 ARG HE H 15.760 7.937 0.554 1.00 . A B . 15 ARG HE 1 1 8 6096 1 1 15 ARG HG2 H 13.188 8.034 0.811 1.00 . A B . 15 ARG HG2 1 1 8 6097 1 1 15 ARG HG3 H 13.854 6.520 1.426 1.00 . A B . 15 ARG HG3 1 1 8 6098 1 1 15 ARG HH11 H 15.617 6.609 -2.688 1.00 . A B . 15 ARG HH11 1 1 8 6099 1 1 15 ARG HH12 H 17.272 7.011 -3.055 1.00 . A B . 15 ARG HH12 1 1 8 6100 1 1 15 ARG HH21 H 17.913 8.499 0.058 1.00 . A B . 15 ARG HH21 1 1 8 6101 1 1 15 ARG HH22 H 18.573 8.089 -1.497 1.00 . A B . 15 ARG HH22 1 1 8 6102 1 1 15 ARG N N 9.849 5.629 1.002 1.00 . A B . 15 ARG N 1 1 8 6103 1 1 15 ARG NE N 15.632 7.525 -0.331 1.00 . A B . 15 ARG NE 1 1 8 6104 1 1 15 ARG NH1 N 16.502 7.011 -2.409 1.00 . A B . 15 ARG NH1 1 1 8 6105 1 1 15 ARG NH2 N 17.803 8.085 -0.852 1.00 . A B . 15 ARG NH2 1 1 8 6106 1 1 15 ARG O O 11.279 8.335 2.737 1.00 . A B . 15 ARG O 1 1 8 6107 1 1 16 ASP C C 8.353 9.679 2.545 1.00 . A B . 16 ASP C 1 1 8 6108 1 1 16 ASP CA C 9.282 9.686 1.333 1.00 . A B . 16 ASP CA 1 1 8 6109 1 1 16 ASP CB C 8.555 10.226 0.098 1.00 . A B . 16 ASP CB 1 1 8 6110 1 1 16 ASP CG C 7.947 11.598 0.307 1.00 . A B . 16 ASP CG 1 1 8 6111 1 1 16 ASP H H 9.501 7.892 0.229 1.00 . A B . 16 ASP H 1 1 8 6112 1 1 16 ASP HA H 10.125 10.322 1.549 1.00 . A B . 16 ASP HA 1 1 8 6113 1 1 16 ASP HB2 H 9.258 10.292 -0.716 1.00 . A B . 16 ASP HB2 1 1 8 6114 1 1 16 ASP HB3 H 7.766 9.538 -0.173 1.00 . A B . 16 ASP HB3 1 1 8 6115 1 1 16 ASP N N 9.797 8.351 1.046 1.00 . A B . 16 ASP N 1 1 8 6116 1 1 16 ASP O O 8.047 10.727 3.114 1.00 . A B . 16 ASP O 1 1 8 6117 1 1 16 ASP OD1 O 8.698 12.596 0.282 1.00 . A B . 16 ASP OD1 1 1 8 6118 1 1 16 ASP OD2 O 6.723 11.685 0.523 1.00 . A B . 16 ASP OD2 1 1 8 6119 1 1 17 GLY C C 5.601 8.164 3.694 1.00 . A B . 17 GLY C 1 1 8 6120 1 1 17 GLY CA C 7.048 8.368 4.094 1.00 . A B . 17 GLY CA 1 1 8 6121 1 1 17 GLY H H 8.244 7.688 2.487 1.00 . A B . 17 GLY H 1 1 8 6122 1 1 17 GLY HA2 H 7.367 7.526 4.692 1.00 . A B . 17 GLY HA2 1 1 8 6123 1 1 17 GLY HA3 H 7.121 9.268 4.689 1.00 . A B . 17 GLY HA3 1 1 8 6124 1 1 17 GLY N N 7.933 8.492 2.953 1.00 . A B . 17 GLY N 1 1 8 6125 1 1 17 GLY O O 4.692 8.479 4.464 1.00 . A B . 17 GLY O 1 1 8 6126 1 1 18 GLY C C 3.231 6.490 2.901 1.00 . A B . 18 GLY C 1 1 8 6127 1 1 18 GLY CA C 4.052 7.381 1.988 1.00 . A B . 18 GLY CA 1 1 8 6128 1 1 18 GLY H H 6.165 7.461 1.909 1.00 . A B . 18 GLY H 1 1 8 6129 1 1 18 GLY HA2 H 3.535 8.320 1.872 1.00 . A B . 18 GLY HA2 1 1 8 6130 1 1 18 GLY HA3 H 4.131 6.907 1.023 1.00 . A B . 18 GLY HA3 1 1 8 6131 1 1 18 GLY N N 5.393 7.646 2.486 1.00 . A B . 18 GLY N 1 1 8 6132 1 1 18 GLY O O 3.770 5.656 3.636 1.00 . A B . 18 GLY O 1 1 8 6133 1 1 19 GLU C C 0.410 4.736 2.960 1.00 . A B . 19 GLU C 1 1 8 6134 1 1 19 GLU CA C 1.002 5.936 3.693 1.00 . A B . 19 GLU CA 1 1 8 6135 1 1 19 GLU CB C -0.121 6.866 4.157 1.00 . A B . 19 GLU CB 1 1 8 6136 1 1 19 GLU CD C -0.781 8.918 5.474 1.00 . A B . 19 GLU CD 1 1 8 6137 1 1 19 GLU CG C 0.361 8.068 4.959 1.00 . A B . 19 GLU CG 1 1 8 6138 1 1 19 GLU H H 1.559 7.282 2.166 1.00 . A B . 19 GLU H 1 1 8 6139 1 1 19 GLU HA H 1.552 5.584 4.553 1.00 . A B . 19 GLU HA 1 1 8 6140 1 1 19 GLU HB2 H -0.641 7.234 3.286 1.00 . A B . 19 GLU HB2 1 1 8 6141 1 1 19 GLU HB3 H -0.814 6.304 4.768 1.00 . A B . 19 GLU HB3 1 1 8 6142 1 1 19 GLU HG2 H 0.939 7.720 5.802 1.00 . A B . 19 GLU HG2 1 1 8 6143 1 1 19 GLU HG3 H 0.987 8.681 4.326 1.00 . A B . 19 GLU HG3 1 1 8 6144 1 1 19 GLU N N 1.922 6.659 2.833 1.00 . A B . 19 GLU N 1 1 8 6145 1 1 19 GLU O O 0.137 4.802 1.761 1.00 . A B . 19 GLU O 1 1 8 6146 1 1 19 GLU OE1 O -1.251 9.799 4.725 1.00 . A B . 19 GLU OE1 1 1 8 6147 1 1 19 GLU OE2 O -1.223 8.705 6.623 1.00 . A B . 19 GLU OE2 1 1 8 6148 1 1 20 LEU C C -1.817 2.293 3.473 1.00 . A B . 20 LEU C 1 1 8 6149 1 1 20 LEU CA C -0.344 2.431 3.110 1.00 . A B . 20 LEU CA 1 1 8 6150 1 1 20 LEU CB C 0.423 1.201 3.596 1.00 . A B . 20 LEU CB 1 1 8 6151 1 1 20 LEU CD1 C 2.557 -0.104 3.650 1.00 . A B . 20 LEU CD1 1 1 8 6152 1 1 20 LEU CD2 C 1.495 0.419 1.462 1.00 . A B . 20 LEU CD2 1 1 8 6153 1 1 20 LEU CG C 1.747 0.921 2.878 1.00 . A B . 20 LEU CG 1 1 8 6154 1 1 20 LEU H H 0.453 3.660 4.636 1.00 . A B . 20 LEU H 1 1 8 6155 1 1 20 LEU HA H -0.253 2.498 2.038 1.00 . A B . 20 LEU HA 1 1 8 6156 1 1 20 LEU HB2 H 0.630 1.329 4.649 1.00 . A B . 20 LEU HB2 1 1 8 6157 1 1 20 LEU HB3 H -0.215 0.340 3.475 1.00 . A B . 20 LEU HB3 1 1 8 6158 1 1 20 LEU HD11 H 2.784 0.280 4.633 1.00 . A B . 20 LEU HD11 1 1 8 6159 1 1 20 LEU HD12 H 3.475 -0.308 3.122 1.00 . A B . 20 LEU HD12 1 1 8 6160 1 1 20 LEU HD13 H 1.984 -1.015 3.743 1.00 . A B . 20 LEU HD13 1 1 8 6161 1 1 20 LEU HD21 H 1.014 1.193 0.881 1.00 . A B . 20 LEU HD21 1 1 8 6162 1 1 20 LEU HD22 H 0.858 -0.452 1.495 1.00 . A B . 20 LEU HD22 1 1 8 6163 1 1 20 LEU HD23 H 2.435 0.157 0.999 1.00 . A B . 20 LEU HD23 1 1 8 6164 1 1 20 LEU HG H 2.324 1.836 2.817 1.00 . A B . 20 LEU HG 1 1 8 6165 1 1 20 LEU N N 0.220 3.645 3.683 1.00 . A B . 20 LEU N 1 1 8 6166 1 1 20 LEU O O -2.177 2.263 4.651 1.00 . A B . 20 LEU O 1 1 8 6167 1 1 21 PHE C C -4.533 0.634 2.340 1.00 . A B . 21 PHE C 1 1 8 6168 1 1 21 PHE CA C -4.096 2.055 2.671 1.00 . A B . 21 PHE CA 1 1 8 6169 1 1 21 PHE CB C -4.863 3.078 1.829 1.00 . A B . 21 PHE CB 1 1 8 6170 1 1 21 PHE CD1 C -4.965 5.100 3.317 1.00 . A B . 21 PHE CD1 1 1 8 6171 1 1 21 PHE CD2 C -3.665 5.231 1.321 1.00 . A B . 21 PHE CD2 1 1 8 6172 1 1 21 PHE CE1 C -4.618 6.398 3.630 1.00 . A B . 21 PHE CE1 1 1 8 6173 1 1 21 PHE CE2 C -3.319 6.529 1.631 1.00 . A B . 21 PHE CE2 1 1 8 6174 1 1 21 PHE CG C -4.494 4.498 2.159 1.00 . A B . 21 PHE CG 1 1 8 6175 1 1 21 PHE CZ C -3.795 7.114 2.786 1.00 . A B . 21 PHE CZ 1 1 8 6176 1 1 21 PHE H H -2.309 2.222 1.540 1.00 . A B . 21 PHE H 1 1 8 6177 1 1 21 PHE HA H -4.290 2.242 3.719 1.00 . A B . 21 PHE HA 1 1 8 6178 1 1 21 PHE HB2 H -4.648 2.908 0.783 1.00 . A B . 21 PHE HB2 1 1 8 6179 1 1 21 PHE HB3 H -5.925 2.957 2.000 1.00 . A B . 21 PHE HB3 1 1 8 6180 1 1 21 PHE HD1 H -5.612 4.545 3.981 1.00 . A B . 21 PHE HD1 1 1 8 6181 1 1 21 PHE HD2 H -3.289 4.778 0.414 1.00 . A B . 21 PHE HD2 1 1 8 6182 1 1 21 PHE HE1 H -4.993 6.854 4.534 1.00 . A B . 21 PHE HE1 1 1 8 6183 1 1 21 PHE HE2 H -2.675 7.088 0.968 1.00 . A B . 21 PHE HE2 1 1 8 6184 1 1 21 PHE HZ H -3.525 8.131 3.032 1.00 . A B . 21 PHE HZ 1 1 8 6185 1 1 21 PHE N N -2.661 2.197 2.459 1.00 . A B . 21 PHE N 1 1 8 6186 1 1 21 PHE O O -5.602 0.397 1.773 1.00 . A B . 21 PHE O 1 1 8 6187 1 1 22 CYS C C -3.737 -2.495 3.745 1.00 . A B . 22 CYS C 1 1 8 6188 1 1 22 CYS CA C -3.929 -1.711 2.455 1.00 . A B . 22 CYS CA 1 1 8 6189 1 1 22 CYS CB C -2.965 -2.217 1.376 1.00 . A B . 22 CYS CB 1 1 8 6190 1 1 22 CYS H H -2.866 -0.050 3.179 1.00 . A B . 22 CYS H 1 1 8 6191 1 1 22 CYS HA H -4.947 -1.824 2.113 1.00 . A B . 22 CYS HA 1 1 8 6192 1 1 22 CYS HB2 H -1.948 -2.061 1.713 1.00 . A B . 22 CYS HB2 1 1 8 6193 1 1 22 CYS HB3 H -3.128 -3.273 1.216 1.00 . A B . 22 CYS HB3 1 1 8 6194 1 1 22 CYS N N -3.685 -0.307 2.708 1.00 . A B . 22 CYS N 1 1 8 6195 1 1 22 CYS O O -3.017 -2.052 4.642 1.00 . A B . 22 CYS O 1 1 8 6196 1 1 22 CYS SG S -3.142 -1.378 -0.229 1.00 . A B . 22 CYS SG 1 1 8 6197 1 1 23 CYS C C -2.945 -5.289 4.857 1.00 . A B . 23 CYS C 1 1 8 6198 1 1 23 CYS CA C -4.233 -4.493 5.014 1.00 . A B . 23 CYS CA 1 1 8 6199 1 1 23 CYS CB C -5.440 -5.428 5.186 1.00 . A B . 23 CYS CB 1 1 8 6200 1 1 23 CYS H H -4.977 -3.927 3.119 1.00 . A B . 23 CYS H 1 1 8 6201 1 1 23 CYS HA H -4.145 -3.854 5.883 1.00 . A B . 23 CYS HA 1 1 8 6202 1 1 23 CYS HB2 H -5.412 -5.860 6.176 1.00 . A B . 23 CYS HB2 1 1 8 6203 1 1 23 CYS HB3 H -6.348 -4.855 5.075 1.00 . A B . 23 CYS HB3 1 1 8 6204 1 1 23 CYS N N -4.393 -3.643 3.848 1.00 . A B . 23 CYS N 1 1 8 6205 1 1 23 CYS O O -2.428 -5.387 3.742 1.00 . A B . 23 CYS O 1 1 8 6206 1 1 23 CYS SG S -5.506 -6.795 4.004 1.00 . A B . 23 CYS SG 1 1 8 6207 1 1 24 ASP C C -0.988 -7.498 4.780 1.00 . A B . 24 ASP C 1 1 8 6208 1 1 24 ASP CA C -1.137 -6.534 5.952 1.00 . A B . 24 ASP CA 1 1 8 6209 1 1 24 ASP CB C -0.910 -7.287 7.267 1.00 . A B . 24 ASP CB 1 1 8 6210 1 1 24 ASP CG C -0.901 -6.374 8.475 1.00 . A B . 24 ASP CG 1 1 8 6211 1 1 24 ASP H H -2.982 -5.866 6.772 1.00 . A B . 24 ASP H 1 1 8 6212 1 1 24 ASP HA H -0.384 -5.766 5.859 1.00 . A B . 24 ASP HA 1 1 8 6213 1 1 24 ASP HB2 H -1.695 -8.015 7.398 1.00 . A B . 24 ASP HB2 1 1 8 6214 1 1 24 ASP HB3 H 0.041 -7.797 7.219 1.00 . A B . 24 ASP HB3 1 1 8 6215 1 1 24 ASP N N -2.449 -5.871 5.948 1.00 . A B . 24 ASP N 1 1 8 6216 1 1 24 ASP O O 0.049 -7.528 4.117 1.00 . A B . 24 ASP O 1 1 8 6217 1 1 24 ASP OD1 O 0.174 -5.829 8.813 1.00 . A B . 24 ASP OD1 1 1 8 6218 1 1 24 ASP OD2 O -1.967 -6.197 9.100 1.00 . A B . 24 ASP OD2 1 1 8 6219 1 1 25 THR C C -1.861 -8.555 2.070 1.00 . A B . 25 THR C 1 1 8 6220 1 1 25 THR CA C -2.029 -9.231 3.435 1.00 . A B . 25 THR CA 1 1 8 6221 1 1 25 THR CB C -3.322 -10.067 3.443 1.00 . A B . 25 THR CB 1 1 8 6222 1 1 25 THR CG2 C -3.245 -11.201 2.433 1.00 . A B . 25 THR CG2 1 1 8 6223 1 1 25 THR H H -2.844 -8.165 5.068 1.00 . A B . 25 THR H 1 1 8 6224 1 1 25 THR HA H -1.197 -9.897 3.598 1.00 . A B . 25 THR HA 1 1 8 6225 1 1 25 THR HB H -4.150 -9.425 3.184 1.00 . A B . 25 THR HB 1 1 8 6226 1 1 25 THR HG1 H -3.145 -11.483 4.808 1.00 . A B . 25 THR HG1 1 1 8 6227 1 1 25 THR HG21 H -4.164 -11.766 2.457 1.00 . A B . 25 THR HG21 1 1 8 6228 1 1 25 THR HG22 H -2.417 -11.849 2.682 1.00 . A B . 25 THR HG22 1 1 8 6229 1 1 25 THR HG23 H -3.098 -10.794 1.443 1.00 . A B . 25 THR HG23 1 1 8 6230 1 1 25 THR N N -2.040 -8.259 4.514 1.00 . A B . 25 THR N 1 1 8 6231 1 1 25 THR O O -0.963 -8.905 1.305 1.00 . A B . 25 THR O 1 1 8 6232 1 1 25 THR OG1 O -3.537 -10.604 4.755 1.00 . A B . 25 THR OG1 1 1 8 6233 1 1 26 CYS C C -1.454 -6.044 0.283 1.00 . A B . 26 CYS C 1 1 8 6234 1 1 26 CYS CA C -2.687 -6.922 0.469 1.00 . A B . 26 CYS CA 1 1 8 6235 1 1 26 CYS CB C -3.943 -6.083 0.248 1.00 . A B . 26 CYS CB 1 1 8 6236 1 1 26 CYS H H -3.329 -7.253 2.467 1.00 . A B . 26 CYS H 1 1 8 6237 1 1 26 CYS HA H -2.661 -7.707 -0.271 1.00 . A B . 26 CYS HA 1 1 8 6238 1 1 26 CYS HB2 H -3.989 -5.318 1.005 1.00 . A B . 26 CYS HB2 1 1 8 6239 1 1 26 CYS HB3 H -3.890 -5.614 -0.723 1.00 . A B . 26 CYS HB3 1 1 8 6240 1 1 26 CYS N N -2.700 -7.564 1.782 1.00 . A B . 26 CYS N 1 1 8 6241 1 1 26 CYS O O -0.951 -5.915 -0.828 1.00 . A B . 26 CYS O 1 1 8 6242 1 1 26 CYS SG S -5.488 -7.008 0.331 1.00 . A B . 26 CYS SG 1 1 8 6243 1 1 27 SER C C 1.437 -5.384 0.882 1.00 . A B . 27 SER C 1 1 8 6244 1 1 27 SER CA C 0.208 -4.584 1.295 1.00 . A B . 27 SER CA 1 1 8 6245 1 1 27 SER CB C 0.457 -3.912 2.645 1.00 . A B . 27 SER CB 1 1 8 6246 1 1 27 SER H H -1.410 -5.576 2.234 1.00 . A B . 27 SER H 1 1 8 6247 1 1 27 SER HA H 0.021 -3.824 0.549 1.00 . A B . 27 SER HA 1 1 8 6248 1 1 27 SER HB2 H 0.665 -4.668 3.386 1.00 . A B . 27 SER HB2 1 1 8 6249 1 1 27 SER HB3 H 1.302 -3.248 2.559 1.00 . A B . 27 SER HB3 1 1 8 6250 1 1 27 SER HG H -0.434 -2.639 3.839 1.00 . A B . 27 SER HG 1 1 8 6251 1 1 27 SER N N -0.969 -5.444 1.365 1.00 . A B . 27 SER N 1 1 8 6252 1 1 27 SER O O 2.373 -4.845 0.301 1.00 . A B . 27 SER O 1 1 8 6253 1 1 27 SER OG O -0.670 -3.165 3.063 1.00 . A B . 27 SER OG 1 1 8 6254 1 1 28 ARG C C 2.359 -8.012 -0.638 1.00 . A B . 28 ARG C 1 1 8 6255 1 1 28 ARG CA C 2.514 -7.561 0.811 1.00 . A B . 28 ARG CA 1 1 8 6256 1 1 28 ARG CB C 2.549 -8.778 1.729 1.00 . A B . 28 ARG CB 1 1 8 6257 1 1 28 ARG CD C 2.878 -9.676 4.043 1.00 . A B . 28 ARG CD 1 1 8 6258 1 1 28 ARG CG C 3.074 -8.485 3.123 1.00 . A B . 28 ARG CG 1 1 8 6259 1 1 28 ARG CZ C 3.048 -12.126 3.858 1.00 . A B . 28 ARG CZ 1 1 8 6260 1 1 28 ARG H H 0.694 -7.027 1.741 1.00 . A B . 28 ARG H 1 1 8 6261 1 1 28 ARG HA H 3.441 -7.018 0.908 1.00 . A B . 28 ARG HA 1 1 8 6262 1 1 28 ARG HB2 H 1.548 -9.170 1.823 1.00 . A B . 28 ARG HB2 1 1 8 6263 1 1 28 ARG HB3 H 3.181 -9.532 1.281 1.00 . A B . 28 ARG HB3 1 1 8 6264 1 1 28 ARG HD2 H 3.391 -9.484 4.974 1.00 . A B . 28 ARG HD2 1 1 8 6265 1 1 28 ARG HD3 H 1.822 -9.799 4.234 1.00 . A B . 28 ARG HD3 1 1 8 6266 1 1 28 ARG HE H 4.049 -10.820 2.723 1.00 . A B . 28 ARG HE 1 1 8 6267 1 1 28 ARG HG2 H 4.128 -8.258 3.062 1.00 . A B . 28 ARG HG2 1 1 8 6268 1 1 28 ARG HG3 H 2.543 -7.636 3.528 1.00 . A B . 28 ARG HG3 1 1 8 6269 1 1 28 ARG HH11 H 1.824 -11.487 5.341 1.00 . A B . 28 ARG HH11 1 1 8 6270 1 1 28 ARG HH12 H 1.944 -13.210 5.164 1.00 . A B . 28 ARG HH12 1 1 8 6271 1 1 28 ARG HH21 H 4.196 -13.074 2.487 1.00 . A B . 28 ARG HH21 1 1 8 6272 1 1 28 ARG HH22 H 3.288 -14.112 3.542 1.00 . A B . 28 ARG HH22 1 1 8 6273 1 1 28 ARG N N 1.433 -6.671 1.204 1.00 . A B . 28 ARG N 1 1 8 6274 1 1 28 ARG NE N 3.402 -10.908 3.462 1.00 . A B . 28 ARG NE 1 1 8 6275 1 1 28 ARG NH1 N 2.203 -12.286 4.868 1.00 . A B . 28 ARG NH1 1 1 8 6276 1 1 28 ARG NH2 N 3.550 -13.189 3.247 1.00 . A B . 28 ARG NH2 1 1 8 6277 1 1 28 ARG O O 3.340 -8.143 -1.365 1.00 . A B . 28 ARG O 1 1 8 6278 1 1 29 VAL C C 0.918 -7.617 -3.422 1.00 . A B . 29 VAL C 1 1 8 6279 1 1 29 VAL CA C 0.861 -8.745 -2.394 1.00 . A B . 29 VAL CA 1 1 8 6280 1 1 29 VAL CB C -0.511 -9.456 -2.486 1.00 . A B . 29 VAL CB 1 1 8 6281 1 1 29 VAL CG1 C -0.731 -10.034 -3.875 1.00 . A B . 29 VAL CG1 1 1 8 6282 1 1 29 VAL CG2 C -0.624 -10.554 -1.441 1.00 . A B . 29 VAL CG2 1 1 8 6283 1 1 29 VAL H H 0.373 -8.058 -0.450 1.00 . A B . 29 VAL H 1 1 8 6284 1 1 29 VAL HA H 1.629 -9.464 -2.628 1.00 . A B . 29 VAL HA 1 1 8 6285 1 1 29 VAL HB H -1.284 -8.728 -2.295 1.00 . A B . 29 VAL HB 1 1 8 6286 1 1 29 VAL HG11 H 0.042 -10.756 -4.090 1.00 . A B . 29 VAL HG11 1 1 8 6287 1 1 29 VAL HG12 H -0.695 -9.241 -4.606 1.00 . A B . 29 VAL HG12 1 1 8 6288 1 1 29 VAL HG13 H -1.695 -10.518 -3.914 1.00 . A B . 29 VAL HG13 1 1 8 6289 1 1 29 VAL HG21 H -0.556 -10.123 -0.454 1.00 . A B . 29 VAL HG21 1 1 8 6290 1 1 29 VAL HG22 H 0.176 -11.264 -1.579 1.00 . A B . 29 VAL HG22 1 1 8 6291 1 1 29 VAL HG23 H -1.573 -11.055 -1.549 1.00 . A B . 29 VAL HG23 1 1 8 6292 1 1 29 VAL N N 1.122 -8.240 -1.054 1.00 . A B . 29 VAL N 1 1 8 6293 1 1 29 VAL O O 1.542 -7.752 -4.474 1.00 . A B . 29 VAL O 1 1 8 6294 1 1 30 PHE C C 0.788 -4.120 -3.433 1.00 . A B . 30 PHE C 1 1 8 6295 1 1 30 PHE CA C 0.187 -5.384 -4.038 1.00 . A B . 30 PHE CA 1 1 8 6296 1 1 30 PHE CB C -1.278 -5.107 -4.408 1.00 . A B . 30 PHE CB 1 1 8 6297 1 1 30 PHE CD1 C -1.704 -6.847 -6.176 1.00 . A B . 30 PHE CD1 1 1 8 6298 1 1 30 PHE CD2 C -3.077 -6.842 -4.225 1.00 . A B . 30 PHE CD2 1 1 8 6299 1 1 30 PHE CE1 C -2.406 -7.929 -6.669 1.00 . A B . 30 PHE CE1 1 1 8 6300 1 1 30 PHE CE2 C -3.781 -7.924 -4.713 1.00 . A B . 30 PHE CE2 1 1 8 6301 1 1 30 PHE CG C -2.030 -6.292 -4.947 1.00 . A B . 30 PHE CG 1 1 8 6302 1 1 30 PHE CZ C -3.445 -8.468 -5.937 1.00 . A B . 30 PHE CZ 1 1 8 6303 1 1 30 PHE H H -0.134 -6.416 -2.217 1.00 . A B . 30 PHE H 1 1 8 6304 1 1 30 PHE HA H 0.736 -5.647 -4.928 1.00 . A B . 30 PHE HA 1 1 8 6305 1 1 30 PHE HB2 H -1.803 -4.763 -3.528 1.00 . A B . 30 PHE HB2 1 1 8 6306 1 1 30 PHE HB3 H -1.307 -4.331 -5.157 1.00 . A B . 30 PHE HB3 1 1 8 6307 1 1 30 PHE HD1 H -0.891 -6.428 -6.749 1.00 . A B . 30 PHE HD1 1 1 8 6308 1 1 30 PHE HD2 H -3.344 -6.416 -3.271 1.00 . A B . 30 PHE HD2 1 1 8 6309 1 1 30 PHE HE1 H -2.141 -8.352 -7.627 1.00 . A B . 30 PHE HE1 1 1 8 6310 1 1 30 PHE HE2 H -4.593 -8.343 -4.138 1.00 . A B . 30 PHE HE2 1 1 8 6311 1 1 30 PHE HZ H -3.995 -9.315 -6.322 1.00 . A B . 30 PHE HZ 1 1 8 6312 1 1 30 PHE N N 0.281 -6.499 -3.107 1.00 . A B . 30 PHE N 1 1 8 6313 1 1 30 PHE O O 0.137 -3.077 -3.402 1.00 . A B . 30 PHE O 1 1 8 6314 1 1 31 HIS C C 2.783 -1.892 -3.292 1.00 . A B . 31 HIS C 1 1 8 6315 1 1 31 HIS CA C 2.671 -3.060 -2.318 1.00 . A B . 31 HIS CA 1 1 8 6316 1 1 31 HIS CB C 4.058 -3.442 -1.795 1.00 . A B . 31 HIS CB 1 1 8 6317 1 1 31 HIS CD2 C 5.770 -1.533 -1.347 1.00 . A B . 31 HIS CD2 1 1 8 6318 1 1 31 HIS CE1 C 5.266 -1.071 0.705 1.00 . A B . 31 HIS CE1 1 1 8 6319 1 1 31 HIS CG C 4.745 -2.359 -1.002 1.00 . A B . 31 HIS CG 1 1 8 6320 1 1 31 HIS H H 2.508 -5.059 -3.013 1.00 . A B . 31 HIS H 1 1 8 6321 1 1 31 HIS HA H 2.055 -2.757 -1.486 1.00 . A B . 31 HIS HA 1 1 8 6322 1 1 31 HIS HB2 H 3.962 -4.309 -1.157 1.00 . A B . 31 HIS HB2 1 1 8 6323 1 1 31 HIS HB3 H 4.690 -3.691 -2.637 1.00 . A B . 31 HIS HB3 1 1 8 6324 1 1 31 HIS HD1 H 3.743 -2.482 0.847 1.00 . A B . 31 HIS HD1 1 1 8 6325 1 1 31 HIS HD2 H 6.246 -1.487 -2.313 1.00 . A B . 31 HIS HD2 1 1 8 6326 1 1 31 HIS HE1 H 5.259 -0.632 1.692 1.00 . A B . 31 HIS HE1 1 1 8 6327 1 1 31 HIS N N 2.025 -4.207 -2.952 1.00 . A B . 31 HIS N 1 1 8 6328 1 1 31 HIS ND1 N 4.440 -2.053 0.304 1.00 . A B . 31 HIS ND1 1 1 8 6329 1 1 31 HIS NE2 N 6.095 -0.716 -0.260 1.00 . A B . 31 HIS NE2 1 1 8 6330 1 1 31 HIS O O 2.345 -0.793 -2.991 1.00 . A B . 31 HIS O 1 1 8 6331 1 1 32 GLU C C 2.233 -0.484 -5.916 1.00 . A B . 32 GLU C 1 1 8 6332 1 1 32 GLU CA C 3.546 -1.102 -5.463 1.00 . A B . 32 GLU CA 1 1 8 6333 1 1 32 GLU CB C 4.296 -1.657 -6.673 1.00 . A B . 32 GLU CB 1 1 8 6334 1 1 32 GLU CD C 6.384 -2.756 -7.567 1.00 . A B . 32 GLU CD 1 1 8 6335 1 1 32 GLU CG C 5.723 -2.093 -6.376 1.00 . A B . 32 GLU CG 1 1 8 6336 1 1 32 GLU H H 3.486 -3.087 -4.723 1.00 . A B . 32 GLU H 1 1 8 6337 1 1 32 GLU HA H 4.148 -0.340 -4.991 1.00 . A B . 32 GLU HA 1 1 8 6338 1 1 32 GLU HB2 H 3.754 -2.510 -7.053 1.00 . A B . 32 GLU HB2 1 1 8 6339 1 1 32 GLU HB3 H 4.329 -0.895 -7.438 1.00 . A B . 32 GLU HB3 1 1 8 6340 1 1 32 GLU HG2 H 6.303 -1.226 -6.101 1.00 . A B . 32 GLU HG2 1 1 8 6341 1 1 32 GLU HG3 H 5.711 -2.795 -5.555 1.00 . A B . 32 GLU HG3 1 1 8 6342 1 1 32 GLU N N 3.301 -2.157 -4.483 1.00 . A B . 32 GLU N 1 1 8 6343 1 1 32 GLU O O 2.135 0.723 -6.129 1.00 . A B . 32 GLU O 1 1 8 6344 1 1 32 GLU OE1 O 6.659 -2.061 -8.566 1.00 . A B . 32 GLU OE1 1 1 8 6345 1 1 32 GLU OE2 O 6.620 -3.980 -7.516 1.00 . A B . 32 GLU OE2 1 1 8 6346 1 1 33 ASP C C -0.812 -0.134 -5.383 1.00 . A B . 33 ASP C 1 1 8 6347 1 1 33 ASP CA C -0.091 -0.899 -6.487 1.00 . A B . 33 ASP CA 1 1 8 6348 1 1 33 ASP CB C -0.933 -2.106 -6.910 1.00 . A B . 33 ASP CB 1 1 8 6349 1 1 33 ASP CG C -0.261 -2.955 -7.973 1.00 . A B . 33 ASP CG 1 1 8 6350 1 1 33 ASP H H 1.369 -2.270 -5.814 1.00 . A B . 33 ASP H 1 1 8 6351 1 1 33 ASP HA H 0.046 -0.245 -7.337 1.00 . A B . 33 ASP HA 1 1 8 6352 1 1 33 ASP HB2 H -1.113 -2.724 -6.048 1.00 . A B . 33 ASP HB2 1 1 8 6353 1 1 33 ASP HB3 H -1.880 -1.759 -7.300 1.00 . A B . 33 ASP HB3 1 1 8 6354 1 1 33 ASP N N 1.224 -1.328 -6.036 1.00 . A B . 33 ASP N 1 1 8 6355 1 1 33 ASP O O -1.700 0.669 -5.656 1.00 . A B . 33 ASP O 1 1 8 6356 1 1 33 ASP OD1 O 0.656 -3.733 -7.629 1.00 . A B . 33 ASP OD1 1 1 8 6357 1 1 33 ASP OD2 O -0.645 -2.849 -9.160 1.00 . A B . 33 ASP OD2 1 1 8 6358 1 1 34 CYS C C -0.701 1.720 -2.897 1.00 . A B . 34 CYS C 1 1 8 6359 1 1 34 CYS CA C -1.057 0.237 -2.979 1.00 . A B . 34 CYS CA 1 1 8 6360 1 1 34 CYS CB C -0.629 -0.469 -1.681 1.00 . A B . 34 CYS CB 1 1 8 6361 1 1 34 CYS H H 0.307 -1.036 -3.993 1.00 . A B . 34 CYS H 1 1 8 6362 1 1 34 CYS HA H -2.127 0.146 -3.093 1.00 . A B . 34 CYS HA 1 1 8 6363 1 1 34 CYS HB2 H -0.690 -1.544 -1.812 1.00 . A B . 34 CYS HB2 1 1 8 6364 1 1 34 CYS HB3 H 0.395 -0.200 -1.461 1.00 . A B . 34 CYS HB3 1 1 8 6365 1 1 34 CYS N N -0.424 -0.394 -4.140 1.00 . A B . 34 CYS N 1 1 8 6366 1 1 34 CYS O O -1.353 2.487 -2.191 1.00 . A B . 34 CYS O 1 1 8 6367 1 1 34 CYS SG S -1.633 -0.023 -0.224 1.00 . A B . 34 CYS SG 1 1 8 6368 1 1 35 HIS C C 0.307 4.278 -4.813 1.00 . A B . 35 HIS C 1 1 8 6369 1 1 35 HIS CA C 0.794 3.504 -3.592 1.00 . A B . 35 HIS CA 1 1 8 6370 1 1 35 HIS CB C 2.322 3.545 -3.524 1.00 . A B . 35 HIS CB 1 1 8 6371 1 1 35 HIS CD2 C 3.323 1.634 -2.098 1.00 . A B . 35 HIS CD2 1 1 8 6372 1 1 35 HIS CE1 C 3.507 2.645 -0.202 1.00 . A B . 35 HIS CE1 1 1 8 6373 1 1 35 HIS CG C 2.881 2.900 -2.290 1.00 . A B . 35 HIS CG 1 1 8 6374 1 1 35 HIS H H 0.795 1.474 -4.198 1.00 . A B . 35 HIS H 1 1 8 6375 1 1 35 HIS HA H 0.393 3.965 -2.702 1.00 . A B . 35 HIS HA 1 1 8 6376 1 1 35 HIS HB2 H 2.722 3.025 -4.382 1.00 . A B . 35 HIS HB2 1 1 8 6377 1 1 35 HIS HB3 H 2.648 4.575 -3.545 1.00 . A B . 35 HIS HB3 1 1 8 6378 1 1 35 HIS HD1 H 2.721 4.451 -0.862 1.00 . A B . 35 HIS HD1 1 1 8 6379 1 1 35 HIS HD2 H 3.372 0.860 -2.851 1.00 . A B . 35 HIS HD2 1 1 8 6380 1 1 35 HIS HE1 H 3.727 2.868 0.833 1.00 . A B . 35 HIS HE1 1 1 8 6381 1 1 35 HIS N N 0.331 2.122 -3.626 1.00 . A B . 35 HIS N 1 1 8 6382 1 1 35 HIS ND1 N 3.000 3.529 -1.070 1.00 . A B . 35 HIS ND1 1 1 8 6383 1 1 35 HIS NE2 N 3.717 1.472 -0.778 1.00 . A B . 35 HIS NE2 1 1 8 6384 1 1 35 HIS O O 0.663 5.440 -5.010 1.00 . A B . 35 HIS O 1 1 8 6385 1 1 36 ILE C C -2.529 4.146 -6.910 1.00 . A B . 36 ILE C 1 1 8 6386 1 1 36 ILE CA C -1.004 4.230 -6.859 1.00 . A B . 36 ILE CA 1 1 8 6387 1 1 36 ILE CB C -0.410 3.523 -8.099 1.00 . A B . 36 ILE CB 1 1 8 6388 1 1 36 ILE CD1 C 1.790 2.798 -9.177 1.00 . A B . 36 ILE CD1 1 1 8 6389 1 1 36 ILE CG1 C 1.121 3.536 -8.035 1.00 . A B . 36 ILE CG1 1 1 8 6390 1 1 36 ILE CG2 C -0.899 4.182 -9.382 1.00 . A B . 36 ILE CG2 1 1 8 6391 1 1 36 ILE H H -0.786 2.718 -5.402 1.00 . A B . 36 ILE H 1 1 8 6392 1 1 36 ILE HA H -0.701 5.265 -6.873 1.00 . A B . 36 ILE HA 1 1 8 6393 1 1 36 ILE HB H -0.753 2.500 -8.097 1.00 . A B . 36 ILE HB 1 1 8 6394 1 1 36 ILE HD11 H 1.503 3.250 -10.115 1.00 . A B . 36 ILE HD11 1 1 8 6395 1 1 36 ILE HD12 H 1.482 1.762 -9.167 1.00 . A B . 36 ILE HD12 1 1 8 6396 1 1 36 ILE HD13 H 2.863 2.854 -9.063 1.00 . A B . 36 ILE HD13 1 1 8 6397 1 1 36 ILE HG12 H 1.468 4.559 -8.053 1.00 . A B . 36 ILE HG12 1 1 8 6398 1 1 36 ILE HG13 H 1.436 3.073 -7.111 1.00 . A B . 36 ILE HG13 1 1 8 6399 1 1 36 ILE HG21 H -0.475 3.670 -10.234 1.00 . A B . 36 ILE HG21 1 1 8 6400 1 1 36 ILE HG22 H -0.593 5.218 -9.395 1.00 . A B . 36 ILE HG22 1 1 8 6401 1 1 36 ILE HG23 H -1.976 4.124 -9.427 1.00 . A B . 36 ILE HG23 1 1 8 6402 1 1 36 ILE N N -0.506 3.628 -5.633 1.00 . A B . 36 ILE N 1 1 8 6403 1 1 36 ILE O O -3.096 3.068 -6.742 1.00 . A B . 36 ILE O 1 1 8 6404 1 1 37 PRO C C -2.337 7.300 -6.015 1.00 . A B . 37 PRO C 1 1 8 6405 1 1 37 PRO CA C -2.614 6.589 -7.340 1.00 . A B . 37 PRO CA 1 1 8 6406 1 1 37 PRO CB C -3.687 7.365 -8.135 1.00 . A B . 37 PRO CB 1 1 8 6407 1 1 37 PRO CD C -4.681 5.358 -7.219 1.00 . A B . 37 PRO CD 1 1 8 6408 1 1 37 PRO CG C -4.891 6.472 -8.210 1.00 . A B . 37 PRO CG 1 1 8 6409 1 1 37 PRO HA H -1.702 6.526 -7.917 1.00 . A B . 37 PRO HA 1 1 8 6410 1 1 37 PRO HB2 H -3.919 8.286 -7.614 1.00 . A B . 37 PRO HB2 1 1 8 6411 1 1 37 PRO HB3 H -3.308 7.597 -9.123 1.00 . A B . 37 PRO HB3 1 1 8 6412 1 1 37 PRO HD2 H -5.107 5.617 -6.258 1.00 . A B . 37 PRO HD2 1 1 8 6413 1 1 37 PRO HD3 H -5.102 4.433 -7.586 1.00 . A B . 37 PRO HD3 1 1 8 6414 1 1 37 PRO HG2 H -5.777 7.035 -7.952 1.00 . A B . 37 PRO HG2 1 1 8 6415 1 1 37 PRO HG3 H -4.984 6.072 -9.209 1.00 . A B . 37 PRO HG3 1 1 8 6416 1 1 37 PRO N N -3.223 5.274 -7.139 1.00 . A B . 37 PRO N 1 1 8 6417 1 1 37 PRO O O -2.754 6.823 -4.958 1.00 . A B . 37 PRO O 1 1 8 6418 1 1 38 PRO C C -2.741 9.623 -4.194 1.00 . A B . 38 PRO C 1 1 8 6419 1 1 38 PRO CA C -1.418 9.271 -4.863 1.00 . A B . 38 PRO CA 1 1 8 6420 1 1 38 PRO CB C -0.747 10.532 -5.406 1.00 . A B . 38 PRO CB 1 1 8 6421 1 1 38 PRO CD C -0.956 9.001 -7.241 1.00 . A B . 38 PRO CD 1 1 8 6422 1 1 38 PRO CG C -0.093 10.102 -6.676 1.00 . A B . 38 PRO CG 1 1 8 6423 1 1 38 PRO HA H -0.766 8.786 -4.151 1.00 . A B . 38 PRO HA 1 1 8 6424 1 1 38 PRO HB2 H -1.497 11.292 -5.581 1.00 . A B . 38 PRO HB2 1 1 8 6425 1 1 38 PRO HB3 H -0.024 10.894 -4.691 1.00 . A B . 38 PRO HB3 1 1 8 6426 1 1 38 PRO HD2 H -1.682 9.405 -7.936 1.00 . A B . 38 PRO HD2 1 1 8 6427 1 1 38 PRO HD3 H -0.347 8.249 -7.726 1.00 . A B . 38 PRO HD3 1 1 8 6428 1 1 38 PRO HG2 H -0.044 10.935 -7.365 1.00 . A B . 38 PRO HG2 1 1 8 6429 1 1 38 PRO HG3 H 0.901 9.731 -6.466 1.00 . A B . 38 PRO HG3 1 1 8 6430 1 1 38 PRO N N -1.627 8.443 -6.052 1.00 . A B . 38 PRO N 1 1 8 6431 1 1 38 PRO O O -3.692 10.045 -4.860 1.00 . A B . 38 PRO O 1 1 8 6432 1 1 39 VAL C C -4.419 11.122 -2.079 1.00 . A B . 39 VAL C 1 1 8 6433 1 1 39 VAL CA C -4.039 9.642 -2.152 1.00 . A B . 39 VAL CA 1 1 8 6434 1 1 39 VAL CB C -3.976 9.021 -0.737 1.00 . A B . 39 VAL CB 1 1 8 6435 1 1 39 VAL CG1 C -2.856 9.627 0.097 1.00 . A B . 39 VAL CG1 1 1 8 6436 1 1 39 VAL CG2 C -5.315 9.161 -0.028 1.00 . A B . 39 VAL CG2 1 1 8 6437 1 1 39 VAL H H -1.994 9.175 -2.399 1.00 . A B . 39 VAL H 1 1 8 6438 1 1 39 VAL HA H -4.812 9.125 -2.699 1.00 . A B . 39 VAL HA 1 1 8 6439 1 1 39 VAL HB H -3.771 7.969 -0.849 1.00 . A B . 39 VAL HB 1 1 8 6440 1 1 39 VAL HG11 H -2.937 10.703 0.082 1.00 . A B . 39 VAL HG11 1 1 8 6441 1 1 39 VAL HG12 H -1.901 9.330 -0.310 1.00 . A B . 39 VAL HG12 1 1 8 6442 1 1 39 VAL HG13 H -2.935 9.276 1.114 1.00 . A B . 39 VAL HG13 1 1 8 6443 1 1 39 VAL HG21 H -5.528 10.206 0.136 1.00 . A B . 39 VAL HG21 1 1 8 6444 1 1 39 VAL HG22 H -5.274 8.648 0.921 1.00 . A B . 39 VAL HG22 1 1 8 6445 1 1 39 VAL HG23 H -6.092 8.726 -0.639 1.00 . A B . 39 VAL HG23 1 1 8 6446 1 1 39 VAL N N -2.802 9.445 -2.884 1.00 . A B . 39 VAL N 1 1 8 6447 1 1 39 VAL O O -3.692 11.951 -1.527 1.00 . A B . 39 VAL O 1 1 8 6448 1 1 40 GLU C C -7.609 12.732 -2.690 1.00 . A B . 40 GLU C 1 1 8 6449 1 1 40 GLU CA C -6.083 12.794 -2.665 1.00 . A B . 40 GLU CA 1 1 8 6450 1 1 40 GLU CB C -5.554 13.587 -3.866 1.00 . A B . 40 GLU CB 1 1 8 6451 1 1 40 GLU CD C -5.540 15.775 -5.113 1.00 . A B . 40 GLU CD 1 1 8 6452 1 1 40 GLU CG C -5.914 15.061 -3.834 1.00 . A B . 40 GLU CG 1 1 8 6453 1 1 40 GLU H H -6.050 10.748 -3.153 1.00 . A B . 40 GLU H 1 1 8 6454 1 1 40 GLU HA H -5.764 13.272 -1.750 1.00 . A B . 40 GLU HA 1 1 8 6455 1 1 40 GLU HB2 H -4.478 13.502 -3.892 1.00 . A B . 40 GLU HB2 1 1 8 6456 1 1 40 GLU HB3 H -5.960 13.159 -4.769 1.00 . A B . 40 GLU HB3 1 1 8 6457 1 1 40 GLU HG2 H -6.979 15.155 -3.684 1.00 . A B . 40 GLU HG2 1 1 8 6458 1 1 40 GLU HG3 H -5.393 15.531 -3.012 1.00 . A B . 40 GLU HG3 1 1 8 6459 1 1 40 GLU N N -5.553 11.444 -2.678 1.00 . A B . 40 GLU N 1 1 8 6460 1 1 40 GLU O O -8.245 13.072 -3.688 1.00 . A B . 40 GLU O 1 1 8 6461 1 1 40 GLU OE1 O -6.347 15.741 -6.067 1.00 . A B . 40 GLU OE1 1 1 8 6462 1 1 40 GLU OE2 O -4.441 16.369 -5.171 1.00 . A B . 40 GLU OE2 1 1 8 6463 1 1 41 ALA C C -10.008 11.773 -0.044 1.00 . A B . 41 ALA C 1 1 8 6464 1 1 41 ALA CA C -9.624 12.081 -1.483 1.00 . A B . 41 ALA CA 1 1 8 6465 1 1 41 ALA CB C -10.085 10.959 -2.406 1.00 . A B . 41 ALA CB 1 1 8 6466 1 1 41 ALA H H -7.623 12.061 -0.813 1.00 . A B . 41 ALA H 1 1 8 6467 1 1 41 ALA HA H -10.108 12.994 -1.790 1.00 . A B . 41 ALA HA 1 1 8 6468 1 1 41 ALA HB1 H -11.155 10.840 -2.325 1.00 . A B . 41 ALA HB1 1 1 8 6469 1 1 41 ALA HB2 H -9.597 10.038 -2.123 1.00 . A B . 41 ALA HB2 1 1 8 6470 1 1 41 ALA HB3 H -9.825 11.204 -3.425 1.00 . A B . 41 ALA HB3 1 1 8 6471 1 1 41 ALA N N -8.184 12.267 -1.590 1.00 . A B . 41 ALA N 1 1 8 6472 1 1 41 ALA O O -10.718 12.543 0.604 1.00 . A B . 41 ALA O 1 1 8 6473 1 1 42 GLU C C -8.648 9.333 2.310 1.00 . A B . 42 GLU C 1 1 8 6474 1 1 42 GLU CA C -9.795 10.201 1.800 1.00 . A B . 42 GLU CA 1 1 8 6475 1 1 42 GLU CB C -11.116 9.430 1.832 1.00 . A B . 42 GLU CB 1 1 8 6476 1 1 42 GLU CD C -12.571 7.684 0.738 1.00 . A B . 42 GLU CD 1 1 8 6477 1 1 42 GLU CG C -11.210 8.339 0.778 1.00 . A B . 42 GLU CG 1 1 8 6478 1 1 42 GLU H H -8.935 10.099 -0.115 1.00 . A B . 42 GLU H 1 1 8 6479 1 1 42 GLU HA H -9.882 11.074 2.428 1.00 . A B . 42 GLU HA 1 1 8 6480 1 1 42 GLU HB2 H -11.228 8.974 2.803 1.00 . A B . 42 GLU HB2 1 1 8 6481 1 1 42 GLU HB3 H -11.927 10.124 1.673 1.00 . A B . 42 GLU HB3 1 1 8 6482 1 1 42 GLU HG2 H -11.011 8.776 -0.189 1.00 . A B . 42 GLU HG2 1 1 8 6483 1 1 42 GLU HG3 H -10.469 7.585 0.991 1.00 . A B . 42 GLU HG3 1 1 8 6484 1 1 42 GLU N N -9.513 10.649 0.449 1.00 . A B . 42 GLU N 1 1 8 6485 1 1 42 GLU O O -8.239 8.381 1.643 1.00 . A B . 42 GLU O 1 1 8 6486 1 1 42 GLU OE1 O -12.844 6.811 1.585 1.00 . A B . 42 GLU OE1 1 1 8 6487 1 1 42 GLU OE2 O -13.385 8.047 -0.134 1.00 . A B . 42 GLU OE2 1 1 8 6488 1 1 43 ARG C C -7.467 8.098 5.231 1.00 . A B . 43 ARG C 1 1 8 6489 1 1 43 ARG CA C -7.002 8.917 4.037 1.00 . A B . 43 ARG CA 1 1 8 6490 1 1 43 ARG CB C -5.855 9.839 4.452 1.00 . A B . 43 ARG CB 1 1 8 6491 1 1 43 ARG CD C -3.968 11.290 3.646 1.00 . A B . 43 ARG CD 1 1 8 6492 1 1 43 ARG CG C -5.336 10.715 3.325 1.00 . A B . 43 ARG CG 1 1 8 6493 1 1 43 ARG CZ C -2.240 12.409 2.270 1.00 . A B . 43 ARG CZ 1 1 8 6494 1 1 43 ARG H H -8.452 10.458 3.951 1.00 . A B . 43 ARG H 1 1 8 6495 1 1 43 ARG HA H -6.645 8.239 3.275 1.00 . A B . 43 ARG HA 1 1 8 6496 1 1 43 ARG HB2 H -6.195 10.481 5.251 1.00 . A B . 43 ARG HB2 1 1 8 6497 1 1 43 ARG HB3 H -5.038 9.233 4.813 1.00 . A B . 43 ARG HB3 1 1 8 6498 1 1 43 ARG HD2 H -4.021 11.815 4.589 1.00 . A B . 43 ARG HD2 1 1 8 6499 1 1 43 ARG HD3 H -3.261 10.478 3.726 1.00 . A B . 43 ARG HD3 1 1 8 6500 1 1 43 ARG HE H -4.208 12.733 2.143 1.00 . A B . 43 ARG HE 1 1 8 6501 1 1 43 ARG HG2 H -5.265 10.123 2.426 1.00 . A B . 43 ARG HG2 1 1 8 6502 1 1 43 ARG HG3 H -6.031 11.528 3.167 1.00 . A B . 43 ARG HG3 1 1 8 6503 1 1 43 ARG HH11 H -1.490 11.018 3.561 1.00 . A B . 43 ARG HH11 1 1 8 6504 1 1 43 ARG HH12 H -0.317 11.861 2.593 1.00 . A B . 43 ARG HH12 1 1 8 6505 1 1 43 ARG HH21 H -2.665 13.822 0.873 1.00 . A B . 43 ARG HH21 1 1 8 6506 1 1 43 ARG HH22 H -0.979 13.452 1.071 1.00 . A B . 43 ARG HH22 1 1 8 6507 1 1 43 ARG N N -8.106 9.676 3.469 1.00 . A B . 43 ARG N 1 1 8 6508 1 1 43 ARG NE N -3.515 12.215 2.609 1.00 . A B . 43 ARG NE 1 1 8 6509 1 1 43 ARG NH1 N -1.271 11.709 2.853 1.00 . A B . 43 ARG NH1 1 1 8 6510 1 1 43 ARG NH2 N -1.937 13.298 1.330 1.00 . A B . 43 ARG NH2 1 1 8 6511 1 1 43 ARG O O -7.627 8.620 6.335 1.00 . A B . 43 ARG O 1 1 8 6512 1 1 44 THR C C -7.146 4.716 6.135 1.00 . A B . 44 THR C 1 1 8 6513 1 1 44 THR CA C -8.098 5.909 6.058 1.00 . A B . 44 THR CA 1 1 8 6514 1 1 44 THR CB C -9.542 5.412 5.834 1.00 . A B . 44 THR CB 1 1 8 6515 1 1 44 THR CG2 C -10.539 6.545 6.014 1.00 . A B . 44 THR CG2 1 1 8 6516 1 1 44 THR H H -7.584 6.467 4.093 1.00 . A B . 44 THR H 1 1 8 6517 1 1 44 THR HA H -8.064 6.450 6.992 1.00 . A B . 44 THR HA 1 1 8 6518 1 1 44 THR HB H -9.759 4.639 6.558 1.00 . A B . 44 THR HB 1 1 8 6519 1 1 44 THR HG1 H -9.029 4.160 4.393 1.00 . A B . 44 THR HG1 1 1 8 6520 1 1 44 THR HG21 H -11.543 6.165 5.887 1.00 . A B . 44 THR HG21 1 1 8 6521 1 1 44 THR HG22 H -10.348 7.311 5.276 1.00 . A B . 44 THR HG22 1 1 8 6522 1 1 44 THR HG23 H -10.434 6.964 7.003 1.00 . A B . 44 THR HG23 1 1 8 6523 1 1 44 THR N N -7.692 6.816 5.001 1.00 . A B . 44 THR N 1 1 8 6524 1 1 44 THR O O -7.388 3.681 5.517 1.00 . A B . 44 THR O 1 1 8 6525 1 1 44 THR OG1 O -9.678 4.866 4.513 1.00 . A B . 44 THR OG1 1 1 8 6526 1 1 45 PRO C C -5.530 2.535 7.665 1.00 . A B . 45 PRO C 1 1 8 6527 1 1 45 PRO CA C -5.012 3.802 6.988 1.00 . A B . 45 PRO CA 1 1 8 6528 1 1 45 PRO CB C -3.900 4.447 7.831 1.00 . A B . 45 PRO CB 1 1 8 6529 1 1 45 PRO CD C -5.683 6.034 7.687 1.00 . A B . 45 PRO CD 1 1 8 6530 1 1 45 PRO CG C -4.190 5.912 7.810 1.00 . A B . 45 PRO CG 1 1 8 6531 1 1 45 PRO HA H -4.622 3.545 6.014 1.00 . A B . 45 PRO HA 1 1 8 6532 1 1 45 PRO HB2 H -3.930 4.052 8.836 1.00 . A B . 45 PRO HB2 1 1 8 6533 1 1 45 PRO HB3 H -2.937 4.231 7.383 1.00 . A B . 45 PRO HB3 1 1 8 6534 1 1 45 PRO HD2 H -6.149 5.998 8.663 1.00 . A B . 45 PRO HD2 1 1 8 6535 1 1 45 PRO HD3 H -5.954 6.945 7.169 1.00 . A B . 45 PRO HD3 1 1 8 6536 1 1 45 PRO HG2 H -3.848 6.367 8.729 1.00 . A B . 45 PRO HG2 1 1 8 6537 1 1 45 PRO HG3 H -3.705 6.369 6.960 1.00 . A B . 45 PRO HG3 1 1 8 6538 1 1 45 PRO N N -6.038 4.850 6.887 1.00 . A B . 45 PRO N 1 1 8 6539 1 1 45 PRO O O -4.939 1.464 7.532 1.00 . A B . 45 PRO O 1 1 8 6540 1 1 46 TRP C C -8.297 0.839 8.187 1.00 . A B . 46 TRP C 1 1 8 6541 1 1 46 TRP CA C -7.243 1.512 9.060 1.00 . A B . 46 TRP CA 1 1 8 6542 1 1 46 TRP CB C -7.864 1.952 10.396 1.00 . A B . 46 TRP CB 1 1 8 6543 1 1 46 TRP CD1 C -10.223 2.901 10.043 1.00 . A B . 46 TRP CD1 1 1 8 6544 1 1 46 TRP CD2 C -8.643 4.458 10.348 1.00 . A B . 46 TRP CD2 1 1 8 6545 1 1 46 TRP CE2 C -9.880 5.102 10.167 1.00 . A B . 46 TRP CE2 1 1 8 6546 1 1 46 TRP CE3 C -7.502 5.239 10.558 1.00 . A B . 46 TRP CE3 1 1 8 6547 1 1 46 TRP CG C -8.882 3.048 10.263 1.00 . A B . 46 TRP CG 1 1 8 6548 1 1 46 TRP CH2 C -8.875 7.225 10.399 1.00 . A B . 46 TRP CH2 1 1 8 6549 1 1 46 TRP CZ2 C -10.009 6.487 10.192 1.00 . A B . 46 TRP CZ2 1 1 8 6550 1 1 46 TRP CZ3 C -7.633 6.616 10.582 1.00 . A B . 46 TRP CZ3 1 1 8 6551 1 1 46 TRP H H -7.079 3.531 8.433 1.00 . A B . 46 TRP H 1 1 8 6552 1 1 46 TRP HA H -6.455 0.801 9.256 1.00 . A B . 46 TRP HA 1 1 8 6553 1 1 46 TRP HB2 H -8.351 1.104 10.855 1.00 . A B . 46 TRP HB2 1 1 8 6554 1 1 46 TRP HB3 H -7.080 2.305 11.051 1.00 . A B . 46 TRP HB3 1 1 8 6555 1 1 46 TRP HD1 H -10.720 1.950 9.931 1.00 . A B . 46 TRP HD1 1 1 8 6556 1 1 46 TRP HE1 H -11.786 4.288 9.833 1.00 . A B . 46 TRP HE1 1 1 8 6557 1 1 46 TRP HE3 H -6.532 4.787 10.701 1.00 . A B . 46 TRP HE3 1 1 8 6558 1 1 46 TRP HH2 H -8.925 8.302 10.423 1.00 . A B . 46 TRP HH2 1 1 8 6559 1 1 46 TRP HZ2 H -10.963 6.973 10.054 1.00 . A B . 46 TRP HZ2 1 1 8 6560 1 1 46 TRP HZ3 H -6.765 7.238 10.743 1.00 . A B . 46 TRP HZ3 1 1 8 6561 1 1 46 TRP N N -6.645 2.654 8.372 1.00 . A B . 46 TRP N 1 1 8 6562 1 1 46 TRP NE1 N -10.827 4.131 9.982 1.00 . A B . 46 TRP NE1 1 1 8 6563 1 1 46 TRP O O -9.165 0.122 8.680 1.00 . A B . 46 TRP O 1 1 8 6564 1 1 47 ASN C C -8.442 0.075 4.682 1.00 . A B . 47 ASN C 1 1 8 6565 1 1 47 ASN CA C -9.169 0.513 5.945 1.00 . A B . 47 ASN CA 1 1 8 6566 1 1 47 ASN CB C -10.240 1.556 5.602 1.00 . A B . 47 ASN CB 1 1 8 6567 1 1 47 ASN CG C -11.326 1.016 4.683 1.00 . A B . 47 ASN CG 1 1 8 6568 1 1 47 ASN H H -7.469 1.610 6.546 1.00 . A B . 47 ASN H 1 1 8 6569 1 1 47 ASN HA H -9.635 -0.345 6.407 1.00 . A B . 47 ASN HA 1 1 8 6570 1 1 47 ASN HB2 H -10.708 1.898 6.514 1.00 . A B . 47 ASN HB2 1 1 8 6571 1 1 47 ASN HB3 H -9.769 2.397 5.112 1.00 . A B . 47 ASN HB3 1 1 8 6572 1 1 47 ASN HD21 H -11.248 -0.767 5.555 1.00 . A B . 47 ASN HD21 1 1 8 6573 1 1 47 ASN HD22 H -12.383 -0.610 4.262 1.00 . A B . 47 ASN HD22 1 1 8 6574 1 1 47 ASN N N -8.211 1.068 6.889 1.00 . A B . 47 ASN N 1 1 8 6575 1 1 47 ASN ND2 N -11.689 -0.245 4.850 1.00 . A B . 47 ASN ND2 1 1 8 6576 1 1 47 ASN O O -7.675 0.846 4.107 1.00 . A B . 47 ASN O 1 1 8 6577 1 1 47 ASN OD1 O -11.859 1.743 3.846 1.00 . A B . 47 ASN OD1 1 1 8 6578 1 1 48 CYS C C -8.780 -1.379 1.823 1.00 . A B . 48 CYS C 1 1 8 6579 1 1 48 CYS CA C -7.983 -1.681 3.087 1.00 . A B . 48 CYS CA 1 1 8 6580 1 1 48 CYS CB C -7.768 -3.194 3.226 1.00 . A B . 48 CYS CB 1 1 8 6581 1 1 48 CYS H H -9.307 -1.731 4.734 1.00 . A B . 48 CYS H 1 1 8 6582 1 1 48 CYS HA H -7.023 -1.190 3.023 1.00 . A B . 48 CYS HA 1 1 8 6583 1 1 48 CYS HB2 H -7.253 -3.395 4.153 1.00 . A B . 48 CYS HB2 1 1 8 6584 1 1 48 CYS HB3 H -8.728 -3.689 3.237 1.00 . A B . 48 CYS HB3 1 1 8 6585 1 1 48 CYS N N -8.667 -1.161 4.256 1.00 . A B . 48 CYS N 1 1 8 6586 1 1 48 CYS O O -9.934 -1.793 1.686 1.00 . A B . 48 CYS O 1 1 8 6587 1 1 48 CYS SG S -6.792 -3.919 1.888 1.00 . A B . 48 CYS SG 1 1 8 6588 1 1 49 ILE C C -8.868 -1.511 -1.326 1.00 . A B . 49 ILE C 1 1 8 6589 1 1 49 ILE CA C -8.803 -0.327 -0.366 1.00 . A B . 49 ILE CA 1 1 8 6590 1 1 49 ILE CB C -8.128 0.875 -1.074 1.00 . A B . 49 ILE CB 1 1 8 6591 1 1 49 ILE CD1 C -5.932 1.716 -2.072 1.00 . A B . 49 ILE CD1 1 1 8 6592 1 1 49 ILE CG1 C -6.617 0.666 -1.217 1.00 . A B . 49 ILE CG1 1 1 8 6593 1 1 49 ILE CG2 C -8.422 2.166 -0.319 1.00 . A B . 49 ILE CG2 1 1 8 6594 1 1 49 ILE H H -7.225 -0.381 1.051 1.00 . A B . 49 ILE H 1 1 8 6595 1 1 49 ILE HA H -9.814 -0.038 -0.122 1.00 . A B . 49 ILE HA 1 1 8 6596 1 1 49 ILE HB H -8.561 0.963 -2.060 1.00 . A B . 49 ILE HB 1 1 8 6597 1 1 49 ILE HD11 H -4.875 1.504 -2.129 1.00 . A B . 49 ILE HD11 1 1 8 6598 1 1 49 ILE HD12 H -6.080 2.690 -1.630 1.00 . A B . 49 ILE HD12 1 1 8 6599 1 1 49 ILE HD13 H -6.356 1.705 -3.065 1.00 . A B . 49 ILE HD13 1 1 8 6600 1 1 49 ILE HG12 H -6.165 0.699 -0.238 1.00 . A B . 49 ILE HG12 1 1 8 6601 1 1 49 ILE HG13 H -6.431 -0.300 -1.663 1.00 . A B . 49 ILE HG13 1 1 8 6602 1 1 49 ILE HG21 H -8.027 2.097 0.682 1.00 . A B . 49 ILE HG21 1 1 8 6603 1 1 49 ILE HG22 H -9.489 2.320 -0.272 1.00 . A B . 49 ILE HG22 1 1 8 6604 1 1 49 ILE HG23 H -7.960 2.996 -0.830 1.00 . A B . 49 ILE HG23 1 1 8 6605 1 1 49 ILE N N -8.148 -0.683 0.885 1.00 . A B . 49 ILE N 1 1 8 6606 1 1 49 ILE O O -9.787 -1.601 -2.133 1.00 . A B . 49 ILE O 1 1 8 6607 1 1 50 PHE C C -8.871 -4.646 -1.738 1.00 . A B . 50 PHE C 1 1 8 6608 1 1 50 PHE CA C -7.865 -3.573 -2.130 1.00 . A B . 50 PHE CA 1 1 8 6609 1 1 50 PHE CB C -6.454 -4.160 -2.230 1.00 . A B . 50 PHE CB 1 1 8 6610 1 1 50 PHE CD1 C -4.950 -2.298 -2.974 1.00 . A B . 50 PHE CD1 1 1 8 6611 1 1 50 PHE CD2 C -5.488 -4.009 -4.541 1.00 . A B . 50 PHE CD2 1 1 8 6612 1 1 50 PHE CE1 C -4.166 -1.671 -3.922 1.00 . A B . 50 PHE CE1 1 1 8 6613 1 1 50 PHE CE2 C -4.703 -3.389 -5.492 1.00 . A B . 50 PHE CE2 1 1 8 6614 1 1 50 PHE CG C -5.620 -3.473 -3.273 1.00 . A B . 50 PHE CG 1 1 8 6615 1 1 50 PHE CZ C -4.116 -2.187 -5.222 1.00 . A B . 50 PHE CZ 1 1 8 6616 1 1 50 PHE H H -7.259 -2.359 -0.497 1.00 . A B . 50 PHE H 1 1 8 6617 1 1 50 PHE HA H -8.146 -3.206 -3.110 1.00 . A B . 50 PHE HA 1 1 8 6618 1 1 50 PHE HB2 H -5.951 -4.058 -1.278 1.00 . A B . 50 PHE HB2 1 1 8 6619 1 1 50 PHE HB3 H -6.520 -5.208 -2.491 1.00 . A B . 50 PHE HB3 1 1 8 6620 1 1 50 PHE HD1 H -5.046 -1.868 -1.989 1.00 . A B . 50 PHE HD1 1 1 8 6621 1 1 50 PHE HD2 H -6.007 -4.922 -4.787 1.00 . A B . 50 PHE HD2 1 1 8 6622 1 1 50 PHE HE1 H -3.648 -0.756 -3.675 1.00 . A B . 50 PHE HE1 1 1 8 6623 1 1 50 PHE HE2 H -4.605 -3.820 -6.476 1.00 . A B . 50 PHE HE2 1 1 8 6624 1 1 50 PHE HZ H -3.534 -1.685 -5.979 1.00 . A B . 50 PHE HZ 1 1 8 6625 1 1 50 PHE N N -7.912 -2.428 -1.223 1.00 . A B . 50 PHE N 1 1 8 6626 1 1 50 PHE O O -9.400 -5.345 -2.597 1.00 . A B . 50 PHE O 1 1 8 6627 1 1 51 CYS C C -11.505 -5.464 -0.391 1.00 . A B . 51 CYS C 1 1 8 6628 1 1 51 CYS CA C -10.074 -5.787 0.033 1.00 . A B . 51 CYS CA 1 1 8 6629 1 1 51 CYS CB C -9.991 -5.934 1.554 1.00 . A B . 51 CYS CB 1 1 8 6630 1 1 51 CYS H H -8.712 -4.174 0.201 1.00 . A B . 51 CYS H 1 1 8 6631 1 1 51 CYS HA H -9.791 -6.727 -0.421 1.00 . A B . 51 CYS HA 1 1 8 6632 1 1 51 CYS HB2 H -9.726 -4.981 1.985 1.00 . A B . 51 CYS HB2 1 1 8 6633 1 1 51 CYS HB3 H -10.955 -6.238 1.933 1.00 . A B . 51 CYS HB3 1 1 8 6634 1 1 51 CYS N N -9.138 -4.777 -0.443 1.00 . A B . 51 CYS N 1 1 8 6635 1 1 51 CYS O O -12.209 -6.321 -0.927 1.00 . A B . 51 CYS O 1 1 8 6636 1 1 51 CYS SG S -8.771 -7.144 2.114 1.00 . A B . 51 CYS SG 1 1 8 6637 1 1 52 ARG C C -13.356 -3.187 -1.889 1.00 . A B . 52 ARG C 1 1 8 6638 1 1 52 ARG CA C -13.295 -3.842 -0.511 1.00 . A B . 52 ARG CA 1 1 8 6639 1 1 52 ARG CB C -13.891 -2.910 0.547 1.00 . A B . 52 ARG CB 1 1 8 6640 1 1 52 ARG CD C -13.744 -0.743 1.817 1.00 . A B . 52 ARG CD 1 1 8 6641 1 1 52 ARG CG C -13.070 -1.658 0.805 1.00 . A B . 52 ARG CG 1 1 8 6642 1 1 52 ARG CZ C -14.844 -0.947 4.020 1.00 . A B . 52 ARG CZ 1 1 8 6643 1 1 52 ARG H H -11.351 -3.582 0.280 1.00 . A B . 52 ARG H 1 1 8 6644 1 1 52 ARG HA H -13.884 -4.744 -0.542 1.00 . A B . 52 ARG HA 1 1 8 6645 1 1 52 ARG HB2 H -14.876 -2.610 0.227 1.00 . A B . 52 ARG HB2 1 1 8 6646 1 1 52 ARG HB3 H -13.978 -3.455 1.475 1.00 . A B . 52 ARG HB3 1 1 8 6647 1 1 52 ARG HD2 H -13.094 0.097 2.007 1.00 . A B . 52 ARG HD2 1 1 8 6648 1 1 52 ARG HD3 H -14.677 -0.389 1.401 1.00 . A B . 52 ARG HD3 1 1 8 6649 1 1 52 ARG HE H -13.564 -2.282 3.245 1.00 . A B . 52 ARG HE 1 1 8 6650 1 1 52 ARG HG2 H -12.103 -1.949 1.190 1.00 . A B . 52 ARG HG2 1 1 8 6651 1 1 52 ARG HG3 H -12.945 -1.122 -0.125 1.00 . A B . 52 ARG HG3 1 1 8 6652 1 1 52 ARG HH11 H -15.309 0.738 2.996 1.00 . A B . 52 ARG HH11 1 1 8 6653 1 1 52 ARG HH12 H -16.091 0.568 4.534 1.00 . A B . 52 ARG HH12 1 1 8 6654 1 1 52 ARG HH21 H -14.575 -2.504 5.291 1.00 . A B . 52 ARG HH21 1 1 8 6655 1 1 52 ARG HH22 H -15.657 -1.265 5.846 1.00 . A B . 52 ARG HH22 1 1 8 6656 1 1 52 ARG N N -11.938 -4.232 -0.159 1.00 . A B . 52 ARG N 1 1 8 6657 1 1 52 ARG NE N -14.018 -1.423 3.085 1.00 . A B . 52 ARG NE 1 1 8 6658 1 1 52 ARG NH1 N -15.462 0.212 3.836 1.00 . A B . 52 ARG NH1 1 1 8 6659 1 1 52 ARG NH2 N -15.043 -1.627 5.139 1.00 . A B . 52 ARG NH2 1 1 8 6660 1 1 52 ARG O O -14.406 -2.713 -2.316 1.00 . A B . 52 ARG O 1 1 8 6661 1 1 53 MET C C -12.601 -1.220 -4.053 1.00 . A B . 53 MET C 1 1 8 6662 1 1 53 MET CA C -12.078 -2.648 -3.932 1.00 . A B . 53 MET CA 1 1 8 6663 1 1 53 MET CB C -12.792 -3.554 -4.939 1.00 . A B . 53 MET CB 1 1 8 6664 1 1 53 MET CE C -10.638 -3.866 -7.250 1.00 . A B . 53 MET CE 1 1 8 6665 1 1 53 MET CG C -12.117 -4.901 -5.131 1.00 . A B . 53 MET CG 1 1 8 6666 1 1 53 MET H H -11.397 -3.508 -2.130 1.00 . A B . 53 MET H 1 1 8 6667 1 1 53 MET HA H -11.025 -2.637 -4.175 1.00 . A B . 53 MET HA 1 1 8 6668 1 1 53 MET HB2 H -13.801 -3.726 -4.597 1.00 . A B . 53 MET HB2 1 1 8 6669 1 1 53 MET HB3 H -12.826 -3.052 -5.895 1.00 . A B . 53 MET HB3 1 1 8 6670 1 1 53 MET HE1 H -11.284 -4.433 -7.902 1.00 . A B . 53 MET HE1 1 1 8 6671 1 1 53 MET HE2 H -9.680 -3.725 -7.728 1.00 . A B . 53 MET HE2 1 1 8 6672 1 1 53 MET HE3 H -11.083 -2.904 -7.046 1.00 . A B . 53 MET HE3 1 1 8 6673 1 1 53 MET HG2 H -12.114 -5.424 -4.186 1.00 . A B . 53 MET HG2 1 1 8 6674 1 1 53 MET HG3 H -12.681 -5.472 -5.854 1.00 . A B . 53 MET HG3 1 1 8 6675 1 1 53 MET N N -12.207 -3.181 -2.571 1.00 . A B . 53 MET N 1 1 8 6676 1 1 53 MET O O -13.440 -0.923 -4.905 1.00 . A B . 53 MET O 1 1 8 6677 1 1 53 MET SD S -10.411 -4.759 -5.711 1.00 . A B . 53 MET SD 1 1 8 6678 1 1 54 LYS C C -11.821 1.654 -4.583 1.00 . A B . 54 LYS C 1 1 8 6679 1 1 54 LYS CA C -12.412 1.082 -3.299 1.00 . A B . 54 LYS CA 1 1 8 6680 1 1 54 LYS CB C -11.884 1.861 -2.085 1.00 . A B . 54 LYS CB 1 1 8 6681 1 1 54 LYS CD C -11.543 4.117 -0.981 1.00 . A B . 54 LYS CD 1 1 8 6682 1 1 54 LYS CE C -12.240 3.795 0.331 1.00 . A B . 54 LYS CE 1 1 8 6683 1 1 54 LYS CG C -12.163 3.365 -2.153 1.00 . A B . 54 LYS CG 1 1 8 6684 1 1 54 LYS H H -11.485 -0.648 -2.499 1.00 . A B . 54 LYS H 1 1 8 6685 1 1 54 LYS HA H -13.489 1.173 -3.340 1.00 . A B . 54 LYS HA 1 1 8 6686 1 1 54 LYS HB2 H -12.343 1.467 -1.189 1.00 . A B . 54 LYS HB2 1 1 8 6687 1 1 54 LYS HB3 H -10.815 1.719 -2.022 1.00 . A B . 54 LYS HB3 1 1 8 6688 1 1 54 LYS HD2 H -10.504 3.843 -0.901 1.00 . A B . 54 LYS HD2 1 1 8 6689 1 1 54 LYS HD3 H -11.623 5.178 -1.169 1.00 . A B . 54 LYS HD3 1 1 8 6690 1 1 54 LYS HE2 H -12.362 2.726 0.404 1.00 . A B . 54 LYS HE2 1 1 8 6691 1 1 54 LYS HE3 H -11.621 4.141 1.146 1.00 . A B . 54 LYS HE3 1 1 8 6692 1 1 54 LYS HG2 H -11.751 3.753 -3.071 1.00 . A B . 54 LYS HG2 1 1 8 6693 1 1 54 LYS HG3 H -13.231 3.523 -2.143 1.00 . A B . 54 LYS HG3 1 1 8 6694 1 1 54 LYS HZ1 H -14.138 4.245 -0.423 1.00 . A B . 54 LYS HZ1 1 1 8 6695 1 1 54 LYS HZ2 H -13.472 5.471 0.544 1.00 . A B . 54 LYS HZ2 1 1 8 6696 1 1 54 LYS HZ3 H -14.090 4.069 1.256 1.00 . A B . 54 LYS HZ3 1 1 8 6697 1 1 54 LYS N N -12.090 -0.335 -3.204 1.00 . A B . 54 LYS N 1 1 8 6698 1 1 54 LYS NZ N -13.578 4.439 0.431 1.00 . A B . 54 LYS NZ 1 1 8 6699 1 1 54 LYS O O -10.648 2.030 -4.633 1.00 . A B . 54 LYS O 1 1 8 6700 1 1 55 GLU C C -13.216 3.184 -7.442 1.00 . A B . 55 GLU C 1 1 8 6701 1 1 55 GLU CA C -12.196 2.191 -6.910 1.00 . A B . 55 GLU CA 1 1 8 6702 1 1 55 GLU CB C -12.006 1.032 -7.893 1.00 . A B . 55 GLU CB 1 1 8 6703 1 1 55 GLU CD C -10.037 2.071 -9.070 1.00 . A B . 55 GLU CD 1 1 8 6704 1 1 55 GLU CG C -11.408 1.451 -9.226 1.00 . A B . 55 GLU CG 1 1 8 6705 1 1 55 GLU H H -13.551 1.362 -5.522 1.00 . A B . 55 GLU H 1 1 8 6706 1 1 55 GLU HA H -11.252 2.693 -6.770 1.00 . A B . 55 GLU HA 1 1 8 6707 1 1 55 GLU HB2 H -11.350 0.302 -7.446 1.00 . A B . 55 GLU HB2 1 1 8 6708 1 1 55 GLU HB3 H -12.965 0.574 -8.081 1.00 . A B . 55 GLU HB3 1 1 8 6709 1 1 55 GLU HG2 H -11.324 0.580 -9.859 1.00 . A B . 55 GLU HG2 1 1 8 6710 1 1 55 GLU HG3 H -12.064 2.172 -9.689 1.00 . A B . 55 GLU HG3 1 1 8 6711 1 1 55 GLU N N -12.631 1.688 -5.623 1.00 . A B . 55 GLU N 1 1 8 6712 1 1 55 GLU O O -14.327 2.806 -7.827 1.00 . A B . 55 GLU O 1 1 8 6713 1 1 55 GLU OE1 O -9.039 1.325 -9.069 1.00 . A B . 55 GLU OE1 1 1 8 6714 1 1 55 GLU OE2 O -9.954 3.307 -8.938 1.00 . A B . 55 GLU OE2 1 1 8 6715 1 1 56 SER C C -12.979 6.491 -8.769 1.00 . A B . 56 SER C 1 1 8 6716 1 1 56 SER CA C -13.739 5.499 -7.895 1.00 . A B . 56 SER CA 1 1 8 6717 1 1 56 SER CB C -14.383 6.197 -6.696 1.00 . A B . 56 SER CB 1 1 8 6718 1 1 56 SER H H -11.960 4.695 -7.105 1.00 . A B . 56 SER H 1 1 8 6719 1 1 56 SER HA H -14.512 5.037 -8.489 1.00 . A B . 56 SER HA 1 1 8 6720 1 1 56 SER HB2 H -14.899 7.083 -7.033 1.00 . A B . 56 SER HB2 1 1 8 6721 1 1 56 SER HB3 H -15.087 5.526 -6.227 1.00 . A B . 56 SER HB3 1 1 8 6722 1 1 56 SER HG H -12.665 6.997 -6.201 1.00 . A B . 56 SER HG 1 1 8 6723 1 1 56 SER N N -12.852 4.452 -7.432 1.00 . A B . 56 SER N 1 1 8 6724 1 1 56 SER O O -12.855 6.229 -9.983 1.00 . A B . 56 SER O 1 1 8 6725 1 1 56 SER OXT O -12.496 7.515 -8.238 1.00 . A B . 56 SER OXT 1 1 8 6726 1 1 56 SER OG O -13.404 6.573 -5.742 1.00 . A B . 56 SER OG 1 1 8 6727 2 2 1 ZN ZN ZN -6.675 -6.207 2.114 1.00 . B B . 101 ZN ZN 1 1 8 6728 3 2 1 ZN ZN ZN 5.664 1.236 -0.410 1.00 . C B . 102 ZN ZN 1 1 9 6729 1 1 1 GLY C C 3.205 -11.974 -2.685 1.00 . A B . 1 GLY C 1 1 9 6730 1 1 1 GLY CA C 3.318 -11.134 -3.939 1.00 . A B . 1 GLY CA 1 1 9 6731 1 1 1 GLY H1 H 4.913 -12.189 -4.760 1.00 . A B . 1 GLY H1 1 1 9 6732 1 1 1 GLY H2 H 4.052 -11.268 -5.884 1.00 . A B . 1 GLY H2 1 1 9 6733 1 1 1 GLY H3 H 3.399 -12.710 -5.298 1.00 . A B . 1 GLY H3 1 1 9 6734 1 1 1 GLY HA2 H 3.901 -10.252 -3.720 1.00 . A B . 1 GLY HA2 1 1 9 6735 1 1 1 GLY HA3 H 2.329 -10.833 -4.250 1.00 . A B . 1 GLY HA3 1 1 9 6736 1 1 1 GLY N N 3.964 -11.876 -5.047 1.00 . A B . 1 GLY N 1 1 9 6737 1 1 1 GLY O O 2.773 -13.126 -2.745 1.00 . A B . 1 GLY O 1 1 9 6738 1 1 2 ALA C C 4.429 -13.319 -0.242 1.00 . A B . 2 ALA C 1 1 9 6739 1 1 2 ALA CA C 3.554 -12.073 -0.253 1.00 . A B . 2 ALA CA 1 1 9 6740 1 1 2 ALA CB C 2.114 -12.414 0.124 1.00 . A B . 2 ALA CB 1 1 9 6741 1 1 2 ALA H H 3.968 -10.481 -1.588 1.00 . A B . 2 ALA H 1 1 9 6742 1 1 2 ALA HA H 3.937 -11.388 0.486 1.00 . A B . 2 ALA HA 1 1 9 6743 1 1 2 ALA HB1 H 1.711 -13.113 -0.593 1.00 . A B . 2 ALA HB1 1 1 9 6744 1 1 2 ALA HB2 H 1.517 -11.514 0.123 1.00 . A B . 2 ALA HB2 1 1 9 6745 1 1 2 ALA HB3 H 2.094 -12.858 1.109 1.00 . A B . 2 ALA HB3 1 1 9 6746 1 1 2 ALA N N 3.609 -11.396 -1.550 1.00 . A B . 2 ALA N 1 1 9 6747 1 1 2 ALA O O 4.035 -14.367 0.268 1.00 . A B . 2 ALA O 1 1 9 6748 1 1 3 MET C C 7.988 -13.747 -0.917 1.00 . A B . 3 MET C 1 1 9 6749 1 1 3 MET CA C 6.563 -14.295 -0.848 1.00 . A B . 3 MET CA 1 1 9 6750 1 1 3 MET CB C 6.257 -15.209 -2.046 1.00 . A B . 3 MET CB 1 1 9 6751 1 1 3 MET CE C 4.843 -18.005 -2.922 1.00 . A B . 3 MET CE 1 1 9 6752 1 1 3 MET CG C 7.019 -16.527 -2.040 1.00 . A B . 3 MET CG 1 1 9 6753 1 1 3 MET H H 5.856 -12.340 -1.235 1.00 . A B . 3 MET H 1 1 9 6754 1 1 3 MET HA H 6.450 -14.859 0.065 1.00 . A B . 3 MET HA 1 1 9 6755 1 1 3 MET HB2 H 5.200 -15.431 -2.050 1.00 . A B . 3 MET HB2 1 1 9 6756 1 1 3 MET HB3 H 6.504 -14.680 -2.957 1.00 . A B . 3 MET HB3 1 1 9 6757 1 1 3 MET HE1 H 4.841 -18.495 -1.960 1.00 . A B . 3 MET HE1 1 1 9 6758 1 1 3 MET HE2 H 4.405 -18.659 -3.660 1.00 . A B . 3 MET HE2 1 1 9 6759 1 1 3 MET HE3 H 4.268 -17.094 -2.862 1.00 . A B . 3 MET HE3 1 1 9 6760 1 1 3 MET HG2 H 8.075 -16.319 -2.131 1.00 . A B . 3 MET HG2 1 1 9 6761 1 1 3 MET HG3 H 6.833 -17.032 -1.103 1.00 . A B . 3 MET HG3 1 1 9 6762 1 1 3 MET N N 5.614 -13.194 -0.815 1.00 . A B . 3 MET N 1 1 9 6763 1 1 3 MET O O 8.946 -14.478 -1.169 1.00 . A B . 3 MET O 1 1 9 6764 1 1 3 MET SD S 6.529 -17.619 -3.391 1.00 . A B . 3 MET SD 1 1 9 6765 1 1 4 GLY C C 9.931 -11.429 0.645 1.00 . A B . 4 GLY C 1 1 9 6766 1 1 4 GLY CA C 9.421 -11.812 -0.728 1.00 . A B . 4 GLY CA 1 1 9 6767 1 1 4 GLY H H 7.332 -11.926 -0.415 1.00 . A B . 4 GLY H 1 1 9 6768 1 1 4 GLY HA2 H 10.123 -12.492 -1.186 1.00 . A B . 4 GLY HA2 1 1 9 6769 1 1 4 GLY HA3 H 9.346 -10.923 -1.336 1.00 . A B . 4 GLY HA3 1 1 9 6770 1 1 4 GLY N N 8.121 -12.453 -0.665 1.00 . A B . 4 GLY N 1 1 9 6771 1 1 4 GLY O O 9.461 -11.952 1.655 1.00 . A B . 4 GLY O 1 1 9 6772 1 1 5 MET C C 11.341 -8.563 2.090 1.00 . A B . 5 MET C 1 1 9 6773 1 1 5 MET CA C 11.464 -10.073 1.950 1.00 . A B . 5 MET CA 1 1 9 6774 1 1 5 MET CB C 12.934 -10.496 2.049 1.00 . A B . 5 MET CB 1 1 9 6775 1 1 5 MET CE C 14.745 -14.257 2.213 1.00 . A B . 5 MET CE 1 1 9 6776 1 1 5 MET CG C 13.136 -12.005 2.100 1.00 . A B . 5 MET CG 1 1 9 6777 1 1 5 MET H H 11.210 -10.117 -0.149 1.00 . A B . 5 MET H 1 1 9 6778 1 1 5 MET HA H 10.908 -10.541 2.748 1.00 . A B . 5 MET HA 1 1 9 6779 1 1 5 MET HB2 H 13.465 -10.112 1.190 1.00 . A B . 5 MET HB2 1 1 9 6780 1 1 5 MET HB3 H 13.360 -10.066 2.944 1.00 . A B . 5 MET HB3 1 1 9 6781 1 1 5 MET HE1 H 14.158 -14.560 3.066 1.00 . A B . 5 MET HE1 1 1 9 6782 1 1 5 MET HE2 H 15.732 -14.690 2.282 1.00 . A B . 5 MET HE2 1 1 9 6783 1 1 5 MET HE3 H 14.267 -14.597 1.307 1.00 . A B . 5 MET HE3 1 1 9 6784 1 1 5 MET HG2 H 12.635 -12.392 2.974 1.00 . A B . 5 MET HG2 1 1 9 6785 1 1 5 MET HG3 H 12.703 -12.445 1.214 1.00 . A B . 5 MET HG3 1 1 9 6786 1 1 5 MET N N 10.885 -10.514 0.689 1.00 . A B . 5 MET N 1 1 9 6787 1 1 5 MET O O 12.344 -7.852 2.124 1.00 . A B . 5 MET O 1 1 9 6788 1 1 5 MET SD S 14.878 -12.470 2.184 1.00 . A B . 5 MET SD 1 1 9 6789 1 1 6 ARG C C 10.336 -5.905 1.062 1.00 . A B . 6 ARG C 1 1 9 6790 1 1 6 ARG CA C 9.795 -6.666 2.270 1.00 . A B . 6 ARG CA 1 1 9 6791 1 1 6 ARG CB C 10.350 -6.072 3.567 1.00 . A B . 6 ARG CB 1 1 9 6792 1 1 6 ARG CD C 10.191 -5.862 6.062 1.00 . A B . 6 ARG CD 1 1 9 6793 1 1 6 ARG CG C 9.603 -6.509 4.819 1.00 . A B . 6 ARG CG 1 1 9 6794 1 1 6 ARG CZ C 9.854 -5.939 8.504 1.00 . A B . 6 ARG CZ 1 1 9 6795 1 1 6 ARG H H 9.355 -8.730 2.173 1.00 . A B . 6 ARG H 1 1 9 6796 1 1 6 ARG HA H 8.720 -6.566 2.279 1.00 . A B . 6 ARG HA 1 1 9 6797 1 1 6 ARG HB2 H 11.380 -6.374 3.668 1.00 . A B . 6 ARG HB2 1 1 9 6798 1 1 6 ARG HB3 H 10.305 -4.995 3.504 1.00 . A B . 6 ARG HB3 1 1 9 6799 1 1 6 ARG HD2 H 11.194 -6.233 6.205 1.00 . A B . 6 ARG HD2 1 1 9 6800 1 1 6 ARG HD3 H 10.223 -4.794 5.913 1.00 . A B . 6 ARG HD3 1 1 9 6801 1 1 6 ARG HE H 8.501 -6.507 7.136 1.00 . A B . 6 ARG HE 1 1 9 6802 1 1 6 ARG HG2 H 8.566 -6.220 4.731 1.00 . A B . 6 ARG HG2 1 1 9 6803 1 1 6 ARG HG3 H 9.674 -7.582 4.914 1.00 . A B . 6 ARG HG3 1 1 9 6804 1 1 6 ARG HH11 H 11.667 -5.243 7.922 1.00 . A B . 6 ARG HH11 1 1 9 6805 1 1 6 ARG HH12 H 11.409 -5.298 9.635 1.00 . A B . 6 ARG HH12 1 1 9 6806 1 1 6 ARG HH21 H 8.150 -6.566 9.403 1.00 . A B . 6 ARG HH21 1 1 9 6807 1 1 6 ARG HH22 H 9.408 -6.050 10.477 1.00 . A B . 6 ARG HH22 1 1 9 6808 1 1 6 ARG N N 10.097 -8.092 2.173 1.00 . A B . 6 ARG N 1 1 9 6809 1 1 6 ARG NE N 9.410 -6.148 7.264 1.00 . A B . 6 ARG NE 1 1 9 6810 1 1 6 ARG NH1 N 11.073 -5.455 8.703 1.00 . A B . 6 ARG NH1 1 1 9 6811 1 1 6 ARG NH2 N 9.075 -6.206 9.544 1.00 . A B . 6 ARG NH2 1 1 9 6812 1 1 6 ARG O O 11.479 -5.446 1.053 1.00 . A B . 6 ARG O 1 1 9 6813 1 1 7 ASN C C 9.814 -3.575 -1.031 1.00 . A B . 7 ASN C 1 1 9 6814 1 1 7 ASN CA C 9.887 -5.094 -1.191 1.00 . A B . 7 ASN CA 1 1 9 6815 1 1 7 ASN CB C 8.987 -5.567 -2.343 1.00 . A B . 7 ASN CB 1 1 9 6816 1 1 7 ASN CG C 9.534 -5.221 -3.721 1.00 . A B . 7 ASN CG 1 1 9 6817 1 1 7 ASN H H 8.570 -6.072 0.153 1.00 . A B . 7 ASN H 1 1 9 6818 1 1 7 ASN HA H 10.908 -5.372 -1.405 1.00 . A B . 7 ASN HA 1 1 9 6819 1 1 7 ASN HB2 H 8.873 -6.639 -2.283 1.00 . A B . 7 ASN HB2 1 1 9 6820 1 1 7 ASN HB3 H 8.016 -5.105 -2.238 1.00 . A B . 7 ASN HB3 1 1 9 6821 1 1 7 ASN HD21 H 10.649 -6.866 -3.723 1.00 . A B . 7 ASN HD21 1 1 9 6822 1 1 7 ASN HD22 H 10.781 -5.870 -5.128 1.00 . A B . 7 ASN HD22 1 1 9 6823 1 1 7 ASN N N 9.493 -5.750 0.054 1.00 . A B . 7 ASN N 1 1 9 6824 1 1 7 ASN ND2 N 10.408 -6.071 -4.243 1.00 . A B . 7 ASN ND2 1 1 9 6825 1 1 7 ASN O O 9.988 -2.819 -1.982 1.00 . A B . 7 ASN O 1 1 9 6826 1 1 7 ASN OD1 O 9.174 -4.203 -4.313 1.00 . A B . 7 ASN OD1 1 1 9 6827 1 1 8 LEU C C 10.820 -1.002 0.363 1.00 . A B . 8 LEU C 1 1 9 6828 1 1 8 LEU CA C 9.479 -1.718 0.521 1.00 . A B . 8 LEU CA 1 1 9 6829 1 1 8 LEU CB C 8.919 -1.525 1.938 1.00 . A B . 8 LEU CB 1 1 9 6830 1 1 8 LEU CD1 C 10.800 -1.328 3.602 1.00 . A B . 8 LEU CD1 1 1 9 6831 1 1 8 LEU CD2 C 8.736 -2.623 4.179 1.00 . A B . 8 LEU CD2 1 1 9 6832 1 1 8 LEU CG C 9.688 -2.221 3.065 1.00 . A B . 8 LEU CG 1 1 9 6833 1 1 8 LEU H H 9.477 -3.795 0.921 1.00 . A B . 8 LEU H 1 1 9 6834 1 1 8 LEU HA H 8.784 -1.289 -0.181 1.00 . A B . 8 LEU HA 1 1 9 6835 1 1 8 LEU HB2 H 8.901 -0.465 2.150 1.00 . A B . 8 LEU HB2 1 1 9 6836 1 1 8 LEU HB3 H 7.903 -1.890 1.949 1.00 . A B . 8 LEU HB3 1 1 9 6837 1 1 8 LEU HD11 H 10.370 -0.433 4.025 1.00 . A B . 8 LEU HD11 1 1 9 6838 1 1 8 LEU HD12 H 11.467 -1.058 2.796 1.00 . A B . 8 LEU HD12 1 1 9 6839 1 1 8 LEU HD13 H 11.352 -1.859 4.364 1.00 . A B . 8 LEU HD13 1 1 9 6840 1 1 8 LEU HD21 H 8.244 -1.744 4.566 1.00 . A B . 8 LEU HD21 1 1 9 6841 1 1 8 LEU HD22 H 9.289 -3.104 4.971 1.00 . A B . 8 LEU HD22 1 1 9 6842 1 1 8 LEU HD23 H 7.997 -3.306 3.789 1.00 . A B . 8 LEU HD23 1 1 9 6843 1 1 8 LEU HG H 10.146 -3.119 2.675 1.00 . A B . 8 LEU HG 1 1 9 6844 1 1 8 LEU N N 9.586 -3.139 0.205 1.00 . A B . 8 LEU N 1 1 9 6845 1 1 8 LEU O O 10.878 0.227 0.379 1.00 . A B . 8 LEU O 1 1 9 6846 1 1 9 ASP C C 13.218 -0.608 -1.473 1.00 . A B . 9 ASP C 1 1 9 6847 1 1 9 ASP CA C 13.203 -1.189 -0.069 1.00 . A B . 9 ASP CA 1 1 9 6848 1 1 9 ASP CB C 14.309 -2.236 0.080 1.00 . A B . 9 ASP CB 1 1 9 6849 1 1 9 ASP CG C 15.691 -1.657 -0.166 1.00 . A B . 9 ASP CG 1 1 9 6850 1 1 9 ASP H H 11.787 -2.745 0.233 1.00 . A B . 9 ASP H 1 1 9 6851 1 1 9 ASP HA H 13.364 -0.394 0.642 1.00 . A B . 9 ASP HA 1 1 9 6852 1 1 9 ASP HB2 H 14.284 -2.638 1.082 1.00 . A B . 9 ASP HB2 1 1 9 6853 1 1 9 ASP HB3 H 14.140 -3.033 -0.627 1.00 . A B . 9 ASP HB3 1 1 9 6854 1 1 9 ASP N N 11.891 -1.771 0.194 1.00 . A B . 9 ASP N 1 1 9 6855 1 1 9 ASP O O 13.837 0.420 -1.740 1.00 . A B . 9 ASP O 1 1 9 6856 1 1 9 ASP OD1 O 16.267 -1.063 0.771 1.00 . A B . 9 ASP OD1 1 1 9 6857 1 1 9 ASP OD2 O 16.209 -1.787 -1.296 1.00 . A B . 9 ASP OD2 1 1 9 6858 1 1 10 GLU C C 11.110 0.036 -3.881 1.00 . A B . 10 GLU C 1 1 9 6859 1 1 10 GLU CA C 12.359 -0.823 -3.737 1.00 . A B . 10 GLU CA 1 1 9 6860 1 1 10 GLU CB C 12.304 -2.020 -4.678 1.00 . A B . 10 GLU CB 1 1 9 6861 1 1 10 GLU CD C 13.487 -4.092 -5.510 1.00 . A B . 10 GLU CD 1 1 9 6862 1 1 10 GLU CG C 13.558 -2.875 -4.618 1.00 . A B . 10 GLU CG 1 1 9 6863 1 1 10 GLU H H 12.079 -2.115 -2.088 1.00 . A B . 10 GLU H 1 1 9 6864 1 1 10 GLU HA H 13.221 -0.225 -3.979 1.00 . A B . 10 GLU HA 1 1 9 6865 1 1 10 GLU HB2 H 11.455 -2.635 -4.415 1.00 . A B . 10 GLU HB2 1 1 9 6866 1 1 10 GLU HB3 H 12.182 -1.664 -5.689 1.00 . A B . 10 GLU HB3 1 1 9 6867 1 1 10 GLU HG2 H 14.401 -2.275 -4.926 1.00 . A B . 10 GLU HG2 1 1 9 6868 1 1 10 GLU HG3 H 13.705 -3.202 -3.599 1.00 . A B . 10 GLU HG3 1 1 9 6869 1 1 10 GLU N N 12.505 -1.277 -2.363 1.00 . A B . 10 GLU N 1 1 9 6870 1 1 10 GLU O O 10.670 0.350 -4.988 1.00 . A B . 10 GLU O 1 1 9 6871 1 1 10 GLU OE1 O 13.563 -3.932 -6.745 1.00 . A B . 10 GLU OE1 1 1 9 6872 1 1 10 GLU OE2 O 13.339 -5.213 -4.984 1.00 . A B . 10 GLU OE2 1 1 9 6873 1 1 11 CYS C C 9.848 2.670 -2.278 1.00 . A B . 11 CYS C 1 1 9 6874 1 1 11 CYS CA C 9.397 1.280 -2.692 1.00 . A B . 11 CYS CA 1 1 9 6875 1 1 11 CYS CB C 8.377 0.719 -1.706 1.00 . A B . 11 CYS CB 1 1 9 6876 1 1 11 CYS H H 10.977 0.132 -1.906 1.00 . A B . 11 CYS H 1 1 9 6877 1 1 11 CYS HA H 8.961 1.324 -3.679 1.00 . A B . 11 CYS HA 1 1 9 6878 1 1 11 CYS HB2 H 8.139 -0.292 -1.991 1.00 . A B . 11 CYS HB2 1 1 9 6879 1 1 11 CYS HB3 H 8.822 0.709 -0.721 1.00 . A B . 11 CYS HB3 1 1 9 6880 1 1 11 CYS N N 10.555 0.412 -2.743 1.00 . A B . 11 CYS N 1 1 9 6881 1 1 11 CYS O O 9.951 2.977 -1.087 1.00 . A B . 11 CYS O 1 1 9 6882 1 1 11 CYS SG S 6.819 1.628 -1.589 1.00 . A B . 11 CYS SG 1 1 9 6883 1 1 12 GLU C C 9.678 5.691 -2.261 1.00 . A B . 12 GLU C 1 1 9 6884 1 1 12 GLU CA C 10.670 4.828 -3.022 1.00 . A B . 12 GLU CA 1 1 9 6885 1 1 12 GLU CB C 11.046 5.482 -4.347 1.00 . A B . 12 GLU CB 1 1 9 6886 1 1 12 GLU CD C 12.373 5.274 -6.492 1.00 . A B . 12 GLU CD 1 1 9 6887 1 1 12 GLU CG C 11.895 4.585 -5.234 1.00 . A B . 12 GLU CG 1 1 9 6888 1 1 12 GLU H H 9.948 3.224 -4.187 1.00 . A B . 12 GLU H 1 1 9 6889 1 1 12 GLU HA H 11.558 4.712 -2.422 1.00 . A B . 12 GLU HA 1 1 9 6890 1 1 12 GLU HB2 H 10.139 5.734 -4.880 1.00 . A B . 12 GLU HB2 1 1 9 6891 1 1 12 GLU HB3 H 11.601 6.386 -4.146 1.00 . A B . 12 GLU HB3 1 1 9 6892 1 1 12 GLU HG2 H 12.759 4.260 -4.675 1.00 . A B . 12 GLU HG2 1 1 9 6893 1 1 12 GLU HG3 H 11.308 3.722 -5.517 1.00 . A B . 12 GLU HG3 1 1 9 6894 1 1 12 GLU N N 10.119 3.506 -3.264 1.00 . A B . 12 GLU N 1 1 9 6895 1 1 12 GLU O O 10.061 6.538 -1.455 1.00 . A B . 12 GLU O 1 1 9 6896 1 1 12 GLU OE1 O 11.536 5.578 -7.367 1.00 . A B . 12 GLU OE1 1 1 9 6897 1 1 12 GLU OE2 O 13.594 5.500 -6.621 1.00 . A B . 12 GLU OE2 1 1 9 6898 1 1 13 VAL C C 7.303 5.860 -0.329 1.00 . A B . 13 VAL C 1 1 9 6899 1 1 13 VAL CA C 7.355 6.194 -1.825 1.00 . A B . 13 VAL CA 1 1 9 6900 1 1 13 VAL CB C 5.982 5.964 -2.498 1.00 . A B . 13 VAL CB 1 1 9 6901 1 1 13 VAL CG1 C 5.627 4.493 -2.542 1.00 . A B . 13 VAL CG1 1 1 9 6902 1 1 13 VAL CG2 C 4.892 6.749 -1.793 1.00 . A B . 13 VAL CG2 1 1 9 6903 1 1 13 VAL H H 8.148 4.730 -3.113 1.00 . A B . 13 VAL H 1 1 9 6904 1 1 13 VAL HA H 7.604 7.239 -1.929 1.00 . A B . 13 VAL HA 1 1 9 6905 1 1 13 VAL HB H 6.046 6.317 -3.516 1.00 . A B . 13 VAL HB 1 1 9 6906 1 1 13 VAL HG11 H 5.546 4.113 -1.535 1.00 . A B . 13 VAL HG11 1 1 9 6907 1 1 13 VAL HG12 H 6.397 3.952 -3.071 1.00 . A B . 13 VAL HG12 1 1 9 6908 1 1 13 VAL HG13 H 4.685 4.367 -3.052 1.00 . A B . 13 VAL HG13 1 1 9 6909 1 1 13 VAL HG21 H 4.748 6.344 -0.804 1.00 . A B . 13 VAL HG21 1 1 9 6910 1 1 13 VAL HG22 H 3.973 6.674 -2.354 1.00 . A B . 13 VAL HG22 1 1 9 6911 1 1 13 VAL HG23 H 5.186 7.785 -1.720 1.00 . A B . 13 VAL HG23 1 1 9 6912 1 1 13 VAL N N 8.399 5.441 -2.486 1.00 . A B . 13 VAL N 1 1 9 6913 1 1 13 VAL O O 6.914 6.693 0.488 1.00 . A B . 13 VAL O 1 1 9 6914 1 1 14 CYS C C 8.919 5.087 2.136 1.00 . A B . 14 CYS C 1 1 9 6915 1 1 14 CYS CA C 7.823 4.284 1.450 1.00 . A B . 14 CYS CA 1 1 9 6916 1 1 14 CYS CB C 8.102 2.790 1.624 1.00 . A B . 14 CYS CB 1 1 9 6917 1 1 14 CYS H H 8.024 4.015 -0.650 1.00 . A B . 14 CYS H 1 1 9 6918 1 1 14 CYS HA H 6.876 4.521 1.911 1.00 . A B . 14 CYS HA 1 1 9 6919 1 1 14 CYS HB2 H 8.457 2.388 0.689 1.00 . A B . 14 CYS HB2 1 1 9 6920 1 1 14 CYS HB3 H 8.867 2.663 2.376 1.00 . A B . 14 CYS HB3 1 1 9 6921 1 1 14 CYS N N 7.737 4.654 0.039 1.00 . A B . 14 CYS N 1 1 9 6922 1 1 14 CYS O O 8.819 5.415 3.319 1.00 . A B . 14 CYS O 1 1 9 6923 1 1 14 CYS SG S 6.664 1.816 2.130 1.00 . A B . 14 CYS SG 1 1 9 6924 1 1 15 ARG C C 10.645 7.639 2.109 1.00 . A B . 15 ARG C 1 1 9 6925 1 1 15 ARG CA C 11.069 6.196 1.888 1.00 . A B . 15 ARG CA 1 1 9 6926 1 1 15 ARG CB C 12.250 6.135 0.926 1.00 . A B . 15 ARG CB 1 1 9 6927 1 1 15 ARG CD C 13.938 4.711 -0.259 1.00 . A B . 15 ARG CD 1 1 9 6928 1 1 15 ARG CG C 12.888 4.760 0.835 1.00 . A B . 15 ARG CG 1 1 9 6929 1 1 15 ARG CZ C 15.562 3.111 -1.201 1.00 . A B . 15 ARG CZ 1 1 9 6930 1 1 15 ARG H H 9.961 5.114 0.440 1.00 . A B . 15 ARG H 1 1 9 6931 1 1 15 ARG HA H 11.363 5.772 2.834 1.00 . A B . 15 ARG HA 1 1 9 6932 1 1 15 ARG HB2 H 11.911 6.418 -0.060 1.00 . A B . 15 ARG HB2 1 1 9 6933 1 1 15 ARG HB3 H 13.003 6.836 1.254 1.00 . A B . 15 ARG HB3 1 1 9 6934 1 1 15 ARG HD2 H 13.445 4.811 -1.214 1.00 . A B . 15 ARG HD2 1 1 9 6935 1 1 15 ARG HD3 H 14.619 5.537 -0.121 1.00 . A B . 15 ARG HD3 1 1 9 6936 1 1 15 ARG HE H 14.573 2.865 0.525 1.00 . A B . 15 ARG HE 1 1 9 6937 1 1 15 ARG HG2 H 13.357 4.526 1.778 1.00 . A B . 15 ARG HG2 1 1 9 6938 1 1 15 ARG HG3 H 12.121 4.032 0.620 1.00 . A B . 15 ARG HG3 1 1 9 6939 1 1 15 ARG HH11 H 15.189 4.721 -2.381 1.00 . A B . 15 ARG HH11 1 1 9 6940 1 1 15 ARG HH12 H 16.371 3.609 -2.996 1.00 . A B . 15 ARG HH12 1 1 9 6941 1 1 15 ARG HH21 H 16.140 1.401 -0.280 1.00 . A B . 15 ARG HH21 1 1 9 6942 1 1 15 ARG HH22 H 16.914 1.721 -1.798 1.00 . A B . 15 ARG HH22 1 1 9 6943 1 1 15 ARG N N 9.954 5.410 1.376 1.00 . A B . 15 ARG N 1 1 9 6944 1 1 15 ARG NE N 14.697 3.463 -0.249 1.00 . A B . 15 ARG NE 1 1 9 6945 1 1 15 ARG NH1 N 15.720 3.874 -2.278 1.00 . A B . 15 ARG NH1 1 1 9 6946 1 1 15 ARG NH2 N 16.260 1.988 -1.083 1.00 . A B . 15 ARG NH2 1 1 9 6947 1 1 15 ARG O O 11.108 8.303 3.035 1.00 . A B . 15 ARG O 1 1 9 6948 1 1 16 ASP C C 8.116 9.505 2.473 1.00 . A B . 16 ASP C 1 1 9 6949 1 1 16 ASP CA C 9.193 9.459 1.397 1.00 . A B . 16 ASP CA 1 1 9 6950 1 1 16 ASP CB C 8.613 9.946 0.067 1.00 . A B . 16 ASP CB 1 1 9 6951 1 1 16 ASP CG C 9.678 10.429 -0.890 1.00 . A B . 16 ASP CG 1 1 9 6952 1 1 16 ASP H H 9.472 7.555 0.500 1.00 . A B . 16 ASP H 1 1 9 6953 1 1 16 ASP HA H 9.999 10.116 1.687 1.00 . A B . 16 ASP HA 1 1 9 6954 1 1 16 ASP HB2 H 8.075 9.135 -0.401 1.00 . A B . 16 ASP HB2 1 1 9 6955 1 1 16 ASP HB3 H 7.929 10.761 0.258 1.00 . A B . 16 ASP HB3 1 1 9 6956 1 1 16 ASP N N 9.748 8.114 1.259 1.00 . A B . 16 ASP N 1 1 9 6957 1 1 16 ASP O O 7.483 10.540 2.690 1.00 . A B . 16 ASP O 1 1 9 6958 1 1 16 ASP OD1 O 10.200 9.610 -1.674 1.00 . A B . 16 ASP OD1 1 1 9 6959 1 1 16 ASP OD2 O 10.004 11.632 -0.865 1.00 . A B . 16 ASP OD2 1 1 9 6960 1 1 17 GLY C C 5.507 8.373 3.629 1.00 . A B . 17 GLY C 1 1 9 6961 1 1 17 GLY CA C 6.910 8.305 4.187 1.00 . A B . 17 GLY CA 1 1 9 6962 1 1 17 GLY H H 8.434 7.580 2.913 1.00 . A B . 17 GLY H 1 1 9 6963 1 1 17 GLY HA2 H 7.031 7.376 4.729 1.00 . A B . 17 GLY HA2 1 1 9 6964 1 1 17 GLY HA3 H 7.056 9.132 4.867 1.00 . A B . 17 GLY HA3 1 1 9 6965 1 1 17 GLY N N 7.908 8.375 3.139 1.00 . A B . 17 GLY N 1 1 9 6966 1 1 17 GLY O O 4.593 8.873 4.285 1.00 . A B . 17 GLY O 1 1 9 6967 1 1 18 GLY C C 3.002 7.128 2.479 1.00 . A B . 18 GLY C 1 1 9 6968 1 1 18 GLY CA C 4.063 7.909 1.736 1.00 . A B . 18 GLY CA 1 1 9 6969 1 1 18 GLY H H 6.133 7.528 1.928 1.00 . A B . 18 GLY H 1 1 9 6970 1 1 18 GLY HA2 H 3.734 8.931 1.639 1.00 . A B . 18 GLY HA2 1 1 9 6971 1 1 18 GLY HA3 H 4.176 7.487 0.750 1.00 . A B . 18 GLY HA3 1 1 9 6972 1 1 18 GLY N N 5.351 7.890 2.400 1.00 . A B . 18 GLY N 1 1 9 6973 1 1 18 GLY O O 3.311 6.236 3.274 1.00 . A B . 18 GLY O 1 1 9 6974 1 1 19 GLU C C 0.327 5.482 2.241 1.00 . A B . 19 GLU C 1 1 9 6975 1 1 19 GLU CA C 0.628 6.833 2.879 1.00 . A B . 19 GLU CA 1 1 9 6976 1 1 19 GLU CB C -0.609 7.739 2.823 1.00 . A B . 19 GLU CB 1 1 9 6977 1 1 19 GLU CD C 0.594 9.942 3.284 1.00 . A B . 19 GLU CD 1 1 9 6978 1 1 19 GLU CG C -0.519 8.995 3.691 1.00 . A B . 19 GLU CG 1 1 9 6979 1 1 19 GLU H H 1.582 8.158 1.546 1.00 . A B . 19 GLU H 1 1 9 6980 1 1 19 GLU HA H 0.901 6.674 3.912 1.00 . A B . 19 GLU HA 1 1 9 6981 1 1 19 GLU HB2 H -0.762 8.051 1.801 1.00 . A B . 19 GLU HB2 1 1 9 6982 1 1 19 GLU HB3 H -1.469 7.169 3.146 1.00 . A B . 19 GLU HB3 1 1 9 6983 1 1 19 GLU HG2 H -1.455 9.527 3.625 1.00 . A B . 19 GLU HG2 1 1 9 6984 1 1 19 GLU HG3 H -0.354 8.693 4.716 1.00 . A B . 19 GLU HG3 1 1 9 6985 1 1 19 GLU N N 1.753 7.465 2.215 1.00 . A B . 19 GLU N 1 1 9 6986 1 1 19 GLU O O 0.621 5.259 1.064 1.00 . A B . 19 GLU O 1 1 9 6987 1 1 19 GLU OE1 O 0.555 10.466 2.149 1.00 . A B . 19 GLU OE1 1 1 9 6988 1 1 19 GLU OE2 O 1.512 10.170 4.098 1.00 . A B . 19 GLU OE2 1 1 9 6989 1 1 20 LEU C C -2.008 2.895 2.908 1.00 . A B . 20 LEU C 1 1 9 6990 1 1 20 LEU CA C -0.558 3.238 2.575 1.00 . A B . 20 LEU CA 1 1 9 6991 1 1 20 LEU CB C 0.398 2.247 3.248 1.00 . A B . 20 LEU CB 1 1 9 6992 1 1 20 LEU CD1 C 0.624 0.574 1.383 1.00 . A B . 20 LEU CD1 1 1 9 6993 1 1 20 LEU CD2 C 1.090 -0.108 3.734 1.00 . A B . 20 LEU CD2 1 1 9 6994 1 1 20 LEU CG C 0.239 0.778 2.841 1.00 . A B . 20 LEU CG 1 1 9 6995 1 1 20 LEU H H -0.498 4.847 3.942 1.00 . A B . 20 LEU H 1 1 9 6996 1 1 20 LEU HA H -0.416 3.200 1.506 1.00 . A B . 20 LEU HA 1 1 9 6997 1 1 20 LEU HB2 H 1.407 2.552 3.018 1.00 . A B . 20 LEU HB2 1 1 9 6998 1 1 20 LEU HB3 H 0.258 2.318 4.317 1.00 . A B . 20 LEU HB3 1 1 9 6999 1 1 20 LEU HD11 H 1.657 0.855 1.239 1.00 . A B . 20 LEU HD11 1 1 9 7000 1 1 20 LEU HD12 H -0.004 1.183 0.750 1.00 . A B . 20 LEU HD12 1 1 9 7001 1 1 20 LEU HD13 H 0.499 -0.466 1.122 1.00 . A B . 20 LEU HD13 1 1 9 7002 1 1 20 LEU HD21 H 0.778 0.008 4.762 1.00 . A B . 20 LEU HD21 1 1 9 7003 1 1 20 LEU HD22 H 2.128 0.175 3.637 1.00 . A B . 20 LEU HD22 1 1 9 7004 1 1 20 LEU HD23 H 0.971 -1.139 3.435 1.00 . A B . 20 LEU HD23 1 1 9 7005 1 1 20 LEU HG H -0.795 0.486 2.961 1.00 . A B . 20 LEU HG 1 1 9 7006 1 1 20 LEU N N -0.256 4.589 3.026 1.00 . A B . 20 LEU N 1 1 9 7007 1 1 20 LEU O O -2.443 3.065 4.046 1.00 . A B . 20 LEU O 1 1 9 7008 1 1 21 PHE C C -4.514 0.678 1.996 1.00 . A B . 21 PHE C 1 1 9 7009 1 1 21 PHE CA C -4.188 2.165 2.119 1.00 . A B . 21 PHE CA 1 1 9 7010 1 1 21 PHE CB C -5.019 2.965 1.110 1.00 . A B . 21 PHE CB 1 1 9 7011 1 1 21 PHE CD1 C -5.403 5.194 2.210 1.00 . A B . 21 PHE CD1 1 1 9 7012 1 1 21 PHE CD2 C -4.010 5.116 0.270 1.00 . A B . 21 PHE CD2 1 1 9 7013 1 1 21 PHE CE1 C -5.209 6.558 2.294 1.00 . A B . 21 PHE CE1 1 1 9 7014 1 1 21 PHE CE2 C -3.818 6.480 0.353 1.00 . A B . 21 PHE CE2 1 1 9 7015 1 1 21 PHE CG C -4.807 4.453 1.198 1.00 . A B . 21 PHE CG 1 1 9 7016 1 1 21 PHE CZ C -4.418 7.202 1.365 1.00 . A B . 21 PHE CZ 1 1 9 7017 1 1 21 PHE H H -2.351 2.245 1.043 1.00 . A B . 21 PHE H 1 1 9 7018 1 1 21 PHE HA H -4.442 2.491 3.119 1.00 . A B . 21 PHE HA 1 1 9 7019 1 1 21 PHE HB2 H -4.758 2.648 0.109 1.00 . A B . 21 PHE HB2 1 1 9 7020 1 1 21 PHE HB3 H -6.070 2.765 1.280 1.00 . A B . 21 PHE HB3 1 1 9 7021 1 1 21 PHE HD1 H -6.025 4.696 2.939 1.00 . A B . 21 PHE HD1 1 1 9 7022 1 1 21 PHE HD2 H -3.538 4.555 -0.524 1.00 . A B . 21 PHE HD2 1 1 9 7023 1 1 21 PHE HE1 H -5.678 7.122 3.086 1.00 . A B . 21 PHE HE1 1 1 9 7024 1 1 21 PHE HE2 H -3.198 6.983 -0.374 1.00 . A B . 21 PHE HE2 1 1 9 7025 1 1 21 PHE HZ H -4.267 8.268 1.430 1.00 . A B . 21 PHE HZ 1 1 9 7026 1 1 21 PHE N N -2.760 2.423 1.922 1.00 . A B . 21 PHE N 1 1 9 7027 1 1 21 PHE O O -5.552 0.297 1.449 1.00 . A B . 21 PHE O 1 1 9 7028 1 1 22 CYS C C -3.464 -2.284 3.743 1.00 . A B . 22 CYS C 1 1 9 7029 1 1 22 CYS CA C -3.828 -1.600 2.436 1.00 . A B . 22 CYS CA 1 1 9 7030 1 1 22 CYS CB C -2.993 -2.197 1.301 1.00 . A B . 22 CYS CB 1 1 9 7031 1 1 22 CYS H H -2.839 0.194 2.961 1.00 . A B . 22 CYS H 1 1 9 7032 1 1 22 CYS HA H -4.874 -1.778 2.230 1.00 . A B . 22 CYS HA 1 1 9 7033 1 1 22 CYS HB2 H -1.997 -1.778 1.336 1.00 . A B . 22 CYS HB2 1 1 9 7034 1 1 22 CYS HB3 H -2.932 -3.269 1.432 1.00 . A B . 22 CYS HB3 1 1 9 7035 1 1 22 CYS N N -3.634 -0.161 2.513 1.00 . A B . 22 CYS N 1 1 9 7036 1 1 22 CYS O O -2.713 -1.746 4.558 1.00 . A B . 22 CYS O 1 1 9 7037 1 1 22 CYS SG S -3.662 -1.886 -0.358 1.00 . A B . 22 CYS SG 1 1 9 7038 1 1 23 CYS C C -2.389 -5.042 4.832 1.00 . A B . 23 CYS C 1 1 9 7039 1 1 23 CYS CA C -3.695 -4.298 5.081 1.00 . A B . 23 CYS CA 1 1 9 7040 1 1 23 CYS CB C -4.827 -5.297 5.340 1.00 . A B . 23 CYS CB 1 1 9 7041 1 1 23 CYS H H -4.605 -3.837 3.239 1.00 . A B . 23 CYS H 1 1 9 7042 1 1 23 CYS HA H -3.580 -3.646 5.936 1.00 . A B . 23 CYS HA 1 1 9 7043 1 1 23 CYS HB2 H -4.707 -5.724 6.328 1.00 . A B . 23 CYS HB2 1 1 9 7044 1 1 23 CYS HB3 H -5.775 -4.779 5.289 1.00 . A B . 23 CYS HB3 1 1 9 7045 1 1 23 CYS N N -4.000 -3.485 3.921 1.00 . A B . 23 CYS N 1 1 9 7046 1 1 23 CYS O O -1.888 -5.029 3.705 1.00 . A B . 23 CYS O 1 1 9 7047 1 1 23 CYS SG S -4.885 -6.666 4.157 1.00 . A B . 23 CYS SG 1 1 9 7048 1 1 24 ASP C C -0.602 -7.383 4.564 1.00 . A B . 24 ASP C 1 1 9 7049 1 1 24 ASP CA C -0.582 -6.408 5.739 1.00 . A B . 24 ASP CA 1 1 9 7050 1 1 24 ASP CB C -0.261 -7.160 7.035 1.00 . A B . 24 ASP CB 1 1 9 7051 1 1 24 ASP CG C 1.078 -7.874 6.980 1.00 . A B . 24 ASP CG 1 1 9 7052 1 1 24 ASP H H -2.334 -5.707 6.713 1.00 . A B . 24 ASP H 1 1 9 7053 1 1 24 ASP HA H 0.189 -5.673 5.564 1.00 . A B . 24 ASP HA 1 1 9 7054 1 1 24 ASP HB2 H -0.238 -6.460 7.857 1.00 . A B . 24 ASP HB2 1 1 9 7055 1 1 24 ASP HB3 H -1.032 -7.895 7.216 1.00 . A B . 24 ASP HB3 1 1 9 7056 1 1 24 ASP N N -1.857 -5.697 5.855 1.00 . A B . 24 ASP N 1 1 9 7057 1 1 24 ASP O O 0.319 -7.407 3.749 1.00 . A B . 24 ASP O 1 1 9 7058 1 1 24 ASP OD1 O 2.109 -7.241 7.289 1.00 . A B . 24 ASP OD1 1 1 9 7059 1 1 24 ASP OD2 O 1.106 -9.071 6.633 1.00 . A B . 24 ASP OD2 1 1 9 7060 1 1 25 THR C C -1.758 -8.600 2.022 1.00 . A B . 25 THR C 1 1 9 7061 1 1 25 THR CA C -1.799 -9.182 3.441 1.00 . A B . 25 THR CA 1 1 9 7062 1 1 25 THR CB C -3.099 -9.980 3.647 1.00 . A B . 25 THR CB 1 1 9 7063 1 1 25 THR CG2 C -3.160 -11.185 2.718 1.00 . A B . 25 THR CG2 1 1 9 7064 1 1 25 THR H H -2.432 -8.006 5.068 1.00 . A B . 25 THR H 1 1 9 7065 1 1 25 THR HA H -0.969 -9.859 3.562 1.00 . A B . 25 THR HA 1 1 9 7066 1 1 25 THR HB H -3.936 -9.333 3.434 1.00 . A B . 25 THR HB 1 1 9 7067 1 1 25 THR HG1 H -2.288 -10.483 5.384 1.00 . A B . 25 THR HG1 1 1 9 7068 1 1 25 THR HG21 H -3.118 -10.851 1.693 1.00 . A B . 25 THR HG21 1 1 9 7069 1 1 25 THR HG22 H -4.081 -11.722 2.886 1.00 . A B . 25 THR HG22 1 1 9 7070 1 1 25 THR HG23 H -2.321 -11.836 2.919 1.00 . A B . 25 THR HG23 1 1 9 7071 1 1 25 THR N N -1.683 -8.147 4.455 1.00 . A B . 25 THR N 1 1 9 7072 1 1 25 THR O O -0.973 -9.049 1.186 1.00 . A B . 25 THR O 1 1 9 7073 1 1 25 THR OG1 O -3.180 -10.417 5.013 1.00 . A B . 25 THR OG1 1 1 9 7074 1 1 26 CYS C C -1.377 -6.170 0.140 1.00 . A B . 26 CYS C 1 1 9 7075 1 1 26 CYS CA C -2.628 -7.001 0.416 1.00 . A B . 26 CYS CA 1 1 9 7076 1 1 26 CYS CB C -3.871 -6.132 0.227 1.00 . A B . 26 CYS CB 1 1 9 7077 1 1 26 CYS H H -3.167 -7.244 2.458 1.00 . A B . 26 CYS H 1 1 9 7078 1 1 26 CYS HA H -2.659 -7.814 -0.296 1.00 . A B . 26 CYS HA 1 1 9 7079 1 1 26 CYS HB2 H -3.835 -5.314 0.927 1.00 . A B . 26 CYS HB2 1 1 9 7080 1 1 26 CYS HB3 H -3.875 -5.734 -0.777 1.00 . A B . 26 CYS HB3 1 1 9 7081 1 1 26 CYS N N -2.582 -7.591 1.752 1.00 . A B . 26 CYS N 1 1 9 7082 1 1 26 CYS O O -0.916 -6.101 -0.996 1.00 . A B . 26 CYS O 1 1 9 7083 1 1 26 CYS SG S -5.435 -6.996 0.485 1.00 . A B . 26 CYS SG 1 1 9 7084 1 1 27 SER C C 1.554 -5.623 0.597 1.00 . A B . 27 SER C 1 1 9 7085 1 1 27 SER CA C 0.386 -4.748 1.037 1.00 . A B . 27 SER CA 1 1 9 7086 1 1 27 SER CB C 0.724 -4.040 2.356 1.00 . A B . 27 SER CB 1 1 9 7087 1 1 27 SER H H -1.231 -5.641 2.072 1.00 . A B . 27 SER H 1 1 9 7088 1 1 27 SER HA H 0.199 -4.005 0.275 1.00 . A B . 27 SER HA 1 1 9 7089 1 1 27 SER HB2 H -0.102 -3.409 2.644 1.00 . A B . 27 SER HB2 1 1 9 7090 1 1 27 SER HB3 H 0.892 -4.781 3.123 1.00 . A B . 27 SER HB3 1 1 9 7091 1 1 27 SER HG H 2.485 -3.425 2.964 1.00 . A B . 27 SER HG 1 1 9 7092 1 1 27 SER N N -0.822 -5.553 1.182 1.00 . A B . 27 SER N 1 1 9 7093 1 1 27 SER O O 2.456 -5.170 -0.093 1.00 . A B . 27 SER O 1 1 9 7094 1 1 27 SER OG O 1.887 -3.234 2.233 1.00 . A B . 27 SER OG 1 1 9 7095 1 1 28 ARG C C 2.438 -8.168 -0.893 1.00 . A B . 28 ARG C 1 1 9 7096 1 1 28 ARG CA C 2.565 -7.819 0.587 1.00 . A B . 28 ARG CA 1 1 9 7097 1 1 28 ARG CB C 2.488 -9.102 1.412 1.00 . A B . 28 ARG CB 1 1 9 7098 1 1 28 ARG CD C 2.772 -10.288 3.591 1.00 . A B . 28 ARG CD 1 1 9 7099 1 1 28 ARG CG C 2.854 -8.948 2.878 1.00 . A B . 28 ARG CG 1 1 9 7100 1 1 28 ARG CZ C 3.871 -10.828 5.732 1.00 . A B . 28 ARG CZ 1 1 9 7101 1 1 28 ARG H H 0.805 -7.194 1.578 1.00 . A B . 28 ARG H 1 1 9 7102 1 1 28 ARG HA H 3.522 -7.346 0.753 1.00 . A B . 28 ARG HA 1 1 9 7103 1 1 28 ARG HB2 H 1.479 -9.480 1.361 1.00 . A B . 28 ARG HB2 1 1 9 7104 1 1 28 ARG HB3 H 3.153 -9.828 0.975 1.00 . A B . 28 ARG HB3 1 1 9 7105 1 1 28 ARG HD2 H 1.803 -10.723 3.399 1.00 . A B . 28 ARG HD2 1 1 9 7106 1 1 28 ARG HD3 H 3.539 -10.935 3.196 1.00 . A B . 28 ARG HD3 1 1 9 7107 1 1 28 ARG HE H 2.329 -9.560 5.518 1.00 . A B . 28 ARG HE 1 1 9 7108 1 1 28 ARG HG2 H 3.865 -8.573 2.951 1.00 . A B . 28 ARG HG2 1 1 9 7109 1 1 28 ARG HG3 H 2.173 -8.255 3.347 1.00 . A B . 28 ARG HG3 1 1 9 7110 1 1 28 ARG HH11 H 4.705 -11.748 4.123 1.00 . A B . 28 ARG HH11 1 1 9 7111 1 1 28 ARG HH12 H 5.418 -12.142 5.655 1.00 . A B . 28 ARG HH12 1 1 9 7112 1 1 28 ARG HH21 H 3.288 -10.058 7.510 1.00 . A B . 28 ARG HH21 1 1 9 7113 1 1 28 ARG HH22 H 4.619 -11.172 7.582 1.00 . A B . 28 ARG HH22 1 1 9 7114 1 1 28 ARG N N 1.528 -6.886 0.991 1.00 . A B . 28 ARG N 1 1 9 7115 1 1 28 ARG NE N 2.953 -10.164 5.034 1.00 . A B . 28 ARG NE 1 1 9 7116 1 1 28 ARG NH1 N 4.735 -11.634 5.120 1.00 . A B . 28 ARG NH1 1 1 9 7117 1 1 28 ARG NH2 N 3.931 -10.672 7.045 1.00 . A B . 28 ARG NH2 1 1 9 7118 1 1 28 ARG O O 3.434 -8.448 -1.563 1.00 . A B . 28 ARG O 1 1 9 7119 1 1 29 VAL C C 0.974 -7.420 -3.746 1.00 . A B . 29 VAL C 1 1 9 7120 1 1 29 VAL CA C 0.943 -8.587 -2.759 1.00 . A B . 29 VAL CA 1 1 9 7121 1 1 29 VAL CB C -0.418 -9.313 -2.864 1.00 . A B . 29 VAL CB 1 1 9 7122 1 1 29 VAL CG1 C -0.619 -9.891 -4.257 1.00 . A B . 29 VAL CG1 1 1 9 7123 1 1 29 VAL CG2 C -0.530 -10.410 -1.820 1.00 . A B . 29 VAL CG2 1 1 9 7124 1 1 29 VAL H H 0.469 -7.829 -0.842 1.00 . A B . 29 VAL H 1 1 9 7125 1 1 29 VAL HA H 1.715 -9.287 -3.032 1.00 . A B . 29 VAL HA 1 1 9 7126 1 1 29 VAL HB H -1.201 -8.593 -2.682 1.00 . A B . 29 VAL HB 1 1 9 7127 1 1 29 VAL HG11 H -1.581 -10.379 -4.308 1.00 . A B . 29 VAL HG11 1 1 9 7128 1 1 29 VAL HG12 H 0.160 -10.610 -4.462 1.00 . A B . 29 VAL HG12 1 1 9 7129 1 1 29 VAL HG13 H -0.577 -9.097 -4.988 1.00 . A B . 29 VAL HG13 1 1 9 7130 1 1 29 VAL HG21 H -0.511 -9.974 -0.832 1.00 . A B . 29 VAL HG21 1 1 9 7131 1 1 29 VAL HG22 H 0.298 -11.094 -1.927 1.00 . A B . 29 VAL HG22 1 1 9 7132 1 1 29 VAL HG23 H -1.458 -10.945 -1.958 1.00 . A B . 29 VAL HG23 1 1 9 7133 1 1 29 VAL N N 1.211 -8.148 -1.398 1.00 . A B . 29 VAL N 1 1 9 7134 1 1 29 VAL O O 1.597 -7.515 -4.800 1.00 . A B . 29 VAL O 1 1 9 7135 1 1 30 PHE C C 0.793 -3.930 -3.639 1.00 . A B . 30 PHE C 1 1 9 7136 1 1 30 PHE CA C 0.217 -5.174 -4.298 1.00 . A B . 30 PHE CA 1 1 9 7137 1 1 30 PHE CB C -1.246 -4.904 -4.677 1.00 . A B . 30 PHE CB 1 1 9 7138 1 1 30 PHE CD1 C -1.650 -6.544 -6.544 1.00 . A B . 30 PHE CD1 1 1 9 7139 1 1 30 PHE CD2 C -2.980 -6.711 -4.570 1.00 . A B . 30 PHE CD2 1 1 9 7140 1 1 30 PHE CE1 C -2.323 -7.619 -7.091 1.00 . A B . 30 PHE CE1 1 1 9 7141 1 1 30 PHE CE2 C -3.656 -7.785 -5.112 1.00 . A B . 30 PHE CE2 1 1 9 7142 1 1 30 PHE CG C -1.969 -6.078 -5.276 1.00 . A B . 30 PHE CG 1 1 9 7143 1 1 30 PHE CZ C -3.327 -8.241 -6.374 1.00 . A B . 30 PHE CZ 1 1 9 7144 1 1 30 PHE H H -0.075 -6.257 -2.497 1.00 . A B . 30 PHE H 1 1 9 7145 1 1 30 PHE HA H 0.782 -5.396 -5.190 1.00 . A B . 30 PHE HA 1 1 9 7146 1 1 30 PHE HB2 H -1.787 -4.608 -3.790 1.00 . A B . 30 PHE HB2 1 1 9 7147 1 1 30 PHE HB3 H -1.276 -4.096 -5.392 1.00 . A B . 30 PHE HB3 1 1 9 7148 1 1 30 PHE HD1 H -0.865 -6.060 -7.108 1.00 . A B . 30 PHE HD1 1 1 9 7149 1 1 30 PHE HD2 H -3.241 -6.355 -3.583 1.00 . A B . 30 PHE HD2 1 1 9 7150 1 1 30 PHE HE1 H -2.066 -7.973 -8.078 1.00 . A B . 30 PHE HE1 1 1 9 7151 1 1 30 PHE HE2 H -4.442 -8.268 -4.549 1.00 . A B . 30 PHE HE2 1 1 9 7152 1 1 30 PHE HZ H -3.854 -9.081 -6.801 1.00 . A B . 30 PHE HZ 1 1 9 7153 1 1 30 PHE N N 0.324 -6.317 -3.396 1.00 . A B . 30 PHE N 1 1 9 7154 1 1 30 PHE O O 0.191 -2.862 -3.697 1.00 . A B . 30 PHE O 1 1 9 7155 1 1 31 HIS C C 2.610 -1.690 -2.991 1.00 . A B . 31 HIS C 1 1 9 7156 1 1 31 HIS CA C 2.572 -3.013 -2.234 1.00 . A B . 31 HIS CA 1 1 9 7157 1 1 31 HIS CB C 3.989 -3.423 -1.823 1.00 . A B . 31 HIS CB 1 1 9 7158 1 1 31 HIS CD2 C 5.779 -1.827 -0.849 1.00 . A B . 31 HIS CD2 1 1 9 7159 1 1 31 HIS CE1 C 4.873 -1.396 1.069 1.00 . A B . 31 HIS CE1 1 1 9 7160 1 1 31 HIS CG C 4.613 -2.516 -0.805 1.00 . A B . 31 HIS CG 1 1 9 7161 1 1 31 HIS H H 2.422 -4.941 -3.095 1.00 . A B . 31 HIS H 1 1 9 7162 1 1 31 HIS HA H 1.978 -2.881 -1.345 1.00 . A B . 31 HIS HA 1 1 9 7163 1 1 31 HIS HB2 H 3.958 -4.418 -1.403 1.00 . A B . 31 HIS HB2 1 1 9 7164 1 1 31 HIS HB3 H 4.620 -3.427 -2.700 1.00 . A B . 31 HIS HB3 1 1 9 7165 1 1 31 HIS HD1 H 3.190 -2.587 0.758 1.00 . A B . 31 HIS HD1 1 1 9 7166 1 1 31 HIS HD2 H 6.468 -1.804 -1.679 1.00 . A B . 31 HIS HD2 1 1 9 7167 1 1 31 HIS HE1 H 4.686 -0.993 2.056 1.00 . A B . 31 HIS HE1 1 1 9 7168 1 1 31 HIS N N 1.960 -4.081 -3.025 1.00 . A B . 31 HIS N 1 1 9 7169 1 1 31 HIS ND1 N 4.050 -2.236 0.420 1.00 . A B . 31 HIS ND1 1 1 9 7170 1 1 31 HIS NE2 N 5.940 -1.118 0.341 1.00 . A B . 31 HIS NE2 1 1 9 7171 1 1 31 HIS O O 2.149 -0.674 -2.488 1.00 . A B . 31 HIS O 1 1 9 7172 1 1 32 GLU C C 1.958 0.128 -5.331 1.00 . A B . 32 GLU C 1 1 9 7173 1 1 32 GLU CA C 3.298 -0.515 -5.000 1.00 . A B . 32 GLU CA 1 1 9 7174 1 1 32 GLU CB C 4.025 -0.854 -6.294 1.00 . A B . 32 GLU CB 1 1 9 7175 1 1 32 GLU CD C 5.655 -2.410 -7.377 1.00 . A B . 32 GLU CD 1 1 9 7176 1 1 32 GLU CG C 5.245 -1.730 -6.095 1.00 . A B . 32 GLU CG 1 1 9 7177 1 1 32 GLU H H 3.286 -2.596 -4.625 1.00 . A B . 32 GLU H 1 1 9 7178 1 1 32 GLU HA H 3.895 0.172 -4.419 1.00 . A B . 32 GLU HA 1 1 9 7179 1 1 32 GLU HB2 H 3.340 -1.373 -6.947 1.00 . A B . 32 GLU HB2 1 1 9 7180 1 1 32 GLU HB3 H 4.338 0.063 -6.769 1.00 . A B . 32 GLU HB3 1 1 9 7181 1 1 32 GLU HG2 H 6.063 -1.118 -5.745 1.00 . A B . 32 GLU HG2 1 1 9 7182 1 1 32 GLU HG3 H 5.019 -2.486 -5.356 1.00 . A B . 32 GLU HG3 1 1 9 7183 1 1 32 GLU N N 3.095 -1.728 -4.219 1.00 . A B . 32 GLU N 1 1 9 7184 1 1 32 GLU O O 1.772 1.338 -5.188 1.00 . A B . 32 GLU O 1 1 9 7185 1 1 32 GLU OE1 O 4.795 -3.077 -7.993 1.00 . A B . 32 GLU OE1 1 1 9 7186 1 1 32 GLU OE2 O 6.832 -2.288 -7.774 1.00 . A B . 32 GLU OE2 1 1 9 7187 1 1 33 ASP C C -1.061 0.263 -4.932 1.00 . A B . 33 ASP C 1 1 9 7188 1 1 33 ASP CA C -0.307 -0.274 -6.142 1.00 . A B . 33 ASP CA 1 1 9 7189 1 1 33 ASP CB C -1.083 -1.444 -6.757 1.00 . A B . 33 ASP CB 1 1 9 7190 1 1 33 ASP CG C -0.418 -2.015 -7.999 1.00 . A B . 33 ASP CG 1 1 9 7191 1 1 33 ASP H H 1.234 -1.668 -5.791 1.00 . A B . 33 ASP H 1 1 9 7192 1 1 33 ASP HA H -0.202 0.512 -6.875 1.00 . A B . 33 ASP HA 1 1 9 7193 1 1 33 ASP HB2 H -1.163 -2.232 -6.026 1.00 . A B . 33 ASP HB2 1 1 9 7194 1 1 33 ASP HB3 H -2.075 -1.109 -7.025 1.00 . A B . 33 ASP HB3 1 1 9 7195 1 1 33 ASP N N 1.024 -0.712 -5.750 1.00 . A B . 33 ASP N 1 1 9 7196 1 1 33 ASP O O -1.956 1.098 -5.060 1.00 . A B . 33 ASP O 1 1 9 7197 1 1 33 ASP OD1 O 0.695 -2.579 -7.886 1.00 . A B . 33 ASP OD1 1 1 9 7198 1 1 33 ASP OD2 O -1.011 -1.918 -9.093 1.00 . A B . 33 ASP OD2 1 1 9 7199 1 1 34 CYS C C -0.787 1.555 -2.046 1.00 . A B . 34 CYS C 1 1 9 7200 1 1 34 CYS CA C -1.294 0.187 -2.508 1.00 . A B . 34 CYS CA 1 1 9 7201 1 1 34 CYS CB C -1.042 -0.875 -1.434 1.00 . A B . 34 CYS CB 1 1 9 7202 1 1 34 CYS H H 0.044 -0.892 -3.736 1.00 . A B . 34 CYS H 1 1 9 7203 1 1 34 CYS HA H -2.359 0.258 -2.680 1.00 . A B . 34 CYS HA 1 1 9 7204 1 1 34 CYS HB2 H -0.015 -1.215 -1.502 1.00 . A B . 34 CYS HB2 1 1 9 7205 1 1 34 CYS HB3 H -1.206 -0.440 -0.460 1.00 . A B . 34 CYS HB3 1 1 9 7206 1 1 34 CYS N N -0.676 -0.221 -3.761 1.00 . A B . 34 CYS N 1 1 9 7207 1 1 34 CYS O O -1.298 2.120 -1.074 1.00 . A B . 34 CYS O 1 1 9 7208 1 1 34 CYS SG S -2.112 -2.340 -1.580 1.00 . A B . 34 CYS SG 1 1 9 7209 1 1 35 HIS C C 0.239 4.408 -3.504 1.00 . A B . 35 HIS C 1 1 9 7210 1 1 35 HIS CA C 0.720 3.420 -2.452 1.00 . A B . 35 HIS CA 1 1 9 7211 1 1 35 HIS CB C 2.249 3.453 -2.410 1.00 . A B . 35 HIS CB 1 1 9 7212 1 1 35 HIS CD2 C 3.226 1.486 -1.067 1.00 . A B . 35 HIS CD2 1 1 9 7213 1 1 35 HIS CE1 C 3.695 2.494 0.782 1.00 . A B . 35 HIS CE1 1 1 9 7214 1 1 35 HIS CG C 2.849 2.771 -1.223 1.00 . A B . 35 HIS CG 1 1 9 7215 1 1 35 HIS H H 0.636 1.554 -3.453 1.00 . A B . 35 HIS H 1 1 9 7216 1 1 35 HIS HA H 0.337 3.721 -1.487 1.00 . A B . 35 HIS HA 1 1 9 7217 1 1 35 HIS HB2 H 2.634 2.967 -3.295 1.00 . A B . 35 HIS HB2 1 1 9 7218 1 1 35 HIS HB3 H 2.575 4.483 -2.404 1.00 . A B . 35 HIS HB3 1 1 9 7219 1 1 35 HIS HD1 H 2.939 4.339 0.194 1.00 . A B . 35 HIS HD1 1 1 9 7220 1 1 35 HIS HD2 H 3.139 0.708 -1.812 1.00 . A B . 35 HIS HD2 1 1 9 7221 1 1 35 HIS HE1 H 4.043 2.705 1.782 1.00 . A B . 35 HIS HE1 1 1 9 7222 1 1 35 HIS N N 0.219 2.081 -2.737 1.00 . A B . 35 HIS N 1 1 9 7223 1 1 35 HIS ND1 N 3.143 3.403 -0.035 1.00 . A B . 35 HIS ND1 1 1 9 7224 1 1 35 HIS NE2 N 3.766 1.307 0.198 1.00 . A B . 35 HIS NE2 1 1 9 7225 1 1 35 HIS O O -0.139 5.536 -3.185 1.00 . A B . 35 HIS O 1 1 9 7226 1 1 36 ILE C C -0.973 4.165 -6.891 1.00 . A B . 36 ILE C 1 1 9 7227 1 1 36 ILE CA C -0.068 4.856 -5.873 1.00 . A B . 36 ILE CA 1 1 9 7228 1 1 36 ILE CB C 1.209 5.397 -6.578 1.00 . A B . 36 ILE CB 1 1 9 7229 1 1 36 ILE CD1 C 2.093 3.413 -7.956 1.00 . A B . 36 ILE CD1 1 1 9 7230 1 1 36 ILE CG1 C 2.281 4.302 -6.740 1.00 . A B . 36 ILE CG1 1 1 9 7231 1 1 36 ILE CG2 C 1.777 6.589 -5.818 1.00 . A B . 36 ILE CG2 1 1 9 7232 1 1 36 ILE H H 0.468 3.037 -4.944 1.00 . A B . 36 ILE H 1 1 9 7233 1 1 36 ILE HA H -0.603 5.701 -5.464 1.00 . A B . 36 ILE HA 1 1 9 7234 1 1 36 ILE HB H 0.919 5.745 -7.558 1.00 . A B . 36 ILE HB 1 1 9 7235 1 1 36 ILE HD11 H 2.167 4.008 -8.854 1.00 . A B . 36 ILE HD11 1 1 9 7236 1 1 36 ILE HD12 H 1.120 2.944 -7.913 1.00 . A B . 36 ILE HD12 1 1 9 7237 1 1 36 ILE HD13 H 2.860 2.651 -7.967 1.00 . A B . 36 ILE HD13 1 1 9 7238 1 1 36 ILE HG12 H 3.251 4.767 -6.822 1.00 . A B . 36 ILE HG12 1 1 9 7239 1 1 36 ILE HG13 H 2.268 3.671 -5.865 1.00 . A B . 36 ILE HG13 1 1 9 7240 1 1 36 ILE HG21 H 1.985 6.301 -4.797 1.00 . A B . 36 ILE HG21 1 1 9 7241 1 1 36 ILE HG22 H 1.060 7.396 -5.826 1.00 . A B . 36 ILE HG22 1 1 9 7242 1 1 36 ILE HG23 H 2.690 6.916 -6.292 1.00 . A B . 36 ILE HG23 1 1 9 7243 1 1 36 ILE N N 0.254 3.976 -4.761 1.00 . A B . 36 ILE N 1 1 9 7244 1 1 36 ILE O O -0.808 2.982 -7.183 1.00 . A B . 36 ILE O 1 1 9 7245 1 1 37 PRO C C -3.040 6.210 -5.620 1.00 . A B . 37 PRO C 1 1 9 7246 1 1 37 PRO CA C -2.304 6.240 -6.956 1.00 . A B . 37 PRO CA 1 1 9 7247 1 1 37 PRO CB C -3.232 6.790 -8.058 1.00 . A B . 37 PRO CB 1 1 9 7248 1 1 37 PRO CD C -2.872 4.451 -8.480 1.00 . A B . 37 PRO CD 1 1 9 7249 1 1 37 PRO CG C -3.249 5.751 -9.137 1.00 . A B . 37 PRO CG 1 1 9 7250 1 1 37 PRO HA H -1.420 6.858 -6.871 1.00 . A B . 37 PRO HA 1 1 9 7251 1 1 37 PRO HB2 H -4.221 6.943 -7.648 1.00 . A B . 37 PRO HB2 1 1 9 7252 1 1 37 PRO HB3 H -2.840 7.731 -8.426 1.00 . A B . 37 PRO HB3 1 1 9 7253 1 1 37 PRO HD2 H -3.748 3.957 -8.080 1.00 . A B . 37 PRO HD2 1 1 9 7254 1 1 37 PRO HD3 H -2.355 3.807 -9.178 1.00 . A B . 37 PRO HD3 1 1 9 7255 1 1 37 PRO HG2 H -4.241 5.682 -9.561 1.00 . A B . 37 PRO HG2 1 1 9 7256 1 1 37 PRO HG3 H -2.530 6.006 -9.903 1.00 . A B . 37 PRO HG3 1 1 9 7257 1 1 37 PRO N N -1.978 4.887 -7.406 1.00 . A B . 37 PRO N 1 1 9 7258 1 1 37 PRO O O -3.905 5.358 -5.406 1.00 . A B . 37 PRO O 1 1 9 7259 1 1 38 PRO C C -4.803 7.675 -3.539 1.00 . A B . 38 PRO C 1 1 9 7260 1 1 38 PRO CA C -3.367 7.185 -3.399 1.00 . A B . 38 PRO CA 1 1 9 7261 1 1 38 PRO CB C -2.525 8.187 -2.606 1.00 . A B . 38 PRO CB 1 1 9 7262 1 1 38 PRO CD C -1.653 8.146 -4.842 1.00 . A B . 38 PRO CD 1 1 9 7263 1 1 38 PRO CG C -1.865 9.036 -3.642 1.00 . A B . 38 PRO CG 1 1 9 7264 1 1 38 PRO HA H -3.360 6.227 -2.901 1.00 . A B . 38 PRO HA 1 1 9 7265 1 1 38 PRO HB2 H -3.170 8.772 -1.965 1.00 . A B . 38 PRO HB2 1 1 9 7266 1 1 38 PRO HB3 H -1.799 7.657 -2.006 1.00 . A B . 38 PRO HB3 1 1 9 7267 1 1 38 PRO HD2 H -1.791 8.704 -5.758 1.00 . A B . 38 PRO HD2 1 1 9 7268 1 1 38 PRO HD3 H -0.669 7.698 -4.815 1.00 . A B . 38 PRO HD3 1 1 9 7269 1 1 38 PRO HG2 H -2.510 9.866 -3.898 1.00 . A B . 38 PRO HG2 1 1 9 7270 1 1 38 PRO HG3 H -0.917 9.399 -3.271 1.00 . A B . 38 PRO HG3 1 1 9 7271 1 1 38 PRO N N -2.700 7.118 -4.696 1.00 . A B . 38 PRO N 1 1 9 7272 1 1 38 PRO O O -5.061 8.678 -4.205 1.00 . A B . 38 PRO O 1 1 9 7273 1 1 39 VAL C C -7.396 8.607 -2.186 1.00 . A B . 39 VAL C 1 1 9 7274 1 1 39 VAL CA C -7.139 7.340 -2.999 1.00 . A B . 39 VAL CA 1 1 9 7275 1 1 39 VAL CB C -8.066 6.198 -2.522 1.00 . A B . 39 VAL CB 1 1 9 7276 1 1 39 VAL CG1 C -8.046 5.043 -3.512 1.00 . A B . 39 VAL CG1 1 1 9 7277 1 1 39 VAL CG2 C -7.669 5.712 -1.138 1.00 . A B . 39 VAL CG2 1 1 9 7278 1 1 39 VAL H H -5.477 6.175 -2.408 1.00 . A B . 39 VAL H 1 1 9 7279 1 1 39 VAL HA H -7.363 7.545 -4.035 1.00 . A B . 39 VAL HA 1 1 9 7280 1 1 39 VAL HB H -9.074 6.579 -2.471 1.00 . A B . 39 VAL HB 1 1 9 7281 1 1 39 VAL HG11 H -7.035 4.682 -3.624 1.00 . A B . 39 VAL HG11 1 1 9 7282 1 1 39 VAL HG12 H -8.417 5.382 -4.468 1.00 . A B . 39 VAL HG12 1 1 9 7283 1 1 39 VAL HG13 H -8.674 4.244 -3.145 1.00 . A B . 39 VAL HG13 1 1 9 7284 1 1 39 VAL HG21 H -6.665 5.320 -1.168 1.00 . A B . 39 VAL HG21 1 1 9 7285 1 1 39 VAL HG22 H -8.351 4.938 -0.819 1.00 . A B . 39 VAL HG22 1 1 9 7286 1 1 39 VAL HG23 H -7.713 6.539 -0.445 1.00 . A B . 39 VAL HG23 1 1 9 7287 1 1 39 VAL N N -5.735 6.965 -2.923 1.00 . A B . 39 VAL N 1 1 9 7288 1 1 39 VAL O O -7.095 8.667 -0.993 1.00 . A B . 39 VAL O 1 1 9 7289 1 1 40 GLU C C -9.458 10.986 -1.474 1.00 . A B . 40 GLU C 1 1 9 7290 1 1 40 GLU CA C -8.129 10.924 -2.218 1.00 . A B . 40 GLU CA 1 1 9 7291 1 1 40 GLU CB C -8.076 12.031 -3.274 1.00 . A B . 40 GLU CB 1 1 9 7292 1 1 40 GLU CD C -6.835 13.056 -5.205 1.00 . A B . 40 GLU CD 1 1 9 7293 1 1 40 GLU CG C -6.771 12.079 -4.053 1.00 . A B . 40 GLU CG 1 1 9 7294 1 1 40 GLU H H -8.194 9.499 -3.783 1.00 . A B . 40 GLU H 1 1 9 7295 1 1 40 GLU HA H -7.328 11.075 -1.511 1.00 . A B . 40 GLU HA 1 1 9 7296 1 1 40 GLU HB2 H -8.881 11.883 -3.976 1.00 . A B . 40 GLU HB2 1 1 9 7297 1 1 40 GLU HB3 H -8.210 12.983 -2.785 1.00 . A B . 40 GLU HB3 1 1 9 7298 1 1 40 GLU HG2 H -5.976 12.381 -3.388 1.00 . A B . 40 GLU HG2 1 1 9 7299 1 1 40 GLU HG3 H -6.561 11.094 -4.445 1.00 . A B . 40 GLU HG3 1 1 9 7300 1 1 40 GLU N N -7.930 9.624 -2.845 1.00 . A B . 40 GLU N 1 1 9 7301 1 1 40 GLU O O -9.568 11.635 -0.437 1.00 . A B . 40 GLU O 1 1 9 7302 1 1 40 GLU OE1 O -7.299 12.664 -6.297 1.00 . A B . 40 GLU OE1 1 1 9 7303 1 1 40 GLU OE2 O -6.443 14.227 -5.025 1.00 . A B . 40 GLU OE2 1 1 9 7304 1 1 41 ALA C C -11.937 9.255 -0.351 1.00 . A B . 41 ALA C 1 1 9 7305 1 1 41 ALA CA C -11.791 10.337 -1.407 1.00 . A B . 41 ALA CA 1 1 9 7306 1 1 41 ALA CB C -12.864 10.185 -2.478 1.00 . A B . 41 ALA CB 1 1 9 7307 1 1 41 ALA H H -10.307 9.764 -2.800 1.00 . A B . 41 ALA H 1 1 9 7308 1 1 41 ALA HA H -11.921 11.298 -0.938 1.00 . A B . 41 ALA HA 1 1 9 7309 1 1 41 ALA HB1 H -12.762 9.224 -2.959 1.00 . A B . 41 ALA HB1 1 1 9 7310 1 1 41 ALA HB2 H -12.753 10.968 -3.211 1.00 . A B . 41 ALA HB2 1 1 9 7311 1 1 41 ALA HB3 H -13.841 10.256 -2.021 1.00 . A B . 41 ALA HB3 1 1 9 7312 1 1 41 ALA N N -10.463 10.305 -2.001 1.00 . A B . 41 ALA N 1 1 9 7313 1 1 41 ALA O O -12.461 9.497 0.738 1.00 . A B . 41 ALA O 1 1 9 7314 1 1 42 GLU C C -10.265 6.721 0.996 1.00 . A B . 42 GLU C 1 1 9 7315 1 1 42 GLU CA C -11.563 6.929 0.230 1.00 . A B . 42 GLU CA 1 1 9 7316 1 1 42 GLU CB C -11.928 5.676 -0.565 1.00 . A B . 42 GLU CB 1 1 9 7317 1 1 42 GLU CD C -13.556 4.582 -2.155 1.00 . A B . 42 GLU CD 1 1 9 7318 1 1 42 GLU CG C -13.244 5.802 -1.318 1.00 . A B . 42 GLU CG 1 1 9 7319 1 1 42 GLU H H -10.976 7.958 -1.519 1.00 . A B . 42 GLU H 1 1 9 7320 1 1 42 GLU HA H -12.352 7.142 0.936 1.00 . A B . 42 GLU HA 1 1 9 7321 1 1 42 GLU HB2 H -11.144 5.476 -1.280 1.00 . A B . 42 GLU HB2 1 1 9 7322 1 1 42 GLU HB3 H -12.003 4.841 0.115 1.00 . A B . 42 GLU HB3 1 1 9 7323 1 1 42 GLU HG2 H -14.041 5.943 -0.603 1.00 . A B . 42 GLU HG2 1 1 9 7324 1 1 42 GLU HG3 H -13.188 6.663 -1.969 1.00 . A B . 42 GLU HG3 1 1 9 7325 1 1 42 GLU N N -11.444 8.070 -0.664 1.00 . A B . 42 GLU N 1 1 9 7326 1 1 42 GLU O O -9.827 5.592 1.220 1.00 . A B . 42 GLU O 1 1 9 7327 1 1 42 GLU OE1 O -14.209 3.652 -1.637 1.00 . A B . 42 GLU OE1 1 1 9 7328 1 1 42 GLU OE2 O -13.162 4.548 -3.338 1.00 . A B . 42 GLU OE2 1 1 9 7329 1 1 43 ARG C C -8.624 7.385 3.576 1.00 . A B . 43 ARG C 1 1 9 7330 1 1 43 ARG CA C -8.396 7.795 2.124 1.00 . A B . 43 ARG CA 1 1 9 7331 1 1 43 ARG CB C -7.688 9.150 2.043 1.00 . A B . 43 ARG CB 1 1 9 7332 1 1 43 ARG CD C -7.778 11.638 2.351 1.00 . A B . 43 ARG CD 1 1 9 7333 1 1 43 ARG CG C -8.571 10.343 2.378 1.00 . A B . 43 ARG CG 1 1 9 7334 1 1 43 ARG CZ C -8.122 14.041 2.811 1.00 . A B . 43 ARG CZ 1 1 9 7335 1 1 43 ARG H H -10.055 8.692 1.170 1.00 . A B . 43 ARG H 1 1 9 7336 1 1 43 ARG HA H -7.770 7.050 1.659 1.00 . A B . 43 ARG HA 1 1 9 7337 1 1 43 ARG HB2 H -6.856 9.145 2.728 1.00 . A B . 43 ARG HB2 1 1 9 7338 1 1 43 ARG HB3 H -7.314 9.282 1.038 1.00 . A B . 43 ARG HB3 1 1 9 7339 1 1 43 ARG HD2 H -6.972 11.568 3.068 1.00 . A B . 43 ARG HD2 1 1 9 7340 1 1 43 ARG HD3 H -7.365 11.768 1.362 1.00 . A B . 43 ARG HD3 1 1 9 7341 1 1 43 ARG HE H -9.567 12.649 2.799 1.00 . A B . 43 ARG HE 1 1 9 7342 1 1 43 ARG HG2 H -9.366 10.405 1.648 1.00 . A B . 43 ARG HG2 1 1 9 7343 1 1 43 ARG HG3 H -8.993 10.204 3.362 1.00 . A B . 43 ARG HG3 1 1 9 7344 1 1 43 ARG HH11 H -6.199 13.530 2.409 1.00 . A B . 43 ARG HH11 1 1 9 7345 1 1 43 ARG HH12 H -6.464 15.210 2.744 1.00 . A B . 43 ARG HH12 1 1 9 7346 1 1 43 ARG HH21 H -9.920 14.872 3.250 1.00 . A B . 43 ARG HH21 1 1 9 7347 1 1 43 ARG HH22 H -8.580 15.977 3.217 1.00 . A B . 43 ARG HH22 1 1 9 7348 1 1 43 ARG N N -9.650 7.828 1.386 1.00 . A B . 43 ARG N 1 1 9 7349 1 1 43 ARG NE N -8.603 12.802 2.676 1.00 . A B . 43 ARG NE 1 1 9 7350 1 1 43 ARG NH1 N -6.826 14.280 2.640 1.00 . A B . 43 ARG NH1 1 1 9 7351 1 1 43 ARG NH2 N -8.939 15.042 3.118 1.00 . A B . 43 ARG NH2 1 1 9 7352 1 1 43 ARG O O -8.560 8.199 4.495 1.00 . A B . 43 ARG O 1 1 9 7353 1 1 44 THR C C -8.057 4.546 5.454 1.00 . A B . 44 THR C 1 1 9 7354 1 1 44 THR CA C -9.132 5.566 5.088 1.00 . A B . 44 THR CA 1 1 9 7355 1 1 44 THR CB C -10.518 4.909 5.156 1.00 . A B . 44 THR CB 1 1 9 7356 1 1 44 THR CG2 C -11.613 5.963 5.099 1.00 . A B . 44 THR CG2 1 1 9 7357 1 1 44 THR H H -8.956 5.517 2.988 1.00 . A B . 44 THR H 1 1 9 7358 1 1 44 THR HA H -9.105 6.381 5.795 1.00 . A B . 44 THR HA 1 1 9 7359 1 1 44 THR HB H -10.602 4.368 6.089 1.00 . A B . 44 THR HB 1 1 9 7360 1 1 44 THR HG1 H -9.909 3.411 4.018 1.00 . A B . 44 THR HG1 1 1 9 7361 1 1 44 THR HG21 H -11.524 6.622 5.949 1.00 . A B . 44 THR HG21 1 1 9 7362 1 1 44 THR HG22 H -12.578 5.482 5.114 1.00 . A B . 44 THR HG22 1 1 9 7363 1 1 44 THR HG23 H -11.511 6.536 4.188 1.00 . A B . 44 THR HG23 1 1 9 7364 1 1 44 THR N N -8.896 6.112 3.768 1.00 . A B . 44 THR N 1 1 9 7365 1 1 44 THR O O -8.093 3.408 4.993 1.00 . A B . 44 THR O 1 1 9 7366 1 1 44 THR OG1 O -10.678 3.995 4.061 1.00 . A B . 44 THR OG1 1 1 9 7367 1 1 45 PRO C C -6.382 2.845 7.456 1.00 . A B . 45 PRO C 1 1 9 7368 1 1 45 PRO CA C -5.952 4.072 6.654 1.00 . A B . 45 PRO CA 1 1 9 7369 1 1 45 PRO CB C -5.049 4.979 7.503 1.00 . A B . 45 PRO CB 1 1 9 7370 1 1 45 PRO CD C -6.982 6.260 6.925 1.00 . A B . 45 PRO CD 1 1 9 7371 1 1 45 PRO CG C -5.513 6.369 7.225 1.00 . A B . 45 PRO CG 1 1 9 7372 1 1 45 PRO HA H -5.411 3.747 5.778 1.00 . A B . 45 PRO HA 1 1 9 7373 1 1 45 PRO HB2 H -5.162 4.725 8.547 1.00 . A B . 45 PRO HB2 1 1 9 7374 1 1 45 PRO HB3 H -4.018 4.842 7.205 1.00 . A B . 45 PRO HB3 1 1 9 7375 1 1 45 PRO HD2 H -7.560 6.295 7.839 1.00 . A B . 45 PRO HD2 1 1 9 7376 1 1 45 PRO HD3 H -7.292 7.043 6.245 1.00 . A B . 45 PRO HD3 1 1 9 7377 1 1 45 PRO HG2 H -5.350 6.993 8.092 1.00 . A B . 45 PRO HG2 1 1 9 7378 1 1 45 PRO HG3 H -4.986 6.767 6.371 1.00 . A B . 45 PRO HG3 1 1 9 7379 1 1 45 PRO N N -7.080 4.940 6.287 1.00 . A B . 45 PRO N 1 1 9 7380 1 1 45 PRO O O -5.700 1.822 7.450 1.00 . A B . 45 PRO O 1 1 9 7381 1 1 46 TRP C C -8.880 0.879 8.120 1.00 . A B . 46 TRP C 1 1 9 7382 1 1 46 TRP CA C -8.022 1.838 8.946 1.00 . A B . 46 TRP CA 1 1 9 7383 1 1 46 TRP CB C -8.822 2.369 10.148 1.00 . A B . 46 TRP CB 1 1 9 7384 1 1 46 TRP CD1 C -11.312 2.631 9.585 1.00 . A B . 46 TRP CD1 1 1 9 7385 1 1 46 TRP CD2 C -10.165 4.551 9.545 1.00 . A B . 46 TRP CD2 1 1 9 7386 1 1 46 TRP CE2 C -11.509 4.822 9.225 1.00 . A B . 46 TRP CE2 1 1 9 7387 1 1 46 TRP CE3 C -9.257 5.613 9.581 1.00 . A B . 46 TRP CE3 1 1 9 7388 1 1 46 TRP CG C -10.058 3.139 9.773 1.00 . A B . 46 TRP CG 1 1 9 7389 1 1 46 TRP CH2 C -11.055 7.125 8.986 1.00 . A B . 46 TRP CH2 1 1 9 7390 1 1 46 TRP CZ2 C -11.966 6.106 8.943 1.00 . A B . 46 TRP CZ2 1 1 9 7391 1 1 46 TRP CZ3 C -9.714 6.889 9.299 1.00 . A B . 46 TRP CZ3 1 1 9 7392 1 1 46 TRP H H -8.048 3.770 8.068 1.00 . A B . 46 TRP H 1 1 9 7393 1 1 46 TRP HA H -7.162 1.295 9.312 1.00 . A B . 46 TRP HA 1 1 9 7394 1 1 46 TRP HB2 H -9.129 1.536 10.762 1.00 . A B . 46 TRP HB2 1 1 9 7395 1 1 46 TRP HB3 H -8.188 3.022 10.733 1.00 . A B . 46 TRP HB3 1 1 9 7396 1 1 46 TRP HD1 H -11.565 1.586 9.685 1.00 . A B . 46 TRP HD1 1 1 9 7397 1 1 46 TRP HE1 H -13.144 3.519 9.072 1.00 . A B . 46 TRP HE1 1 1 9 7398 1 1 46 TRP HE3 H -8.217 5.451 9.822 1.00 . A B . 46 TRP HE3 1 1 9 7399 1 1 46 TRP HH2 H -11.363 8.137 8.771 1.00 . A B . 46 TRP HH2 1 1 9 7400 1 1 46 TRP HZ2 H -13.000 6.303 8.701 1.00 . A B . 46 TRP HZ2 1 1 9 7401 1 1 46 TRP HZ3 H -9.028 7.723 9.321 1.00 . A B . 46 TRP HZ3 1 1 9 7402 1 1 46 TRP N N -7.528 2.941 8.125 1.00 . A B . 46 TRP N 1 1 9 7403 1 1 46 TRP NE1 N -12.185 3.635 9.256 1.00 . A B . 46 TRP NE1 1 1 9 7404 1 1 46 TRP O O -9.477 -0.057 8.653 1.00 . A B . 46 TRP O 1 1 9 7405 1 1 47 ASN C C -8.843 -0.125 4.728 1.00 . A B . 47 ASN C 1 1 9 7406 1 1 47 ASN CA C -9.705 0.276 5.916 1.00 . A B . 47 ASN CA 1 1 9 7407 1 1 47 ASN CB C -10.958 1.021 5.432 1.00 . A B . 47 ASN CB 1 1 9 7408 1 1 47 ASN CG C -11.831 0.172 4.515 1.00 . A B . 47 ASN CG 1 1 9 7409 1 1 47 ASN H H -8.402 1.853 6.445 1.00 . A B . 47 ASN H 1 1 9 7410 1 1 47 ASN HA H -10.002 -0.612 6.455 1.00 . A B . 47 ASN HA 1 1 9 7411 1 1 47 ASN HB2 H -11.544 1.320 6.288 1.00 . A B . 47 ASN HB2 1 1 9 7412 1 1 47 ASN HB3 H -10.654 1.904 4.889 1.00 . A B . 47 ASN HB3 1 1 9 7413 1 1 47 ASN HD21 H -12.893 -0.493 6.063 1.00 . A B . 47 ASN HD21 1 1 9 7414 1 1 47 ASN HD22 H -13.366 -1.094 4.508 1.00 . A B . 47 ASN HD22 1 1 9 7415 1 1 47 ASN N N -8.925 1.111 6.818 1.00 . A B . 47 ASN N 1 1 9 7416 1 1 47 ASN ND2 N -12.791 -0.543 5.086 1.00 . A B . 47 ASN ND2 1 1 9 7417 1 1 47 ASN O O -8.092 0.693 4.199 1.00 . A B . 47 ASN O 1 1 9 7418 1 1 47 ASN OD1 O -11.645 0.162 3.300 1.00 . A B . 47 ASN OD1 1 1 9 7419 1 1 48 CYS C C -8.984 -1.791 1.927 1.00 . A B . 48 CYS C 1 1 9 7420 1 1 48 CYS CA C -8.139 -1.846 3.195 1.00 . A B . 48 CYS CA 1 1 9 7421 1 1 48 CYS CB C -7.648 -3.273 3.459 1.00 . A B . 48 CYS CB 1 1 9 7422 1 1 48 CYS H H -9.520 -2.004 4.788 1.00 . A B . 48 CYS H 1 1 9 7423 1 1 48 CYS HA H -7.288 -1.188 3.084 1.00 . A B . 48 CYS HA 1 1 9 7424 1 1 48 CYS HB2 H -7.117 -3.296 4.397 1.00 . A B . 48 CYS HB2 1 1 9 7425 1 1 48 CYS HB3 H -8.500 -3.935 3.518 1.00 . A B . 48 CYS HB3 1 1 9 7426 1 1 48 CYS N N -8.921 -1.381 4.325 1.00 . A B . 48 CYS N 1 1 9 7427 1 1 48 CYS O O -10.025 -2.445 1.836 1.00 . A B . 48 CYS O 1 1 9 7428 1 1 48 CYS SG S -6.536 -3.923 2.195 1.00 . A B . 48 CYS SG 1 1 9 7429 1 1 49 ILE C C -9.162 -2.062 -1.220 1.00 . A B . 49 ILE C 1 1 9 7430 1 1 49 ILE CA C -9.282 -0.856 -0.295 1.00 . A B . 49 ILE CA 1 1 9 7431 1 1 49 ILE CB C -8.876 0.429 -1.061 1.00 . A B . 49 ILE CB 1 1 9 7432 1 1 49 ILE CD1 C -6.934 1.603 -2.224 1.00 . A B . 49 ILE CD1 1 1 9 7433 1 1 49 ILE CG1 C -7.363 0.489 -1.290 1.00 . A B . 49 ILE CG1 1 1 9 7434 1 1 49 ILE CG2 C -9.349 1.668 -0.309 1.00 . A B . 49 ILE CG2 1 1 9 7435 1 1 49 ILE H H -7.645 -0.601 1.032 1.00 . A B . 49 ILE H 1 1 9 7436 1 1 49 ILE HA H -10.319 -0.755 -0.010 1.00 . A B . 49 ILE HA 1 1 9 7437 1 1 49 ILE HB H -9.372 0.412 -2.020 1.00 . A B . 49 ILE HB 1 1 9 7438 1 1 49 ILE HD11 H -7.264 2.552 -1.827 1.00 . A B . 49 ILE HD11 1 1 9 7439 1 1 49 ILE HD12 H -7.376 1.447 -3.197 1.00 . A B . 49 ILE HD12 1 1 9 7440 1 1 49 ILE HD13 H -5.858 1.606 -2.314 1.00 . A B . 49 ILE HD13 1 1 9 7441 1 1 49 ILE HG12 H -6.873 0.650 -0.343 1.00 . A B . 49 ILE HG12 1 1 9 7442 1 1 49 ILE HG13 H -7.029 -0.448 -1.711 1.00 . A B . 49 ILE HG13 1 1 9 7443 1 1 49 ILE HG21 H -8.919 1.677 0.681 1.00 . A B . 49 ILE HG21 1 1 9 7444 1 1 49 ILE HG22 H -10.426 1.658 -0.234 1.00 . A B . 49 ILE HG22 1 1 9 7445 1 1 49 ILE HG23 H -9.034 2.554 -0.843 1.00 . A B . 49 ILE HG23 1 1 9 7446 1 1 49 ILE N N -8.516 -1.044 0.934 1.00 . A B . 49 ILE N 1 1 9 7447 1 1 49 ILE O O -10.054 -2.334 -2.019 1.00 . A B . 49 ILE O 1 1 9 7448 1 1 50 PHE C C -8.684 -5.161 -1.407 1.00 . A B . 50 PHE C 1 1 9 7449 1 1 50 PHE CA C -7.866 -3.984 -1.923 1.00 . A B . 50 PHE CA 1 1 9 7450 1 1 50 PHE CB C -6.385 -4.342 -2.060 1.00 . A B . 50 PHE CB 1 1 9 7451 1 1 50 PHE CD1 C -5.304 -2.329 -3.098 1.00 . A B . 50 PHE CD1 1 1 9 7452 1 1 50 PHE CD2 C -5.530 -4.295 -4.425 1.00 . A B . 50 PHE CD2 1 1 9 7453 1 1 50 PHE CE1 C -4.691 -1.682 -4.156 1.00 . A B . 50 PHE CE1 1 1 9 7454 1 1 50 PHE CE2 C -4.917 -3.655 -5.485 1.00 . A B . 50 PHE CE2 1 1 9 7455 1 1 50 PHE CG C -5.732 -3.641 -3.222 1.00 . A B . 50 PHE CG 1 1 9 7456 1 1 50 PHE CZ C -4.555 -2.345 -5.382 1.00 . A B . 50 PHE CZ 1 1 9 7457 1 1 50 PHE H H -7.427 -2.586 -0.388 1.00 . A B . 50 PHE H 1 1 9 7458 1 1 50 PHE HA H -8.242 -3.735 -2.907 1.00 . A B . 50 PHE HA 1 1 9 7459 1 1 50 PHE HB2 H -5.859 -4.061 -1.157 1.00 . A B . 50 PHE HB2 1 1 9 7460 1 1 50 PHE HB3 H -6.289 -5.408 -2.215 1.00 . A B . 50 PHE HB3 1 1 9 7461 1 1 50 PHE HD1 H -5.454 -1.807 -2.165 1.00 . A B . 50 PHE HD1 1 1 9 7462 1 1 50 PHE HD2 H -5.861 -5.316 -4.534 1.00 . A B . 50 PHE HD2 1 1 9 7463 1 1 50 PHE HE1 H -4.363 -0.660 -4.047 1.00 . A B . 50 PHE HE1 1 1 9 7464 1 1 50 PHE HE2 H -4.767 -4.178 -6.418 1.00 . A B . 50 PHE HE2 1 1 9 7465 1 1 50 PHE HZ H -4.100 -1.841 -6.221 1.00 . A B . 50 PHE HZ 1 1 9 7466 1 1 50 PHE N N -8.070 -2.803 -1.093 1.00 . A B . 50 PHE N 1 1 9 7467 1 1 50 PHE O O -9.113 -6.012 -2.183 1.00 . A B . 50 PHE O 1 1 9 7468 1 1 51 CYS C C -11.156 -6.225 0.000 1.00 . A B . 51 CYS C 1 1 9 7469 1 1 51 CYS CA C -9.715 -6.257 0.511 1.00 . A B . 51 CYS CA 1 1 9 7470 1 1 51 CYS CB C -9.705 -6.138 2.034 1.00 . A B . 51 CYS CB 1 1 9 7471 1 1 51 CYS H H -8.545 -4.491 0.475 1.00 . A B . 51 CYS H 1 1 9 7472 1 1 51 CYS HA H -9.273 -7.203 0.231 1.00 . A B . 51 CYS HA 1 1 9 7473 1 1 51 CYS HB2 H -9.557 -5.105 2.303 1.00 . A B . 51 CYS HB2 1 1 9 7474 1 1 51 CYS HB3 H -10.658 -6.469 2.420 1.00 . A B . 51 CYS HB3 1 1 9 7475 1 1 51 CYS N N -8.911 -5.199 -0.094 1.00 . A B . 51 CYS N 1 1 9 7476 1 1 51 CYS O O -11.831 -7.252 -0.033 1.00 . A B . 51 CYS O 1 1 9 7477 1 1 51 CYS SG S -8.413 -7.106 2.848 1.00 . A B . 51 CYS SG 1 1 9 7478 1 1 52 ARG C C -12.908 -4.886 -2.476 1.00 . A B . 52 ARG C 1 1 9 7479 1 1 52 ARG CA C -12.968 -4.933 -0.954 1.00 . A B . 52 ARG CA 1 1 9 7480 1 1 52 ARG CB C -13.695 -3.694 -0.412 1.00 . A B . 52 ARG CB 1 1 9 7481 1 1 52 ARG CD C -14.009 -1.204 -0.504 1.00 . A B . 52 ARG CD 1 1 9 7482 1 1 52 ARG CG C -13.101 -2.368 -0.865 1.00 . A B . 52 ARG CG 1 1 9 7483 1 1 52 ARG CZ C -16.285 -0.413 -1.034 1.00 . A B . 52 ARG CZ 1 1 9 7484 1 1 52 ARG H H -11.066 -4.252 -0.316 1.00 . A B . 52 ARG H 1 1 9 7485 1 1 52 ARG HA H -13.515 -5.814 -0.661 1.00 . A B . 52 ARG HA 1 1 9 7486 1 1 52 ARG HB2 H -14.724 -3.729 -0.734 1.00 . A B . 52 ARG HB2 1 1 9 7487 1 1 52 ARG HB3 H -13.667 -3.724 0.667 1.00 . A B . 52 ARG HB3 1 1 9 7488 1 1 52 ARG HD2 H -14.136 -1.179 0.568 1.00 . A B . 52 ARG HD2 1 1 9 7489 1 1 52 ARG HD3 H -13.548 -0.286 -0.833 1.00 . A B . 52 ARG HD3 1 1 9 7490 1 1 52 ARG HE H -15.498 -2.142 -1.661 1.00 . A B . 52 ARG HE 1 1 9 7491 1 1 52 ARG HG2 H -12.145 -2.227 -0.384 1.00 . A B . 52 ARG HG2 1 1 9 7492 1 1 52 ARG HG3 H -12.968 -2.390 -1.936 1.00 . A B . 52 ARG HG3 1 1 9 7493 1 1 52 ARG HH11 H -15.188 0.864 0.094 1.00 . A B . 52 ARG HH11 1 1 9 7494 1 1 52 ARG HH12 H -16.800 1.393 -0.271 1.00 . A B . 52 ARG HH12 1 1 9 7495 1 1 52 ARG HH21 H -17.613 -1.455 -2.158 1.00 . A B . 52 ARG HH21 1 1 9 7496 1 1 52 ARG HH22 H -18.183 0.069 -1.555 1.00 . A B . 52 ARG HH22 1 1 9 7497 1 1 52 ARG N N -11.627 -5.051 -0.398 1.00 . A B . 52 ARG N 1 1 9 7498 1 1 52 ARG NE N -15.324 -1.326 -1.134 1.00 . A B . 52 ARG NE 1 1 9 7499 1 1 52 ARG NH1 N -16.075 0.703 -0.349 1.00 . A B . 52 ARG NH1 1 1 9 7500 1 1 52 ARG NH2 N -17.454 -0.614 -1.628 1.00 . A B . 52 ARG NH2 1 1 9 7501 1 1 52 ARG O O -13.927 -4.742 -3.150 1.00 . A B . 52 ARG O 1 1 9 7502 1 1 53 MET C C -11.521 -6.421 -5.010 1.00 . A B . 53 MET C 1 1 9 7503 1 1 53 MET CA C -11.490 -5.006 -4.447 1.00 . A B . 53 MET CA 1 1 9 7504 1 1 53 MET CB C -10.151 -4.336 -4.774 1.00 . A B . 53 MET CB 1 1 9 7505 1 1 53 MET CE C -11.354 -2.122 -6.579 1.00 . A B . 53 MET CE 1 1 9 7506 1 1 53 MET CG C -9.772 -4.380 -6.248 1.00 . A B . 53 MET CG 1 1 9 7507 1 1 53 MET H H -10.935 -5.148 -2.412 1.00 . A B . 53 MET H 1 1 9 7508 1 1 53 MET HA H -12.288 -4.436 -4.893 1.00 . A B . 53 MET HA 1 1 9 7509 1 1 53 MET HB2 H -10.197 -3.300 -4.471 1.00 . A B . 53 MET HB2 1 1 9 7510 1 1 53 MET HB3 H -9.372 -4.829 -4.211 1.00 . A B . 53 MET HB3 1 1 9 7511 1 1 53 MET HE1 H -11.682 -2.259 -5.559 1.00 . A B . 53 MET HE1 1 1 9 7512 1 1 53 MET HE2 H -12.118 -1.600 -7.135 1.00 . A B . 53 MET HE2 1 1 9 7513 1 1 53 MET HE3 H -10.441 -1.544 -6.590 1.00 . A B . 53 MET HE3 1 1 9 7514 1 1 53 MET HG2 H -8.872 -3.801 -6.391 1.00 . A B . 53 MET HG2 1 1 9 7515 1 1 53 MET HG3 H -9.582 -5.408 -6.524 1.00 . A B . 53 MET HG3 1 1 9 7516 1 1 53 MET N N -11.703 -5.026 -3.007 1.00 . A B . 53 MET N 1 1 9 7517 1 1 53 MET O O -12.134 -6.660 -6.055 1.00 . A B . 53 MET O 1 1 9 7518 1 1 53 MET SD S -11.056 -3.721 -7.329 1.00 . A B . 53 MET SD 1 1 9 7519 1 1 54 LYS C C -10.089 -8.819 -6.096 1.00 . A B . 54 LYS C 1 1 9 7520 1 1 54 LYS CA C -10.780 -8.736 -4.738 1.00 . A B . 54 LYS CA 1 1 9 7521 1 1 54 LYS CB C -12.162 -9.397 -4.795 1.00 . A B . 54 LYS CB 1 1 9 7522 1 1 54 LYS CD C -13.517 -11.463 -5.232 1.00 . A B . 54 LYS CD 1 1 9 7523 1 1 54 LYS CE C -13.480 -12.910 -5.686 1.00 . A B . 54 LYS CE 1 1 9 7524 1 1 54 LYS CG C -12.126 -10.859 -5.206 1.00 . A B . 54 LYS CG 1 1 9 7525 1 1 54 LYS H H -10.481 -7.094 -3.446 1.00 . A B . 54 LYS H 1 1 9 7526 1 1 54 LYS HA H -10.174 -9.258 -4.014 1.00 . A B . 54 LYS HA 1 1 9 7527 1 1 54 LYS HB2 H -12.623 -9.327 -3.821 1.00 . A B . 54 LYS HB2 1 1 9 7528 1 1 54 LYS HB3 H -12.771 -8.861 -5.507 1.00 . A B . 54 LYS HB3 1 1 9 7529 1 1 54 LYS HD2 H -13.938 -11.418 -4.240 1.00 . A B . 54 LYS HD2 1 1 9 7530 1 1 54 LYS HD3 H -14.132 -10.896 -5.914 1.00 . A B . 54 LYS HD3 1 1 9 7531 1 1 54 LYS HE2 H -12.866 -13.475 -5.000 1.00 . A B . 54 LYS HE2 1 1 9 7532 1 1 54 LYS HE3 H -14.485 -13.303 -5.676 1.00 . A B . 54 LYS HE3 1 1 9 7533 1 1 54 LYS HG2 H -11.695 -10.933 -6.193 1.00 . A B . 54 LYS HG2 1 1 9 7534 1 1 54 LYS HG3 H -11.517 -11.410 -4.502 1.00 . A B . 54 LYS HG3 1 1 9 7535 1 1 54 LYS HZ1 H -12.873 -14.042 -7.330 1.00 . A B . 54 LYS HZ1 1 1 9 7536 1 1 54 LYS HZ2 H -11.964 -12.639 -7.097 1.00 . A B . 54 LYS HZ2 1 1 9 7537 1 1 54 LYS HZ3 H -13.522 -12.538 -7.741 1.00 . A B . 54 LYS HZ3 1 1 9 7538 1 1 54 LYS N N -10.885 -7.349 -4.299 1.00 . A B . 54 LYS N 1 1 9 7539 1 1 54 LYS NZ N -12.921 -13.040 -7.057 1.00 . A B . 54 LYS NZ 1 1 9 7540 1 1 54 LYS O O -10.737 -8.784 -7.147 1.00 . A B . 54 LYS O 1 1 9 7541 1 1 55 GLU C C -6.876 -10.007 -7.148 1.00 . A B . 55 GLU C 1 1 9 7542 1 1 55 GLU CA C -7.984 -8.969 -7.283 1.00 . A B . 55 GLU CA 1 1 9 7543 1 1 55 GLU CB C -7.393 -7.591 -7.592 1.00 . A B . 55 GLU CB 1 1 9 7544 1 1 55 GLU CD C -7.458 -7.925 -10.094 1.00 . A B . 55 GLU CD 1 1 9 7545 1 1 55 GLU CG C -6.617 -7.532 -8.898 1.00 . A B . 55 GLU CG 1 1 9 7546 1 1 55 GLU H H -8.313 -8.974 -5.198 1.00 . A B . 55 GLU H 1 1 9 7547 1 1 55 GLU HA H -8.639 -9.259 -8.089 1.00 . A B . 55 GLU HA 1 1 9 7548 1 1 55 GLU HB2 H -8.199 -6.874 -7.649 1.00 . A B . 55 GLU HB2 1 1 9 7549 1 1 55 GLU HB3 H -6.729 -7.310 -6.790 1.00 . A B . 55 GLU HB3 1 1 9 7550 1 1 55 GLU HG2 H -6.261 -6.522 -9.045 1.00 . A B . 55 GLU HG2 1 1 9 7551 1 1 55 GLU HG3 H -5.773 -8.204 -8.832 1.00 . A B . 55 GLU HG3 1 1 9 7552 1 1 55 GLU N N -8.771 -8.918 -6.066 1.00 . A B . 55 GLU N 1 1 9 7553 1 1 55 GLU O O -6.017 -9.906 -6.271 1.00 . A B . 55 GLU O 1 1 9 7554 1 1 55 GLU OE1 O -8.374 -7.160 -10.461 1.00 . A B . 55 GLU OE1 1 1 9 7555 1 1 55 GLU OE2 O -7.205 -8.999 -10.679 1.00 . A B . 55 GLU OE2 1 1 9 7556 1 1 56 SER C C -5.833 -12.654 -9.412 1.00 . A B . 56 SER C 1 1 9 7557 1 1 56 SER CA C -5.925 -12.061 -8.010 1.00 . A B . 56 SER CA 1 1 9 7558 1 1 56 SER CB C -6.278 -13.143 -6.982 1.00 . A B . 56 SER CB 1 1 9 7559 1 1 56 SER H H -7.660 -11.055 -8.646 1.00 . A B . 56 SER H 1 1 9 7560 1 1 56 SER HA H -4.974 -11.620 -7.753 1.00 . A B . 56 SER HA 1 1 9 7561 1 1 56 SER HB2 H -6.436 -12.679 -6.021 1.00 . A B . 56 SER HB2 1 1 9 7562 1 1 56 SER HB3 H -7.181 -13.646 -7.290 1.00 . A B . 56 SER HB3 1 1 9 7563 1 1 56 SER HG H -5.599 -14.980 -7.022 1.00 . A B . 56 SER HG 1 1 9 7564 1 1 56 SER N N -6.924 -11.013 -7.999 1.00 . A B . 56 SER N 1 1 9 7565 1 1 56 SER O O -4.853 -12.351 -10.124 1.00 . A B . 56 SER O 1 1 9 7566 1 1 56 SER OXT O -6.764 -13.383 -9.812 1.00 . A B . 56 SER OXT 1 1 9 7567 1 1 56 SER OG O -5.240 -14.101 -6.857 1.00 . A B . 56 SER OG 1 1 9 7568 2 2 1 ZN ZN ZN -6.341 -6.199 2.436 1.00 . B B . 101 ZN ZN 1 1 9 7569 3 2 1 ZN ZN ZN 5.715 0.866 0.272 1.00 . C B . 102 ZN ZN 1 1 10 7570 1 1 1 GLY C C 3.275 -11.625 10.560 1.00 . A B . 1 GLY C 1 1 10 7571 1 1 1 GLY CA C 2.916 -11.922 11.998 1.00 . A B . 1 GLY CA 1 1 10 7572 1 1 1 GLY H1 H 4.531 -13.174 12.393 1.00 . A B . 1 GLY H1 1 1 10 7573 1 1 1 GLY H2 H 3.821 -12.519 13.777 1.00 . A B . 1 GLY H2 1 1 10 7574 1 1 1 GLY H3 H 4.806 -11.557 12.794 1.00 . A B . 1 GLY H3 1 1 10 7575 1 1 1 GLY HA2 H 2.194 -12.722 12.018 1.00 . A B . 1 GLY HA2 1 1 10 7576 1 1 1 GLY HA3 H 2.476 -11.040 12.439 1.00 . A B . 1 GLY HA3 1 1 10 7577 1 1 1 GLY N N 4.100 -12.321 12.797 1.00 . A B . 1 GLY N 1 1 10 7578 1 1 1 GLY O O 3.648 -12.528 9.808 1.00 . A B . 1 GLY O 1 1 10 7579 1 1 2 ALA C C 4.301 -8.676 8.792 1.00 . A B . 2 ALA C 1 1 10 7580 1 1 2 ALA CA C 3.480 -9.960 8.810 1.00 . A B . 2 ALA CA 1 1 10 7581 1 1 2 ALA CB C 2.188 -9.783 8.024 1.00 . A B . 2 ALA CB 1 1 10 7582 1 1 2 ALA H H 2.894 -9.681 10.824 1.00 . A B . 2 ALA H 1 1 10 7583 1 1 2 ALA HA H 4.052 -10.751 8.347 1.00 . A B . 2 ALA HA 1 1 10 7584 1 1 2 ALA HB1 H 1.581 -9.022 8.493 1.00 . A B . 2 ALA HB1 1 1 10 7585 1 1 2 ALA HB2 H 1.645 -10.717 8.006 1.00 . A B . 2 ALA HB2 1 1 10 7586 1 1 2 ALA HB3 H 2.421 -9.484 7.017 1.00 . A B . 2 ALA HB3 1 1 10 7587 1 1 2 ALA N N 3.179 -10.363 10.175 1.00 . A B . 2 ALA N 1 1 10 7588 1 1 2 ALA O O 4.386 -7.993 7.771 1.00 . A B . 2 ALA O 1 1 10 7589 1 1 3 MET C C 7.162 -7.376 9.779 1.00 . A B . 3 MET C 1 1 10 7590 1 1 3 MET CA C 5.681 -7.122 10.052 1.00 . A B . 3 MET CA 1 1 10 7591 1 1 3 MET CB C 5.493 -6.529 11.456 1.00 . A B . 3 MET CB 1 1 10 7592 1 1 3 MET CE C 6.069 -2.409 11.067 1.00 . A B . 3 MET CE 1 1 10 7593 1 1 3 MET CG C 6.059 -5.124 11.624 1.00 . A B . 3 MET CG 1 1 10 7594 1 1 3 MET H H 4.864 -8.973 10.687 1.00 . A B . 3 MET H 1 1 10 7595 1 1 3 MET HA H 5.307 -6.423 9.320 1.00 . A B . 3 MET HA 1 1 10 7596 1 1 3 MET HB2 H 4.436 -6.493 11.678 1.00 . A B . 3 MET HB2 1 1 10 7597 1 1 3 MET HB3 H 5.977 -7.176 12.173 1.00 . A B . 3 MET HB3 1 1 10 7598 1 1 3 MET HE1 H 7.087 -2.532 10.728 1.00 . A B . 3 MET HE1 1 1 10 7599 1 1 3 MET HE2 H 6.063 -2.238 12.133 1.00 . A B . 3 MET HE2 1 1 10 7600 1 1 3 MET HE3 H 5.621 -1.563 10.565 1.00 . A B . 3 MET HE3 1 1 10 7601 1 1 3 MET HG2 H 6.032 -4.859 12.671 1.00 . A B . 3 MET HG2 1 1 10 7602 1 1 3 MET HG3 H 7.083 -5.119 11.280 1.00 . A B . 3 MET HG3 1 1 10 7603 1 1 3 MET N N 4.917 -8.359 9.922 1.00 . A B . 3 MET N 1 1 10 7604 1 1 3 MET O O 7.958 -6.442 9.660 1.00 . A B . 3 MET O 1 1 10 7605 1 1 3 MET SD S 5.133 -3.889 10.694 1.00 . A B . 3 MET SD 1 1 10 7606 1 1 4 GLY C C 9.403 -8.776 8.060 1.00 . A B . 4 GLY C 1 1 10 7607 1 1 4 GLY CA C 8.916 -9.004 9.475 1.00 . A B . 4 GLY CA 1 1 10 7608 1 1 4 GLY H H 6.832 -9.344 9.654 1.00 . A B . 4 GLY H 1 1 10 7609 1 1 4 GLY HA2 H 9.514 -8.408 10.150 1.00 . A B . 4 GLY HA2 1 1 10 7610 1 1 4 GLY HA3 H 9.044 -10.046 9.724 1.00 . A B . 4 GLY HA3 1 1 10 7611 1 1 4 GLY N N 7.522 -8.645 9.648 1.00 . A B . 4 GLY N 1 1 10 7612 1 1 4 GLY O O 10.376 -8.056 7.840 1.00 . A B . 4 GLY O 1 1 10 7613 1 1 5 MET C C 8.250 -8.214 4.998 1.00 . A B . 5 MET C 1 1 10 7614 1 1 5 MET CA C 9.111 -9.255 5.702 1.00 . A B . 5 MET CA 1 1 10 7615 1 1 5 MET CB C 9.016 -10.606 4.983 1.00 . A B . 5 MET CB 1 1 10 7616 1 1 5 MET CE C 12.073 -11.053 4.068 1.00 . A B . 5 MET CE 1 1 10 7617 1 1 5 MET CG C 9.401 -10.544 3.509 1.00 . A B . 5 MET CG 1 1 10 7618 1 1 5 MET H H 7.935 -9.915 7.332 1.00 . A B . 5 MET H 1 1 10 7619 1 1 5 MET HA H 10.138 -8.920 5.680 1.00 . A B . 5 MET HA 1 1 10 7620 1 1 5 MET HB2 H 9.673 -11.309 5.475 1.00 . A B . 5 MET HB2 1 1 10 7621 1 1 5 MET HB3 H 8.001 -10.966 5.052 1.00 . A B . 5 MET HB3 1 1 10 7622 1 1 5 MET HE1 H 11.813 -11.090 5.116 1.00 . A B . 5 MET HE1 1 1 10 7623 1 1 5 MET HE2 H 13.110 -10.774 3.965 1.00 . A B . 5 MET HE2 1 1 10 7624 1 1 5 MET HE3 H 11.916 -12.024 3.626 1.00 . A B . 5 MET HE3 1 1 10 7625 1 1 5 MET HG2 H 9.382 -11.544 3.104 1.00 . A B . 5 MET HG2 1 1 10 7626 1 1 5 MET HG3 H 8.677 -9.934 2.988 1.00 . A B . 5 MET HG3 1 1 10 7627 1 1 5 MET N N 8.723 -9.380 7.098 1.00 . A B . 5 MET N 1 1 10 7628 1 1 5 MET O O 7.249 -8.537 4.356 1.00 . A B . 5 MET O 1 1 10 7629 1 1 5 MET SD S 11.043 -9.846 3.239 1.00 . A B . 5 MET SD 1 1 10 7630 1 1 6 ARG C C 8.913 -5.255 3.438 1.00 . A B . 6 ARG C 1 1 10 7631 1 1 6 ARG CA C 7.977 -5.862 4.470 1.00 . A B . 6 ARG CA 1 1 10 7632 1 1 6 ARG CB C 7.542 -4.798 5.480 1.00 . A B . 6 ARG CB 1 1 10 7633 1 1 6 ARG CD C 6.190 -4.255 7.534 1.00 . A B . 6 ARG CD 1 1 10 7634 1 1 6 ARG CG C 6.475 -5.282 6.449 1.00 . A B . 6 ARG CG 1 1 10 7635 1 1 6 ARG CZ C 4.632 -2.362 7.221 1.00 . A B . 6 ARG CZ 1 1 10 7636 1 1 6 ARG H H 9.415 -6.772 5.717 1.00 . A B . 6 ARG H 1 1 10 7637 1 1 6 ARG HA H 7.107 -6.254 3.966 1.00 . A B . 6 ARG HA 1 1 10 7638 1 1 6 ARG HB2 H 8.404 -4.486 6.052 1.00 . A B . 6 ARG HB2 1 1 10 7639 1 1 6 ARG HB3 H 7.152 -3.947 4.942 1.00 . A B . 6 ARG HB3 1 1 10 7640 1 1 6 ARG HD2 H 5.390 -4.623 8.158 1.00 . A B . 6 ARG HD2 1 1 10 7641 1 1 6 ARG HD3 H 7.079 -4.128 8.134 1.00 . A B . 6 ARG HD3 1 1 10 7642 1 1 6 ARG HE H 6.467 -2.487 6.434 1.00 . A B . 6 ARG HE 1 1 10 7643 1 1 6 ARG HG2 H 5.565 -5.470 5.900 1.00 . A B . 6 ARG HG2 1 1 10 7644 1 1 6 ARG HG3 H 6.814 -6.198 6.912 1.00 . A B . 6 ARG HG3 1 1 10 7645 1 1 6 ARG HH11 H 3.855 -3.898 8.299 1.00 . A B . 6 ARG HH11 1 1 10 7646 1 1 6 ARG HH12 H 2.816 -2.520 8.111 1.00 . A B . 6 ARG HH12 1 1 10 7647 1 1 6 ARG HH21 H 5.097 -0.675 6.195 1.00 . A B . 6 ARG HH21 1 1 10 7648 1 1 6 ARG HH22 H 3.518 -0.698 6.916 1.00 . A B . 6 ARG HH22 1 1 10 7649 1 1 6 ARG N N 8.644 -6.963 5.142 1.00 . A B . 6 ARG N 1 1 10 7650 1 1 6 ARG NE N 5.802 -2.956 6.986 1.00 . A B . 6 ARG NE 1 1 10 7651 1 1 6 ARG NH1 N 3.693 -2.977 7.932 1.00 . A B . 6 ARG NH1 1 1 10 7652 1 1 6 ARG NH2 N 4.397 -1.151 6.737 1.00 . A B . 6 ARG NH2 1 1 10 7653 1 1 6 ARG O O 9.598 -4.271 3.711 1.00 . A B . 6 ARG O 1 1 10 7654 1 1 7 ASN C C 9.374 -4.070 0.653 1.00 . A B . 7 ASN C 1 1 10 7655 1 1 7 ASN CA C 9.842 -5.414 1.199 1.00 . A B . 7 ASN CA 1 1 10 7656 1 1 7 ASN CB C 9.910 -6.454 0.073 1.00 . A B . 7 ASN CB 1 1 10 7657 1 1 7 ASN CG C 11.001 -6.148 -0.939 1.00 . A B . 7 ASN CG 1 1 10 7658 1 1 7 ASN H H 8.376 -6.639 2.110 1.00 . A B . 7 ASN H 1 1 10 7659 1 1 7 ASN HA H 10.827 -5.291 1.621 1.00 . A B . 7 ASN HA 1 1 10 7660 1 1 7 ASN HB2 H 10.109 -7.426 0.503 1.00 . A B . 7 ASN HB2 1 1 10 7661 1 1 7 ASN HB3 H 8.962 -6.479 -0.441 1.00 . A B . 7 ASN HB3 1 1 10 7662 1 1 7 ASN HD21 H 9.730 -5.135 -2.088 1.00 . A B . 7 ASN HD21 1 1 10 7663 1 1 7 ASN HD22 H 11.364 -5.220 -2.658 1.00 . A B . 7 ASN HD22 1 1 10 7664 1 1 7 ASN N N 8.956 -5.866 2.265 1.00 . A B . 7 ASN N 1 1 10 7665 1 1 7 ASN ND2 N 10.663 -5.433 -2.002 1.00 . A B . 7 ASN ND2 1 1 10 7666 1 1 7 ASN O O 8.482 -4.002 -0.190 1.00 . A B . 7 ASN O 1 1 10 7667 1 1 7 ASN OD1 O 12.147 -6.561 -0.769 1.00 . A B . 7 ASN OD1 1 1 10 7668 1 1 8 LEU C C 10.854 -0.895 0.304 1.00 . A B . 8 LEU C 1 1 10 7669 1 1 8 LEU CA C 9.617 -1.652 0.770 1.00 . A B . 8 LEU CA 1 1 10 7670 1 1 8 LEU CB C 8.921 -0.935 1.940 1.00 . A B . 8 LEU CB 1 1 10 7671 1 1 8 LEU CD1 C 10.798 -0.230 3.474 1.00 . A B . 8 LEU CD1 1 1 10 7672 1 1 8 LEU CD2 C 8.561 -0.826 4.421 1.00 . A B . 8 LEU CD2 1 1 10 7673 1 1 8 LEU CG C 9.570 -1.114 3.319 1.00 . A B . 8 LEU CG 1 1 10 7674 1 1 8 LEU H H 10.674 -3.138 1.837 1.00 . A B . 8 LEU H 1 1 10 7675 1 1 8 LEU HA H 8.931 -1.724 -0.058 1.00 . A B . 8 LEU HA 1 1 10 7676 1 1 8 LEU HB2 H 8.890 0.121 1.720 1.00 . A B . 8 LEU HB2 1 1 10 7677 1 1 8 LEU HB3 H 7.906 -1.299 2.001 1.00 . A B . 8 LEU HB3 1 1 10 7678 1 1 8 LEU HD11 H 10.511 0.806 3.371 1.00 . A B . 8 LEU HD11 1 1 10 7679 1 1 8 LEU HD12 H 11.520 -0.482 2.711 1.00 . A B . 8 LEU HD12 1 1 10 7680 1 1 8 LEU HD13 H 11.234 -0.387 4.449 1.00 . A B . 8 LEU HD13 1 1 10 7681 1 1 8 LEU HD21 H 9.031 -0.963 5.384 1.00 . A B . 8 LEU HD21 1 1 10 7682 1 1 8 LEU HD22 H 7.725 -1.502 4.330 1.00 . A B . 8 LEU HD22 1 1 10 7683 1 1 8 LEU HD23 H 8.211 0.192 4.332 1.00 . A B . 8 LEU HD23 1 1 10 7684 1 1 8 LEU HG H 9.889 -2.141 3.423 1.00 . A B . 8 LEU HG 1 1 10 7685 1 1 8 LEU N N 9.971 -3.008 1.164 1.00 . A B . 8 LEU N 1 1 10 7686 1 1 8 LEU O O 10.883 0.336 0.278 1.00 . A B . 8 LEU O 1 1 10 7687 1 1 9 ASP C C 13.102 -0.461 -1.853 1.00 . A B . 9 ASP C 1 1 10 7688 1 1 9 ASP CA C 13.154 -1.097 -0.465 1.00 . A B . 9 ASP CA 1 1 10 7689 1 1 9 ASP CB C 14.225 -2.189 -0.410 1.00 . A B . 9 ASP CB 1 1 10 7690 1 1 9 ASP CG C 15.608 -1.678 -0.757 1.00 . A B . 9 ASP CG 1 1 10 7691 1 1 9 ASP H H 11.724 -2.622 -0.144 1.00 . A B . 9 ASP H 1 1 10 7692 1 1 9 ASP HA H 13.400 -0.333 0.254 1.00 . A B . 9 ASP HA 1 1 10 7693 1 1 9 ASP HB2 H 14.258 -2.598 0.589 1.00 . A B . 9 ASP HB2 1 1 10 7694 1 1 9 ASP HB3 H 13.966 -2.973 -1.104 1.00 . A B . 9 ASP HB3 1 1 10 7695 1 1 9 ASP N N 11.861 -1.656 -0.093 1.00 . A B . 9 ASP N 1 1 10 7696 1 1 9 ASP O O 13.709 0.584 -2.091 1.00 . A B . 9 ASP O 1 1 10 7697 1 1 9 ASP OD1 O 16.198 -0.943 0.061 1.00 . A B . 9 ASP OD1 1 1 10 7698 1 1 9 ASP OD2 O 16.104 -1.991 -1.859 1.00 . A B . 9 ASP OD2 1 1 10 7699 1 1 10 GLU C C 11.000 0.378 -4.194 1.00 . A B . 10 GLU C 1 1 10 7700 1 1 10 GLU CA C 12.199 -0.560 -4.116 1.00 . A B . 10 GLU CA 1 1 10 7701 1 1 10 GLU CB C 12.032 -1.702 -5.119 1.00 . A B . 10 GLU CB 1 1 10 7702 1 1 10 GLU CD C 14.314 -1.789 -6.188 1.00 . A B . 10 GLU CD 1 1 10 7703 1 1 10 GLU CG C 13.295 -2.514 -5.333 1.00 . A B . 10 GLU CG 1 1 10 7704 1 1 10 GLU H H 11.930 -1.931 -2.516 1.00 . A B . 10 GLU H 1 1 10 7705 1 1 10 GLU HA H 13.089 -0.004 -4.363 1.00 . A B . 10 GLU HA 1 1 10 7706 1 1 10 GLU HB2 H 11.255 -2.364 -4.770 1.00 . A B . 10 GLU HB2 1 1 10 7707 1 1 10 GLU HB3 H 11.734 -1.285 -6.069 1.00 . A B . 10 GLU HB3 1 1 10 7708 1 1 10 GLU HG2 H 13.738 -2.720 -4.370 1.00 . A B . 10 GLU HG2 1 1 10 7709 1 1 10 GLU HG3 H 13.034 -3.443 -5.816 1.00 . A B . 10 GLU HG3 1 1 10 7710 1 1 10 GLU N N 12.364 -1.087 -2.761 1.00 . A B . 10 GLU N 1 1 10 7711 1 1 10 GLU O O 10.582 0.794 -5.278 1.00 . A B . 10 GLU O 1 1 10 7712 1 1 10 GLU OE1 O 14.241 -1.907 -7.429 1.00 . A B . 10 GLU OE1 1 1 10 7713 1 1 10 GLU OE2 O 15.193 -1.098 -5.631 1.00 . A B . 10 GLU OE2 1 1 10 7714 1 1 11 CYS C C 9.726 2.982 -2.558 1.00 . A B . 11 CYS C 1 1 10 7715 1 1 11 CYS CA C 9.307 1.572 -2.942 1.00 . A B . 11 CYS CA 1 1 10 7716 1 1 11 CYS CB C 8.349 0.989 -1.911 1.00 . A B . 11 CYS CB 1 1 10 7717 1 1 11 CYS H H 10.910 0.419 -2.213 1.00 . A B . 11 CYS H 1 1 10 7718 1 1 11 CYS HA H 8.826 1.594 -3.907 1.00 . A B . 11 CYS HA 1 1 10 7719 1 1 11 CYS HB2 H 8.090 -0.013 -2.210 1.00 . A B . 11 CYS HB2 1 1 10 7720 1 1 11 CYS HB3 H 8.853 0.949 -0.958 1.00 . A B . 11 CYS HB3 1 1 10 7721 1 1 11 CYS N N 10.477 0.724 -3.035 1.00 . A B . 11 CYS N 1 1 10 7722 1 1 11 CYS O O 9.894 3.299 -1.376 1.00 . A B . 11 CYS O 1 1 10 7723 1 1 11 CYS SG S 6.807 1.899 -1.677 1.00 . A B . 11 CYS SG 1 1 10 7724 1 1 12 GLU C C 9.386 5.961 -2.497 1.00 . A B . 12 GLU C 1 1 10 7725 1 1 12 GLU CA C 10.364 5.186 -3.362 1.00 . A B . 12 GLU CA 1 1 10 7726 1 1 12 GLU CB C 10.545 5.883 -4.708 1.00 . A B . 12 GLU CB 1 1 10 7727 1 1 12 GLU CD C 12.955 5.203 -5.122 1.00 . A B . 12 GLU CD 1 1 10 7728 1 1 12 GLU CG C 11.525 5.175 -5.632 1.00 . A B . 12 GLU CG 1 1 10 7729 1 1 12 GLU H H 9.726 3.513 -4.479 1.00 . A B . 12 GLU H 1 1 10 7730 1 1 12 GLU HA H 11.315 5.144 -2.859 1.00 . A B . 12 GLU HA 1 1 10 7731 1 1 12 GLU HB2 H 9.585 5.935 -5.202 1.00 . A B . 12 GLU HB2 1 1 10 7732 1 1 12 GLU HB3 H 10.905 6.886 -4.535 1.00 . A B . 12 GLU HB3 1 1 10 7733 1 1 12 GLU HG2 H 11.220 4.144 -5.731 1.00 . A B . 12 GLU HG2 1 1 10 7734 1 1 12 GLU HG3 H 11.494 5.652 -6.600 1.00 . A B . 12 GLU HG3 1 1 10 7735 1 1 12 GLU N N 9.905 3.821 -3.565 1.00 . A B . 12 GLU N 1 1 10 7736 1 1 12 GLU O O 9.784 6.782 -1.672 1.00 . A B . 12 GLU O 1 1 10 7737 1 1 12 GLU OE1 O 13.239 4.545 -4.097 1.00 . A B . 12 GLU OE1 1 1 10 7738 1 1 12 GLU OE2 O 13.805 5.880 -5.733 1.00 . A B . 12 GLU OE2 1 1 10 7739 1 1 13 VAL C C 7.138 6.065 -0.427 1.00 . A B . 13 VAL C 1 1 10 7740 1 1 13 VAL CA C 7.078 6.380 -1.925 1.00 . A B . 13 VAL CA 1 1 10 7741 1 1 13 VAL CB C 5.669 6.103 -2.500 1.00 . A B . 13 VAL CB 1 1 10 7742 1 1 13 VAL CG1 C 5.376 4.620 -2.564 1.00 . A B . 13 VAL CG1 1 1 10 7743 1 1 13 VAL CG2 C 4.604 6.817 -1.692 1.00 . A B . 13 VAL CG2 1 1 10 7744 1 1 13 VAL H H 7.848 4.955 -3.277 1.00 . A B . 13 VAL H 1 1 10 7745 1 1 13 VAL HA H 7.281 7.432 -2.050 1.00 . A B . 13 VAL HA 1 1 10 7746 1 1 13 VAL HB H 5.641 6.488 -3.506 1.00 . A B . 13 VAL HB 1 1 10 7747 1 1 13 VAL HG11 H 5.394 4.207 -1.568 1.00 . A B . 13 VAL HG11 1 1 10 7748 1 1 13 VAL HG12 H 6.121 4.130 -3.174 1.00 . A B . 13 VAL HG12 1 1 10 7749 1 1 13 VAL HG13 H 4.400 4.466 -2.998 1.00 . A B . 13 VAL HG13 1 1 10 7750 1 1 13 VAL HG21 H 3.649 6.712 -2.184 1.00 . A B . 13 VAL HG21 1 1 10 7751 1 1 13 VAL HG22 H 4.856 7.863 -1.605 1.00 . A B . 13 VAL HG22 1 1 10 7752 1 1 13 VAL HG23 H 4.552 6.373 -0.710 1.00 . A B . 13 VAL HG23 1 1 10 7753 1 1 13 VAL N N 8.107 5.667 -2.655 1.00 . A B . 13 VAL N 1 1 10 7754 1 1 13 VAL O O 6.834 6.920 0.401 1.00 . A B . 13 VAL O 1 1 10 7755 1 1 14 CYS C C 8.895 5.378 1.913 1.00 . A B . 14 CYS C 1 1 10 7756 1 1 14 CYS CA C 7.782 4.520 1.338 1.00 . A B . 14 CYS CA 1 1 10 7757 1 1 14 CYS CB C 8.135 3.044 1.514 1.00 . A B . 14 CYS CB 1 1 10 7758 1 1 14 CYS H H 7.747 4.182 -0.764 1.00 . A B . 14 CYS H 1 1 10 7759 1 1 14 CYS HA H 6.868 4.730 1.870 1.00 . A B . 14 CYS HA 1 1 10 7760 1 1 14 CYS HB2 H 8.500 2.656 0.576 1.00 . A B . 14 CYS HB2 1 1 10 7761 1 1 14 CYS HB3 H 8.912 2.958 2.258 1.00 . A B . 14 CYS HB3 1 1 10 7762 1 1 14 CYS N N 7.568 4.855 -0.070 1.00 . A B . 14 CYS N 1 1 10 7763 1 1 14 CYS O O 8.856 5.785 3.073 1.00 . A B . 14 CYS O 1 1 10 7764 1 1 14 CYS SG S 6.752 2.009 2.037 1.00 . A B . 14 CYS SG 1 1 10 7765 1 1 15 ARG C C 10.584 7.930 1.626 1.00 . A B . 15 ARG C 1 1 10 7766 1 1 15 ARG CA C 11.012 6.477 1.466 1.00 . A B . 15 ARG CA 1 1 10 7767 1 1 15 ARG CB C 12.118 6.363 0.424 1.00 . A B . 15 ARG CB 1 1 10 7768 1 1 15 ARG CD C 13.522 4.848 -0.999 1.00 . A B . 15 ARG CD 1 1 10 7769 1 1 15 ARG CG C 12.533 4.928 0.148 1.00 . A B . 15 ARG CG 1 1 10 7770 1 1 15 ARG CZ C 15.709 5.818 -1.588 1.00 . A B . 15 ARG CZ 1 1 10 7771 1 1 15 ARG H H 9.821 5.315 0.155 1.00 . A B . 15 ARG H 1 1 10 7772 1 1 15 ARG HA H 11.374 6.111 2.412 1.00 . A B . 15 ARG HA 1 1 10 7773 1 1 15 ARG HB2 H 11.771 6.801 -0.501 1.00 . A B . 15 ARG HB2 1 1 10 7774 1 1 15 ARG HB3 H 12.983 6.907 0.769 1.00 . A B . 15 ARG HB3 1 1 10 7775 1 1 15 ARG HD2 H 13.714 3.808 -1.220 1.00 . A B . 15 ARG HD2 1 1 10 7776 1 1 15 ARG HD3 H 13.087 5.325 -1.864 1.00 . A B . 15 ARG HD3 1 1 10 7777 1 1 15 ARG HE H 14.958 5.715 0.264 1.00 . A B . 15 ARG HE 1 1 10 7778 1 1 15 ARG HG2 H 12.994 4.519 1.035 1.00 . A B . 15 ARG HG2 1 1 10 7779 1 1 15 ARG HG3 H 11.655 4.352 -0.100 1.00 . A B . 15 ARG HG3 1 1 10 7780 1 1 15 ARG HH11 H 14.609 5.190 -3.183 1.00 . A B . 15 ARG HH11 1 1 10 7781 1 1 15 ARG HH12 H 16.182 5.831 -3.559 1.00 . A B . 15 ARG HH12 1 1 10 7782 1 1 15 ARG HH21 H 17.017 6.563 -0.232 1.00 . A B . 15 ARG HH21 1 1 10 7783 1 1 15 ARG HH22 H 17.553 6.600 -1.882 1.00 . A B . 15 ARG HH22 1 1 10 7784 1 1 15 ARG N N 9.876 5.662 1.074 1.00 . A B . 15 ARG N 1 1 10 7785 1 1 15 ARG NE N 14.784 5.506 -0.682 1.00 . A B . 15 ARG NE 1 1 10 7786 1 1 15 ARG NH1 N 15.484 5.596 -2.879 1.00 . A B . 15 ARG NH1 1 1 10 7787 1 1 15 ARG NH2 N 16.850 6.374 -1.205 1.00 . A B . 15 ARG NH2 1 1 10 7788 1 1 15 ARG O O 11.070 8.641 2.505 1.00 . A B . 15 ARG O 1 1 10 7789 1 1 16 ASP C C 8.081 9.816 1.987 1.00 . A B . 16 ASP C 1 1 10 7790 1 1 16 ASP CA C 9.093 9.704 0.849 1.00 . A B . 16 ASP CA 1 1 10 7791 1 1 16 ASP CB C 8.418 10.091 -0.472 1.00 . A B . 16 ASP CB 1 1 10 7792 1 1 16 ASP CG C 9.408 10.442 -1.566 1.00 . A B . 16 ASP CG 1 1 10 7793 1 1 16 ASP H H 9.392 7.765 0.034 1.00 . A B . 16 ASP H 1 1 10 7794 1 1 16 ASP HA H 9.903 10.390 1.040 1.00 . A B . 16 ASP HA 1 1 10 7795 1 1 16 ASP HB2 H 7.817 9.262 -0.813 1.00 . A B . 16 ASP HB2 1 1 10 7796 1 1 16 ASP HB3 H 7.778 10.945 -0.302 1.00 . A B . 16 ASP HB3 1 1 10 7797 1 1 16 ASP N N 9.665 8.359 0.769 1.00 . A B . 16 ASP N 1 1 10 7798 1 1 16 ASP O O 7.430 10.848 2.149 1.00 . A B . 16 ASP O 1 1 10 7799 1 1 16 ASP OD1 O 9.944 11.568 -1.555 1.00 . A B . 16 ASP OD1 1 1 10 7800 1 1 16 ASP OD2 O 9.667 9.585 -2.436 1.00 . A B . 16 ASP OD2 1 1 10 7801 1 1 17 GLY C C 5.599 8.575 3.539 1.00 . A B . 17 GLY C 1 1 10 7802 1 1 17 GLY CA C 7.054 8.775 3.914 1.00 . A B . 17 GLY CA 1 1 10 7803 1 1 17 GLY H H 8.444 7.934 2.553 1.00 . A B . 17 GLY H 1 1 10 7804 1 1 17 GLY HA2 H 7.348 7.991 4.597 1.00 . A B . 17 GLY HA2 1 1 10 7805 1 1 17 GLY HA3 H 7.159 9.728 4.411 1.00 . A B . 17 GLY HA3 1 1 10 7806 1 1 17 GLY N N 7.940 8.749 2.763 1.00 . A B . 17 GLY N 1 1 10 7807 1 1 17 GLY O O 4.699 8.990 4.274 1.00 . A B . 17 GLY O 1 1 10 7808 1 1 18 GLY C C 3.318 6.656 2.819 1.00 . A B . 18 GLY C 1 1 10 7809 1 1 18 GLY CA C 4.018 7.675 1.948 1.00 . A B . 18 GLY CA 1 1 10 7810 1 1 18 GLY H H 6.130 7.671 1.836 1.00 . A B . 18 GLY H 1 1 10 7811 1 1 18 GLY HA2 H 3.452 8.594 1.963 1.00 . A B . 18 GLY HA2 1 1 10 7812 1 1 18 GLY HA3 H 4.052 7.304 0.938 1.00 . A B . 18 GLY HA3 1 1 10 7813 1 1 18 GLY N N 5.368 7.947 2.395 1.00 . A B . 18 GLY N 1 1 10 7814 1 1 18 GLY O O 3.962 5.814 3.448 1.00 . A B . 18 GLY O 1 1 10 7815 1 1 19 GLU C C 0.613 4.698 2.929 1.00 . A B . 19 GLU C 1 1 10 7816 1 1 19 GLU CA C 1.210 5.862 3.707 1.00 . A B . 19 GLU CA 1 1 10 7817 1 1 19 GLU CB C 0.108 6.677 4.385 1.00 . A B . 19 GLU CB 1 1 10 7818 1 1 19 GLU CD C -0.450 8.413 6.134 1.00 . A B . 19 GLU CD 1 1 10 7819 1 1 19 GLU CG C 0.642 7.737 5.338 1.00 . A B . 19 GLU CG 1 1 10 7820 1 1 19 GLU H H 1.547 7.370 2.259 1.00 . A B . 19 GLU H 1 1 10 7821 1 1 19 GLU HA H 1.868 5.465 4.465 1.00 . A B . 19 GLU HA 1 1 10 7822 1 1 19 GLU HB2 H -0.473 7.173 3.620 1.00 . A B . 19 GLU HB2 1 1 10 7823 1 1 19 GLU HB3 H -0.537 6.008 4.938 1.00 . A B . 19 GLU HB3 1 1 10 7824 1 1 19 GLU HG2 H 1.331 7.273 6.028 1.00 . A B . 19 GLU HG2 1 1 10 7825 1 1 19 GLU HG3 H 1.164 8.488 4.764 1.00 . A B . 19 GLU HG3 1 1 10 7826 1 1 19 GLU N N 2.002 6.723 2.844 1.00 . A B . 19 GLU N 1 1 10 7827 1 1 19 GLU O O 0.435 4.771 1.714 1.00 . A B . 19 GLU O 1 1 10 7828 1 1 19 GLU OE1 O -1.035 9.399 5.634 1.00 . A B . 19 GLU OE1 1 1 10 7829 1 1 19 GLU OE2 O -0.718 7.968 7.272 1.00 . A B . 19 GLU OE2 1 1 10 7830 1 1 20 LEU C C -1.786 2.464 3.203 1.00 . A B . 20 LEU C 1 1 10 7831 1 1 20 LEU CA C -0.274 2.435 3.052 1.00 . A B . 20 LEU CA 1 1 10 7832 1 1 20 LEU CB C 0.274 1.168 3.713 1.00 . A B . 20 LEU CB 1 1 10 7833 1 1 20 LEU CD1 C 2.193 -0.389 4.104 1.00 . A B . 20 LEU CD1 1 1 10 7834 1 1 20 LEU CD2 C 1.431 0.069 1.779 1.00 . A B . 20 LEU CD2 1 1 10 7835 1 1 20 LEU CG C 1.611 0.660 3.171 1.00 . A B . 20 LEU CG 1 1 10 7836 1 1 20 LEU H H 0.508 3.631 4.607 1.00 . A B . 20 LEU H 1 1 10 7837 1 1 20 LEU HA H -0.021 2.423 2.004 1.00 . A B . 20 LEU HA 1 1 10 7838 1 1 20 LEU HB2 H 0.393 1.363 4.769 1.00 . A B . 20 LEU HB2 1 1 10 7839 1 1 20 LEU HB3 H -0.458 0.384 3.591 1.00 . A B . 20 LEU HB3 1 1 10 7840 1 1 20 LEU HD11 H 3.131 -0.745 3.705 1.00 . A B . 20 LEU HD11 1 1 10 7841 1 1 20 LEU HD12 H 1.502 -1.216 4.190 1.00 . A B . 20 LEU HD12 1 1 10 7842 1 1 20 LEU HD13 H 2.358 0.045 5.078 1.00 . A B . 20 LEU HD13 1 1 10 7843 1 1 20 LEU HD21 H 2.381 -0.301 1.421 1.00 . A B . 20 LEU HD21 1 1 10 7844 1 1 20 LEU HD22 H 1.066 0.829 1.105 1.00 . A B . 20 LEU HD22 1 1 10 7845 1 1 20 LEU HD23 H 0.724 -0.746 1.821 1.00 . A B . 20 LEU HD23 1 1 10 7846 1 1 20 LEU HG H 2.311 1.483 3.105 1.00 . A B . 20 LEU HG 1 1 10 7847 1 1 20 LEU N N 0.325 3.622 3.645 1.00 . A B . 20 LEU N 1 1 10 7848 1 1 20 LEU O O -2.305 2.781 4.276 1.00 . A B . 20 LEU O 1 1 10 7849 1 1 21 PHE C C -4.395 0.619 1.966 1.00 . A B . 21 PHE C 1 1 10 7850 1 1 21 PHE CA C -3.944 2.060 2.162 1.00 . A B . 21 PHE CA 1 1 10 7851 1 1 21 PHE CB C -4.538 2.976 1.084 1.00 . A B . 21 PHE CB 1 1 10 7852 1 1 21 PHE CD1 C -3.038 4.963 0.786 1.00 . A B . 21 PHE CD1 1 1 10 7853 1 1 21 PHE CD2 C -5.068 5.257 2.003 1.00 . A B . 21 PHE CD2 1 1 10 7854 1 1 21 PHE CE1 C -2.737 6.297 0.965 1.00 . A B . 21 PHE CE1 1 1 10 7855 1 1 21 PHE CE2 C -4.772 6.592 2.179 1.00 . A B . 21 PHE CE2 1 1 10 7856 1 1 21 PHE CG C -4.206 4.426 1.303 1.00 . A B . 21 PHE CG 1 1 10 7857 1 1 21 PHE CZ C -3.580 7.093 1.752 1.00 . A B . 21 PHE CZ 1 1 10 7858 1 1 21 PHE H H -2.022 1.911 1.293 1.00 . A B . 21 PHE H 1 1 10 7859 1 1 21 PHE HA H -4.269 2.400 3.138 1.00 . A B . 21 PHE HA 1 1 10 7860 1 1 21 PHE HB2 H -4.156 2.684 0.115 1.00 . A B . 21 PHE HB2 1 1 10 7861 1 1 21 PHE HB3 H -5.615 2.877 1.087 1.00 . A B . 21 PHE HB3 1 1 10 7862 1 1 21 PHE HD1 H -2.357 4.326 0.241 1.00 . A B . 21 PHE HD1 1 1 10 7863 1 1 21 PHE HD2 H -5.979 4.854 2.415 1.00 . A B . 21 PHE HD2 1 1 10 7864 1 1 21 PHE HE1 H -1.823 6.702 0.558 1.00 . A B . 21 PHE HE1 1 1 10 7865 1 1 21 PHE HE2 H -5.453 7.229 2.723 1.00 . A B . 21 PHE HE2 1 1 10 7866 1 1 21 PHE HZ H -3.333 8.128 1.929 1.00 . A B . 21 PHE HZ 1 1 10 7867 1 1 21 PHE N N -2.489 2.124 2.133 1.00 . A B . 21 PHE N 1 1 10 7868 1 1 21 PHE O O -5.419 0.338 1.344 1.00 . A B . 21 PHE O 1 1 10 7869 1 1 22 CYS C C -3.669 -2.412 3.724 1.00 . A B . 22 CYS C 1 1 10 7870 1 1 22 CYS CA C -3.884 -1.716 2.395 1.00 . A B . 22 CYS CA 1 1 10 7871 1 1 22 CYS CB C -2.991 -2.369 1.344 1.00 . A B . 22 CYS CB 1 1 10 7872 1 1 22 CYS H H -2.797 -0.005 2.975 1.00 . A B . 22 CYS H 1 1 10 7873 1 1 22 CYS HA H -4.914 -1.830 2.099 1.00 . A B . 22 CYS HA 1 1 10 7874 1 1 22 CYS HB2 H -2.017 -1.899 1.367 1.00 . A B . 22 CYS HB2 1 1 10 7875 1 1 22 CYS HB3 H -2.880 -3.420 1.576 1.00 . A B . 22 CYS HB3 1 1 10 7876 1 1 22 CYS N N -3.602 -0.296 2.499 1.00 . A B . 22 CYS N 1 1 10 7877 1 1 22 CYS O O -2.929 -1.930 4.582 1.00 . A B . 22 CYS O 1 1 10 7878 1 1 22 CYS SG S -3.616 -2.244 -0.357 1.00 . A B . 22 CYS SG 1 1 10 7879 1 1 23 CYS C C -2.876 -5.239 4.819 1.00 . A B . 23 CYS C 1 1 10 7880 1 1 23 CYS CA C -4.126 -4.386 5.039 1.00 . A B . 23 CYS CA 1 1 10 7881 1 1 23 CYS CB C -5.368 -5.260 5.263 1.00 . A B . 23 CYS CB 1 1 10 7882 1 1 23 CYS H H -4.931 -3.846 3.172 1.00 . A B . 23 CYS H 1 1 10 7883 1 1 23 CYS HA H -3.970 -3.744 5.895 1.00 . A B . 23 CYS HA 1 1 10 7884 1 1 23 CYS HB2 H -5.328 -5.680 6.259 1.00 . A B . 23 CYS HB2 1 1 10 7885 1 1 23 CYS HB3 H -6.251 -4.641 5.176 1.00 . A B . 23 CYS HB3 1 1 10 7886 1 1 23 CYS N N -4.317 -3.552 3.875 1.00 . A B . 23 CYS N 1 1 10 7887 1 1 23 CYS O O -2.374 -5.300 3.691 1.00 . A B . 23 CYS O 1 1 10 7888 1 1 23 CYS SG S -5.545 -6.637 4.101 1.00 . A B . 23 CYS SG 1 1 10 7889 1 1 24 ASP C C -1.098 -7.603 4.613 1.00 . A B . 24 ASP C 1 1 10 7890 1 1 24 ASP CA C -1.124 -6.645 5.801 1.00 . A B . 24 ASP CA 1 1 10 7891 1 1 24 ASP CB C -0.884 -7.435 7.093 1.00 . A B . 24 ASP CB 1 1 10 7892 1 1 24 ASP CG C -0.439 -6.563 8.250 1.00 . A B . 24 ASP CG 1 1 10 7893 1 1 24 ASP H H -2.885 -5.875 6.714 1.00 . A B . 24 ASP H 1 1 10 7894 1 1 24 ASP HA H -0.323 -5.931 5.681 1.00 . A B . 24 ASP HA 1 1 10 7895 1 1 24 ASP HB2 H -1.799 -7.933 7.376 1.00 . A B . 24 ASP HB2 1 1 10 7896 1 1 24 ASP HB3 H -0.119 -8.177 6.913 1.00 . A B . 24 ASP HB3 1 1 10 7897 1 1 24 ASP N N -2.385 -5.890 5.870 1.00 . A B . 24 ASP N 1 1 10 7898 1 1 24 ASP O O -0.146 -7.612 3.830 1.00 . A B . 24 ASP O 1 1 10 7899 1 1 24 ASP OD1 O -1.294 -5.880 8.854 1.00 . A B . 24 ASP OD1 1 1 10 7900 1 1 24 ASP OD2 O 0.768 -6.562 8.572 1.00 . A B . 24 ASP OD2 1 1 10 7901 1 1 25 THR C C -2.117 -8.813 2.024 1.00 . A B . 25 THR C 1 1 10 7902 1 1 25 THR CA C -2.232 -9.406 3.434 1.00 . A B . 25 THR CA 1 1 10 7903 1 1 25 THR CB C -3.542 -10.202 3.562 1.00 . A B . 25 THR CB 1 1 10 7904 1 1 25 THR CG2 C -3.563 -11.383 2.603 1.00 . A B . 25 THR CG2 1 1 10 7905 1 1 25 THR H H -2.920 -8.270 5.078 1.00 . A B . 25 THR H 1 1 10 7906 1 1 25 THR HA H -1.409 -10.088 3.588 1.00 . A B . 25 THR HA 1 1 10 7907 1 1 25 THR HB H -4.366 -9.548 3.325 1.00 . A B . 25 THR HB 1 1 10 7908 1 1 25 THR HG1 H -4.459 -10.245 5.313 1.00 . A B . 25 THR HG1 1 1 10 7909 1 1 25 THR HG21 H -4.491 -11.922 2.716 1.00 . A B . 25 THR HG21 1 1 10 7910 1 1 25 THR HG22 H -2.735 -12.042 2.822 1.00 . A B . 25 THR HG22 1 1 10 7911 1 1 25 THR HG23 H -3.476 -11.022 1.590 1.00 . A B . 25 THR HG23 1 1 10 7912 1 1 25 THR N N -2.160 -8.381 4.466 1.00 . A B . 25 THR N 1 1 10 7913 1 1 25 THR O O -1.377 -9.327 1.187 1.00 . A B . 25 THR O 1 1 10 7914 1 1 25 THR OG1 O -3.691 -10.673 4.911 1.00 . A B . 25 THR OG1 1 1 10 7915 1 1 26 CYS C C -1.514 -6.330 0.209 1.00 . A B . 26 CYS C 1 1 10 7916 1 1 26 CYS CA C -2.807 -7.112 0.436 1.00 . A B . 26 CYS CA 1 1 10 7917 1 1 26 CYS CB C -4.006 -6.184 0.234 1.00 . A B . 26 CYS CB 1 1 10 7918 1 1 26 CYS H H -3.418 -7.356 2.458 1.00 . A B . 26 CYS H 1 1 10 7919 1 1 26 CYS HA H -2.856 -7.908 -0.292 1.00 . A B . 26 CYS HA 1 1 10 7920 1 1 26 CYS HB2 H -3.962 -5.394 0.966 1.00 . A B . 26 CYS HB2 1 1 10 7921 1 1 26 CYS HB3 H -3.953 -5.750 -0.753 1.00 . A B . 26 CYS HB3 1 1 10 7922 1 1 26 CYS N N -2.840 -7.730 1.761 1.00 . A B . 26 CYS N 1 1 10 7923 1 1 26 CYS O O -0.971 -6.331 -0.894 1.00 . A B . 26 CYS O 1 1 10 7924 1 1 26 CYS SG S -5.616 -6.987 0.399 1.00 . A B . 26 CYS SG 1 1 10 7925 1 1 27 SER C C 1.392 -5.629 0.733 1.00 . A B . 27 SER C 1 1 10 7926 1 1 27 SER CA C 0.162 -4.826 1.147 1.00 . A B . 27 SER CA 1 1 10 7927 1 1 27 SER CB C 0.420 -4.117 2.479 1.00 . A B . 27 SER CB 1 1 10 7928 1 1 27 SER H H -1.442 -5.784 2.137 1.00 . A B . 27 SER H 1 1 10 7929 1 1 27 SER HA H -0.038 -4.083 0.388 1.00 . A B . 27 SER HA 1 1 10 7930 1 1 27 SER HB2 H -0.425 -3.491 2.720 1.00 . A B . 27 SER HB2 1 1 10 7931 1 1 27 SER HB3 H 0.553 -4.855 3.255 1.00 . A B . 27 SER HB3 1 1 10 7932 1 1 27 SER HG H 2.138 -3.492 3.187 1.00 . A B . 27 SER HG 1 1 10 7933 1 1 27 SER N N -1.016 -5.681 1.257 1.00 . A B . 27 SER N 1 1 10 7934 1 1 27 SER O O 2.256 -5.135 0.020 1.00 . A B . 27 SER O 1 1 10 7935 1 1 27 SER OG O 1.580 -3.304 2.421 1.00 . A B . 27 SER OG 1 1 10 7936 1 1 28 ARG C C 2.566 -8.198 -0.584 1.00 . A B . 28 ARG C 1 1 10 7937 1 1 28 ARG CA C 2.596 -7.731 0.869 1.00 . A B . 28 ARG CA 1 1 10 7938 1 1 28 ARG CB C 2.618 -8.935 1.814 1.00 . A B . 28 ARG CB 1 1 10 7939 1 1 28 ARG CD C 2.707 -9.742 4.201 1.00 . A B . 28 ARG CD 1 1 10 7940 1 1 28 ARG CG C 2.894 -8.560 3.263 1.00 . A B . 28 ARG CG 1 1 10 7941 1 1 28 ARG CZ C 3.675 -11.977 4.599 1.00 . A B . 28 ARG CZ 1 1 10 7942 1 1 28 ARG H H 0.735 -7.225 1.740 1.00 . A B . 28 ARG H 1 1 10 7943 1 1 28 ARG HA H 3.491 -7.149 1.024 1.00 . A B . 28 ARG HA 1 1 10 7944 1 1 28 ARG HB2 H 1.658 -9.428 1.769 1.00 . A B . 28 ARG HB2 1 1 10 7945 1 1 28 ARG HB3 H 3.385 -9.622 1.489 1.00 . A B . 28 ARG HB3 1 1 10 7946 1 1 28 ARG HD2 H 2.791 -9.390 5.216 1.00 . A B . 28 ARG HD2 1 1 10 7947 1 1 28 ARG HD3 H 1.721 -10.158 4.048 1.00 . A B . 28 ARG HD3 1 1 10 7948 1 1 28 ARG HE H 4.441 -10.595 3.367 1.00 . A B . 28 ARG HE 1 1 10 7949 1 1 28 ARG HG2 H 3.913 -8.210 3.345 1.00 . A B . 28 ARG HG2 1 1 10 7950 1 1 28 ARG HG3 H 2.219 -7.770 3.556 1.00 . A B . 28 ARG HG3 1 1 10 7951 1 1 28 ARG HH11 H 1.936 -11.629 5.583 1.00 . A B . 28 ARG HH11 1 1 10 7952 1 1 28 ARG HH12 H 2.662 -13.176 5.882 1.00 . A B . 28 ARG HH12 1 1 10 7953 1 1 28 ARG HH21 H 5.394 -12.633 3.753 1.00 . A B . 28 ARG HH21 1 1 10 7954 1 1 28 ARG HH22 H 4.623 -13.753 4.835 1.00 . A B . 28 ARG HH22 1 1 10 7955 1 1 28 ARG N N 1.458 -6.876 1.176 1.00 . A B . 28 ARG N 1 1 10 7956 1 1 28 ARG NE N 3.702 -10.792 3.988 1.00 . A B . 28 ARG NE 1 1 10 7957 1 1 28 ARG NH1 N 2.678 -12.286 5.420 1.00 . A B . 28 ARG NH1 1 1 10 7958 1 1 28 ARG NH2 N 4.641 -12.858 4.378 1.00 . A B . 28 ARG NH2 1 1 10 7959 1 1 28 ARG O O 3.590 -8.604 -1.137 1.00 . A B . 28 ARG O 1 1 10 7960 1 1 29 VAL C C 1.212 -7.443 -3.572 1.00 . A B . 29 VAL C 1 1 10 7961 1 1 29 VAL CA C 1.233 -8.603 -2.573 1.00 . A B . 29 VAL CA 1 1 10 7962 1 1 29 VAL CB C -0.052 -9.446 -2.726 1.00 . A B . 29 VAL CB 1 1 10 7963 1 1 29 VAL CG1 C -0.179 -9.994 -4.139 1.00 . A B . 29 VAL CG1 1 1 10 7964 1 1 29 VAL CG2 C -0.065 -10.584 -1.718 1.00 . A B . 29 VAL CG2 1 1 10 7965 1 1 29 VAL H H 0.625 -7.747 -0.733 1.00 . A B . 29 VAL H 1 1 10 7966 1 1 29 VAL HA H 2.076 -9.236 -2.800 1.00 . A B . 29 VAL HA 1 1 10 7967 1 1 29 VAL HB H -0.901 -8.810 -2.528 1.00 . A B . 29 VAL HB 1 1 10 7968 1 1 29 VAL HG11 H -1.091 -10.566 -4.221 1.00 . A B . 29 VAL HG11 1 1 10 7969 1 1 29 VAL HG12 H 0.666 -10.631 -4.353 1.00 . A B . 29 VAL HG12 1 1 10 7970 1 1 29 VAL HG13 H -0.200 -9.175 -4.843 1.00 . A B . 29 VAL HG13 1 1 10 7971 1 1 29 VAL HG21 H -0.948 -11.188 -1.872 1.00 . A B . 29 VAL HG21 1 1 10 7972 1 1 29 VAL HG22 H -0.076 -10.180 -0.718 1.00 . A B . 29 VAL HG22 1 1 10 7973 1 1 29 VAL HG23 H 0.815 -11.195 -1.853 1.00 . A B . 29 VAL HG23 1 1 10 7974 1 1 29 VAL N N 1.395 -8.130 -1.205 1.00 . A B . 29 VAL N 1 1 10 7975 1 1 29 VAL O O 1.837 -7.517 -4.632 1.00 . A B . 29 VAL O 1 1 10 7976 1 1 30 PHE C C 0.932 -3.970 -3.501 1.00 . A B . 30 PHE C 1 1 10 7977 1 1 30 PHE CA C 0.367 -5.233 -4.136 1.00 . A B . 30 PHE CA 1 1 10 7978 1 1 30 PHE CB C -1.110 -4.996 -4.488 1.00 . A B . 30 PHE CB 1 1 10 7979 1 1 30 PHE CD1 C -1.555 -6.667 -6.308 1.00 . A B . 30 PHE CD1 1 1 10 7980 1 1 30 PHE CD2 C -2.783 -6.870 -4.271 1.00 . A B . 30 PHE CD2 1 1 10 7981 1 1 30 PHE CE1 C -2.207 -7.773 -6.815 1.00 . A B . 30 PHE CE1 1 1 10 7982 1 1 30 PHE CE2 C -3.437 -7.977 -4.777 1.00 . A B . 30 PHE CE2 1 1 10 7983 1 1 30 PHE CG C -1.834 -6.200 -5.031 1.00 . A B . 30 PHE CG 1 1 10 7984 1 1 30 PHE CZ C -3.191 -8.418 -6.020 1.00 . A B . 30 PHE CZ 1 1 10 7985 1 1 30 PHE H H 0.110 -6.320 -2.333 1.00 . A B . 30 PHE H 1 1 10 7986 1 1 30 PHE HA H 0.919 -5.452 -5.038 1.00 . A B . 30 PHE HA 1 1 10 7987 1 1 30 PHE HB2 H -1.632 -4.678 -3.596 1.00 . A B . 30 PHE HB2 1 1 10 7988 1 1 30 PHE HB3 H -1.170 -4.210 -5.228 1.00 . A B . 30 PHE HB3 1 1 10 7989 1 1 30 PHE HD1 H -0.815 -6.159 -6.907 1.00 . A B . 30 PHE HD1 1 1 10 7990 1 1 30 PHE HD2 H -3.011 -6.522 -3.275 1.00 . A B . 30 PHE HD2 1 1 10 7991 1 1 30 PHE HE1 H -1.978 -8.124 -7.812 1.00 . A B . 30 PHE HE1 1 1 10 7992 1 1 30 PHE HE2 H -4.173 -8.490 -4.176 1.00 . A B . 30 PHE HE2 1 1 10 7993 1 1 30 PHE HZ H -3.717 -9.279 -6.405 1.00 . A B . 30 PHE HZ 1 1 10 7994 1 1 30 PHE N N 0.516 -6.367 -3.228 1.00 . A B . 30 PHE N 1 1 10 7995 1 1 30 PHE O O 0.325 -2.907 -3.587 1.00 . A B . 30 PHE O 1 1 10 7996 1 1 31 HIS C C 2.737 -1.698 -2.903 1.00 . A B . 31 HIS C 1 1 10 7997 1 1 31 HIS CA C 2.705 -3.005 -2.112 1.00 . A B . 31 HIS CA 1 1 10 7998 1 1 31 HIS CB C 4.120 -3.402 -1.682 1.00 . A B . 31 HIS CB 1 1 10 7999 1 1 31 HIS CD2 C 5.892 -1.659 -0.942 1.00 . A B . 31 HIS CD2 1 1 10 8000 1 1 31 HIS CE1 C 5.215 -1.289 1.078 1.00 . A B . 31 HIS CE1 1 1 10 8001 1 1 31 HIS CG C 4.789 -2.427 -0.755 1.00 . A B . 31 HIS CG 1 1 10 8002 1 1 31 HIS H H 2.566 -4.958 -2.924 1.00 . A B . 31 HIS H 1 1 10 8003 1 1 31 HIS HA H 2.106 -2.855 -1.227 1.00 . A B . 31 HIS HA 1 1 10 8004 1 1 31 HIS HB2 H 4.074 -4.356 -1.177 1.00 . A B . 31 HIS HB2 1 1 10 8005 1 1 31 HIS HB3 H 4.736 -3.501 -2.564 1.00 . A B . 31 HIS HB3 1 1 10 8006 1 1 31 HIS HD1 H 3.589 -2.586 0.975 1.00 . A B . 31 HIS HD1 1 1 10 8007 1 1 31 HIS HD2 H 6.470 -1.594 -1.852 1.00 . A B . 31 HIS HD2 1 1 10 8008 1 1 31 HIS HE1 H 5.138 -0.912 2.087 1.00 . A B . 31 HIS HE1 1 1 10 8009 1 1 31 HIS N N 2.099 -4.097 -2.877 1.00 . A B . 31 HIS N 1 1 10 8010 1 1 31 HIS ND1 N 4.371 -2.182 0.535 1.00 . A B . 31 HIS ND1 1 1 10 8011 1 1 31 HIS NE2 N 6.158 -0.938 0.222 1.00 . A B . 31 HIS NE2 1 1 10 8012 1 1 31 HIS O O 2.272 -0.671 -2.421 1.00 . A B . 31 HIS O 1 1 10 8013 1 1 32 GLU C C 2.062 0.101 -5.256 1.00 . A B . 32 GLU C 1 1 10 8014 1 1 32 GLU CA C 3.398 -0.561 -4.953 1.00 . A B . 32 GLU CA 1 1 10 8015 1 1 32 GLU CB C 4.104 -0.908 -6.261 1.00 . A B . 32 GLU CB 1 1 10 8016 1 1 32 GLU CD C 6.380 -0.071 -5.573 1.00 . A B . 32 GLU CD 1 1 10 8017 1 1 32 GLU CG C 5.575 -1.244 -6.090 1.00 . A B . 32 GLU CG 1 1 10 8018 1 1 32 GLU H H 3.440 -2.636 -4.514 1.00 . A B . 32 GLU H 1 1 10 8019 1 1 32 GLU HA H 4.012 0.133 -4.398 1.00 . A B . 32 GLU HA 1 1 10 8020 1 1 32 GLU HB2 H 3.610 -1.759 -6.705 1.00 . A B . 32 GLU HB2 1 1 10 8021 1 1 32 GLU HB3 H 4.024 -0.066 -6.931 1.00 . A B . 32 GLU HB3 1 1 10 8022 1 1 32 GLU HG2 H 5.665 -2.057 -5.388 1.00 . A B . 32 GLU HG2 1 1 10 8023 1 1 32 GLU HG3 H 5.979 -1.546 -7.045 1.00 . A B . 32 GLU HG3 1 1 10 8024 1 1 32 GLU N N 3.224 -1.759 -4.134 1.00 . A B . 32 GLU N 1 1 10 8025 1 1 32 GLU O O 1.948 1.327 -5.260 1.00 . A B . 32 GLU O 1 1 10 8026 1 1 32 GLU OE1 O 6.230 1.038 -6.115 1.00 . A B . 32 GLU OE1 1 1 10 8027 1 1 32 GLU OE2 O 7.146 -0.250 -4.595 1.00 . A B . 32 GLU OE2 1 1 10 8028 1 1 33 ASP C C -1.003 0.229 -4.582 1.00 . A B . 33 ASP C 1 1 10 8029 1 1 33 ASP CA C -0.275 -0.233 -5.834 1.00 . A B . 33 ASP CA 1 1 10 8030 1 1 33 ASP CB C -1.087 -1.326 -6.531 1.00 . A B . 33 ASP CB 1 1 10 8031 1 1 33 ASP CG C -0.567 -1.652 -7.914 1.00 . A B . 33 ASP CG 1 1 10 8032 1 1 33 ASP H H 1.211 -1.687 -5.451 1.00 . A B . 33 ASP H 1 1 10 8033 1 1 33 ASP HA H -0.163 0.607 -6.505 1.00 . A B . 33 ASP HA 1 1 10 8034 1 1 33 ASP HB2 H -1.049 -2.225 -5.935 1.00 . A B . 33 ASP HB2 1 1 10 8035 1 1 33 ASP HB3 H -2.114 -1.003 -6.620 1.00 . A B . 33 ASP HB3 1 1 10 8036 1 1 33 ASP N N 1.055 -0.721 -5.501 1.00 . A B . 33 ASP N 1 1 10 8037 1 1 33 ASP O O -1.894 1.073 -4.642 1.00 . A B . 33 ASP O 1 1 10 8038 1 1 33 ASP OD1 O 0.337 -2.509 -8.022 1.00 . A B . 33 ASP OD1 1 1 10 8039 1 1 33 ASP OD2 O -1.053 -1.059 -8.898 1.00 . A B . 33 ASP OD2 1 1 10 8040 1 1 34 CYS C C -0.778 1.329 -1.616 1.00 . A B . 34 CYS C 1 1 10 8041 1 1 34 CYS CA C -1.233 -0.018 -2.172 1.00 . A B . 34 CYS CA 1 1 10 8042 1 1 34 CYS CB C -0.945 -1.142 -1.179 1.00 . A B . 34 CYS CB 1 1 10 8043 1 1 34 CYS H H 0.146 -0.965 -3.470 1.00 . A B . 34 CYS H 1 1 10 8044 1 1 34 CYS HA H -2.299 0.027 -2.343 1.00 . A B . 34 CYS HA 1 1 10 8045 1 1 34 CYS HB2 H 0.094 -1.435 -1.262 1.00 . A B . 34 CYS HB2 1 1 10 8046 1 1 34 CYS HB3 H -1.137 -0.788 -0.176 1.00 . A B . 34 CYS HB3 1 1 10 8047 1 1 34 CYS N N -0.600 -0.321 -3.449 1.00 . A B . 34 CYS N 1 1 10 8048 1 1 34 CYS O O -1.188 1.734 -0.525 1.00 . A B . 34 CYS O 1 1 10 8049 1 1 34 CYS SG S -1.961 -2.627 -1.455 1.00 . A B . 34 CYS SG 1 1 10 8050 1 1 35 HIS C C -0.223 4.375 -2.932 1.00 . A B . 35 HIS C 1 1 10 8051 1 1 35 HIS CA C 0.483 3.370 -2.027 1.00 . A B . 35 HIS CA 1 1 10 8052 1 1 35 HIS CB C 1.996 3.532 -2.164 1.00 . A B . 35 HIS CB 1 1 10 8053 1 1 35 HIS CD2 C 3.219 1.573 -1.016 1.00 . A B . 35 HIS CD2 1 1 10 8054 1 1 35 HIS CE1 C 3.744 2.514 0.854 1.00 . A B . 35 HIS CE1 1 1 10 8055 1 1 35 HIS CG C 2.764 2.843 -1.081 1.00 . A B . 35 HIS CG 1 1 10 8056 1 1 35 HIS H H 0.462 1.580 -3.157 1.00 . A B . 35 HIS H 1 1 10 8057 1 1 35 HIS HA H 0.202 3.559 -1.002 1.00 . A B . 35 HIS HA 1 1 10 8058 1 1 35 HIS HB2 H 2.309 3.114 -3.110 1.00 . A B . 35 HIS HB2 1 1 10 8059 1 1 35 HIS HB3 H 2.244 4.583 -2.137 1.00 . A B . 35 HIS HB3 1 1 10 8060 1 1 35 HIS HD1 H 2.868 4.341 0.403 1.00 . A B . 35 HIS HD1 1 1 10 8061 1 1 35 HIS HD2 H 3.133 0.830 -1.798 1.00 . A B . 35 HIS HD2 1 1 10 8062 1 1 35 HIS HE1 H 4.140 2.696 1.841 1.00 . A B . 35 HIS HE1 1 1 10 8063 1 1 35 HIS N N 0.078 2.010 -2.364 1.00 . A B . 35 HIS N 1 1 10 8064 1 1 35 HIS ND1 N 3.100 3.430 0.118 1.00 . A B . 35 HIS ND1 1 1 10 8065 1 1 35 HIS NE2 N 3.838 1.362 0.208 1.00 . A B . 35 HIS NE2 1 1 10 8066 1 1 35 HIS O O 0.041 5.575 -2.874 1.00 . A B . 35 HIS O 1 1 10 8067 1 1 36 ILE C C -3.317 4.465 -4.668 1.00 . A B . 36 ILE C 1 1 10 8068 1 1 36 ILE CA C -1.809 4.696 -4.750 1.00 . A B . 36 ILE CA 1 1 10 8069 1 1 36 ILE CB C -1.323 4.377 -6.183 1.00 . A B . 36 ILE CB 1 1 10 8070 1 1 36 ILE CD1 C 0.779 4.133 -7.610 1.00 . A B . 36 ILE CD1 1 1 10 8071 1 1 36 ILE CG1 C 0.198 4.546 -6.275 1.00 . A B . 36 ILE CG1 1 1 10 8072 1 1 36 ILE CG2 C -2.026 5.264 -7.204 1.00 . A B . 36 ILE CG2 1 1 10 8073 1 1 36 ILE H H -1.302 2.909 -3.751 1.00 . A B . 36 ILE H 1 1 10 8074 1 1 36 ILE HA H -1.591 5.729 -4.533 1.00 . A B . 36 ILE HA 1 1 10 8075 1 1 36 ILE HB H -1.576 3.351 -6.399 1.00 . A B . 36 ILE HB 1 1 10 8076 1 1 36 ILE HD11 H 0.328 4.721 -8.395 1.00 . A B . 36 ILE HD11 1 1 10 8077 1 1 36 ILE HD12 H 0.577 3.087 -7.781 1.00 . A B . 36 ILE HD12 1 1 10 8078 1 1 36 ILE HD13 H 1.847 4.296 -7.603 1.00 . A B . 36 ILE HD13 1 1 10 8079 1 1 36 ILE HG12 H 0.449 5.583 -6.111 1.00 . A B . 36 ILE HG12 1 1 10 8080 1 1 36 ILE HG13 H 0.664 3.944 -5.508 1.00 . A B . 36 ILE HG13 1 1 10 8081 1 1 36 ILE HG21 H -1.821 6.300 -6.984 1.00 . A B . 36 ILE HG21 1 1 10 8082 1 1 36 ILE HG22 H -3.090 5.089 -7.160 1.00 . A B . 36 ILE HG22 1 1 10 8083 1 1 36 ILE HG23 H -1.663 5.028 -8.194 1.00 . A B . 36 ILE HG23 1 1 10 8084 1 1 36 ILE N N -1.110 3.869 -3.779 1.00 . A B . 36 ILE N 1 1 10 8085 1 1 36 ILE O O -3.771 3.322 -4.684 1.00 . A B . 36 ILE O 1 1 10 8086 1 1 37 PRO C C -3.308 7.367 -3.097 1.00 . A B . 37 PRO C 1 1 10 8087 1 1 37 PRO CA C -3.631 6.917 -4.523 1.00 . A B . 37 PRO CA 1 1 10 8088 1 1 37 PRO CB C -4.822 7.703 -5.072 1.00 . A B . 37 PRO CB 1 1 10 8089 1 1 37 PRO CD C -5.594 5.482 -4.534 1.00 . A B . 37 PRO CD 1 1 10 8090 1 1 37 PRO CG C -6.019 6.933 -4.619 1.00 . A B . 37 PRO CG 1 1 10 8091 1 1 37 PRO HA H -2.770 7.064 -5.158 1.00 . A B . 37 PRO HA 1 1 10 8092 1 1 37 PRO HB2 H -4.813 8.707 -4.664 1.00 . A B . 37 PRO HB2 1 1 10 8093 1 1 37 PRO HB3 H -4.763 7.742 -6.153 1.00 . A B . 37 PRO HB3 1 1 10 8094 1 1 37 PRO HD2 H -5.935 5.042 -3.606 1.00 . A B . 37 PRO HD2 1 1 10 8095 1 1 37 PRO HD3 H -5.981 4.926 -5.378 1.00 . A B . 37 PRO HD3 1 1 10 8096 1 1 37 PRO HG2 H -6.333 7.288 -3.646 1.00 . A B . 37 PRO HG2 1 1 10 8097 1 1 37 PRO HG3 H -6.821 7.046 -5.335 1.00 . A B . 37 PRO HG3 1 1 10 8098 1 1 37 PRO N N -4.120 5.538 -4.577 1.00 . A B . 37 PRO N 1 1 10 8099 1 1 37 PRO O O -3.949 6.932 -2.139 1.00 . A B . 37 PRO O 1 1 10 8100 1 1 38 PRO C C -3.009 9.739 -1.107 1.00 . A B . 38 PRO C 1 1 10 8101 1 1 38 PRO CA C -1.937 8.793 -1.635 1.00 . A B . 38 PRO CA 1 1 10 8102 1 1 38 PRO CB C -0.639 9.556 -1.914 1.00 . A B . 38 PRO CB 1 1 10 8103 1 1 38 PRO CD C -1.454 8.767 -4.026 1.00 . A B . 38 PRO CD 1 1 10 8104 1 1 38 PRO CG C -0.699 9.894 -3.366 1.00 . A B . 38 PRO CG 1 1 10 8105 1 1 38 PRO HA H -1.755 8.013 -0.914 1.00 . A B . 38 PRO HA 1 1 10 8106 1 1 38 PRO HB2 H -0.605 10.445 -1.300 1.00 . A B . 38 PRO HB2 1 1 10 8107 1 1 38 PRO HB3 H 0.209 8.925 -1.688 1.00 . A B . 38 PRO HB3 1 1 10 8108 1 1 38 PRO HD2 H -2.059 9.142 -4.842 1.00 . A B . 38 PRO HD2 1 1 10 8109 1 1 38 PRO HD3 H -0.770 8.006 -4.381 1.00 . A B . 38 PRO HD3 1 1 10 8110 1 1 38 PRO HG2 H -1.225 10.830 -3.501 1.00 . A B . 38 PRO HG2 1 1 10 8111 1 1 38 PRO HG3 H 0.301 9.965 -3.769 1.00 . A B . 38 PRO HG3 1 1 10 8112 1 1 38 PRO N N -2.304 8.243 -2.942 1.00 . A B . 38 PRO N 1 1 10 8113 1 1 38 PRO O O -3.775 10.316 -1.884 1.00 . A B . 38 PRO O 1 1 10 8114 1 1 39 VAL C C -3.753 12.226 0.561 1.00 . A B . 39 VAL C 1 1 10 8115 1 1 39 VAL CA C -4.069 10.755 0.824 1.00 . A B . 39 VAL CA 1 1 10 8116 1 1 39 VAL CB C -4.238 10.498 2.343 1.00 . A B . 39 VAL CB 1 1 10 8117 1 1 39 VAL CG1 C -2.914 10.584 3.086 1.00 . A B . 39 VAL CG1 1 1 10 8118 1 1 39 VAL CG2 C -5.248 11.468 2.937 1.00 . A B . 39 VAL CG2 1 1 10 8119 1 1 39 VAL H H -2.442 9.405 0.779 1.00 . A B . 39 VAL H 1 1 10 8120 1 1 39 VAL HA H -5.013 10.528 0.351 1.00 . A B . 39 VAL HA 1 1 10 8121 1 1 39 VAL HB H -4.624 9.501 2.469 1.00 . A B . 39 VAL HB 1 1 10 8122 1 1 39 VAL HG11 H -2.251 9.809 2.735 1.00 . A B . 39 VAL HG11 1 1 10 8123 1 1 39 VAL HG12 H -3.088 10.457 4.144 1.00 . A B . 39 VAL HG12 1 1 10 8124 1 1 39 VAL HG13 H -2.466 11.550 2.909 1.00 . A B . 39 VAL HG13 1 1 10 8125 1 1 39 VAL HG21 H -5.417 11.223 3.975 1.00 . A B . 39 VAL HG21 1 1 10 8126 1 1 39 VAL HG22 H -6.178 11.395 2.392 1.00 . A B . 39 VAL HG22 1 1 10 8127 1 1 39 VAL HG23 H -4.867 12.476 2.862 1.00 . A B . 39 VAL HG23 1 1 10 8128 1 1 39 VAL N N -3.074 9.889 0.212 1.00 . A B . 39 VAL N 1 1 10 8129 1 1 39 VAL O O -2.798 12.791 1.103 1.00 . A B . 39 VAL O 1 1 10 8130 1 1 40 GLU C C -5.793 14.860 -0.756 1.00 . A B . 40 GLU C 1 1 10 8131 1 1 40 GLU CA C -4.411 14.223 -0.665 1.00 . A B . 40 GLU CA 1 1 10 8132 1 1 40 GLU CB C -3.658 14.376 -1.996 1.00 . A B . 40 GLU CB 1 1 10 8133 1 1 40 GLU CD C -1.540 13.936 -3.302 1.00 . A B . 40 GLU CD 1 1 10 8134 1 1 40 GLU CG C -2.234 13.836 -1.962 1.00 . A B . 40 GLU CG 1 1 10 8135 1 1 40 GLU H H -5.268 12.298 -0.724 1.00 . A B . 40 GLU H 1 1 10 8136 1 1 40 GLU HA H -3.853 14.711 0.119 1.00 . A B . 40 GLU HA 1 1 10 8137 1 1 40 GLU HB2 H -4.199 13.848 -2.767 1.00 . A B . 40 GLU HB2 1 1 10 8138 1 1 40 GLU HB3 H -3.615 15.424 -2.253 1.00 . A B . 40 GLU HB3 1 1 10 8139 1 1 40 GLU HG2 H -1.664 14.402 -1.241 1.00 . A B . 40 GLU HG2 1 1 10 8140 1 1 40 GLU HG3 H -2.262 12.799 -1.664 1.00 . A B . 40 GLU HG3 1 1 10 8141 1 1 40 GLU N N -4.551 12.821 -0.309 1.00 . A B . 40 GLU N 1 1 10 8142 1 1 40 GLU O O -6.056 15.890 -0.137 1.00 . A B . 40 GLU O 1 1 10 8143 1 1 40 GLU OE1 O -1.804 13.089 -4.179 1.00 . A B . 40 GLU OE1 1 1 10 8144 1 1 40 GLU OE2 O -0.730 14.865 -3.490 1.00 . A B . 40 GLU OE2 1 1 10 8145 1 1 41 ALA C C -8.926 14.000 -0.577 1.00 . A B . 41 ALA C 1 1 10 8146 1 1 41 ALA CA C -8.054 14.691 -1.611 1.00 . A B . 41 ALA CA 1 1 10 8147 1 1 41 ALA CB C -8.596 14.448 -3.013 1.00 . A B . 41 ALA CB 1 1 10 8148 1 1 41 ALA H H -6.415 13.413 -1.986 1.00 . A B . 41 ALA H 1 1 10 8149 1 1 41 ALA HA H -8.062 15.752 -1.423 1.00 . A B . 41 ALA HA 1 1 10 8150 1 1 41 ALA HB1 H -7.965 14.946 -3.735 1.00 . A B . 41 ALA HB1 1 1 10 8151 1 1 41 ALA HB2 H -9.601 14.839 -3.084 1.00 . A B . 41 ALA HB2 1 1 10 8152 1 1 41 ALA HB3 H -8.609 13.388 -3.218 1.00 . A B . 41 ALA HB3 1 1 10 8153 1 1 41 ALA N N -6.683 14.223 -1.502 1.00 . A B . 41 ALA N 1 1 10 8154 1 1 41 ALA O O -9.816 14.611 0.012 1.00 . A B . 41 ALA O 1 1 10 8155 1 1 42 GLU C C -8.655 10.611 0.856 1.00 . A B . 42 GLU C 1 1 10 8156 1 1 42 GLU CA C -9.402 11.915 0.587 1.00 . A B . 42 GLU CA 1 1 10 8157 1 1 42 GLU CB C -10.802 11.632 0.030 1.00 . A B . 42 GLU CB 1 1 10 8158 1 1 42 GLU CD C -12.192 10.528 -1.752 1.00 . A B . 42 GLU CD 1 1 10 8159 1 1 42 GLU CG C -10.798 10.887 -1.293 1.00 . A B . 42 GLU CG 1 1 10 8160 1 1 42 GLU H H -7.887 12.313 -0.820 1.00 . A B . 42 GLU H 1 1 10 8161 1 1 42 GLU HA H -9.492 12.465 1.509 1.00 . A B . 42 GLU HA 1 1 10 8162 1 1 42 GLU HB2 H -11.353 11.046 0.748 1.00 . A B . 42 GLU HB2 1 1 10 8163 1 1 42 GLU HB3 H -11.309 12.574 -0.117 1.00 . A B . 42 GLU HB3 1 1 10 8164 1 1 42 GLU HG2 H -10.335 11.513 -2.042 1.00 . A B . 42 GLU HG2 1 1 10 8165 1 1 42 GLU HG3 H -10.224 9.979 -1.177 1.00 . A B . 42 GLU HG3 1 1 10 8166 1 1 42 GLU N N -8.643 12.725 -0.348 1.00 . A B . 42 GLU N 1 1 10 8167 1 1 42 GLU O O -7.429 10.576 0.751 1.00 . A B . 42 GLU O 1 1 10 8168 1 1 42 GLU OE1 O -12.813 9.632 -1.145 1.00 . A B . 42 GLU OE1 1 1 10 8169 1 1 42 GLU OE2 O -12.675 11.135 -2.728 1.00 . A B . 42 GLU OE2 1 1 10 8170 1 1 43 ARG C C -8.246 8.149 2.867 1.00 . A B . 43 ARG C 1 1 10 8171 1 1 43 ARG CA C -8.855 8.233 1.479 1.00 . A B . 43 ARG CA 1 1 10 8172 1 1 43 ARG CB C -7.847 7.794 0.413 1.00 . A B . 43 ARG CB 1 1 10 8173 1 1 43 ARG CD C -9.128 5.826 -0.522 1.00 . A B . 43 ARG CD 1 1 10 8174 1 1 43 ARG CG C -8.487 7.182 -0.825 1.00 . A B . 43 ARG CG 1 1 10 8175 1 1 43 ARG CZ C -10.750 4.977 1.148 1.00 . A B . 43 ARG CZ 1 1 10 8176 1 1 43 ARG H H -10.371 9.685 1.281 1.00 . A B . 43 ARG H 1 1 10 8177 1 1 43 ARG HA H -9.687 7.545 1.449 1.00 . A B . 43 ARG HA 1 1 10 8178 1 1 43 ARG HB2 H -7.275 8.658 0.104 1.00 . A B . 43 ARG HB2 1 1 10 8179 1 1 43 ARG HB3 H -7.178 7.065 0.845 1.00 . A B . 43 ARG HB3 1 1 10 8180 1 1 43 ARG HD2 H -9.420 5.364 -1.452 1.00 . A B . 43 ARG HD2 1 1 10 8181 1 1 43 ARG HD3 H -8.397 5.202 -0.027 1.00 . A B . 43 ARG HD3 1 1 10 8182 1 1 43 ARG HE H -10.810 6.791 0.302 1.00 . A B . 43 ARG HE 1 1 10 8183 1 1 43 ARG HG2 H -9.250 7.853 -1.192 1.00 . A B . 43 ARG HG2 1 1 10 8184 1 1 43 ARG HG3 H -7.728 7.052 -1.583 1.00 . A B . 43 ARG HG3 1 1 10 8185 1 1 43 ARG HH11 H -9.293 3.650 0.671 1.00 . A B . 43 ARG HH11 1 1 10 8186 1 1 43 ARG HH12 H -10.460 3.087 1.829 1.00 . A B . 43 ARG HH12 1 1 10 8187 1 1 43 ARG HH21 H -12.321 6.056 1.834 1.00 . A B . 43 ARG HH21 1 1 10 8188 1 1 43 ARG HH22 H -12.169 4.460 2.501 1.00 . A B . 43 ARG HH22 1 1 10 8189 1 1 43 ARG N N -9.404 9.561 1.202 1.00 . A B . 43 ARG N 1 1 10 8190 1 1 43 ARG NE N -10.311 5.941 0.337 1.00 . A B . 43 ARG NE 1 1 10 8191 1 1 43 ARG NH1 N -10.114 3.815 1.222 1.00 . A B . 43 ARG NH1 1 1 10 8192 1 1 43 ARG NH2 N -11.831 5.180 1.887 1.00 . A B . 43 ARG NH2 1 1 10 8193 1 1 43 ARG O O -7.468 9.006 3.286 1.00 . A B . 43 ARG O 1 1 10 8194 1 1 44 THR C C -7.204 5.713 4.987 1.00 . A B . 44 THR C 1 1 10 8195 1 1 44 THR CA C -8.187 6.885 4.937 1.00 . A B . 44 THR CA 1 1 10 8196 1 1 44 THR CB C -9.404 6.598 5.835 1.00 . A B . 44 THR CB 1 1 10 8197 1 1 44 THR CG2 C -10.300 7.824 5.936 1.00 . A B . 44 THR CG2 1 1 10 8198 1 1 44 THR H H -9.234 6.454 3.173 1.00 . A B . 44 THR H 1 1 10 8199 1 1 44 THR HA H -7.703 7.782 5.287 1.00 . A B . 44 THR HA 1 1 10 8200 1 1 44 THR HB H -9.057 6.334 6.824 1.00 . A B . 44 THR HB 1 1 10 8201 1 1 44 THR HG1 H -11.038 5.495 5.682 1.00 . A B . 44 THR HG1 1 1 10 8202 1 1 44 THR HG21 H -11.178 7.581 6.514 1.00 . A B . 44 THR HG21 1 1 10 8203 1 1 44 THR HG22 H -10.597 8.135 4.945 1.00 . A B . 44 THR HG22 1 1 10 8204 1 1 44 THR HG23 H -9.762 8.628 6.418 1.00 . A B . 44 THR HG23 1 1 10 8205 1 1 44 THR N N -8.628 7.106 3.578 1.00 . A B . 44 THR N 1 1 10 8206 1 1 44 THR O O -7.495 4.629 4.482 1.00 . A B . 44 THR O 1 1 10 8207 1 1 44 THR OG1 O -10.156 5.506 5.291 1.00 . A B . 44 THR OG1 1 1 10 8208 1 1 45 PRO C C -5.358 3.646 6.419 1.00 . A B . 45 PRO C 1 1 10 8209 1 1 45 PRO CA C -4.963 4.892 5.623 1.00 . A B . 45 PRO CA 1 1 10 8210 1 1 45 PRO CB C -3.780 5.598 6.300 1.00 . A B . 45 PRO CB 1 1 10 8211 1 1 45 PRO CD C -5.577 7.176 6.213 1.00 . A B . 45 PRO CD 1 1 10 8212 1 1 45 PRO CG C -4.080 7.056 6.202 1.00 . A B . 45 PRO CG 1 1 10 8213 1 1 45 PRO HA H -4.675 4.591 4.627 1.00 . A B . 45 PRO HA 1 1 10 8214 1 1 45 PRO HB2 H -3.709 5.276 7.330 1.00 . A B . 45 PRO HB2 1 1 10 8215 1 1 45 PRO HB3 H -2.866 5.349 5.778 1.00 . A B . 45 PRO HB3 1 1 10 8216 1 1 45 PRO HD2 H -5.946 7.245 7.230 1.00 . A B . 45 PRO HD2 1 1 10 8217 1 1 45 PRO HD3 H -5.891 8.033 5.636 1.00 . A B . 45 PRO HD3 1 1 10 8218 1 1 45 PRO HG2 H -3.654 7.575 7.049 1.00 . A B . 45 PRO HG2 1 1 10 8219 1 1 45 PRO HG3 H -3.679 7.453 5.280 1.00 . A B . 45 PRO HG3 1 1 10 8220 1 1 45 PRO N N -6.013 5.921 5.577 1.00 . A B . 45 PRO N 1 1 10 8221 1 1 45 PRO O O -4.743 2.590 6.270 1.00 . A B . 45 PRO O 1 1 10 8222 1 1 46 TRP C C -7.938 1.843 7.395 1.00 . A B . 46 TRP C 1 1 10 8223 1 1 46 TRP CA C -6.815 2.625 8.077 1.00 . A B . 46 TRP CA 1 1 10 8224 1 1 46 TRP CB C -7.245 3.090 9.478 1.00 . A B . 46 TRP CB 1 1 10 8225 1 1 46 TRP CD1 C -9.674 3.912 9.580 1.00 . A B . 46 TRP CD1 1 1 10 8226 1 1 46 TRP CD2 C -8.159 5.552 9.423 1.00 . A B . 46 TRP CD2 1 1 10 8227 1 1 46 TRP CE2 C -9.441 6.128 9.475 1.00 . A B . 46 TRP CE2 1 1 10 8228 1 1 46 TRP CE3 C -7.048 6.393 9.323 1.00 . A B . 46 TRP CE3 1 1 10 8229 1 1 46 TRP CG C -8.329 4.130 9.489 1.00 . A B . 46 TRP CG 1 1 10 8230 1 1 46 TRP CH2 C -8.534 8.301 9.335 1.00 . A B . 46 TRP CH2 1 1 10 8231 1 1 46 TRP CZ2 C -9.641 7.504 9.434 1.00 . A B . 46 TRP CZ2 1 1 10 8232 1 1 46 TRP CZ3 C -7.249 7.759 9.280 1.00 . A B . 46 TRP CZ3 1 1 10 8233 1 1 46 TRP H H -6.865 4.611 7.316 1.00 . A B . 46 TRP H 1 1 10 8234 1 1 46 TRP HA H -5.966 1.966 8.177 1.00 . A B . 46 TRP HA 1 1 10 8235 1 1 46 TRP HB2 H -7.605 2.237 10.034 1.00 . A B . 46 TRP HB2 1 1 10 8236 1 1 46 TRP HB3 H -6.385 3.502 9.989 1.00 . A B . 46 TRP HB3 1 1 10 8237 1 1 46 TRP HD1 H -10.131 2.936 9.644 1.00 . A B . 46 TRP HD1 1 1 10 8238 1 1 46 TRP HE1 H -11.324 5.213 9.627 1.00 . A B . 46 TRP HE1 1 1 10 8239 1 1 46 TRP HE3 H -6.047 5.993 9.278 1.00 . A B . 46 TRP HE3 1 1 10 8240 1 1 46 TRP HH2 H -8.639 9.374 9.296 1.00 . A B . 46 TRP HH2 1 1 10 8241 1 1 46 TRP HZ2 H -10.628 7.938 9.480 1.00 . A B . 46 TRP HZ2 1 1 10 8242 1 1 46 TRP HZ3 H -6.402 8.426 9.200 1.00 . A B . 46 TRP HZ3 1 1 10 8243 1 1 46 TRP N N -6.386 3.757 7.255 1.00 . A B . 46 TRP N 1 1 10 8244 1 1 46 TRP NE1 N -10.349 5.108 9.571 1.00 . A B . 46 TRP NE1 1 1 10 8245 1 1 46 TRP O O -8.734 1.164 8.046 1.00 . A B . 46 TRP O 1 1 10 8246 1 1 47 ASN C C -8.257 0.583 4.082 1.00 . A B . 47 ASN C 1 1 10 8247 1 1 47 ASN CA C -8.958 1.206 5.280 1.00 . A B . 47 ASN CA 1 1 10 8248 1 1 47 ASN CB C -10.068 2.158 4.810 1.00 . A B . 47 ASN CB 1 1 10 8249 1 1 47 ASN CG C -11.087 1.495 3.892 1.00 . A B . 47 ASN CG 1 1 10 8250 1 1 47 ASN H H -7.316 2.488 5.618 1.00 . A B . 47 ASN H 1 1 10 8251 1 1 47 ASN HA H -9.385 0.427 5.894 1.00 . A B . 47 ASN HA 1 1 10 8252 1 1 47 ASN HB2 H -10.590 2.543 5.674 1.00 . A B . 47 ASN HB2 1 1 10 8253 1 1 47 ASN HB3 H -9.618 2.981 4.276 1.00 . A B . 47 ASN HB3 1 1 10 8254 1 1 47 ASN HD21 H -11.082 -0.172 4.983 1.00 . A B . 47 ASN HD21 1 1 10 8255 1 1 47 ASN HD22 H -12.123 -0.177 3.601 1.00 . A B . 47 ASN HD22 1 1 10 8256 1 1 47 ASN N N -7.978 1.929 6.079 1.00 . A B . 47 ASN N 1 1 10 8257 1 1 47 ASN ND2 N -11.468 0.259 4.189 1.00 . A B . 47 ASN ND2 1 1 10 8258 1 1 47 ASN O O -7.495 1.260 3.392 1.00 . A B . 47 ASN O 1 1 10 8259 1 1 47 ASN OD1 O -11.549 2.110 2.932 1.00 . A B . 47 ASN OD1 1 1 10 8260 1 1 48 CYS C C -8.609 -1.175 1.446 1.00 . A B . 48 CYS C 1 1 10 8261 1 1 48 CYS CA C -7.825 -1.374 2.740 1.00 . A B . 48 CYS CA 1 1 10 8262 1 1 48 CYS CB C -7.669 -2.874 3.048 1.00 . A B . 48 CYS CB 1 1 10 8263 1 1 48 CYS H H -9.153 -1.186 4.376 1.00 . A B . 48 CYS H 1 1 10 8264 1 1 48 CYS HA H -6.848 -0.928 2.629 1.00 . A B . 48 CYS HA 1 1 10 8265 1 1 48 CYS HB2 H -7.232 -2.992 4.028 1.00 . A B . 48 CYS HB2 1 1 10 8266 1 1 48 CYS HB3 H -8.643 -3.341 3.035 1.00 . A B . 48 CYS HB3 1 1 10 8267 1 1 48 CYS N N -8.497 -0.698 3.833 1.00 . A B . 48 CYS N 1 1 10 8268 1 1 48 CYS O O -9.772 -1.572 1.344 1.00 . A B . 48 CYS O 1 1 10 8269 1 1 48 CYS SG S -6.616 -3.756 1.867 1.00 . A B . 48 CYS SG 1 1 10 8270 1 1 49 ILE C C -8.669 -1.553 -1.701 1.00 . A B . 49 ILE C 1 1 10 8271 1 1 49 ILE CA C -8.618 -0.313 -0.823 1.00 . A B . 49 ILE CA 1 1 10 8272 1 1 49 ILE CB C -7.952 0.844 -1.608 1.00 . A B . 49 ILE CB 1 1 10 8273 1 1 49 ILE CD1 C -5.755 1.660 -2.613 1.00 . A B . 49 ILE CD1 1 1 10 8274 1 1 49 ILE CG1 C -6.434 0.659 -1.700 1.00 . A B . 49 ILE CG1 1 1 10 8275 1 1 49 ILE CG2 C -8.288 2.183 -0.968 1.00 . A B . 49 ILE CG2 1 1 10 8276 1 1 49 ILE H H -7.026 -0.306 0.581 1.00 . A B . 49 ILE H 1 1 10 8277 1 1 49 ILE HA H -9.634 -0.018 -0.600 1.00 . A B . 49 ILE HA 1 1 10 8278 1 1 49 ILE HB H -8.362 0.844 -2.606 1.00 . A B . 49 ILE HB 1 1 10 8279 1 1 49 ILE HD11 H -5.950 2.663 -2.258 1.00 . A B . 49 ILE HD11 1 1 10 8280 1 1 49 ILE HD12 H -6.140 1.554 -3.616 1.00 . A B . 49 ILE HD12 1 1 10 8281 1 1 49 ILE HD13 H -4.689 1.482 -2.615 1.00 . A B . 49 ILE HD13 1 1 10 8282 1 1 49 ILE HG12 H -6.009 0.772 -0.717 1.00 . A B . 49 ILE HG12 1 1 10 8283 1 1 49 ILE HG13 H -6.220 -0.332 -2.072 1.00 . A B . 49 ILE HG13 1 1 10 8284 1 1 49 ILE HG21 H -9.351 2.361 -1.037 1.00 . A B . 49 ILE HG21 1 1 10 8285 1 1 49 ILE HG22 H -7.757 2.971 -1.481 1.00 . A B . 49 ILE HG22 1 1 10 8286 1 1 49 ILE HG23 H -7.994 2.170 0.071 1.00 . A B . 49 ILE HG23 1 1 10 8287 1 1 49 ILE N N -7.961 -0.585 0.449 1.00 . A B . 49 ILE N 1 1 10 8288 1 1 49 ILE O O -9.588 -1.715 -2.494 1.00 . A B . 49 ILE O 1 1 10 8289 1 1 50 PHE C C -8.659 -4.680 -1.867 1.00 . A B . 50 PHE C 1 1 10 8290 1 1 50 PHE CA C -7.648 -3.652 -2.353 1.00 . A B . 50 PHE CA 1 1 10 8291 1 1 50 PHE CB C -6.234 -4.234 -2.431 1.00 . A B . 50 PHE CB 1 1 10 8292 1 1 50 PHE CD1 C -4.898 -2.465 -3.617 1.00 . A B . 50 PHE CD1 1 1 10 8293 1 1 50 PHE CD2 C -5.393 -4.484 -4.782 1.00 . A B . 50 PHE CD2 1 1 10 8294 1 1 50 PHE CE1 C -4.234 -1.984 -4.728 1.00 . A B . 50 PHE CE1 1 1 10 8295 1 1 50 PHE CE2 C -4.735 -4.007 -5.898 1.00 . A B . 50 PHE CE2 1 1 10 8296 1 1 50 PHE CG C -5.483 -3.720 -3.630 1.00 . A B . 50 PHE CG 1 1 10 8297 1 1 50 PHE CZ C -4.153 -2.757 -5.871 1.00 . A B . 50 PHE CZ 1 1 10 8298 1 1 50 PHE H H -7.046 -2.314 -0.822 1.00 . A B . 50 PHE H 1 1 10 8299 1 1 50 PHE HA H -7.945 -3.357 -3.352 1.00 . A B . 50 PHE HA 1 1 10 8300 1 1 50 PHE HB2 H -5.679 -3.964 -1.542 1.00 . A B . 50 PHE HB2 1 1 10 8301 1 1 50 PHE HB3 H -6.291 -5.311 -2.507 1.00 . A B . 50 PHE HB3 1 1 10 8302 1 1 50 PHE HD1 H -4.957 -1.861 -2.727 1.00 . A B . 50 PHE HD1 1 1 10 8303 1 1 50 PHE HD2 H -5.843 -5.464 -4.803 1.00 . A B . 50 PHE HD2 1 1 10 8304 1 1 50 PHE HE1 H -3.782 -1.004 -4.705 1.00 . A B . 50 PHE HE1 1 1 10 8305 1 1 50 PHE HE2 H -4.673 -4.614 -6.789 1.00 . A B . 50 PHE HE2 1 1 10 8306 1 1 50 PHE HZ H -3.641 -2.382 -6.745 1.00 . A B . 50 PHE HZ 1 1 10 8307 1 1 50 PHE N N -7.700 -2.445 -1.538 1.00 . A B . 50 PHE N 1 1 10 8308 1 1 50 PHE O O -9.179 -5.462 -2.656 1.00 . A B . 50 PHE O 1 1 10 8309 1 1 51 CYS C C -11.353 -5.116 -0.564 1.00 . A B . 51 CYS C 1 1 10 8310 1 1 51 CYS CA C -9.986 -5.545 -0.033 1.00 . A B . 51 CYS CA 1 1 10 8311 1 1 51 CYS CB C -9.989 -5.542 1.498 1.00 . A B . 51 CYS CB 1 1 10 8312 1 1 51 CYS H H -8.447 -4.083 0.031 1.00 . A B . 51 CYS H 1 1 10 8313 1 1 51 CYS HA H -9.786 -6.550 -0.381 1.00 . A B . 51 CYS HA 1 1 10 8314 1 1 51 CYS HB2 H -9.685 -4.570 1.852 1.00 . A B . 51 CYS HB2 1 1 10 8315 1 1 51 CYS HB3 H -10.991 -5.748 1.848 1.00 . A B . 51 CYS HB3 1 1 10 8316 1 1 51 CYS N N -8.939 -4.681 -0.569 1.00 . A B . 51 CYS N 1 1 10 8317 1 1 51 CYS O O -12.167 -5.955 -0.950 1.00 . A B . 51 CYS O 1 1 10 8318 1 1 51 CYS SG S -8.887 -6.767 2.240 1.00 . A B . 51 CYS SG 1 1 10 8319 1 1 52 ARG C C -12.856 -3.333 -2.659 1.00 . A B . 52 ARG C 1 1 10 8320 1 1 52 ARG CA C -12.848 -3.279 -1.130 1.00 . A B . 52 ARG CA 1 1 10 8321 1 1 52 ARG CB C -13.065 -1.830 -0.670 1.00 . A B . 52 ARG CB 1 1 10 8322 1 1 52 ARG CD C -14.520 -2.252 1.370 1.00 . A B . 52 ARG CD 1 1 10 8323 1 1 52 ARG CG C -13.221 -1.650 0.839 1.00 . A B . 52 ARG CG 1 1 10 8324 1 1 52 ARG CZ C -15.465 -4.508 1.011 1.00 . A B . 52 ARG CZ 1 1 10 8325 1 1 52 ARG H H -10.955 -3.188 -0.190 1.00 . A B . 52 ARG H 1 1 10 8326 1 1 52 ARG HA H -13.653 -3.891 -0.758 1.00 . A B . 52 ARG HA 1 1 10 8327 1 1 52 ARG HB2 H -12.220 -1.237 -0.990 1.00 . A B . 52 ARG HB2 1 1 10 8328 1 1 52 ARG HB3 H -13.953 -1.447 -1.149 1.00 . A B . 52 ARG HB3 1 1 10 8329 1 1 52 ARG HD2 H -14.695 -1.869 2.364 1.00 . A B . 52 ARG HD2 1 1 10 8330 1 1 52 ARG HD3 H -15.331 -1.949 0.725 1.00 . A B . 52 ARG HD3 1 1 10 8331 1 1 52 ARG HE H -13.677 -4.120 1.824 1.00 . A B . 52 ARG HE 1 1 10 8332 1 1 52 ARG HG2 H -12.390 -2.127 1.337 1.00 . A B . 52 ARG HG2 1 1 10 8333 1 1 52 ARG HG3 H -13.209 -0.592 1.063 1.00 . A B . 52 ARG HG3 1 1 10 8334 1 1 52 ARG HH11 H -16.678 -2.999 0.405 1.00 . A B . 52 ARG HH11 1 1 10 8335 1 1 52 ARG HH12 H -17.306 -4.599 0.170 1.00 . A B . 52 ARG HH12 1 1 10 8336 1 1 52 ARG HH21 H -14.524 -6.224 1.535 1.00 . A B . 52 ARG HH21 1 1 10 8337 1 1 52 ARG HH22 H -16.081 -6.428 0.799 1.00 . A B . 52 ARG HH22 1 1 10 8338 1 1 52 ARG N N -11.599 -3.811 -0.586 1.00 . A B . 52 ARG N 1 1 10 8339 1 1 52 ARG NE N -14.481 -3.712 1.431 1.00 . A B . 52 ARG NE 1 1 10 8340 1 1 52 ARG NH1 N -16.571 -3.992 0.487 1.00 . A B . 52 ARG NH1 1 1 10 8341 1 1 52 ARG NH2 N -15.347 -5.825 1.126 1.00 . A B . 52 ARG NH2 1 1 10 8342 1 1 52 ARG O O -13.890 -3.130 -3.294 1.00 . A B . 52 ARG O 1 1 10 8343 1 1 53 MET C C -11.211 -5.075 -5.126 1.00 . A B . 53 MET C 1 1 10 8344 1 1 53 MET CA C -11.572 -3.658 -4.696 1.00 . A B . 53 MET CA 1 1 10 8345 1 1 53 MET CB C -10.511 -2.661 -5.180 1.00 . A B . 53 MET CB 1 1 10 8346 1 1 53 MET CE C -11.739 -1.338 -8.939 1.00 . A B . 53 MET CE 1 1 10 8347 1 1 53 MET CG C -10.548 -2.395 -6.676 1.00 . A B . 53 MET CG 1 1 10 8348 1 1 53 MET H H -10.915 -3.781 -2.685 1.00 . A B . 53 MET H 1 1 10 8349 1 1 53 MET HA H -12.526 -3.397 -5.125 1.00 . A B . 53 MET HA 1 1 10 8350 1 1 53 MET HB2 H -10.659 -1.722 -4.668 1.00 . A B . 53 MET HB2 1 1 10 8351 1 1 53 MET HB3 H -9.534 -3.046 -4.929 1.00 . A B . 53 MET HB3 1 1 10 8352 1 1 53 MET HE1 H -11.524 -2.279 -9.422 1.00 . A B . 53 MET HE1 1 1 10 8353 1 1 53 MET HE2 H -10.886 -0.681 -9.030 1.00 . A B . 53 MET HE2 1 1 10 8354 1 1 53 MET HE3 H -12.597 -0.880 -9.408 1.00 . A B . 53 MET HE3 1 1 10 8355 1 1 53 MET HG2 H -9.728 -1.741 -6.932 1.00 . A B . 53 MET HG2 1 1 10 8356 1 1 53 MET HG3 H -10.435 -3.334 -7.195 1.00 . A B . 53 MET HG3 1 1 10 8357 1 1 53 MET N N -11.700 -3.603 -3.245 1.00 . A B . 53 MET N 1 1 10 8358 1 1 53 MET O O -10.492 -5.291 -6.100 1.00 . A B . 53 MET O 1 1 10 8359 1 1 53 MET SD S -12.090 -1.624 -7.205 1.00 . A B . 53 MET SD 1 1 10 8360 1 1 54 LYS C C -12.716 -8.113 -5.171 1.00 . A B . 54 LYS C 1 1 10 8361 1 1 54 LYS CA C -11.452 -7.442 -4.647 1.00 . A B . 54 LYS CA 1 1 10 8362 1 1 54 LYS CB C -10.954 -8.139 -3.373 1.00 . A B . 54 LYS CB 1 1 10 8363 1 1 54 LYS CD C -10.136 -10.259 -2.269 1.00 . A B . 54 LYS CD 1 1 10 8364 1 1 54 LYS CE C -11.139 -10.124 -1.129 1.00 . A B . 54 LYS CE 1 1 10 8365 1 1 54 LYS CG C -10.639 -9.619 -3.557 1.00 . A B . 54 LYS CG 1 1 10 8366 1 1 54 LYS H H -12.315 -5.803 -3.640 1.00 . A B . 54 LYS H 1 1 10 8367 1 1 54 LYS HA H -10.686 -7.493 -5.406 1.00 . A B . 54 LYS HA 1 1 10 8368 1 1 54 LYS HB2 H -10.059 -7.640 -3.029 1.00 . A B . 54 LYS HB2 1 1 10 8369 1 1 54 LYS HB3 H -11.715 -8.050 -2.615 1.00 . A B . 54 LYS HB3 1 1 10 8370 1 1 54 LYS HD2 H -9.954 -11.306 -2.449 1.00 . A B . 54 LYS HD2 1 1 10 8371 1 1 54 LYS HD3 H -9.212 -9.778 -1.981 1.00 . A B . 54 LYS HD3 1 1 10 8372 1 1 54 LYS HE2 H -10.747 -10.638 -0.264 1.00 . A B . 54 LYS HE2 1 1 10 8373 1 1 54 LYS HE3 H -11.261 -9.076 -0.897 1.00 . A B . 54 LYS HE3 1 1 10 8374 1 1 54 LYS HG2 H -11.537 -10.130 -3.868 1.00 . A B . 54 LYS HG2 1 1 10 8375 1 1 54 LYS HG3 H -9.882 -9.727 -4.320 1.00 . A B . 54 LYS HG3 1 1 10 8376 1 1 54 LYS HZ1 H -12.885 -10.196 -2.276 1.00 . A B . 54 LYS HZ1 1 1 10 8377 1 1 54 LYS HZ2 H -13.111 -10.621 -0.655 1.00 . A B . 54 LYS HZ2 1 1 10 8378 1 1 54 LYS HZ3 H -12.370 -11.708 -1.719 1.00 . A B . 54 LYS HZ3 1 1 10 8379 1 1 54 LYS N N -11.722 -6.040 -4.381 1.00 . A B . 54 LYS N 1 1 10 8380 1 1 54 LYS NZ N -12.468 -10.702 -1.470 1.00 . A B . 54 LYS NZ 1 1 10 8381 1 1 54 LYS O O -13.445 -8.775 -4.429 1.00 . A B . 54 LYS O 1 1 10 8382 1 1 55 GLU C C -13.863 -8.920 -8.491 1.00 . A B . 55 GLU C 1 1 10 8383 1 1 55 GLU CA C -14.177 -8.442 -7.077 1.00 . A B . 55 GLU CA 1 1 10 8384 1 1 55 GLU CB C -15.261 -7.367 -7.098 1.00 . A B . 55 GLU CB 1 1 10 8385 1 1 55 GLU CD C -17.621 -6.717 -7.660 1.00 . A B . 55 GLU CD 1 1 10 8386 1 1 55 GLU CG C -16.601 -7.834 -7.638 1.00 . A B . 55 GLU CG 1 1 10 8387 1 1 55 GLU H H -12.347 -7.398 -6.994 1.00 . A B . 55 GLU H 1 1 10 8388 1 1 55 GLU HA H -14.522 -9.279 -6.491 1.00 . A B . 55 GLU HA 1 1 10 8389 1 1 55 GLU HB2 H -15.413 -7.013 -6.091 1.00 . A B . 55 GLU HB2 1 1 10 8390 1 1 55 GLU HB3 H -14.919 -6.546 -7.708 1.00 . A B . 55 GLU HB3 1 1 10 8391 1 1 55 GLU HG2 H -16.465 -8.201 -8.644 1.00 . A B . 55 GLU HG2 1 1 10 8392 1 1 55 GLU HG3 H -16.972 -8.630 -7.010 1.00 . A B . 55 GLU HG3 1 1 10 8393 1 1 55 GLU N N -12.980 -7.915 -6.451 1.00 . A B . 55 GLU N 1 1 10 8394 1 1 55 GLU O O -14.124 -8.225 -9.472 1.00 . A B . 55 GLU O 1 1 10 8395 1 1 55 GLU OE1 O -17.635 -5.943 -8.639 1.00 . A B . 55 GLU OE1 1 1 10 8396 1 1 55 GLU OE2 O -18.403 -6.599 -6.694 1.00 . A B . 55 GLU OE2 1 1 10 8397 1 1 56 SER C C -12.947 -12.209 -9.730 1.00 . A B . 56 SER C 1 1 10 8398 1 1 56 SER CA C -12.958 -10.692 -9.865 1.00 . A B . 56 SER CA 1 1 10 8399 1 1 56 SER CB C -11.606 -10.183 -10.379 1.00 . A B . 56 SER CB 1 1 10 8400 1 1 56 SER H H -13.041 -10.583 -7.763 1.00 . A B . 56 SER H 1 1 10 8401 1 1 56 SER HA H -13.733 -10.409 -10.561 1.00 . A B . 56 SER HA 1 1 10 8402 1 1 56 SER HB2 H -11.553 -9.113 -10.246 1.00 . A B . 56 SER HB2 1 1 10 8403 1 1 56 SER HB3 H -10.811 -10.654 -9.820 1.00 . A B . 56 SER HB3 1 1 10 8404 1 1 56 SER HG H -11.041 -11.359 -11.850 1.00 . A B . 56 SER HG 1 1 10 8405 1 1 56 SER N N -13.274 -10.097 -8.582 1.00 . A B . 56 SER N 1 1 10 8406 1 1 56 SER O O -11.934 -12.761 -9.249 1.00 . A B . 56 SER O 1 1 10 8407 1 1 56 SER OXT O -13.961 -12.840 -10.092 1.00 . A B . 56 SER OXT 1 1 10 8408 1 1 56 SER OG O -11.434 -10.480 -11.757 1.00 . A B . 56 SER OG 1 1 10 8409 2 2 1 ZN ZN ZN -6.701 -6.039 2.189 1.00 . B B . 101 ZN ZN 1 1 10 8410 3 2 1 ZN ZN ZN 5.808 1.032 0.194 1.00 . C B . 102 ZN ZN 1 1 11 8411 1 1 1 GLY C C 19.553 -7.255 4.330 1.00 . A B . 1 GLY C 1 1 11 8412 1 1 1 GLY CA C 19.418 -6.941 5.803 1.00 . A B . 1 GLY CA 1 1 11 8413 1 1 1 GLY H1 H 17.473 -6.203 5.721 1.00 . A B . 1 GLY H1 1 1 11 8414 1 1 1 GLY H2 H 17.936 -6.741 7.254 1.00 . A B . 1 GLY H2 1 1 11 8415 1 1 1 GLY H3 H 17.566 -7.859 6.043 1.00 . A B . 1 GLY H3 1 1 11 8416 1 1 1 GLY HA2 H 19.847 -5.970 5.996 1.00 . A B . 1 GLY HA2 1 1 11 8417 1 1 1 GLY HA3 H 19.956 -7.684 6.374 1.00 . A B . 1 GLY HA3 1 1 11 8418 1 1 1 GLY N N 18.001 -6.935 6.237 1.00 . A B . 1 GLY N 1 1 11 8419 1 1 1 GLY O O 19.637 -8.420 3.942 1.00 . A B . 1 GLY O 1 1 11 8420 1 1 2 ALA C C 20.565 -5.317 1.463 1.00 . A B . 2 ALA C 1 1 11 8421 1 1 2 ALA CA C 19.666 -6.390 2.063 1.00 . A B . 2 ALA CA 1 1 11 8422 1 1 2 ALA CB C 18.283 -6.354 1.423 1.00 . A B . 2 ALA CB 1 1 11 8423 1 1 2 ALA H H 19.488 -5.312 3.874 1.00 . A B . 2 ALA H 1 1 11 8424 1 1 2 ALA HA H 20.101 -7.361 1.872 1.00 . A B . 2 ALA HA 1 1 11 8425 1 1 2 ALA HB1 H 17.659 -7.114 1.869 1.00 . A B . 2 ALA HB1 1 1 11 8426 1 1 2 ALA HB2 H 18.371 -6.537 0.362 1.00 . A B . 2 ALA HB2 1 1 11 8427 1 1 2 ALA HB3 H 17.838 -5.383 1.584 1.00 . A B . 2 ALA HB3 1 1 11 8428 1 1 2 ALA N N 19.559 -6.221 3.504 1.00 . A B . 2 ALA N 1 1 11 8429 1 1 2 ALA O O 20.162 -4.597 0.547 1.00 . A B . 2 ALA O 1 1 11 8430 1 1 3 MET C C 22.322 -2.820 1.775 1.00 . A B . 3 MET C 1 1 11 8431 1 1 3 MET CA C 22.778 -4.258 1.517 1.00 . A B . 3 MET CA 1 1 11 8432 1 1 3 MET CB C 23.067 -4.499 0.023 1.00 . A B . 3 MET CB 1 1 11 8433 1 1 3 MET CE C 23.132 -3.883 -3.093 1.00 . A B . 3 MET CE 1 1 11 8434 1 1 3 MET CG C 24.212 -3.663 -0.538 1.00 . A B . 3 MET CG 1 1 11 8435 1 1 3 MET H H 22.003 -5.775 2.777 1.00 . A B . 3 MET H 1 1 11 8436 1 1 3 MET HA H 23.684 -4.433 2.077 1.00 . A B . 3 MET HA 1 1 11 8437 1 1 3 MET HB2 H 23.310 -5.541 -0.120 1.00 . A B . 3 MET HB2 1 1 11 8438 1 1 3 MET HB3 H 22.174 -4.270 -0.541 1.00 . A B . 3 MET HB3 1 1 11 8439 1 1 3 MET HE1 H 22.370 -4.534 -2.692 1.00 . A B . 3 MET HE1 1 1 11 8440 1 1 3 MET HE2 H 23.274 -4.095 -4.143 1.00 . A B . 3 MET HE2 1 1 11 8441 1 1 3 MET HE3 H 22.826 -2.855 -2.974 1.00 . A B . 3 MET HE3 1 1 11 8442 1 1 3 MET HG2 H 23.912 -2.626 -0.553 1.00 . A B . 3 MET HG2 1 1 11 8443 1 1 3 MET HG3 H 25.074 -3.778 0.103 1.00 . A B . 3 MET HG3 1 1 11 8444 1 1 3 MET N N 21.777 -5.205 2.008 1.00 . A B . 3 MET N 1 1 11 8445 1 1 3 MET O O 22.094 -2.040 0.846 1.00 . A B . 3 MET O 1 1 11 8446 1 1 3 MET SD S 24.671 -4.153 -2.215 1.00 . A B . 3 MET SD 1 1 11 8447 1 1 4 GLY C C 21.084 -1.166 4.798 1.00 . A B . 4 GLY C 1 1 11 8448 1 1 4 GLY CA C 21.759 -1.156 3.442 1.00 . A B . 4 GLY CA 1 1 11 8449 1 1 4 GLY H H 22.342 -3.163 3.744 1.00 . A B . 4 GLY H 1 1 11 8450 1 1 4 GLY HA2 H 22.627 -0.513 3.481 1.00 . A B . 4 GLY HA2 1 1 11 8451 1 1 4 GLY HA3 H 21.067 -0.773 2.707 1.00 . A B . 4 GLY HA3 1 1 11 8452 1 1 4 GLY N N 22.175 -2.487 3.052 1.00 . A B . 4 GLY N 1 1 11 8453 1 1 4 GLY O O 21.304 -2.081 5.593 1.00 . A B . 4 GLY O 1 1 11 8454 1 1 5 MET C C 18.014 -0.142 6.008 1.00 . A B . 5 MET C 1 1 11 8455 1 1 5 MET CA C 19.504 -0.105 6.312 1.00 . A B . 5 MET CA 1 1 11 8456 1 1 5 MET CB C 19.851 1.144 7.132 1.00 . A B . 5 MET CB 1 1 11 8457 1 1 5 MET CE C 20.284 2.737 9.868 1.00 . A B . 5 MET CE 1 1 11 8458 1 1 5 MET CG C 21.196 1.057 7.842 1.00 . A B . 5 MET CG 1 1 11 8459 1 1 5 MET H H 20.171 0.570 4.416 1.00 . A B . 5 MET H 1 1 11 8460 1 1 5 MET HA H 19.758 -0.982 6.888 1.00 . A B . 5 MET HA 1 1 11 8461 1 1 5 MET HB2 H 19.872 2.000 6.472 1.00 . A B . 5 MET HB2 1 1 11 8462 1 1 5 MET HB3 H 19.083 1.296 7.877 1.00 . A B . 5 MET HB3 1 1 11 8463 1 1 5 MET HE1 H 20.263 1.870 10.512 1.00 . A B . 5 MET HE1 1 1 11 8464 1 1 5 MET HE2 H 19.349 2.808 9.332 1.00 . A B . 5 MET HE2 1 1 11 8465 1 1 5 MET HE3 H 20.423 3.626 10.466 1.00 . A B . 5 MET HE3 1 1 11 8466 1 1 5 MET HG2 H 21.153 0.257 8.566 1.00 . A B . 5 MET HG2 1 1 11 8467 1 1 5 MET HG3 H 21.961 0.838 7.113 1.00 . A B . 5 MET HG3 1 1 11 8468 1 1 5 MET N N 20.270 -0.155 5.070 1.00 . A B . 5 MET N 1 1 11 8469 1 1 5 MET O O 17.344 -1.142 6.258 1.00 . A B . 5 MET O 1 1 11 8470 1 1 5 MET SD S 21.638 2.584 8.702 1.00 . A B . 5 MET SD 1 1 11 8471 1 1 6 ARG C C 16.056 1.089 3.506 1.00 . A B . 6 ARG C 1 1 11 8472 1 1 6 ARG CA C 16.114 0.993 5.020 1.00 . A B . 6 ARG CA 1 1 11 8473 1 1 6 ARG CB C 15.371 2.175 5.648 1.00 . A B . 6 ARG CB 1 1 11 8474 1 1 6 ARG CD C 14.442 3.254 7.715 1.00 . A B . 6 ARG CD 1 1 11 8475 1 1 6 ARG CG C 15.247 2.091 7.160 1.00 . A B . 6 ARG CG 1 1 11 8476 1 1 6 ARG CZ C 13.354 3.857 9.842 1.00 . A B . 6 ARG CZ 1 1 11 8477 1 1 6 ARG H H 18.064 1.740 5.337 1.00 . A B . 6 ARG H 1 1 11 8478 1 1 6 ARG HA H 15.638 0.072 5.327 1.00 . A B . 6 ARG HA 1 1 11 8479 1 1 6 ARG HB2 H 15.896 3.087 5.402 1.00 . A B . 6 ARG HB2 1 1 11 8480 1 1 6 ARG HB3 H 14.378 2.219 5.228 1.00 . A B . 6 ARG HB3 1 1 11 8481 1 1 6 ARG HD2 H 14.971 4.173 7.513 1.00 . A B . 6 ARG HD2 1 1 11 8482 1 1 6 ARG HD3 H 13.480 3.278 7.223 1.00 . A B . 6 ARG HD3 1 1 11 8483 1 1 6 ARG HE H 14.779 2.471 9.635 1.00 . A B . 6 ARG HE 1 1 11 8484 1 1 6 ARG HG2 H 14.751 1.169 7.422 1.00 . A B . 6 ARG HG2 1 1 11 8485 1 1 6 ARG HG3 H 16.235 2.108 7.595 1.00 . A B . 6 ARG HG3 1 1 11 8486 1 1 6 ARG HH11 H 12.704 4.917 8.241 1.00 . A B . 6 ARG HH11 1 1 11 8487 1 1 6 ARG HH12 H 11.953 5.320 9.749 1.00 . A B . 6 ARG HH12 1 1 11 8488 1 1 6 ARG HH21 H 13.779 2.975 11.614 1.00 . A B . 6 ARG HH21 1 1 11 8489 1 1 6 ARG HH22 H 12.558 4.209 11.674 1.00 . A B . 6 ARG HH22 1 1 11 8490 1 1 6 ARG N N 17.498 0.947 5.457 1.00 . A B . 6 ARG N 1 1 11 8491 1 1 6 ARG NE N 14.233 3.134 9.154 1.00 . A B . 6 ARG NE 1 1 11 8492 1 1 6 ARG NH1 N 12.610 4.769 9.228 1.00 . A B . 6 ARG NH1 1 1 11 8493 1 1 6 ARG NH2 N 13.218 3.665 11.148 1.00 . A B . 6 ARG NH2 1 1 11 8494 1 1 6 ARG O O 15.592 2.083 2.948 1.00 . A B . 6 ARG O 1 1 11 8495 1 1 7 ASN C C 15.199 -0.369 0.853 1.00 . A B . 7 ASN C 1 1 11 8496 1 1 7 ASN CA C 16.571 0.026 1.388 1.00 . A B . 7 ASN CA 1 1 11 8497 1 1 7 ASN CB C 17.663 -0.924 0.875 1.00 . A B . 7 ASN CB 1 1 11 8498 1 1 7 ASN CG C 18.013 -0.679 -0.586 1.00 . A B . 7 ASN CG 1 1 11 8499 1 1 7 ASN H H 16.869 -0.726 3.347 1.00 . A B . 7 ASN H 1 1 11 8500 1 1 7 ASN HA H 16.792 1.028 1.051 1.00 . A B . 7 ASN HA 1 1 11 8501 1 1 7 ASN HB2 H 18.558 -0.785 1.464 1.00 . A B . 7 ASN HB2 1 1 11 8502 1 1 7 ASN HB3 H 17.325 -1.944 0.980 1.00 . A B . 7 ASN HB3 1 1 11 8503 1 1 7 ASN HD21 H 16.708 -2.050 -1.180 1.00 . A B . 7 ASN HD21 1 1 11 8504 1 1 7 ASN HD22 H 17.578 -1.249 -2.436 1.00 . A B . 7 ASN HD22 1 1 11 8505 1 1 7 ASN N N 16.539 0.050 2.844 1.00 . A B . 7 ASN N 1 1 11 8506 1 1 7 ASN ND2 N 17.370 -1.398 -1.489 1.00 . A B . 7 ASN ND2 1 1 11 8507 1 1 7 ASN O O 14.890 -0.168 -0.321 1.00 . A B . 7 ASN O 1 1 11 8508 1 1 7 ASN OD1 O 18.871 0.147 -0.897 1.00 . A B . 7 ASN OD1 1 1 11 8509 1 1 8 LEU C C 12.752 -2.231 0.392 1.00 . A B . 8 LEU C 1 1 11 8510 1 1 8 LEU CA C 12.964 -1.187 1.488 1.00 . A B . 8 LEU CA 1 1 11 8511 1 1 8 LEU CB C 12.262 0.124 1.111 1.00 . A B . 8 LEU CB 1 1 11 8512 1 1 8 LEU CD1 C 11.775 2.537 1.597 1.00 . A B . 8 LEU CD1 1 1 11 8513 1 1 8 LEU CD2 C 11.695 0.870 3.454 1.00 . A B . 8 LEU CD2 1 1 11 8514 1 1 8 LEU CG C 12.377 1.254 2.146 1.00 . A B . 8 LEU CG 1 1 11 8515 1 1 8 LEU H H 14.756 -1.194 2.618 1.00 . A B . 8 LEU H 1 1 11 8516 1 1 8 LEU HA H 12.524 -1.560 2.399 1.00 . A B . 8 LEU HA 1 1 11 8517 1 1 8 LEU HB2 H 12.683 0.472 0.180 1.00 . A B . 8 LEU HB2 1 1 11 8518 1 1 8 LEU HB3 H 11.215 -0.083 0.957 1.00 . A B . 8 LEU HB3 1 1 11 8519 1 1 8 LEU HD11 H 11.812 3.306 2.355 1.00 . A B . 8 LEU HD11 1 1 11 8520 1 1 8 LEU HD12 H 10.748 2.361 1.314 1.00 . A B . 8 LEU HD12 1 1 11 8521 1 1 8 LEU HD13 H 12.335 2.858 0.732 1.00 . A B . 8 LEU HD13 1 1 11 8522 1 1 8 LEU HD21 H 11.687 1.720 4.118 1.00 . A B . 8 LEU HD21 1 1 11 8523 1 1 8 LEU HD22 H 12.236 0.059 3.919 1.00 . A B . 8 LEU HD22 1 1 11 8524 1 1 8 LEU HD23 H 10.681 0.557 3.254 1.00 . A B . 8 LEU HD23 1 1 11 8525 1 1 8 LEU HG H 13.422 1.439 2.353 1.00 . A B . 8 LEU HG 1 1 11 8526 1 1 8 LEU N N 14.383 -0.935 1.748 1.00 . A B . 8 LEU N 1 1 11 8527 1 1 8 LEU O O 13.692 -2.885 -0.065 1.00 . A B . 8 LEU O 1 1 11 8528 1 1 9 ASP C C 11.261 -2.737 -2.437 1.00 . A B . 9 ASP C 1 1 11 8529 1 1 9 ASP CA C 11.100 -3.342 -1.039 1.00 . A B . 9 ASP CA 1 1 11 8530 1 1 9 ASP CB C 9.650 -3.796 -0.798 1.00 . A B . 9 ASP CB 1 1 11 8531 1 1 9 ASP CG C 9.190 -4.895 -1.746 1.00 . A B . 9 ASP CG 1 1 11 8532 1 1 9 ASP H H 10.803 -1.817 0.390 1.00 . A B . 9 ASP H 1 1 11 8533 1 1 9 ASP HA H 11.752 -4.198 -0.956 1.00 . A B . 9 ASP HA 1 1 11 8534 1 1 9 ASP HB2 H 9.564 -4.167 0.213 1.00 . A B . 9 ASP HB2 1 1 11 8535 1 1 9 ASP HB3 H 8.996 -2.946 -0.917 1.00 . A B . 9 ASP HB3 1 1 11 8536 1 1 9 ASP N N 11.497 -2.378 -0.016 1.00 . A B . 9 ASP N 1 1 11 8537 1 1 9 ASP O O 10.701 -3.240 -3.409 1.00 . A B . 9 ASP O 1 1 11 8538 1 1 9 ASP OD1 O 9.774 -5.999 -1.720 1.00 . A B . 9 ASP OD1 1 1 11 8539 1 1 9 ASP OD2 O 8.233 -4.661 -2.521 1.00 . A B . 9 ASP OD2 1 1 11 8540 1 1 10 GLU C C 11.005 0.084 -3.923 1.00 . A B . 10 GLU C 1 1 11 8541 1 1 10 GLU CA C 12.198 -0.838 -3.735 1.00 . A B . 10 GLU CA 1 1 11 8542 1 1 10 GLU CB C 12.414 -1.713 -4.975 1.00 . A B . 10 GLU CB 1 1 11 8543 1 1 10 GLU CD C 14.934 -1.884 -4.832 1.00 . A B . 10 GLU CD 1 1 11 8544 1 1 10 GLU CG C 13.620 -2.633 -4.871 1.00 . A B . 10 GLU CG 1 1 11 8545 1 1 10 GLU H H 12.544 -1.384 -1.721 1.00 . A B . 10 GLU H 1 1 11 8546 1 1 10 GLU HA H 13.075 -0.221 -3.593 1.00 . A B . 10 GLU HA 1 1 11 8547 1 1 10 GLU HB2 H 11.537 -2.323 -5.123 1.00 . A B . 10 GLU HB2 1 1 11 8548 1 1 10 GLU HB3 H 12.547 -1.073 -5.834 1.00 . A B . 10 GLU HB3 1 1 11 8549 1 1 10 GLU HG2 H 13.530 -3.214 -3.965 1.00 . A B . 10 GLU HG2 1 1 11 8550 1 1 10 GLU HG3 H 13.625 -3.296 -5.723 1.00 . A B . 10 GLU HG3 1 1 11 8551 1 1 10 GLU N N 12.030 -1.642 -2.511 1.00 . A B . 10 GLU N 1 1 11 8552 1 1 10 GLU O O 10.594 0.394 -5.043 1.00 . A B . 10 GLU O 1 1 11 8553 1 1 10 GLU OE1 O 15.368 -1.494 -3.729 1.00 . A B . 10 GLU OE1 1 1 11 8554 1 1 10 GLU OE2 O 15.546 -1.692 -5.900 1.00 . A B . 10 GLU OE2 1 1 11 8555 1 1 11 CYS C C 9.797 2.819 -2.424 1.00 . A B . 11 CYS C 1 1 11 8556 1 1 11 CYS CA C 9.328 1.416 -2.787 1.00 . A B . 11 CYS CA 1 1 11 8557 1 1 11 CYS CB C 8.316 0.903 -1.774 1.00 . A B . 11 CYS CB 1 1 11 8558 1 1 11 CYS H H 10.846 0.229 -1.954 1.00 . A B . 11 CYS H 1 1 11 8559 1 1 11 CYS HA H 8.884 1.425 -3.768 1.00 . A B . 11 CYS HA 1 1 11 8560 1 1 11 CYS HB2 H 8.042 -0.102 -2.039 1.00 . A B . 11 CYS HB2 1 1 11 8561 1 1 11 CYS HB3 H 8.785 0.890 -0.802 1.00 . A B . 11 CYS HB3 1 1 11 8562 1 1 11 CYS N N 10.458 0.515 -2.803 1.00 . A B . 11 CYS N 1 1 11 8563 1 1 11 CYS O O 9.873 3.177 -1.246 1.00 . A B . 11 CYS O 1 1 11 8564 1 1 11 CYS SG S 6.789 1.857 -1.626 1.00 . A B . 11 CYS SG 1 1 11 8565 1 1 12 GLU C C 9.589 5.862 -2.573 1.00 . A B . 12 GLU C 1 1 11 8566 1 1 12 GLU CA C 10.621 4.959 -3.226 1.00 . A B . 12 GLU CA 1 1 11 8567 1 1 12 GLU CB C 11.116 5.572 -4.533 1.00 . A B . 12 GLU CB 1 1 11 8568 1 1 12 GLU CD C 13.563 5.192 -4.024 1.00 . A B . 12 GLU CD 1 1 11 8569 1 1 12 GLU CG C 12.434 4.982 -5.016 1.00 . A B . 12 GLU CG 1 1 11 8570 1 1 12 GLU H H 9.986 3.284 -4.355 1.00 . A B . 12 GLU H 1 1 11 8571 1 1 12 GLU HA H 11.461 4.874 -2.553 1.00 . A B . 12 GLU HA 1 1 11 8572 1 1 12 GLU HB2 H 10.369 5.415 -5.296 1.00 . A B . 12 GLU HB2 1 1 11 8573 1 1 12 GLU HB3 H 11.255 6.633 -4.389 1.00 . A B . 12 GLU HB3 1 1 11 8574 1 1 12 GLU HG2 H 12.306 3.922 -5.173 1.00 . A B . 12 GLU HG2 1 1 11 8575 1 1 12 GLU HG3 H 12.703 5.452 -5.949 1.00 . A B . 12 GLU HG3 1 1 11 8576 1 1 12 GLU N N 10.102 3.614 -3.438 1.00 . A B . 12 GLU N 1 1 11 8577 1 1 12 GLU O O 9.939 6.853 -1.935 1.00 . A B . 12 GLU O 1 1 11 8578 1 1 12 GLU OE1 O 14.221 6.254 -4.077 1.00 . A B . 12 GLU OE1 1 1 11 8579 1 1 12 GLU OE2 O 13.794 4.302 -3.180 1.00 . A B . 12 GLU OE2 1 1 11 8580 1 1 13 VAL C C 7.279 6.057 -0.565 1.00 . A B . 13 VAL C 1 1 11 8581 1 1 13 VAL CA C 7.271 6.299 -2.080 1.00 . A B . 13 VAL CA 1 1 11 8582 1 1 13 VAL CB C 5.880 6.021 -2.700 1.00 . A B . 13 VAL CB 1 1 11 8583 1 1 13 VAL CG1 C 5.525 4.552 -2.653 1.00 . A B . 13 VAL CG1 1 1 11 8584 1 1 13 VAL CG2 C 4.805 6.846 -2.012 1.00 . A B . 13 VAL CG2 1 1 11 8585 1 1 13 VAL H H 8.079 4.752 -3.270 1.00 . A B . 13 VAL H 1 1 11 8586 1 1 13 VAL HA H 7.505 7.340 -2.248 1.00 . A B . 13 VAL HA 1 1 11 8587 1 1 13 VAL HB H 5.914 6.317 -3.737 1.00 . A B . 13 VAL HB 1 1 11 8588 1 1 13 VAL HG11 H 4.605 4.391 -3.189 1.00 . A B . 13 VAL HG11 1 1 11 8589 1 1 13 VAL HG12 H 5.401 4.244 -1.625 1.00 . A B . 13 VAL HG12 1 1 11 8590 1 1 13 VAL HG13 H 6.312 3.974 -3.110 1.00 . A B . 13 VAL HG13 1 1 11 8591 1 1 13 VAL HG21 H 3.864 6.708 -2.521 1.00 . A B . 13 VAL HG21 1 1 11 8592 1 1 13 VAL HG22 H 5.081 7.890 -2.036 1.00 . A B . 13 VAL HG22 1 1 11 8593 1 1 13 VAL HG23 H 4.712 6.521 -0.987 1.00 . A B . 13 VAL HG23 1 1 11 8594 1 1 13 VAL N N 8.318 5.526 -2.722 1.00 . A B . 13 VAL N 1 1 11 8595 1 1 13 VAL O O 6.964 6.952 0.213 1.00 . A B . 13 VAL O 1 1 11 8596 1 1 14 CYS C C 9.070 5.418 1.795 1.00 . A B . 14 CYS C 1 1 11 8597 1 1 14 CYS CA C 7.899 4.589 1.280 1.00 . A B . 14 CYS CA 1 1 11 8598 1 1 14 CYS CB C 8.172 3.107 1.534 1.00 . A B . 14 CYS CB 1 1 11 8599 1 1 14 CYS H H 7.832 4.140 -0.798 1.00 . A B . 14 CYS H 1 1 11 8600 1 1 14 CYS HA H 7.006 4.878 1.811 1.00 . A B . 14 CYS HA 1 1 11 8601 1 1 14 CYS HB2 H 8.526 2.657 0.620 1.00 . A B . 14 CYS HB2 1 1 11 8602 1 1 14 CYS HB3 H 8.935 3.019 2.292 1.00 . A B . 14 CYS HB3 1 1 11 8603 1 1 14 CYS N N 7.683 4.857 -0.143 1.00 . A B . 14 CYS N 1 1 11 8604 1 1 14 CYS O O 9.093 5.840 2.951 1.00 . A B . 14 CYS O 1 1 11 8605 1 1 14 CYS SG S 6.733 2.167 2.088 1.00 . A B . 14 CYS SG 1 1 11 8606 1 1 15 ARG C C 10.702 7.929 1.469 1.00 . A B . 15 ARG C 1 1 11 8607 1 1 15 ARG CA C 11.174 6.499 1.221 1.00 . A B . 15 ARG CA 1 1 11 8608 1 1 15 ARG CB C 12.168 6.448 0.059 1.00 . A B . 15 ARG CB 1 1 11 8609 1 1 15 ARG CD C 14.283 7.243 -0.998 1.00 . A B . 15 ARG CD 1 1 11 8610 1 1 15 ARG CG C 13.421 7.283 0.253 1.00 . A B . 15 ARG CG 1 1 11 8611 1 1 15 ARG CZ C 16.552 7.892 -1.712 1.00 . A B . 15 ARG CZ 1 1 11 8612 1 1 15 ARG H H 9.959 5.243 0.026 1.00 . A B . 15 ARG H 1 1 11 8613 1 1 15 ARG HA H 11.644 6.122 2.113 1.00 . A B . 15 ARG HA 1 1 11 8614 1 1 15 ARG HB2 H 12.471 5.422 -0.091 1.00 . A B . 15 ARG HB2 1 1 11 8615 1 1 15 ARG HB3 H 11.668 6.795 -0.834 1.00 . A B . 15 ARG HB3 1 1 11 8616 1 1 15 ARG HD2 H 14.494 6.214 -1.240 1.00 . A B . 15 ARG HD2 1 1 11 8617 1 1 15 ARG HD3 H 13.729 7.695 -1.809 1.00 . A B . 15 ARG HD3 1 1 11 8618 1 1 15 ARG HE H 15.654 8.519 -0.035 1.00 . A B . 15 ARG HE 1 1 11 8619 1 1 15 ARG HG2 H 13.136 8.304 0.455 1.00 . A B . 15 ARG HG2 1 1 11 8620 1 1 15 ARG HG3 H 13.985 6.888 1.085 1.00 . A B . 15 ARG HG3 1 1 11 8621 1 1 15 ARG HH11 H 15.586 6.641 -2.996 1.00 . A B . 15 ARG HH11 1 1 11 8622 1 1 15 ARG HH12 H 17.197 7.099 -3.466 1.00 . A B . 15 ARG HH12 1 1 11 8623 1 1 15 ARG HH21 H 17.754 9.145 -0.669 1.00 . A B . 15 ARG HH21 1 1 11 8624 1 1 15 ARG HH22 H 18.425 8.535 -2.147 1.00 . A B . 15 ARG HH22 1 1 11 8625 1 1 15 ARG N N 10.029 5.653 0.914 1.00 . A B . 15 ARG N 1 1 11 8626 1 1 15 ARG NE N 15.547 7.958 -0.839 1.00 . A B . 15 ARG NE 1 1 11 8627 1 1 15 ARG NH1 N 16.437 7.154 -2.812 1.00 . A B . 15 ARG NH1 1 1 11 8628 1 1 15 ARG NH2 N 17.666 8.577 -1.492 1.00 . A B . 15 ARG NH2 1 1 11 8629 1 1 15 ARG O O 11.228 8.636 2.329 1.00 . A B . 15 ARG O 1 1 11 8630 1 1 16 ASP C C 8.154 9.655 2.116 1.00 . A B . 16 ASP C 1 1 11 8631 1 1 16 ASP CA C 9.051 9.635 0.879 1.00 . A B . 16 ASP CA 1 1 11 8632 1 1 16 ASP CB C 8.215 9.992 -0.355 1.00 . A B . 16 ASP CB 1 1 11 8633 1 1 16 ASP CG C 9.041 10.102 -1.618 1.00 . A B . 16 ASP CG 1 1 11 8634 1 1 16 ASP H H 9.413 7.757 -0.038 1.00 . A B . 16 ASP H 1 1 11 8635 1 1 16 ASP HA H 9.830 10.370 1.001 1.00 . A B . 16 ASP HA 1 1 11 8636 1 1 16 ASP HB2 H 7.469 9.226 -0.507 1.00 . A B . 16 ASP HB2 1 1 11 8637 1 1 16 ASP HB3 H 7.722 10.938 -0.183 1.00 . A B . 16 ASP HB3 1 1 11 8638 1 1 16 ASP N N 9.692 8.332 0.705 1.00 . A B . 16 ASP N 1 1 11 8639 1 1 16 ASP O O 7.632 10.703 2.499 1.00 . A B . 16 ASP O 1 1 11 8640 1 1 16 ASP OD1 O 10.079 10.796 -1.595 1.00 . A B . 16 ASP OD1 1 1 11 8641 1 1 16 ASP OD2 O 8.665 9.490 -2.640 1.00 . A B . 16 ASP OD2 1 1 11 8642 1 1 17 GLY C C 5.675 8.171 3.550 1.00 . A B . 17 GLY C 1 1 11 8643 1 1 17 GLY CA C 7.130 8.397 3.911 1.00 . A B . 17 GLY CA 1 1 11 8644 1 1 17 GLY H H 8.440 7.699 2.401 1.00 . A B . 17 GLY H 1 1 11 8645 1 1 17 GLY HA2 H 7.471 7.572 4.521 1.00 . A B . 17 GLY HA2 1 1 11 8646 1 1 17 GLY HA3 H 7.212 9.312 4.480 1.00 . A B . 17 GLY HA3 1 1 11 8647 1 1 17 GLY N N 7.978 8.495 2.737 1.00 . A B . 17 GLY N 1 1 11 8648 1 1 17 GLY O O 4.779 8.469 4.343 1.00 . A B . 17 GLY O 1 1 11 8649 1 1 18 GLY C C 3.314 6.458 2.749 1.00 . A B . 18 GLY C 1 1 11 8650 1 1 18 GLY CA C 4.100 7.408 1.870 1.00 . A B . 18 GLY CA 1 1 11 8651 1 1 18 GLY H H 6.208 7.436 1.768 1.00 . A B . 18 GLY H 1 1 11 8652 1 1 18 GLY HA2 H 3.576 8.350 1.821 1.00 . A B . 18 GLY HA2 1 1 11 8653 1 1 18 GLY HA3 H 4.157 6.992 0.878 1.00 . A B . 18 GLY HA3 1 1 11 8654 1 1 18 GLY N N 5.447 7.650 2.349 1.00 . A B . 18 GLY N 1 1 11 8655 1 1 18 GLY O O 3.872 5.527 3.336 1.00 . A B . 18 GLY O 1 1 11 8656 1 1 19 GLU C C 0.549 4.714 2.914 1.00 . A B . 19 GLU C 1 1 11 8657 1 1 19 GLU CA C 1.130 5.906 3.666 1.00 . A B . 19 GLU CA 1 1 11 8658 1 1 19 GLU CB C 0.006 6.790 4.202 1.00 . A B . 19 GLU CB 1 1 11 8659 1 1 19 GLU CD C 0.902 6.997 6.547 1.00 . A B . 19 GLU CD 1 1 11 8660 1 1 19 GLU CG C 0.449 7.735 5.308 1.00 . A B . 19 GLU CG 1 1 11 8661 1 1 19 GLU H H 1.639 7.418 2.275 1.00 . A B . 19 GLU H 1 1 11 8662 1 1 19 GLU HA H 1.711 5.540 4.497 1.00 . A B . 19 GLU HA 1 1 11 8663 1 1 19 GLU HB2 H -0.380 7.385 3.389 1.00 . A B . 19 GLU HB2 1 1 11 8664 1 1 19 GLU HB3 H -0.785 6.159 4.586 1.00 . A B . 19 GLU HB3 1 1 11 8665 1 1 19 GLU HG2 H 1.272 8.334 4.945 1.00 . A B . 19 GLU HG2 1 1 11 8666 1 1 19 GLU HG3 H -0.376 8.382 5.571 1.00 . A B . 19 GLU HG3 1 1 11 8667 1 1 19 GLU N N 2.015 6.692 2.820 1.00 . A B . 19 GLU N 1 1 11 8668 1 1 19 GLU O O 0.494 4.706 1.684 1.00 . A B . 19 GLU O 1 1 11 8669 1 1 19 GLU OE1 O 0.044 6.666 7.391 1.00 . A B . 19 GLU OE1 1 1 11 8670 1 1 19 GLU OE2 O 2.118 6.745 6.688 1.00 . A B . 19 GLU OE2 1 1 11 8671 1 1 20 LEU C C -1.981 2.520 3.269 1.00 . A B . 20 LEU C 1 1 11 8672 1 1 20 LEU CA C -0.470 2.509 3.105 1.00 . A B . 20 LEU CA 1 1 11 8673 1 1 20 LEU CB C 0.104 1.266 3.784 1.00 . A B . 20 LEU CB 1 1 11 8674 1 1 20 LEU CD1 C 2.061 -0.224 4.235 1.00 . A B . 20 LEU CD1 1 1 11 8675 1 1 20 LEU CD2 C 1.369 0.229 1.883 1.00 . A B . 20 LEU CD2 1 1 11 8676 1 1 20 LEU CG C 1.476 0.812 3.288 1.00 . A B . 20 LEU CG 1 1 11 8677 1 1 20 LEU H H 0.176 3.798 4.645 1.00 . A B . 20 LEU H 1 1 11 8678 1 1 20 LEU HA H -0.227 2.481 2.054 1.00 . A B . 20 LEU HA 1 1 11 8679 1 1 20 LEU HB2 H 0.178 1.468 4.843 1.00 . A B . 20 LEU HB2 1 1 11 8680 1 1 20 LEU HB3 H -0.593 0.455 3.639 1.00 . A B . 20 LEU HB3 1 1 11 8681 1 1 20 LEU HD11 H 3.044 -0.510 3.894 1.00 . A B . 20 LEU HD11 1 1 11 8682 1 1 20 LEU HD12 H 1.419 -1.094 4.253 1.00 . A B . 20 LEU HD12 1 1 11 8683 1 1 20 LEU HD13 H 2.131 0.193 5.229 1.00 . A B . 20 LEU HD13 1 1 11 8684 1 1 20 LEU HD21 H 0.669 -0.592 1.887 1.00 . A B . 20 LEU HD21 1 1 11 8685 1 1 20 LEU HD22 H 2.338 -0.130 1.570 1.00 . A B . 20 LEU HD22 1 1 11 8686 1 1 20 LEU HD23 H 1.029 0.990 1.197 1.00 . A B . 20 LEU HD23 1 1 11 8687 1 1 20 LEU HG H 2.146 1.662 3.255 1.00 . A B . 20 LEU HG 1 1 11 8688 1 1 20 LEU N N 0.116 3.716 3.670 1.00 . A B . 20 LEU N 1 1 11 8689 1 1 20 LEU O O -2.494 2.859 4.336 1.00 . A B . 20 LEU O 1 1 11 8690 1 1 21 PHE C C -4.630 0.680 2.015 1.00 . A B . 21 PHE C 1 1 11 8691 1 1 21 PHE CA C -4.143 2.106 2.250 1.00 . A B . 21 PHE CA 1 1 11 8692 1 1 21 PHE CB C -4.709 3.070 1.201 1.00 . A B . 21 PHE CB 1 1 11 8693 1 1 21 PHE CD1 C -4.608 5.354 2.245 1.00 . A B . 21 PHE CD1 1 1 11 8694 1 1 21 PHE CD2 C -3.092 4.855 0.472 1.00 . A B . 21 PHE CD2 1 1 11 8695 1 1 21 PHE CE1 C -4.089 6.629 2.332 1.00 . A B . 21 PHE CE1 1 1 11 8696 1 1 21 PHE CE2 C -2.567 6.129 0.560 1.00 . A B . 21 PHE CE2 1 1 11 8697 1 1 21 PHE CG C -4.117 4.450 1.315 1.00 . A B . 21 PHE CG 1 1 11 8698 1 1 21 PHE CZ C -2.982 6.973 1.563 1.00 . A B . 21 PHE CZ 1 1 11 8699 1 1 21 PHE H H -2.221 1.906 1.384 1.00 . A B . 21 PHE H 1 1 11 8700 1 1 21 PHE HA H -4.459 2.427 3.236 1.00 . A B . 21 PHE HA 1 1 11 8701 1 1 21 PHE HB2 H -4.490 2.687 0.212 1.00 . A B . 21 PHE HB2 1 1 11 8702 1 1 21 PHE HB3 H -5.779 3.149 1.326 1.00 . A B . 21 PHE HB3 1 1 11 8703 1 1 21 PHE HD1 H -5.403 5.056 2.912 1.00 . A B . 21 PHE HD1 1 1 11 8704 1 1 21 PHE HD2 H -2.696 4.162 -0.258 1.00 . A B . 21 PHE HD2 1 1 11 8705 1 1 21 PHE HE1 H -4.484 7.324 3.059 1.00 . A B . 21 PHE HE1 1 1 11 8706 1 1 21 PHE HE2 H -1.771 6.432 -0.100 1.00 . A B . 21 PHE HE2 1 1 11 8707 1 1 21 PHE HZ H -2.541 7.955 1.655 1.00 . A B . 21 PHE HZ 1 1 11 8708 1 1 21 PHE N N -2.688 2.147 2.216 1.00 . A B . 21 PHE N 1 1 11 8709 1 1 21 PHE O O -5.669 0.441 1.398 1.00 . A B . 21 PHE O 1 1 11 8710 1 1 22 CYS C C -3.981 -2.423 3.666 1.00 . A B . 22 CYS C 1 1 11 8711 1 1 22 CYS CA C -4.154 -1.679 2.357 1.00 . A B . 22 CYS CA 1 1 11 8712 1 1 22 CYS CB C -3.234 -2.302 1.308 1.00 . A B . 22 CYS CB 1 1 11 8713 1 1 22 CYS H H -3.068 -0.009 3.042 1.00 . A B . 22 CYS H 1 1 11 8714 1 1 22 CYS HA H -5.178 -1.771 2.031 1.00 . A B . 22 CYS HA 1 1 11 8715 1 1 22 CYS HB2 H -2.242 -1.881 1.414 1.00 . A B . 22 CYS HB2 1 1 11 8716 1 1 22 CYS HB3 H -3.182 -3.369 1.473 1.00 . A B . 22 CYS HB3 1 1 11 8717 1 1 22 CYS N N -3.859 -0.268 2.524 1.00 . A B . 22 CYS N 1 1 11 8718 1 1 22 CYS O O -3.356 -1.919 4.602 1.00 . A B . 22 CYS O 1 1 11 8719 1 1 22 CYS SG S -3.757 -2.036 -0.409 1.00 . A B . 22 CYS SG 1 1 11 8720 1 1 23 CYS C C -2.965 -5.164 4.705 1.00 . A B . 23 CYS C 1 1 11 8721 1 1 23 CYS CA C -4.328 -4.494 4.858 1.00 . A B . 23 CYS CA 1 1 11 8722 1 1 23 CYS CB C -5.450 -5.541 4.951 1.00 . A B . 23 CYS CB 1 1 11 8723 1 1 23 CYS H H -5.091 -3.931 2.978 1.00 . A B . 23 CYS H 1 1 11 8724 1 1 23 CYS HA H -4.322 -3.884 5.752 1.00 . A B . 23 CYS HA 1 1 11 8725 1 1 23 CYS HB2 H -5.418 -6.007 5.927 1.00 . A B . 23 CYS HB2 1 1 11 8726 1 1 23 CYS HB3 H -6.402 -5.045 4.827 1.00 . A B . 23 CYS HB3 1 1 11 8727 1 1 23 CYS N N -4.535 -3.624 3.723 1.00 . A B . 23 CYS N 1 1 11 8728 1 1 23 CYS O O -2.408 -5.159 3.602 1.00 . A B . 23 CYS O 1 1 11 8729 1 1 23 CYS SG S -5.354 -6.863 3.717 1.00 . A B . 23 CYS SG 1 1 11 8730 1 1 24 ASP C C -0.940 -7.323 4.624 1.00 . A B . 24 ASP C 1 1 11 8731 1 1 24 ASP CA C -1.081 -6.301 5.747 1.00 . A B . 24 ASP CA 1 1 11 8732 1 1 24 ASP CB C -0.722 -6.943 7.090 1.00 . A B . 24 ASP CB 1 1 11 8733 1 1 24 ASP CG C -0.470 -5.918 8.177 1.00 . A B . 24 ASP CG 1 1 11 8734 1 1 24 ASP H H -2.955 -5.771 6.606 1.00 . A B . 24 ASP H 1 1 11 8735 1 1 24 ASP HA H -0.391 -5.492 5.559 1.00 . A B . 24 ASP HA 1 1 11 8736 1 1 24 ASP HB2 H -1.532 -7.581 7.404 1.00 . A B . 24 ASP HB2 1 1 11 8737 1 1 24 ASP HB3 H 0.172 -7.537 6.967 1.00 . A B . 24 ASP HB3 1 1 11 8738 1 1 24 ASP N N -2.430 -5.728 5.779 1.00 . A B . 24 ASP N 1 1 11 8739 1 1 24 ASP O O 0.057 -7.332 3.897 1.00 . A B . 24 ASP O 1 1 11 8740 1 1 24 ASP OD1 O 0.580 -5.243 8.139 1.00 . A B . 24 ASP OD1 1 1 11 8741 1 1 24 ASP OD2 O -1.327 -5.773 9.075 1.00 . A B . 24 ASP OD2 1 1 11 8742 1 1 25 THR C C -1.797 -8.620 2.043 1.00 . A B . 25 THR C 1 1 11 8743 1 1 25 THR CA C -1.975 -9.193 3.455 1.00 . A B . 25 THR CA 1 1 11 8744 1 1 25 THR CB C -3.285 -9.993 3.529 1.00 . A B . 25 THR CB 1 1 11 8745 1 1 25 THR CG2 C -3.232 -11.222 2.635 1.00 . A B . 25 THR CG2 1 1 11 8746 1 1 25 THR H H -2.749 -8.047 5.045 1.00 . A B . 25 THR H 1 1 11 8747 1 1 25 THR HA H -1.155 -9.864 3.666 1.00 . A B . 25 THR HA 1 1 11 8748 1 1 25 THR HB H -4.095 -9.359 3.203 1.00 . A B . 25 THR HB 1 1 11 8749 1 1 25 THR HG1 H -2.677 -10.549 5.324 1.00 . A B . 25 THR HG1 1 1 11 8750 1 1 25 THR HG21 H -3.079 -10.915 1.611 1.00 . A B . 25 THR HG21 1 1 11 8751 1 1 25 THR HG22 H -4.162 -11.762 2.714 1.00 . A B . 25 THR HG22 1 1 11 8752 1 1 25 THR HG23 H -2.418 -11.857 2.947 1.00 . A B . 25 THR HG23 1 1 11 8753 1 1 25 THR N N -1.968 -8.146 4.462 1.00 . A B . 25 THR N 1 1 11 8754 1 1 25 THR O O -0.937 -9.079 1.287 1.00 . A B . 25 THR O 1 1 11 8755 1 1 25 THR OG1 O -3.524 -10.396 4.883 1.00 . A B . 25 THR OG1 1 1 11 8756 1 1 26 CYS C C -1.254 -6.165 0.199 1.00 . A B . 26 CYS C 1 1 11 8757 1 1 26 CYS CA C -2.510 -7.013 0.363 1.00 . A B . 26 CYS CA 1 1 11 8758 1 1 26 CYS CB C -3.739 -6.153 0.060 1.00 . A B . 26 CYS CB 1 1 11 8759 1 1 26 CYS H H -3.207 -7.235 2.360 1.00 . A B . 26 CYS H 1 1 11 8760 1 1 26 CYS HA H -2.470 -7.826 -0.347 1.00 . A B . 26 CYS HA 1 1 11 8761 1 1 26 CYS HB2 H -3.831 -5.400 0.823 1.00 . A B . 26 CYS HB2 1 1 11 8762 1 1 26 CYS HB3 H -3.605 -5.670 -0.896 1.00 . A B . 26 CYS HB3 1 1 11 8763 1 1 26 CYS N N -2.582 -7.601 1.700 1.00 . A B . 26 CYS N 1 1 11 8764 1 1 26 CYS O O -0.698 -6.085 -0.889 1.00 . A B . 26 CYS O 1 1 11 8765 1 1 26 CYS SG S -5.301 -7.053 0.008 1.00 . A B . 26 CYS SG 1 1 11 8766 1 1 27 SER C C 1.622 -5.472 0.891 1.00 . A B . 27 SER C 1 1 11 8767 1 1 27 SER CA C 0.368 -4.675 1.232 1.00 . A B . 27 SER CA 1 1 11 8768 1 1 27 SER CB C 0.558 -3.953 2.566 1.00 . A B . 27 SER CB 1 1 11 8769 1 1 27 SER H H -1.266 -5.669 2.140 1.00 . A B . 27 SER H 1 1 11 8770 1 1 27 SER HA H 0.200 -3.940 0.458 1.00 . A B . 27 SER HA 1 1 11 8771 1 1 27 SER HB2 H -0.316 -3.357 2.779 1.00 . A B . 27 SER HB2 1 1 11 8772 1 1 27 SER HB3 H 0.695 -4.684 3.347 1.00 . A B . 27 SER HB3 1 1 11 8773 1 1 27 SER HG H 2.277 -3.321 3.265 1.00 . A B . 27 SER HG 1 1 11 8774 1 1 27 SER N N -0.804 -5.543 1.283 1.00 . A B . 27 SER N 1 1 11 8775 1 1 27 SER O O 2.594 -4.932 0.371 1.00 . A B . 27 SER O 1 1 11 8776 1 1 27 SER OG O 1.690 -3.101 2.532 1.00 . A B . 27 SER OG 1 1 11 8777 1 1 28 ARG C C 2.667 -8.088 -0.576 1.00 . A B . 28 ARG C 1 1 11 8778 1 1 28 ARG CA C 2.734 -7.620 0.874 1.00 . A B . 28 ARG CA 1 1 11 8779 1 1 28 ARG CB C 2.778 -8.818 1.826 1.00 . A B . 28 ARG CB 1 1 11 8780 1 1 28 ARG CD C 3.075 -9.642 4.186 1.00 . A B . 28 ARG CD 1 1 11 8781 1 1 28 ARG CG C 3.107 -8.436 3.262 1.00 . A B . 28 ARG CG 1 1 11 8782 1 1 28 ARG CZ C 4.277 -11.772 4.507 1.00 . A B . 28 ARG CZ 1 1 11 8783 1 1 28 ARG H H 0.845 -7.131 1.689 1.00 . A B . 28 ARG H 1 1 11 8784 1 1 28 ARG HA H 3.634 -7.040 1.003 1.00 . A B . 28 ARG HA 1 1 11 8785 1 1 28 ARG HB2 H 1.813 -9.303 1.818 1.00 . A B . 28 ARG HB2 1 1 11 8786 1 1 28 ARG HB3 H 3.527 -9.514 1.479 1.00 . A B . 28 ARG HB3 1 1 11 8787 1 1 28 ARG HD2 H 3.229 -9.304 5.200 1.00 . A B . 28 ARG HD2 1 1 11 8788 1 1 28 ARG HD3 H 2.106 -10.113 4.109 1.00 . A B . 28 ARG HD3 1 1 11 8789 1 1 28 ARG HE H 4.714 -10.407 3.110 1.00 . A B . 28 ARG HE 1 1 11 8790 1 1 28 ARG HG2 H 4.096 -8.003 3.292 1.00 . A B . 28 ARG HG2 1 1 11 8791 1 1 28 ARG HG3 H 2.384 -7.711 3.607 1.00 . A B . 28 ARG HG3 1 1 11 8792 1 1 28 ARG HH11 H 2.716 -11.478 5.771 1.00 . A B . 28 ARG HH11 1 1 11 8793 1 1 28 ARG HH12 H 3.588 -12.961 6.000 1.00 . A B . 28 ARG HH12 1 1 11 8794 1 1 28 ARG HH21 H 5.875 -12.357 3.399 1.00 . A B . 28 ARG HH21 1 1 11 8795 1 1 28 ARG HH22 H 5.387 -13.466 4.643 1.00 . A B . 28 ARG HH22 1 1 11 8796 1 1 28 ARG N N 1.610 -6.759 1.200 1.00 . A B . 28 ARG N 1 1 11 8797 1 1 28 ARG NE N 4.108 -10.623 3.855 1.00 . A B . 28 ARG NE 1 1 11 8798 1 1 28 ARG NH1 N 3.462 -12.098 5.505 1.00 . A B . 28 ARG NH1 1 1 11 8799 1 1 28 ARG NH2 N 5.258 -12.597 4.155 1.00 . A B . 28 ARG NH2 1 1 11 8800 1 1 28 ARG O O 3.671 -8.509 -1.146 1.00 . A B . 28 ARG O 1 1 11 8801 1 1 29 VAL C C 1.297 -7.305 -3.532 1.00 . A B . 29 VAL C 1 1 11 8802 1 1 29 VAL CA C 1.288 -8.471 -2.539 1.00 . A B . 29 VAL CA 1 1 11 8803 1 1 29 VAL CB C -0.029 -9.261 -2.689 1.00 . A B . 29 VAL CB 1 1 11 8804 1 1 29 VAL CG1 C -0.138 -9.868 -4.078 1.00 . A B . 29 VAL CG1 1 1 11 8805 1 1 29 VAL CG2 C -0.134 -10.346 -1.630 1.00 . A B . 29 VAL CG2 1 1 11 8806 1 1 29 VAL H H 0.723 -7.629 -0.682 1.00 . A B . 29 VAL H 1 1 11 8807 1 1 29 VAL HA H 2.104 -9.133 -2.780 1.00 . A B . 29 VAL HA 1 1 11 8808 1 1 29 VAL HB H -0.853 -8.577 -2.554 1.00 . A B . 29 VAL HB 1 1 11 8809 1 1 29 VAL HG11 H 0.686 -10.550 -4.235 1.00 . A B . 29 VAL HG11 1 1 11 8810 1 1 29 VAL HG12 H -0.102 -9.084 -4.818 1.00 . A B . 29 VAL HG12 1 1 11 8811 1 1 29 VAL HG13 H -1.069 -10.405 -4.164 1.00 . A B . 29 VAL HG13 1 1 11 8812 1 1 29 VAL HG21 H -0.149 -9.893 -0.650 1.00 . A B . 29 VAL HG21 1 1 11 8813 1 1 29 VAL HG22 H 0.716 -11.007 -1.708 1.00 . A B . 29 VAL HG22 1 1 11 8814 1 1 29 VAL HG23 H -1.043 -10.908 -1.781 1.00 . A B . 29 VAL HG23 1 1 11 8815 1 1 29 VAL N N 1.482 -8.008 -1.171 1.00 . A B . 29 VAL N 1 1 11 8816 1 1 29 VAL O O 2.005 -7.341 -4.537 1.00 . A B . 29 VAL O 1 1 11 8817 1 1 30 PHE C C 0.928 -3.863 -3.478 1.00 . A B . 30 PHE C 1 1 11 8818 1 1 30 PHE CA C 0.400 -5.127 -4.142 1.00 . A B . 30 PHE CA 1 1 11 8819 1 1 30 PHE CB C -1.066 -4.907 -4.544 1.00 . A B . 30 PHE CB 1 1 11 8820 1 1 30 PHE CD1 C -1.431 -6.709 -6.271 1.00 . A B . 30 PHE CD1 1 1 11 8821 1 1 30 PHE CD2 C -2.797 -6.711 -4.316 1.00 . A B . 30 PHE CD2 1 1 11 8822 1 1 30 PHE CE1 C -2.092 -7.830 -6.735 1.00 . A B . 30 PHE CE1 1 1 11 8823 1 1 30 PHE CE2 C -3.461 -7.832 -4.775 1.00 . A B . 30 PHE CE2 1 1 11 8824 1 1 30 PHE CG C -1.774 -6.137 -5.054 1.00 . A B . 30 PHE CG 1 1 11 8825 1 1 30 PHE CZ C -3.109 -8.393 -5.986 1.00 . A B . 30 PHE CZ 1 1 11 8826 1 1 30 PHE H H 0.073 -6.233 -2.363 1.00 . A B . 30 PHE H 1 1 11 8827 1 1 30 PHE HA H 0.989 -5.332 -5.024 1.00 . A B . 30 PHE HA 1 1 11 8828 1 1 30 PHE HB2 H -1.614 -4.549 -3.685 1.00 . A B . 30 PHE HB2 1 1 11 8829 1 1 30 PHE HB3 H -1.105 -4.156 -5.322 1.00 . A B . 30 PHE HB3 1 1 11 8830 1 1 30 PHE HD1 H -0.638 -6.274 -6.859 1.00 . A B . 30 PHE HD1 1 1 11 8831 1 1 30 PHE HD2 H -3.077 -6.272 -3.371 1.00 . A B . 30 PHE HD2 1 1 11 8832 1 1 30 PHE HE1 H -1.816 -8.267 -7.684 1.00 . A B . 30 PHE HE1 1 1 11 8833 1 1 30 PHE HE2 H -4.254 -8.269 -4.185 1.00 . A B . 30 PHE HE2 1 1 11 8834 1 1 30 PHE HZ H -3.626 -9.269 -6.347 1.00 . A B . 30 PHE HZ 1 1 11 8835 1 1 30 PHE N N 0.536 -6.260 -3.232 1.00 . A B . 30 PHE N 1 1 11 8836 1 1 30 PHE O O 0.319 -2.800 -3.587 1.00 . A B . 30 PHE O 1 1 11 8837 1 1 31 HIS C C 2.675 -1.592 -2.787 1.00 . A B . 31 HIS C 1 1 11 8838 1 1 31 HIS CA C 2.646 -2.906 -2.012 1.00 . A B . 31 HIS CA 1 1 11 8839 1 1 31 HIS CB C 4.064 -3.291 -1.575 1.00 . A B . 31 HIS CB 1 1 11 8840 1 1 31 HIS CD2 C 5.840 -1.589 -0.758 1.00 . A B . 31 HIS CD2 1 1 11 8841 1 1 31 HIS CE1 C 5.052 -1.148 1.208 1.00 . A B . 31 HIS CE1 1 1 11 8842 1 1 31 HIS CG C 4.707 -2.323 -0.622 1.00 . A B . 31 HIS CG 1 1 11 8843 1 1 31 HIS H H 2.524 -4.860 -2.820 1.00 . A B . 31 HIS H 1 1 11 8844 1 1 31 HIS HA H 2.037 -2.774 -1.133 1.00 . A B . 31 HIS HA 1 1 11 8845 1 1 31 HIS HB2 H 4.028 -4.255 -1.088 1.00 . A B . 31 HIS HB2 1 1 11 8846 1 1 31 HIS HB3 H 4.691 -3.361 -2.452 1.00 . A B . 31 HIS HB3 1 1 11 8847 1 1 31 HIS HD1 H 3.398 -2.407 1.036 1.00 . A B . 31 HIS HD1 1 1 11 8848 1 1 31 HIS HD2 H 6.471 -1.559 -1.634 1.00 . A B . 31 HIS HD2 1 1 11 8849 1 1 31 HIS HE1 H 4.928 -0.742 2.203 1.00 . A B . 31 HIS HE1 1 1 11 8850 1 1 31 HIS N N 2.064 -3.995 -2.800 1.00 . A B . 31 HIS N 1 1 11 8851 1 1 31 HIS ND1 N 4.217 -2.035 0.633 1.00 . A B . 31 HIS ND1 1 1 11 8852 1 1 31 HIS NE2 N 6.054 -0.844 0.402 1.00 . A B . 31 HIS NE2 1 1 11 8853 1 1 31 HIS O O 2.218 -0.569 -2.292 1.00 . A B . 31 HIS O 1 1 11 8854 1 1 32 GLU C C 2.051 0.260 -5.136 1.00 . A B . 32 GLU C 1 1 11 8855 1 1 32 GLU CA C 3.367 -0.443 -4.813 1.00 . A B . 32 GLU CA 1 1 11 8856 1 1 32 GLU CB C 4.102 -0.800 -6.101 1.00 . A B . 32 GLU CB 1 1 11 8857 1 1 32 GLU CD C 6.079 -1.984 -7.114 1.00 . A B . 32 GLU CD 1 1 11 8858 1 1 32 GLU CG C 5.490 -1.373 -5.866 1.00 . A B . 32 GLU CG 1 1 11 8859 1 1 32 GLU H H 3.321 -2.523 -4.418 1.00 . A B . 32 GLU H 1 1 11 8860 1 1 32 GLU HA H 3.983 0.228 -4.232 1.00 . A B . 32 GLU HA 1 1 11 8861 1 1 32 GLU HB2 H 3.519 -1.532 -6.642 1.00 . A B . 32 GLU HB2 1 1 11 8862 1 1 32 GLU HB3 H 4.199 0.089 -6.706 1.00 . A B . 32 GLU HB3 1 1 11 8863 1 1 32 GLU HG2 H 6.142 -0.580 -5.529 1.00 . A B . 32 GLU HG2 1 1 11 8864 1 1 32 GLU HG3 H 5.431 -2.136 -5.104 1.00 . A B . 32 GLU HG3 1 1 11 8865 1 1 32 GLU N N 3.148 -1.646 -4.018 1.00 . A B . 32 GLU N 1 1 11 8866 1 1 32 GLU O O 1.952 1.484 -5.049 1.00 . A B . 32 GLU O 1 1 11 8867 1 1 32 GLU OE1 O 5.712 -3.129 -7.458 1.00 . A B . 32 GLU OE1 1 1 11 8868 1 1 32 GLU OE2 O 6.914 -1.318 -7.762 1.00 . A B . 32 GLU OE2 1 1 11 8869 1 1 33 ASP C C -1.029 0.435 -4.574 1.00 . A B . 33 ASP C 1 1 11 8870 1 1 33 ASP CA C -0.271 0.038 -5.832 1.00 . A B . 33 ASP CA 1 1 11 8871 1 1 33 ASP CB C -1.109 -0.956 -6.642 1.00 . A B . 33 ASP CB 1 1 11 8872 1 1 33 ASP CG C -0.638 -1.096 -8.074 1.00 . A B . 33 ASP CG 1 1 11 8873 1 1 33 ASP H H 1.170 -1.490 -5.527 1.00 . A B . 33 ASP H 1 1 11 8874 1 1 33 ASP HA H -0.104 0.923 -6.428 1.00 . A B . 33 ASP HA 1 1 11 8875 1 1 33 ASP HB2 H -1.058 -1.925 -6.171 1.00 . A B . 33 ASP HB2 1 1 11 8876 1 1 33 ASP HB3 H -2.136 -0.622 -6.654 1.00 . A B . 33 ASP HB3 1 1 11 8877 1 1 33 ASP N N 1.039 -0.519 -5.495 1.00 . A B . 33 ASP N 1 1 11 8878 1 1 33 ASP O O -1.907 1.295 -4.610 1.00 . A B . 33 ASP O 1 1 11 8879 1 1 33 ASP OD1 O -0.970 -0.227 -8.901 1.00 . A B . 33 ASP OD1 1 1 11 8880 1 1 33 ASP OD2 O 0.061 -2.082 -8.381 1.00 . A B . 33 ASP OD2 1 1 11 8881 1 1 34 CYS C C -0.895 1.401 -1.582 1.00 . A B . 34 CYS C 1 1 11 8882 1 1 34 CYS CA C -1.324 0.064 -2.180 1.00 . A B . 34 CYS CA 1 1 11 8883 1 1 34 CYS CB C -1.029 -1.077 -1.207 1.00 . A B . 34 CYS CB 1 1 11 8884 1 1 34 CYS H H 0.042 -0.868 -3.503 1.00 . A B . 34 CYS H 1 1 11 8885 1 1 34 CYS HA H -2.392 0.098 -2.357 1.00 . A B . 34 CYS HA 1 1 11 8886 1 1 34 CYS HB2 H -0.002 -1.399 -1.333 1.00 . A B . 34 CYS HB2 1 1 11 8887 1 1 34 CYS HB3 H -1.173 -0.729 -0.195 1.00 . A B . 34 CYS HB3 1 1 11 8888 1 1 34 CYS N N -0.677 -0.195 -3.461 1.00 . A B . 34 CYS N 1 1 11 8889 1 1 34 CYS O O -1.373 1.800 -0.517 1.00 . A B . 34 CYS O 1 1 11 8890 1 1 34 CYS SG S -2.095 -2.530 -1.455 1.00 . A B . 34 CYS SG 1 1 11 8891 1 1 35 HIS C C -0.387 4.472 -2.632 1.00 . A B . 35 HIS C 1 1 11 8892 1 1 35 HIS CA C 0.414 3.426 -1.869 1.00 . A B . 35 HIS CA 1 1 11 8893 1 1 35 HIS CB C 1.912 3.620 -2.097 1.00 . A B . 35 HIS CB 1 1 11 8894 1 1 35 HIS CD2 C 3.181 1.698 -0.937 1.00 . A B . 35 HIS CD2 1 1 11 8895 1 1 35 HIS CE1 C 3.719 2.681 0.908 1.00 . A B . 35 HIS CE1 1 1 11 8896 1 1 35 HIS CG C 2.735 2.970 -1.031 1.00 . A B . 35 HIS CG 1 1 11 8897 1 1 35 HIS H H 0.433 1.667 -3.045 1.00 . A B . 35 HIS H 1 1 11 8898 1 1 35 HIS HA H 0.209 3.532 -0.814 1.00 . A B . 35 HIS HA 1 1 11 8899 1 1 35 HIS HB2 H 2.184 3.181 -3.047 1.00 . A B . 35 HIS HB2 1 1 11 8900 1 1 35 HIS HB3 H 2.138 4.676 -2.107 1.00 . A B . 35 HIS HB3 1 1 11 8901 1 1 35 HIS HD1 H 2.867 4.510 0.408 1.00 . A B . 35 HIS HD1 1 1 11 8902 1 1 35 HIS HD2 H 3.089 0.940 -1.702 1.00 . A B . 35 HIS HD2 1 1 11 8903 1 1 35 HIS HE1 H 4.114 2.883 1.892 1.00 . A B . 35 HIS HE1 1 1 11 8904 1 1 35 HIS N N 0.012 2.084 -2.264 1.00 . A B . 35 HIS N 1 1 11 8905 1 1 35 HIS ND1 N 3.085 3.585 0.149 1.00 . A B . 35 HIS ND1 1 1 11 8906 1 1 35 HIS NE2 N 3.799 1.511 0.292 1.00 . A B . 35 HIS NE2 1 1 11 8907 1 1 35 HIS O O -0.244 5.674 -2.405 1.00 . A B . 35 HIS O 1 1 11 8908 1 1 36 ILE C C -3.550 4.659 -3.942 1.00 . A B . 36 ILE C 1 1 11 8909 1 1 36 ILE CA C -2.087 4.866 -4.330 1.00 . A B . 36 ILE CA 1 1 11 8910 1 1 36 ILE CB C -1.910 4.565 -5.838 1.00 . A B . 36 ILE CB 1 1 11 8911 1 1 36 ILE CD1 C -0.167 4.320 -7.684 1.00 . A B . 36 ILE CD1 1 1 11 8912 1 1 36 ILE CG1 C -0.430 4.640 -6.227 1.00 . A B . 36 ILE CG1 1 1 11 8913 1 1 36 ILE CG2 C -2.733 5.528 -6.686 1.00 . A B . 36 ILE CG2 1 1 11 8914 1 1 36 ILE H H -1.304 3.029 -3.657 1.00 . A B . 36 ILE H 1 1 11 8915 1 1 36 ILE HA H -1.803 5.889 -4.141 1.00 . A B . 36 ILE HA 1 1 11 8916 1 1 36 ILE HB H -2.271 3.565 -6.023 1.00 . A B . 36 ILE HB 1 1 11 8917 1 1 36 ILE HD11 H -0.715 5.009 -8.308 1.00 . A B . 36 ILE HD11 1 1 11 8918 1 1 36 ILE HD12 H -0.488 3.311 -7.897 1.00 . A B . 36 ILE HD12 1 1 11 8919 1 1 36 ILE HD13 H 0.888 4.412 -7.890 1.00 . A B . 36 ILE HD13 1 1 11 8920 1 1 36 ILE HG12 H -0.063 5.638 -6.035 1.00 . A B . 36 ILE HG12 1 1 11 8921 1 1 36 ILE HG13 H 0.128 3.937 -5.626 1.00 . A B . 36 ILE HG13 1 1 11 8922 1 1 36 ILE HG21 H -2.373 6.534 -6.540 1.00 . A B . 36 ILE HG21 1 1 11 8923 1 1 36 ILE HG22 H -3.771 5.471 -6.393 1.00 . A B . 36 ILE HG22 1 1 11 8924 1 1 36 ILE HG23 H -2.639 5.261 -7.728 1.00 . A B . 36 ILE HG23 1 1 11 8925 1 1 36 ILE N N -1.238 3.998 -3.531 1.00 . A B . 36 ILE N 1 1 11 8926 1 1 36 ILE O O -3.985 3.523 -3.763 1.00 . A B . 36 ILE O 1 1 11 8927 1 1 37 PRO C C -3.307 7.667 -2.620 1.00 . A B . 37 PRO C 1 1 11 8928 1 1 37 PRO CA C -3.877 7.123 -3.928 1.00 . A B . 37 PRO CA 1 1 11 8929 1 1 37 PRO CB C -5.166 7.886 -4.298 1.00 . A B . 37 PRO CB 1 1 11 8930 1 1 37 PRO CD C -5.759 5.700 -3.476 1.00 . A B . 37 PRO CD 1 1 11 8931 1 1 37 PRO CG C -6.279 6.880 -4.248 1.00 . A B . 37 PRO CG 1 1 11 8932 1 1 37 PRO HA H -3.147 7.226 -4.717 1.00 . A B . 37 PRO HA 1 1 11 8933 1 1 37 PRO HB2 H -5.328 8.681 -3.580 1.00 . A B . 37 PRO HB2 1 1 11 8934 1 1 37 PRO HB3 H -5.064 8.310 -5.291 1.00 . A B . 37 PRO HB3 1 1 11 8935 1 1 37 PRO HD2 H -5.929 5.830 -2.416 1.00 . A B . 37 PRO HD2 1 1 11 8936 1 1 37 PRO HD3 H -6.208 4.781 -3.827 1.00 . A B . 37 PRO HD3 1 1 11 8937 1 1 37 PRO HG2 H -7.135 7.308 -3.746 1.00 . A B . 37 PRO HG2 1 1 11 8938 1 1 37 PRO HG3 H -6.546 6.582 -5.253 1.00 . A B . 37 PRO HG3 1 1 11 8939 1 1 37 PRO N N -4.334 5.740 -3.787 1.00 . A B . 37 PRO N 1 1 11 8940 1 1 37 PRO O O -3.892 7.461 -1.558 1.00 . A B . 37 PRO O 1 1 11 8941 1 1 38 PRO C C -2.420 9.845 -0.683 1.00 . A B . 38 PRO C 1 1 11 8942 1 1 38 PRO CA C -1.495 8.947 -1.506 1.00 . A B . 38 PRO CA 1 1 11 8943 1 1 38 PRO CB C -0.351 9.771 -2.102 1.00 . A B . 38 PRO CB 1 1 11 8944 1 1 38 PRO CD C -1.416 8.660 -3.930 1.00 . A B . 38 PRO CD 1 1 11 8945 1 1 38 PRO CG C -0.081 9.144 -3.427 1.00 . A B . 38 PRO CG 1 1 11 8946 1 1 38 PRO HA H -1.089 8.175 -0.869 1.00 . A B . 38 PRO HA 1 1 11 8947 1 1 38 PRO HB2 H -0.661 10.802 -2.204 1.00 . A B . 38 PRO HB2 1 1 11 8948 1 1 38 PRO HB3 H 0.512 9.713 -1.454 1.00 . A B . 38 PRO HB3 1 1 11 8949 1 1 38 PRO HD2 H -1.910 9.434 -4.505 1.00 . A B . 38 PRO HD2 1 1 11 8950 1 1 38 PRO HD3 H -1.296 7.765 -4.525 1.00 . A B . 38 PRO HD3 1 1 11 8951 1 1 38 PRO HG2 H 0.337 9.877 -4.104 1.00 . A B . 38 PRO HG2 1 1 11 8952 1 1 38 PRO HG3 H 0.600 8.311 -3.306 1.00 . A B . 38 PRO HG3 1 1 11 8953 1 1 38 PRO N N -2.160 8.372 -2.689 1.00 . A B . 38 PRO N 1 1 11 8954 1 1 38 PRO O O -3.423 10.355 -1.188 1.00 . A B . 38 PRO O 1 1 11 8955 1 1 39 VAL C C -2.750 12.313 1.275 1.00 . A B . 39 VAL C 1 1 11 8956 1 1 39 VAL CA C -2.915 10.807 1.489 1.00 . A B . 39 VAL CA 1 1 11 8957 1 1 39 VAL CB C -2.660 10.444 2.975 1.00 . A B . 39 VAL CB 1 1 11 8958 1 1 39 VAL CG1 C -1.182 10.513 3.335 1.00 . A B . 39 VAL CG1 1 1 11 8959 1 1 39 VAL CG2 C -3.472 11.342 3.896 1.00 . A B . 39 VAL CG2 1 1 11 8960 1 1 39 VAL H H -1.244 9.646 0.918 1.00 . A B . 39 VAL H 1 1 11 8961 1 1 39 VAL HA H -3.939 10.548 1.267 1.00 . A B . 39 VAL HA 1 1 11 8962 1 1 39 VAL HB H -2.988 9.429 3.127 1.00 . A B . 39 VAL HB 1 1 11 8963 1 1 39 VAL HG11 H -1.070 10.419 4.406 1.00 . A B . 39 VAL HG11 1 1 11 8964 1 1 39 VAL HG12 H -0.776 11.458 3.010 1.00 . A B . 39 VAL HG12 1 1 11 8965 1 1 39 VAL HG13 H -0.657 9.707 2.850 1.00 . A B . 39 VAL HG13 1 1 11 8966 1 1 39 VAL HG21 H -3.275 11.077 4.924 1.00 . A B . 39 VAL HG21 1 1 11 8967 1 1 39 VAL HG22 H -4.524 11.213 3.687 1.00 . A B . 39 VAL HG22 1 1 11 8968 1 1 39 VAL HG23 H -3.196 12.372 3.729 1.00 . A B . 39 VAL HG23 1 1 11 8969 1 1 39 VAL N N -2.078 10.034 0.585 1.00 . A B . 39 VAL N 1 1 11 8970 1 1 39 VAL O O -1.816 12.939 1.775 1.00 . A B . 39 VAL O 1 1 11 8971 1 1 40 GLU C C -4.792 14.899 1.285 1.00 . A B . 40 GLU C 1 1 11 8972 1 1 40 GLU CA C -3.727 14.331 0.358 1.00 . A B . 40 GLU CA 1 1 11 8973 1 1 40 GLU CB C -4.024 14.734 -1.093 1.00 . A B . 40 GLU CB 1 1 11 8974 1 1 40 GLU CD C -2.058 13.559 -2.199 1.00 . A B . 40 GLU CD 1 1 11 8975 1 1 40 GLU CG C -2.793 14.863 -1.983 1.00 . A B . 40 GLU CG 1 1 11 8976 1 1 40 GLU H H -4.306 12.320 0.032 1.00 . A B . 40 GLU H 1 1 11 8977 1 1 40 GLU HA H -2.770 14.732 0.651 1.00 . A B . 40 GLU HA 1 1 11 8978 1 1 40 GLU HB2 H -4.677 13.996 -1.532 1.00 . A B . 40 GLU HB2 1 1 11 8979 1 1 40 GLU HB3 H -4.534 15.686 -1.086 1.00 . A B . 40 GLU HB3 1 1 11 8980 1 1 40 GLU HG2 H -3.107 15.238 -2.945 1.00 . A B . 40 GLU HG2 1 1 11 8981 1 1 40 GLU HG3 H -2.114 15.571 -1.534 1.00 . A B . 40 GLU HG3 1 1 11 8982 1 1 40 GLU N N -3.662 12.885 0.510 1.00 . A B . 40 GLU N 1 1 11 8983 1 1 40 GLU O O -4.777 16.082 1.625 1.00 . A B . 40 GLU O 1 1 11 8984 1 1 40 GLU OE1 O -2.475 12.771 -3.079 1.00 . A B . 40 GLU OE1 1 1 11 8985 1 1 40 GLU OE2 O -1.081 13.301 -1.465 1.00 . A B . 40 GLU OE2 1 1 11 8986 1 1 41 ALA C C -6.817 13.565 3.840 1.00 . A B . 41 ALA C 1 1 11 8987 1 1 41 ALA CA C -6.785 14.435 2.588 1.00 . A B . 41 ALA CA 1 1 11 8988 1 1 41 ALA CB C -8.121 14.378 1.862 1.00 . A B . 41 ALA CB 1 1 11 8989 1 1 41 ALA H H -5.659 13.109 1.394 1.00 . A B . 41 ALA H 1 1 11 8990 1 1 41 ALA HA H -6.610 15.459 2.883 1.00 . A B . 41 ALA HA 1 1 11 8991 1 1 41 ALA HB1 H -8.347 13.355 1.604 1.00 . A B . 41 ALA HB1 1 1 11 8992 1 1 41 ALA HB2 H -8.067 14.972 0.963 1.00 . A B . 41 ALA HB2 1 1 11 8993 1 1 41 ALA HB3 H -8.896 14.767 2.504 1.00 . A B . 41 ALA HB3 1 1 11 8994 1 1 41 ALA N N -5.708 14.039 1.699 1.00 . A B . 41 ALA N 1 1 11 8995 1 1 41 ALA O O -6.505 14.033 4.935 1.00 . A B . 41 ALA O 1 1 11 8996 1 1 42 GLU C C -6.585 10.081 4.580 1.00 . A B . 42 GLU C 1 1 11 8997 1 1 42 GLU CA C -7.327 11.392 4.812 1.00 . A B . 42 GLU CA 1 1 11 8998 1 1 42 GLU CB C -8.806 11.097 5.072 1.00 . A B . 42 GLU CB 1 1 11 8999 1 1 42 GLU CD C -11.068 11.988 5.732 1.00 . A B . 42 GLU CD 1 1 11 9000 1 1 42 GLU CG C -9.617 12.320 5.460 1.00 . A B . 42 GLU CG 1 1 11 9001 1 1 42 GLU H H -7.335 11.958 2.770 1.00 . A B . 42 GLU H 1 1 11 9002 1 1 42 GLU HA H -6.910 11.879 5.679 1.00 . A B . 42 GLU HA 1 1 11 9003 1 1 42 GLU HB2 H -9.239 10.677 4.176 1.00 . A B . 42 GLU HB2 1 1 11 9004 1 1 42 GLU HB3 H -8.882 10.373 5.869 1.00 . A B . 42 GLU HB3 1 1 11 9005 1 1 42 GLU HG2 H -9.188 12.752 6.352 1.00 . A B . 42 GLU HG2 1 1 11 9006 1 1 42 GLU HG3 H -9.568 13.036 4.653 1.00 . A B . 42 GLU HG3 1 1 11 9007 1 1 42 GLU N N -7.177 12.298 3.676 1.00 . A B . 42 GLU N 1 1 11 9008 1 1 42 GLU O O -6.426 9.638 3.441 1.00 . A B . 42 GLU O 1 1 11 9009 1 1 42 GLU OE1 O -11.879 12.015 4.779 1.00 . A B . 42 GLU OE1 1 1 11 9010 1 1 42 GLU OE2 O -11.408 11.703 6.899 1.00 . A B . 42 GLU OE2 1 1 11 9011 1 1 43 ARG C C -6.140 7.186 6.529 1.00 . A B . 43 ARG C 1 1 11 9012 1 1 43 ARG CA C -5.458 8.183 5.599 1.00 . A B . 43 ARG CA 1 1 11 9013 1 1 43 ARG CB C -3.971 8.319 5.957 1.00 . A B . 43 ARG CB 1 1 11 9014 1 1 43 ARG CD C -2.226 8.964 7.662 1.00 . A B . 43 ARG CD 1 1 11 9015 1 1 43 ARG CG C -3.711 8.936 7.325 1.00 . A B . 43 ARG CG 1 1 11 9016 1 1 43 ARG CZ C -0.858 9.444 9.675 1.00 . A B . 43 ARG CZ 1 1 11 9017 1 1 43 ARG H H -6.252 9.897 6.542 1.00 . A B . 43 ARG H 1 1 11 9018 1 1 43 ARG HA H -5.544 7.823 4.586 1.00 . A B . 43 ARG HA 1 1 11 9019 1 1 43 ARG HB2 H -3.522 7.337 5.939 1.00 . A B . 43 ARG HB2 1 1 11 9020 1 1 43 ARG HB3 H -3.493 8.935 5.212 1.00 . A B . 43 ARG HB3 1 1 11 9021 1 1 43 ARG HD2 H -1.855 7.949 7.683 1.00 . A B . 43 ARG HD2 1 1 11 9022 1 1 43 ARG HD3 H -1.705 9.521 6.897 1.00 . A B . 43 ARG HD3 1 1 11 9023 1 1 43 ARG HE H -2.691 10.165 9.322 1.00 . A B . 43 ARG HE 1 1 11 9024 1 1 43 ARG HG2 H -4.089 9.947 7.331 1.00 . A B . 43 ARG HG2 1 1 11 9025 1 1 43 ARG HG3 H -4.226 8.353 8.074 1.00 . A B . 43 ARG HG3 1 1 11 9026 1 1 43 ARG HH11 H 0.037 8.159 8.377 1.00 . A B . 43 ARG HH11 1 1 11 9027 1 1 43 ARG HH12 H 0.960 8.556 9.797 1.00 . A B . 43 ARG HH12 1 1 11 9028 1 1 43 ARG HH21 H -1.465 10.668 11.172 1.00 . A B . 43 ARG HH21 1 1 11 9029 1 1 43 ARG HH22 H 0.113 9.973 11.373 1.00 . A B . 43 ARG HH22 1 1 11 9030 1 1 43 ARG N N -6.128 9.470 5.666 1.00 . A B . 43 ARG N 1 1 11 9031 1 1 43 ARG NE N -1.978 9.589 8.962 1.00 . A B . 43 ARG NE 1 1 11 9032 1 1 43 ARG NH1 N 0.124 8.659 9.248 1.00 . A B . 43 ARG NH1 1 1 11 9033 1 1 43 ARG NH2 N -0.726 10.079 10.830 1.00 . A B . 43 ARG NH2 1 1 11 9034 1 1 43 ARG O O -6.273 7.429 7.730 1.00 . A B . 43 ARG O 1 1 11 9035 1 1 44 THR C C -6.555 3.696 6.603 1.00 . A B . 44 THR C 1 1 11 9036 1 1 44 THR CA C -7.252 5.049 6.758 1.00 . A B . 44 THR CA 1 1 11 9037 1 1 44 THR CB C -8.735 4.917 6.354 1.00 . A B . 44 THR CB 1 1 11 9038 1 1 44 THR CG2 C -9.508 6.180 6.707 1.00 . A B . 44 THR CG2 1 1 11 9039 1 1 44 THR H H -6.493 5.947 5.003 1.00 . A B . 44 THR H 1 1 11 9040 1 1 44 THR HA H -7.208 5.351 7.795 1.00 . A B . 44 THR HA 1 1 11 9041 1 1 44 THR HB H -9.166 4.084 6.890 1.00 . A B . 44 THR HB 1 1 11 9042 1 1 44 THR HG1 H -8.300 3.908 4.710 1.00 . A B . 44 THR HG1 1 1 11 9043 1 1 44 THR HG21 H -9.081 7.020 6.180 1.00 . A B . 44 THR HG21 1 1 11 9044 1 1 44 THR HG22 H -9.447 6.354 7.771 1.00 . A B . 44 THR HG22 1 1 11 9045 1 1 44 THR HG23 H -10.542 6.062 6.418 1.00 . A B . 44 THR HG23 1 1 11 9046 1 1 44 THR N N -6.590 6.075 5.971 1.00 . A B . 44 THR N 1 1 11 9047 1 1 44 THR O O -6.996 2.849 5.826 1.00 . A B . 44 THR O 1 1 11 9048 1 1 44 THR OG1 O -8.841 4.676 4.944 1.00 . A B . 44 THR OG1 1 1 11 9049 1 1 45 PRO C C -5.455 1.017 7.812 1.00 . A B . 45 PRO C 1 1 11 9050 1 1 45 PRO CA C -4.686 2.219 7.266 1.00 . A B . 45 PRO CA 1 1 11 9051 1 1 45 PRO CB C -3.445 2.494 8.130 1.00 . A B . 45 PRO CB 1 1 11 9052 1 1 45 PRO CD C -4.864 4.411 8.301 1.00 . A B . 45 PRO CD 1 1 11 9053 1 1 45 PRO CG C -3.427 3.972 8.338 1.00 . A B . 45 PRO CG 1 1 11 9054 1 1 45 PRO HA H -4.381 2.011 6.251 1.00 . A B . 45 PRO HA 1 1 11 9055 1 1 45 PRO HB2 H -3.534 1.963 9.068 1.00 . A B . 45 PRO HB2 1 1 11 9056 1 1 45 PRO HB3 H -2.559 2.159 7.605 1.00 . A B . 45 PRO HB3 1 1 11 9057 1 1 45 PRO HD2 H -5.321 4.312 9.277 1.00 . A B . 45 PRO HD2 1 1 11 9058 1 1 45 PRO HD3 H -4.949 5.428 7.942 1.00 . A B . 45 PRO HD3 1 1 11 9059 1 1 45 PRO HG2 H -2.989 4.202 9.300 1.00 . A B . 45 PRO HG2 1 1 11 9060 1 1 45 PRO HG3 H -2.867 4.448 7.547 1.00 . A B . 45 PRO HG3 1 1 11 9061 1 1 45 PRO N N -5.457 3.470 7.345 1.00 . A B . 45 PRO N 1 1 11 9062 1 1 45 PRO O O -5.048 -0.129 7.629 1.00 . A B . 45 PRO O 1 1 11 9063 1 1 46 TRP C C -8.471 -0.195 8.000 1.00 . A B . 46 TRP C 1 1 11 9064 1 1 46 TRP CA C -7.419 0.230 9.022 1.00 . A B . 46 TRP CA 1 1 11 9065 1 1 46 TRP CB C -8.098 0.693 10.321 1.00 . A B . 46 TRP CB 1 1 11 9066 1 1 46 TRP CD1 C -10.187 2.094 9.801 1.00 . A B . 46 TRP CD1 1 1 11 9067 1 1 46 TRP CD2 C -8.392 3.300 10.377 1.00 . A B . 46 TRP CD2 1 1 11 9068 1 1 46 TRP CE2 C -9.459 4.179 10.117 1.00 . A B . 46 TRP CE2 1 1 11 9069 1 1 46 TRP CE3 C -7.157 3.836 10.761 1.00 . A B . 46 TRP CE3 1 1 11 9070 1 1 46 TRP CG C -8.877 1.969 10.169 1.00 . A B . 46 TRP CG 1 1 11 9071 1 1 46 TRP CH2 C -8.111 6.055 10.601 1.00 . A B . 46 TRP CH2 1 1 11 9072 1 1 46 TRP CZ2 C -9.329 5.559 10.226 1.00 . A B . 46 TRP CZ2 1 1 11 9073 1 1 46 TRP CZ3 C -7.031 5.208 10.868 1.00 . A B . 46 TRP CZ3 1 1 11 9074 1 1 46 TRP H H -6.822 2.223 8.625 1.00 . A B . 46 TRP H 1 1 11 9075 1 1 46 TRP HA H -6.787 -0.620 9.237 1.00 . A B . 46 TRP HA 1 1 11 9076 1 1 46 TRP HB2 H -8.783 -0.075 10.654 1.00 . A B . 46 TRP HB2 1 1 11 9077 1 1 46 TRP HB3 H -7.344 0.848 11.082 1.00 . A B . 46 TRP HB3 1 1 11 9078 1 1 46 TRP HD1 H -10.836 1.263 9.569 1.00 . A B . 46 TRP HD1 1 1 11 9079 1 1 46 TRP HE1 H -11.431 3.766 9.532 1.00 . A B . 46 TRP HE1 1 1 11 9080 1 1 46 TRP HE3 H -6.310 3.197 10.970 1.00 . A B . 46 TRP HE3 1 1 11 9081 1 1 46 TRP HH2 H -7.963 7.119 10.695 1.00 . A B . 46 TRP HH2 1 1 11 9082 1 1 46 TRP HZ2 H -10.154 6.227 10.024 1.00 . A B . 46 TRP HZ2 1 1 11 9083 1 1 46 TRP HZ3 H -6.087 5.642 11.161 1.00 . A B . 46 TRP HZ3 1 1 11 9084 1 1 46 TRP N N -6.569 1.288 8.484 1.00 . A B . 46 TRP N 1 1 11 9085 1 1 46 TRP NE1 N -10.541 3.419 9.766 1.00 . A B . 46 TRP NE1 1 1 11 9086 1 1 46 TRP O O -9.321 -1.041 8.282 1.00 . A B . 46 TRP O 1 1 11 9087 1 1 47 ASN C C -8.587 -0.291 4.483 1.00 . A B . 47 ASN C 1 1 11 9088 1 1 47 ASN CA C -9.346 0.075 5.749 1.00 . A B . 47 ASN CA 1 1 11 9089 1 1 47 ASN CB C -10.274 1.265 5.470 1.00 . A B . 47 ASN CB 1 1 11 9090 1 1 47 ASN CG C -11.352 0.930 4.451 1.00 . A B . 47 ASN CG 1 1 11 9091 1 1 47 ASN H H -7.677 1.024 6.633 1.00 . A B . 47 ASN H 1 1 11 9092 1 1 47 ASN HA H -9.938 -0.771 6.067 1.00 . A B . 47 ASN HA 1 1 11 9093 1 1 47 ASN HB2 H -10.754 1.568 6.390 1.00 . A B . 47 ASN HB2 1 1 11 9094 1 1 47 ASN HB3 H -9.689 2.090 5.087 1.00 . A B . 47 ASN HB3 1 1 11 9095 1 1 47 ASN HD21 H -11.336 2.800 3.770 1.00 . A B . 47 ASN HD21 1 1 11 9096 1 1 47 ASN HD22 H -12.453 1.724 2.998 1.00 . A B . 47 ASN HD22 1 1 11 9097 1 1 47 ASN N N -8.402 0.387 6.812 1.00 . A B . 47 ASN N 1 1 11 9098 1 1 47 ASN ND2 N -11.752 1.916 3.661 1.00 . A B . 47 ASN ND2 1 1 11 9099 1 1 47 ASN O O -7.752 0.479 4.010 1.00 . A B . 47 ASN O 1 1 11 9100 1 1 47 ASN OD1 O -11.818 -0.209 4.372 1.00 . A B . 47 ASN OD1 1 1 11 9101 1 1 48 CYS C C -8.980 -1.658 1.505 1.00 . A B . 48 CYS C 1 1 11 9102 1 1 48 CYS CA C -8.155 -1.922 2.762 1.00 . A B . 48 CYS CA 1 1 11 9103 1 1 48 CYS CB C -7.849 -3.419 2.895 1.00 . A B . 48 CYS CB 1 1 11 9104 1 1 48 CYS H H -9.549 -2.035 4.342 1.00 . A B . 48 CYS H 1 1 11 9105 1 1 48 CYS HA H -7.229 -1.371 2.698 1.00 . A B . 48 CYS HA 1 1 11 9106 1 1 48 CYS HB2 H -7.358 -3.596 3.840 1.00 . A B . 48 CYS HB2 1 1 11 9107 1 1 48 CYS HB3 H -8.777 -3.972 2.870 1.00 . A B . 48 CYS HB3 1 1 11 9108 1 1 48 CYS N N -8.861 -1.464 3.940 1.00 . A B . 48 CYS N 1 1 11 9109 1 1 48 CYS O O -10.102 -2.151 1.374 1.00 . A B . 48 CYS O 1 1 11 9110 1 1 48 CYS SG S -6.783 -4.073 1.593 1.00 . A B . 48 CYS SG 1 1 11 9111 1 1 49 ILE C C -9.026 -1.769 -1.653 1.00 . A B . 49 ILE C 1 1 11 9112 1 1 49 ILE CA C -9.094 -0.594 -0.682 1.00 . A B . 49 ILE CA 1 1 11 9113 1 1 49 ILE CB C -8.531 0.676 -1.373 1.00 . A B . 49 ILE CB 1 1 11 9114 1 1 49 ILE CD1 C -6.419 1.708 -2.369 1.00 . A B . 49 ILE CD1 1 1 11 9115 1 1 49 ILE CG1 C -7.006 0.607 -1.509 1.00 . A B . 49 ILE CG1 1 1 11 9116 1 1 49 ILE CG2 C -8.940 1.930 -0.610 1.00 . A B . 49 ILE CG2 1 1 11 9117 1 1 49 ILE H H -7.511 -0.538 0.731 1.00 . A B . 49 ILE H 1 1 11 9118 1 1 49 ILE HA H -10.132 -0.411 -0.442 1.00 . A B . 49 ILE HA 1 1 11 9119 1 1 49 ILE HB H -8.964 0.733 -2.361 1.00 . A B . 49 ILE HB 1 1 11 9120 1 1 49 ILE HD11 H -6.823 1.640 -3.369 1.00 . A B . 49 ILE HD11 1 1 11 9121 1 1 49 ILE HD12 H -5.343 1.603 -2.407 1.00 . A B . 49 ILE HD12 1 1 11 9122 1 1 49 ILE HD13 H -6.671 2.669 -1.944 1.00 . A B . 49 ILE HD13 1 1 11 9123 1 1 49 ILE HG12 H -6.566 0.690 -0.529 1.00 . A B . 49 ILE HG12 1 1 11 9124 1 1 49 ILE HG13 H -6.732 -0.342 -1.947 1.00 . A B . 49 ILE HG13 1 1 11 9125 1 1 49 ILE HG21 H -10.018 2.007 -0.590 1.00 . A B . 49 ILE HG21 1 1 11 9126 1 1 49 ILE HG22 H -8.527 2.800 -1.101 1.00 . A B . 49 ILE HG22 1 1 11 9127 1 1 49 ILE HG23 H -8.564 1.877 0.400 1.00 . A B . 49 ILE HG23 1 1 11 9128 1 1 49 ILE N N -8.408 -0.904 0.570 1.00 . A B . 49 ILE N 1 1 11 9129 1 1 49 ILE O O -9.891 -1.927 -2.513 1.00 . A B . 49 ILE O 1 1 11 9130 1 1 50 PHE C C -8.765 -4.892 -1.970 1.00 . A B . 50 PHE C 1 1 11 9131 1 1 50 PHE CA C -7.836 -3.760 -2.375 1.00 . A B . 50 PHE CA 1 1 11 9132 1 1 50 PHE CB C -6.380 -4.229 -2.435 1.00 . A B . 50 PHE CB 1 1 11 9133 1 1 50 PHE CD1 C -5.141 -2.286 -3.420 1.00 . A B . 50 PHE CD1 1 1 11 9134 1 1 50 PHE CD2 C -5.418 -4.244 -4.748 1.00 . A B . 50 PHE CD2 1 1 11 9135 1 1 50 PHE CE1 C -4.462 -1.675 -4.454 1.00 . A B . 50 PHE CE1 1 1 11 9136 1 1 50 PHE CE2 C -4.742 -3.640 -5.789 1.00 . A B . 50 PHE CE2 1 1 11 9137 1 1 50 PHE CG C -5.622 -3.576 -3.553 1.00 . A B . 50 PHE CG 1 1 11 9138 1 1 50 PHE CZ C -4.264 -2.353 -5.643 1.00 . A B . 50 PHE CZ 1 1 11 9139 1 1 50 PHE H H -7.399 -2.481 -0.742 1.00 . A B . 50 PHE H 1 1 11 9140 1 1 50 PHE HA H -8.128 -3.438 -3.367 1.00 . A B . 50 PHE HA 1 1 11 9141 1 1 50 PHE HB2 H -5.882 -3.990 -1.505 1.00 . A B . 50 PHE HB2 1 1 11 9142 1 1 50 PHE HB3 H -6.356 -5.299 -2.594 1.00 . A B . 50 PHE HB3 1 1 11 9143 1 1 50 PHE HD1 H -5.294 -1.757 -2.493 1.00 . A B . 50 PHE HD1 1 1 11 9144 1 1 50 PHE HD2 H -5.790 -5.252 -4.862 1.00 . A B . 50 PHE HD2 1 1 11 9145 1 1 50 PHE HE1 H -4.090 -0.669 -4.336 1.00 . A B . 50 PHE HE1 1 1 11 9146 1 1 50 PHE HE2 H -4.589 -4.173 -6.716 1.00 . A B . 50 PHE HE2 1 1 11 9147 1 1 50 PHE HZ H -3.738 -1.876 -6.456 1.00 . A B . 50 PHE HZ 1 1 11 9148 1 1 50 PHE N N -8.004 -2.606 -1.499 1.00 . A B . 50 PHE N 1 1 11 9149 1 1 50 PHE O O -9.218 -5.658 -2.807 1.00 . A B . 50 PHE O 1 1 11 9150 1 1 51 CYS C C -11.428 -5.608 -0.620 1.00 . A B . 51 CYS C 1 1 11 9151 1 1 51 CYS CA C -10.007 -6.000 -0.222 1.00 . A B . 51 CYS CA 1 1 11 9152 1 1 51 CYS CB C -9.910 -6.217 1.291 1.00 . A B . 51 CYS CB 1 1 11 9153 1 1 51 CYS H H -8.627 -4.398 -0.037 1.00 . A B . 51 CYS H 1 1 11 9154 1 1 51 CYS HA H -9.762 -6.928 -0.722 1.00 . A B . 51 CYS HA 1 1 11 9155 1 1 51 CYS HB2 H -9.713 -5.274 1.775 1.00 . A B . 51 CYS HB2 1 1 11 9156 1 1 51 CYS HB3 H -10.853 -6.606 1.650 1.00 . A B . 51 CYS HB3 1 1 11 9157 1 1 51 CYS N N -9.053 -5.000 -0.681 1.00 . A B . 51 CYS N 1 1 11 9158 1 1 51 CYS O O -12.244 -6.466 -0.955 1.00 . A B . 51 CYS O 1 1 11 9159 1 1 51 CYS SG S -8.614 -7.376 1.792 1.00 . A B . 51 CYS SG 1 1 11 9160 1 1 52 ARG C C -13.228 -3.826 -2.528 1.00 . A B . 52 ARG C 1 1 11 9161 1 1 52 ARG CA C -13.042 -3.825 -1.009 1.00 . A B . 52 ARG CA 1 1 11 9162 1 1 52 ARG CB C -13.298 -2.414 -0.464 1.00 . A B . 52 ARG CB 1 1 11 9163 1 1 52 ARG CD C -14.823 -3.061 1.458 1.00 . A B . 52 ARG CD 1 1 11 9164 1 1 52 ARG CG C -13.538 -2.347 1.041 1.00 . A B . 52 ARG CG 1 1 11 9165 1 1 52 ARG CZ C -15.686 -5.368 1.200 1.00 . A B . 52 ARG CZ 1 1 11 9166 1 1 52 ARG H H -11.068 -3.659 -0.280 1.00 . A B . 52 ARG H 1 1 11 9167 1 1 52 ARG HA H -13.771 -4.495 -0.579 1.00 . A B . 52 ARG HA 1 1 11 9168 1 1 52 ARG HB2 H -12.444 -1.795 -0.695 1.00 . A B . 52 ARG HB2 1 1 11 9169 1 1 52 ARG HB3 H -14.165 -2.005 -0.963 1.00 . A B . 52 ARG HB3 1 1 11 9170 1 1 52 ARG HD2 H -15.082 -2.749 2.459 1.00 . A B . 52 ARG HD2 1 1 11 9171 1 1 52 ARG HD3 H -15.616 -2.775 0.781 1.00 . A B . 52 ARG HD3 1 1 11 9172 1 1 52 ARG HE H -13.796 -4.886 1.651 1.00 . A B . 52 ARG HE 1 1 11 9173 1 1 52 ARG HG2 H -12.704 -2.809 1.548 1.00 . A B . 52 ARG HG2 1 1 11 9174 1 1 52 ARG HG3 H -13.604 -1.308 1.335 1.00 . A B . 52 ARG HG3 1 1 11 9175 1 1 52 ARG HH11 H -17.060 -3.925 0.800 1.00 . A B . 52 ARG HH11 1 1 11 9176 1 1 52 ARG HH12 H -17.646 -5.556 0.703 1.00 . A B . 52 ARG HH12 1 1 11 9177 1 1 52 ARG HH21 H -14.558 -7.029 1.492 1.00 . A B . 52 ARG HH21 1 1 11 9178 1 1 52 ARG HH22 H -16.218 -7.321 1.078 1.00 . A B . 52 ARG HH22 1 1 11 9179 1 1 52 ARG N N -11.723 -4.309 -0.608 1.00 . A B . 52 ARG N 1 1 11 9180 1 1 52 ARG NE N -14.686 -4.519 1.442 1.00 . A B . 52 ARG NE 1 1 11 9181 1 1 52 ARG NH1 N -16.892 -4.913 0.874 1.00 . A B . 52 ARG NH1 1 1 11 9182 1 1 52 ARG NH2 N -15.471 -6.677 1.262 1.00 . A B . 52 ARG NH2 1 1 11 9183 1 1 52 ARG O O -14.153 -3.198 -3.039 1.00 . A B . 52 ARG O 1 1 11 9184 1 1 53 MET C C -13.413 -5.898 -4.967 1.00 . A B . 53 MET C 1 1 11 9185 1 1 53 MET CA C -12.547 -4.674 -4.693 1.00 . A B . 53 MET CA 1 1 11 9186 1 1 53 MET CB C -11.206 -4.796 -5.434 1.00 . A B . 53 MET CB 1 1 11 9187 1 1 53 MET CE C -8.521 -7.959 -5.921 1.00 . A B . 53 MET CE 1 1 11 9188 1 1 53 MET CG C -10.575 -6.182 -5.374 1.00 . A B . 53 MET CG 1 1 11 9189 1 1 53 MET H H -11.571 -4.909 -2.818 1.00 . A B . 53 MET H 1 1 11 9190 1 1 53 MET HA H -13.069 -3.800 -5.049 1.00 . A B . 53 MET HA 1 1 11 9191 1 1 53 MET HB2 H -11.361 -4.544 -6.472 1.00 . A B . 53 MET HB2 1 1 11 9192 1 1 53 MET HB3 H -10.509 -4.091 -5.006 1.00 . A B . 53 MET HB3 1 1 11 9193 1 1 53 MET HE1 H -9.272 -8.637 -6.302 1.00 . A B . 53 MET HE1 1 1 11 9194 1 1 53 MET HE2 H -8.422 -8.094 -4.855 1.00 . A B . 53 MET HE2 1 1 11 9195 1 1 53 MET HE3 H -7.575 -8.165 -6.400 1.00 . A B . 53 MET HE3 1 1 11 9196 1 1 53 MET HG2 H -10.397 -6.440 -4.341 1.00 . A B . 53 MET HG2 1 1 11 9197 1 1 53 MET HG3 H -11.263 -6.894 -5.807 1.00 . A B . 53 MET HG3 1 1 11 9198 1 1 53 MET N N -12.357 -4.516 -3.252 1.00 . A B . 53 MET N 1 1 11 9199 1 1 53 MET O O -13.751 -6.199 -6.110 1.00 . A B . 53 MET O 1 1 11 9200 1 1 53 MET SD S -9.011 -6.271 -6.269 1.00 . A B . 53 MET SD 1 1 11 9201 1 1 54 LYS C C -15.973 -7.512 -3.401 1.00 . A B . 54 LYS C 1 1 11 9202 1 1 54 LYS CA C -14.592 -7.789 -3.998 1.00 . A B . 54 LYS CA 1 1 11 9203 1 1 54 LYS CB C -13.901 -8.948 -3.261 1.00 . A B . 54 LYS CB 1 1 11 9204 1 1 54 LYS CD C -13.902 -11.364 -2.579 1.00 . A B . 54 LYS CD 1 1 11 9205 1 1 54 LYS CE C -14.549 -12.730 -2.753 1.00 . A B . 54 LYS CE 1 1 11 9206 1 1 54 LYS CG C -14.549 -10.313 -3.467 1.00 . A B . 54 LYS CG 1 1 11 9207 1 1 54 LYS H H -13.457 -6.309 -3.021 1.00 . A B . 54 LYS H 1 1 11 9208 1 1 54 LYS HA H -14.701 -8.038 -5.043 1.00 . A B . 54 LYS HA 1 1 11 9209 1 1 54 LYS HB2 H -12.877 -9.011 -3.599 1.00 . A B . 54 LYS HB2 1 1 11 9210 1 1 54 LYS HB3 H -13.903 -8.729 -2.203 1.00 . A B . 54 LYS HB3 1 1 11 9211 1 1 54 LYS HD2 H -12.856 -11.440 -2.833 1.00 . A B . 54 LYS HD2 1 1 11 9212 1 1 54 LYS HD3 H -14.002 -11.059 -1.547 1.00 . A B . 54 LYS HD3 1 1 11 9213 1 1 54 LYS HE2 H -14.102 -13.417 -2.053 1.00 . A B . 54 LYS HE2 1 1 11 9214 1 1 54 LYS HE3 H -15.604 -12.642 -2.544 1.00 . A B . 54 LYS HE3 1 1 11 9215 1 1 54 LYS HG2 H -15.598 -10.246 -3.224 1.00 . A B . 54 LYS HG2 1 1 11 9216 1 1 54 LYS HG3 H -14.431 -10.605 -4.501 1.00 . A B . 54 LYS HG3 1 1 11 9217 1 1 54 LYS HZ1 H -14.767 -14.223 -4.196 1.00 . A B . 54 LYS HZ1 1 1 11 9218 1 1 54 LYS HZ2 H -13.360 -13.304 -4.374 1.00 . A B . 54 LYS HZ2 1 1 11 9219 1 1 54 LYS HZ3 H -14.855 -12.655 -4.818 1.00 . A B . 54 LYS HZ3 1 1 11 9220 1 1 54 LYS N N -13.766 -6.600 -3.902 1.00 . A B . 54 LYS N 1 1 11 9221 1 1 54 LYS NZ N -14.370 -13.264 -4.130 1.00 . A B . 54 LYS NZ 1 1 11 9222 1 1 54 LYS O O -16.390 -8.152 -2.436 1.00 . A B . 54 LYS O 1 1 11 9223 1 1 55 GLU C C -19.053 -6.610 -4.511 1.00 . A B . 55 GLU C 1 1 11 9224 1 1 55 GLU CA C -18.003 -6.188 -3.493 1.00 . A B . 55 GLU CA 1 1 11 9225 1 1 55 GLU CB C -18.112 -4.689 -3.213 1.00 . A B . 55 GLU CB 1 1 11 9226 1 1 55 GLU CD C -17.329 -2.750 -1.799 1.00 . A B . 55 GLU CD 1 1 11 9227 1 1 55 GLU CG C -17.066 -4.173 -2.239 1.00 . A B . 55 GLU CG 1 1 11 9228 1 1 55 GLU H H -16.287 -6.045 -4.726 1.00 . A B . 55 GLU H 1 1 11 9229 1 1 55 GLU HA H -18.177 -6.727 -2.575 1.00 . A B . 55 GLU HA 1 1 11 9230 1 1 55 GLU HB2 H -18.005 -4.152 -4.143 1.00 . A B . 55 GLU HB2 1 1 11 9231 1 1 55 GLU HB3 H -19.088 -4.486 -2.799 1.00 . A B . 55 GLU HB3 1 1 11 9232 1 1 55 GLU HG2 H -17.063 -4.808 -1.366 1.00 . A B . 55 GLU HG2 1 1 11 9233 1 1 55 GLU HG3 H -16.098 -4.215 -2.716 1.00 . A B . 55 GLU HG3 1 1 11 9234 1 1 55 GLU N N -16.671 -6.537 -3.967 1.00 . A B . 55 GLU N 1 1 11 9235 1 1 55 GLU O O -19.833 -5.791 -5.005 1.00 . A B . 55 GLU O 1 1 11 9236 1 1 55 GLU OE1 O -17.283 -1.836 -2.649 1.00 . A B . 55 GLU OE1 1 1 11 9237 1 1 55 GLU OE2 O -17.583 -2.533 -0.594 1.00 . A B . 55 GLU OE2 1 1 11 9238 1 1 56 SER C C -20.795 -9.573 -5.164 1.00 . A B . 56 SER C 1 1 11 9239 1 1 56 SER CA C -19.987 -8.445 -5.793 1.00 . A B . 56 SER CA 1 1 11 9240 1 1 56 SER CB C -19.220 -8.952 -7.017 1.00 . A B . 56 SER CB 1 1 11 9241 1 1 56 SER H H -18.434 -8.492 -4.370 1.00 . A B . 56 SER H 1 1 11 9242 1 1 56 SER HA H -20.660 -7.657 -6.098 1.00 . A B . 56 SER HA 1 1 11 9243 1 1 56 SER HB2 H -18.627 -9.811 -6.738 1.00 . A B . 56 SER HB2 1 1 11 9244 1 1 56 SER HB3 H -19.922 -9.235 -7.786 1.00 . A B . 56 SER HB3 1 1 11 9245 1 1 56 SER HG H -18.853 -7.123 -7.627 1.00 . A B . 56 SER HG 1 1 11 9246 1 1 56 SER N N -19.062 -7.894 -4.820 1.00 . A B . 56 SER N 1 1 11 9247 1 1 56 SER O O -21.944 -9.325 -4.751 1.00 . A B . 56 SER O 1 1 11 9248 1 1 56 SER OXT O -20.267 -10.697 -5.052 1.00 . A B . 56 SER OXT 1 1 11 9249 1 1 56 SER OG O -18.359 -7.947 -7.530 1.00 . A B . 56 SER OG 1 1 11 9250 2 2 1 ZN ZN ZN -6.548 -6.356 1.805 1.00 . B B . 101 ZN ZN 1 1 11 9251 3 2 1 ZN ZN ZN 5.761 1.133 0.289 1.00 . C B . 102 ZN ZN 1 1 12 9252 1 1 1 GLY C C 12.203 -11.170 8.886 1.00 . A B . 1 GLY C 1 1 12 9253 1 1 1 GLY CA C 12.176 -12.681 8.998 1.00 . A B . 1 GLY CA 1 1 12 9254 1 1 1 GLY H1 H 11.924 -13.067 6.973 1.00 . A B . 1 GLY H1 1 1 12 9255 1 1 1 GLY H2 H 10.477 -12.965 7.836 1.00 . A B . 1 GLY H2 1 1 12 9256 1 1 1 GLY H3 H 11.450 -14.341 7.976 1.00 . A B . 1 GLY H3 1 1 12 9257 1 1 1 GLY HA2 H 11.686 -12.954 9.920 1.00 . A B . 1 GLY HA2 1 1 12 9258 1 1 1 GLY HA3 H 13.191 -13.049 9.015 1.00 . A B . 1 GLY HA3 1 1 12 9259 1 1 1 GLY N N 11.457 -13.309 7.868 1.00 . A B . 1 GLY N 1 1 12 9260 1 1 1 GLY O O 11.209 -10.551 8.503 1.00 . A B . 1 GLY O 1 1 12 9261 1 1 2 ALA C C 14.089 -8.604 7.911 1.00 . A B . 2 ALA C 1 1 12 9262 1 1 2 ALA CA C 13.468 -9.122 9.203 1.00 . A B . 2 ALA CA 1 1 12 9263 1 1 2 ALA CB C 14.285 -8.672 10.405 1.00 . A B . 2 ALA CB 1 1 12 9264 1 1 2 ALA H H 14.130 -11.125 9.416 1.00 . A B . 2 ALA H 1 1 12 9265 1 1 2 ALA HA H 12.475 -8.709 9.298 1.00 . A B . 2 ALA HA 1 1 12 9266 1 1 2 ALA HB1 H 15.296 -9.038 10.311 1.00 . A B . 2 ALA HB1 1 1 12 9267 1 1 2 ALA HB2 H 13.843 -9.064 11.310 1.00 . A B . 2 ALA HB2 1 1 12 9268 1 1 2 ALA HB3 H 14.296 -7.593 10.449 1.00 . A B . 2 ALA HB3 1 1 12 9269 1 1 2 ALA N N 13.345 -10.574 9.192 1.00 . A B . 2 ALA N 1 1 12 9270 1 1 2 ALA O O 14.471 -7.434 7.819 1.00 . A B . 2 ALA O 1 1 12 9271 1 1 3 MET C C 14.085 -9.898 4.509 1.00 . A B . 3 MET C 1 1 12 9272 1 1 3 MET CA C 14.744 -9.090 5.625 1.00 . A B . 3 MET CA 1 1 12 9273 1 1 3 MET CB C 16.265 -9.287 5.625 1.00 . A B . 3 MET CB 1 1 12 9274 1 1 3 MET CE C 17.628 -6.652 2.683 1.00 . A B . 3 MET CE 1 1 12 9275 1 1 3 MET CG C 16.961 -8.727 4.389 1.00 . A B . 3 MET CG 1 1 12 9276 1 1 3 MET H H 13.869 -10.394 7.046 1.00 . A B . 3 MET H 1 1 12 9277 1 1 3 MET HA H 14.526 -8.043 5.469 1.00 . A B . 3 MET HA 1 1 12 9278 1 1 3 MET HB2 H 16.677 -8.798 6.497 1.00 . A B . 3 MET HB2 1 1 12 9279 1 1 3 MET HB3 H 16.480 -10.344 5.685 1.00 . A B . 3 MET HB3 1 1 12 9280 1 1 3 MET HE1 H 17.580 -5.602 2.435 1.00 . A B . 3 MET HE1 1 1 12 9281 1 1 3 MET HE2 H 17.229 -7.234 1.864 1.00 . A B . 3 MET HE2 1 1 12 9282 1 1 3 MET HE3 H 18.655 -6.934 2.856 1.00 . A B . 3 MET HE3 1 1 12 9283 1 1 3 MET HG2 H 18.024 -8.888 4.485 1.00 . A B . 3 MET HG2 1 1 12 9284 1 1 3 MET HG3 H 16.597 -9.253 3.518 1.00 . A B . 3 MET HG3 1 1 12 9285 1 1 3 MET N N 14.184 -9.471 6.913 1.00 . A B . 3 MET N 1 1 12 9286 1 1 3 MET O O 14.750 -10.562 3.712 1.00 . A B . 3 MET O 1 1 12 9287 1 1 3 MET SD S 16.665 -6.962 4.162 1.00 . A B . 3 MET SD 1 1 12 9288 1 1 4 GLY C C 11.219 -9.592 2.595 1.00 . A B . 4 GLY C 1 1 12 9289 1 1 4 GLY CA C 12.031 -10.545 3.437 1.00 . A B . 4 GLY CA 1 1 12 9290 1 1 4 GLY H H 12.283 -9.338 5.156 1.00 . A B . 4 GLY H 1 1 12 9291 1 1 4 GLY HA2 H 12.730 -11.070 2.802 1.00 . A B . 4 GLY HA2 1 1 12 9292 1 1 4 GLY HA3 H 11.367 -11.262 3.895 1.00 . A B . 4 GLY HA3 1 1 12 9293 1 1 4 GLY N N 12.766 -9.852 4.472 1.00 . A B . 4 GLY N 1 1 12 9294 1 1 4 GLY O O 11.406 -9.507 1.383 1.00 . A B . 4 GLY O 1 1 12 9295 1 1 5 MET C C 10.208 -6.564 2.386 1.00 . A B . 5 MET C 1 1 12 9296 1 1 5 MET CA C 9.481 -7.893 2.552 1.00 . A B . 5 MET CA 1 1 12 9297 1 1 5 MET CB C 8.162 -7.679 3.309 1.00 . A B . 5 MET CB 1 1 12 9298 1 1 5 MET CE C 6.886 -11.450 4.602 1.00 . A B . 5 MET CE 1 1 12 9299 1 1 5 MET CG C 7.331 -8.944 3.494 1.00 . A B . 5 MET CG 1 1 12 9300 1 1 5 MET H H 10.243 -8.954 4.216 1.00 . A B . 5 MET H 1 1 12 9301 1 1 5 MET HA H 9.264 -8.291 1.573 1.00 . A B . 5 MET HA 1 1 12 9302 1 1 5 MET HB2 H 8.386 -7.278 4.286 1.00 . A B . 5 MET HB2 1 1 12 9303 1 1 5 MET HB3 H 7.566 -6.960 2.766 1.00 . A B . 5 MET HB3 1 1 12 9304 1 1 5 MET HE1 H 7.192 -12.230 5.284 1.00 . A B . 5 MET HE1 1 1 12 9305 1 1 5 MET HE2 H 6.870 -11.838 3.594 1.00 . A B . 5 MET HE2 1 1 12 9306 1 1 5 MET HE3 H 5.899 -11.105 4.871 1.00 . A B . 5 MET HE3 1 1 12 9307 1 1 5 MET HG2 H 6.344 -8.664 3.831 1.00 . A B . 5 MET HG2 1 1 12 9308 1 1 5 MET HG3 H 7.252 -9.451 2.543 1.00 . A B . 5 MET HG3 1 1 12 9309 1 1 5 MET N N 10.332 -8.851 3.243 1.00 . A B . 5 MET N 1 1 12 9310 1 1 5 MET O O 9.704 -5.508 2.763 1.00 . A B . 5 MET O 1 1 12 9311 1 1 5 MET SD S 8.042 -10.086 4.698 1.00 . A B . 5 MET SD 1 1 12 9312 1 1 6 ARG C C 11.898 -4.793 0.260 1.00 . A B . 6 ARG C 1 1 12 9313 1 1 6 ARG CA C 12.218 -5.441 1.606 1.00 . A B . 6 ARG CA 1 1 12 9314 1 1 6 ARG CB C 13.702 -5.818 1.701 1.00 . A B . 6 ARG CB 1 1 12 9315 1 1 6 ARG CD C 14.366 -3.753 2.991 1.00 . A B . 6 ARG CD 1 1 12 9316 1 1 6 ARG CG C 14.653 -4.630 1.781 1.00 . A B . 6 ARG CG 1 1 12 9317 1 1 6 ARG CZ C 14.582 -3.926 5.446 1.00 . A B . 6 ARG CZ 1 1 12 9318 1 1 6 ARG H H 11.716 -7.496 1.468 1.00 . A B . 6 ARG H 1 1 12 9319 1 1 6 ARG HA H 11.978 -4.742 2.393 1.00 . A B . 6 ARG HA 1 1 12 9320 1 1 6 ARG HB2 H 13.850 -6.424 2.582 1.00 . A B . 6 ARG HB2 1 1 12 9321 1 1 6 ARG HB3 H 13.964 -6.400 0.831 1.00 . A B . 6 ARG HB3 1 1 12 9322 1 1 6 ARG HD2 H 15.088 -2.951 3.016 1.00 . A B . 6 ARG HD2 1 1 12 9323 1 1 6 ARG HD3 H 13.374 -3.340 2.893 1.00 . A B . 6 ARG HD3 1 1 12 9324 1 1 6 ARG HE H 14.399 -5.478 4.196 1.00 . A B . 6 ARG HE 1 1 12 9325 1 1 6 ARG HG2 H 15.665 -4.998 1.848 1.00 . A B . 6 ARG HG2 1 1 12 9326 1 1 6 ARG HG3 H 14.544 -4.037 0.884 1.00 . A B . 6 ARG HG3 1 1 12 9327 1 1 6 ARG HH11 H 14.609 -2.024 4.735 1.00 . A B . 6 ARG HH11 1 1 12 9328 1 1 6 ARG HH12 H 14.754 -2.173 6.458 1.00 . A B . 6 ARG HH12 1 1 12 9329 1 1 6 ARG HH21 H 14.589 -5.681 6.462 1.00 . A B . 6 ARG HH21 1 1 12 9330 1 1 6 ARG HH22 H 14.753 -4.255 7.439 1.00 . A B . 6 ARG HH22 1 1 12 9331 1 1 6 ARG N N 11.391 -6.625 1.796 1.00 . A B . 6 ARG N 1 1 12 9332 1 1 6 ARG NE N 14.447 -4.497 4.248 1.00 . A B . 6 ARG NE 1 1 12 9333 1 1 6 ARG NH1 N 14.654 -2.601 5.553 1.00 . A B . 6 ARG NH1 1 1 12 9334 1 1 6 ARG NH2 N 14.644 -4.681 6.535 1.00 . A B . 6 ARG NH2 1 1 12 9335 1 1 6 ARG O O 12.759 -4.210 -0.401 1.00 . A B . 6 ARG O 1 1 12 9336 1 1 7 ASN C C 9.990 -2.807 -1.227 1.00 . A B . 7 ASN C 1 1 12 9337 1 1 7 ASN CA C 10.184 -4.310 -1.393 1.00 . A B . 7 ASN CA 1 1 12 9338 1 1 7 ASN CB C 8.876 -4.976 -1.850 1.00 . A B . 7 ASN CB 1 1 12 9339 1 1 7 ASN CG C 8.507 -4.642 -3.288 1.00 . A B . 7 ASN CG 1 1 12 9340 1 1 7 ASN H H 9.995 -5.342 0.449 1.00 . A B . 7 ASN H 1 1 12 9341 1 1 7 ASN HA H 10.948 -4.482 -2.130 1.00 . A B . 7 ASN HA 1 1 12 9342 1 1 7 ASN HB2 H 8.980 -6.048 -1.771 1.00 . A B . 7 ASN HB2 1 1 12 9343 1 1 7 ASN HB3 H 8.070 -4.651 -1.208 1.00 . A B . 7 ASN HB3 1 1 12 9344 1 1 7 ASN HD21 H 10.414 -4.726 -3.842 1.00 . A B . 7 ASN HD21 1 1 12 9345 1 1 7 ASN HD22 H 9.284 -4.333 -5.090 1.00 . A B . 7 ASN HD22 1 1 12 9346 1 1 7 ASN N N 10.637 -4.882 -0.131 1.00 . A B . 7 ASN N 1 1 12 9347 1 1 7 ASN ND2 N 9.501 -4.561 -4.160 1.00 . A B . 7 ASN ND2 1 1 12 9348 1 1 7 ASN O O 9.930 -2.057 -2.199 1.00 . A B . 7 ASN O 1 1 12 9349 1 1 7 ASN OD1 O 7.330 -4.505 -3.619 1.00 . A B . 7 ASN OD1 1 1 12 9350 1 1 8 LEU C C 11.041 -0.178 0.199 1.00 . A B . 8 LEU C 1 1 12 9351 1 1 8 LEU CA C 9.744 -0.967 0.356 1.00 . A B . 8 LEU CA 1 1 12 9352 1 1 8 LEU CB C 9.188 -0.827 1.782 1.00 . A B . 8 LEU CB 1 1 12 9353 1 1 8 LEU CD1 C 11.026 -0.465 3.468 1.00 . A B . 8 LEU CD1 1 1 12 9354 1 1 8 LEU CD2 C 9.126 -2.008 3.992 1.00 . A B . 8 LEU CD2 1 1 12 9355 1 1 8 LEU CG C 10.029 -1.464 2.896 1.00 . A B . 8 LEU CG 1 1 12 9356 1 1 8 LEU H H 10.031 -3.024 0.756 1.00 . A B . 8 LEU H 1 1 12 9357 1 1 8 LEU HA H 9.018 -0.573 -0.339 1.00 . A B . 8 LEU HA 1 1 12 9358 1 1 8 LEU HB2 H 9.088 0.227 2.000 1.00 . A B . 8 LEU HB2 1 1 12 9359 1 1 8 LEU HB3 H 8.208 -1.274 1.804 1.00 . A B . 8 LEU HB3 1 1 12 9360 1 1 8 LEU HD11 H 11.676 -0.114 2.682 1.00 . A B . 8 LEU HD11 1 1 12 9361 1 1 8 LEU HD12 H 11.615 -0.943 4.237 1.00 . A B . 8 LEU HD12 1 1 12 9362 1 1 8 LEU HD13 H 10.492 0.372 3.894 1.00 . A B . 8 LEU HD13 1 1 12 9363 1 1 8 LEU HD21 H 9.730 -2.453 4.770 1.00 . A B . 8 LEU HD21 1 1 12 9364 1 1 8 LEU HD22 H 8.466 -2.756 3.578 1.00 . A B . 8 LEU HD22 1 1 12 9365 1 1 8 LEU HD23 H 8.539 -1.203 4.409 1.00 . A B . 8 LEU HD23 1 1 12 9366 1 1 8 LEU HG H 10.589 -2.291 2.485 1.00 . A B . 8 LEU HG 1 1 12 9367 1 1 8 LEU N N 9.939 -2.374 0.029 1.00 . A B . 8 LEU N 1 1 12 9368 1 1 8 LEU O O 11.048 1.050 0.285 1.00 . A B . 8 LEU O 1 1 12 9369 1 1 9 ASP C C 13.535 0.368 -1.599 1.00 . A B . 9 ASP C 1 1 12 9370 1 1 9 ASP CA C 13.433 -0.255 -0.214 1.00 . A B . 9 ASP CA 1 1 12 9371 1 1 9 ASP CB C 14.559 -1.268 -0.003 1.00 . A B . 9 ASP CB 1 1 12 9372 1 1 9 ASP CG C 15.930 -0.625 -0.073 1.00 . A B . 9 ASP CG 1 1 12 9373 1 1 9 ASP H H 12.042 -1.862 -0.150 1.00 . A B . 9 ASP H 1 1 12 9374 1 1 9 ASP HA H 13.513 0.525 0.526 1.00 . A B . 9 ASP HA 1 1 12 9375 1 1 9 ASP HB2 H 14.446 -1.723 0.969 1.00 . A B . 9 ASP HB2 1 1 12 9376 1 1 9 ASP HB3 H 14.498 -2.031 -0.763 1.00 . A B . 9 ASP HB3 1 1 12 9377 1 1 9 ASP N N 12.130 -0.891 -0.053 1.00 . A B . 9 ASP N 1 1 12 9378 1 1 9 ASP O O 14.163 1.411 -1.787 1.00 . A B . 9 ASP O 1 1 12 9379 1 1 9 ASP OD1 O 16.347 0.018 0.912 1.00 . A B . 9 ASP OD1 1 1 12 9380 1 1 9 ASP OD2 O 16.600 -0.763 -1.119 1.00 . A B . 9 ASP OD2 1 1 12 9381 1 1 10 GLU C C 11.503 0.897 -4.189 1.00 . A B . 10 GLU C 1 1 12 9382 1 1 10 GLU CA C 12.838 0.204 -3.932 1.00 . A B . 10 GLU CA 1 1 12 9383 1 1 10 GLU CB C 13.042 -0.963 -4.897 1.00 . A B . 10 GLU CB 1 1 12 9384 1 1 10 GLU CD C 14.436 -2.994 -5.461 1.00 . A B . 10 GLU CD 1 1 12 9385 1 1 10 GLU CG C 14.307 -1.756 -4.606 1.00 . A B . 10 GLU CG 1 1 12 9386 1 1 10 GLU H H 12.462 -1.135 -2.338 1.00 . A B . 10 GLU H 1 1 12 9387 1 1 10 GLU HA H 13.635 0.918 -4.064 1.00 . A B . 10 GLU HA 1 1 12 9388 1 1 10 GLU HB2 H 12.195 -1.629 -4.827 1.00 . A B . 10 GLU HB2 1 1 12 9389 1 1 10 GLU HB3 H 13.108 -0.578 -5.904 1.00 . A B . 10 GLU HB3 1 1 12 9390 1 1 10 GLU HG2 H 15.162 -1.122 -4.790 1.00 . A B . 10 GLU HG2 1 1 12 9391 1 1 10 GLU HG3 H 14.298 -2.051 -3.567 1.00 . A B . 10 GLU HG3 1 1 12 9392 1 1 10 GLU N N 12.892 -0.283 -2.558 1.00 . A B . 10 GLU N 1 1 12 9393 1 1 10 GLU O O 11.094 1.122 -5.330 1.00 . A B . 10 GLU O 1 1 12 9394 1 1 10 GLU OE1 O 13.901 -4.052 -5.068 1.00 . A B . 10 GLU OE1 1 1 12 9395 1 1 10 GLU OE2 O 15.071 -2.920 -6.532 1.00 . A B . 10 GLU OE2 1 1 12 9396 1 1 11 CYS C C 9.801 3.389 -2.789 1.00 . A B . 11 CYS C 1 1 12 9397 1 1 11 CYS CA C 9.567 1.924 -3.135 1.00 . A B . 11 CYS CA 1 1 12 9398 1 1 11 CYS CB C 8.615 1.256 -2.139 1.00 . A B . 11 CYS CB 1 1 12 9399 1 1 11 CYS H H 11.246 1.038 -2.233 1.00 . A B . 11 CYS H 1 1 12 9400 1 1 11 CYS HA H 9.162 1.849 -4.133 1.00 . A B . 11 CYS HA 1 1 12 9401 1 1 11 CYS HB2 H 8.556 0.209 -2.375 1.00 . A B . 11 CYS HB2 1 1 12 9402 1 1 11 CYS HB3 H 9.030 1.363 -1.147 1.00 . A B . 11 CYS HB3 1 1 12 9403 1 1 11 CYS N N 10.840 1.235 -3.100 1.00 . A B . 11 CYS N 1 1 12 9404 1 1 11 CYS O O 9.933 3.751 -1.618 1.00 . A B . 11 CYS O 1 1 12 9405 1 1 11 CYS SG S 6.920 1.893 -2.093 1.00 . A B . 11 CYS SG 1 1 12 9406 1 1 12 GLU C C 9.307 6.309 -2.681 1.00 . A B . 12 GLU C 1 1 12 9407 1 1 12 GLU CA C 10.203 5.632 -3.700 1.00 . A B . 12 GLU CA 1 1 12 9408 1 1 12 GLU CB C 10.044 6.343 -5.042 1.00 . A B . 12 GLU CB 1 1 12 9409 1 1 12 GLU CD C 10.671 6.491 -7.474 1.00 . A B . 12 GLU CD 1 1 12 9410 1 1 12 GLU CG C 10.868 5.746 -6.171 1.00 . A B . 12 GLU CG 1 1 12 9411 1 1 12 GLU H H 9.714 3.853 -4.728 1.00 . A B . 12 GLU H 1 1 12 9412 1 1 12 GLU HA H 11.226 5.718 -3.376 1.00 . A B . 12 GLU HA 1 1 12 9413 1 1 12 GLU HB2 H 9.005 6.309 -5.329 1.00 . A B . 12 GLU HB2 1 1 12 9414 1 1 12 GLU HB3 H 10.338 7.375 -4.921 1.00 . A B . 12 GLU HB3 1 1 12 9415 1 1 12 GLU HG2 H 11.913 5.789 -5.902 1.00 . A B . 12 GLU HG2 1 1 12 9416 1 1 12 GLU HG3 H 10.572 4.717 -6.312 1.00 . A B . 12 GLU HG3 1 1 12 9417 1 1 12 GLU N N 9.882 4.213 -3.831 1.00 . A B . 12 GLU N 1 1 12 9418 1 1 12 GLU O O 9.772 7.059 -1.826 1.00 . A B . 12 GLU O 1 1 12 9419 1 1 12 GLU OE1 O 11.332 7.530 -7.678 1.00 . A B . 12 GLU OE1 1 1 12 9420 1 1 12 GLU OE2 O 9.837 6.057 -8.291 1.00 . A B . 12 GLU OE2 1 1 12 9421 1 1 13 VAL C C 7.205 6.218 -0.454 1.00 . A B . 13 VAL C 1 1 12 9422 1 1 13 VAL CA C 7.045 6.655 -1.915 1.00 . A B . 13 VAL CA 1 1 12 9423 1 1 13 VAL CB C 5.619 6.378 -2.434 1.00 . A B . 13 VAL CB 1 1 12 9424 1 1 13 VAL CG1 C 5.344 4.890 -2.503 1.00 . A B . 13 VAL CG1 1 1 12 9425 1 1 13 VAL CG2 C 4.581 7.071 -1.574 1.00 . A B . 13 VAL CG2 1 1 12 9426 1 1 13 VAL H H 7.730 5.346 -3.420 1.00 . A B . 13 VAL H 1 1 12 9427 1 1 13 VAL HA H 7.219 7.719 -1.971 1.00 . A B . 13 VAL HA 1 1 12 9428 1 1 13 VAL HB H 5.546 6.773 -3.435 1.00 . A B . 13 VAL HB 1 1 12 9429 1 1 13 VAL HG11 H 4.369 4.728 -2.932 1.00 . A B . 13 VAL HG11 1 1 12 9430 1 1 13 VAL HG12 H 5.373 4.474 -1.507 1.00 . A B . 13 VAL HG12 1 1 12 9431 1 1 13 VAL HG13 H 6.091 4.411 -3.116 1.00 . A B . 13 VAL HG13 1 1 12 9432 1 1 13 VAL HG21 H 3.602 6.920 -2.000 1.00 . A B . 13 VAL HG21 1 1 12 9433 1 1 13 VAL HG22 H 4.800 8.128 -1.527 1.00 . A B . 13 VAL HG22 1 1 12 9434 1 1 13 VAL HG23 H 4.611 6.651 -0.582 1.00 . A B . 13 VAL HG23 1 1 12 9435 1 1 13 VAL N N 8.027 6.015 -2.764 1.00 . A B . 13 VAL N 1 1 12 9436 1 1 13 VAL O O 6.924 6.983 0.465 1.00 . A B . 13 VAL O 1 1 12 9437 1 1 14 CYS C C 9.157 5.284 1.705 1.00 . A B . 14 CYS C 1 1 12 9438 1 1 14 CYS CA C 7.977 4.529 1.114 1.00 . A B . 14 CYS CA 1 1 12 9439 1 1 14 CYS CB C 8.264 3.031 1.137 1.00 . A B . 14 CYS CB 1 1 12 9440 1 1 14 CYS H H 7.885 4.416 -1.005 1.00 . A B . 14 CYS H 1 1 12 9441 1 1 14 CYS HA H 7.105 4.726 1.717 1.00 . A B . 14 CYS HA 1 1 12 9442 1 1 14 CYS HB2 H 8.559 2.717 0.150 1.00 . A B . 14 CYS HB2 1 1 12 9443 1 1 14 CYS HB3 H 9.072 2.840 1.827 1.00 . A B . 14 CYS HB3 1 1 12 9444 1 1 14 CYS N N 7.694 5.000 -0.239 1.00 . A B . 14 CYS N 1 1 12 9445 1 1 14 CYS O O 9.239 5.481 2.917 1.00 . A B . 14 CYS O 1 1 12 9446 1 1 14 CYS SG S 6.855 2.020 1.640 1.00 . A B . 14 CYS SG 1 1 12 9447 1 1 15 ARG C C 10.788 7.841 1.764 1.00 . A B . 15 ARG C 1 1 12 9448 1 1 15 ARG CA C 11.226 6.473 1.265 1.00 . A B . 15 ARG CA 1 1 12 9449 1 1 15 ARG CB C 12.227 6.632 0.122 1.00 . A B . 15 ARG CB 1 1 12 9450 1 1 15 ARG CD C 13.657 5.528 -1.632 1.00 . A B . 15 ARG CD 1 1 12 9451 1 1 15 ARG CG C 12.663 5.315 -0.496 1.00 . A B . 15 ARG CG 1 1 12 9452 1 1 15 ARG CZ C 13.693 6.635 -3.846 1.00 . A B . 15 ARG CZ 1 1 12 9453 1 1 15 ARG H H 9.933 5.509 -0.116 1.00 . A B . 15 ARG H 1 1 12 9454 1 1 15 ARG HA H 11.692 5.939 2.075 1.00 . A B . 15 ARG HA 1 1 12 9455 1 1 15 ARG HB2 H 11.777 7.236 -0.651 1.00 . A B . 15 ARG HB2 1 1 12 9456 1 1 15 ARG HB3 H 13.105 7.137 0.496 1.00 . A B . 15 ARG HB3 1 1 12 9457 1 1 15 ARG HD2 H 14.587 5.885 -1.214 1.00 . A B . 15 ARG HD2 1 1 12 9458 1 1 15 ARG HD3 H 13.826 4.583 -2.126 1.00 . A B . 15 ARG HD3 1 1 12 9459 1 1 15 ARG HE H 12.453 7.105 -2.345 1.00 . A B . 15 ARG HE 1 1 12 9460 1 1 15 ARG HG2 H 13.129 4.709 0.267 1.00 . A B . 15 ARG HG2 1 1 12 9461 1 1 15 ARG HG3 H 11.793 4.804 -0.879 1.00 . A B . 15 ARG HG3 1 1 12 9462 1 1 15 ARG HH11 H 14.987 5.083 -3.669 1.00 . A B . 15 ARG HH11 1 1 12 9463 1 1 15 ARG HH12 H 15.034 5.920 -5.187 1.00 . A B . 15 ARG HH12 1 1 12 9464 1 1 15 ARG HH21 H 12.503 8.196 -4.352 1.00 . A B . 15 ARG HH21 1 1 12 9465 1 1 15 ARG HH22 H 13.620 7.688 -5.577 1.00 . A B . 15 ARG HH22 1 1 12 9466 1 1 15 ARG N N 10.062 5.710 0.838 1.00 . A B . 15 ARG N 1 1 12 9467 1 1 15 ARG NE N 13.181 6.502 -2.620 1.00 . A B . 15 ARG NE 1 1 12 9468 1 1 15 ARG NH1 N 14.647 5.813 -4.267 1.00 . A B . 15 ARG NH1 1 1 12 9469 1 1 15 ARG NH2 N 13.235 7.580 -4.656 1.00 . A B . 15 ARG NH2 1 1 12 9470 1 1 15 ARG O O 11.349 8.382 2.715 1.00 . A B . 15 ARG O 1 1 12 9471 1 1 16 ASP C C 8.246 9.516 2.684 1.00 . A B . 16 ASP C 1 1 12 9472 1 1 16 ASP CA C 9.196 9.667 1.500 1.00 . A B . 16 ASP CA 1 1 12 9473 1 1 16 ASP CB C 8.453 10.303 0.322 1.00 . A B . 16 ASP CB 1 1 12 9474 1 1 16 ASP CG C 9.383 10.788 -0.771 1.00 . A B . 16 ASP CG 1 1 12 9475 1 1 16 ASP H H 9.425 7.927 0.312 1.00 . A B . 16 ASP H 1 1 12 9476 1 1 16 ASP HA H 10.009 10.315 1.790 1.00 . A B . 16 ASP HA 1 1 12 9477 1 1 16 ASP HB2 H 7.784 9.569 -0.105 1.00 . A B . 16 ASP HB2 1 1 12 9478 1 1 16 ASP HB3 H 7.876 11.142 0.681 1.00 . A B . 16 ASP HB3 1 1 12 9479 1 1 16 ASP N N 9.771 8.385 1.109 1.00 . A B . 16 ASP N 1 1 12 9480 1 1 16 ASP O O 7.661 10.494 3.150 1.00 . A B . 16 ASP O 1 1 12 9481 1 1 16 ASP OD1 O 10.151 11.744 -0.528 1.00 . A B . 16 ASP OD1 1 1 12 9482 1 1 16 ASP OD2 O 9.353 10.219 -1.882 1.00 . A B . 16 ASP OD2 1 1 12 9483 1 1 17 GLY C C 5.766 8.015 3.924 1.00 . A B . 17 GLY C 1 1 12 9484 1 1 17 GLY CA C 7.233 8.039 4.305 1.00 . A B . 17 GLY CA 1 1 12 9485 1 1 17 GLY H H 8.577 7.547 2.746 1.00 . A B . 17 GLY H 1 1 12 9486 1 1 17 GLY HA2 H 7.498 7.086 4.744 1.00 . A B . 17 GLY HA2 1 1 12 9487 1 1 17 GLY HA3 H 7.389 8.818 5.039 1.00 . A B . 17 GLY HA3 1 1 12 9488 1 1 17 GLY N N 8.096 8.290 3.167 1.00 . A B . 17 GLY N 1 1 12 9489 1 1 17 GLY O O 4.906 8.424 4.706 1.00 . A B . 17 GLY O 1 1 12 9490 1 1 18 GLY C C 3.268 6.515 3.085 1.00 . A B . 18 GLY C 1 1 12 9491 1 1 18 GLY CA C 4.114 7.448 2.244 1.00 . A B . 18 GLY CA 1 1 12 9492 1 1 18 GLY H H 6.221 7.301 2.112 1.00 . A B . 18 GLY H 1 1 12 9493 1 1 18 GLY HA2 H 3.665 8.427 2.257 1.00 . A B . 18 GLY HA2 1 1 12 9494 1 1 18 GLY HA3 H 4.122 7.083 1.230 1.00 . A B . 18 GLY HA3 1 1 12 9495 1 1 18 GLY N N 5.484 7.553 2.712 1.00 . A B . 18 GLY N 1 1 12 9496 1 1 18 GLY O O 3.787 5.724 3.878 1.00 . A B . 18 GLY O 1 1 12 9497 1 1 19 GLU C C 0.437 4.683 2.848 1.00 . A B . 19 GLU C 1 1 12 9498 1 1 19 GLU CA C 1.029 5.805 3.685 1.00 . A B . 19 GLU CA 1 1 12 9499 1 1 19 GLU CB C -0.093 6.683 4.240 1.00 . A B . 19 GLU CB 1 1 12 9500 1 1 19 GLU CD C -0.731 8.381 5.992 1.00 . A B . 19 GLU CD 1 1 12 9501 1 1 19 GLU CG C 0.392 7.773 5.182 1.00 . A B . 19 GLU CG 1 1 12 9502 1 1 19 GLU H H 1.613 7.202 2.211 1.00 . A B . 19 GLU H 1 1 12 9503 1 1 19 GLU HA H 1.575 5.371 4.507 1.00 . A B . 19 GLU HA 1 1 12 9504 1 1 19 GLU HB2 H -0.599 7.156 3.411 1.00 . A B . 19 GLU HB2 1 1 12 9505 1 1 19 GLU HB3 H -0.800 6.058 4.771 1.00 . A B . 19 GLU HB3 1 1 12 9506 1 1 19 GLU HG2 H 1.118 7.354 5.862 1.00 . A B . 19 GLU HG2 1 1 12 9507 1 1 19 GLU HG3 H 0.856 8.555 4.600 1.00 . A B . 19 GLU HG3 1 1 12 9508 1 1 19 GLU N N 1.961 6.600 2.904 1.00 . A B . 19 GLU N 1 1 12 9509 1 1 19 GLU O O 0.132 4.861 1.669 1.00 . A B . 19 GLU O 1 1 12 9510 1 1 19 GLU OE1 O -1.425 9.281 5.481 1.00 . A B . 19 GLU OE1 1 1 12 9511 1 1 19 GLU OE2 O -0.916 7.962 7.156 1.00 . A B . 19 GLU OE2 1 1 12 9512 1 1 20 LEU C C -1.823 2.391 2.990 1.00 . A B . 20 LEU C 1 1 12 9513 1 1 20 LEU CA C -0.312 2.371 2.820 1.00 . A B . 20 LEU CA 1 1 12 9514 1 1 20 LEU CB C 0.263 1.085 3.414 1.00 . A B . 20 LEU CB 1 1 12 9515 1 1 20 LEU CD1 C 2.282 -0.332 3.837 1.00 . A B . 20 LEU CD1 1 1 12 9516 1 1 20 LEU CD2 C 1.583 0.156 1.498 1.00 . A B . 20 LEU CD2 1 1 12 9517 1 1 20 LEU CG C 1.657 0.702 2.917 1.00 . A B . 20 LEU CG 1 1 12 9518 1 1 20 LEU H H 0.581 3.448 4.400 1.00 . A B . 20 LEU H 1 1 12 9519 1 1 20 LEU HA H -0.072 2.415 1.769 1.00 . A B . 20 LEU HA 1 1 12 9520 1 1 20 LEU HB2 H 0.307 1.201 4.488 1.00 . A B . 20 LEU HB2 1 1 12 9521 1 1 20 LEU HB3 H -0.414 0.278 3.184 1.00 . A B . 20 LEU HB3 1 1 12 9522 1 1 20 LEU HD11 H 3.260 -0.600 3.464 1.00 . A B . 20 LEU HD11 1 1 12 9523 1 1 20 LEU HD12 H 1.654 -1.210 3.866 1.00 . A B . 20 LEU HD12 1 1 12 9524 1 1 20 LEU HD13 H 2.375 0.079 4.830 1.00 . A B . 20 LEU HD13 1 1 12 9525 1 1 20 LEU HD21 H 1.203 0.917 0.834 1.00 . A B . 20 LEU HD21 1 1 12 9526 1 1 20 LEU HD22 H 0.928 -0.701 1.475 1.00 . A B . 20 LEU HD22 1 1 12 9527 1 1 20 LEU HD23 H 2.571 -0.140 1.176 1.00 . A B . 20 LEU HD23 1 1 12 9528 1 1 20 LEU HG H 2.291 1.579 2.912 1.00 . A B . 20 LEU HG 1 1 12 9529 1 1 20 LEU N N 0.286 3.527 3.469 1.00 . A B . 20 LEU N 1 1 12 9530 1 1 20 LEU O O -2.328 2.776 4.046 1.00 . A B . 20 LEU O 1 1 12 9531 1 1 21 PHE C C -4.456 0.486 1.903 1.00 . A B . 21 PHE C 1 1 12 9532 1 1 21 PHE CA C -3.997 1.935 2.004 1.00 . A B . 21 PHE CA 1 1 12 9533 1 1 21 PHE CB C -4.590 2.770 0.861 1.00 . A B . 21 PHE CB 1 1 12 9534 1 1 21 PHE CD1 C -4.276 5.125 1.660 1.00 . A B . 21 PHE CD1 1 1 12 9535 1 1 21 PHE CD2 C -3.077 4.429 -0.282 1.00 . A B . 21 PHE CD2 1 1 12 9536 1 1 21 PHE CE1 C -3.728 6.386 1.550 1.00 . A B . 21 PHE CE1 1 1 12 9537 1 1 21 PHE CE2 C -2.524 5.688 -0.392 1.00 . A B . 21 PHE CE2 1 1 12 9538 1 1 21 PHE CG C -3.959 4.132 0.748 1.00 . A B . 21 PHE CG 1 1 12 9539 1 1 21 PHE CZ C -2.741 6.620 0.554 1.00 . A B . 21 PHE CZ 1 1 12 9540 1 1 21 PHE H H -2.084 1.735 1.118 1.00 . A B . 21 PHE H 1 1 12 9541 1 1 21 PHE HA H -4.314 2.343 2.955 1.00 . A B . 21 PHE HA 1 1 12 9542 1 1 21 PHE HB2 H -4.431 2.252 -0.075 1.00 . A B . 21 PHE HB2 1 1 12 9543 1 1 21 PHE HB3 H -5.653 2.901 1.020 1.00 . A B . 21 PHE HB3 1 1 12 9544 1 1 21 PHE HD1 H -4.958 4.906 2.468 1.00 . A B . 21 PHE HD1 1 1 12 9545 1 1 21 PHE HD2 H -2.819 3.665 -1.000 1.00 . A B . 21 PHE HD2 1 1 12 9546 1 1 21 PHE HE1 H -3.984 7.151 2.268 1.00 . A B . 21 PHE HE1 1 1 12 9547 1 1 21 PHE HE2 H -1.838 5.908 -1.196 1.00 . A B . 21 PHE HE2 1 1 12 9548 1 1 21 PHE HZ H -2.264 7.584 0.479 1.00 . A B . 21 PHE HZ 1 1 12 9549 1 1 21 PHE N N -2.540 1.990 1.953 1.00 . A B . 21 PHE N 1 1 12 9550 1 1 21 PHE O O -5.464 0.172 1.264 1.00 . A B . 21 PHE O 1 1 12 9551 1 1 22 CYS C C -3.651 -2.530 3.763 1.00 . A B . 22 CYS C 1 1 12 9552 1 1 22 CYS CA C -3.941 -1.827 2.438 1.00 . A B . 22 CYS CA 1 1 12 9553 1 1 22 CYS CB C -3.075 -2.438 1.335 1.00 . A B . 22 CYS CB 1 1 12 9554 1 1 22 CYS H H -2.889 -0.085 2.994 1.00 . A B . 22 CYS H 1 1 12 9555 1 1 22 CYS HA H -4.981 -1.962 2.183 1.00 . A B . 22 CYS HA 1 1 12 9556 1 1 22 CYS HB2 H -2.088 -1.998 1.384 1.00 . A B . 22 CYS HB2 1 1 12 9557 1 1 22 CYS HB3 H -2.996 -3.504 1.491 1.00 . A B . 22 CYS HB3 1 1 12 9558 1 1 22 CYS N N -3.680 -0.400 2.512 1.00 . A B . 22 CYS N 1 1 12 9559 1 1 22 CYS O O -2.912 -2.015 4.603 1.00 . A B . 22 CYS O 1 1 12 9560 1 1 22 CYS SG S -3.702 -2.165 -0.348 1.00 . A B . 22 CYS SG 1 1 12 9561 1 1 23 CYS C C -2.535 -5.124 4.959 1.00 . A B . 23 CYS C 1 1 12 9562 1 1 23 CYS CA C -3.955 -4.578 5.074 1.00 . A B . 23 CYS CA 1 1 12 9563 1 1 23 CYS CB C -4.939 -5.753 5.114 1.00 . A B . 23 CYS CB 1 1 12 9564 1 1 23 CYS H H -4.861 -4.027 3.244 1.00 . A B . 23 CYS H 1 1 12 9565 1 1 23 CYS HA H -4.047 -3.989 5.975 1.00 . A B . 23 CYS HA 1 1 12 9566 1 1 23 CYS HB2 H -4.657 -6.472 4.356 1.00 . A B . 23 CYS HB2 1 1 12 9567 1 1 23 CYS HB3 H -4.887 -6.224 6.086 1.00 . A B . 23 CYS HB3 1 1 12 9568 1 1 23 CYS N N -4.236 -3.719 3.924 1.00 . A B . 23 CYS N 1 1 12 9569 1 1 23 CYS O O -1.950 -5.054 3.881 1.00 . A B . 23 CYS O 1 1 12 9570 1 1 23 CYS SG S -6.657 -5.299 4.817 1.00 . A B . 23 CYS SG 1 1 12 9571 1 1 24 ASP C C -0.491 -7.244 4.852 1.00 . A B . 24 ASP C 1 1 12 9572 1 1 24 ASP CA C -0.631 -6.246 6.000 1.00 . A B . 24 ASP CA 1 1 12 9573 1 1 24 ASP CB C -0.282 -6.935 7.326 1.00 . A B . 24 ASP CB 1 1 12 9574 1 1 24 ASP CG C -0.186 -5.964 8.485 1.00 . A B . 24 ASP CG 1 1 12 9575 1 1 24 ASP H H -2.484 -5.683 6.888 1.00 . A B . 24 ASP H 1 1 12 9576 1 1 24 ASP HA H 0.063 -5.436 5.836 1.00 . A B . 24 ASP HA 1 1 12 9577 1 1 24 ASP HB2 H -1.042 -7.664 7.557 1.00 . A B . 24 ASP HB2 1 1 12 9578 1 1 24 ASP HB3 H 0.669 -7.436 7.222 1.00 . A B . 24 ASP HB3 1 1 12 9579 1 1 24 ASP N N -1.984 -5.674 6.039 1.00 . A B . 24 ASP N 1 1 12 9580 1 1 24 ASP O O 0.462 -7.179 4.073 1.00 . A B . 24 ASP O 1 1 12 9581 1 1 24 ASP OD1 O 0.905 -5.396 8.707 1.00 . A B . 24 ASP OD1 1 1 12 9582 1 1 24 ASP OD2 O -1.199 -5.764 9.183 1.00 . A B . 24 ASP OD2 1 1 12 9583 1 1 25 THR C C -1.640 -8.529 2.316 1.00 . A B . 25 THR C 1 1 12 9584 1 1 25 THR CA C -1.451 -9.158 3.698 1.00 . A B . 25 THR CA 1 1 12 9585 1 1 25 THR CB C -2.552 -10.202 3.949 1.00 . A B . 25 THR CB 1 1 12 9586 1 1 25 THR CG2 C -2.468 -11.339 2.942 1.00 . A B . 25 THR CG2 1 1 12 9587 1 1 25 THR H H -2.177 -8.152 5.412 1.00 . A B . 25 THR H 1 1 12 9588 1 1 25 THR HA H -0.497 -9.663 3.726 1.00 . A B . 25 THR HA 1 1 12 9589 1 1 25 THR HB H -3.513 -9.722 3.855 1.00 . A B . 25 THR HB 1 1 12 9590 1 1 25 THR HG1 H -1.521 -11.073 5.388 1.00 . A B . 25 THR HG1 1 1 12 9591 1 1 25 THR HG21 H -3.266 -12.043 3.126 1.00 . A B . 25 THR HG21 1 1 12 9592 1 1 25 THR HG22 H -1.517 -11.839 3.042 1.00 . A B . 25 THR HG22 1 1 12 9593 1 1 25 THR HG23 H -2.562 -10.942 1.942 1.00 . A B . 25 THR HG23 1 1 12 9594 1 1 25 THR N N -1.454 -8.150 4.746 1.00 . A B . 25 THR N 1 1 12 9595 1 1 25 THR O O -0.897 -8.831 1.384 1.00 . A B . 25 THR O 1 1 12 9596 1 1 25 THR OG1 O -2.417 -10.728 5.274 1.00 . A B . 25 THR OG1 1 1 12 9597 1 1 26 CYS C C -1.732 -6.148 0.448 1.00 . A B . 26 CYS C 1 1 12 9598 1 1 26 CYS CA C -2.916 -6.997 0.915 1.00 . A B . 26 CYS CA 1 1 12 9599 1 1 26 CYS CB C -4.186 -6.141 1.032 1.00 . A B . 26 CYS CB 1 1 12 9600 1 1 26 CYS H H -3.158 -7.410 2.981 1.00 . A B . 26 CYS H 1 1 12 9601 1 1 26 CYS HA H -3.086 -7.780 0.189 1.00 . A B . 26 CYS HA 1 1 12 9602 1 1 26 CYS HB2 H -4.009 -5.343 1.733 1.00 . A B . 26 CYS HB2 1 1 12 9603 1 1 26 CYS HB3 H -4.423 -5.724 0.063 1.00 . A B . 26 CYS HB3 1 1 12 9604 1 1 26 CYS N N -2.620 -7.637 2.194 1.00 . A B . 26 CYS N 1 1 12 9605 1 1 26 CYS O O -1.390 -6.134 -0.733 1.00 . A B . 26 CYS O 1 1 12 9606 1 1 26 CYS SG S -5.633 -7.061 1.606 1.00 . A B . 26 CYS SG 1 1 12 9607 1 1 27 SER C C 1.259 -5.524 0.714 1.00 . A B . 27 SER C 1 1 12 9608 1 1 27 SER CA C 0.073 -4.648 1.107 1.00 . A B . 27 SER CA 1 1 12 9609 1 1 27 SER CB C 0.426 -3.801 2.331 1.00 . A B . 27 SER CB 1 1 12 9610 1 1 27 SER H H -1.445 -5.502 2.311 1.00 . A B . 27 SER H 1 1 12 9611 1 1 27 SER HA H -0.168 -3.993 0.283 1.00 . A B . 27 SER HA 1 1 12 9612 1 1 27 SER HB2 H -0.408 -3.163 2.575 1.00 . A B . 27 SER HB2 1 1 12 9613 1 1 27 SER HB3 H 0.633 -4.454 3.166 1.00 . A B . 27 SER HB3 1 1 12 9614 1 1 27 SER HG H 2.176 -3.083 2.834 1.00 . A B . 27 SER HG 1 1 12 9615 1 1 27 SER N N -1.099 -5.464 1.391 1.00 . A B . 27 SER N 1 1 12 9616 1 1 27 SER O O 2.126 -5.112 -0.045 1.00 . A B . 27 SER O 1 1 12 9617 1 1 27 SER OG O 1.562 -2.991 2.095 1.00 . A B . 27 SER OG 1 1 12 9618 1 1 28 ARG C C 2.244 -8.217 -0.481 1.00 . A B . 28 ARG C 1 1 12 9619 1 1 28 ARG CA C 2.374 -7.663 0.936 1.00 . A B . 28 ARG CA 1 1 12 9620 1 1 28 ARG CB C 2.378 -8.798 1.960 1.00 . A B . 28 ARG CB 1 1 12 9621 1 1 28 ARG CD C 3.498 -10.833 2.895 1.00 . A B . 28 ARG CD 1 1 12 9622 1 1 28 ARG CG C 3.542 -9.762 1.819 1.00 . A B . 28 ARG CG 1 1 12 9623 1 1 28 ARG CZ C 3.418 -10.959 5.356 1.00 . A B . 28 ARG CZ 1 1 12 9624 1 1 28 ARG H H 0.565 -7.032 1.822 1.00 . A B . 28 ARG H 1 1 12 9625 1 1 28 ARG HA H 3.301 -7.115 1.012 1.00 . A B . 28 ARG HA 1 1 12 9626 1 1 28 ARG HB2 H 2.415 -8.371 2.950 1.00 . A B . 28 ARG HB2 1 1 12 9627 1 1 28 ARG HB3 H 1.462 -9.360 1.856 1.00 . A B . 28 ARG HB3 1 1 12 9628 1 1 28 ARG HD2 H 2.571 -11.377 2.804 1.00 . A B . 28 ARG HD2 1 1 12 9629 1 1 28 ARG HD3 H 4.328 -11.507 2.750 1.00 . A B . 28 ARG HD3 1 1 12 9630 1 1 28 ARG HE H 3.772 -9.296 4.305 1.00 . A B . 28 ARG HE 1 1 12 9631 1 1 28 ARG HG2 H 3.491 -10.236 0.850 1.00 . A B . 28 ARG HG2 1 1 12 9632 1 1 28 ARG HG3 H 4.468 -9.212 1.907 1.00 . A B . 28 ARG HG3 1 1 12 9633 1 1 28 ARG HH11 H 3.014 -12.706 4.412 1.00 . A B . 28 ARG HH11 1 1 12 9634 1 1 28 ARG HH12 H 3.000 -12.776 6.144 1.00 . A B . 28 ARG HH12 1 1 12 9635 1 1 28 ARG HH21 H 3.756 -9.380 6.577 1.00 . A B . 28 ARG HH21 1 1 12 9636 1 1 28 ARG HH22 H 3.430 -10.884 7.379 1.00 . A B . 28 ARG HH22 1 1 12 9637 1 1 28 ARG N N 1.289 -6.743 1.228 1.00 . A B . 28 ARG N 1 1 12 9638 1 1 28 ARG NE N 3.579 -10.259 4.237 1.00 . A B . 28 ARG NE 1 1 12 9639 1 1 28 ARG NH1 N 3.122 -12.250 5.300 1.00 . A B . 28 ARG NH1 1 1 12 9640 1 1 28 ARG NH2 N 3.543 -10.361 6.531 1.00 . A B . 28 ARG NH2 1 1 12 9641 1 1 28 ARG O O 3.215 -8.702 -1.065 1.00 . A B . 28 ARG O 1 1 12 9642 1 1 29 VAL C C 0.847 -7.467 -3.391 1.00 . A B . 29 VAL C 1 1 12 9643 1 1 29 VAL CA C 0.797 -8.618 -2.384 1.00 . A B . 29 VAL CA 1 1 12 9644 1 1 29 VAL CB C -0.562 -9.345 -2.496 1.00 . A B . 29 VAL CB 1 1 12 9645 1 1 29 VAL CG1 C -0.781 -9.876 -3.905 1.00 . A B . 29 VAL CG1 1 1 12 9646 1 1 29 VAL CG2 C -0.651 -10.482 -1.489 1.00 . A B . 29 VAL CG2 1 1 12 9647 1 1 29 VAL H H 0.296 -7.777 -0.510 1.00 . A B . 29 VAL H 1 1 12 9648 1 1 29 VAL HA H 1.575 -9.322 -2.628 1.00 . A B . 29 VAL HA 1 1 12 9649 1 1 29 VAL HB H -1.346 -8.637 -2.272 1.00 . A B . 29 VAL HB 1 1 12 9650 1 1 29 VAL HG11 H -0.749 -9.058 -4.608 1.00 . A B . 29 VAL HG11 1 1 12 9651 1 1 29 VAL HG12 H -1.744 -10.361 -3.962 1.00 . A B . 29 VAL HG12 1 1 12 9652 1 1 29 VAL HG13 H -0.006 -10.587 -4.146 1.00 . A B . 29 VAL HG13 1 1 12 9653 1 1 29 VAL HG21 H 0.161 -11.173 -1.657 1.00 . A B . 29 VAL HG21 1 1 12 9654 1 1 29 VAL HG22 H -1.593 -10.997 -1.610 1.00 . A B . 29 VAL HG22 1 1 12 9655 1 1 29 VAL HG23 H -0.585 -10.083 -0.488 1.00 . A B . 29 VAL HG23 1 1 12 9656 1 1 29 VAL N N 1.040 -8.144 -1.032 1.00 . A B . 29 VAL N 1 1 12 9657 1 1 29 VAL O O 1.474 -7.582 -4.446 1.00 . A B . 29 VAL O 1 1 12 9658 1 1 30 PHE C C 0.774 -3.984 -3.428 1.00 . A B . 30 PHE C 1 1 12 9659 1 1 30 PHE CA C 0.108 -5.231 -3.993 1.00 . A B . 30 PHE CA 1 1 12 9660 1 1 30 PHE CB C -1.362 -4.899 -4.295 1.00 . A B . 30 PHE CB 1 1 12 9661 1 1 30 PHE CD1 C -2.101 -6.592 -6.008 1.00 . A B . 30 PHE CD1 1 1 12 9662 1 1 30 PHE CD2 C -3.113 -6.637 -3.847 1.00 . A B . 30 PHE CD2 1 1 12 9663 1 1 30 PHE CE1 C -2.888 -7.656 -6.399 1.00 . A B . 30 PHE CE1 1 1 12 9664 1 1 30 PHE CE2 C -3.900 -7.702 -4.233 1.00 . A B . 30 PHE CE2 1 1 12 9665 1 1 30 PHE CG C -2.203 -6.070 -4.727 1.00 . A B . 30 PHE CG 1 1 12 9666 1 1 30 PHE CZ C -3.788 -8.214 -5.510 1.00 . A B . 30 PHE CZ 1 1 12 9667 1 1 30 PHE H H -0.187 -6.265 -2.161 1.00 . A B . 30 PHE H 1 1 12 9668 1 1 30 PHE HA H 0.604 -5.512 -4.908 1.00 . A B . 30 PHE HA 1 1 12 9669 1 1 30 PHE HB2 H -1.814 -4.483 -3.405 1.00 . A B . 30 PHE HB2 1 1 12 9670 1 1 30 PHE HB3 H -1.394 -4.159 -5.082 1.00 . A B . 30 PHE HB3 1 1 12 9671 1 1 30 PHE HD1 H -1.398 -6.161 -6.705 1.00 . A B . 30 PHE HD1 1 1 12 9672 1 1 30 PHE HD2 H -3.205 -6.236 -2.848 1.00 . A B . 30 PHE HD2 1 1 12 9673 1 1 30 PHE HE1 H -2.802 -8.052 -7.401 1.00 . A B . 30 PHE HE1 1 1 12 9674 1 1 30 PHE HE2 H -4.604 -8.136 -3.537 1.00 . A B . 30 PHE HE2 1 1 12 9675 1 1 30 PHE HZ H -4.405 -9.047 -5.815 1.00 . A B . 30 PHE HZ 1 1 12 9676 1 1 30 PHE N N 0.211 -6.349 -3.059 1.00 . A B . 30 PHE N 1 1 12 9677 1 1 30 PHE O O 0.235 -2.890 -3.562 1.00 . A B . 30 PHE O 1 1 12 9678 1 1 31 HIS C C 2.693 -1.794 -2.999 1.00 . A B . 31 HIS C 1 1 12 9679 1 1 31 HIS CA C 2.625 -3.043 -2.130 1.00 . A B . 31 HIS CA 1 1 12 9680 1 1 31 HIS CB C 4.039 -3.471 -1.717 1.00 . A B . 31 HIS CB 1 1 12 9681 1 1 31 HIS CD2 C 5.902 -1.725 -1.225 1.00 . A B . 31 HIS CD2 1 1 12 9682 1 1 31 HIS CE1 C 5.371 -1.199 0.805 1.00 . A B . 31 HIS CE1 1 1 12 9683 1 1 31 HIS CG C 4.794 -2.448 -0.910 1.00 . A B . 31 HIS CG 1 1 12 9684 1 1 31 HIS H H 2.366 -5.031 -2.822 1.00 . A B . 31 HIS H 1 1 12 9685 1 1 31 HIS HA H 2.058 -2.813 -1.241 1.00 . A B . 31 HIS HA 1 1 12 9686 1 1 31 HIS HB2 H 3.969 -4.371 -1.122 1.00 . A B . 31 HIS HB2 1 1 12 9687 1 1 31 HIS HB3 H 4.612 -3.682 -2.609 1.00 . A B . 31 HIS HB3 1 1 12 9688 1 1 31 HIS HD1 H 3.712 -2.451 0.901 1.00 . A B . 31 HIS HD1 1 1 12 9689 1 1 31 HIS HD2 H 6.420 -1.742 -2.171 1.00 . A B . 31 HIS HD2 1 1 12 9690 1 1 31 HIS HE1 H 5.363 -0.745 1.785 1.00 . A B . 31 HIS HE1 1 1 12 9691 1 1 31 HIS N N 1.945 -4.146 -2.818 1.00 . A B . 31 HIS N 1 1 12 9692 1 1 31 HIS ND1 N 4.471 -2.102 0.382 1.00 . A B . 31 HIS ND1 1 1 12 9693 1 1 31 HIS NE2 N 6.266 -0.935 -0.133 1.00 . A B . 31 HIS NE2 1 1 12 9694 1 1 31 HIS O O 2.282 -0.722 -2.576 1.00 . A B . 31 HIS O 1 1 12 9695 1 1 32 GLU C C 2.077 -0.081 -5.402 1.00 . A B . 32 GLU C 1 1 12 9696 1 1 32 GLU CA C 3.376 -0.832 -5.123 1.00 . A B . 32 GLU CA 1 1 12 9697 1 1 32 GLU CB C 3.986 -1.311 -6.444 1.00 . A B . 32 GLU CB 1 1 12 9698 1 1 32 GLU CD C 4.852 -3.687 -6.237 1.00 . A B . 32 GLU CD 1 1 12 9699 1 1 32 GLU CG C 5.207 -2.210 -6.281 1.00 . A B . 32 GLU CG 1 1 12 9700 1 1 32 GLU H H 3.327 -2.872 -4.553 1.00 . A B . 32 GLU H 1 1 12 9701 1 1 32 GLU HA H 4.066 -0.157 -4.636 1.00 . A B . 32 GLU HA 1 1 12 9702 1 1 32 GLU HB2 H 3.235 -1.864 -6.987 1.00 . A B . 32 GLU HB2 1 1 12 9703 1 1 32 GLU HB3 H 4.275 -0.448 -7.026 1.00 . A B . 32 GLU HB3 1 1 12 9704 1 1 32 GLU HG2 H 5.875 -2.043 -7.113 1.00 . A B . 32 GLU HG2 1 1 12 9705 1 1 32 GLU HG3 H 5.708 -1.949 -5.364 1.00 . A B . 32 GLU HG3 1 1 12 9706 1 1 32 GLU N N 3.148 -1.958 -4.229 1.00 . A B . 32 GLU N 1 1 12 9707 1 1 32 GLU O O 2.043 1.148 -5.385 1.00 . A B . 32 GLU O 1 1 12 9708 1 1 32 GLU OE1 O 4.182 -4.107 -5.272 1.00 . A B . 32 GLU OE1 1 1 12 9709 1 1 32 GLU OE2 O 5.248 -4.439 -7.152 1.00 . A B . 32 GLU OE2 1 1 12 9710 1 1 33 ASP C C -0.991 0.255 -4.726 1.00 . A B . 33 ASP C 1 1 12 9711 1 1 33 ASP CA C -0.282 -0.248 -5.977 1.00 . A B . 33 ASP CA 1 1 12 9712 1 1 33 ASP CB C -1.171 -1.258 -6.708 1.00 . A B . 33 ASP CB 1 1 12 9713 1 1 33 ASP CG C -0.670 -1.585 -8.098 1.00 . A B . 33 ASP CG 1 1 12 9714 1 1 33 ASP H H 1.101 -1.807 -5.592 1.00 . A B . 33 ASP H 1 1 12 9715 1 1 33 ASP HA H -0.102 0.592 -6.632 1.00 . A B . 33 ASP HA 1 1 12 9716 1 1 33 ASP HB2 H -1.211 -2.173 -6.135 1.00 . A B . 33 ASP HB2 1 1 12 9717 1 1 33 ASP HB3 H -2.167 -0.850 -6.793 1.00 . A B . 33 ASP HB3 1 1 12 9718 1 1 33 ASP N N 1.012 -0.833 -5.646 1.00 . A B . 33 ASP N 1 1 12 9719 1 1 33 ASP O O -1.816 1.164 -4.793 1.00 . A B . 33 ASP O 1 1 12 9720 1 1 33 ASP OD1 O -0.893 -0.777 -9.026 1.00 . A B . 33 ASP OD1 1 1 12 9721 1 1 33 ASP OD2 O -0.044 -2.656 -8.271 1.00 . A B . 33 ASP OD2 1 1 12 9722 1 1 34 CYS C C -0.755 1.374 -1.790 1.00 . A B . 34 CYS C 1 1 12 9723 1 1 34 CYS CA C -1.272 0.033 -2.311 1.00 . A B . 34 CYS CA 1 1 12 9724 1 1 34 CYS CB C -1.033 -1.070 -1.275 1.00 . A B . 34 CYS CB 1 1 12 9725 1 1 34 CYS H H 0.038 -1.029 -3.592 1.00 . A B . 34 CYS H 1 1 12 9726 1 1 34 CYS HA H -2.336 0.123 -2.484 1.00 . A B . 34 CYS HA 1 1 12 9727 1 1 34 CYS HB2 H -0.002 -1.395 -1.336 1.00 . A B . 34 CYS HB2 1 1 12 9728 1 1 34 CYS HB3 H -1.224 -0.677 -0.288 1.00 . A B . 34 CYS HB3 1 1 12 9729 1 1 34 CYS N N -0.651 -0.327 -3.583 1.00 . A B . 34 CYS N 1 1 12 9730 1 1 34 CYS O O -1.094 1.795 -0.681 1.00 . A B . 34 CYS O 1 1 12 9731 1 1 34 CYS SG S -2.083 -2.543 -1.509 1.00 . A B . 34 CYS SG 1 1 12 9732 1 1 35 HIS C C -0.214 4.399 -3.133 1.00 . A B . 35 HIS C 1 1 12 9733 1 1 35 HIS CA C 0.535 3.378 -2.285 1.00 . A B . 35 HIS CA 1 1 12 9734 1 1 35 HIS CB C 2.039 3.503 -2.524 1.00 . A B . 35 HIS CB 1 1 12 9735 1 1 35 HIS CD2 C 3.319 1.569 -1.401 1.00 . A B . 35 HIS CD2 1 1 12 9736 1 1 35 HIS CE1 C 3.850 2.516 0.466 1.00 . A B . 35 HIS CE1 1 1 12 9737 1 1 35 HIS CG C 2.851 2.834 -1.461 1.00 . A B . 35 HIS CG 1 1 12 9738 1 1 35 HIS H H 0.410 1.583 -3.396 1.00 . A B . 35 HIS H 1 1 12 9739 1 1 35 HIS HA H 0.331 3.569 -1.241 1.00 . A B . 35 HIS HA 1 1 12 9740 1 1 35 HIS HB2 H 2.283 3.041 -3.472 1.00 . A B . 35 HIS HB2 1 1 12 9741 1 1 35 HIS HB3 H 2.309 4.548 -2.551 1.00 . A B . 35 HIS HB3 1 1 12 9742 1 1 35 HIS HD1 H 2.967 4.343 0.014 1.00 . A B . 35 HIS HD1 1 1 12 9743 1 1 35 HIS HD2 H 3.232 0.826 -2.181 1.00 . A B . 35 HIS HD2 1 1 12 9744 1 1 35 HIS HE1 H 4.245 2.700 1.455 1.00 . A B . 35 HIS HE1 1 1 12 9745 1 1 35 HIS N N 0.079 2.028 -2.587 1.00 . A B . 35 HIS N 1 1 12 9746 1 1 35 HIS ND1 N 3.195 3.426 -0.267 1.00 . A B . 35 HIS ND1 1 1 12 9747 1 1 35 HIS NE2 N 3.950 1.363 -0.180 1.00 . A B . 35 HIS NE2 1 1 12 9748 1 1 35 HIS O O -0.043 5.607 -2.963 1.00 . A B . 35 HIS O 1 1 12 9749 1 1 36 ILE C C -3.306 4.565 -4.647 1.00 . A B . 36 ILE C 1 1 12 9750 1 1 36 ILE CA C -1.817 4.741 -4.944 1.00 . A B . 36 ILE CA 1 1 12 9751 1 1 36 ILE CB C -1.533 4.394 -6.439 1.00 . A B . 36 ILE CB 1 1 12 9752 1 1 36 ILE CD1 C 1.009 4.004 -6.362 1.00 . A B . 36 ILE CD1 1 1 12 9753 1 1 36 ILE CG1 C -0.130 4.865 -6.868 1.00 . A B . 36 ILE CG1 1 1 12 9754 1 1 36 ILE CG2 C -2.592 4.995 -7.357 1.00 . A B . 36 ILE CG2 1 1 12 9755 1 1 36 ILE H H -1.141 2.927 -4.108 1.00 . A B . 36 ILE H 1 1 12 9756 1 1 36 ILE HA H -1.542 5.769 -4.767 1.00 . A B . 36 ILE HA 1 1 12 9757 1 1 36 ILE HB H -1.585 3.322 -6.541 1.00 . A B . 36 ILE HB 1 1 12 9758 1 1 36 ILE HD11 H 0.968 3.950 -5.284 1.00 . A B . 36 ILE HD11 1 1 12 9759 1 1 36 ILE HD12 H 1.950 4.438 -6.664 1.00 . A B . 36 ILE HD12 1 1 12 9760 1 1 36 ILE HD13 H 0.923 3.010 -6.775 1.00 . A B . 36 ILE HD13 1 1 12 9761 1 1 36 ILE HG12 H -0.078 4.873 -7.945 1.00 . A B . 36 ILE HG12 1 1 12 9762 1 1 36 ILE HG13 H 0.030 5.869 -6.503 1.00 . A B . 36 ILE HG13 1 1 12 9763 1 1 36 ILE HG21 H -2.453 4.623 -8.361 1.00 . A B . 36 ILE HG21 1 1 12 9764 1 1 36 ILE HG22 H -2.502 6.069 -7.357 1.00 . A B . 36 ILE HG22 1 1 12 9765 1 1 36 ILE HG23 H -3.574 4.717 -7.002 1.00 . A B . 36 ILE HG23 1 1 12 9766 1 1 36 ILE N N -1.038 3.900 -4.045 1.00 . A B . 36 ILE N 1 1 12 9767 1 1 36 ILE O O -3.763 3.444 -4.432 1.00 . A B . 36 ILE O 1 1 12 9768 1 1 37 PRO C C -2.847 7.592 -3.670 1.00 . A B . 37 PRO C 1 1 12 9769 1 1 37 PRO CA C -3.606 7.023 -4.864 1.00 . A B . 37 PRO CA 1 1 12 9770 1 1 37 PRO CB C -4.889 7.835 -5.106 1.00 . A B . 37 PRO CB 1 1 12 9771 1 1 37 PRO CD C -5.528 5.651 -4.350 1.00 . A B . 37 PRO CD 1 1 12 9772 1 1 37 PRO CG C -6.007 6.841 -5.123 1.00 . A B . 37 PRO CG 1 1 12 9773 1 1 37 PRO HA H -2.980 7.067 -5.741 1.00 . A B . 37 PRO HA 1 1 12 9774 1 1 37 PRO HB2 H -5.016 8.552 -4.305 1.00 . A B . 37 PRO HB2 1 1 12 9775 1 1 37 PRO HB3 H -4.812 8.356 -6.053 1.00 . A B . 37 PRO HB3 1 1 12 9776 1 1 37 PRO HD2 H -5.728 5.775 -3.295 1.00 . A B . 37 PRO HD2 1 1 12 9777 1 1 37 PRO HD3 H -5.984 4.745 -4.721 1.00 . A B . 37 PRO HD3 1 1 12 9778 1 1 37 PRO HG2 H -6.881 7.267 -4.652 1.00 . A B . 37 PRO HG2 1 1 12 9779 1 1 37 PRO HG3 H -6.231 6.562 -6.141 1.00 . A B . 37 PRO HG3 1 1 12 9780 1 1 37 PRO N N -4.090 5.660 -4.618 1.00 . A B . 37 PRO N 1 1 12 9781 1 1 37 PRO O O -3.332 7.537 -2.541 1.00 . A B . 37 PRO O 1 1 12 9782 1 1 38 PRO C C -1.518 9.725 -1.998 1.00 . A B . 38 PRO C 1 1 12 9783 1 1 38 PRO CA C -0.792 8.698 -2.857 1.00 . A B . 38 PRO CA 1 1 12 9784 1 1 38 PRO CB C 0.357 9.359 -3.622 1.00 . A B . 38 PRO CB 1 1 12 9785 1 1 38 PRO CD C -1.039 8.305 -5.249 1.00 . A B . 38 PRO CD 1 1 12 9786 1 1 38 PRO CG C 0.394 8.649 -4.933 1.00 . A B . 38 PRO CG 1 1 12 9787 1 1 38 PRO HA H -0.402 7.913 -2.224 1.00 . A B . 38 PRO HA 1 1 12 9788 1 1 38 PRO HB2 H 0.152 10.414 -3.741 1.00 . A B . 38 PRO HB2 1 1 12 9789 1 1 38 PRO HB3 H 1.279 9.226 -3.074 1.00 . A B . 38 PRO HB3 1 1 12 9790 1 1 38 PRO HD2 H -1.512 9.106 -5.799 1.00 . A B . 38 PRO HD2 1 1 12 9791 1 1 38 PRO HD3 H -1.093 7.380 -5.805 1.00 . A B . 38 PRO HD3 1 1 12 9792 1 1 38 PRO HG2 H 0.805 9.299 -5.695 1.00 . A B . 38 PRO HG2 1 1 12 9793 1 1 38 PRO HG3 H 0.987 7.749 -4.844 1.00 . A B . 38 PRO HG3 1 1 12 9794 1 1 38 PRO N N -1.649 8.152 -3.915 1.00 . A B . 38 PRO N 1 1 12 9795 1 1 38 PRO O O -2.228 10.592 -2.516 1.00 . A B . 38 PRO O 1 1 12 9796 1 1 39 VAL C C -1.502 11.921 0.173 1.00 . A B . 39 VAL C 1 1 12 9797 1 1 39 VAL CA C -2.030 10.492 0.247 1.00 . A B . 39 VAL CA 1 1 12 9798 1 1 39 VAL CB C -1.950 9.968 1.703 1.00 . A B . 39 VAL CB 1 1 12 9799 1 1 39 VAL CG1 C -0.511 9.775 2.152 1.00 . A B . 39 VAL CG1 1 1 12 9800 1 1 39 VAL CG2 C -2.689 10.896 2.656 1.00 . A B . 39 VAL CG2 1 1 12 9801 1 1 39 VAL H H -0.726 8.942 -0.343 1.00 . A B . 39 VAL H 1 1 12 9802 1 1 39 VAL HA H -3.071 10.502 -0.039 1.00 . A B . 39 VAL HA 1 1 12 9803 1 1 39 VAL HB H -2.438 9.007 1.737 1.00 . A B . 39 VAL HB 1 1 12 9804 1 1 39 VAL HG11 H -0.063 8.968 1.595 1.00 . A B . 39 VAL HG11 1 1 12 9805 1 1 39 VAL HG12 H -0.493 9.539 3.205 1.00 . A B . 39 VAL HG12 1 1 12 9806 1 1 39 VAL HG13 H 0.043 10.685 1.979 1.00 . A B . 39 VAL HG13 1 1 12 9807 1 1 39 VAL HG21 H -3.723 10.967 2.359 1.00 . A B . 39 VAL HG21 1 1 12 9808 1 1 39 VAL HG22 H -2.238 11.877 2.625 1.00 . A B . 39 VAL HG22 1 1 12 9809 1 1 39 VAL HG23 H -2.629 10.504 3.660 1.00 . A B . 39 VAL HG23 1 1 12 9810 1 1 39 VAL N N -1.340 9.619 -0.688 1.00 . A B . 39 VAL N 1 1 12 9811 1 1 39 VAL O O -0.311 12.181 0.361 1.00 . A B . 39 VAL O 1 1 12 9812 1 1 40 GLU C C -2.769 14.888 1.080 1.00 . A B . 40 GLU C 1 1 12 9813 1 1 40 GLU CA C -2.091 14.252 -0.127 1.00 . A B . 40 GLU CA 1 1 12 9814 1 1 40 GLU CB C -2.564 14.911 -1.427 1.00 . A B . 40 GLU CB 1 1 12 9815 1 1 40 GLU CD C -3.026 17.044 -2.667 1.00 . A B . 40 GLU CD 1 1 12 9816 1 1 40 GLU CG C -2.327 16.408 -1.487 1.00 . A B . 40 GLU CG 1 1 12 9817 1 1 40 GLU H H -3.295 12.548 -0.409 1.00 . A B . 40 GLU H 1 1 12 9818 1 1 40 GLU HA H -1.022 14.365 -0.033 1.00 . A B . 40 GLU HA 1 1 12 9819 1 1 40 GLU HB2 H -2.043 14.457 -2.256 1.00 . A B . 40 GLU HB2 1 1 12 9820 1 1 40 GLU HB3 H -3.621 14.735 -1.542 1.00 . A B . 40 GLU HB3 1 1 12 9821 1 1 40 GLU HG2 H -2.704 16.855 -0.579 1.00 . A B . 40 GLU HG2 1 1 12 9822 1 1 40 GLU HG3 H -1.266 16.593 -1.569 1.00 . A B . 40 GLU HG3 1 1 12 9823 1 1 40 GLU N N -2.397 12.835 -0.147 1.00 . A B . 40 GLU N 1 1 12 9824 1 1 40 GLU O O -2.193 15.745 1.753 1.00 . A B . 40 GLU O 1 1 12 9825 1 1 40 GLU OE1 O -2.425 17.104 -3.762 1.00 . A B . 40 GLU OE1 1 1 12 9826 1 1 40 GLU OE2 O -4.184 17.483 -2.511 1.00 . A B . 40 GLU OE2 1 1 12 9827 1 1 41 ALA C C -6.086 14.138 2.604 1.00 . A B . 41 ALA C 1 1 12 9828 1 1 41 ALA CA C -4.763 14.890 2.505 1.00 . A B . 41 ALA CA 1 1 12 9829 1 1 41 ALA CB C -5.025 16.388 2.423 1.00 . A B . 41 ALA CB 1 1 12 9830 1 1 41 ALA H H -4.391 13.773 0.753 1.00 . A B . 41 ALA H 1 1 12 9831 1 1 41 ALA HA H -4.182 14.695 3.393 1.00 . A B . 41 ALA HA 1 1 12 9832 1 1 41 ALA HB1 H -5.621 16.602 1.550 1.00 . A B . 41 ALA HB1 1 1 12 9833 1 1 41 ALA HB2 H -4.085 16.914 2.355 1.00 . A B . 41 ALA HB2 1 1 12 9834 1 1 41 ALA HB3 H -5.554 16.709 3.309 1.00 . A B . 41 ALA HB3 1 1 12 9835 1 1 41 ALA N N -3.993 14.435 1.352 1.00 . A B . 41 ALA N 1 1 12 9836 1 1 41 ALA O O -6.538 13.794 3.693 1.00 . A B . 41 ALA O 1 1 12 9837 1 1 42 GLU C C -8.005 11.793 1.172 1.00 . A B . 42 GLU C 1 1 12 9838 1 1 42 GLU CA C -8.029 13.303 1.392 1.00 . A B . 42 GLU CA 1 1 12 9839 1 1 42 GLU CB C -8.806 13.968 0.259 1.00 . A B . 42 GLU CB 1 1 12 9840 1 1 42 GLU CD C -9.406 16.112 -0.909 1.00 . A B . 42 GLU CD 1 1 12 9841 1 1 42 GLU CG C -8.846 15.483 0.347 1.00 . A B . 42 GLU CG 1 1 12 9842 1 1 42 GLU H H -6.203 14.034 0.615 1.00 . A B . 42 GLU H 1 1 12 9843 1 1 42 GLU HA H -8.523 13.515 2.328 1.00 . A B . 42 GLU HA 1 1 12 9844 1 1 42 GLU HB2 H -8.352 13.695 -0.682 1.00 . A B . 42 GLU HB2 1 1 12 9845 1 1 42 GLU HB3 H -9.823 13.602 0.276 1.00 . A B . 42 GLU HB3 1 1 12 9846 1 1 42 GLU HG2 H -9.466 15.768 1.184 1.00 . A B . 42 GLU HG2 1 1 12 9847 1 1 42 GLU HG3 H -7.843 15.851 0.501 1.00 . A B . 42 GLU HG3 1 1 12 9848 1 1 42 GLU N N -6.683 13.862 1.453 1.00 . A B . 42 GLU N 1 1 12 9849 1 1 42 GLU O O -8.739 11.268 0.336 1.00 . A B . 42 GLU O 1 1 12 9850 1 1 42 GLU OE1 O -10.645 16.226 -1.019 1.00 . A B . 42 GLU OE1 1 1 12 9851 1 1 42 GLU OE2 O -8.612 16.492 -1.797 1.00 . A B . 42 GLU OE2 1 1 12 9852 1 1 43 ARG C C -7.028 9.007 3.173 1.00 . A B . 43 ARG C 1 1 12 9853 1 1 43 ARG CA C -7.067 9.646 1.795 1.00 . A B . 43 ARG CA 1 1 12 9854 1 1 43 ARG CB C -5.824 9.248 0.991 1.00 . A B . 43 ARG CB 1 1 12 9855 1 1 43 ARG CD C -6.925 9.013 -1.266 1.00 . A B . 43 ARG CD 1 1 12 9856 1 1 43 ARG CG C -5.848 9.721 -0.456 1.00 . A B . 43 ARG CG 1 1 12 9857 1 1 43 ARG CZ C -7.956 9.165 -3.507 1.00 . A B . 43 ARG CZ 1 1 12 9858 1 1 43 ARG H H -6.614 11.560 2.579 1.00 . A B . 43 ARG H 1 1 12 9859 1 1 43 ARG HA H -7.947 9.298 1.278 1.00 . A B . 43 ARG HA 1 1 12 9860 1 1 43 ARG HB2 H -4.952 9.669 1.469 1.00 . A B . 43 ARG HB2 1 1 12 9861 1 1 43 ARG HB3 H -5.738 8.172 0.993 1.00 . A B . 43 ARG HB3 1 1 12 9862 1 1 43 ARG HD2 H -6.655 7.973 -1.371 1.00 . A B . 43 ARG HD2 1 1 12 9863 1 1 43 ARG HD3 H -7.864 9.088 -0.739 1.00 . A B . 43 ARG HD3 1 1 12 9864 1 1 43 ARG HE H -6.510 10.369 -2.820 1.00 . A B . 43 ARG HE 1 1 12 9865 1 1 43 ARG HG2 H -6.045 10.781 -0.471 1.00 . A B . 43 ARG HG2 1 1 12 9866 1 1 43 ARG HG3 H -4.885 9.526 -0.905 1.00 . A B . 43 ARG HG3 1 1 12 9867 1 1 43 ARG HH11 H -8.633 7.623 -2.377 1.00 . A B . 43 ARG HH11 1 1 12 9868 1 1 43 ARG HH12 H -9.375 7.785 -3.937 1.00 . A B . 43 ARG HH12 1 1 12 9869 1 1 43 ARG HH21 H -7.492 10.583 -4.882 1.00 . A B . 43 ARG HH21 1 1 12 9870 1 1 43 ARG HH22 H -8.719 9.450 -5.362 1.00 . A B . 43 ARG HH22 1 1 12 9871 1 1 43 ARG N N -7.166 11.095 1.917 1.00 . A B . 43 ARG N 1 1 12 9872 1 1 43 ARG NE N -7.081 9.598 -2.598 1.00 . A B . 43 ARG NE 1 1 12 9873 1 1 43 ARG NH1 N -8.714 8.105 -3.253 1.00 . A B . 43 ARG NH1 1 1 12 9874 1 1 43 ARG NH2 N -8.064 9.783 -4.675 1.00 . A B . 43 ARG NH2 1 1 12 9875 1 1 43 ARG O O -6.351 9.500 4.075 1.00 . A B . 43 ARG O 1 1 12 9876 1 1 44 THR C C -6.959 5.990 4.626 1.00 . A B . 44 THR C 1 1 12 9877 1 1 44 THR CA C -7.843 7.243 4.616 1.00 . A B . 44 THR CA 1 1 12 9878 1 1 44 THR CB C -9.304 6.872 4.940 1.00 . A B . 44 THR CB 1 1 12 9879 1 1 44 THR CG2 C -10.118 8.123 5.248 1.00 . A B . 44 THR CG2 1 1 12 9880 1 1 44 THR H H -8.272 7.569 2.578 1.00 . A B . 44 THR H 1 1 12 9881 1 1 44 THR HA H -7.493 7.928 5.373 1.00 . A B . 44 THR HA 1 1 12 9882 1 1 44 THR HB H -9.314 6.229 5.809 1.00 . A B . 44 THR HB 1 1 12 9883 1 1 44 THR HG1 H -10.613 5.617 4.152 1.00 . A B . 44 THR HG1 1 1 12 9884 1 1 44 THR HG21 H -9.708 8.617 6.115 1.00 . A B . 44 THR HG21 1 1 12 9885 1 1 44 THR HG22 H -11.144 7.849 5.440 1.00 . A B . 44 THR HG22 1 1 12 9886 1 1 44 THR HG23 H -10.076 8.793 4.401 1.00 . A B . 44 THR HG23 1 1 12 9887 1 1 44 THR N N -7.764 7.923 3.337 1.00 . A B . 44 THR N 1 1 12 9888 1 1 44 THR O O -7.248 5.012 3.936 1.00 . A B . 44 THR O 1 1 12 9889 1 1 44 THR OG1 O -9.896 6.181 3.832 1.00 . A B . 44 THR OG1 1 1 12 9890 1 1 45 PRO C C -5.500 3.630 6.075 1.00 . A B . 45 PRO C 1 1 12 9891 1 1 45 PRO CA C -4.904 4.892 5.453 1.00 . A B . 45 PRO CA 1 1 12 9892 1 1 45 PRO CB C -3.753 5.420 6.324 1.00 . A B . 45 PRO CB 1 1 12 9893 1 1 45 PRO CD C -5.442 7.124 6.267 1.00 . A B . 45 PRO CD 1 1 12 9894 1 1 45 PRO CG C -3.964 6.896 6.423 1.00 . A B . 45 PRO CG 1 1 12 9895 1 1 45 PRO HA H -4.529 4.656 4.469 1.00 . A B . 45 PRO HA 1 1 12 9896 1 1 45 PRO HB2 H -3.791 4.949 7.298 1.00 . A B . 45 PRO HB2 1 1 12 9897 1 1 45 PRO HB3 H -2.809 5.190 5.848 1.00 . A B . 45 PRO HB3 1 1 12 9898 1 1 45 PRO HD2 H -5.939 7.073 7.228 1.00 . A B . 45 PRO HD2 1 1 12 9899 1 1 45 PRO HD3 H -5.630 8.077 5.791 1.00 . A B . 45 PRO HD3 1 1 12 9900 1 1 45 PRO HG2 H -3.630 7.249 7.389 1.00 . A B . 45 PRO HG2 1 1 12 9901 1 1 45 PRO HG3 H -3.421 7.398 5.634 1.00 . A B . 45 PRO HG3 1 1 12 9902 1 1 45 PRO N N -5.858 6.011 5.400 1.00 . A B . 45 PRO N 1 1 12 9903 1 1 45 PRO O O -5.028 2.522 5.822 1.00 . A B . 45 PRO O 1 1 12 9904 1 1 46 TRP C C -8.305 2.083 6.689 1.00 . A B . 46 TRP C 1 1 12 9905 1 1 46 TRP CA C -7.180 2.662 7.545 1.00 . A B . 46 TRP CA 1 1 12 9906 1 1 46 TRP CB C -7.713 3.074 8.926 1.00 . A B . 46 TRP CB 1 1 12 9907 1 1 46 TRP CD1 C -10.023 4.175 8.747 1.00 . A B . 46 TRP CD1 1 1 12 9908 1 1 46 TRP CD2 C -8.340 5.625 9.011 1.00 . A B . 46 TRP CD2 1 1 12 9909 1 1 46 TRP CE2 C -9.545 6.345 8.928 1.00 . A B . 46 TRP CE2 1 1 12 9910 1 1 46 TRP CE3 C -7.146 6.328 9.179 1.00 . A B . 46 TRP CE3 1 1 12 9911 1 1 46 TRP CG C -8.667 4.234 8.892 1.00 . A B . 46 TRP CG 1 1 12 9912 1 1 46 TRP CH2 C -8.405 8.396 9.171 1.00 . A B . 46 TRP CH2 1 1 12 9913 1 1 46 TRP CZ2 C -9.590 7.732 9.008 1.00 . A B . 46 TRP CZ2 1 1 12 9914 1 1 46 TRP CZ3 C -7.192 7.708 9.257 1.00 . A B . 46 TRP CZ3 1 1 12 9915 1 1 46 TRP H H -6.899 4.700 7.020 1.00 . A B . 46 TRP H 1 1 12 9916 1 1 46 TRP HA H -6.426 1.899 7.674 1.00 . A B . 46 TRP HA 1 1 12 9917 1 1 46 TRP HB2 H -8.232 2.235 9.367 1.00 . A B . 46 TRP HB2 1 1 12 9918 1 1 46 TRP HB3 H -6.880 3.344 9.562 1.00 . A B . 46 TRP HB3 1 1 12 9919 1 1 46 TRP HD1 H -10.583 3.261 8.631 1.00 . A B . 46 TRP HD1 1 1 12 9920 1 1 46 TRP HE1 H -11.511 5.659 8.682 1.00 . A B . 46 TRP HE1 1 1 12 9921 1 1 46 TRP HE3 H -6.200 5.814 9.246 1.00 . A B . 46 TRP HE3 1 1 12 9922 1 1 46 TRP HH2 H -8.390 9.473 9.235 1.00 . A B . 46 TRP HH2 1 1 12 9923 1 1 46 TRP HZ2 H -10.521 8.278 8.948 1.00 . A B . 46 TRP HZ2 1 1 12 9924 1 1 46 TRP HZ3 H -6.280 8.271 9.385 1.00 . A B . 46 TRP HZ3 1 1 12 9925 1 1 46 TRP N N -6.545 3.797 6.877 1.00 . A B . 46 TRP N 1 1 12 9926 1 1 46 TRP NE1 N -10.556 5.440 8.766 1.00 . A B . 46 TRP NE1 1 1 12 9927 1 1 46 TRP O O -9.221 1.433 7.194 1.00 . A B . 46 TRP O 1 1 12 9928 1 1 47 ASN C C -8.511 1.096 3.309 1.00 . A B . 47 ASN C 1 1 12 9929 1 1 47 ASN CA C -9.210 1.816 4.452 1.00 . A B . 47 ASN CA 1 1 12 9930 1 1 47 ASN CB C -10.066 2.964 3.905 1.00 . A B . 47 ASN CB 1 1 12 9931 1 1 47 ASN CG C -11.120 2.504 2.907 1.00 . A B . 47 ASN CG 1 1 12 9932 1 1 47 ASN H H -7.452 2.820 5.048 1.00 . A B . 47 ASN H 1 1 12 9933 1 1 47 ASN HA H -9.842 1.117 4.977 1.00 . A B . 47 ASN HA 1 1 12 9934 1 1 47 ASN HB2 H -10.569 3.451 4.727 1.00 . A B . 47 ASN HB2 1 1 12 9935 1 1 47 ASN HB3 H -9.421 3.678 3.414 1.00 . A B . 47 ASN HB3 1 1 12 9936 1 1 47 ASN HD21 H -11.414 0.809 3.914 1.00 . A B . 47 ASN HD21 1 1 12 9937 1 1 47 ASN HD22 H -12.366 1.011 2.482 1.00 . A B . 47 ASN HD22 1 1 12 9938 1 1 47 ASN N N -8.219 2.316 5.392 1.00 . A B . 47 ASN N 1 1 12 9939 1 1 47 ASN ND2 N -11.692 1.324 3.123 1.00 . A B . 47 ASN ND2 1 1 12 9940 1 1 47 ASN O O -7.757 1.709 2.550 1.00 . A B . 47 ASN O 1 1 12 9941 1 1 47 ASN OD1 O -11.438 3.220 1.958 1.00 . A B . 47 ASN OD1 1 1 12 9942 1 1 48 CYS C C -8.925 -0.968 0.898 1.00 . A B . 48 CYS C 1 1 12 9943 1 1 48 CYS CA C -8.115 -1.012 2.183 1.00 . A B . 48 CYS CA 1 1 12 9944 1 1 48 CYS CB C -7.990 -2.454 2.684 1.00 . A B . 48 CYS CB 1 1 12 9945 1 1 48 CYS H H -9.433 -0.609 3.773 1.00 . A B . 48 CYS H 1 1 12 9946 1 1 48 CYS HA H -7.129 -0.605 2.002 1.00 . A B . 48 CYS HA 1 1 12 9947 1 1 48 CYS HB2 H -7.450 -2.456 3.619 1.00 . A B . 48 CYS HB2 1 1 12 9948 1 1 48 CYS HB3 H -8.983 -2.847 2.855 1.00 . A B . 48 CYS HB3 1 1 12 9949 1 1 48 CYS N N -8.764 -0.197 3.191 1.00 . A B . 48 CYS N 1 1 12 9950 1 1 48 CYS O O -10.101 -1.335 0.875 1.00 . A B . 48 CYS O 1 1 12 9951 1 1 48 CYS SG S -7.138 -3.604 1.571 1.00 . A B . 48 CYS SG 1 1 12 9952 1 1 49 ILE C C -8.973 -1.792 -2.168 1.00 . A B . 49 ILE C 1 1 12 9953 1 1 49 ILE CA C -8.956 -0.441 -1.460 1.00 . A B . 49 ILE CA 1 1 12 9954 1 1 49 ILE CB C -8.300 0.628 -2.370 1.00 . A B . 49 ILE CB 1 1 12 9955 1 1 49 ILE CD1 C -6.072 1.443 -3.311 1.00 . A B . 49 ILE CD1 1 1 12 9956 1 1 49 ILE CG1 C -6.772 0.507 -2.349 1.00 . A B . 49 ILE CG1 1 1 12 9957 1 1 49 ILE CG2 C -8.727 2.028 -1.941 1.00 . A B . 49 ILE CG2 1 1 12 9958 1 1 49 ILE H H -7.348 -0.264 -0.091 1.00 . A B . 49 ILE H 1 1 12 9959 1 1 49 ILE HA H -9.978 -0.141 -1.273 1.00 . A B . 49 ILE HA 1 1 12 9960 1 1 49 ILE HB H -8.650 0.466 -3.380 1.00 . A B . 49 ILE HB 1 1 12 9961 1 1 49 ILE HD11 H -6.379 1.220 -4.322 1.00 . A B . 49 ILE HD11 1 1 12 9962 1 1 49 ILE HD12 H -5.002 1.318 -3.223 1.00 . A B . 49 ILE HD12 1 1 12 9963 1 1 49 ILE HD13 H -6.333 2.464 -3.075 1.00 . A B . 49 ILE HD13 1 1 12 9964 1 1 49 ILE HG12 H -6.418 0.739 -1.358 1.00 . A B . 49 ILE HG12 1 1 12 9965 1 1 49 ILE HG13 H -6.491 -0.505 -2.602 1.00 . A B . 49 ILE HG13 1 1 12 9966 1 1 49 ILE HG21 H -8.266 2.759 -2.589 1.00 . A B . 49 ILE HG21 1 1 12 9967 1 1 49 ILE HG22 H -8.411 2.204 -0.922 1.00 . A B . 49 ILE HG22 1 1 12 9968 1 1 49 ILE HG23 H -9.801 2.116 -2.006 1.00 . A B . 49 ILE HG23 1 1 12 9969 1 1 49 ILE N N -8.288 -0.537 -0.173 1.00 . A B . 49 ILE N 1 1 12 9970 1 1 49 ILE O O -9.896 -2.098 -2.917 1.00 . A B . 49 ILE O 1 1 12 9971 1 1 50 PHE C C -8.796 -4.940 -1.991 1.00 . A B . 50 PHE C 1 1 12 9972 1 1 50 PHE CA C -7.838 -3.904 -2.555 1.00 . A B . 50 PHE CA 1 1 12 9973 1 1 50 PHE CB C -6.390 -4.394 -2.552 1.00 . A B . 50 PHE CB 1 1 12 9974 1 1 50 PHE CD1 C -5.532 -4.319 -4.904 1.00 . A B . 50 PHE CD1 1 1 12 9975 1 1 50 PHE CD2 C -4.948 -2.541 -3.432 1.00 . A B . 50 PHE CD2 1 1 12 9976 1 1 50 PHE CE1 C -4.838 -3.707 -5.926 1.00 . A B . 50 PHE CE1 1 1 12 9977 1 1 50 PHE CE2 C -4.246 -1.926 -4.446 1.00 . A B . 50 PHE CE2 1 1 12 9978 1 1 50 PHE CG C -5.596 -3.743 -3.646 1.00 . A B . 50 PHE CG 1 1 12 9979 1 1 50 PHE CZ C -4.192 -2.510 -5.697 1.00 . A B . 50 PHE CZ 1 1 12 9980 1 1 50 PHE H H -7.346 -2.378 -1.173 1.00 . A B . 50 PHE H 1 1 12 9981 1 1 50 PHE HA H -8.125 -3.736 -3.585 1.00 . A B . 50 PHE HA 1 1 12 9982 1 1 50 PHE HB2 H -5.927 -4.158 -1.604 1.00 . A B . 50 PHE HB2 1 1 12 9983 1 1 50 PHE HB3 H -6.371 -5.463 -2.711 1.00 . A B . 50 PHE HB3 1 1 12 9984 1 1 50 PHE HD1 H -6.034 -5.257 -5.082 1.00 . A B . 50 PHE HD1 1 1 12 9985 1 1 50 PHE HD2 H -4.986 -2.086 -2.454 1.00 . A B . 50 PHE HD2 1 1 12 9986 1 1 50 PHE HE1 H -4.796 -4.168 -6.901 1.00 . A B . 50 PHE HE1 1 1 12 9987 1 1 50 PHE HE2 H -3.745 -0.988 -4.263 1.00 . A B . 50 PHE HE2 1 1 12 9988 1 1 50 PHE HZ H -3.651 -2.029 -6.497 1.00 . A B . 50 PHE HZ 1 1 12 9989 1 1 50 PHE N N -7.974 -2.618 -1.886 1.00 . A B . 50 PHE N 1 1 12 9990 1 1 50 PHE O O -9.202 -5.853 -2.701 1.00 . A B . 50 PHE O 1 1 12 9991 1 1 51 CYS C C -11.498 -5.526 -0.844 1.00 . A B . 51 CYS C 1 1 12 9992 1 1 51 CYS CA C -10.154 -5.697 -0.135 1.00 . A B . 51 CYS CA 1 1 12 9993 1 1 51 CYS CB C -10.309 -5.438 1.363 1.00 . A B . 51 CYS CB 1 1 12 9994 1 1 51 CYS H H -8.729 -4.125 -0.163 1.00 . A B . 51 CYS H 1 1 12 9995 1 1 51 CYS HA H -9.820 -6.716 -0.281 1.00 . A B . 51 CYS HA 1 1 12 9996 1 1 51 CYS HB2 H -10.021 -4.418 1.575 1.00 . A B . 51 CYS HB2 1 1 12 9997 1 1 51 CYS HB3 H -11.341 -5.581 1.644 1.00 . A B . 51 CYS HB3 1 1 12 9998 1 1 51 CYS N N -9.147 -4.818 -0.717 1.00 . A B . 51 CYS N 1 1 12 9999 1 1 51 CYS O O -12.264 -6.478 -0.976 1.00 . A B . 51 CYS O 1 1 12 10000 1 1 51 CYS SG S -9.297 -6.521 2.399 1.00 . A B . 51 CYS SG 1 1 12 10001 1 1 52 ARG C C -12.792 -4.322 -3.543 1.00 . A B . 52 ARG C 1 1 12 10002 1 1 52 ARG CA C -13.004 -4.056 -2.056 1.00 . A B . 52 ARG CA 1 1 12 10003 1 1 52 ARG CB C -13.479 -2.616 -1.840 1.00 . A B . 52 ARG CB 1 1 12 10004 1 1 52 ARG CD C -14.253 -0.850 -0.222 1.00 . A B . 52 ARG CD 1 1 12 10005 1 1 52 ARG CG C -13.724 -2.265 -0.381 1.00 . A B . 52 ARG CG 1 1 12 10006 1 1 52 ARG CZ C -13.154 1.359 -0.225 1.00 . A B . 52 ARG CZ 1 1 12 10007 1 1 52 ARG H H -11.171 -3.569 -1.121 1.00 . A B . 52 ARG H 1 1 12 10008 1 1 52 ARG HA H -13.758 -4.734 -1.688 1.00 . A B . 52 ARG HA 1 1 12 10009 1 1 52 ARG HB2 H -12.732 -1.940 -2.229 1.00 . A B . 52 ARG HB2 1 1 12 10010 1 1 52 ARG HB3 H -14.400 -2.471 -2.383 1.00 . A B . 52 ARG HB3 1 1 12 10011 1 1 52 ARG HD2 H -15.193 -0.769 -0.748 1.00 . A B . 52 ARG HD2 1 1 12 10012 1 1 52 ARG HD3 H -14.413 -0.655 0.828 1.00 . A B . 52 ARG HD3 1 1 12 10013 1 1 52 ARG HE H -12.813 -0.094 -1.557 1.00 . A B . 52 ARG HE 1 1 12 10014 1 1 52 ARG HG2 H -14.446 -2.954 0.031 1.00 . A B . 52 ARG HG2 1 1 12 10015 1 1 52 ARG HG3 H -12.793 -2.352 0.160 1.00 . A B . 52 ARG HG3 1 1 12 10016 1 1 52 ARG HH11 H -14.483 1.091 1.284 1.00 . A B . 52 ARG HH11 1 1 12 10017 1 1 52 ARG HH12 H -13.701 2.638 1.249 1.00 . A B . 52 ARG HH12 1 1 12 10018 1 1 52 ARG HH21 H -11.789 1.940 -1.605 1.00 . A B . 52 ARG HH21 1 1 12 10019 1 1 52 ARG HH22 H -12.155 3.118 -0.383 1.00 . A B . 52 ARG HH22 1 1 12 10020 1 1 52 ARG N N -11.779 -4.313 -1.308 1.00 . A B . 52 ARG N 1 1 12 10021 1 1 52 ARG NE N -13.329 0.150 -0.754 1.00 . A B . 52 ARG NE 1 1 12 10022 1 1 52 ARG NH1 N -13.835 1.724 0.856 1.00 . A B . 52 ARG NH1 1 1 12 10023 1 1 52 ARG NH2 N -12.301 2.208 -0.783 1.00 . A B . 52 ARG NH2 1 1 12 10024 1 1 52 ARG O O -13.745 -4.409 -4.315 1.00 . A B . 52 ARG O 1 1 12 10025 1 1 53 MET C C -10.595 -6.135 -5.453 1.00 . A B . 53 MET C 1 1 12 10026 1 1 53 MET CA C -11.184 -4.737 -5.323 1.00 . A B . 53 MET CA 1 1 12 10027 1 1 53 MET CB C -10.190 -3.697 -5.850 1.00 . A B . 53 MET CB 1 1 12 10028 1 1 53 MET CE C -10.585 0.359 -6.762 1.00 . A B . 53 MET CE 1 1 12 10029 1 1 53 MET CG C -10.780 -2.307 -6.017 1.00 . A B . 53 MET CG 1 1 12 10030 1 1 53 MET H H -10.824 -4.402 -3.264 1.00 . A B . 53 MET H 1 1 12 10031 1 1 53 MET HA H -12.090 -4.688 -5.907 1.00 . A B . 53 MET HA 1 1 12 10032 1 1 53 MET HB2 H -9.360 -3.631 -5.164 1.00 . A B . 53 MET HB2 1 1 12 10033 1 1 53 MET HB3 H -9.824 -4.025 -6.811 1.00 . A B . 53 MET HB3 1 1 12 10034 1 1 53 MET HE1 H -11.360 0.168 -7.489 1.00 . A B . 53 MET HE1 1 1 12 10035 1 1 53 MET HE2 H -9.976 1.186 -7.094 1.00 . A B . 53 MET HE2 1 1 12 10036 1 1 53 MET HE3 H -11.035 0.604 -5.812 1.00 . A B . 53 MET HE3 1 1 12 10037 1 1 53 MET HG2 H -11.580 -2.353 -6.739 1.00 . A B . 53 MET HG2 1 1 12 10038 1 1 53 MET HG3 H -11.175 -1.981 -5.065 1.00 . A B . 53 MET HG3 1 1 12 10039 1 1 53 MET N N -11.535 -4.465 -3.934 1.00 . A B . 53 MET N 1 1 12 10040 1 1 53 MET O O -9.770 -6.400 -6.327 1.00 . A B . 53 MET O 1 1 12 10041 1 1 53 MET SD S -9.563 -1.101 -6.580 1.00 . A B . 53 MET SD 1 1 12 10042 1 1 54 LYS C C -11.274 -9.180 -5.667 1.00 . A B . 54 LYS C 1 1 12 10043 1 1 54 LYS CA C -10.544 -8.397 -4.584 1.00 . A B . 54 LYS CA 1 1 12 10044 1 1 54 LYS CB C -10.732 -9.066 -3.215 1.00 . A B . 54 LYS CB 1 1 12 10045 1 1 54 LYS CD C -12.302 -9.789 -1.390 1.00 . A B . 54 LYS CD 1 1 12 10046 1 1 54 LYS CE C -13.750 -9.854 -0.925 1.00 . A B . 54 LYS CE 1 1 12 10047 1 1 54 LYS CG C -12.183 -9.148 -2.763 1.00 . A B . 54 LYS CG 1 1 12 10048 1 1 54 LYS H H -11.626 -6.734 -3.858 1.00 . A B . 54 LYS H 1 1 12 10049 1 1 54 LYS HA H -9.492 -8.379 -4.824 1.00 . A B . 54 LYS HA 1 1 12 10050 1 1 54 LYS HB2 H -10.333 -10.070 -3.258 1.00 . A B . 54 LYS HB2 1 1 12 10051 1 1 54 LYS HB3 H -10.181 -8.503 -2.475 1.00 . A B . 54 LYS HB3 1 1 12 10052 1 1 54 LYS HD2 H -11.906 -10.793 -1.437 1.00 . A B . 54 LYS HD2 1 1 12 10053 1 1 54 LYS HD3 H -11.732 -9.207 -0.682 1.00 . A B . 54 LYS HD3 1 1 12 10054 1 1 54 LYS HE2 H -14.311 -10.467 -1.614 1.00 . A B . 54 LYS HE2 1 1 12 10055 1 1 54 LYS HE3 H -13.777 -10.302 0.057 1.00 . A B . 54 LYS HE3 1 1 12 10056 1 1 54 LYS HG2 H -12.588 -8.147 -2.718 1.00 . A B . 54 LYS HG2 1 1 12 10057 1 1 54 LYS HG3 H -12.742 -9.734 -3.477 1.00 . A B . 54 LYS HG3 1 1 12 10058 1 1 54 LYS HZ1 H -13.809 -7.878 -0.249 1.00 . A B . 54 LYS HZ1 1 1 12 10059 1 1 54 LYS HZ2 H -15.335 -8.575 -0.459 1.00 . A B . 54 LYS HZ2 1 1 12 10060 1 1 54 LYS HZ3 H -14.438 -8.089 -1.807 1.00 . A B . 54 LYS HZ3 1 1 12 10061 1 1 54 LYS N N -11.008 -7.020 -4.559 1.00 . A B . 54 LYS N 1 1 12 10062 1 1 54 LYS NZ N -14.376 -8.506 -0.857 1.00 . A B . 54 LYS NZ 1 1 12 10063 1 1 54 LYS O O -12.457 -8.955 -5.918 1.00 . A B . 54 LYS O 1 1 12 10064 1 1 55 GLU C C -11.787 -12.128 -6.851 1.00 . A B . 55 GLU C 1 1 12 10065 1 1 55 GLU CA C -11.116 -10.871 -7.400 1.00 . A B . 55 GLU CA 1 1 12 10066 1 1 55 GLU CB C -10.011 -11.237 -8.390 1.00 . A B . 55 GLU CB 1 1 12 10067 1 1 55 GLU CD C -9.367 -12.282 -10.583 1.00 . A B . 55 GLU CD 1 1 12 10068 1 1 55 GLU CG C -10.500 -11.951 -9.637 1.00 . A B . 55 GLU CG 1 1 12 10069 1 1 55 GLU H H -9.623 -10.226 -6.054 1.00 . A B . 55 GLU H 1 1 12 10070 1 1 55 GLU HA H -11.856 -10.270 -7.905 1.00 . A B . 55 GLU HA 1 1 12 10071 1 1 55 GLU HB2 H -9.511 -10.332 -8.696 1.00 . A B . 55 GLU HB2 1 1 12 10072 1 1 55 GLU HB3 H -9.300 -11.879 -7.892 1.00 . A B . 55 GLU HB3 1 1 12 10073 1 1 55 GLU HG2 H -10.988 -12.870 -9.346 1.00 . A B . 55 GLU HG2 1 1 12 10074 1 1 55 GLU HG3 H -11.206 -11.314 -10.150 1.00 . A B . 55 GLU HG3 1 1 12 10075 1 1 55 GLU N N -10.558 -10.082 -6.316 1.00 . A B . 55 GLU N 1 1 12 10076 1 1 55 GLU O O -11.172 -13.192 -6.773 1.00 . A B . 55 GLU O 1 1 12 10077 1 1 55 GLU OE1 O -8.763 -13.365 -10.438 1.00 . A B . 55 GLU OE1 1 1 12 10078 1 1 55 GLU OE2 O -9.063 -11.454 -11.466 1.00 . A B . 55 GLU OE2 1 1 12 10079 1 1 56 SER C C -15.231 -13.050 -6.384 1.00 . A B . 56 SER C 1 1 12 10080 1 1 56 SER CA C -13.790 -13.095 -5.888 1.00 . A B . 56 SER CA 1 1 12 10081 1 1 56 SER CB C -13.739 -13.030 -4.356 1.00 . A B . 56 SER CB 1 1 12 10082 1 1 56 SER H H -13.490 -11.123 -6.582 1.00 . A B . 56 SER H 1 1 12 10083 1 1 56 SER HA H -13.334 -14.016 -6.220 1.00 . A B . 56 SER HA 1 1 12 10084 1 1 56 SER HB2 H -12.713 -12.929 -4.037 1.00 . A B . 56 SER HB2 1 1 12 10085 1 1 56 SER HB3 H -14.304 -12.174 -4.015 1.00 . A B . 56 SER HB3 1 1 12 10086 1 1 56 SER HG H -13.733 -14.961 -3.990 1.00 . A B . 56 SER HG 1 1 12 10087 1 1 56 SER N N -13.043 -11.992 -6.464 1.00 . A B . 56 SER N 1 1 12 10088 1 1 56 SER O O -15.551 -13.788 -7.343 1.00 . A B . 56 SER O 1 1 12 10089 1 1 56 SER OXT O -16.029 -12.266 -5.834 1.00 . A B . 56 SER OXT 1 1 12 10090 1 1 56 SER OG O -14.286 -14.200 -3.762 1.00 . A B . 56 SER OG 1 1 12 10091 2 2 1 ZN ZN ZN -7.176 -5.656 2.599 1.00 . B B . 101 ZN ZN 1 1 12 10092 3 2 1 ZN ZN ZN 5.920 1.036 -0.206 1.00 . C B . 102 ZN ZN 1 1 13 10093 1 1 1 GLY C C 18.012 -9.394 8.894 1.00 . A B . 1 GLY C 1 1 13 10094 1 1 1 GLY CA C 18.134 -10.554 9.852 1.00 . A B . 1 GLY CA 1 1 13 10095 1 1 1 GLY H1 H 17.662 -9.453 11.549 1.00 . A B . 1 GLY H1 1 1 13 10096 1 1 1 GLY H2 H 17.486 -11.121 11.747 1.00 . A B . 1 GLY H2 1 1 13 10097 1 1 1 GLY H3 H 16.341 -10.249 10.860 1.00 . A B . 1 GLY H3 1 1 13 10098 1 1 1 GLY HA2 H 19.173 -10.686 10.114 1.00 . A B . 1 GLY HA2 1 1 13 10099 1 1 1 GLY HA3 H 17.778 -11.451 9.369 1.00 . A B . 1 GLY HA3 1 1 13 10100 1 1 1 GLY N N 17.351 -10.330 11.088 1.00 . A B . 1 GLY N 1 1 13 10101 1 1 1 GLY O O 17.593 -8.308 9.287 1.00 . A B . 1 GLY O 1 1 13 10102 1 1 2 ALA C C 17.227 -8.775 5.623 1.00 . A B . 2 ALA C 1 1 13 10103 1 1 2 ALA CA C 18.338 -8.553 6.643 1.00 . A B . 2 ALA CA 1 1 13 10104 1 1 2 ALA CB C 19.691 -8.446 5.947 1.00 . A B . 2 ALA CB 1 1 13 10105 1 1 2 ALA H H 18.651 -10.518 7.368 1.00 . A B . 2 ALA H 1 1 13 10106 1 1 2 ALA HA H 18.153 -7.623 7.161 1.00 . A B . 2 ALA HA 1 1 13 10107 1 1 2 ALA HB1 H 20.464 -8.293 6.685 1.00 . A B . 2 ALA HB1 1 1 13 10108 1 1 2 ALA HB2 H 19.678 -7.612 5.260 1.00 . A B . 2 ALA HB2 1 1 13 10109 1 1 2 ALA HB3 H 19.889 -9.357 5.402 1.00 . A B . 2 ALA HB3 1 1 13 10110 1 1 2 ALA N N 18.364 -9.616 7.636 1.00 . A B . 2 ALA N 1 1 13 10111 1 1 2 ALA O O 17.196 -8.123 4.578 1.00 . A B . 2 ALA O 1 1 13 10112 1 1 3 MET C C 13.922 -10.264 5.806 1.00 . A B . 3 MET C 1 1 13 10113 1 1 3 MET CA C 15.197 -9.972 5.030 1.00 . A B . 3 MET CA 1 1 13 10114 1 1 3 MET CB C 15.524 -11.147 4.100 1.00 . A B . 3 MET CB 1 1 13 10115 1 1 3 MET CE C 16.614 -9.281 0.532 1.00 . A B . 3 MET CE 1 1 13 10116 1 1 3 MET CG C 16.316 -10.741 2.864 1.00 . A B . 3 MET CG 1 1 13 10117 1 1 3 MET H H 16.370 -10.160 6.787 1.00 . A B . 3 MET H 1 1 13 10118 1 1 3 MET HA H 15.034 -9.090 4.427 1.00 . A B . 3 MET HA 1 1 13 10119 1 1 3 MET HB2 H 16.099 -11.880 4.648 1.00 . A B . 3 MET HB2 1 1 13 10120 1 1 3 MET HB3 H 14.598 -11.600 3.775 1.00 . A B . 3 MET HB3 1 1 13 10121 1 1 3 MET HE1 H 16.878 -10.216 0.062 1.00 . A B . 3 MET HE1 1 1 13 10122 1 1 3 MET HE2 H 17.497 -8.835 0.964 1.00 . A B . 3 MET HE2 1 1 13 10123 1 1 3 MET HE3 H 16.195 -8.614 -0.205 1.00 . A B . 3 MET HE3 1 1 13 10124 1 1 3 MET HG2 H 17.238 -10.274 3.177 1.00 . A B . 3 MET HG2 1 1 13 10125 1 1 3 MET HG3 H 16.540 -11.627 2.286 1.00 . A B . 3 MET HG3 1 1 13 10126 1 1 3 MET N N 16.309 -9.682 5.929 1.00 . A B . 3 MET N 1 1 13 10127 1 1 3 MET O O 13.947 -10.418 7.028 1.00 . A B . 3 MET O 1 1 13 10128 1 1 3 MET SD S 15.409 -9.584 1.819 1.00 . A B . 3 MET SD 1 1 13 10129 1 1 4 GLY C C 10.486 -9.620 5.127 1.00 . A B . 4 GLY C 1 1 13 10130 1 1 4 GLY CA C 11.525 -10.563 5.692 1.00 . A B . 4 GLY CA 1 1 13 10131 1 1 4 GLY H H 12.871 -10.207 4.110 1.00 . A B . 4 GLY H 1 1 13 10132 1 1 4 GLY HA2 H 11.222 -11.582 5.499 1.00 . A B . 4 GLY HA2 1 1 13 10133 1 1 4 GLY HA3 H 11.601 -10.409 6.758 1.00 . A B . 4 GLY HA3 1 1 13 10134 1 1 4 GLY N N 12.815 -10.330 5.083 1.00 . A B . 4 GLY N 1 1 13 10135 1 1 4 GLY O O 9.744 -9.972 4.208 1.00 . A B . 4 GLY O 1 1 13 10136 1 1 5 MET C C 10.422 -6.168 4.731 1.00 . A B . 5 MET C 1 1 13 10137 1 1 5 MET CA C 9.582 -7.374 5.136 1.00 . A B . 5 MET CA 1 1 13 10138 1 1 5 MET CB C 8.521 -6.985 6.174 1.00 . A B . 5 MET CB 1 1 13 10139 1 1 5 MET CE C 5.847 -8.262 4.955 1.00 . A B . 5 MET CE 1 1 13 10140 1 1 5 MET CG C 7.426 -6.078 5.625 1.00 . A B . 5 MET CG 1 1 13 10141 1 1 5 MET H H 11.024 -8.209 6.431 1.00 . A B . 5 MET H 1 1 13 10142 1 1 5 MET HA H 9.093 -7.766 4.257 1.00 . A B . 5 MET HA 1 1 13 10143 1 1 5 MET HB2 H 8.057 -7.885 6.550 1.00 . A B . 5 MET HB2 1 1 13 10144 1 1 5 MET HB3 H 9.006 -6.473 6.992 1.00 . A B . 5 MET HB3 1 1 13 10145 1 1 5 MET HE1 H 5.270 -8.795 4.215 1.00 . A B . 5 MET HE1 1 1 13 10146 1 1 5 MET HE2 H 5.204 -7.971 5.772 1.00 . A B . 5 MET HE2 1 1 13 10147 1 1 5 MET HE3 H 6.635 -8.901 5.327 1.00 . A B . 5 MET HE3 1 1 13 10148 1 1 5 MET HG2 H 6.706 -5.890 6.407 1.00 . A B . 5 MET HG2 1 1 13 10149 1 1 5 MET HG3 H 7.873 -5.143 5.318 1.00 . A B . 5 MET HG3 1 1 13 10150 1 1 5 MET N N 10.453 -8.411 5.659 1.00 . A B . 5 MET N 1 1 13 10151 1 1 5 MET O O 10.166 -5.034 5.138 1.00 . A B . 5 MET O 1 1 13 10152 1 1 5 MET SD S 6.566 -6.798 4.209 1.00 . A B . 5 MET SD 1 1 13 10153 1 1 6 ARG C C 12.362 -5.301 1.965 1.00 . A B . 6 ARG C 1 1 13 10154 1 1 6 ARG CA C 12.345 -5.381 3.483 1.00 . A B . 6 ARG CA 1 1 13 10155 1 1 6 ARG CB C 13.763 -5.613 4.002 1.00 . A B . 6 ARG CB 1 1 13 10156 1 1 6 ARG CD C 15.311 -5.747 5.965 1.00 . A B . 6 ARG CD 1 1 13 10157 1 1 6 ARG CG C 13.867 -5.636 5.514 1.00 . A B . 6 ARG CG 1 1 13 10158 1 1 6 ARG CZ C 16.502 -5.505 8.107 1.00 . A B . 6 ARG CZ 1 1 13 10159 1 1 6 ARG H H 11.605 -7.353 3.645 1.00 . A B . 6 ARG H 1 1 13 10160 1 1 6 ARG HA H 11.977 -4.444 3.873 1.00 . A B . 6 ARG HA 1 1 13 10161 1 1 6 ARG HB2 H 14.119 -6.561 3.626 1.00 . A B . 6 ARG HB2 1 1 13 10162 1 1 6 ARG HB3 H 14.402 -4.826 3.630 1.00 . A B . 6 ARG HB3 1 1 13 10163 1 1 6 ARG HD2 H 15.751 -6.622 5.511 1.00 . A B . 6 ARG HD2 1 1 13 10164 1 1 6 ARG HD3 H 15.846 -4.866 5.639 1.00 . A B . 6 ARG HD3 1 1 13 10165 1 1 6 ARG HE H 14.644 -6.223 7.896 1.00 . A B . 6 ARG HE 1 1 13 10166 1 1 6 ARG HG2 H 13.443 -4.725 5.912 1.00 . A B . 6 ARG HG2 1 1 13 10167 1 1 6 ARG HG3 H 13.316 -6.485 5.889 1.00 . A B . 6 ARG HG3 1 1 13 10168 1 1 6 ARG HH11 H 17.570 -4.932 6.481 1.00 . A B . 6 ARG HH11 1 1 13 10169 1 1 6 ARG HH12 H 18.390 -4.778 8.003 1.00 . A B . 6 ARG HH12 1 1 13 10170 1 1 6 ARG HH21 H 15.710 -5.995 9.904 1.00 . A B . 6 ARG HH21 1 1 13 10171 1 1 6 ARG HH22 H 17.324 -5.365 9.954 1.00 . A B . 6 ARG HH22 1 1 13 10172 1 1 6 ARG N N 11.448 -6.430 3.937 1.00 . A B . 6 ARG N 1 1 13 10173 1 1 6 ARG NE N 15.422 -5.859 7.414 1.00 . A B . 6 ARG NE 1 1 13 10174 1 1 6 ARG NH1 N 17.571 -5.029 7.480 1.00 . A B . 6 ARG NH1 1 1 13 10175 1 1 6 ARG NH2 N 16.511 -5.630 9.426 1.00 . A B . 6 ARG NH2 1 1 13 10176 1 1 6 ARG O O 13.358 -5.628 1.323 1.00 . A B . 6 ARG O 1 1 13 10177 1 1 7 ASN C C 10.717 -3.178 -0.212 1.00 . A B . 7 ASN C 1 1 13 10178 1 1 7 ASN CA C 11.176 -4.614 -0.027 1.00 . A B . 7 ASN CA 1 1 13 10179 1 1 7 ASN CB C 10.226 -5.589 -0.731 1.00 . A B . 7 ASN CB 1 1 13 10180 1 1 7 ASN CG C 10.423 -5.611 -2.242 1.00 . A B . 7 ASN CG 1 1 13 10181 1 1 7 ASN H H 10.449 -4.754 1.954 1.00 . A B . 7 ASN H 1 1 13 10182 1 1 7 ASN HA H 12.167 -4.722 -0.438 1.00 . A B . 7 ASN HA 1 1 13 10183 1 1 7 ASN HB2 H 10.400 -6.584 -0.350 1.00 . A B . 7 ASN HB2 1 1 13 10184 1 1 7 ASN HB3 H 9.207 -5.302 -0.521 1.00 . A B . 7 ASN HB3 1 1 13 10185 1 1 7 ASN HD21 H 9.137 -4.114 -2.491 1.00 . A B . 7 ASN HD21 1 1 13 10186 1 1 7 ASN HD22 H 9.853 -4.737 -3.935 1.00 . A B . 7 ASN HD22 1 1 13 10187 1 1 7 ASN N N 11.247 -4.886 1.399 1.00 . A B . 7 ASN N 1 1 13 10188 1 1 7 ASN ND2 N 9.734 -4.734 -2.961 1.00 . A B . 7 ASN ND2 1 1 13 10189 1 1 7 ASN O O 9.705 -2.900 -0.858 1.00 . A B . 7 ASN O 1 1 13 10190 1 1 7 ASN OD1 O 11.205 -6.409 -2.761 1.00 . A B . 7 ASN OD1 1 1 13 10191 1 1 8 LEU C C 12.182 -0.032 -0.274 1.00 . A B . 8 LEU C 1 1 13 10192 1 1 8 LEU CA C 11.099 -0.860 0.406 1.00 . A B . 8 LEU CA 1 1 13 10193 1 1 8 LEU CB C 10.923 -0.374 1.844 1.00 . A B . 8 LEU CB 1 1 13 10194 1 1 8 LEU CD1 C 10.148 -0.787 4.186 1.00 . A B . 8 LEU CD1 1 1 13 10195 1 1 8 LEU CD2 C 8.673 -1.406 2.272 1.00 . A B . 8 LEU CD2 1 1 13 10196 1 1 8 LEU CG C 10.110 -1.294 2.754 1.00 . A B . 8 LEU CG 1 1 13 10197 1 1 8 LEU H H 12.253 -2.559 0.898 1.00 . A B . 8 LEU H 1 1 13 10198 1 1 8 LEU HA H 10.172 -0.744 -0.129 1.00 . A B . 8 LEU HA 1 1 13 10199 1 1 8 LEU HB2 H 11.905 -0.252 2.275 1.00 . A B . 8 LEU HB2 1 1 13 10200 1 1 8 LEU HB3 H 10.439 0.590 1.821 1.00 . A B . 8 LEU HB3 1 1 13 10201 1 1 8 LEU HD11 H 9.744 0.213 4.224 1.00 . A B . 8 LEU HD11 1 1 13 10202 1 1 8 LEU HD12 H 11.168 -0.777 4.539 1.00 . A B . 8 LEU HD12 1 1 13 10203 1 1 8 LEU HD13 H 9.559 -1.438 4.812 1.00 . A B . 8 LEU HD13 1 1 13 10204 1 1 8 LEU HD21 H 8.118 -2.047 2.941 1.00 . A B . 8 LEU HD21 1 1 13 10205 1 1 8 LEU HD22 H 8.659 -1.827 1.278 1.00 . A B . 8 LEU HD22 1 1 13 10206 1 1 8 LEU HD23 H 8.221 -0.426 2.256 1.00 . A B . 8 LEU HD23 1 1 13 10207 1 1 8 LEU HG H 10.549 -2.282 2.736 1.00 . A B . 8 LEU HG 1 1 13 10208 1 1 8 LEU N N 11.452 -2.269 0.408 1.00 . A B . 8 LEU N 1 1 13 10209 1 1 8 LEU O O 12.201 1.197 -0.168 1.00 . A B . 8 LEU O 1 1 13 10210 1 1 9 ASP C C 13.872 0.447 -2.991 1.00 . A B . 9 ASP C 1 1 13 10211 1 1 9 ASP CA C 14.219 -0.041 -1.594 1.00 . A B . 9 ASP CA 1 1 13 10212 1 1 9 ASP CB C 15.429 -0.977 -1.653 1.00 . A B . 9 ASP CB 1 1 13 10213 1 1 9 ASP CG C 15.925 -1.376 -0.278 1.00 . A B . 9 ASP CG 1 1 13 10214 1 1 9 ASP H H 12.954 -1.673 -1.095 1.00 . A B . 9 ASP H 1 1 13 10215 1 1 9 ASP HA H 14.469 0.812 -0.986 1.00 . A B . 9 ASP HA 1 1 13 10216 1 1 9 ASP HB2 H 15.153 -1.873 -2.187 1.00 . A B . 9 ASP HB2 1 1 13 10217 1 1 9 ASP HB3 H 16.233 -0.483 -2.177 1.00 . A B . 9 ASP HB3 1 1 13 10218 1 1 9 ASP N N 13.074 -0.706 -0.977 1.00 . A B . 9 ASP N 1 1 13 10219 1 1 9 ASP O O 14.539 1.323 -3.541 1.00 . A B . 9 ASP O 1 1 13 10220 1 1 9 ASP OD1 O 16.706 -0.610 0.324 1.00 . A B . 9 ASP OD1 1 1 13 10221 1 1 9 ASP OD2 O 15.541 -2.459 0.212 1.00 . A B . 9 ASP OD2 1 1 13 10222 1 1 10 GLU C C 11.120 1.148 -4.756 1.00 . A B . 10 GLU C 1 1 13 10223 1 1 10 GLU CA C 12.352 0.262 -4.882 1.00 . A B . 10 GLU CA 1 1 13 10224 1 1 10 GLU CB C 12.009 -0.977 -5.708 1.00 . A B . 10 GLU CB 1 1 13 10225 1 1 10 GLU CD C 12.698 -3.311 -6.343 1.00 . A B . 10 GLU CD 1 1 13 10226 1 1 10 GLU CG C 13.154 -1.964 -5.830 1.00 . A B . 10 GLU CG 1 1 13 10227 1 1 10 GLU H H 12.367 -0.855 -3.085 1.00 . A B . 10 GLU H 1 1 13 10228 1 1 10 GLU HA H 13.137 0.815 -5.371 1.00 . A B . 10 GLU HA 1 1 13 10229 1 1 10 GLU HB2 H 11.174 -1.482 -5.249 1.00 . A B . 10 GLU HB2 1 1 13 10230 1 1 10 GLU HB3 H 11.727 -0.663 -6.702 1.00 . A B . 10 GLU HB3 1 1 13 10231 1 1 10 GLU HG2 H 13.886 -1.564 -6.515 1.00 . A B . 10 GLU HG2 1 1 13 10232 1 1 10 GLU HG3 H 13.605 -2.098 -4.859 1.00 . A B . 10 GLU HG3 1 1 13 10233 1 1 10 GLU N N 12.828 -0.131 -3.561 1.00 . A B . 10 GLU N 1 1 13 10234 1 1 10 GLU O O 10.631 1.707 -5.736 1.00 . A B . 10 GLU O 1 1 13 10235 1 1 10 GLU OE1 O 12.155 -4.098 -5.541 1.00 . A B . 10 GLU OE1 1 1 13 10236 1 1 10 GLU OE2 O 12.876 -3.591 -7.548 1.00 . A B . 10 GLU OE2 1 1 13 10237 1 1 11 CYS C C 9.820 3.423 -2.769 1.00 . A B . 11 CYS C 1 1 13 10238 1 1 11 CYS CA C 9.429 2.048 -3.285 1.00 . A B . 11 CYS CA 1 1 13 10239 1 1 11 CYS CB C 8.545 1.319 -2.275 1.00 . A B . 11 CYS CB 1 1 13 10240 1 1 11 CYS H H 11.105 0.871 -2.788 1.00 . A B . 11 CYS H 1 1 13 10241 1 1 11 CYS HA H 8.895 2.156 -4.218 1.00 . A B . 11 CYS HA 1 1 13 10242 1 1 11 CYS HB2 H 8.448 0.291 -2.575 1.00 . A B . 11 CYS HB2 1 1 13 10243 1 1 11 CYS HB3 H 9.023 1.359 -1.308 1.00 . A B . 11 CYS HB3 1 1 13 10244 1 1 11 CYS N N 10.628 1.276 -3.536 1.00 . A B . 11 CYS N 1 1 13 10245 1 1 11 CYS O O 10.004 3.623 -1.565 1.00 . A B . 11 CYS O 1 1 13 10246 1 1 11 CYS SG S 6.876 1.996 -2.091 1.00 . A B . 11 CYS SG 1 1 13 10247 1 1 12 GLU C C 9.428 6.396 -2.428 1.00 . A B . 12 GLU C 1 1 13 10248 1 1 12 GLU CA C 10.397 5.706 -3.373 1.00 . A B . 12 GLU CA 1 1 13 10249 1 1 12 GLU CB C 10.542 6.513 -4.660 1.00 . A B . 12 GLU CB 1 1 13 10250 1 1 12 GLU CD C 12.832 7.397 -4.111 1.00 . A B . 12 GLU CD 1 1 13 10251 1 1 12 GLU CG C 11.416 7.746 -4.516 1.00 . A B . 12 GLU CG 1 1 13 10252 1 1 12 GLU H H 9.738 4.145 -4.626 1.00 . A B . 12 GLU H 1 1 13 10253 1 1 12 GLU HA H 11.358 5.629 -2.894 1.00 . A B . 12 GLU HA 1 1 13 10254 1 1 12 GLU HB2 H 10.974 5.879 -5.419 1.00 . A B . 12 GLU HB2 1 1 13 10255 1 1 12 GLU HB3 H 9.561 6.829 -4.982 1.00 . A B . 12 GLU HB3 1 1 13 10256 1 1 12 GLU HG2 H 11.443 8.268 -5.460 1.00 . A B . 12 GLU HG2 1 1 13 10257 1 1 12 GLU HG3 H 10.988 8.389 -3.761 1.00 . A B . 12 GLU HG3 1 1 13 10258 1 1 12 GLU N N 9.940 4.365 -3.691 1.00 . A B . 12 GLU N 1 1 13 10259 1 1 12 GLU O O 9.827 7.207 -1.591 1.00 . A B . 12 GLU O 1 1 13 10260 1 1 12 GLU OE1 O 13.424 6.489 -4.735 1.00 . A B . 12 GLU OE1 1 1 13 10261 1 1 12 GLU OE2 O 13.365 8.031 -3.176 1.00 . A B . 12 GLU OE2 1 1 13 10262 1 1 13 VAL C C 7.222 6.162 -0.282 1.00 . A B . 13 VAL C 1 1 13 10263 1 1 13 VAL CA C 7.129 6.660 -1.730 1.00 . A B . 13 VAL CA 1 1 13 10264 1 1 13 VAL CB C 5.720 6.423 -2.320 1.00 . A B . 13 VAL CB 1 1 13 10265 1 1 13 VAL CG1 C 5.415 4.947 -2.449 1.00 . A B . 13 VAL CG1 1 1 13 10266 1 1 13 VAL CG2 C 4.655 7.114 -1.488 1.00 . A B . 13 VAL CG2 1 1 13 10267 1 1 13 VAL H H 7.902 5.382 -3.220 1.00 . A B . 13 VAL H 1 1 13 10268 1 1 13 VAL HA H 7.312 7.724 -1.730 1.00 . A B . 13 VAL HA 1 1 13 10269 1 1 13 VAL HB H 5.700 6.849 -3.311 1.00 . A B . 13 VAL HB 1 1 13 10270 1 1 13 VAL HG11 H 4.460 4.821 -2.933 1.00 . A B . 13 VAL HG11 1 1 13 10271 1 1 13 VAL HG12 H 5.381 4.501 -1.466 1.00 . A B . 13 VAL HG12 1 1 13 10272 1 1 13 VAL HG13 H 6.183 4.469 -3.037 1.00 . A B . 13 VAL HG13 1 1 13 10273 1 1 13 VAL HG21 H 3.692 6.983 -1.955 1.00 . A B . 13 VAL HG21 1 1 13 10274 1 1 13 VAL HG22 H 4.883 8.167 -1.413 1.00 . A B . 13 VAL HG22 1 1 13 10275 1 1 13 VAL HG23 H 4.639 6.676 -0.503 1.00 . A B . 13 VAL HG23 1 1 13 10276 1 1 13 VAL N N 8.156 6.056 -2.553 1.00 . A B . 13 VAL N 1 1 13 10277 1 1 13 VAL O O 6.963 6.916 0.652 1.00 . A B . 13 VAL O 1 1 13 10278 1 1 14 CYS C C 9.038 5.115 1.888 1.00 . A B . 14 CYS C 1 1 13 10279 1 1 14 CYS CA C 7.868 4.381 1.251 1.00 . A B . 14 CYS CA 1 1 13 10280 1 1 14 CYS CB C 8.169 2.885 1.214 1.00 . A B . 14 CYS CB 1 1 13 10281 1 1 14 CYS H H 7.751 4.318 -0.871 1.00 . A B . 14 CYS H 1 1 13 10282 1 1 14 CYS HA H 6.983 4.550 1.844 1.00 . A B . 14 CYS HA 1 1 13 10283 1 1 14 CYS HB2 H 8.496 2.622 0.220 1.00 . A B . 14 CYS HB2 1 1 13 10284 1 1 14 CYS HB3 H 8.962 2.671 1.915 1.00 . A B . 14 CYS HB3 1 1 13 10285 1 1 14 CYS N N 7.621 4.903 -0.094 1.00 . A B . 14 CYS N 1 1 13 10286 1 1 14 CYS O O 9.027 5.434 3.075 1.00 . A B . 14 CYS O 1 1 13 10287 1 1 14 CYS SG S 6.765 1.825 1.625 1.00 . A B . 14 CYS SG 1 1 13 10288 1 1 15 ARG C C 10.853 7.541 1.881 1.00 . A B . 15 ARG C 1 1 13 10289 1 1 15 ARG CA C 11.223 6.109 1.501 1.00 . A B . 15 ARG CA 1 1 13 10290 1 1 15 ARG CB C 12.248 6.100 0.369 1.00 . A B . 15 ARG CB 1 1 13 10291 1 1 15 ARG CD C 14.494 6.731 -0.497 1.00 . A B . 15 ARG CD 1 1 13 10292 1 1 15 ARG CG C 13.603 6.679 0.729 1.00 . A B . 15 ARG CG 1 1 13 10293 1 1 15 ARG CZ C 16.687 7.688 -1.069 1.00 . A B . 15 ARG CZ 1 1 13 10294 1 1 15 ARG H H 9.966 5.099 0.132 1.00 . A B . 15 ARG H 1 1 13 10295 1 1 15 ARG HA H 11.629 5.606 2.361 1.00 . A B . 15 ARG HA 1 1 13 10296 1 1 15 ARG HB2 H 12.395 5.080 0.051 1.00 . A B . 15 ARG HB2 1 1 13 10297 1 1 15 ARG HB3 H 11.848 6.667 -0.460 1.00 . A B . 15 ARG HB3 1 1 13 10298 1 1 15 ARG HD2 H 14.514 5.752 -0.952 1.00 . A B . 15 ARG HD2 1 1 13 10299 1 1 15 ARG HD3 H 14.075 7.439 -1.196 1.00 . A B . 15 ARG HD3 1 1 13 10300 1 1 15 ARG HE H 16.189 6.947 0.724 1.00 . A B . 15 ARG HE 1 1 13 10301 1 1 15 ARG HG2 H 13.469 7.679 1.112 1.00 . A B . 15 ARG HG2 1 1 13 10302 1 1 15 ARG HG3 H 14.068 6.056 1.479 1.00 . A B . 15 ARG HG3 1 1 13 10303 1 1 15 ARG HH11 H 15.297 7.804 -2.550 1.00 . A B . 15 ARG HH11 1 1 13 10304 1 1 15 ARG HH12 H 16.876 8.400 -2.958 1.00 . A B . 15 ARG HH12 1 1 13 10305 1 1 15 ARG HH21 H 18.273 7.745 0.196 1.00 . A B . 15 ARG HH21 1 1 13 10306 1 1 15 ARG HH22 H 18.569 8.370 -1.396 1.00 . A B . 15 ARG HH22 1 1 13 10307 1 1 15 ARG N N 10.037 5.390 1.067 1.00 . A B . 15 ARG N 1 1 13 10308 1 1 15 ARG NE N 15.862 7.130 -0.186 1.00 . A B . 15 ARG NE 1 1 13 10309 1 1 15 ARG NH1 N 16.253 7.991 -2.289 1.00 . A B . 15 ARG NH1 1 1 13 10310 1 1 15 ARG NH2 N 17.942 7.958 -0.729 1.00 . A B . 15 ARG NH2 1 1 13 10311 1 1 15 ARG O O 11.397 8.118 2.823 1.00 . A B . 15 ARG O 1 1 13 10312 1 1 16 ASP C C 8.548 9.481 2.660 1.00 . A B . 16 ASP C 1 1 13 10313 1 1 16 ASP CA C 9.397 9.438 1.386 1.00 . A B . 16 ASP CA 1 1 13 10314 1 1 16 ASP CB C 8.566 9.891 0.178 1.00 . A B . 16 ASP CB 1 1 13 10315 1 1 16 ASP CG C 8.125 11.339 0.257 1.00 . A B . 16 ASP CG 1 1 13 10316 1 1 16 ASP H H 9.596 7.609 0.344 1.00 . A B . 16 ASP H 1 1 13 10317 1 1 16 ASP HA H 10.240 10.101 1.503 1.00 . A B . 16 ASP HA 1 1 13 10318 1 1 16 ASP HB2 H 9.155 9.769 -0.717 1.00 . A B . 16 ASP HB2 1 1 13 10319 1 1 16 ASP HB3 H 7.686 9.270 0.106 1.00 . A B . 16 ASP HB3 1 1 13 10320 1 1 16 ASP N N 9.911 8.096 1.133 1.00 . A B . 16 ASP N 1 1 13 10321 1 1 16 ASP O O 8.288 10.550 3.208 1.00 . A B . 16 ASP O 1 1 13 10322 1 1 16 ASP OD1 O 8.906 12.231 -0.131 1.00 . A B . 16 ASP OD1 1 1 13 10323 1 1 16 ASP OD2 O 7.000 11.594 0.741 1.00 . A B . 16 ASP OD2 1 1 13 10324 1 1 17 GLY C C 5.841 8.170 4.010 1.00 . A B . 17 GLY C 1 1 13 10325 1 1 17 GLY CA C 7.320 8.244 4.337 1.00 . A B . 17 GLY CA 1 1 13 10326 1 1 17 GLY H H 8.423 7.486 2.693 1.00 . A B . 17 GLY H 1 1 13 10327 1 1 17 GLY HA2 H 7.597 7.369 4.905 1.00 . A B . 17 GLY HA2 1 1 13 10328 1 1 17 GLY HA3 H 7.502 9.124 4.938 1.00 . A B . 17 GLY HA3 1 1 13 10329 1 1 17 GLY N N 8.146 8.312 3.143 1.00 . A B . 17 GLY N 1 1 13 10330 1 1 17 GLY O O 4.995 8.526 4.831 1.00 . A B . 17 GLY O 1 1 13 10331 1 1 18 GLY C C 3.339 6.623 3.177 1.00 . A B . 18 GLY C 1 1 13 10332 1 1 18 GLY CA C 4.162 7.595 2.350 1.00 . A B . 18 GLY CA 1 1 13 10333 1 1 18 GLY H H 6.273 7.500 2.186 1.00 . A B . 18 GLY H 1 1 13 10334 1 1 18 GLY HA2 H 3.691 8.565 2.394 1.00 . A B . 18 GLY HA2 1 1 13 10335 1 1 18 GLY HA3 H 4.164 7.260 1.326 1.00 . A B . 18 GLY HA3 1 1 13 10336 1 1 18 GLY N N 5.538 7.721 2.798 1.00 . A B . 18 GLY N 1 1 13 10337 1 1 18 GLY O O 3.871 5.873 4.000 1.00 . A B . 18 GLY O 1 1 13 10338 1 1 19 GLU C C 0.604 4.635 2.827 1.00 . A B . 19 GLU C 1 1 13 10339 1 1 19 GLU CA C 1.114 5.789 3.688 1.00 . A B . 19 GLU CA 1 1 13 10340 1 1 19 GLU CB C -0.055 6.635 4.211 1.00 . A B . 19 GLU CB 1 1 13 10341 1 1 19 GLU CD C -0.810 8.410 5.864 1.00 . A B . 19 GLU CD 1 1 13 10342 1 1 19 GLU CG C 0.358 7.631 5.292 1.00 . A B . 19 GLU CG 1 1 13 10343 1 1 19 GLU H H 1.683 7.204 2.231 1.00 . A B . 19 GLU H 1 1 13 10344 1 1 19 GLU HA H 1.652 5.377 4.527 1.00 . A B . 19 GLU HA 1 1 13 10345 1 1 19 GLU HB2 H -0.476 7.188 3.385 1.00 . A B . 19 GLU HB2 1 1 13 10346 1 1 19 GLU HB3 H -0.813 5.979 4.618 1.00 . A B . 19 GLU HB3 1 1 13 10347 1 1 19 GLU HG2 H 0.836 7.095 6.097 1.00 . A B . 19 GLU HG2 1 1 13 10348 1 1 19 GLU HG3 H 1.060 8.331 4.864 1.00 . A B . 19 GLU HG3 1 1 13 10349 1 1 19 GLU N N 2.036 6.628 2.940 1.00 . A B . 19 GLU N 1 1 13 10350 1 1 19 GLU O O 0.656 4.693 1.598 1.00 . A B . 19 GLU O 1 1 13 10351 1 1 19 GLU OE1 O -1.666 7.794 6.527 1.00 . A B . 19 GLU OE1 1 1 13 10352 1 1 19 GLU OE2 O -0.888 9.635 5.631 1.00 . A B . 19 GLU OE2 1 1 13 10353 1 1 20 LEU C C -1.896 2.323 2.969 1.00 . A B . 20 LEU C 1 1 13 10354 1 1 20 LEU CA C -0.385 2.402 2.816 1.00 . A B . 20 LEU CA 1 1 13 10355 1 1 20 LEU CB C 0.245 1.139 3.401 1.00 . A B . 20 LEU CB 1 1 13 10356 1 1 20 LEU CD1 C 2.292 -0.247 3.767 1.00 . A B . 20 LEU CD1 1 1 13 10357 1 1 20 LEU CD2 C 1.527 0.236 1.453 1.00 . A B . 20 LEU CD2 1 1 13 10358 1 1 20 LEU CG C 1.631 0.781 2.868 1.00 . A B . 20 LEU CG 1 1 13 10359 1 1 20 LEU H H 0.134 3.611 4.471 1.00 . A B . 20 LEU H 1 1 13 10360 1 1 20 LEU HA H -0.135 2.473 1.768 1.00 . A B . 20 LEU HA 1 1 13 10361 1 1 20 LEU HB2 H 0.318 1.266 4.469 1.00 . A B . 20 LEU HB2 1 1 13 10362 1 1 20 LEU HB3 H -0.418 0.311 3.202 1.00 . A B . 20 LEU HB3 1 1 13 10363 1 1 20 LEU HD11 H 3.261 -0.507 3.365 1.00 . A B . 20 LEU HD11 1 1 13 10364 1 1 20 LEU HD12 H 1.673 -1.131 3.813 1.00 . A B . 20 LEU HD12 1 1 13 10365 1 1 20 LEU HD13 H 2.410 0.162 4.758 1.00 . A B . 20 LEU HD13 1 1 13 10366 1 1 20 LEU HD21 H 1.122 0.994 0.800 1.00 . A B . 20 LEU HD21 1 1 13 10367 1 1 20 LEU HD22 H 0.881 -0.627 1.448 1.00 . A B . 20 LEU HD22 1 1 13 10368 1 1 20 LEU HD23 H 2.509 -0.051 1.105 1.00 . A B . 20 LEU HD23 1 1 13 10369 1 1 20 LEU HG H 2.250 1.668 2.848 1.00 . A B . 20 LEU HG 1 1 13 10370 1 1 20 LEU N N 0.137 3.585 3.491 1.00 . A B . 20 LEU N 1 1 13 10371 1 1 20 LEU O O -2.418 2.415 4.082 1.00 . A B . 20 LEU O 1 1 13 10372 1 1 21 PHE C C -4.576 0.676 1.712 1.00 . A B . 21 PHE C 1 1 13 10373 1 1 21 PHE CA C -4.053 2.098 1.891 1.00 . A B . 21 PHE CA 1 1 13 10374 1 1 21 PHE CB C -4.616 3.027 0.809 1.00 . A B . 21 PHE CB 1 1 13 10375 1 1 21 PHE CD1 C -4.515 5.228 2.011 1.00 . A B . 21 PHE CD1 1 1 13 10376 1 1 21 PHE CD2 C -3.209 4.966 0.030 1.00 . A B . 21 PHE CD2 1 1 13 10377 1 1 21 PHE CE1 C -4.037 6.511 2.158 1.00 . A B . 21 PHE CE1 1 1 13 10378 1 1 21 PHE CE2 C -2.732 6.254 0.175 1.00 . A B . 21 PHE CE2 1 1 13 10379 1 1 21 PHE CG C -4.109 4.436 0.947 1.00 . A B . 21 PHE CG 1 1 13 10380 1 1 21 PHE CZ C -3.147 7.026 1.241 1.00 . A B . 21 PHE CZ 1 1 13 10381 1 1 21 PHE H H -2.134 1.997 1.005 1.00 . A B . 21 PHE H 1 1 13 10382 1 1 21 PHE HA H -4.366 2.459 2.862 1.00 . A B . 21 PHE HA 1 1 13 10383 1 1 21 PHE HB2 H -4.330 2.655 -0.166 1.00 . A B . 21 PHE HB2 1 1 13 10384 1 1 21 PHE HB3 H -5.697 3.048 0.879 1.00 . A B . 21 PHE HB3 1 1 13 10385 1 1 21 PHE HD1 H -5.215 4.833 2.732 1.00 . A B . 21 PHE HD1 1 1 13 10386 1 1 21 PHE HD2 H -2.883 4.365 -0.806 1.00 . A B . 21 PHE HD2 1 1 13 10387 1 1 21 PHE HE1 H -4.359 7.113 2.992 1.00 . A B . 21 PHE HE1 1 1 13 10388 1 1 21 PHE HE2 H -2.034 6.656 -0.544 1.00 . A B . 21 PHE HE2 1 1 13 10389 1 1 21 PHE HZ H -2.772 8.031 1.359 1.00 . A B . 21 PHE HZ 1 1 13 10390 1 1 21 PHE N N -2.598 2.126 1.864 1.00 . A B . 21 PHE N 1 1 13 10391 1 1 21 PHE O O -5.528 0.433 0.966 1.00 . A B . 21 PHE O 1 1 13 10392 1 1 22 CYS C C -3.926 -2.384 3.625 1.00 . A B . 22 CYS C 1 1 13 10393 1 1 22 CYS CA C -4.398 -1.642 2.378 1.00 . A B . 22 CYS CA 1 1 13 10394 1 1 22 CYS CB C -3.922 -2.355 1.109 1.00 . A B . 22 CYS CB 1 1 13 10395 1 1 22 CYS H H -3.115 -0.039 2.871 1.00 . A B . 22 CYS H 1 1 13 10396 1 1 22 CYS HA H -5.474 -1.620 2.384 1.00 . A B . 22 CYS HA 1 1 13 10397 1 1 22 CYS HB2 H -4.389 -3.327 1.050 1.00 . A B . 22 CYS HB2 1 1 13 10398 1 1 22 CYS HB3 H -4.208 -1.767 0.246 1.00 . A B . 22 CYS HB3 1 1 13 10399 1 1 22 CYS N N -3.934 -0.269 2.384 1.00 . A B . 22 CYS N 1 1 13 10400 1 1 22 CYS O O -3.198 -1.823 4.449 1.00 . A B . 22 CYS O 1 1 13 10401 1 1 22 CYS SG S -2.126 -2.603 1.033 1.00 . A B . 22 CYS SG 1 1 13 10402 1 1 23 CYS C C -2.517 -4.864 4.832 1.00 . A B . 23 CYS C 1 1 13 10403 1 1 23 CYS CA C -3.985 -4.458 4.914 1.00 . A B . 23 CYS CA 1 1 13 10404 1 1 23 CYS CB C -4.851 -5.721 4.974 1.00 . A B . 23 CYS CB 1 1 13 10405 1 1 23 CYS H H -4.905 -4.028 3.060 1.00 . A B . 23 CYS H 1 1 13 10406 1 1 23 CYS HA H -4.144 -3.870 5.807 1.00 . A B . 23 CYS HA 1 1 13 10407 1 1 23 CYS HB2 H -4.474 -6.438 4.257 1.00 . A B . 23 CYS HB2 1 1 13 10408 1 1 23 CYS HB3 H -4.789 -6.145 5.966 1.00 . A B . 23 CYS HB3 1 1 13 10409 1 1 23 CYS N N -4.348 -3.641 3.759 1.00 . A B . 23 CYS N 1 1 13 10410 1 1 23 CYS O O -1.914 -4.770 3.764 1.00 . A B . 23 CYS O 1 1 13 10411 1 1 23 CYS SG S -6.595 -5.450 4.601 1.00 . A B . 23 CYS SG 1 1 13 10412 1 1 24 ASP C C -0.295 -6.822 4.898 1.00 . A B . 24 ASP C 1 1 13 10413 1 1 24 ASP CA C -0.556 -5.765 5.968 1.00 . A B . 24 ASP CA 1 1 13 10414 1 1 24 ASP CB C -0.197 -6.330 7.346 1.00 . A B . 24 ASP CB 1 1 13 10415 1 1 24 ASP CG C -0.185 -5.270 8.428 1.00 . A B . 24 ASP CG 1 1 13 10416 1 1 24 ASP H H -2.473 -5.344 6.773 1.00 . A B . 24 ASP H 1 1 13 10417 1 1 24 ASP HA H 0.069 -4.908 5.769 1.00 . A B . 24 ASP HA 1 1 13 10418 1 1 24 ASP HB2 H -0.917 -7.085 7.620 1.00 . A B . 24 ASP HB2 1 1 13 10419 1 1 24 ASP HB3 H 0.783 -6.779 7.298 1.00 . A B . 24 ASP HB3 1 1 13 10420 1 1 24 ASP N N -1.951 -5.320 5.942 1.00 . A B . 24 ASP N 1 1 13 10421 1 1 24 ASP O O 0.634 -6.698 4.099 1.00 . A B . 24 ASP O 1 1 13 10422 1 1 24 ASP OD1 O -1.273 -4.891 8.906 1.00 . A B . 24 ASP OD1 1 1 13 10423 1 1 24 ASP OD2 O 0.915 -4.806 8.800 1.00 . A B . 24 ASP OD2 1 1 13 10424 1 1 25 THR C C -1.208 -8.460 2.491 1.00 . A B . 25 THR C 1 1 13 10425 1 1 25 THR CA C -0.997 -8.941 3.927 1.00 . A B . 25 THR CA 1 1 13 10426 1 1 25 THR CB C -1.991 -10.068 4.254 1.00 . A B . 25 THR CB 1 1 13 10427 1 1 25 THR CG2 C -1.777 -11.272 3.351 1.00 . A B . 25 THR CG2 1 1 13 10428 1 1 25 THR H H -1.863 -7.883 5.538 1.00 . A B . 25 THR H 1 1 13 10429 1 1 25 THR HA H 0.004 -9.338 4.016 1.00 . A B . 25 THR HA 1 1 13 10430 1 1 25 THR HB H -2.993 -9.696 4.107 1.00 . A B . 25 THR HB 1 1 13 10431 1 1 25 THR HG1 H -0.892 -10.524 5.831 1.00 . A B . 25 THR HG1 1 1 13 10432 1 1 25 THR HG21 H -0.767 -11.635 3.468 1.00 . A B . 25 THR HG21 1 1 13 10433 1 1 25 THR HG22 H -1.939 -10.983 2.323 1.00 . A B . 25 THR HG22 1 1 13 10434 1 1 25 THR HG23 H -2.474 -12.052 3.620 1.00 . A B . 25 THR HG23 1 1 13 10435 1 1 25 THR N N -1.134 -7.851 4.880 1.00 . A B . 25 THR N 1 1 13 10436 1 1 25 THR O O -0.452 -8.821 1.590 1.00 . A B . 25 THR O 1 1 13 10437 1 1 25 THR OG1 O -1.832 -10.459 5.626 1.00 . A B . 25 THR OG1 1 1 13 10438 1 1 26 CYS C C -1.348 -6.206 0.484 1.00 . A B . 26 CYS C 1 1 13 10439 1 1 26 CYS CA C -2.509 -7.084 0.960 1.00 . A B . 26 CYS CA 1 1 13 10440 1 1 26 CYS CB C -3.823 -6.293 0.990 1.00 . A B . 26 CYS CB 1 1 13 10441 1 1 26 CYS H H -2.802 -7.383 3.036 1.00 . A B . 26 CYS H 1 1 13 10442 1 1 26 CYS HA H -2.612 -7.917 0.280 1.00 . A B . 26 CYS HA 1 1 13 10443 1 1 26 CYS HB2 H -3.706 -5.436 1.632 1.00 . A B . 26 CYS HB2 1 1 13 10444 1 1 26 CYS HB3 H -4.062 -5.964 -0.013 1.00 . A B . 26 CYS HB3 1 1 13 10445 1 1 26 CYS N N -2.225 -7.629 2.284 1.00 . A B . 26 CYS N 1 1 13 10446 1 1 26 CYS O O -1.016 -6.188 -0.699 1.00 . A B . 26 CYS O 1 1 13 10447 1 1 26 CYS SG S -5.228 -7.260 1.603 1.00 . A B . 26 CYS SG 1 1 13 10448 1 1 27 SER C C 1.637 -5.505 0.734 1.00 . A B . 27 SER C 1 1 13 10449 1 1 27 SER CA C 0.431 -4.663 1.141 1.00 . A B . 27 SER CA 1 1 13 10450 1 1 27 SER CB C 0.776 -3.815 2.366 1.00 . A B . 27 SER CB 1 1 13 10451 1 1 27 SER H H -1.086 -5.531 2.341 1.00 . A B . 27 SER H 1 1 13 10452 1 1 27 SER HA H 0.171 -4.007 0.323 1.00 . A B . 27 SER HA 1 1 13 10453 1 1 27 SER HB2 H -0.075 -3.203 2.626 1.00 . A B . 27 SER HB2 1 1 13 10454 1 1 27 SER HB3 H 1.015 -4.466 3.193 1.00 . A B . 27 SER HB3 1 1 13 10455 1 1 27 SER HG H 1.634 -2.058 2.281 1.00 . A B . 27 SER HG 1 1 13 10456 1 1 27 SER N N -0.727 -5.504 1.426 1.00 . A B . 27 SER N 1 1 13 10457 1 1 27 SER O O 2.548 -5.023 0.063 1.00 . A B . 27 SER O 1 1 13 10458 1 1 27 SER OG O 1.885 -2.968 2.114 1.00 . A B . 27 SER OG 1 1 13 10459 1 1 28 ARG C C 2.551 -8.104 -0.676 1.00 . A B . 28 ARG C 1 1 13 10460 1 1 28 ARG CA C 2.732 -7.651 0.768 1.00 . A B . 28 ARG CA 1 1 13 10461 1 1 28 ARG CB C 2.792 -8.858 1.708 1.00 . A B . 28 ARG CB 1 1 13 10462 1 1 28 ARG CD C 3.914 -11.030 2.300 1.00 . A B . 28 ARG CD 1 1 13 10463 1 1 28 ARG CG C 3.922 -9.819 1.384 1.00 . A B . 28 ARG CG 1 1 13 10464 1 1 28 ARG CZ C 5.048 -13.222 2.392 1.00 . A B . 28 ARG CZ 1 1 13 10465 1 1 28 ARG H H 0.927 -7.094 1.713 1.00 . A B . 28 ARG H 1 1 13 10466 1 1 28 ARG HA H 3.654 -7.099 0.844 1.00 . A B . 28 ARG HA 1 1 13 10467 1 1 28 ARG HB2 H 2.926 -8.506 2.720 1.00 . A B . 28 ARG HB2 1 1 13 10468 1 1 28 ARG HB3 H 1.860 -9.398 1.644 1.00 . A B . 28 ARG HB3 1 1 13 10469 1 1 28 ARG HD2 H 4.057 -10.698 3.317 1.00 . A B . 28 ARG HD2 1 1 13 10470 1 1 28 ARG HD3 H 2.960 -11.527 2.213 1.00 . A B . 28 ARG HD3 1 1 13 10471 1 1 28 ARG HE H 5.673 -11.648 1.332 1.00 . A B . 28 ARG HE 1 1 13 10472 1 1 28 ARG HG2 H 3.813 -10.153 0.365 1.00 . A B . 28 ARG HG2 1 1 13 10473 1 1 28 ARG HG3 H 4.864 -9.302 1.496 1.00 . A B . 28 ARG HG3 1 1 13 10474 1 1 28 ARG HH11 H 3.396 -13.093 3.561 1.00 . A B . 28 ARG HH11 1 1 13 10475 1 1 28 ARG HH12 H 4.201 -14.628 3.578 1.00 . A B . 28 ARG HH12 1 1 13 10476 1 1 28 ARG HH21 H 6.734 -13.654 1.352 1.00 . A B . 28 ARG HH21 1 1 13 10477 1 1 28 ARG HH22 H 6.099 -14.952 2.313 1.00 . A B . 28 ARG HH22 1 1 13 10478 1 1 28 ARG N N 1.653 -6.761 1.145 1.00 . A B . 28 ARG N 1 1 13 10479 1 1 28 ARG NE N 4.975 -11.969 1.948 1.00 . A B . 28 ARG NE 1 1 13 10480 1 1 28 ARG NH1 N 4.143 -13.685 3.244 1.00 . A B . 28 ARG NH1 1 1 13 10481 1 1 28 ARG NH2 N 6.039 -14.006 1.989 1.00 . A B . 28 ARG NH2 1 1 13 10482 1 1 28 ARG O O 3.522 -8.294 -1.409 1.00 . A B . 28 ARG O 1 1 13 10483 1 1 29 VAL C C 0.949 -7.559 -3.424 1.00 . A B . 29 VAL C 1 1 13 10484 1 1 29 VAL CA C 0.985 -8.712 -2.423 1.00 . A B . 29 VAL CA 1 1 13 10485 1 1 29 VAL CB C -0.363 -9.466 -2.457 1.00 . A B . 29 VAL CB 1 1 13 10486 1 1 29 VAL CG1 C -0.653 -9.991 -3.854 1.00 . A B . 29 VAL CG1 1 1 13 10487 1 1 29 VAL CG2 C -0.366 -10.609 -1.452 1.00 . A B . 29 VAL CG2 1 1 13 10488 1 1 29 VAL H H 0.568 -8.017 -0.474 1.00 . A B . 29 VAL H 1 1 13 10489 1 1 29 VAL HA H 1.761 -9.400 -2.719 1.00 . A B . 29 VAL HA 1 1 13 10490 1 1 29 VAL HB H -1.146 -8.775 -2.184 1.00 . A B . 29 VAL HB 1 1 13 10491 1 1 29 VAL HG11 H 0.108 -10.702 -4.135 1.00 . A B . 29 VAL HG11 1 1 13 10492 1 1 29 VAL HG12 H -0.655 -9.170 -4.555 1.00 . A B . 29 VAL HG12 1 1 13 10493 1 1 29 VAL HG13 H -1.619 -10.473 -3.863 1.00 . A B . 29 VAL HG13 1 1 13 10494 1 1 29 VAL HG21 H 0.470 -11.264 -1.649 1.00 . A B . 29 VAL HG21 1 1 13 10495 1 1 29 VAL HG22 H -1.288 -11.165 -1.543 1.00 . A B . 29 VAL HG22 1 1 13 10496 1 1 29 VAL HG23 H -0.285 -10.212 -0.451 1.00 . A B . 29 VAL HG23 1 1 13 10497 1 1 29 VAL N N 1.299 -8.241 -1.086 1.00 . A B . 29 VAL N 1 1 13 10498 1 1 29 VAL O O 1.597 -7.615 -4.467 1.00 . A B . 29 VAL O 1 1 13 10499 1 1 30 PHE C C 0.648 -4.117 -3.450 1.00 . A B . 30 PHE C 1 1 13 10500 1 1 30 PHE CA C 0.033 -5.388 -4.018 1.00 . A B . 30 PHE CA 1 1 13 10501 1 1 30 PHE CB C -1.456 -5.141 -4.299 1.00 . A B . 30 PHE CB 1 1 13 10502 1 1 30 PHE CD1 C -1.928 -6.794 -6.136 1.00 . A B . 30 PHE CD1 1 1 13 10503 1 1 30 PHE CD2 C -3.180 -6.951 -4.111 1.00 . A B . 30 PHE CD2 1 1 13 10504 1 1 30 PHE CE1 C -2.621 -7.873 -6.650 1.00 . A B . 30 PHE CE1 1 1 13 10505 1 1 30 PHE CE2 C -3.875 -8.031 -4.621 1.00 . A B . 30 PHE CE2 1 1 13 10506 1 1 30 PHE CG C -2.199 -6.322 -4.860 1.00 . A B . 30 PHE CG 1 1 13 10507 1 1 30 PHE CZ C -3.594 -8.493 -5.891 1.00 . A B . 30 PHE CZ 1 1 13 10508 1 1 30 PHE H H -0.199 -6.463 -2.203 1.00 . A B . 30 PHE H 1 1 13 10509 1 1 30 PHE HA H 0.532 -5.637 -4.943 1.00 . A B . 30 PHE HA 1 1 13 10510 1 1 30 PHE HB2 H -1.942 -4.860 -3.376 1.00 . A B . 30 PHE HB2 1 1 13 10511 1 1 30 PHE HB3 H -1.545 -4.328 -5.005 1.00 . A B . 30 PHE HB3 1 1 13 10512 1 1 30 PHE HD1 H -1.167 -6.313 -6.733 1.00 . A B . 30 PHE HD1 1 1 13 10513 1 1 30 PHE HD2 H -3.405 -6.589 -3.118 1.00 . A B . 30 PHE HD2 1 1 13 10514 1 1 30 PHE HE1 H -2.402 -8.231 -7.644 1.00 . A B . 30 PHE HE1 1 1 13 10515 1 1 30 PHE HE2 H -4.636 -8.513 -4.025 1.00 . A B . 30 PHE HE2 1 1 13 10516 1 1 30 PHE HZ H -4.136 -9.337 -6.291 1.00 . A B . 30 PHE HZ 1 1 13 10517 1 1 30 PHE N N 0.215 -6.505 -3.096 1.00 . A B . 30 PHE N 1 1 13 10518 1 1 30 PHE O O 0.009 -3.070 -3.439 1.00 . A B . 30 PHE O 1 1 13 10519 1 1 31 HIS C C 2.537 -1.836 -3.193 1.00 . A B . 31 HIS C 1 1 13 10520 1 1 31 HIS CA C 2.573 -3.101 -2.343 1.00 . A B . 31 HIS CA 1 1 13 10521 1 1 31 HIS CB C 4.022 -3.486 -2.042 1.00 . A B . 31 HIS CB 1 1 13 10522 1 1 31 HIS CD2 C 5.835 -1.709 -1.516 1.00 . A B . 31 HIS CD2 1 1 13 10523 1 1 31 HIS CE1 C 5.406 -1.365 0.579 1.00 . A B . 31 HIS CE1 1 1 13 10524 1 1 31 HIS CG C 4.770 -2.490 -1.203 1.00 . A B . 31 HIS CG 1 1 13 10525 1 1 31 HIS H H 2.370 -5.062 -3.117 1.00 . A B . 31 HIS H 1 1 13 10526 1 1 31 HIS HA H 2.064 -2.907 -1.413 1.00 . A B . 31 HIS HA 1 1 13 10527 1 1 31 HIS HB2 H 4.029 -4.429 -1.514 1.00 . A B . 31 HIS HB2 1 1 13 10528 1 1 31 HIS HB3 H 4.554 -3.601 -2.976 1.00 . A B . 31 HIS HB3 1 1 13 10529 1 1 31 HIS HD1 H 3.783 -2.673 0.657 1.00 . A B . 31 HIS HD1 1 1 13 10530 1 1 31 HIS HD2 H 6.285 -1.618 -2.493 1.00 . A B . 31 HIS HD2 1 1 13 10531 1 1 31 HIS HE1 H 5.444 -0.990 1.592 1.00 . A B . 31 HIS HE1 1 1 13 10532 1 1 31 HIS N N 1.892 -4.215 -3.003 1.00 . A B . 31 HIS N 1 1 13 10533 1 1 31 HIS ND1 N 4.508 -2.260 0.130 1.00 . A B . 31 HIS ND1 1 1 13 10534 1 1 31 HIS NE2 N 6.240 -1.001 -0.383 1.00 . A B . 31 HIS NE2 1 1 13 10535 1 1 31 HIS O O 2.125 -0.783 -2.723 1.00 . A B . 31 HIS O 1 1 13 10536 1 1 32 GLU C C 1.676 -0.150 -5.555 1.00 . A B . 32 GLU C 1 1 13 10537 1 1 32 GLU CA C 3.027 -0.811 -5.343 1.00 . A B . 32 GLU CA 1 1 13 10538 1 1 32 GLU CB C 3.620 -1.231 -6.686 1.00 . A B . 32 GLU CB 1 1 13 10539 1 1 32 GLU CD C 5.942 -0.409 -6.201 1.00 . A B . 32 GLU CD 1 1 13 10540 1 1 32 GLU CG C 5.092 -1.590 -6.609 1.00 . A B . 32 GLU CG 1 1 13 10541 1 1 32 GLU H H 3.072 -2.860 -4.814 1.00 . A B . 32 GLU H 1 1 13 10542 1 1 32 GLU HA H 3.691 -0.102 -4.873 1.00 . A B . 32 GLU HA 1 1 13 10543 1 1 32 GLU HB2 H 3.077 -2.089 -7.052 1.00 . A B . 32 GLU HB2 1 1 13 10544 1 1 32 GLU HB3 H 3.506 -0.417 -7.386 1.00 . A B . 32 GLU HB3 1 1 13 10545 1 1 32 GLU HG2 H 5.221 -2.375 -5.882 1.00 . A B . 32 GLU HG2 1 1 13 10546 1 1 32 GLU HG3 H 5.422 -1.936 -7.578 1.00 . A B . 32 GLU HG3 1 1 13 10547 1 1 32 GLU N N 2.909 -1.964 -4.458 1.00 . A B . 32 GLU N 1 1 13 10548 1 1 32 GLU O O 1.567 1.077 -5.596 1.00 . A B . 32 GLU O 1 1 13 10549 1 1 32 GLU OE1 O 6.365 0.359 -7.086 1.00 . A B . 32 GLU OE1 1 1 13 10550 1 1 32 GLU OE2 O 6.197 -0.246 -4.989 1.00 . A B . 32 GLU OE2 1 1 13 10551 1 1 33 ASP C C -1.301 0.055 -4.611 1.00 . A B . 33 ASP C 1 1 13 10552 1 1 33 ASP CA C -0.702 -0.488 -5.897 1.00 . A B . 33 ASP CA 1 1 13 10553 1 1 33 ASP CB C -1.591 -1.600 -6.454 1.00 . A B . 33 ASP CB 1 1 13 10554 1 1 33 ASP CG C -1.075 -2.166 -7.756 1.00 . A B . 33 ASP CG 1 1 13 10555 1 1 33 ASP H H 0.805 -1.940 -5.584 1.00 . A B . 33 ASP H 1 1 13 10556 1 1 33 ASP HA H -0.643 0.311 -6.619 1.00 . A B . 33 ASP HA 1 1 13 10557 1 1 33 ASP HB2 H -1.643 -2.400 -5.733 1.00 . A B . 33 ASP HB2 1 1 13 10558 1 1 33 ASP HB3 H -2.583 -1.205 -6.622 1.00 . A B . 33 ASP HB3 1 1 13 10559 1 1 33 ASP N N 0.648 -0.974 -5.666 1.00 . A B . 33 ASP N 1 1 13 10560 1 1 33 ASP O O -2.192 0.900 -4.639 1.00 . A B . 33 ASP O 1 1 13 10561 1 1 33 ASP OD1 O -1.129 -1.457 -8.782 1.00 . A B . 33 ASP OD1 1 1 13 10562 1 1 33 ASP OD2 O -0.613 -3.326 -7.763 1.00 . A B . 33 ASP OD2 1 1 13 10563 1 1 34 CYS C C -0.811 1.435 -1.865 1.00 . A B . 34 CYS C 1 1 13 10564 1 1 34 CYS CA C -1.267 0.011 -2.173 1.00 . A B . 34 CYS CA 1 1 13 10565 1 1 34 CYS CB C -0.770 -0.940 -1.083 1.00 . A B . 34 CYS CB 1 1 13 10566 1 1 34 CYS H H -0.091 -1.114 -3.530 1.00 . A B . 34 CYS H 1 1 13 10567 1 1 34 CYS HA H -2.347 -0.010 -2.187 1.00 . A B . 34 CYS HA 1 1 13 10568 1 1 34 CYS HB2 H 0.258 -1.207 -1.291 1.00 . A B . 34 CYS HB2 1 1 13 10569 1 1 34 CYS HB3 H -0.821 -0.440 -0.128 1.00 . A B . 34 CYS HB3 1 1 13 10570 1 1 34 CYS N N -0.799 -0.430 -3.482 1.00 . A B . 34 CYS N 1 1 13 10571 1 1 34 CYS O O -1.262 2.045 -0.894 1.00 . A B . 34 CYS O 1 1 13 10572 1 1 34 CYS SG S -1.716 -2.489 -0.949 1.00 . A B . 34 CYS SG 1 1 13 10573 1 1 35 HIS C C -0.116 4.212 -3.596 1.00 . A B . 35 HIS C 1 1 13 10574 1 1 35 HIS CA C 0.557 3.327 -2.554 1.00 . A B . 35 HIS CA 1 1 13 10575 1 1 35 HIS CB C 2.075 3.405 -2.714 1.00 . A B . 35 HIS CB 1 1 13 10576 1 1 35 HIS CD2 C 3.293 1.461 -1.530 1.00 . A B . 35 HIS CD2 1 1 13 10577 1 1 35 HIS CE1 C 3.796 2.425 0.335 1.00 . A B . 35 HIS CE1 1 1 13 10578 1 1 35 HIS CG C 2.828 2.729 -1.612 1.00 . A B . 35 HIS CG 1 1 13 10579 1 1 35 HIS H H 0.474 1.386 -3.392 1.00 . A B . 35 HIS H 1 1 13 10580 1 1 35 HIS HA H 0.289 3.674 -1.566 1.00 . A B . 35 HIS HA 1 1 13 10581 1 1 35 HIS HB2 H 2.351 2.926 -3.642 1.00 . A B . 35 HIS HB2 1 1 13 10582 1 1 35 HIS HB3 H 2.375 4.442 -2.743 1.00 . A B . 35 HIS HB3 1 1 13 10583 1 1 35 HIS HD1 H 2.910 4.243 -0.139 1.00 . A B . 35 HIS HD1 1 1 13 10584 1 1 35 HIS HD2 H 3.218 0.709 -2.303 1.00 . A B . 35 HIS HD2 1 1 13 10585 1 1 35 HIS HE1 H 4.182 2.621 1.325 1.00 . A B . 35 HIS HE1 1 1 13 10586 1 1 35 HIS N N 0.097 1.950 -2.684 1.00 . A B . 35 HIS N 1 1 13 10587 1 1 35 HIS ND1 N 3.152 3.331 -0.414 1.00 . A B . 35 HIS ND1 1 1 13 10588 1 1 35 HIS NE2 N 3.903 1.269 -0.300 1.00 . A B . 35 HIS NE2 1 1 13 10589 1 1 35 HIS O O 0.249 5.377 -3.771 1.00 . A B . 35 HIS O 1 1 13 10590 1 1 36 ILE C C -3.317 4.276 -5.016 1.00 . A B . 36 ILE C 1 1 13 10591 1 1 36 ILE CA C -1.824 4.351 -5.328 1.00 . A B . 36 ILE CA 1 1 13 10592 1 1 36 ILE CB C -1.562 3.748 -6.729 1.00 . A B . 36 ILE CB 1 1 13 10593 1 1 36 ILE CD1 C 0.295 3.126 -8.372 1.00 . A B . 36 ILE CD1 1 1 13 10594 1 1 36 ILE CG1 C -0.060 3.744 -7.035 1.00 . A B . 36 ILE CG1 1 1 13 10595 1 1 36 ILE CG2 C -2.324 4.517 -7.799 1.00 . A B . 36 ILE CG2 1 1 13 10596 1 1 36 ILE H H -1.304 2.702 -4.123 1.00 . A B . 36 ILE H 1 1 13 10597 1 1 36 ILE HA H -1.508 5.384 -5.326 1.00 . A B . 36 ILE HA 1 1 13 10598 1 1 36 ILE HB H -1.923 2.731 -6.728 1.00 . A B . 36 ILE HB 1 1 13 10599 1 1 36 ILE HD11 H 1.367 3.140 -8.503 1.00 . A B . 36 ILE HD11 1 1 13 10600 1 1 36 ILE HD12 H -0.171 3.692 -9.165 1.00 . A B . 36 ILE HD12 1 1 13 10601 1 1 36 ILE HD13 H -0.058 2.107 -8.404 1.00 . A B . 36 ILE HD13 1 1 13 10602 1 1 36 ILE HG12 H 0.305 4.760 -7.032 1.00 . A B . 36 ILE HG12 1 1 13 10603 1 1 36 ILE HG13 H 0.452 3.184 -6.265 1.00 . A B . 36 ILE HG13 1 1 13 10604 1 1 36 ILE HG21 H -3.383 4.473 -7.589 1.00 . A B . 36 ILE HG21 1 1 13 10605 1 1 36 ILE HG22 H -2.131 4.075 -8.766 1.00 . A B . 36 ILE HG22 1 1 13 10606 1 1 36 ILE HG23 H -2.000 5.546 -7.804 1.00 . A B . 36 ILE HG23 1 1 13 10607 1 1 36 ILE N N -1.079 3.639 -4.302 1.00 . A B . 36 ILE N 1 1 13 10608 1 1 36 ILE O O -3.853 3.187 -4.824 1.00 . A B . 36 ILE O 1 1 13 10609 1 1 37 PRO C C -2.513 7.227 -4.129 1.00 . A B . 37 PRO C 1 1 13 10610 1 1 37 PRO CA C -3.447 6.744 -5.237 1.00 . A B . 37 PRO CA 1 1 13 10611 1 1 37 PRO CB C -4.685 7.645 -5.320 1.00 . A B . 37 PRO CB 1 1 13 10612 1 1 37 PRO CD C -5.451 5.498 -4.611 1.00 . A B . 37 PRO CD 1 1 13 10613 1 1 37 PRO CG C -5.690 6.974 -4.446 1.00 . A B . 37 PRO CG 1 1 13 10614 1 1 37 PRO HA H -2.919 6.759 -6.181 1.00 . A B . 37 PRO HA 1 1 13 10615 1 1 37 PRO HB2 H -4.441 8.633 -4.953 1.00 . A B . 37 PRO HB2 1 1 13 10616 1 1 37 PRO HB3 H -5.027 7.704 -6.347 1.00 . A B . 37 PRO HB3 1 1 13 10617 1 1 37 PRO HD2 H -5.650 4.974 -3.686 1.00 . A B . 37 PRO HD2 1 1 13 10618 1 1 37 PRO HD3 H -6.065 5.100 -5.409 1.00 . A B . 37 PRO HD3 1 1 13 10619 1 1 37 PRO HG2 H -5.537 7.267 -3.415 1.00 . A B . 37 PRO HG2 1 1 13 10620 1 1 37 PRO HG3 H -6.691 7.231 -4.765 1.00 . A B . 37 PRO HG3 1 1 13 10621 1 1 37 PRO N N -4.020 5.418 -4.961 1.00 . A B . 37 PRO N 1 1 13 10622 1 1 37 PRO O O -2.679 6.866 -2.963 1.00 . A B . 37 PRO O 1 1 13 10623 1 1 38 PRO C C -1.259 9.490 -2.503 1.00 . A B . 38 PRO C 1 1 13 10624 1 1 38 PRO CA C -0.559 8.607 -3.528 1.00 . A B . 38 PRO CA 1 1 13 10625 1 1 38 PRO CB C 0.397 9.439 -4.391 1.00 . A B . 38 PRO CB 1 1 13 10626 1 1 38 PRO CD C -1.211 8.463 -5.869 1.00 . A B . 38 PRO CD 1 1 13 10627 1 1 38 PRO CG C -0.334 9.671 -5.671 1.00 . A B . 38 PRO CG 1 1 13 10628 1 1 38 PRO HA H -0.007 7.832 -3.018 1.00 . A B . 38 PRO HA 1 1 13 10629 1 1 38 PRO HB2 H 0.617 10.372 -3.887 1.00 . A B . 38 PRO HB2 1 1 13 10630 1 1 38 PRO HB3 H 1.313 8.889 -4.552 1.00 . A B . 38 PRO HB3 1 1 13 10631 1 1 38 PRO HD2 H -2.120 8.732 -6.391 1.00 . A B . 38 PRO HD2 1 1 13 10632 1 1 38 PRO HD3 H -0.681 7.688 -6.406 1.00 . A B . 38 PRO HD3 1 1 13 10633 1 1 38 PRO HG2 H -0.937 10.566 -5.592 1.00 . A B . 38 PRO HG2 1 1 13 10634 1 1 38 PRO HG3 H 0.371 9.763 -6.485 1.00 . A B . 38 PRO HG3 1 1 13 10635 1 1 38 PRO N N -1.505 8.039 -4.491 1.00 . A B . 38 PRO N 1 1 13 10636 1 1 38 PRO O O -2.134 10.288 -2.853 1.00 . A B . 38 PRO O 1 1 13 10637 1 1 39 VAL C C -1.496 11.556 -0.365 1.00 . A B . 39 VAL C 1 1 13 10638 1 1 39 VAL CA C -1.488 10.045 -0.134 1.00 . A B . 39 VAL CA 1 1 13 10639 1 1 39 VAL CB C -0.800 9.708 1.213 1.00 . A B . 39 VAL CB 1 1 13 10640 1 1 39 VAL CG1 C 0.673 10.085 1.205 1.00 . A B . 39 VAL CG1 1 1 13 10641 1 1 39 VAL CG2 C -1.522 10.380 2.370 1.00 . A B . 39 VAL CG2 1 1 13 10642 1 1 39 VAL H H -0.132 8.715 -1.054 1.00 . A B . 39 VAL H 1 1 13 10643 1 1 39 VAL HA H -2.509 9.705 -0.075 1.00 . A B . 39 VAL HA 1 1 13 10644 1 1 39 VAL HB H -0.864 8.642 1.358 1.00 . A B . 39 VAL HB 1 1 13 10645 1 1 39 VAL HG11 H 1.092 9.915 2.186 1.00 . A B . 39 VAL HG11 1 1 13 10646 1 1 39 VAL HG12 H 0.777 11.129 0.945 1.00 . A B . 39 VAL HG12 1 1 13 10647 1 1 39 VAL HG13 H 1.197 9.481 0.482 1.00 . A B . 39 VAL HG13 1 1 13 10648 1 1 39 VAL HG21 H -2.548 10.047 2.393 1.00 . A B . 39 VAL HG21 1 1 13 10649 1 1 39 VAL HG22 H -1.492 11.452 2.241 1.00 . A B . 39 VAL HG22 1 1 13 10650 1 1 39 VAL HG23 H -1.037 10.116 3.298 1.00 . A B . 39 VAL HG23 1 1 13 10651 1 1 39 VAL N N -0.863 9.333 -1.243 1.00 . A B . 39 VAL N 1 1 13 10652 1 1 39 VAL O O -0.464 12.163 -0.668 1.00 . A B . 39 VAL O 1 1 13 10653 1 1 40 GLU C C -3.855 14.146 0.541 1.00 . A B . 40 GLU C 1 1 13 10654 1 1 40 GLU CA C -2.848 13.577 -0.459 1.00 . A B . 40 GLU CA 1 1 13 10655 1 1 40 GLU CB C -3.315 13.851 -1.893 1.00 . A B . 40 GLU CB 1 1 13 10656 1 1 40 GLU CD C -2.120 16.034 -2.341 1.00 . A B . 40 GLU CD 1 1 13 10657 1 1 40 GLU CG C -3.455 15.328 -2.218 1.00 . A B . 40 GLU CG 1 1 13 10658 1 1 40 GLU H H -3.459 11.605 -0.023 1.00 . A B . 40 GLU H 1 1 13 10659 1 1 40 GLU HA H -1.892 14.054 -0.302 1.00 . A B . 40 GLU HA 1 1 13 10660 1 1 40 GLU HB2 H -2.602 13.419 -2.580 1.00 . A B . 40 GLU HB2 1 1 13 10661 1 1 40 GLU HB3 H -4.275 13.380 -2.044 1.00 . A B . 40 GLU HB3 1 1 13 10662 1 1 40 GLU HG2 H -3.985 15.430 -3.152 1.00 . A B . 40 GLU HG2 1 1 13 10663 1 1 40 GLU HG3 H -4.022 15.799 -1.430 1.00 . A B . 40 GLU HG3 1 1 13 10664 1 1 40 GLU N N -2.677 12.148 -0.252 1.00 . A B . 40 GLU N 1 1 13 10665 1 1 40 GLU O O -3.591 15.157 1.190 1.00 . A B . 40 GLU O 1 1 13 10666 1 1 40 GLU OE1 O -1.554 16.427 -1.296 1.00 . A B . 40 GLU OE1 1 1 13 10667 1 1 40 GLU OE2 O -1.628 16.197 -3.478 1.00 . A B . 40 GLU OE2 1 1 13 10668 1 1 41 ALA C C -6.740 12.783 2.260 1.00 . A B . 41 ALA C 1 1 13 10669 1 1 41 ALA CA C -6.048 13.954 1.575 1.00 . A B . 41 ALA CA 1 1 13 10670 1 1 41 ALA CB C -7.064 14.809 0.832 1.00 . A B . 41 ALA CB 1 1 13 10671 1 1 41 ALA H H -5.152 12.674 0.147 1.00 . A B . 41 ALA H 1 1 13 10672 1 1 41 ALA HA H -5.580 14.568 2.329 1.00 . A B . 41 ALA HA 1 1 13 10673 1 1 41 ALA HB1 H -7.577 14.204 0.097 1.00 . A B . 41 ALA HB1 1 1 13 10674 1 1 41 ALA HB2 H -6.555 15.621 0.337 1.00 . A B . 41 ALA HB2 1 1 13 10675 1 1 41 ALA HB3 H -7.783 15.207 1.534 1.00 . A B . 41 ALA HB3 1 1 13 10676 1 1 41 ALA N N -5.005 13.490 0.668 1.00 . A B . 41 ALA N 1 1 13 10677 1 1 41 ALA O O -6.931 12.789 3.476 1.00 . A B . 41 ALA O 1 1 13 10678 1 1 42 GLU C C -6.752 9.672 2.669 1.00 . A B . 42 GLU C 1 1 13 10679 1 1 42 GLU CA C -7.767 10.594 2.014 1.00 . A B . 42 GLU CA 1 1 13 10680 1 1 42 GLU CB C -8.519 9.845 0.911 1.00 . A B . 42 GLU CB 1 1 13 10681 1 1 42 GLU CD C -10.806 10.772 1.421 1.00 . A B . 42 GLU CD 1 1 13 10682 1 1 42 GLU CG C -9.721 10.602 0.378 1.00 . A B . 42 GLU CG 1 1 13 10683 1 1 42 GLU H H -6.924 11.829 0.516 1.00 . A B . 42 GLU H 1 1 13 10684 1 1 42 GLU HA H -8.475 10.920 2.760 1.00 . A B . 42 GLU HA 1 1 13 10685 1 1 42 GLU HB2 H -7.843 9.657 0.091 1.00 . A B . 42 GLU HB2 1 1 13 10686 1 1 42 GLU HB3 H -8.861 8.901 1.307 1.00 . A B . 42 GLU HB3 1 1 13 10687 1 1 42 GLU HG2 H -9.399 11.580 0.053 1.00 . A B . 42 GLU HG2 1 1 13 10688 1 1 42 GLU HG3 H -10.130 10.060 -0.462 1.00 . A B . 42 GLU HG3 1 1 13 10689 1 1 42 GLU N N -7.108 11.779 1.477 1.00 . A B . 42 GLU N 1 1 13 10690 1 1 42 GLU O O -6.302 8.693 2.070 1.00 . A B . 42 GLU O 1 1 13 10691 1 1 42 GLU OE1 O -10.715 11.721 2.231 1.00 . A B . 42 GLU OE1 1 1 13 10692 1 1 42 GLU OE2 O -11.754 9.958 1.438 1.00 . A B . 42 GLU OE2 1 1 13 10693 1 1 43 ARG C C -6.112 8.137 5.441 1.00 . A B . 43 ARG C 1 1 13 10694 1 1 43 ARG CA C -5.409 9.215 4.632 1.00 . A B . 43 ARG CA 1 1 13 10695 1 1 43 ARG CB C -4.581 10.112 5.548 1.00 . A B . 43 ARG CB 1 1 13 10696 1 1 43 ARG CD C -2.861 11.940 5.637 1.00 . A B . 43 ARG CD 1 1 13 10697 1 1 43 ARG CG C -4.014 11.337 4.852 1.00 . A B . 43 ARG CG 1 1 13 10698 1 1 43 ARG CZ C -2.604 11.827 8.091 1.00 . A B . 43 ARG CZ 1 1 13 10699 1 1 43 ARG H H -6.794 10.781 4.325 1.00 . A B . 43 ARG H 1 1 13 10700 1 1 43 ARG HA H -4.755 8.743 3.916 1.00 . A B . 43 ARG HA 1 1 13 10701 1 1 43 ARG HB2 H -5.205 10.444 6.365 1.00 . A B . 43 ARG HB2 1 1 13 10702 1 1 43 ARG HB3 H -3.759 9.536 5.946 1.00 . A B . 43 ARG HB3 1 1 13 10703 1 1 43 ARG HD2 H -2.055 11.223 5.666 1.00 . A B . 43 ARG HD2 1 1 13 10704 1 1 43 ARG HD3 H -2.525 12.833 5.132 1.00 . A B . 43 ARG HD3 1 1 13 10705 1 1 43 ARG HE H -3.987 12.913 7.127 1.00 . A B . 43 ARG HE 1 1 13 10706 1 1 43 ARG HG2 H -3.659 11.051 3.873 1.00 . A B . 43 ARG HG2 1 1 13 10707 1 1 43 ARG HG3 H -4.797 12.076 4.751 1.00 . A B . 43 ARG HG3 1 1 13 10708 1 1 43 ARG HH11 H -1.371 10.581 7.055 1.00 . A B . 43 ARG HH11 1 1 13 10709 1 1 43 ARG HH12 H -1.155 10.587 8.780 1.00 . A B . 43 ARG HH12 1 1 13 10710 1 1 43 ARG HH21 H -3.712 12.912 9.397 1.00 . A B . 43 ARG HH21 1 1 13 10711 1 1 43 ARG HH22 H -2.494 11.907 10.116 1.00 . A B . 43 ARG HH22 1 1 13 10712 1 1 43 ARG N N -6.386 9.996 3.898 1.00 . A B . 43 ARG N 1 1 13 10713 1 1 43 ARG NE N -3.236 12.285 7.009 1.00 . A B . 43 ARG NE 1 1 13 10714 1 1 43 ARG NH1 N -1.633 10.928 7.969 1.00 . A B . 43 ARG NH1 1 1 13 10715 1 1 43 ARG NH2 N -2.965 12.249 9.298 1.00 . A B . 43 ARG NH2 1 1 13 10716 1 1 43 ARG O O -6.457 8.339 6.607 1.00 . A B . 43 ARG O 1 1 13 10717 1 1 44 THR C C -6.289 4.610 5.408 1.00 . A B . 44 THR C 1 1 13 10718 1 1 44 THR CA C -7.080 5.921 5.442 1.00 . A B . 44 THR CA 1 1 13 10719 1 1 44 THR CB C -8.444 5.712 4.753 1.00 . A B . 44 THR CB 1 1 13 10720 1 1 44 THR CG2 C -9.336 6.932 4.927 1.00 . A B . 44 THR CG2 1 1 13 10721 1 1 44 THR H H -6.029 6.891 3.889 1.00 . A B . 44 THR H 1 1 13 10722 1 1 44 THR HA H -7.257 6.198 6.470 1.00 . A B . 44 THR HA 1 1 13 10723 1 1 44 THR HB H -8.930 4.857 5.202 1.00 . A B . 44 THR HB 1 1 13 10724 1 1 44 THR HG1 H -7.639 4.715 3.250 1.00 . A B . 44 THR HG1 1 1 13 10725 1 1 44 THR HG21 H -10.287 6.754 4.447 1.00 . A B . 44 THR HG21 1 1 13 10726 1 1 44 THR HG22 H -8.860 7.791 4.477 1.00 . A B . 44 THR HG22 1 1 13 10727 1 1 44 THR HG23 H -9.492 7.117 5.978 1.00 . A B . 44 THR HG23 1 1 13 10728 1 1 44 THR N N -6.349 7.001 4.808 1.00 . A B . 44 THR N 1 1 13 10729 1 1 44 THR O O -6.522 3.759 4.549 1.00 . A B . 44 THR O 1 1 13 10730 1 1 44 THR OG1 O -8.248 5.460 3.354 1.00 . A B . 44 THR OG1 1 1 13 10731 1 1 45 PRO C C -5.348 1.989 6.855 1.00 . A B . 45 PRO C 1 1 13 10732 1 1 45 PRO CA C -4.528 3.203 6.417 1.00 . A B . 45 PRO CA 1 1 13 10733 1 1 45 PRO CB C -3.459 3.532 7.471 1.00 . A B . 45 PRO CB 1 1 13 10734 1 1 45 PRO CD C -4.967 5.390 7.381 1.00 . A B . 45 PRO CD 1 1 13 10735 1 1 45 PRO CG C -3.545 5.011 7.677 1.00 . A B . 45 PRO CG 1 1 13 10736 1 1 45 PRO HA H -4.053 2.987 5.471 1.00 . A B . 45 PRO HA 1 1 13 10737 1 1 45 PRO HB2 H -3.675 2.994 8.383 1.00 . A B . 45 PRO HB2 1 1 13 10738 1 1 45 PRO HB3 H -2.487 3.243 7.099 1.00 . A B . 45 PRO HB3 1 1 13 10739 1 1 45 PRO HD2 H -5.583 5.271 8.263 1.00 . A B . 45 PRO HD2 1 1 13 10740 1 1 45 PRO HD3 H -5.026 6.403 7.007 1.00 . A B . 45 PRO HD3 1 1 13 10741 1 1 45 PRO HG2 H -3.295 5.253 8.700 1.00 . A B . 45 PRO HG2 1 1 13 10742 1 1 45 PRO HG3 H -2.873 5.516 6.997 1.00 . A B . 45 PRO HG3 1 1 13 10743 1 1 45 PRO N N -5.342 4.425 6.341 1.00 . A B . 45 PRO N 1 1 13 10744 1 1 45 PRO O O -4.902 0.846 6.745 1.00 . A B . 45 PRO O 1 1 13 10745 1 1 46 TRP C C -8.462 0.857 6.706 1.00 . A B . 46 TRP C 1 1 13 10746 1 1 46 TRP CA C -7.448 1.192 7.795 1.00 . A B . 46 TRP CA 1 1 13 10747 1 1 46 TRP CB C -8.172 1.617 9.079 1.00 . A B . 46 TRP CB 1 1 13 10748 1 1 46 TRP CD1 C -10.119 3.162 8.459 1.00 . A B . 46 TRP CD1 1 1 13 10749 1 1 46 TRP CD2 C -8.351 4.225 9.326 1.00 . A B . 46 TRP CD2 1 1 13 10750 1 1 46 TRP CE2 C -9.342 5.175 9.026 1.00 . A B . 46 TRP CE2 1 1 13 10751 1 1 46 TRP CE3 C -7.146 4.664 9.885 1.00 . A B . 46 TRP CE3 1 1 13 10752 1 1 46 TRP CG C -8.867 2.940 8.955 1.00 . A B . 46 TRP CG 1 1 13 10753 1 1 46 TRP CH2 C -7.979 6.936 9.810 1.00 . A B . 46 TRP CH2 1 1 13 10754 1 1 46 TRP CZ2 C -9.168 6.536 9.264 1.00 . A B . 46 TRP CZ2 1 1 13 10755 1 1 46 TRP CZ3 C -6.975 6.015 10.120 1.00 . A B . 46 TRP CZ3 1 1 13 10756 1 1 46 TRP H H -6.839 3.182 7.423 1.00 . A B . 46 TRP H 1 1 13 10757 1 1 46 TRP HA H -6.852 0.313 7.996 1.00 . A B . 46 TRP HA 1 1 13 10758 1 1 46 TRP HB2 H -8.914 0.873 9.329 1.00 . A B . 46 TRP HB2 1 1 13 10759 1 1 46 TRP HB3 H -7.454 1.689 9.883 1.00 . A B . 46 TRP HB3 1 1 13 10760 1 1 46 TRP HD1 H -10.773 2.388 8.090 1.00 . A B . 46 TRP HD1 1 1 13 10761 1 1 46 TRP HE1 H -11.253 4.909 8.196 1.00 . A B . 46 TRP HE1 1 1 13 10762 1 1 46 TRP HE3 H -6.357 3.968 10.131 1.00 . A B . 46 TRP HE3 1 1 13 10763 1 1 46 TRP HH2 H -7.799 7.981 10.010 1.00 . A B . 46 TRP HH2 1 1 13 10764 1 1 46 TRP HZ2 H -9.936 7.258 9.033 1.00 . A B . 46 TRP HZ2 1 1 13 10765 1 1 46 TRP HZ3 H -6.051 6.374 10.549 1.00 . A B . 46 TRP HZ3 1 1 13 10766 1 1 46 TRP N N -6.549 2.249 7.350 1.00 . A B . 46 TRP N 1 1 13 10767 1 1 46 TRP NE1 N -10.410 4.502 8.498 1.00 . A B . 46 TRP NE1 1 1 13 10768 1 1 46 TRP O O -9.317 -0.009 6.880 1.00 . A B . 46 TRP O 1 1 13 10769 1 1 47 ASN C C -8.500 0.700 3.315 1.00 . A B . 47 ASN C 1 1 13 10770 1 1 47 ASN CA C -9.262 1.326 4.468 1.00 . A B . 47 ASN CA 1 1 13 10771 1 1 47 ASN CB C -9.921 2.632 4.004 1.00 . A B . 47 ASN CB 1 1 13 10772 1 1 47 ASN CG C -10.907 2.408 2.865 1.00 . A B . 47 ASN CG 1 1 13 10773 1 1 47 ASN H H -7.641 2.213 5.496 1.00 . A B . 47 ASN H 1 1 13 10774 1 1 47 ASN HA H -10.029 0.640 4.795 1.00 . A B . 47 ASN HA 1 1 13 10775 1 1 47 ASN HB2 H -10.451 3.078 4.834 1.00 . A B . 47 ASN HB2 1 1 13 10776 1 1 47 ASN HB3 H -9.155 3.313 3.667 1.00 . A B . 47 ASN HB3 1 1 13 10777 1 1 47 ASN HD21 H -9.465 2.616 1.507 1.00 . A B . 47 ASN HD21 1 1 13 10778 1 1 47 ASN HD22 H -11.050 2.304 0.879 1.00 . A B . 47 ASN HD22 1 1 13 10779 1 1 47 ASN N N -8.360 1.553 5.585 1.00 . A B . 47 ASN N 1 1 13 10780 1 1 47 ASN ND2 N -10.426 2.449 1.626 1.00 . A B . 47 ASN ND2 1 1 13 10781 1 1 47 ASN O O -7.725 1.373 2.637 1.00 . A B . 47 ASN O 1 1 13 10782 1 1 47 ASN OD1 O -12.095 2.192 3.095 1.00 . A B . 47 ASN OD1 1 1 13 10783 1 1 48 CYS C C -8.835 -1.200 0.757 1.00 . A B . 48 CYS C 1 1 13 10784 1 1 48 CYS CA C -8.034 -1.298 2.044 1.00 . A B . 48 CYS CA 1 1 13 10785 1 1 48 CYS CB C -7.872 -2.757 2.471 1.00 . A B . 48 CYS CB 1 1 13 10786 1 1 48 CYS H H -9.384 -1.055 3.646 1.00 . A B . 48 CYS H 1 1 13 10787 1 1 48 CYS HA H -7.065 -0.848 1.900 1.00 . A B . 48 CYS HA 1 1 13 10788 1 1 48 CYS HB2 H -7.369 -2.789 3.425 1.00 . A B . 48 CYS HB2 1 1 13 10789 1 1 48 CYS HB3 H -8.855 -3.188 2.589 1.00 . A B . 48 CYS HB3 1 1 13 10790 1 1 48 CYS N N -8.721 -0.581 3.098 1.00 . A B . 48 CYS N 1 1 13 10791 1 1 48 CYS O O -9.982 -1.636 0.693 1.00 . A B . 48 CYS O 1 1 13 10792 1 1 48 CYS SG S -6.943 -3.833 1.348 1.00 . A B . 48 CYS SG 1 1 13 10793 1 1 49 ILE C C -9.211 -1.749 -2.243 1.00 . A B . 49 ILE C 1 1 13 10794 1 1 49 ILE CA C -8.891 -0.433 -1.542 1.00 . A B . 49 ILE CA 1 1 13 10795 1 1 49 ILE CB C -8.079 0.488 -2.486 1.00 . A B . 49 ILE CB 1 1 13 10796 1 1 49 ILE CD1 C -5.748 0.935 -3.424 1.00 . A B . 49 ILE CD1 1 1 13 10797 1 1 49 ILE CG1 C -6.587 0.140 -2.445 1.00 . A B . 49 ILE CG1 1 1 13 10798 1 1 49 ILE CG2 C -8.298 1.951 -2.120 1.00 . A B . 49 ILE CG2 1 1 13 10799 1 1 49 ILE H H -7.277 -0.374 -0.170 1.00 . A B . 49 ILE H 1 1 13 10800 1 1 49 ILE HA H -9.826 0.064 -1.321 1.00 . A B . 49 ILE HA 1 1 13 10801 1 1 49 ILE HB H -8.445 0.338 -3.490 1.00 . A B . 49 ILE HB 1 1 13 10802 1 1 49 ILE HD11 H -4.720 0.607 -3.368 1.00 . A B . 49 ILE HD11 1 1 13 10803 1 1 49 ILE HD12 H -5.804 1.986 -3.174 1.00 . A B . 49 ILE HD12 1 1 13 10804 1 1 49 ILE HD13 H -6.121 0.783 -4.426 1.00 . A B . 49 ILE HD13 1 1 13 10805 1 1 49 ILE HG12 H -6.208 0.340 -1.455 1.00 . A B . 49 ILE HG12 1 1 13 10806 1 1 49 ILE HG13 H -6.461 -0.908 -2.672 1.00 . A B . 49 ILE HG13 1 1 13 10807 1 1 49 ILE HG21 H -9.341 2.204 -2.246 1.00 . A B . 49 ILE HG21 1 1 13 10808 1 1 49 ILE HG22 H -7.695 2.576 -2.763 1.00 . A B . 49 ILE HG22 1 1 13 10809 1 1 49 ILE HG23 H -8.010 2.113 -1.091 1.00 . A B . 49 ILE HG23 1 1 13 10810 1 1 49 ILE N N -8.213 -0.652 -0.272 1.00 . A B . 49 ILE N 1 1 13 10811 1 1 49 ILE O O -10.194 -1.845 -2.976 1.00 . A B . 49 ILE O 1 1 13 10812 1 1 50 PHE C C -9.678 -4.873 -1.907 1.00 . A B . 50 PHE C 1 1 13 10813 1 1 50 PHE CA C -8.601 -4.066 -2.634 1.00 . A B . 50 PHE CA 1 1 13 10814 1 1 50 PHE CB C -7.284 -4.840 -2.731 1.00 . A B . 50 PHE CB 1 1 13 10815 1 1 50 PHE CD1 C -6.349 -4.621 -5.047 1.00 . A B . 50 PHE CD1 1 1 13 10816 1 1 50 PHE CD2 C -5.401 -3.282 -3.315 1.00 . A B . 50 PHE CD2 1 1 13 10817 1 1 50 PHE CE1 C -5.461 -4.083 -5.952 1.00 . A B . 50 PHE CE1 1 1 13 10818 1 1 50 PHE CE2 C -4.512 -2.739 -4.219 1.00 . A B . 50 PHE CE2 1 1 13 10819 1 1 50 PHE CG C -6.331 -4.230 -3.718 1.00 . A B . 50 PHE CG 1 1 13 10820 1 1 50 PHE CZ C -4.600 -3.065 -5.549 1.00 . A B . 50 PHE CZ 1 1 13 10821 1 1 50 PHE H H -7.717 -2.682 -1.301 1.00 . A B . 50 PHE H 1 1 13 10822 1 1 50 PHE HA H -8.956 -3.869 -3.638 1.00 . A B . 50 PHE HA 1 1 13 10823 1 1 50 PHE HB2 H -6.801 -4.848 -1.764 1.00 . A B . 50 PHE HB2 1 1 13 10824 1 1 50 PHE HB3 H -7.487 -5.856 -3.039 1.00 . A B . 50 PHE HB3 1 1 13 10825 1 1 50 PHE HD1 H -7.068 -5.355 -5.375 1.00 . A B . 50 PHE HD1 1 1 13 10826 1 1 50 PHE HD2 H -5.375 -2.969 -2.282 1.00 . A B . 50 PHE HD2 1 1 13 10827 1 1 50 PHE HE1 H -5.486 -4.401 -6.983 1.00 . A B . 50 PHE HE1 1 1 13 10828 1 1 50 PHE HE2 H -3.793 -2.000 -3.893 1.00 . A B . 50 PHE HE2 1 1 13 10829 1 1 50 PHE HZ H -3.929 -2.610 -6.261 1.00 . A B . 50 PHE HZ 1 1 13 10830 1 1 50 PHE N N -8.399 -2.770 -1.996 1.00 . A B . 50 PHE N 1 1 13 10831 1 1 50 PHE O O -10.498 -5.539 -2.534 1.00 . A B . 50 PHE O 1 1 13 10832 1 1 51 CYS C C -12.055 -4.893 0.118 1.00 . A B . 51 CYS C 1 1 13 10833 1 1 51 CYS CA C -10.666 -5.511 0.236 1.00 . A B . 51 CYS CA 1 1 13 10834 1 1 51 CYS CB C -10.248 -5.577 1.711 1.00 . A B . 51 CYS CB 1 1 13 10835 1 1 51 CYS H H -9.002 -4.247 -0.131 1.00 . A B . 51 CYS H 1 1 13 10836 1 1 51 CYS HA H -10.719 -6.520 -0.150 1.00 . A B . 51 CYS HA 1 1 13 10837 1 1 51 CYS HB2 H -9.831 -4.628 2.000 1.00 . A B . 51 CYS HB2 1 1 13 10838 1 1 51 CYS HB3 H -11.122 -5.774 2.315 1.00 . A B . 51 CYS HB3 1 1 13 10839 1 1 51 CYS N N -9.682 -4.794 -0.577 1.00 . A B . 51 CYS N 1 1 13 10840 1 1 51 CYS O O -13.055 -5.554 0.386 1.00 . A B . 51 CYS O 1 1 13 10841 1 1 51 CYS SG S -9.020 -6.857 2.087 1.00 . A B . 51 CYS SG 1 1 13 10842 1 1 52 ARG C C -13.947 -2.865 -1.724 1.00 . A B . 52 ARG C 1 1 13 10843 1 1 52 ARG CA C -13.400 -2.929 -0.305 1.00 . A B . 52 ARG CA 1 1 13 10844 1 1 52 ARG CB C -13.264 -1.513 0.267 1.00 . A B . 52 ARG CB 1 1 13 10845 1 1 52 ARG CD C -13.809 -2.254 2.614 1.00 . A B . 52 ARG CD 1 1 13 10846 1 1 52 ARG CG C -12.848 -1.471 1.730 1.00 . A B . 52 ARG CG 1 1 13 10847 1 1 52 ARG CZ C -16.220 -2.309 3.147 1.00 . A B . 52 ARG CZ 1 1 13 10848 1 1 52 ARG H H -11.351 -3.205 -0.708 1.00 . A B . 52 ARG H 1 1 13 10849 1 1 52 ARG HA H -14.090 -3.491 0.306 1.00 . A B . 52 ARG HA 1 1 13 10850 1 1 52 ARG HB2 H -12.525 -0.975 -0.308 1.00 . A B . 52 ARG HB2 1 1 13 10851 1 1 52 ARG HB3 H -14.214 -1.008 0.174 1.00 . A B . 52 ARG HB3 1 1 13 10852 1 1 52 ARG HD2 H -13.772 -3.295 2.330 1.00 . A B . 52 ARG HD2 1 1 13 10853 1 1 52 ARG HD3 H -13.494 -2.153 3.642 1.00 . A B . 52 ARG HD3 1 1 13 10854 1 1 52 ARG HE H -15.352 -1.022 1.880 1.00 . A B . 52 ARG HE 1 1 13 10855 1 1 52 ARG HG2 H -11.860 -1.899 1.822 1.00 . A B . 52 ARG HG2 1 1 13 10856 1 1 52 ARG HG3 H -12.827 -0.441 2.056 1.00 . A B . 52 ARG HG3 1 1 13 10857 1 1 52 ARG HH11 H -15.113 -3.708 4.116 1.00 . A B . 52 ARG HH11 1 1 13 10858 1 1 52 ARG HH12 H -16.810 -3.728 4.473 1.00 . A B . 52 ARG HH12 1 1 13 10859 1 1 52 ARG HH21 H -17.588 -1.048 2.345 1.00 . A B . 52 ARG HH21 1 1 13 10860 1 1 52 ARG HH22 H -18.220 -2.217 3.460 1.00 . A B . 52 ARG HH22 1 1 13 10861 1 1 52 ARG N N -12.126 -3.632 -0.292 1.00 . A B . 52 ARG N 1 1 13 10862 1 1 52 ARG NE N -15.187 -1.779 2.490 1.00 . A B . 52 ARG NE 1 1 13 10863 1 1 52 ARG NH1 N -16.033 -3.329 3.978 1.00 . A B . 52 ARG NH1 1 1 13 10864 1 1 52 ARG NH2 N -17.440 -1.818 2.971 1.00 . A B . 52 ARG NH2 1 1 13 10865 1 1 52 ARG O O -15.060 -2.399 -1.951 1.00 . A B . 52 ARG O 1 1 13 10866 1 1 53 MET C C -14.386 -4.606 -4.392 1.00 . A B . 53 MET C 1 1 13 10867 1 1 53 MET CA C -13.588 -3.345 -4.079 1.00 . A B . 53 MET CA 1 1 13 10868 1 1 53 MET CB C -12.387 -3.228 -5.029 1.00 . A B . 53 MET CB 1 1 13 10869 1 1 53 MET CE C -9.599 -6.006 -6.414 1.00 . A B . 53 MET CE 1 1 13 10870 1 1 53 MET CG C -11.600 -4.516 -5.210 1.00 . A B . 53 MET CG 1 1 13 10871 1 1 53 MET H H -12.294 -3.731 -2.442 1.00 . A B . 53 MET H 1 1 13 10872 1 1 53 MET HA H -14.230 -2.490 -4.220 1.00 . A B . 53 MET HA 1 1 13 10873 1 1 53 MET HB2 H -12.741 -2.914 -5.999 1.00 . A B . 53 MET HB2 1 1 13 10874 1 1 53 MET HB3 H -11.715 -2.475 -4.644 1.00 . A B . 53 MET HB3 1 1 13 10875 1 1 53 MET HE1 H -9.339 -6.360 -5.427 1.00 . A B . 53 MET HE1 1 1 13 10876 1 1 53 MET HE2 H -8.728 -6.045 -7.051 1.00 . A B . 53 MET HE2 1 1 13 10877 1 1 53 MET HE3 H -10.377 -6.631 -6.828 1.00 . A B . 53 MET HE3 1 1 13 10878 1 1 53 MET HG2 H -11.243 -4.847 -4.247 1.00 . A B . 53 MET HG2 1 1 13 10879 1 1 53 MET HG3 H -12.257 -5.266 -5.625 1.00 . A B . 53 MET HG3 1 1 13 10880 1 1 53 MET N N -13.165 -3.354 -2.681 1.00 . A B . 53 MET N 1 1 13 10881 1 1 53 MET O O -14.729 -4.874 -5.544 1.00 . A B . 53 MET O 1 1 13 10882 1 1 53 MET SD S -10.185 -4.317 -6.309 1.00 . A B . 53 MET SD 1 1 13 10883 1 1 54 LYS C C -16.869 -6.206 -3.959 1.00 . A B . 54 LYS C 1 1 13 10884 1 1 54 LYS CA C -15.476 -6.575 -3.465 1.00 . A B . 54 LYS CA 1 1 13 10885 1 1 54 LYS CB C -15.566 -7.285 -2.106 1.00 . A B . 54 LYS CB 1 1 13 10886 1 1 54 LYS CD C -15.885 -9.599 -3.050 1.00 . A B . 54 LYS CD 1 1 13 10887 1 1 54 LYS CE C -16.815 -10.799 -3.148 1.00 . A B . 54 LYS CE 1 1 13 10888 1 1 54 LYS CG C -16.438 -8.535 -2.116 1.00 . A B . 54 LYS CG 1 1 13 10889 1 1 54 LYS H H -14.302 -5.130 -2.475 1.00 . A B . 54 LYS H 1 1 13 10890 1 1 54 LYS HA H -15.007 -7.232 -4.182 1.00 . A B . 54 LYS HA 1 1 13 10891 1 1 54 LYS HB2 H -14.572 -7.569 -1.794 1.00 . A B . 54 LYS HB2 1 1 13 10892 1 1 54 LYS HB3 H -15.975 -6.594 -1.382 1.00 . A B . 54 LYS HB3 1 1 13 10893 1 1 54 LYS HD2 H -15.760 -9.172 -4.031 1.00 . A B . 54 LYS HD2 1 1 13 10894 1 1 54 LYS HD3 H -14.927 -9.929 -2.675 1.00 . A B . 54 LYS HD3 1 1 13 10895 1 1 54 LYS HE2 H -16.922 -11.239 -2.168 1.00 . A B . 54 LYS HE2 1 1 13 10896 1 1 54 LYS HE3 H -17.780 -10.461 -3.498 1.00 . A B . 54 LYS HE3 1 1 13 10897 1 1 54 LYS HG2 H -16.480 -8.936 -1.115 1.00 . A B . 54 LYS HG2 1 1 13 10898 1 1 54 LYS HG3 H -17.433 -8.265 -2.441 1.00 . A B . 54 LYS HG3 1 1 13 10899 1 1 54 LYS HZ1 H -16.197 -11.427 -5.042 1.00 . A B . 54 LYS HZ1 1 1 13 10900 1 1 54 LYS HZ2 H -16.947 -12.637 -4.129 1.00 . A B . 54 LYS HZ2 1 1 13 10901 1 1 54 LYS HZ3 H -15.363 -12.166 -3.768 1.00 . A B . 54 LYS HZ3 1 1 13 10902 1 1 54 LYS N N -14.661 -5.378 -3.349 1.00 . A B . 54 LYS N 1 1 13 10903 1 1 54 LYS NZ N -16.295 -11.828 -4.086 1.00 . A B . 54 LYS NZ 1 1 13 10904 1 1 54 LYS O O -17.476 -5.248 -3.475 1.00 . A B . 54 LYS O 1 1 13 10905 1 1 55 GLU C C -19.615 -7.853 -5.167 1.00 . A B . 55 GLU C 1 1 13 10906 1 1 55 GLU CA C -18.679 -6.697 -5.488 1.00 . A B . 55 GLU CA 1 1 13 10907 1 1 55 GLU CB C -18.590 -6.483 -6.999 1.00 . A B . 55 GLU CB 1 1 13 10908 1 1 55 GLU CD C -19.804 -5.945 -9.140 1.00 . A B . 55 GLU CD 1 1 13 10909 1 1 55 GLU CG C -19.935 -6.238 -7.662 1.00 . A B . 55 GLU CG 1 1 13 10910 1 1 55 GLU H H -16.834 -7.706 -5.277 1.00 . A B . 55 GLU H 1 1 13 10911 1 1 55 GLU HA H -19.062 -5.799 -5.028 1.00 . A B . 55 GLU HA 1 1 13 10912 1 1 55 GLU HB2 H -17.960 -5.628 -7.191 1.00 . A B . 55 GLU HB2 1 1 13 10913 1 1 55 GLU HB3 H -18.145 -7.356 -7.450 1.00 . A B . 55 GLU HB3 1 1 13 10914 1 1 55 GLU HG2 H -20.549 -7.116 -7.536 1.00 . A B . 55 GLU HG2 1 1 13 10915 1 1 55 GLU HG3 H -20.410 -5.394 -7.182 1.00 . A B . 55 GLU HG3 1 1 13 10916 1 1 55 GLU N N -17.363 -6.953 -4.932 1.00 . A B . 55 GLU N 1 1 13 10917 1 1 55 GLU O O -19.294 -9.012 -5.427 1.00 . A B . 55 GLU O 1 1 13 10918 1 1 55 GLU OE1 O -19.827 -6.899 -9.943 1.00 . A B . 55 GLU OE1 1 1 13 10919 1 1 55 GLU OE2 O -19.676 -4.757 -9.508 1.00 . A B . 55 GLU OE2 1 1 13 10920 1 1 56 SER C C -23.128 -7.888 -4.231 1.00 . A B . 56 SER C 1 1 13 10921 1 1 56 SER CA C -21.746 -8.535 -4.245 1.00 . A B . 56 SER CA 1 1 13 10922 1 1 56 SER CB C -21.420 -9.175 -2.888 1.00 . A B . 56 SER CB 1 1 13 10923 1 1 56 SER H H -20.939 -6.592 -4.366 1.00 . A B . 56 SER H 1 1 13 10924 1 1 56 SER HA H -21.724 -9.296 -5.011 1.00 . A B . 56 SER HA 1 1 13 10925 1 1 56 SER HB2 H -20.388 -9.493 -2.884 1.00 . A B . 56 SER HB2 1 1 13 10926 1 1 56 SER HB3 H -21.573 -8.447 -2.105 1.00 . A B . 56 SER HB3 1 1 13 10927 1 1 56 SER HG H -21.989 -11.027 -3.214 1.00 . A B . 56 SER HG 1 1 13 10928 1 1 56 SER N N -20.754 -7.533 -4.579 1.00 . A B . 56 SER N 1 1 13 10929 1 1 56 SER O O -23.525 -7.343 -3.182 1.00 . A B . 56 SER O 1 1 13 10930 1 1 56 SER OXT O -23.796 -7.900 -5.288 1.00 . A B . 56 SER OXT 1 1 13 10931 1 1 56 SER OG O -22.243 -10.302 -2.628 1.00 . A B . 56 SER OG 1 1 13 10932 2 2 1 ZN ZN ZN -6.940 -5.893 2.369 1.00 . B B . 101 ZN ZN 1 1 13 10933 3 2 1 ZN ZN ZN 5.873 0.964 -0.303 1.00 . C B . 102 ZN ZN 1 1 14 10934 1 1 1 GLY C C 8.905 -13.352 -3.570 1.00 . A B . 1 GLY C 1 1 14 10935 1 1 1 GLY CA C 7.520 -12.868 -3.935 1.00 . A B . 1 GLY CA 1 1 14 10936 1 1 1 GLY H1 H 6.487 -11.086 -4.246 1.00 . A B . 1 GLY H1 1 1 14 10937 1 1 1 GLY H2 H 8.127 -11.005 -4.637 1.00 . A B . 1 GLY H2 1 1 14 10938 1 1 1 GLY H3 H 7.644 -11.004 -3.018 1.00 . A B . 1 GLY H3 1 1 14 10939 1 1 1 GLY HA2 H 6.815 -13.246 -3.210 1.00 . A B . 1 GLY HA2 1 1 14 10940 1 1 1 GLY HA3 H 7.258 -13.252 -4.910 1.00 . A B . 1 GLY HA3 1 1 14 10941 1 1 1 GLY N N 7.437 -11.390 -3.961 1.00 . A B . 1 GLY N 1 1 14 10942 1 1 1 GLY O O 9.792 -12.539 -3.290 1.00 . A B . 1 GLY O 1 1 14 10943 1 1 2 ALA C C 10.851 -14.923 -1.862 1.00 . A B . 2 ALA C 1 1 14 10944 1 1 2 ALA CA C 10.376 -15.298 -3.264 1.00 . A B . 2 ALA CA 1 1 14 10945 1 1 2 ALA CB C 11.422 -14.919 -4.311 1.00 . A B . 2 ALA CB 1 1 14 10946 1 1 2 ALA H H 8.325 -15.255 -3.782 1.00 . A B . 2 ALA H 1 1 14 10947 1 1 2 ALA HA H 10.237 -16.369 -3.305 1.00 . A B . 2 ALA HA 1 1 14 10948 1 1 2 ALA HB1 H 12.343 -15.444 -4.106 1.00 . A B . 2 ALA HB1 1 1 14 10949 1 1 2 ALA HB2 H 11.598 -13.854 -4.273 1.00 . A B . 2 ALA HB2 1 1 14 10950 1 1 2 ALA HB3 H 11.065 -15.191 -5.294 1.00 . A B . 2 ALA HB3 1 1 14 10951 1 1 2 ALA N N 9.088 -14.675 -3.571 1.00 . A B . 2 ALA N 1 1 14 10952 1 1 2 ALA O O 12.028 -14.618 -1.656 1.00 . A B . 2 ALA O 1 1 14 10953 1 1 3 MET C C 10.772 -13.184 0.562 1.00 . A B . 3 MET C 1 1 14 10954 1 1 3 MET CA C 10.212 -14.604 0.484 1.00 . A B . 3 MET CA 1 1 14 10955 1 1 3 MET CB C 11.194 -15.610 1.104 1.00 . A B . 3 MET CB 1 1 14 10956 1 1 3 MET CE C 11.964 -18.152 2.879 1.00 . A B . 3 MET CE 1 1 14 10957 1 1 3 MET CG C 11.357 -15.459 2.612 1.00 . A B . 3 MET CG 1 1 14 10958 1 1 3 MET H H 9.002 -15.210 -1.147 1.00 . A B . 3 MET H 1 1 14 10959 1 1 3 MET HA H 9.282 -14.638 1.032 1.00 . A B . 3 MET HA 1 1 14 10960 1 1 3 MET HB2 H 10.841 -16.612 0.901 1.00 . A B . 3 MET HB2 1 1 14 10961 1 1 3 MET HB3 H 12.162 -15.480 0.643 1.00 . A B . 3 MET HB3 1 1 14 10962 1 1 3 MET HE1 H 12.625 -18.919 3.250 1.00 . A B . 3 MET HE1 1 1 14 10963 1 1 3 MET HE2 H 11.871 -18.244 1.807 1.00 . A B . 3 MET HE2 1 1 14 10964 1 1 3 MET HE3 H 10.992 -18.262 3.336 1.00 . A B . 3 MET HE3 1 1 14 10965 1 1 3 MET HG2 H 11.621 -14.435 2.832 1.00 . A B . 3 MET HG2 1 1 14 10966 1 1 3 MET HG3 H 10.416 -15.697 3.089 1.00 . A B . 3 MET HG3 1 1 14 10967 1 1 3 MET N N 9.921 -14.950 -0.906 1.00 . A B . 3 MET N 1 1 14 10968 1 1 3 MET O O 11.840 -12.944 1.133 1.00 . A B . 3 MET O 1 1 14 10969 1 1 3 MET SD S 12.635 -16.539 3.285 1.00 . A B . 3 MET SD 1 1 14 10970 1 1 4 GLY C C 10.365 -10.218 1.307 1.00 . A B . 4 GLY C 1 1 14 10971 1 1 4 GLY CA C 10.473 -10.869 -0.056 1.00 . A B . 4 GLY CA 1 1 14 10972 1 1 4 GLY H H 9.209 -12.510 -0.481 1.00 . A B . 4 GLY H 1 1 14 10973 1 1 4 GLY HA2 H 11.499 -10.823 -0.385 1.00 . A B . 4 GLY HA2 1 1 14 10974 1 1 4 GLY HA3 H 9.856 -10.320 -0.753 1.00 . A B . 4 GLY HA3 1 1 14 10975 1 1 4 GLY N N 10.047 -12.253 -0.040 1.00 . A B . 4 GLY N 1 1 14 10976 1 1 4 GLY O O 9.273 -9.849 1.744 1.00 . A B . 4 GLY O 1 1 14 10977 1 1 5 MET C C 11.535 -7.933 3.128 1.00 . A B . 5 MET C 1 1 14 10978 1 1 5 MET CA C 11.535 -9.447 3.291 1.00 . A B . 5 MET CA 1 1 14 10979 1 1 5 MET CB C 12.775 -9.886 4.079 1.00 . A B . 5 MET CB 1 1 14 10980 1 1 5 MET CE C 13.970 -13.591 5.594 1.00 . A B . 5 MET CE 1 1 14 10981 1 1 5 MET CG C 12.808 -11.371 4.413 1.00 . A B . 5 MET CG 1 1 14 10982 1 1 5 MET H H 12.328 -10.422 1.590 1.00 . A B . 5 MET H 1 1 14 10983 1 1 5 MET HA H 10.648 -9.743 3.831 1.00 . A B . 5 MET HA 1 1 14 10984 1 1 5 MET HB2 H 13.658 -9.648 3.503 1.00 . A B . 5 MET HB2 1 1 14 10985 1 1 5 MET HB3 H 12.809 -9.332 5.007 1.00 . A B . 5 MET HB3 1 1 14 10986 1 1 5 MET HE1 H 13.061 -13.729 6.161 1.00 . A B . 5 MET HE1 1 1 14 10987 1 1 5 MET HE2 H 14.799 -14.029 6.130 1.00 . A B . 5 MET HE2 1 1 14 10988 1 1 5 MET HE3 H 13.870 -14.071 4.631 1.00 . A B . 5 MET HE3 1 1 14 10989 1 1 5 MET HG2 H 11.931 -11.613 4.990 1.00 . A B . 5 MET HG2 1 1 14 10990 1 1 5 MET HG3 H 12.796 -11.938 3.494 1.00 . A B . 5 MET HG3 1 1 14 10991 1 1 5 MET N N 11.496 -10.086 1.985 1.00 . A B . 5 MET N 1 1 14 10992 1 1 5 MET O O 12.594 -7.318 2.982 1.00 . A B . 5 MET O 1 1 14 10993 1 1 5 MET SD S 14.268 -11.840 5.361 1.00 . A B . 5 MET SD 1 1 14 10994 1 1 6 ARG C C 10.732 -5.467 1.605 1.00 . A B . 6 ARG C 1 1 14 10995 1 1 6 ARG CA C 10.158 -5.909 2.950 1.00 . A B . 6 ARG CA 1 1 14 10996 1 1 6 ARG CB C 10.798 -5.113 4.095 1.00 . A B . 6 ARG CB 1 1 14 10997 1 1 6 ARG CD C 10.880 -4.622 6.565 1.00 . A B . 6 ARG CD 1 1 14 10998 1 1 6 ARG CG C 10.218 -5.436 5.464 1.00 . A B . 6 ARG CG 1 1 14 10999 1 1 6 ARG CZ C 10.665 -4.362 9.014 1.00 . A B . 6 ARG CZ 1 1 14 11000 1 1 6 ARG H H 9.543 -7.903 3.299 1.00 . A B . 6 ARG H 1 1 14 11001 1 1 6 ARG HA H 9.097 -5.715 2.945 1.00 . A B . 6 ARG HA 1 1 14 11002 1 1 6 ARG HB2 H 11.855 -5.327 4.117 1.00 . A B . 6 ARG HB2 1 1 14 11003 1 1 6 ARG HB3 H 10.656 -4.059 3.906 1.00 . A B . 6 ARG HB3 1 1 14 11004 1 1 6 ARG HD2 H 11.949 -4.756 6.504 1.00 . A B . 6 ARG HD2 1 1 14 11005 1 1 6 ARG HD3 H 10.638 -3.580 6.422 1.00 . A B . 6 ARG HD3 1 1 14 11006 1 1 6 ARG HE H 9.914 -5.878 7.943 1.00 . A B . 6 ARG HE 1 1 14 11007 1 1 6 ARG HG2 H 9.161 -5.217 5.458 1.00 . A B . 6 ARG HG2 1 1 14 11008 1 1 6 ARG HG3 H 10.368 -6.486 5.667 1.00 . A B . 6 ARG HG3 1 1 14 11009 1 1 6 ARG HH11 H 11.634 -2.831 8.106 1.00 . A B . 6 ARG HH11 1 1 14 11010 1 1 6 ARG HH12 H 11.502 -2.707 9.830 1.00 . A B . 6 ARG HH12 1 1 14 11011 1 1 6 ARG HH21 H 9.741 -5.717 10.203 1.00 . A B . 6 ARG HH21 1 1 14 11012 1 1 6 ARG HH22 H 10.406 -4.341 11.023 1.00 . A B . 6 ARG HH22 1 1 14 11013 1 1 6 ARG N N 10.337 -7.346 3.146 1.00 . A B . 6 ARG N 1 1 14 11014 1 1 6 ARG NE N 10.424 -5.036 7.890 1.00 . A B . 6 ARG NE 1 1 14 11015 1 1 6 ARG NH1 N 11.317 -3.208 8.980 1.00 . A B . 6 ARG NH1 1 1 14 11016 1 1 6 ARG NH2 N 10.238 -4.845 10.172 1.00 . A B . 6 ARG NH2 1 1 14 11017 1 1 6 ARG O O 11.776 -4.807 1.542 1.00 . A B . 6 ARG O 1 1 14 11018 1 1 7 ASN C C 9.983 -4.059 -1.128 1.00 . A B . 7 ASN C 1 1 14 11019 1 1 7 ASN CA C 10.465 -5.470 -0.816 1.00 . A B . 7 ASN CA 1 1 14 11020 1 1 7 ASN CB C 9.922 -6.465 -1.852 1.00 . A B . 7 ASN CB 1 1 14 11021 1 1 7 ASN CG C 10.515 -6.259 -3.242 1.00 . A B . 7 ASN CG 1 1 14 11022 1 1 7 ASN H H 9.227 -6.368 0.653 1.00 . A B . 7 ASN H 1 1 14 11023 1 1 7 ASN HA H 11.544 -5.483 -0.842 1.00 . A B . 7 ASN HA 1 1 14 11024 1 1 7 ASN HB2 H 10.158 -7.470 -1.530 1.00 . A B . 7 ASN HB2 1 1 14 11025 1 1 7 ASN HB3 H 8.850 -6.357 -1.915 1.00 . A B . 7 ASN HB3 1 1 14 11026 1 1 7 ASN HD21 H 9.052 -5.007 -3.737 1.00 . A B . 7 ASN HD21 1 1 14 11027 1 1 7 ASN HD22 H 10.246 -5.283 -4.960 1.00 . A B . 7 ASN HD22 1 1 14 11028 1 1 7 ASN N N 10.045 -5.839 0.532 1.00 . A B . 7 ASN N 1 1 14 11029 1 1 7 ASN ND2 N 9.870 -5.438 -4.061 1.00 . A B . 7 ASN ND2 1 1 14 11030 1 1 7 ASN O O 9.010 -3.860 -1.858 1.00 . A B . 7 ASN O 1 1 14 11031 1 1 7 ASN OD1 O 11.546 -6.842 -3.579 1.00 . A B . 7 ASN OD1 1 1 14 11032 1 1 8 LEU C C 11.474 -0.836 -1.055 1.00 . A B . 8 LEU C 1 1 14 11033 1 1 8 LEU CA C 10.273 -1.690 -0.682 1.00 . A B . 8 LEU CA 1 1 14 11034 1 1 8 LEU CB C 9.611 -1.187 0.610 1.00 . A B . 8 LEU CB 1 1 14 11035 1 1 8 LEU CD1 C 11.521 -0.536 2.142 1.00 . A B . 8 LEU CD1 1 1 14 11036 1 1 8 LEU CD2 C 9.402 -1.463 3.095 1.00 . A B . 8 LEU CD2 1 1 14 11037 1 1 8 LEU CG C 10.361 -1.497 1.916 1.00 . A B . 8 LEU CG 1 1 14 11038 1 1 8 LEU H H 11.427 -3.313 0.022 1.00 . A B . 8 LEU H 1 1 14 11039 1 1 8 LEU HA H 9.555 -1.636 -1.485 1.00 . A B . 8 LEU HA 1 1 14 11040 1 1 8 LEU HB2 H 9.498 -0.116 0.533 1.00 . A B . 8 LEU HB2 1 1 14 11041 1 1 8 LEU HB3 H 8.629 -1.628 0.677 1.00 . A B . 8 LEU HB3 1 1 14 11042 1 1 8 LEU HD11 H 12.043 -0.806 3.047 1.00 . A B . 8 LEU HD11 1 1 14 11043 1 1 8 LEU HD12 H 11.141 0.472 2.233 1.00 . A B . 8 LEU HD12 1 1 14 11044 1 1 8 LEU HD13 H 12.200 -0.589 1.303 1.00 . A B . 8 LEU HD13 1 1 14 11045 1 1 8 LEU HD21 H 9.948 -1.646 4.009 1.00 . A B . 8 LEU HD21 1 1 14 11046 1 1 8 LEU HD22 H 8.648 -2.226 2.968 1.00 . A B . 8 LEU HD22 1 1 14 11047 1 1 8 LEU HD23 H 8.928 -0.494 3.147 1.00 . A B . 8 LEU HD23 1 1 14 11048 1 1 8 LEU HG H 10.772 -2.495 1.851 1.00 . A B . 8 LEU HG 1 1 14 11049 1 1 8 LEU N N 10.653 -3.085 -0.535 1.00 . A B . 8 LEU N 1 1 14 11050 1 1 8 LEU O O 11.458 0.385 -0.912 1.00 . A B . 8 LEU O 1 1 14 11051 1 1 9 ASP C C 13.543 -0.110 -3.281 1.00 . A B . 9 ASP C 1 1 14 11052 1 1 9 ASP CA C 13.730 -0.813 -1.947 1.00 . A B . 9 ASP CA 1 1 14 11053 1 1 9 ASP CB C 14.898 -1.802 -2.018 1.00 . A B . 9 ASP CB 1 1 14 11054 1 1 9 ASP CG C 15.227 -2.419 -0.671 1.00 . A B . 9 ASP CG 1 1 14 11055 1 1 9 ASP H H 12.396 -2.453 -1.747 1.00 . A B . 9 ASP H 1 1 14 11056 1 1 9 ASP HA H 13.939 -0.072 -1.192 1.00 . A B . 9 ASP HA 1 1 14 11057 1 1 9 ASP HB2 H 14.643 -2.598 -2.701 1.00 . A B . 9 ASP HB2 1 1 14 11058 1 1 9 ASP HB3 H 15.774 -1.287 -2.383 1.00 . A B . 9 ASP HB3 1 1 14 11059 1 1 9 ASP N N 12.496 -1.492 -1.575 1.00 . A B . 9 ASP N 1 1 14 11060 1 1 9 ASP O O 14.221 0.870 -3.591 1.00 . A B . 9 ASP O 1 1 14 11061 1 1 9 ASP OD1 O 15.985 -1.798 0.106 1.00 . A B . 9 ASP OD1 1 1 14 11062 1 1 9 ASP OD2 O 14.725 -3.524 -0.378 1.00 . A B . 9 ASP OD2 1 1 14 11063 1 1 10 GLU C C 11.053 0.930 -5.132 1.00 . A B . 10 GLU C 1 1 14 11064 1 1 10 GLU CA C 12.230 -0.015 -5.330 1.00 . A B . 10 GLU CA 1 1 14 11065 1 1 10 GLU CB C 11.867 -1.109 -6.335 1.00 . A B . 10 GLU CB 1 1 14 11066 1 1 10 GLU CD C 10.562 -3.238 -6.685 1.00 . A B . 10 GLU CD 1 1 14 11067 1 1 10 GLU CG C 10.667 -1.940 -5.913 1.00 . A B . 10 GLU CG 1 1 14 11068 1 1 10 GLU H H 12.155 -1.444 -3.778 1.00 . A B . 10 GLU H 1 1 14 11069 1 1 10 GLU HA H 13.075 0.544 -5.699 1.00 . A B . 10 GLU HA 1 1 14 11070 1 1 10 GLU HB2 H 11.644 -0.648 -7.285 1.00 . A B . 10 GLU HB2 1 1 14 11071 1 1 10 GLU HB3 H 12.711 -1.770 -6.452 1.00 . A B . 10 GLU HB3 1 1 14 11072 1 1 10 GLU HG2 H 10.752 -2.167 -4.862 1.00 . A B . 10 GLU HG2 1 1 14 11073 1 1 10 GLU HG3 H 9.770 -1.365 -6.081 1.00 . A B . 10 GLU HG3 1 1 14 11074 1 1 10 GLU N N 12.603 -0.619 -4.061 1.00 . A B . 10 GLU N 1 1 14 11075 1 1 10 GLU O O 10.539 1.524 -6.080 1.00 . A B . 10 GLU O 1 1 14 11076 1 1 10 GLU OE1 O 11.141 -4.248 -6.239 1.00 . A B . 10 GLU OE1 1 1 14 11077 1 1 10 GLU OE2 O 9.893 -3.254 -7.741 1.00 . A B . 10 GLU OE2 1 1 14 11078 1 1 11 CYS C C 9.950 3.186 -2.933 1.00 . A B . 11 CYS C 1 1 14 11079 1 1 11 CYS CA C 9.486 1.869 -3.539 1.00 . A B . 11 CYS CA 1 1 14 11080 1 1 11 CYS CB C 8.611 1.099 -2.552 1.00 . A B . 11 CYS CB 1 1 14 11081 1 1 11 CYS H H 11.130 0.612 -3.170 1.00 . A B . 11 CYS H 1 1 14 11082 1 1 11 CYS HA H 8.926 2.066 -4.440 1.00 . A B . 11 CYS HA 1 1 14 11083 1 1 11 CYS HB2 H 8.415 0.121 -2.957 1.00 . A B . 11 CYS HB2 1 1 14 11084 1 1 11 CYS HB3 H 9.151 0.991 -1.625 1.00 . A B . 11 CYS HB3 1 1 14 11085 1 1 11 CYS N N 10.634 1.059 -3.885 1.00 . A B . 11 CYS N 1 1 14 11086 1 1 11 CYS O O 10.178 3.283 -1.725 1.00 . A B . 11 CYS O 1 1 14 11087 1 1 11 CYS SG S 7.015 1.856 -2.168 1.00 . A B . 11 CYS SG 1 1 14 11088 1 1 12 GLU C C 9.528 6.125 -2.392 1.00 . A B . 12 GLU C 1 1 14 11089 1 1 12 GLU CA C 10.536 5.508 -3.346 1.00 . A B . 12 GLU CA 1 1 14 11090 1 1 12 GLU CB C 10.720 6.419 -4.554 1.00 . A B . 12 GLU CB 1 1 14 11091 1 1 12 GLU CD C 12.773 7.624 -3.721 1.00 . A B . 12 GLU CD 1 1 14 11092 1 1 12 GLU CG C 11.353 7.760 -4.224 1.00 . A B . 12 GLU CG 1 1 14 11093 1 1 12 GLU H H 9.891 4.051 -4.729 1.00 . A B . 12 GLU H 1 1 14 11094 1 1 12 GLU HA H 11.478 5.393 -2.838 1.00 . A B . 12 GLU HA 1 1 14 11095 1 1 12 GLU HB2 H 11.346 5.917 -5.274 1.00 . A B . 12 GLU HB2 1 1 14 11096 1 1 12 GLU HB3 H 9.752 6.601 -4.995 1.00 . A B . 12 GLU HB3 1 1 14 11097 1 1 12 GLU HG2 H 11.357 8.371 -5.115 1.00 . A B . 12 GLU HG2 1 1 14 11098 1 1 12 GLU HG3 H 10.760 8.245 -3.461 1.00 . A B . 12 GLU HG3 1 1 14 11099 1 1 12 GLU N N 10.086 4.194 -3.779 1.00 . A B . 12 GLU N 1 1 14 11100 1 1 12 GLU O O 9.891 6.822 -1.446 1.00 . A B . 12 GLU O 1 1 14 11101 1 1 12 GLU OE1 O 13.658 7.259 -4.522 1.00 . A B . 12 GLU OE1 1 1 14 11102 1 1 12 GLU OE2 O 13.016 7.896 -2.529 1.00 . A B . 12 GLU OE2 1 1 14 11103 1 1 13 VAL C C 7.210 5.894 -0.408 1.00 . A B . 13 VAL C 1 1 14 11104 1 1 13 VAL CA C 7.188 6.413 -1.851 1.00 . A B . 13 VAL CA 1 1 14 11105 1 1 13 VAL CB C 5.817 6.165 -2.524 1.00 . A B . 13 VAL CB 1 1 14 11106 1 1 13 VAL CG1 C 5.555 4.688 -2.712 1.00 . A B . 13 VAL CG1 1 1 14 11107 1 1 13 VAL CG2 C 4.694 6.802 -1.729 1.00 . A B . 13 VAL CG2 1 1 14 11108 1 1 13 VAL H H 8.033 5.198 -3.344 1.00 . A B . 13 VAL H 1 1 14 11109 1 1 13 VAL HA H 7.357 7.480 -1.829 1.00 . A B . 13 VAL HA 1 1 14 11110 1 1 13 VAL HB H 5.838 6.622 -3.501 1.00 . A B . 13 VAL HB 1 1 14 11111 1 1 13 VAL HG11 H 4.615 4.555 -3.224 1.00 . A B . 13 VAL HG11 1 1 14 11112 1 1 13 VAL HG12 H 5.511 4.206 -1.749 1.00 . A B . 13 VAL HG12 1 1 14 11113 1 1 13 VAL HG13 H 6.348 4.252 -3.300 1.00 . A B . 13 VAL HG13 1 1 14 11114 1 1 13 VAL HG21 H 3.769 6.713 -2.277 1.00 . A B . 13 VAL HG21 1 1 14 11115 1 1 13 VAL HG22 H 4.919 7.845 -1.561 1.00 . A B . 13 VAL HG22 1 1 14 11116 1 1 13 VAL HG23 H 4.601 6.294 -0.782 1.00 . A B . 13 VAL HG23 1 1 14 11117 1 1 13 VAL N N 8.261 5.832 -2.630 1.00 . A B . 13 VAL N 1 1 14 11118 1 1 13 VAL O O 6.765 6.578 0.511 1.00 . A B . 13 VAL O 1 1 14 11119 1 1 14 CYS C C 8.895 5.002 1.939 1.00 . A B . 14 CYS C 1 1 14 11120 1 1 14 CYS CA C 7.911 4.160 1.144 1.00 . A B . 14 CYS CA 1 1 14 11121 1 1 14 CYS CB C 8.392 2.712 1.112 1.00 . A B . 14 CYS CB 1 1 14 11122 1 1 14 CYS H H 8.115 4.194 -0.971 1.00 . A B . 14 CYS H 1 1 14 11123 1 1 14 CYS HA H 6.947 4.204 1.625 1.00 . A B . 14 CYS HA 1 1 14 11124 1 1 14 CYS HB2 H 8.739 2.478 0.118 1.00 . A B . 14 CYS HB2 1 1 14 11125 1 1 14 CYS HB3 H 9.210 2.599 1.809 1.00 . A B . 14 CYS HB3 1 1 14 11126 1 1 14 CYS N N 7.765 4.700 -0.204 1.00 . A B . 14 CYS N 1 1 14 11127 1 1 14 CYS O O 8.712 5.238 3.133 1.00 . A B . 14 CYS O 1 1 14 11128 1 1 14 CYS SG S 7.125 1.504 1.550 1.00 . A B . 14 CYS SG 1 1 14 11129 1 1 15 ARG C C 10.439 7.689 2.117 1.00 . A B . 15 ARG C 1 1 14 11130 1 1 15 ARG CA C 10.959 6.282 1.871 1.00 . A B . 15 ARG CA 1 1 14 11131 1 1 15 ARG CB C 12.199 6.322 0.984 1.00 . A B . 15 ARG CB 1 1 14 11132 1 1 15 ARG CD C 13.997 5.046 -0.207 1.00 . A B . 15 ARG CD 1 1 14 11133 1 1 15 ARG CG C 12.811 4.955 0.734 1.00 . A B . 15 ARG CG 1 1 14 11134 1 1 15 ARG CZ C 15.518 3.498 -1.387 1.00 . A B . 15 ARG CZ 1 1 14 11135 1 1 15 ARG H H 9.987 5.261 0.294 1.00 . A B . 15 ARG H 1 1 14 11136 1 1 15 ARG HA H 11.214 5.834 2.816 1.00 . A B . 15 ARG HA 1 1 14 11137 1 1 15 ARG HB2 H 11.928 6.753 0.032 1.00 . A B . 15 ARG HB2 1 1 14 11138 1 1 15 ARG HB3 H 12.943 6.947 1.453 1.00 . A B . 15 ARG HB3 1 1 14 11139 1 1 15 ARG HD2 H 13.655 5.417 -1.161 1.00 . A B . 15 ARG HD2 1 1 14 11140 1 1 15 ARG HD3 H 14.714 5.737 0.209 1.00 . A B . 15 ARG HD3 1 1 14 11141 1 1 15 ARG HE H 14.431 3.033 0.231 1.00 . A B . 15 ARG HE 1 1 14 11142 1 1 15 ARG HG2 H 13.140 4.539 1.673 1.00 . A B . 15 ARG HG2 1 1 14 11143 1 1 15 ARG HG3 H 12.062 4.312 0.296 1.00 . A B . 15 ARG HG3 1 1 14 11144 1 1 15 ARG HH11 H 15.407 5.349 -2.204 1.00 . A B . 15 ARG HH11 1 1 14 11145 1 1 15 ARG HH12 H 16.483 4.252 -3.004 1.00 . A B . 15 ARG HH12 1 1 14 11146 1 1 15 ARG HH21 H 15.850 1.586 -0.817 1.00 . A B . 15 ARG HH21 1 1 14 11147 1 1 15 ARG HH22 H 16.734 2.106 -2.216 1.00 . A B . 15 ARG HH22 1 1 14 11148 1 1 15 ARG N N 9.927 5.466 1.252 1.00 . A B . 15 ARG N 1 1 14 11149 1 1 15 ARG NE N 14.648 3.752 -0.408 1.00 . A B . 15 ARG NE 1 1 14 11150 1 1 15 ARG NH1 N 15.826 4.443 -2.270 1.00 . A B . 15 ARG NH1 1 1 14 11151 1 1 15 ARG NH2 N 16.078 2.302 -1.481 1.00 . A B . 15 ARG NH2 1 1 14 11152 1 1 15 ARG O O 10.859 8.371 3.051 1.00 . A B . 15 ARG O 1 1 14 11153 1 1 16 ASP C C 7.851 9.386 2.551 1.00 . A B . 16 ASP C 1 1 14 11154 1 1 16 ASP CA C 8.868 9.410 1.409 1.00 . A B . 16 ASP CA 1 1 14 11155 1 1 16 ASP CB C 8.185 9.798 0.092 1.00 . A B . 16 ASP CB 1 1 14 11156 1 1 16 ASP CG C 7.614 11.205 0.111 1.00 . A B . 16 ASP CG 1 1 14 11157 1 1 16 ASP H H 9.274 7.536 0.510 1.00 . A B . 16 ASP H 1 1 14 11158 1 1 16 ASP HA H 9.633 10.135 1.640 1.00 . A B . 16 ASP HA 1 1 14 11159 1 1 16 ASP HB2 H 8.907 9.735 -0.708 1.00 . A B . 16 ASP HB2 1 1 14 11160 1 1 16 ASP HB3 H 7.380 9.105 -0.104 1.00 . A B . 16 ASP HB3 1 1 14 11161 1 1 16 ASP N N 9.512 8.109 1.270 1.00 . A B . 16 ASP N 1 1 14 11162 1 1 16 ASP O O 7.325 10.421 2.964 1.00 . A B . 16 ASP O 1 1 14 11163 1 1 16 ASP OD1 O 8.395 12.171 0.241 1.00 . A B . 16 ASP OD1 1 1 14 11164 1 1 16 ASP OD2 O 6.377 11.352 0.011 1.00 . A B . 16 ASP OD2 1 1 14 11165 1 1 17 GLY C C 5.224 7.943 3.663 1.00 . A B . 17 GLY C 1 1 14 11166 1 1 17 GLY CA C 6.650 8.044 4.160 1.00 . A B . 17 GLY CA 1 1 14 11167 1 1 17 GLY H H 8.074 7.410 2.732 1.00 . A B . 17 GLY H 1 1 14 11168 1 1 17 GLY HA2 H 6.891 7.148 4.715 1.00 . A B . 17 GLY HA2 1 1 14 11169 1 1 17 GLY HA3 H 6.731 8.898 4.818 1.00 . A B . 17 GLY HA3 1 1 14 11170 1 1 17 GLY N N 7.598 8.194 3.076 1.00 . A B . 17 GLY N 1 1 14 11171 1 1 17 GLY O O 4.294 8.374 4.341 1.00 . A B . 17 GLY O 1 1 14 11172 1 1 18 GLY C C 2.944 6.151 2.635 1.00 . A B . 18 GLY C 1 1 14 11173 1 1 18 GLY CA C 3.734 7.219 1.914 1.00 . A B . 18 GLY CA 1 1 14 11174 1 1 18 GLY H H 5.843 7.103 1.954 1.00 . A B . 18 GLY H 1 1 14 11175 1 1 18 GLY HA2 H 3.202 8.155 1.981 1.00 . A B . 18 GLY HA2 1 1 14 11176 1 1 18 GLY HA3 H 3.822 6.944 0.876 1.00 . A B . 18 GLY HA3 1 1 14 11177 1 1 18 GLY N N 5.057 7.391 2.468 1.00 . A B . 18 GLY N 1 1 14 11178 1 1 18 GLY O O 3.403 5.015 2.770 1.00 . A B . 18 GLY O 1 1 14 11179 1 1 19 GLU C C 0.470 4.447 2.913 1.00 . A B . 19 GLU C 1 1 14 11180 1 1 19 GLU CA C 0.871 5.616 3.798 1.00 . A B . 19 GLU CA 1 1 14 11181 1 1 19 GLU CB C -0.389 6.356 4.261 1.00 . A B . 19 GLU CB 1 1 14 11182 1 1 19 GLU CD C 0.900 7.573 6.071 1.00 . A B . 19 GLU CD 1 1 14 11183 1 1 19 GLU CG C -0.355 6.813 5.712 1.00 . A B . 19 GLU CG 1 1 14 11184 1 1 19 GLU H H 1.481 7.451 2.964 1.00 . A B . 19 GLU H 1 1 14 11185 1 1 19 GLU HA H 1.393 5.238 4.661 1.00 . A B . 19 GLU HA 1 1 14 11186 1 1 19 GLU HB2 H -0.524 7.227 3.638 1.00 . A B . 19 GLU HB2 1 1 14 11187 1 1 19 GLU HB3 H -1.241 5.703 4.131 1.00 . A B . 19 GLU HB3 1 1 14 11188 1 1 19 GLU HG2 H -1.203 7.455 5.890 1.00 . A B . 19 GLU HG2 1 1 14 11189 1 1 19 GLU HG3 H -0.428 5.945 6.351 1.00 . A B . 19 GLU HG3 1 1 14 11190 1 1 19 GLU N N 1.763 6.527 3.098 1.00 . A B . 19 GLU N 1 1 14 11191 1 1 19 GLU O O 0.234 4.608 1.716 1.00 . A B . 19 GLU O 1 1 14 11192 1 1 19 GLU OE1 O 1.055 8.725 5.626 1.00 . A B . 19 GLU OE1 1 1 14 11193 1 1 19 GLU OE2 O 1.732 7.025 6.824 1.00 . A B . 19 GLU OE2 1 1 14 11194 1 1 20 LEU C C -1.605 2.029 2.997 1.00 . A B . 20 LEU C 1 1 14 11195 1 1 20 LEU CA C -0.096 2.095 2.840 1.00 . A B . 20 LEU CA 1 1 14 11196 1 1 20 LEU CB C 0.540 0.832 3.420 1.00 . A B . 20 LEU CB 1 1 14 11197 1 1 20 LEU CD1 C 2.605 -0.546 3.744 1.00 . A B . 20 LEU CD1 1 1 14 11198 1 1 20 LEU CD2 C 1.753 -0.123 1.445 1.00 . A B . 20 LEU CD2 1 1 14 11199 1 1 20 LEU CG C 1.907 0.457 2.844 1.00 . A B . 20 LEU CG 1 1 14 11200 1 1 20 LEU H H 0.717 3.201 4.441 1.00 . A B . 20 LEU H 1 1 14 11201 1 1 20 LEU HA H 0.153 2.172 1.792 1.00 . A B . 20 LEU HA 1 1 14 11202 1 1 20 LEU HB2 H 0.647 0.969 4.487 1.00 . A B . 20 LEU HB2 1 1 14 11203 1 1 20 LEU HB3 H -0.138 0.011 3.247 1.00 . A B . 20 LEU HB3 1 1 14 11204 1 1 20 LEU HD11 H 2.818 -0.089 4.699 1.00 . A B . 20 LEU HD11 1 1 14 11205 1 1 20 LEU HD12 H 3.529 -0.864 3.281 1.00 . A B . 20 LEU HD12 1 1 14 11206 1 1 20 LEU HD13 H 1.964 -1.402 3.891 1.00 . A B . 20 LEU HD13 1 1 14 11207 1 1 20 LEU HD21 H 2.722 -0.432 1.077 1.00 . A B . 20 LEU HD21 1 1 14 11208 1 1 20 LEU HD22 H 1.341 0.626 0.784 1.00 . A B . 20 LEU HD22 1 1 14 11209 1 1 20 LEU HD23 H 1.094 -0.975 1.479 1.00 . A B . 20 LEU HD23 1 1 14 11210 1 1 20 LEU HG H 2.524 1.343 2.780 1.00 . A B . 20 LEU HG 1 1 14 11211 1 1 20 LEU N N 0.413 3.274 3.513 1.00 . A B . 20 LEU N 1 1 14 11212 1 1 20 LEU O O -2.116 1.988 4.117 1.00 . A B . 20 LEU O 1 1 14 11213 1 1 21 PHE C C -4.241 0.526 1.738 1.00 . A B . 21 PHE C 1 1 14 11214 1 1 21 PHE CA C -3.773 1.963 1.923 1.00 . A B . 21 PHE CA 1 1 14 11215 1 1 21 PHE CB C -4.374 2.884 0.851 1.00 . A B . 21 PHE CB 1 1 14 11216 1 1 21 PHE CD1 C -4.846 5.072 2.002 1.00 . A B . 21 PHE CD1 1 1 14 11217 1 1 21 PHE CD2 C -3.033 4.983 0.450 1.00 . A B . 21 PHE CD2 1 1 14 11218 1 1 21 PHE CE1 C -4.571 6.404 2.248 1.00 . A B . 21 PHE CE1 1 1 14 11219 1 1 21 PHE CE2 C -2.760 6.316 0.692 1.00 . A B . 21 PHE CE2 1 1 14 11220 1 1 21 PHE CG C -4.080 4.343 1.100 1.00 . A B . 21 PHE CG 1 1 14 11221 1 1 21 PHE CZ C -3.528 7.027 1.592 1.00 . A B . 21 PHE CZ 1 1 14 11222 1 1 21 PHE H H -1.865 2.012 1.012 1.00 . A B . 21 PHE H 1 1 14 11223 1 1 21 PHE HA H -4.087 2.306 2.901 1.00 . A B . 21 PHE HA 1 1 14 11224 1 1 21 PHE HB2 H -3.968 2.618 -0.117 1.00 . A B . 21 PHE HB2 1 1 14 11225 1 1 21 PHE HB3 H -5.449 2.755 0.833 1.00 . A B . 21 PHE HB3 1 1 14 11226 1 1 21 PHE HD1 H -5.664 4.591 2.519 1.00 . A B . 21 PHE HD1 1 1 14 11227 1 1 21 PHE HD2 H -2.428 4.434 -0.256 1.00 . A B . 21 PHE HD2 1 1 14 11228 1 1 21 PHE HE1 H -5.175 6.959 2.951 1.00 . A B . 21 PHE HE1 1 1 14 11229 1 1 21 PHE HE2 H -1.942 6.802 0.178 1.00 . A B . 21 PHE HE2 1 1 14 11230 1 1 21 PHE HZ H -3.314 8.068 1.785 1.00 . A B . 21 PHE HZ 1 1 14 11231 1 1 21 PHE N N -2.319 2.014 1.886 1.00 . A B . 21 PHE N 1 1 14 11232 1 1 21 PHE O O -5.170 0.241 0.981 1.00 . A B . 21 PHE O 1 1 14 11233 1 1 22 CYS C C -3.599 -2.477 3.695 1.00 . A B . 22 CYS C 1 1 14 11234 1 1 22 CYS CA C -3.861 -1.793 2.355 1.00 . A B . 22 CYS CA 1 1 14 11235 1 1 22 CYS CB C -3.009 -2.434 1.261 1.00 . A B . 22 CYS CB 1 1 14 11236 1 1 22 CYS H H -2.786 -0.081 2.952 1.00 . A B . 22 CYS H 1 1 14 11237 1 1 22 CYS HA H -4.903 -1.900 2.098 1.00 . A B . 22 CYS HA 1 1 14 11238 1 1 22 CYS HB2 H -2.023 -1.985 1.282 1.00 . A B . 22 CYS HB2 1 1 14 11239 1 1 22 CYS HB3 H -2.918 -3.490 1.448 1.00 . A B . 22 CYS HB3 1 1 14 11240 1 1 22 CYS N N -3.556 -0.377 2.422 1.00 . A B . 22 CYS N 1 1 14 11241 1 1 22 CYS O O -2.914 -1.926 4.561 1.00 . A B . 22 CYS O 1 1 14 11242 1 1 22 CYS SG S -3.665 -2.217 -0.421 1.00 . A B . 22 CYS SG 1 1 14 11243 1 1 23 CYS C C -2.464 -5.013 4.985 1.00 . A B . 23 CYS C 1 1 14 11244 1 1 23 CYS CA C -3.890 -4.487 5.050 1.00 . A B . 23 CYS CA 1 1 14 11245 1 1 23 CYS CB C -4.861 -5.668 5.129 1.00 . A B . 23 CYS CB 1 1 14 11246 1 1 23 CYS H H -4.712 -4.040 3.152 1.00 . A B . 23 CYS H 1 1 14 11247 1 1 23 CYS HA H -4.005 -3.857 5.921 1.00 . A B . 23 CYS HA 1 1 14 11248 1 1 23 CYS HB2 H -4.567 -6.411 4.403 1.00 . A B . 23 CYS HB2 1 1 14 11249 1 1 23 CYS HB3 H -4.815 -6.100 6.120 1.00 . A B . 23 CYS HB3 1 1 14 11250 1 1 23 CYS N N -4.148 -3.681 3.859 1.00 . A B . 23 CYS N 1 1 14 11251 1 1 23 CYS O O -1.871 -5.000 3.913 1.00 . A B . 23 CYS O 1 1 14 11252 1 1 23 CYS SG S -6.579 -5.237 4.796 1.00 . A B . 23 CYS SG 1 1 14 11253 1 1 24 ASP C C -0.295 -6.998 5.010 1.00 . A B . 24 ASP C 1 1 14 11254 1 1 24 ASP CA C -0.536 -5.975 6.121 1.00 . A B . 24 ASP CA 1 1 14 11255 1 1 24 ASP CB C -0.192 -6.585 7.486 1.00 . A B . 24 ASP CB 1 1 14 11256 1 1 24 ASP CG C -0.160 -5.551 8.594 1.00 . A B . 24 ASP CG 1 1 14 11257 1 1 24 ASP H H -2.453 -5.509 6.923 1.00 . A B . 24 ASP H 1 1 14 11258 1 1 24 ASP HA H 0.109 -5.127 5.949 1.00 . A B . 24 ASP HA 1 1 14 11259 1 1 24 ASP HB2 H -0.930 -7.330 7.737 1.00 . A B . 24 ASP HB2 1 1 14 11260 1 1 24 ASP HB3 H 0.779 -7.053 7.427 1.00 . A B . 24 ASP HB3 1 1 14 11261 1 1 24 ASP N N -1.919 -5.487 6.098 1.00 . A B . 24 ASP N 1 1 14 11262 1 1 24 ASP O O 0.687 -6.908 4.274 1.00 . A B . 24 ASP O 1 1 14 11263 1 1 24 ASP OD1 O 0.877 -4.876 8.760 1.00 . A B . 24 ASP OD1 1 1 14 11264 1 1 24 ASP OD2 O -1.176 -5.404 9.308 1.00 . A B . 24 ASP OD2 1 1 14 11265 1 1 25 THR C C -1.332 -8.352 2.447 1.00 . A B . 25 THR C 1 1 14 11266 1 1 25 THR CA C -1.131 -8.958 3.838 1.00 . A B . 25 THR CA 1 1 14 11267 1 1 25 THR CB C -2.165 -10.070 4.082 1.00 . A B . 25 THR CB 1 1 14 11268 1 1 25 THR CG2 C -2.048 -11.173 3.041 1.00 . A B . 25 THR CG2 1 1 14 11269 1 1 25 THR H H -1.966 -7.966 5.506 1.00 . A B . 25 THR H 1 1 14 11270 1 1 25 THR HA H -0.148 -9.399 3.887 1.00 . A B . 25 THR HA 1 1 14 11271 1 1 25 THR HB H -3.154 -9.639 4.024 1.00 . A B . 25 THR HB 1 1 14 11272 1 1 25 THR HG1 H -2.827 -10.856 5.773 1.00 . A B . 25 THR HG1 1 1 14 11273 1 1 25 THR HG21 H -1.056 -11.597 3.076 1.00 . A B . 25 THR HG21 1 1 14 11274 1 1 25 THR HG22 H -2.226 -10.761 2.058 1.00 . A B . 25 THR HG22 1 1 14 11275 1 1 25 THR HG23 H -2.777 -11.943 3.246 1.00 . A B . 25 THR HG23 1 1 14 11276 1 1 25 THR N N -1.216 -7.942 4.876 1.00 . A B . 25 THR N 1 1 14 11277 1 1 25 THR O O -0.556 -8.616 1.529 1.00 . A B . 25 THR O 1 1 14 11278 1 1 25 THR OG1 O -1.970 -10.621 5.394 1.00 . A B . 25 THR OG1 1 1 14 11279 1 1 26 CYS C C -1.482 -6.020 0.552 1.00 . A B . 26 CYS C 1 1 14 11280 1 1 26 CYS CA C -2.658 -6.889 1.015 1.00 . A B . 26 CYS CA 1 1 14 11281 1 1 26 CYS CB C -3.946 -6.053 1.119 1.00 . A B . 26 CYS CB 1 1 14 11282 1 1 26 CYS H H -2.927 -7.319 3.073 1.00 . A B . 26 CYS H 1 1 14 11283 1 1 26 CYS HA H -2.807 -7.680 0.293 1.00 . A B . 26 CYS HA 1 1 14 11284 1 1 26 CYS HB2 H -3.793 -5.261 1.830 1.00 . A B . 26 CYS HB2 1 1 14 11285 1 1 26 CYS HB3 H -4.172 -5.629 0.150 1.00 . A B . 26 CYS HB3 1 1 14 11286 1 1 26 CYS N N -2.359 -7.516 2.301 1.00 . A B . 26 CYS N 1 1 14 11287 1 1 26 CYS O O -1.120 -6.022 -0.624 1.00 . A B . 26 CYS O 1 1 14 11288 1 1 26 CYS SG S -5.395 -6.989 1.664 1.00 . A B . 26 CYS SG 1 1 14 11289 1 1 27 SER C C 1.496 -5.215 0.796 1.00 . A B . 27 SER C 1 1 14 11290 1 1 27 SER CA C 0.255 -4.432 1.214 1.00 . A B . 27 SER CA 1 1 14 11291 1 1 27 SER CB C 0.588 -3.582 2.440 1.00 . A B . 27 SER CB 1 1 14 11292 1 1 27 SER H H -1.229 -5.358 2.414 1.00 . A B . 27 SER H 1 1 14 11293 1 1 27 SER HA H -0.029 -3.779 0.404 1.00 . A B . 27 SER HA 1 1 14 11294 1 1 27 SER HB2 H 0.843 -4.230 3.265 1.00 . A B . 27 SER HB2 1 1 14 11295 1 1 27 SER HB3 H 1.427 -2.945 2.211 1.00 . A B . 27 SER HB3 1 1 14 11296 1 1 27 SER HG H -0.434 -2.555 3.756 1.00 . A B . 27 SER HG 1 1 14 11297 1 1 27 SER N N -0.877 -5.309 1.497 1.00 . A B . 27 SER N 1 1 14 11298 1 1 27 SER O O 2.382 -4.672 0.142 1.00 . A B . 27 SER O 1 1 14 11299 1 1 27 SER OG O -0.510 -2.772 2.823 1.00 . A B . 27 SER OG 1 1 14 11300 1 1 28 ARG C C 2.531 -7.916 -0.558 1.00 . A B . 28 ARG C 1 1 14 11301 1 1 28 ARG CA C 2.718 -7.298 0.821 1.00 . A B . 28 ARG CA 1 1 14 11302 1 1 28 ARG CB C 2.959 -8.385 1.873 1.00 . A B . 28 ARG CB 1 1 14 11303 1 1 28 ARG CD C 3.667 -8.949 4.231 1.00 . A B . 28 ARG CD 1 1 14 11304 1 1 28 ARG CG C 3.475 -7.843 3.201 1.00 . A B . 28 ARG CG 1 1 14 11305 1 1 28 ARG CZ C 5.545 -10.501 4.648 1.00 . A B . 28 ARG CZ 1 1 14 11306 1 1 28 ARG H H 0.848 -6.869 1.713 1.00 . A B . 28 ARG H 1 1 14 11307 1 1 28 ARG HA H 3.580 -6.649 0.788 1.00 . A B . 28 ARG HA 1 1 14 11308 1 1 28 ARG HB2 H 2.030 -8.902 2.056 1.00 . A B . 28 ARG HB2 1 1 14 11309 1 1 28 ARG HB3 H 3.684 -9.087 1.488 1.00 . A B . 28 ARG HB3 1 1 14 11310 1 1 28 ARG HD2 H 3.975 -8.502 5.164 1.00 . A B . 28 ARG HD2 1 1 14 11311 1 1 28 ARG HD3 H 2.728 -9.462 4.373 1.00 . A B . 28 ARG HD3 1 1 14 11312 1 1 28 ARG HE H 4.714 -10.153 2.860 1.00 . A B . 28 ARG HE 1 1 14 11313 1 1 28 ARG HG2 H 4.425 -7.358 3.034 1.00 . A B . 28 ARG HG2 1 1 14 11314 1 1 28 ARG HG3 H 2.765 -7.125 3.585 1.00 . A B . 28 ARG HG3 1 1 14 11315 1 1 28 ARG HH11 H 4.859 -9.557 6.309 1.00 . A B . 28 ARG HH11 1 1 14 11316 1 1 28 ARG HH12 H 6.173 -10.660 6.568 1.00 . A B . 28 ARG HH12 1 1 14 11317 1 1 28 ARG HH21 H 6.451 -11.600 3.205 1.00 . A B . 28 ARG HH21 1 1 14 11318 1 1 28 ARG HH22 H 7.083 -11.810 4.807 1.00 . A B . 28 ARG HH22 1 1 14 11319 1 1 28 ARG N N 1.573 -6.478 1.180 1.00 . A B . 28 ARG N 1 1 14 11320 1 1 28 ARG NE N 4.681 -9.919 3.815 1.00 . A B . 28 ARG NE 1 1 14 11321 1 1 28 ARG NH1 N 5.524 -10.214 5.945 1.00 . A B . 28 ARG NH1 1 1 14 11322 1 1 28 ARG NH2 N 6.429 -11.374 4.183 1.00 . A B . 28 ARG NH2 1 1 14 11323 1 1 28 ARG O O 3.497 -8.333 -1.198 1.00 . A B . 28 ARG O 1 1 14 11324 1 1 29 VAL C C 0.931 -7.412 -3.383 1.00 . A B . 29 VAL C 1 1 14 11325 1 1 29 VAL CA C 0.991 -8.521 -2.331 1.00 . A B . 29 VAL CA 1 1 14 11326 1 1 29 VAL CB C -0.338 -9.313 -2.330 1.00 . A B . 29 VAL CB 1 1 14 11327 1 1 29 VAL CG1 C -0.618 -9.912 -3.701 1.00 . A B . 29 VAL CG1 1 1 14 11328 1 1 29 VAL CG2 C -0.310 -10.407 -1.274 1.00 . A B . 29 VAL CG2 1 1 14 11329 1 1 29 VAL H H 0.547 -7.670 -0.451 1.00 . A B . 29 VAL H 1 1 14 11330 1 1 29 VAL HA H 1.786 -9.201 -2.591 1.00 . A B . 29 VAL HA 1 1 14 11331 1 1 29 VAL HB H -1.140 -8.633 -2.087 1.00 . A B . 29 VAL HB 1 1 14 11332 1 1 29 VAL HG11 H -1.559 -10.443 -3.675 1.00 . A B . 29 VAL HG11 1 1 14 11333 1 1 29 VAL HG12 H 0.174 -10.599 -3.963 1.00 . A B . 29 VAL HG12 1 1 14 11334 1 1 29 VAL HG13 H -0.669 -9.124 -4.437 1.00 . A B . 29 VAL HG13 1 1 14 11335 1 1 29 VAL HG21 H 0.527 -11.065 -1.459 1.00 . A B . 29 VAL HG21 1 1 14 11336 1 1 29 VAL HG22 H -1.229 -10.974 -1.321 1.00 . A B . 29 VAL HG22 1 1 14 11337 1 1 29 VAL HG23 H -0.212 -9.963 -0.295 1.00 . A B . 29 VAL HG23 1 1 14 11338 1 1 29 VAL N N 1.288 -7.978 -1.014 1.00 . A B . 29 VAL N 1 1 14 11339 1 1 29 VAL O O 1.597 -7.486 -4.415 1.00 . A B . 29 VAL O 1 1 14 11340 1 1 30 PHE C C 0.674 -4.025 -3.582 1.00 . A B . 30 PHE C 1 1 14 11341 1 1 30 PHE CA C -0.031 -5.283 -4.068 1.00 . A B . 30 PHE CA 1 1 14 11342 1 1 30 PHE CB C -1.523 -4.975 -4.264 1.00 . A B . 30 PHE CB 1 1 14 11343 1 1 30 PHE CD1 C -2.299 -6.788 -5.814 1.00 . A B . 30 PHE CD1 1 1 14 11344 1 1 30 PHE CD2 C -3.260 -6.685 -3.633 1.00 . A B . 30 PHE CD2 1 1 14 11345 1 1 30 PHE CE1 C -3.079 -7.889 -6.110 1.00 . A B . 30 PHE CE1 1 1 14 11346 1 1 30 PHE CE2 C -4.042 -7.787 -3.924 1.00 . A B . 30 PHE CE2 1 1 14 11347 1 1 30 PHE CG C -2.381 -6.173 -4.574 1.00 . A B . 30 PHE CG 1 1 14 11348 1 1 30 PHE CZ C -3.978 -8.379 -5.131 1.00 . A B . 30 PHE CZ 1 1 14 11349 1 1 30 PHE H H -0.275 -6.306 -2.223 1.00 . A B . 30 PHE H 1 1 14 11350 1 1 30 PHE HA H 0.401 -5.592 -5.009 1.00 . A B . 30 PHE HA 1 1 14 11351 1 1 30 PHE HB2 H -1.906 -4.524 -3.359 1.00 . A B . 30 PHE HB2 1 1 14 11352 1 1 30 PHE HB3 H -1.627 -4.270 -5.077 1.00 . A B . 30 PHE HB3 1 1 14 11353 1 1 30 PHE HD1 H -1.614 -6.402 -6.555 1.00 . A B . 30 PHE HD1 1 1 14 11354 1 1 30 PHE HD2 H -3.333 -6.218 -2.662 1.00 . A B . 30 PHE HD2 1 1 14 11355 1 1 30 PHE HE1 H -3.004 -8.357 -7.080 1.00 . A B . 30 PHE HE1 1 1 14 11356 1 1 30 PHE HE2 H -4.723 -8.177 -3.182 1.00 . A B . 30 PHE HE2 1 1 14 11357 1 1 30 PHE HZ H -4.599 -9.236 -5.347 1.00 . A B . 30 PHE HZ 1 1 14 11358 1 1 30 PHE N N 0.160 -6.366 -3.105 1.00 . A B . 30 PHE N 1 1 14 11359 1 1 30 PHE O O 0.123 -2.931 -3.662 1.00 . A B . 30 PHE O 1 1 14 11360 1 1 31 HIS C C 2.645 -1.823 -3.235 1.00 . A B . 31 HIS C 1 1 14 11361 1 1 31 HIS CA C 2.639 -3.122 -2.434 1.00 . A B . 31 HIS CA 1 1 14 11362 1 1 31 HIS CB C 4.075 -3.582 -2.175 1.00 . A B . 31 HIS CB 1 1 14 11363 1 1 31 HIS CD2 C 5.944 -1.849 -1.694 1.00 . A B . 31 HIS CD2 1 1 14 11364 1 1 31 HIS CE1 C 5.670 -1.609 0.440 1.00 . A B . 31 HIS CE1 1 1 14 11365 1 1 31 HIS CG C 4.896 -2.638 -1.343 1.00 . A B . 31 HIS CG 1 1 14 11366 1 1 31 HIS H H 2.331 -5.065 -3.212 1.00 . A B . 31 HIS H 1 1 14 11367 1 1 31 HIS HA H 2.157 -2.939 -1.487 1.00 . A B . 31 HIS HA 1 1 14 11368 1 1 31 HIS HB2 H 4.048 -4.532 -1.662 1.00 . A B . 31 HIS HB2 1 1 14 11369 1 1 31 HIS HB3 H 4.574 -3.710 -3.125 1.00 . A B . 31 HIS HB3 1 1 14 11370 1 1 31 HIS HD1 H 4.053 -2.915 0.574 1.00 . A B . 31 HIS HD1 1 1 14 11371 1 1 31 HIS HD2 H 6.330 -1.719 -2.691 1.00 . A B . 31 HIS HD2 1 1 14 11372 1 1 31 HIS HE1 H 5.779 -1.286 1.465 1.00 . A B . 31 HIS HE1 1 1 14 11373 1 1 31 HIS N N 1.902 -4.192 -3.108 1.00 . A B . 31 HIS N 1 1 14 11374 1 1 31 HIS ND1 N 4.735 -2.475 0.014 1.00 . A B . 31 HIS ND1 1 1 14 11375 1 1 31 HIS NE2 N 6.437 -1.204 -0.560 1.00 . A B . 31 HIS NE2 1 1 14 11376 1 1 31 HIS O O 2.261 -0.782 -2.722 1.00 . A B . 31 HIS O 1 1 14 11377 1 1 32 GLU C C 1.874 0.003 -5.565 1.00 . A B . 32 GLU C 1 1 14 11378 1 1 32 GLU CA C 3.199 -0.703 -5.319 1.00 . A B . 32 GLU CA 1 1 14 11379 1 1 32 GLU CB C 3.842 -1.068 -6.655 1.00 . A B . 32 GLU CB 1 1 14 11380 1 1 32 GLU CD C 5.809 -2.066 -7.871 1.00 . A B . 32 GLU CD 1 1 14 11381 1 1 32 GLU CG C 5.242 -1.649 -6.534 1.00 . A B . 32 GLU CG 1 1 14 11382 1 1 32 GLU H H 3.100 -2.784 -4.918 1.00 . A B . 32 GLU H 1 1 14 11383 1 1 32 GLU HA H 3.854 -0.034 -4.780 1.00 . A B . 32 GLU HA 1 1 14 11384 1 1 32 GLU HB2 H 3.217 -1.794 -7.152 1.00 . A B . 32 GLU HB2 1 1 14 11385 1 1 32 GLU HB3 H 3.897 -0.179 -7.265 1.00 . A B . 32 GLU HB3 1 1 14 11386 1 1 32 GLU HG2 H 5.892 -0.902 -6.103 1.00 . A B . 32 GLU HG2 1 1 14 11387 1 1 32 GLU HG3 H 5.209 -2.513 -5.887 1.00 . A B . 32 GLU HG3 1 1 14 11388 1 1 32 GLU N N 3.005 -1.901 -4.505 1.00 . A B . 32 GLU N 1 1 14 11389 1 1 32 GLU O O 1.793 1.234 -5.563 1.00 . A B . 32 GLU O 1 1 14 11390 1 1 32 GLU OE1 O 6.283 -1.188 -8.619 1.00 . A B . 32 GLU OE1 1 1 14 11391 1 1 32 GLU OE2 O 5.784 -3.278 -8.181 1.00 . A B . 32 GLU OE2 1 1 14 11392 1 1 33 ASP C C -1.157 0.225 -4.764 1.00 . A B . 33 ASP C 1 1 14 11393 1 1 33 ASP CA C -0.494 -0.280 -6.041 1.00 . A B . 33 ASP CA 1 1 14 11394 1 1 33 ASP CB C -1.358 -1.370 -6.682 1.00 . A B . 33 ASP CB 1 1 14 11395 1 1 33 ASP CG C -0.808 -1.862 -8.007 1.00 . A B . 33 ASP CG 1 1 14 11396 1 1 33 ASP H H 0.969 -1.764 -5.694 1.00 . A B . 33 ASP H 1 1 14 11397 1 1 33 ASP HA H -0.390 0.543 -6.733 1.00 . A B . 33 ASP HA 1 1 14 11398 1 1 33 ASP HB2 H -1.416 -2.212 -6.008 1.00 . A B . 33 ASP HB2 1 1 14 11399 1 1 33 ASP HB3 H -2.353 -0.982 -6.850 1.00 . A B . 33 ASP HB3 1 1 14 11400 1 1 33 ASP N N 0.836 -0.793 -5.755 1.00 . A B . 33 ASP N 1 1 14 11401 1 1 33 ASP O O -2.040 1.081 -4.803 1.00 . A B . 33 ASP O 1 1 14 11402 1 1 33 ASP OD1 O 0.144 -2.670 -7.998 1.00 . A B . 33 ASP OD1 1 1 14 11403 1 1 33 ASP OD2 O -1.310 -1.430 -9.067 1.00 . A B . 33 ASP OD2 1 1 14 11404 1 1 34 CYS C C -0.696 1.365 -1.812 1.00 . A B . 34 CYS C 1 1 14 11405 1 1 34 CYS CA C -1.265 0.045 -2.332 1.00 . A B . 34 CYS CA 1 1 14 11406 1 1 34 CYS CB C -1.004 -1.083 -1.330 1.00 . A B . 34 CYS CB 1 1 14 11407 1 1 34 CYS H H 0.012 -0.978 -3.676 1.00 . A B . 34 CYS H 1 1 14 11408 1 1 34 CYS HA H -2.334 0.158 -2.454 1.00 . A B . 34 CYS HA 1 1 14 11409 1 1 34 CYS HB2 H 0.029 -1.398 -1.415 1.00 . A B . 34 CYS HB2 1 1 14 11410 1 1 34 CYS HB3 H -1.184 -0.719 -0.329 1.00 . A B . 34 CYS HB3 1 1 14 11411 1 1 34 CYS N N -0.711 -0.310 -3.634 1.00 . A B . 34 CYS N 1 1 14 11412 1 1 34 CYS O O -1.050 1.819 -0.722 1.00 . A B . 34 CYS O 1 1 14 11413 1 1 34 CYS SG S -2.046 -2.557 -1.591 1.00 . A B . 34 CYS SG 1 1 14 11414 1 1 35 HIS C C 0.061 4.364 -3.121 1.00 . A B . 35 HIS C 1 1 14 11415 1 1 35 HIS CA C 0.729 3.291 -2.269 1.00 . A B . 35 HIS CA 1 1 14 11416 1 1 35 HIS CB C 2.237 3.335 -2.494 1.00 . A B . 35 HIS CB 1 1 14 11417 1 1 35 HIS CD2 C 3.483 1.345 -1.436 1.00 . A B . 35 HIS CD2 1 1 14 11418 1 1 35 HIS CE1 C 4.060 2.226 0.446 1.00 . A B . 35 HIS CE1 1 1 14 11419 1 1 35 HIS CG C 3.020 2.612 -1.446 1.00 . A B . 35 HIS CG 1 1 14 11420 1 1 35 HIS H H 0.515 1.504 -3.390 1.00 . A B . 35 HIS H 1 1 14 11421 1 1 35 HIS HA H 0.525 3.489 -1.226 1.00 . A B . 35 HIS HA 1 1 14 11422 1 1 35 HIS HB2 H 2.459 2.877 -3.449 1.00 . A B . 35 HIS HB2 1 1 14 11423 1 1 35 HIS HB3 H 2.562 4.365 -2.508 1.00 . A B . 35 HIS HB3 1 1 14 11424 1 1 35 HIS HD1 H 3.155 4.061 0.086 1.00 . A B . 35 HIS HD1 1 1 14 11425 1 1 35 HIS HD2 H 3.375 0.627 -2.238 1.00 . A B . 35 HIS HD2 1 1 14 11426 1 1 35 HIS HE1 H 4.478 2.377 1.430 1.00 . A B . 35 HIS HE1 1 1 14 11427 1 1 35 HIS N N 0.195 1.968 -2.589 1.00 . A B . 35 HIS N 1 1 14 11428 1 1 35 HIS ND1 N 3.388 3.162 -0.238 1.00 . A B . 35 HIS ND1 1 1 14 11429 1 1 35 HIS NE2 N 4.142 1.096 -0.241 1.00 . A B . 35 HIS NE2 1 1 14 11430 1 1 35 HIS O O 0.475 5.525 -3.117 1.00 . A B . 35 HIS O 1 1 14 11431 1 1 36 ILE C C -3.144 4.921 -4.356 1.00 . A B . 36 ILE C 1 1 14 11432 1 1 36 ILE CA C -1.670 4.866 -4.753 1.00 . A B . 36 ILE CA 1 1 14 11433 1 1 36 ILE CB C -1.544 4.407 -6.225 1.00 . A B . 36 ILE CB 1 1 14 11434 1 1 36 ILE CD1 C 0.152 3.719 -8.006 1.00 . A B . 36 ILE CD1 1 1 14 11435 1 1 36 ILE CG1 C -0.069 4.223 -6.595 1.00 . A B . 36 ILE CG1 1 1 14 11436 1 1 36 ILE CG2 C -2.207 5.406 -7.163 1.00 . A B . 36 ILE CG2 1 1 14 11437 1 1 36 ILE H H -1.230 3.022 -3.829 1.00 . A B . 36 ILE H 1 1 14 11438 1 1 36 ILE HA H -1.236 5.852 -4.658 1.00 . A B . 36 ILE HA 1 1 14 11439 1 1 36 ILE HB H -2.054 3.461 -6.325 1.00 . A B . 36 ILE HB 1 1 14 11440 1 1 36 ILE HD11 H -0.355 2.775 -8.137 1.00 . A B . 36 ILE HD11 1 1 14 11441 1 1 36 ILE HD12 H 1.211 3.585 -8.180 1.00 . A B . 36 ILE HD12 1 1 14 11442 1 1 36 ILE HD13 H -0.240 4.438 -8.711 1.00 . A B . 36 ILE HD13 1 1 14 11443 1 1 36 ILE HG12 H 0.440 5.170 -6.499 1.00 . A B . 36 ILE HG12 1 1 14 11444 1 1 36 ILE HG13 H 0.377 3.512 -5.915 1.00 . A B . 36 ILE HG13 1 1 14 11445 1 1 36 ILE HG21 H -1.704 6.358 -7.088 1.00 . A B . 36 ILE HG21 1 1 14 11446 1 1 36 ILE HG22 H -3.244 5.523 -6.888 1.00 . A B . 36 ILE HG22 1 1 14 11447 1 1 36 ILE HG23 H -2.141 5.043 -8.178 1.00 . A B . 36 ILE HG23 1 1 14 11448 1 1 36 ILE N N -0.952 3.960 -3.870 1.00 . A B . 36 ILE N 1 1 14 11449 1 1 36 ILE O O -3.761 3.880 -4.128 1.00 . A B . 36 ILE O 1 1 14 11450 1 1 37 PRO C C -2.109 7.808 -3.438 1.00 . A B . 37 PRO C 1 1 14 11451 1 1 37 PRO CA C -3.074 7.400 -4.549 1.00 . A B . 37 PRO CA 1 1 14 11452 1 1 37 PRO CB C -4.238 8.410 -4.626 1.00 . A B . 37 PRO CB 1 1 14 11453 1 1 37 PRO CD C -5.139 6.331 -3.877 1.00 . A B . 37 PRO CD 1 1 14 11454 1 1 37 PRO CG C -5.484 7.587 -4.619 1.00 . A B . 37 PRO CG 1 1 14 11455 1 1 37 PRO HA H -2.548 7.371 -5.492 1.00 . A B . 37 PRO HA 1 1 14 11456 1 1 37 PRO HB2 H -4.198 9.068 -3.767 1.00 . A B . 37 PRO HB2 1 1 14 11457 1 1 37 PRO HB3 H -4.155 8.993 -5.535 1.00 . A B . 37 PRO HB3 1 1 14 11458 1 1 37 PRO HD2 H -5.227 6.480 -2.810 1.00 . A B . 37 PRO HD2 1 1 14 11459 1 1 37 PRO HD3 H -5.760 5.507 -4.204 1.00 . A B . 37 PRO HD3 1 1 14 11460 1 1 37 PRO HG2 H -6.275 8.121 -4.107 1.00 . A B . 37 PRO HG2 1 1 14 11461 1 1 37 PRO HG3 H -5.780 7.357 -5.634 1.00 . A B . 37 PRO HG3 1 1 14 11462 1 1 37 PRO N N -3.742 6.121 -4.266 1.00 . A B . 37 PRO N 1 1 14 11463 1 1 37 PRO O O -2.278 7.407 -2.287 1.00 . A B . 37 PRO O 1 1 14 11464 1 1 38 PRO C C -0.840 9.859 -1.670 1.00 . A B . 38 PRO C 1 1 14 11465 1 1 38 PRO CA C -0.123 9.125 -2.798 1.00 . A B . 38 PRO CA 1 1 14 11466 1 1 38 PRO CB C 0.742 10.098 -3.604 1.00 . A B . 38 PRO CB 1 1 14 11467 1 1 38 PRO CD C -0.746 9.029 -5.154 1.00 . A B . 38 PRO CD 1 1 14 11468 1 1 38 PRO CG C 0.634 9.626 -5.015 1.00 . A B . 38 PRO CG 1 1 14 11469 1 1 38 PRO HA H 0.495 8.340 -2.386 1.00 . A B . 38 PRO HA 1 1 14 11470 1 1 38 PRO HB2 H 0.359 11.103 -3.487 1.00 . A B . 38 PRO HB2 1 1 14 11471 1 1 38 PRO HB3 H 1.762 10.054 -3.248 1.00 . A B . 38 PRO HB3 1 1 14 11472 1 1 38 PRO HD2 H -1.451 9.773 -5.502 1.00 . A B . 38 PRO HD2 1 1 14 11473 1 1 38 PRO HD3 H -0.727 8.182 -5.828 1.00 . A B . 38 PRO HD3 1 1 14 11474 1 1 38 PRO HG2 H 0.756 10.460 -5.695 1.00 . A B . 38 PRO HG2 1 1 14 11475 1 1 38 PRO HG3 H 1.389 8.875 -5.206 1.00 . A B . 38 PRO HG3 1 1 14 11476 1 1 38 PRO N N -1.074 8.600 -3.782 1.00 . A B . 38 PRO N 1 1 14 11477 1 1 38 PRO O O -1.720 10.685 -1.918 1.00 . A B . 38 PRO O 1 1 14 11478 1 1 39 VAL C C -1.029 11.609 0.808 1.00 . A B . 39 VAL C 1 1 14 11479 1 1 39 VAL CA C -1.144 10.084 0.730 1.00 . A B . 39 VAL CA 1 1 14 11480 1 1 39 VAL CB C -0.627 9.434 2.034 1.00 . A B . 39 VAL CB 1 1 14 11481 1 1 39 VAL CG1 C 0.871 9.626 2.203 1.00 . A B . 39 VAL CG1 1 1 14 11482 1 1 39 VAL CG2 C -1.378 9.975 3.237 1.00 . A B . 39 VAL CG2 1 1 14 11483 1 1 39 VAL H H 0.287 8.933 -0.311 1.00 . A B . 39 VAL H 1 1 14 11484 1 1 39 VAL HA H -2.187 9.831 0.633 1.00 . A B . 39 VAL HA 1 1 14 11485 1 1 39 VAL HB H -0.820 8.376 1.972 1.00 . A B . 39 VAL HB 1 1 14 11486 1 1 39 VAL HG11 H 1.109 10.674 2.125 1.00 . A B . 39 VAL HG11 1 1 14 11487 1 1 39 VAL HG12 H 1.394 9.078 1.436 1.00 . A B . 39 VAL HG12 1 1 14 11488 1 1 39 VAL HG13 H 1.173 9.259 3.174 1.00 . A B . 39 VAL HG13 1 1 14 11489 1 1 39 VAL HG21 H -1.203 11.037 3.324 1.00 . A B . 39 VAL HG21 1 1 14 11490 1 1 39 VAL HG22 H -1.029 9.478 4.131 1.00 . A B . 39 VAL HG22 1 1 14 11491 1 1 39 VAL HG23 H -2.435 9.793 3.113 1.00 . A B . 39 VAL HG23 1 1 14 11492 1 1 39 VAL N N -0.465 9.546 -0.438 1.00 . A B . 39 VAL N 1 1 14 11493 1 1 39 VAL O O 0.063 12.170 0.921 1.00 . A B . 39 VAL O 1 1 14 11494 1 1 40 GLU C C -3.240 14.096 1.926 1.00 . A B . 40 GLU C 1 1 14 11495 1 1 40 GLU CA C -2.248 13.713 0.833 1.00 . A B . 40 GLU CA 1 1 14 11496 1 1 40 GLU CB C -2.671 14.347 -0.497 1.00 . A B . 40 GLU CB 1 1 14 11497 1 1 40 GLU CD C -0.314 14.873 -1.263 1.00 . A B . 40 GLU CD 1 1 14 11498 1 1 40 GLU CG C -1.637 14.216 -1.605 1.00 . A B . 40 GLU CG 1 1 14 11499 1 1 40 GLU H H -3.003 11.758 0.578 1.00 . A B . 40 GLU H 1 1 14 11500 1 1 40 GLU HA H -1.268 14.075 1.102 1.00 . A B . 40 GLU HA 1 1 14 11501 1 1 40 GLU HB2 H -3.583 13.876 -0.830 1.00 . A B . 40 GLU HB2 1 1 14 11502 1 1 40 GLU HB3 H -2.860 15.397 -0.333 1.00 . A B . 40 GLU HB3 1 1 14 11503 1 1 40 GLU HG2 H -1.460 13.168 -1.791 1.00 . A B . 40 GLU HG2 1 1 14 11504 1 1 40 GLU HG3 H -2.029 14.676 -2.500 1.00 . A B . 40 GLU HG3 1 1 14 11505 1 1 40 GLU N N -2.174 12.267 0.721 1.00 . A B . 40 GLU N 1 1 14 11506 1 1 40 GLU O O -4.447 14.166 1.680 1.00 . A B . 40 GLU O 1 1 14 11507 1 1 40 GLU OE1 O -0.310 15.817 -0.444 1.00 . A B . 40 GLU OE1 1 1 14 11508 1 1 40 GLU OE2 O 0.732 14.449 -1.800 1.00 . A B . 40 GLU OE2 1 1 14 11509 1 1 41 ALA C C -4.405 13.579 4.840 1.00 . A B . 41 ALA C 1 1 14 11510 1 1 41 ALA CA C -3.508 14.700 4.309 1.00 . A B . 41 ALA CA 1 1 14 11511 1 1 41 ALA CB C -4.330 15.944 4.006 1.00 . A B . 41 ALA CB 1 1 14 11512 1 1 41 ALA H H -1.756 14.162 3.256 1.00 . A B . 41 ALA H 1 1 14 11513 1 1 41 ALA HA H -2.807 14.959 5.085 1.00 . A B . 41 ALA HA 1 1 14 11514 1 1 41 ALA HB1 H -4.787 16.303 4.916 1.00 . A B . 41 ALA HB1 1 1 14 11515 1 1 41 ALA HB2 H -5.101 15.697 3.289 1.00 . A B . 41 ALA HB2 1 1 14 11516 1 1 41 ALA HB3 H -3.689 16.709 3.596 1.00 . A B . 41 ALA HB3 1 1 14 11517 1 1 41 ALA N N -2.720 14.291 3.139 1.00 . A B . 41 ALA N 1 1 14 11518 1 1 41 ALA O O -4.809 13.602 6.003 1.00 . A B . 41 ALA O 1 1 14 11519 1 1 42 GLU C C -4.698 10.289 4.768 1.00 . A B . 42 GLU C 1 1 14 11520 1 1 42 GLU CA C -5.557 11.490 4.404 1.00 . A B . 42 GLU CA 1 1 14 11521 1 1 42 GLU CB C -6.524 11.122 3.280 1.00 . A B . 42 GLU CB 1 1 14 11522 1 1 42 GLU CD C -8.170 11.944 1.563 1.00 . A B . 42 GLU CD 1 1 14 11523 1 1 42 GLU CG C -7.344 12.297 2.779 1.00 . A B . 42 GLU CG 1 1 14 11524 1 1 42 GLU H H -4.351 12.629 3.091 1.00 . A B . 42 GLU H 1 1 14 11525 1 1 42 GLU HA H -6.120 11.797 5.271 1.00 . A B . 42 GLU HA 1 1 14 11526 1 1 42 GLU HB2 H -5.961 10.722 2.451 1.00 . A B . 42 GLU HB2 1 1 14 11527 1 1 42 GLU HB3 H -7.204 10.364 3.640 1.00 . A B . 42 GLU HB3 1 1 14 11528 1 1 42 GLU HG2 H -8.008 12.618 3.567 1.00 . A B . 42 GLU HG2 1 1 14 11529 1 1 42 GLU HG3 H -6.673 13.105 2.521 1.00 . A B . 42 GLU HG3 1 1 14 11530 1 1 42 GLU N N -4.709 12.603 4.003 1.00 . A B . 42 GLU N 1 1 14 11531 1 1 42 GLU O O -4.630 9.308 4.027 1.00 . A B . 42 GLU O 1 1 14 11532 1 1 42 GLU OE1 O -7.626 11.974 0.438 1.00 . A B . 42 GLU OE1 1 1 14 11533 1 1 42 GLU OE2 O -9.370 11.638 1.723 1.00 . A B . 42 GLU OE2 1 1 14 11534 1 1 43 ARG C C -3.918 8.201 7.016 1.00 . A B . 43 ARG C 1 1 14 11535 1 1 43 ARG CA C -3.137 9.313 6.337 1.00 . A B . 43 ARG CA 1 1 14 11536 1 1 43 ARG CB C -2.063 9.848 7.280 1.00 . A B . 43 ARG CB 1 1 14 11537 1 1 43 ARG CD C 0.089 11.113 7.399 1.00 . A B . 43 ARG CD 1 1 14 11538 1 1 43 ARG CG C -1.253 10.997 6.703 1.00 . A B . 43 ARG CG 1 1 14 11539 1 1 43 ARG CZ C 1.871 12.258 6.130 1.00 . A B . 43 ARG CZ 1 1 14 11540 1 1 43 ARG H H -4.158 11.161 6.481 1.00 . A B . 43 ARG H 1 1 14 11541 1 1 43 ARG HA H -2.660 8.910 5.456 1.00 . A B . 43 ARG HA 1 1 14 11542 1 1 43 ARG HB2 H -2.538 10.192 8.187 1.00 . A B . 43 ARG HB2 1 1 14 11543 1 1 43 ARG HB3 H -1.385 9.045 7.523 1.00 . A B . 43 ARG HB3 1 1 14 11544 1 1 43 ARG HD2 H -0.078 11.175 8.464 1.00 . A B . 43 ARG HD2 1 1 14 11545 1 1 43 ARG HD3 H 0.669 10.230 7.179 1.00 . A B . 43 ARG HD3 1 1 14 11546 1 1 43 ARG HE H 0.568 13.158 7.353 1.00 . A B . 43 ARG HE 1 1 14 11547 1 1 43 ARG HG2 H -1.090 10.820 5.651 1.00 . A B . 43 ARG HG2 1 1 14 11548 1 1 43 ARG HG3 H -1.803 11.918 6.837 1.00 . A B . 43 ARG HG3 1 1 14 11549 1 1 43 ARG HH11 H 1.713 10.269 5.705 1.00 . A B . 43 ARG HH11 1 1 14 11550 1 1 43 ARG HH12 H 3.011 11.113 4.907 1.00 . A B . 43 ARG HH12 1 1 14 11551 1 1 43 ARG HH21 H 2.264 14.239 6.298 1.00 . A B . 43 ARG HH21 1 1 14 11552 1 1 43 ARG HH22 H 3.317 13.361 5.234 1.00 . A B . 43 ARG HH22 1 1 14 11553 1 1 43 ARG N N -4.032 10.373 5.907 1.00 . A B . 43 ARG N 1 1 14 11554 1 1 43 ARG NE N 0.837 12.291 6.969 1.00 . A B . 43 ARG NE 1 1 14 11555 1 1 43 ARG NH1 N 2.227 11.126 5.533 1.00 . A B . 43 ARG NH1 1 1 14 11556 1 1 43 ARG NH2 N 2.537 13.374 5.867 1.00 . A B . 43 ARG NH2 1 1 14 11557 1 1 43 ARG O O -3.888 8.055 8.239 1.00 . A B . 43 ARG O 1 1 14 11558 1 1 44 THR C C -4.860 4.977 6.324 1.00 . A B . 44 THR C 1 1 14 11559 1 1 44 THR CA C -5.434 6.339 6.719 1.00 . A B . 44 THR CA 1 1 14 11560 1 1 44 THR CB C -6.878 6.456 6.193 1.00 . A B . 44 THR CB 1 1 14 11561 1 1 44 THR CG2 C -7.577 7.668 6.786 1.00 . A B . 44 THR CG2 1 1 14 11562 1 1 44 THR H H -4.596 7.598 5.246 1.00 . A B . 44 THR H 1 1 14 11563 1 1 44 THR HA H -5.456 6.416 7.795 1.00 . A B . 44 THR HA 1 1 14 11564 1 1 44 THR HB H -7.422 5.566 6.477 1.00 . A B . 44 THR HB 1 1 14 11565 1 1 44 THR HG1 H -6.328 5.852 4.393 1.00 . A B . 44 THR HG1 1 1 14 11566 1 1 44 THR HG21 H -7.608 7.575 7.860 1.00 . A B . 44 THR HG21 1 1 14 11567 1 1 44 THR HG22 H -8.584 7.727 6.399 1.00 . A B . 44 THR HG22 1 1 14 11568 1 1 44 THR HG23 H -7.034 8.562 6.516 1.00 . A B . 44 THR HG23 1 1 14 11569 1 1 44 THR N N -4.618 7.424 6.212 1.00 . A B . 44 THR N 1 1 14 11570 1 1 44 THR O O -5.212 4.427 5.279 1.00 . A B . 44 THR O 1 1 14 11571 1 1 44 THR OG1 O -6.869 6.564 4.761 1.00 . A B . 44 THR OG1 1 1 14 11572 1 1 45 PRO C C -4.400 1.970 7.167 1.00 . A B . 45 PRO C 1 1 14 11573 1 1 45 PRO CA C -3.387 3.084 6.903 1.00 . A B . 45 PRO CA 1 1 14 11574 1 1 45 PRO CB C -2.218 2.994 7.900 1.00 . A B . 45 PRO CB 1 1 14 11575 1 1 45 PRO CD C -3.428 5.005 8.378 1.00 . A B . 45 PRO CD 1 1 14 11576 1 1 45 PRO CG C -2.073 4.365 8.480 1.00 . A B . 45 PRO CG 1 1 14 11577 1 1 45 PRO HA H -3.016 2.999 5.893 1.00 . A B . 45 PRO HA 1 1 14 11578 1 1 45 PRO HB2 H -2.455 2.268 8.664 1.00 . A B . 45 PRO HB2 1 1 14 11579 1 1 45 PRO HB3 H -1.321 2.692 7.376 1.00 . A B . 45 PRO HB3 1 1 14 11580 1 1 45 PRO HD2 H -4.037 4.747 9.236 1.00 . A B . 45 PRO HD2 1 1 14 11581 1 1 45 PRO HD3 H -3.342 6.079 8.280 1.00 . A B . 45 PRO HD3 1 1 14 11582 1 1 45 PRO HG2 H -1.768 4.296 9.515 1.00 . A B . 45 PRO HG2 1 1 14 11583 1 1 45 PRO HG3 H -1.348 4.930 7.912 1.00 . A B . 45 PRO HG3 1 1 14 11584 1 1 45 PRO N N -3.965 4.408 7.151 1.00 . A B . 45 PRO N 1 1 14 11585 1 1 45 PRO O O -4.158 0.805 6.863 1.00 . A B . 45 PRO O 1 1 14 11586 1 1 46 TRP C C -7.715 1.552 6.968 1.00 . A B . 46 TRP C 1 1 14 11587 1 1 46 TRP CA C -6.622 1.429 8.026 1.00 . A B . 46 TRP CA 1 1 14 11588 1 1 46 TRP CB C -7.192 1.716 9.422 1.00 . A B . 46 TRP CB 1 1 14 11589 1 1 46 TRP CD1 C -8.196 4.080 9.361 1.00 . A B . 46 TRP CD1 1 1 14 11590 1 1 46 TRP CD2 C -6.281 3.923 10.513 1.00 . A B . 46 TRP CD2 1 1 14 11591 1 1 46 TRP CE2 C -6.720 5.259 10.550 1.00 . A B . 46 TRP CE2 1 1 14 11592 1 1 46 TRP CE3 C -5.094 3.586 11.174 1.00 . A B . 46 TRP CE3 1 1 14 11593 1 1 46 TRP CG C -7.240 3.183 9.745 1.00 . A B . 46 TRP CG 1 1 14 11594 1 1 46 TRP CH2 C -4.858 5.899 11.853 1.00 . A B . 46 TRP CH2 1 1 14 11595 1 1 46 TRP CZ2 C -6.015 6.257 11.216 1.00 . A B . 46 TRP CZ2 1 1 14 11596 1 1 46 TRP CZ3 C -4.396 4.579 11.837 1.00 . A B . 46 TRP CZ3 1 1 14 11597 1 1 46 TRP H H -5.641 3.296 7.977 1.00 . A B . 46 TRP H 1 1 14 11598 1 1 46 TRP HA H -6.224 0.425 8.002 1.00 . A B . 46 TRP HA 1 1 14 11599 1 1 46 TRP HB2 H -8.201 1.328 9.479 1.00 . A B . 46 TRP HB2 1 1 14 11600 1 1 46 TRP HB3 H -6.581 1.227 10.166 1.00 . A B . 46 TRP HB3 1 1 14 11601 1 1 46 TRP HD1 H -9.061 3.830 8.765 1.00 . A B . 46 TRP HD1 1 1 14 11602 1 1 46 TRP HE1 H -8.422 6.144 9.696 1.00 . A B . 46 TRP HE1 1 1 14 11603 1 1 46 TRP HE3 H -4.720 2.573 11.173 1.00 . A B . 46 TRP HE3 1 1 14 11604 1 1 46 TRP HH2 H -4.278 6.640 12.381 1.00 . A B . 46 TRP HH2 1 1 14 11605 1 1 46 TRP HZ2 H -6.359 7.280 11.240 1.00 . A B . 46 TRP HZ2 1 1 14 11606 1 1 46 TRP HZ3 H -3.477 4.340 12.352 1.00 . A B . 46 TRP HZ3 1 1 14 11607 1 1 46 TRP N N -5.532 2.353 7.738 1.00 . A B . 46 TRP N 1 1 14 11608 1 1 46 TRP NE1 N -7.888 5.330 9.837 1.00 . A B . 46 TRP NE1 1 1 14 11609 1 1 46 TRP O O -8.902 1.394 7.253 1.00 . A B . 46 TRP O 1 1 14 11610 1 1 47 ASN C C -7.708 1.185 3.452 1.00 . A B . 47 ASN C 1 1 14 11611 1 1 47 ASN CA C -8.218 1.996 4.628 1.00 . A B . 47 ASN CA 1 1 14 11612 1 1 47 ASN CB C -8.343 3.470 4.214 1.00 . A B . 47 ASN CB 1 1 14 11613 1 1 47 ASN CG C -9.288 3.679 3.036 1.00 . A B . 47 ASN CG 1 1 14 11614 1 1 47 ASN H H -6.336 1.958 5.588 1.00 . A B . 47 ASN H 1 1 14 11615 1 1 47 ASN HA H -9.186 1.623 4.931 1.00 . A B . 47 ASN HA 1 1 14 11616 1 1 47 ASN HB2 H -8.711 4.044 5.051 1.00 . A B . 47 ASN HB2 1 1 14 11617 1 1 47 ASN HB3 H -7.367 3.841 3.934 1.00 . A B . 47 ASN HB3 1 1 14 11618 1 1 47 ASN HD21 H -10.548 2.319 3.751 1.00 . A B . 47 ASN HD21 1 1 14 11619 1 1 47 ASN HD22 H -11.015 3.061 2.258 1.00 . A B . 47 ASN HD22 1 1 14 11620 1 1 47 ASN N N -7.299 1.850 5.748 1.00 . A B . 47 ASN N 1 1 14 11621 1 1 47 ASN ND2 N -10.394 2.946 3.014 1.00 . A B . 47 ASN ND2 1 1 14 11622 1 1 47 ASN O O -6.861 1.658 2.702 1.00 . A B . 47 ASN O 1 1 14 11623 1 1 47 ASN OD1 O -9.039 4.517 2.166 1.00 . A B . 47 ASN OD1 1 1 14 11624 1 1 48 CYS C C -8.592 -0.733 0.995 1.00 . A B . 48 CYS C 1 1 14 11625 1 1 48 CYS CA C -7.722 -0.896 2.231 1.00 . A B . 48 CYS CA 1 1 14 11626 1 1 48 CYS CB C -7.727 -2.357 2.694 1.00 . A B . 48 CYS CB 1 1 14 11627 1 1 48 CYS H H -8.943 -0.336 3.862 1.00 . A B . 48 CYS H 1 1 14 11628 1 1 48 CYS HA H -6.711 -0.597 1.994 1.00 . A B . 48 CYS HA 1 1 14 11629 1 1 48 CYS HB2 H -7.198 -2.433 3.633 1.00 . A B . 48 CYS HB2 1 1 14 11630 1 1 48 CYS HB3 H -8.751 -2.671 2.844 1.00 . A B . 48 CYS HB3 1 1 14 11631 1 1 48 CYS N N -8.208 -0.030 3.291 1.00 . A B . 48 CYS N 1 1 14 11632 1 1 48 CYS O O -9.805 -0.949 1.039 1.00 . A B . 48 CYS O 1 1 14 11633 1 1 48 CYS SG S -6.958 -3.535 1.548 1.00 . A B . 48 CYS SG 1 1 14 11634 1 1 49 ILE C C -8.980 -1.447 -2.083 1.00 . A B . 49 ILE C 1 1 14 11635 1 1 49 ILE CA C -8.680 -0.138 -1.354 1.00 . A B . 49 ILE CA 1 1 14 11636 1 1 49 ILE CB C -7.905 0.821 -2.292 1.00 . A B . 49 ILE CB 1 1 14 11637 1 1 49 ILE CD1 C -5.593 1.375 -3.216 1.00 . A B . 49 ILE CD1 1 1 14 11638 1 1 49 ILE CG1 C -6.402 0.524 -2.261 1.00 . A B . 49 ILE CG1 1 1 14 11639 1 1 49 ILE CG2 C -8.168 2.271 -1.909 1.00 . A B . 49 ILE CG2 1 1 14 11640 1 1 49 ILE H H -6.994 -0.213 -0.075 1.00 . A B . 49 ILE H 1 1 14 11641 1 1 49 ILE HA H -9.620 0.332 -1.104 1.00 . A B . 49 ILE HA 1 1 14 11642 1 1 49 ILE HB H -8.271 0.670 -3.296 1.00 . A B . 49 ILE HB 1 1 14 11643 1 1 49 ILE HD11 H -5.699 2.415 -2.947 1.00 . A B . 49 ILE HD11 1 1 14 11644 1 1 49 ILE HD12 H -5.950 1.225 -4.223 1.00 . A B . 49 ILE HD12 1 1 14 11645 1 1 49 ILE HD13 H -4.552 1.093 -3.156 1.00 . A B . 49 ILE HD13 1 1 14 11646 1 1 49 ILE HG12 H -6.030 0.713 -1.267 1.00 . A B . 49 ILE HG12 1 1 14 11647 1 1 49 ILE HG13 H -6.240 -0.512 -2.515 1.00 . A B . 49 ILE HG13 1 1 14 11648 1 1 49 ILE HG21 H -7.585 2.922 -2.544 1.00 . A B . 49 ILE HG21 1 1 14 11649 1 1 49 ILE HG22 H -7.886 2.428 -0.878 1.00 . A B . 49 ILE HG22 1 1 14 11650 1 1 49 ILE HG23 H -9.218 2.493 -2.032 1.00 . A B . 49 ILE HG23 1 1 14 11651 1 1 49 ILE N N -7.965 -0.365 -0.107 1.00 . A B . 49 ILE N 1 1 14 11652 1 1 49 ILE O O -9.967 -1.544 -2.814 1.00 . A B . 49 ILE O 1 1 14 11653 1 1 50 PHE C C -9.417 -4.570 -1.899 1.00 . A B . 50 PHE C 1 1 14 11654 1 1 50 PHE CA C -8.325 -3.733 -2.556 1.00 . A B . 50 PHE CA 1 1 14 11655 1 1 50 PHE CB C -7.001 -4.501 -2.648 1.00 . A B . 50 PHE CB 1 1 14 11656 1 1 50 PHE CD1 C -5.298 -2.825 -3.399 1.00 . A B . 50 PHE CD1 1 1 14 11657 1 1 50 PHE CD2 C -6.042 -4.460 -4.965 1.00 . A B . 50 PHE CD2 1 1 14 11658 1 1 50 PHE CE1 C -4.475 -2.273 -4.359 1.00 . A B . 50 PHE CE1 1 1 14 11659 1 1 50 PHE CE2 C -5.224 -3.912 -5.933 1.00 . A B . 50 PHE CE2 1 1 14 11660 1 1 50 PHE CG C -6.088 -3.923 -3.688 1.00 . A B . 50 PHE CG 1 1 14 11661 1 1 50 PHE CZ C -4.439 -2.817 -5.629 1.00 . A B . 50 PHE CZ 1 1 14 11662 1 1 50 PHE H H -7.488 -2.390 -1.145 1.00 . A B . 50 PHE H 1 1 14 11663 1 1 50 PHE HA H -8.651 -3.498 -3.560 1.00 . A B . 50 PHE HA 1 1 14 11664 1 1 50 PHE HB2 H -6.492 -4.466 -1.694 1.00 . A B . 50 PHE HB2 1 1 14 11665 1 1 50 PHE HB3 H -7.201 -5.531 -2.912 1.00 . A B . 50 PHE HB3 1 1 14 11666 1 1 50 PHE HD1 H -5.324 -2.401 -2.407 1.00 . A B . 50 PHE HD1 1 1 14 11667 1 1 50 PHE HD2 H -6.655 -5.317 -5.201 1.00 . A B . 50 PHE HD2 1 1 14 11668 1 1 50 PHE HE1 H -3.865 -1.416 -4.117 1.00 . A B . 50 PHE HE1 1 1 14 11669 1 1 50 PHE HE2 H -5.198 -4.341 -6.924 1.00 . A B . 50 PHE HE2 1 1 14 11670 1 1 50 PHE HZ H -3.800 -2.384 -6.385 1.00 . A B . 50 PHE HZ 1 1 14 11671 1 1 50 PHE N N -8.154 -2.461 -1.860 1.00 . A B . 50 PHE N 1 1 14 11672 1 1 50 PHE O O -10.197 -5.239 -2.580 1.00 . A B . 50 PHE O 1 1 14 11673 1 1 51 CYS C C -11.911 -4.749 -0.126 1.00 . A B . 51 CYS C 1 1 14 11674 1 1 51 CYS CA C -10.501 -5.238 0.181 1.00 . A B . 51 CYS CA 1 1 14 11675 1 1 51 CYS CB C -10.238 -5.180 1.691 1.00 . A B . 51 CYS CB 1 1 14 11676 1 1 51 CYS H H -8.848 -3.939 -0.092 1.00 . A B . 51 CYS H 1 1 14 11677 1 1 51 CYS HA H -10.435 -6.270 -0.135 1.00 . A B . 51 CYS HA 1 1 14 11678 1 1 51 CYS HB2 H -9.806 -4.223 1.939 1.00 . A B . 51 CYS HB2 1 1 14 11679 1 1 51 CYS HB3 H -11.176 -5.292 2.216 1.00 . A B . 51 CYS HB3 1 1 14 11680 1 1 51 CYS N N -9.492 -4.500 -0.574 1.00 . A B . 51 CYS N 1 1 14 11681 1 1 51 CYS O O -12.880 -5.467 0.103 1.00 . A B . 51 CYS O 1 1 14 11682 1 1 51 CYS SG S -9.116 -6.468 2.291 1.00 . A B . 51 CYS SG 1 1 14 11683 1 1 52 ARG C C -13.740 -3.070 -2.342 1.00 . A B . 52 ARG C 1 1 14 11684 1 1 52 ARG CA C -13.358 -2.965 -0.869 1.00 . A B . 52 ARG CA 1 1 14 11685 1 1 52 ARG CB C -13.405 -1.505 -0.406 1.00 . A B . 52 ARG CB 1 1 14 11686 1 1 52 ARG CD C -13.290 0.111 1.529 1.00 . A B . 52 ARG CD 1 1 14 11687 1 1 52 ARG CG C -13.160 -1.338 1.085 1.00 . A B . 52 ARG CG 1 1 14 11688 1 1 52 ARG CZ C -13.370 1.356 3.664 1.00 . A B . 52 ARG CZ 1 1 14 11689 1 1 52 ARG H H -11.260 -3.059 -1.005 1.00 . A B . 52 ARG H 1 1 14 11690 1 1 52 ARG HA H -14.060 -3.542 -0.291 1.00 . A B . 52 ARG HA 1 1 14 11691 1 1 52 ARG HB2 H -12.651 -0.944 -0.940 1.00 . A B . 52 ARG HB2 1 1 14 11692 1 1 52 ARG HB3 H -14.377 -1.098 -0.639 1.00 . A B . 52 ARG HB3 1 1 14 11693 1 1 52 ARG HD2 H -12.519 0.695 1.048 1.00 . A B . 52 ARG HD2 1 1 14 11694 1 1 52 ARG HD3 H -14.261 0.483 1.238 1.00 . A B . 52 ARG HD3 1 1 14 11695 1 1 52 ARG HE H -12.883 -0.572 3.471 1.00 . A B . 52 ARG HE 1 1 14 11696 1 1 52 ARG HG2 H -13.880 -1.931 1.629 1.00 . A B . 52 ARG HG2 1 1 14 11697 1 1 52 ARG HG3 H -12.161 -1.684 1.313 1.00 . A B . 52 ARG HG3 1 1 14 11698 1 1 52 ARG HH11 H -13.768 2.491 2.034 1.00 . A B . 52 ARG HH11 1 1 14 11699 1 1 52 ARG HH12 H -13.860 3.317 3.555 1.00 . A B . 52 ARG HH12 1 1 14 11700 1 1 52 ARG HH21 H -12.991 0.512 5.466 1.00 . A B . 52 ARG HH21 1 1 14 11701 1 1 52 ARG HH22 H -13.415 2.193 5.508 1.00 . A B . 52 ARG HH22 1 1 14 11702 1 1 52 ARG N N -12.040 -3.537 -0.652 1.00 . A B . 52 ARG N 1 1 14 11703 1 1 52 ARG NE N -13.148 0.238 2.978 1.00 . A B . 52 ARG NE 1 1 14 11704 1 1 52 ARG NH1 N -13.692 2.477 3.036 1.00 . A B . 52 ARG NH1 1 1 14 11705 1 1 52 ARG NH2 N -13.249 1.355 4.984 1.00 . A B . 52 ARG NH2 1 1 14 11706 1 1 52 ARG O O -14.779 -2.570 -2.762 1.00 . A B . 52 ARG O 1 1 14 11707 1 1 53 MET C C -13.094 -5.426 -4.871 1.00 . A B . 53 MET C 1 1 14 11708 1 1 53 MET CA C -13.151 -3.942 -4.540 1.00 . A B . 53 MET CA 1 1 14 11709 1 1 53 MET CB C -12.151 -3.174 -5.405 1.00 . A B . 53 MET CB 1 1 14 11710 1 1 53 MET CE C -11.568 -1.245 -7.913 1.00 . A B . 53 MET CE 1 1 14 11711 1 1 53 MET CG C -12.247 -1.666 -5.255 1.00 . A B . 53 MET CG 1 1 14 11712 1 1 53 MET H H -12.055 -4.071 -2.731 1.00 . A B . 53 MET H 1 1 14 11713 1 1 53 MET HA H -14.145 -3.580 -4.746 1.00 . A B . 53 MET HA 1 1 14 11714 1 1 53 MET HB2 H -11.151 -3.478 -5.133 1.00 . A B . 53 MET HB2 1 1 14 11715 1 1 53 MET HB3 H -12.324 -3.423 -6.440 1.00 . A B . 53 MET HB3 1 1 14 11716 1 1 53 MET HE1 H -11.496 -2.316 -8.029 1.00 . A B . 53 MET HE1 1 1 14 11717 1 1 53 MET HE2 H -10.937 -0.760 -8.643 1.00 . A B . 53 MET HE2 1 1 14 11718 1 1 53 MET HE3 H -12.592 -0.936 -8.061 1.00 . A B . 53 MET HE3 1 1 14 11719 1 1 53 MET HG2 H -13.237 -1.352 -5.549 1.00 . A B . 53 MET HG2 1 1 14 11720 1 1 53 MET HG3 H -12.084 -1.414 -4.218 1.00 . A B . 53 MET HG3 1 1 14 11721 1 1 53 MET N N -12.885 -3.724 -3.120 1.00 . A B . 53 MET N 1 1 14 11722 1 1 53 MET O O -13.437 -5.842 -5.976 1.00 . A B . 53 MET O 1 1 14 11723 1 1 53 MET SD S -11.038 -0.786 -6.263 1.00 . A B . 53 MET SD 1 1 14 11724 1 1 54 LYS C C -13.933 -8.257 -4.364 1.00 . A B . 54 LYS C 1 1 14 11725 1 1 54 LYS CA C -12.563 -7.660 -4.046 1.00 . A B . 54 LYS CA 1 1 14 11726 1 1 54 LYS CB C -11.993 -8.280 -2.764 1.00 . A B . 54 LYS CB 1 1 14 11727 1 1 54 LYS CD C -10.797 -10.232 -3.814 1.00 . A B . 54 LYS CD 1 1 14 11728 1 1 54 LYS CE C -10.655 -11.744 -3.837 1.00 . A B . 54 LYS CE 1 1 14 11729 1 1 54 LYS CG C -11.852 -9.794 -2.811 1.00 . A B . 54 LYS CG 1 1 14 11730 1 1 54 LYS H H -12.374 -5.805 -3.056 1.00 . A B . 54 LYS H 1 1 14 11731 1 1 54 LYS HA H -11.894 -7.869 -4.868 1.00 . A B . 54 LYS HA 1 1 14 11732 1 1 54 LYS HB2 H -11.015 -7.859 -2.576 1.00 . A B . 54 LYS HB2 1 1 14 11733 1 1 54 LYS HB3 H -12.643 -8.027 -1.940 1.00 . A B . 54 LYS HB3 1 1 14 11734 1 1 54 LYS HD2 H -11.086 -9.893 -4.797 1.00 . A B . 54 LYS HD2 1 1 14 11735 1 1 54 LYS HD3 H -9.851 -9.793 -3.541 1.00 . A B . 54 LYS HD3 1 1 14 11736 1 1 54 LYS HE2 H -10.436 -12.088 -2.838 1.00 . A B . 54 LYS HE2 1 1 14 11737 1 1 54 LYS HE3 H -11.589 -12.175 -4.166 1.00 . A B . 54 LYS HE3 1 1 14 11738 1 1 54 LYS HG2 H -11.572 -10.150 -1.831 1.00 . A B . 54 LYS HG2 1 1 14 11739 1 1 54 LYS HG3 H -12.803 -10.226 -3.093 1.00 . A B . 54 LYS HG3 1 1 14 11740 1 1 54 LYS HZ1 H -8.658 -11.801 -4.446 1.00 . A B . 54 LYS HZ1 1 1 14 11741 1 1 54 LYS HZ2 H -9.765 -11.876 -5.721 1.00 . A B . 54 LYS HZ2 1 1 14 11742 1 1 54 LYS HZ3 H -9.509 -13.231 -4.747 1.00 . A B . 54 LYS HZ3 1 1 14 11743 1 1 54 LYS N N -12.656 -6.213 -3.897 1.00 . A B . 54 LYS N 1 1 14 11744 1 1 54 LYS NZ N -9.571 -12.191 -4.750 1.00 . A B . 54 LYS NZ 1 1 14 11745 1 1 54 LYS O O -14.159 -8.767 -5.461 1.00 . A B . 54 LYS O 1 1 14 11746 1 1 55 GLU C C -17.190 -7.843 -2.801 1.00 . A B . 55 GLU C 1 1 14 11747 1 1 55 GLU CA C -16.190 -8.688 -3.582 1.00 . A B . 55 GLU CA 1 1 14 11748 1 1 55 GLU CB C -16.265 -10.153 -3.151 1.00 . A B . 55 GLU CB 1 1 14 11749 1 1 55 GLU CD C -15.881 -11.863 -1.340 1.00 . A B . 55 GLU CD 1 1 14 11750 1 1 55 GLU CG C -15.688 -10.427 -1.771 1.00 . A B . 55 GLU CG 1 1 14 11751 1 1 55 GLU H H -14.603 -7.762 -2.549 1.00 . A B . 55 GLU H 1 1 14 11752 1 1 55 GLU HA H -16.429 -8.619 -4.630 1.00 . A B . 55 GLU HA 1 1 14 11753 1 1 55 GLU HB2 H -17.298 -10.460 -3.152 1.00 . A B . 55 GLU HB2 1 1 14 11754 1 1 55 GLU HB3 H -15.722 -10.751 -3.867 1.00 . A B . 55 GLU HB3 1 1 14 11755 1 1 55 GLU HG2 H -14.632 -10.209 -1.787 1.00 . A B . 55 GLU HG2 1 1 14 11756 1 1 55 GLU HG3 H -16.178 -9.781 -1.057 1.00 . A B . 55 GLU HG3 1 1 14 11757 1 1 55 GLU N N -14.844 -8.175 -3.405 1.00 . A B . 55 GLU N 1 1 14 11758 1 1 55 GLU O O -17.849 -8.319 -1.874 1.00 . A B . 55 GLU O 1 1 14 11759 1 1 55 GLU OE1 O -15.114 -12.737 -1.800 1.00 . A B . 55 GLU OE1 1 1 14 11760 1 1 55 GLU OE2 O -16.811 -12.129 -0.549 1.00 . A B . 55 GLU OE2 1 1 14 11761 1 1 56 SER C C -18.816 -4.712 -3.523 1.00 . A B . 56 SER C 1 1 14 11762 1 1 56 SER CA C -18.198 -5.671 -2.508 1.00 . A B . 56 SER CA 1 1 14 11763 1 1 56 SER CB C -17.441 -4.906 -1.416 1.00 . A B . 56 SER CB 1 1 14 11764 1 1 56 SER H H -16.776 -6.268 -3.948 1.00 . A B . 56 SER H 1 1 14 11765 1 1 56 SER HA H -18.985 -6.252 -2.052 1.00 . A B . 56 SER HA 1 1 14 11766 1 1 56 SER HB2 H -16.807 -5.592 -0.876 1.00 . A B . 56 SER HB2 1 1 14 11767 1 1 56 SER HB3 H -16.833 -4.141 -1.875 1.00 . A B . 56 SER HB3 1 1 14 11768 1 1 56 SER HG H -19.010 -3.801 -0.985 1.00 . A B . 56 SER HG 1 1 14 11769 1 1 56 SER N N -17.300 -6.586 -3.182 1.00 . A B . 56 SER N 1 1 14 11770 1 1 56 SER O O -18.259 -3.614 -3.734 1.00 . A B . 56 SER O 1 1 14 11771 1 1 56 SER OXT O -19.848 -5.080 -4.123 1.00 . A B . 56 SER OXT 1 1 14 11772 1 1 56 SER OG O -18.332 -4.291 -0.497 1.00 . A B . 56 SER OG 1 1 14 11773 2 2 1 ZN ZN ZN -7.008 -5.591 2.566 1.00 . B B . 101 ZN ZN 1 1 14 11774 3 2 1 ZN ZN ZN 6.105 0.762 -0.363 1.00 . C B . 102 ZN ZN 1 1 15 11775 1 1 1 GLY C C 11.812 -6.435 12.431 1.00 . A B . 1 GLY C 1 1 15 11776 1 1 1 GLY CA C 10.656 -6.116 13.354 1.00 . A B . 1 GLY CA 1 1 15 11777 1 1 1 GLY H1 H 10.997 -7.626 14.745 1.00 . A B . 1 GLY H1 1 1 15 11778 1 1 1 GLY H2 H 9.950 -8.069 13.496 1.00 . A B . 1 GLY H2 1 1 15 11779 1 1 1 GLY H3 H 9.405 -7.053 14.733 1.00 . A B . 1 GLY H3 1 1 15 11780 1 1 1 GLY HA2 H 9.824 -5.761 12.764 1.00 . A B . 1 GLY HA2 1 1 15 11781 1 1 1 GLY HA3 H 10.958 -5.336 14.037 1.00 . A B . 1 GLY HA3 1 1 15 11782 1 1 1 GLY N N 10.222 -7.297 14.138 1.00 . A B . 1 GLY N 1 1 15 11783 1 1 1 GLY O O 12.824 -6.985 12.868 1.00 . A B . 1 GLY O 1 1 15 11784 1 1 2 ALA C C 13.149 -7.753 10.069 1.00 . A B . 2 ALA C 1 1 15 11785 1 1 2 ALA CA C 12.684 -6.299 10.136 1.00 . A B . 2 ALA CA 1 1 15 11786 1 1 2 ALA CB C 13.866 -5.369 10.392 1.00 . A B . 2 ALA CB 1 1 15 11787 1 1 2 ALA H H 10.788 -5.713 10.873 1.00 . A B . 2 ALA H 1 1 15 11788 1 1 2 ALA HA H 12.257 -6.035 9.179 1.00 . A B . 2 ALA HA 1 1 15 11789 1 1 2 ALA HB1 H 13.527 -4.343 10.388 1.00 . A B . 2 ALA HB1 1 1 15 11790 1 1 2 ALA HB2 H 14.608 -5.506 9.620 1.00 . A B . 2 ALA HB2 1 1 15 11791 1 1 2 ALA HB3 H 14.302 -5.598 11.353 1.00 . A B . 2 ALA HB3 1 1 15 11792 1 1 2 ALA N N 11.645 -6.105 11.150 1.00 . A B . 2 ALA N 1 1 15 11793 1 1 2 ALA O O 14.347 -8.033 10.057 1.00 . A B . 2 ALA O 1 1 15 11794 1 1 3 MET C C 11.554 -10.762 8.938 1.00 . A B . 3 MET C 1 1 15 11795 1 1 3 MET CA C 12.508 -10.096 9.918 1.00 . A B . 3 MET CA 1 1 15 11796 1 1 3 MET CB C 12.446 -10.803 11.279 1.00 . A B . 3 MET CB 1 1 15 11797 1 1 3 MET CE C 13.917 -12.973 13.144 1.00 . A B . 3 MET CE 1 1 15 11798 1 1 3 MET CG C 13.545 -10.380 12.246 1.00 . A B . 3 MET CG 1 1 15 11799 1 1 3 MET H H 11.255 -8.393 10.071 1.00 . A B . 3 MET H 1 1 15 11800 1 1 3 MET HA H 13.513 -10.178 9.527 1.00 . A B . 3 MET HA 1 1 15 11801 1 1 3 MET HB2 H 11.491 -10.594 11.739 1.00 . A B . 3 MET HB2 1 1 15 11802 1 1 3 MET HB3 H 12.529 -11.869 11.120 1.00 . A B . 3 MET HB3 1 1 15 11803 1 1 3 MET HE1 H 13.134 -13.292 12.475 1.00 . A B . 3 MET HE1 1 1 15 11804 1 1 3 MET HE2 H 13.991 -13.668 13.967 1.00 . A B . 3 MET HE2 1 1 15 11805 1 1 3 MET HE3 H 14.857 -12.944 12.612 1.00 . A B . 3 MET HE3 1 1 15 11806 1 1 3 MET HG2 H 14.501 -10.511 11.762 1.00 . A B . 3 MET HG2 1 1 15 11807 1 1 3 MET HG3 H 13.409 -9.337 12.492 1.00 . A B . 3 MET HG3 1 1 15 11808 1 1 3 MET N N 12.196 -8.676 10.033 1.00 . A B . 3 MET N 1 1 15 11809 1 1 3 MET O O 11.095 -11.883 9.157 1.00 . A B . 3 MET O 1 1 15 11810 1 1 3 MET SD S 13.538 -11.339 13.774 1.00 . A B . 3 MET SD 1 1 15 11811 1 1 4 GLY C C 10.778 -10.135 5.455 1.00 . A B . 4 GLY C 1 1 15 11812 1 1 4 GLY CA C 10.368 -10.578 6.844 1.00 . A B . 4 GLY CA 1 1 15 11813 1 1 4 GLY H H 11.663 -9.168 7.739 1.00 . A B . 4 GLY H 1 1 15 11814 1 1 4 GLY HA2 H 10.380 -11.658 6.888 1.00 . A B . 4 GLY HA2 1 1 15 11815 1 1 4 GLY HA3 H 9.366 -10.229 7.044 1.00 . A B . 4 GLY HA3 1 1 15 11816 1 1 4 GLY N N 11.259 -10.056 7.858 1.00 . A B . 4 GLY N 1 1 15 11817 1 1 4 GLY O O 11.968 -10.086 5.141 1.00 . A B . 4 GLY O 1 1 15 11818 1 1 5 MET C C 9.449 -7.979 3.043 1.00 . A B . 5 MET C 1 1 15 11819 1 1 5 MET CA C 10.076 -9.345 3.270 1.00 . A B . 5 MET CA 1 1 15 11820 1 1 5 MET CB C 9.555 -10.337 2.224 1.00 . A B . 5 MET CB 1 1 15 11821 1 1 5 MET CE C 7.972 -12.931 1.294 1.00 . A B . 5 MET CE 1 1 15 11822 1 1 5 MET CG C 10.272 -11.678 2.235 1.00 . A B . 5 MET CG 1 1 15 11823 1 1 5 MET H H 8.869 -9.891 4.918 1.00 . A B . 5 MET H 1 1 15 11824 1 1 5 MET HA H 11.148 -9.254 3.166 1.00 . A B . 5 MET HA 1 1 15 11825 1 1 5 MET HB2 H 8.506 -10.512 2.406 1.00 . A B . 5 MET HB2 1 1 15 11826 1 1 5 MET HB3 H 9.671 -9.898 1.242 1.00 . A B . 5 MET HB3 1 1 15 11827 1 1 5 MET HE1 H 7.852 -13.329 2.291 1.00 . A B . 5 MET HE1 1 1 15 11828 1 1 5 MET HE2 H 7.507 -13.597 0.584 1.00 . A B . 5 MET HE2 1 1 15 11829 1 1 5 MET HE3 H 7.506 -11.959 1.235 1.00 . A B . 5 MET HE3 1 1 15 11830 1 1 5 MET HG2 H 11.331 -11.506 2.115 1.00 . A B . 5 MET HG2 1 1 15 11831 1 1 5 MET HG3 H 10.095 -12.158 3.186 1.00 . A B . 5 MET HG3 1 1 15 11832 1 1 5 MET N N 9.801 -9.813 4.620 1.00 . A B . 5 MET N 1 1 15 11833 1 1 5 MET O O 8.421 -7.855 2.376 1.00 . A B . 5 MET O 1 1 15 11834 1 1 5 MET SD S 9.717 -12.782 0.918 1.00 . A B . 5 MET SD 1 1 15 11835 1 1 6 ARG C C 10.502 -4.883 2.426 1.00 . A B . 6 ARG C 1 1 15 11836 1 1 6 ARG CA C 9.591 -5.593 3.415 1.00 . A B . 6 ARG CA 1 1 15 11837 1 1 6 ARG CB C 9.544 -4.819 4.738 1.00 . A B . 6 ARG CB 1 1 15 11838 1 1 6 ARG CD C 8.470 -4.522 6.993 1.00 . A B . 6 ARG CD 1 1 15 11839 1 1 6 ARG CG C 8.634 -5.440 5.790 1.00 . A B . 6 ARG CG 1 1 15 11840 1 1 6 ARG CZ C 7.803 -2.166 7.364 1.00 . A B . 6 ARG CZ 1 1 15 11841 1 1 6 ARG H H 10.856 -7.115 4.162 1.00 . A B . 6 ARG H 1 1 15 11842 1 1 6 ARG HA H 8.597 -5.643 2.998 1.00 . A B . 6 ARG HA 1 1 15 11843 1 1 6 ARG HB2 H 10.542 -4.765 5.145 1.00 . A B . 6 ARG HB2 1 1 15 11844 1 1 6 ARG HB3 H 9.193 -3.817 4.539 1.00 . A B . 6 ARG HB3 1 1 15 11845 1 1 6 ARG HD2 H 7.918 -5.046 7.760 1.00 . A B . 6 ARG HD2 1 1 15 11846 1 1 6 ARG HD3 H 9.448 -4.261 7.367 1.00 . A B . 6 ARG HD3 1 1 15 11847 1 1 6 ARG HE H 7.195 -3.312 5.836 1.00 . A B . 6 ARG HE 1 1 15 11848 1 1 6 ARG HG2 H 7.665 -5.621 5.352 1.00 . A B . 6 ARG HG2 1 1 15 11849 1 1 6 ARG HG3 H 9.064 -6.376 6.118 1.00 . A B . 6 ARG HG3 1 1 15 11850 1 1 6 ARG HH11 H 9.059 -2.899 8.778 1.00 . A B . 6 ARG HH11 1 1 15 11851 1 1 6 ARG HH12 H 8.573 -1.249 8.997 1.00 . A B . 6 ARG HH12 1 1 15 11852 1 1 6 ARG HH21 H 6.547 -1.152 6.142 1.00 . A B . 6 ARG HH21 1 1 15 11853 1 1 6 ARG HH22 H 7.155 -0.251 7.495 1.00 . A B . 6 ARG HH22 1 1 15 11854 1 1 6 ARG N N 10.060 -6.954 3.611 1.00 . A B . 6 ARG N 1 1 15 11855 1 1 6 ARG NE N 7.750 -3.294 6.650 1.00 . A B . 6 ARG NE 1 1 15 11856 1 1 6 ARG NH1 N 8.536 -2.100 8.469 1.00 . A B . 6 ARG NH1 1 1 15 11857 1 1 6 ARG NH2 N 7.111 -1.105 6.970 1.00 . A B . 6 ARG NH2 1 1 15 11858 1 1 6 ARG O O 11.359 -4.082 2.807 1.00 . A B . 6 ARG O 1 1 15 11859 1 1 7 ASN C C 10.623 -3.241 -0.271 1.00 . A B . 7 ASN C 1 1 15 11860 1 1 7 ASN CA C 11.158 -4.613 0.108 1.00 . A B . 7 ASN CA 1 1 15 11861 1 1 7 ASN CB C 11.226 -5.518 -1.129 1.00 . A B . 7 ASN CB 1 1 15 11862 1 1 7 ASN CG C 12.312 -5.087 -2.113 1.00 . A B . 7 ASN CG 1 1 15 11863 1 1 7 ASN H H 9.605 -5.814 0.905 1.00 . A B . 7 ASN H 1 1 15 11864 1 1 7 ASN HA H 12.152 -4.494 0.511 1.00 . A B . 7 ASN HA 1 1 15 11865 1 1 7 ASN HB2 H 11.429 -6.531 -0.813 1.00 . A B . 7 ASN HB2 1 1 15 11866 1 1 7 ASN HB3 H 10.272 -5.488 -1.635 1.00 . A B . 7 ASN HB3 1 1 15 11867 1 1 7 ASN HD21 H 12.539 -6.958 -2.755 1.00 . A B . 7 ASN HD21 1 1 15 11868 1 1 7 ASN HD22 H 13.551 -5.775 -3.507 1.00 . A B . 7 ASN HD22 1 1 15 11869 1 1 7 ASN N N 10.325 -5.195 1.151 1.00 . A B . 7 ASN N 1 1 15 11870 1 1 7 ASN ND2 N 12.855 -6.037 -2.864 1.00 . A B . 7 ASN ND2 1 1 15 11871 1 1 7 ASN O O 10.073 -3.042 -1.356 1.00 . A B . 7 ASN O 1 1 15 11872 1 1 7 ASN OD1 O 12.669 -3.910 -2.198 1.00 . A B . 7 ASN OD1 1 1 15 11873 1 1 8 LEU C C 11.579 -0.114 -0.054 1.00 . A B . 8 LEU C 1 1 15 11874 1 1 8 LEU CA C 10.373 -0.931 0.389 1.00 . A B . 8 LEU CA 1 1 15 11875 1 1 8 LEU CB C 9.688 -0.327 1.628 1.00 . A B . 8 LEU CB 1 1 15 11876 1 1 8 LEU CD1 C 11.485 0.740 3.054 1.00 . A B . 8 LEU CD1 1 1 15 11877 1 1 8 LEU CD2 C 9.518 -0.373 4.127 1.00 . A B . 8 LEU CD2 1 1 15 11878 1 1 8 LEU CG C 10.475 -0.396 2.946 1.00 . A B . 8 LEU CG 1 1 15 11879 1 1 8 LEU H H 11.170 -2.535 1.506 1.00 . A B . 8 LEU H 1 1 15 11880 1 1 8 LEU HA H 9.664 -0.952 -0.425 1.00 . A B . 8 LEU HA 1 1 15 11881 1 1 8 LEU HB2 H 9.474 0.711 1.420 1.00 . A B . 8 LEU HB2 1 1 15 11882 1 1 8 LEU HB3 H 8.749 -0.842 1.774 1.00 . A B . 8 LEU HB3 1 1 15 11883 1 1 8 LEU HD11 H 10.965 1.686 3.060 1.00 . A B . 8 LEU HD11 1 1 15 11884 1 1 8 LEU HD12 H 12.156 0.704 2.208 1.00 . A B . 8 LEU HD12 1 1 15 11885 1 1 8 LEU HD13 H 12.049 0.633 3.967 1.00 . A B . 8 LEU HD13 1 1 15 11886 1 1 8 LEU HD21 H 8.896 0.507 4.070 1.00 . A B . 8 LEU HD21 1 1 15 11887 1 1 8 LEU HD22 H 10.081 -0.354 5.047 1.00 . A B . 8 LEU HD22 1 1 15 11888 1 1 8 LEU HD23 H 8.895 -1.256 4.105 1.00 . A B . 8 LEU HD23 1 1 15 11889 1 1 8 LEU HG H 11.021 -1.326 2.980 1.00 . A B . 8 LEU HG 1 1 15 11890 1 1 8 LEU N N 10.775 -2.299 0.638 1.00 . A B . 8 LEU N 1 1 15 11891 1 1 8 LEU O O 11.524 1.112 -0.150 1.00 . A B . 8 LEU O 1 1 15 11892 1 1 9 ASP C C 13.710 0.317 -2.231 1.00 . A B . 9 ASP C 1 1 15 11893 1 1 9 ASP CA C 13.893 -0.210 -0.815 1.00 . A B . 9 ASP CA 1 1 15 11894 1 1 9 ASP CB C 15.041 -1.223 -0.766 1.00 . A B . 9 ASP CB 1 1 15 11895 1 1 9 ASP CG C 16.394 -0.596 -1.045 1.00 . A B . 9 ASP CG 1 1 15 11896 1 1 9 ASP H H 12.599 -1.802 -0.297 1.00 . A B . 9 ASP H 1 1 15 11897 1 1 9 ASP HA H 14.117 0.615 -0.158 1.00 . A B . 9 ASP HA 1 1 15 11898 1 1 9 ASP HB2 H 15.073 -1.670 0.216 1.00 . A B . 9 ASP HB2 1 1 15 11899 1 1 9 ASP HB3 H 14.862 -1.994 -1.499 1.00 . A B . 9 ASP HB3 1 1 15 11900 1 1 9 ASP N N 12.655 -0.827 -0.362 1.00 . A B . 9 ASP N 1 1 15 11901 1 1 9 ASP O O 14.265 1.346 -2.607 1.00 . A B . 9 ASP O 1 1 15 11902 1 1 9 ASP OD1 O 16.753 -0.460 -2.234 1.00 . A B . 9 ASP OD1 1 1 15 11903 1 1 9 ASP OD2 O 17.100 -0.228 -0.088 1.00 . A B . 9 ASP OD2 1 1 15 11904 1 1 10 GLU C C 11.260 0.837 -4.349 1.00 . A B . 10 GLU C 1 1 15 11905 1 1 10 GLU CA C 12.548 0.028 -4.353 1.00 . A B . 10 GLU CA 1 1 15 11906 1 1 10 GLU CB C 12.398 -1.181 -5.276 1.00 . A B . 10 GLU CB 1 1 15 11907 1 1 10 GLU CD C 14.647 -0.888 -6.362 1.00 . A B . 10 GLU CD 1 1 15 11908 1 1 10 GLU CG C 13.716 -1.835 -5.635 1.00 . A B . 10 GLU CG 1 1 15 11909 1 1 10 GLU H H 12.515 -1.226 -2.648 1.00 . A B . 10 GLU H 1 1 15 11910 1 1 10 GLU HA H 13.348 0.652 -4.718 1.00 . A B . 10 GLU HA 1 1 15 11911 1 1 10 GLU HB2 H 11.776 -1.919 -4.790 1.00 . A B . 10 GLU HB2 1 1 15 11912 1 1 10 GLU HB3 H 11.917 -0.862 -6.188 1.00 . A B . 10 GLU HB3 1 1 15 11913 1 1 10 GLU HG2 H 14.199 -2.163 -4.726 1.00 . A B . 10 GLU HG2 1 1 15 11914 1 1 10 GLU HG3 H 13.522 -2.688 -6.269 1.00 . A B . 10 GLU HG3 1 1 15 11915 1 1 10 GLU N N 12.893 -0.393 -3.001 1.00 . A B . 10 GLU N 1 1 15 11916 1 1 10 GLU O O 10.739 1.211 -5.400 1.00 . A B . 10 GLU O 1 1 15 11917 1 1 10 GLU OE1 O 14.187 -0.179 -7.284 1.00 . A B . 10 GLU OE1 1 1 15 11918 1 1 10 GLU OE2 O 15.845 -0.851 -6.022 1.00 . A B . 10 GLU OE2 1 1 15 11919 1 1 11 CYS C C 9.886 3.292 -2.596 1.00 . A B . 11 CYS C 1 1 15 11920 1 1 11 CYS CA C 9.536 1.871 -3.007 1.00 . A B . 11 CYS CA 1 1 15 11921 1 1 11 CYS CB C 8.644 1.202 -1.958 1.00 . A B . 11 CYS CB 1 1 15 11922 1 1 11 CYS H H 11.246 0.824 -2.361 1.00 . A B . 11 CYS H 1 1 15 11923 1 1 11 CYS HA H 9.026 1.889 -3.957 1.00 . A B . 11 CYS HA 1 1 15 11924 1 1 11 CYS HB2 H 8.561 0.156 -2.193 1.00 . A B . 11 CYS HB2 1 1 15 11925 1 1 11 CYS HB3 H 9.112 1.308 -0.992 1.00 . A B . 11 CYS HB3 1 1 15 11926 1 1 11 CYS N N 10.759 1.112 -3.158 1.00 . A B . 11 CYS N 1 1 15 11927 1 1 11 CYS O O 10.028 3.595 -1.407 1.00 . A B . 11 CYS O 1 1 15 11928 1 1 11 CYS SG S 6.962 1.866 -1.827 1.00 . A B . 11 CYS SG 1 1 15 11929 1 1 12 GLU C C 9.371 6.268 -2.548 1.00 . A B . 12 GLU C 1 1 15 11930 1 1 12 GLU CA C 10.419 5.538 -3.366 1.00 . A B . 12 GLU CA 1 1 15 11931 1 1 12 GLU CB C 10.619 6.241 -4.706 1.00 . A B . 12 GLU CB 1 1 15 11932 1 1 12 GLU CD C 11.243 8.355 -5.920 1.00 . A B . 12 GLU CD 1 1 15 11933 1 1 12 GLU CG C 11.126 7.664 -4.582 1.00 . A B . 12 GLU CG 1 1 15 11934 1 1 12 GLU H H 9.867 3.855 -4.510 1.00 . A B . 12 GLU H 1 1 15 11935 1 1 12 GLU HA H 11.350 5.537 -2.823 1.00 . A B . 12 GLU HA 1 1 15 11936 1 1 12 GLU HB2 H 11.330 5.679 -5.291 1.00 . A B . 12 GLU HB2 1 1 15 11937 1 1 12 GLU HB3 H 9.673 6.264 -5.226 1.00 . A B . 12 GLU HB3 1 1 15 11938 1 1 12 GLU HG2 H 10.441 8.225 -3.963 1.00 . A B . 12 GLU HG2 1 1 15 11939 1 1 12 GLU HG3 H 12.100 7.648 -4.114 1.00 . A B . 12 GLU HG3 1 1 15 11940 1 1 12 GLU N N 10.024 4.157 -3.590 1.00 . A B . 12 GLU N 1 1 15 11941 1 1 12 GLU O O 9.684 7.175 -1.783 1.00 . A B . 12 GLU O 1 1 15 11942 1 1 12 GLU OE1 O 10.218 8.844 -6.431 1.00 . A B . 12 GLU OE1 1 1 15 11943 1 1 12 GLU OE2 O 12.366 8.416 -6.466 1.00 . A B . 12 GLU OE2 1 1 15 11944 1 1 13 VAL C C 7.137 6.134 -0.471 1.00 . A B . 13 VAL C 1 1 15 11945 1 1 13 VAL CA C 7.053 6.481 -1.959 1.00 . A B . 13 VAL CA 1 1 15 11946 1 1 13 VAL CB C 5.675 6.124 -2.557 1.00 . A B . 13 VAL CB 1 1 15 11947 1 1 13 VAL CG1 C 5.507 4.627 -2.690 1.00 . A B . 13 VAL CG1 1 1 15 11948 1 1 13 VAL CG2 C 4.554 6.720 -1.725 1.00 . A B . 13 VAL CG2 1 1 15 11949 1 1 13 VAL H H 7.929 5.113 -3.297 1.00 . A B . 13 VAL H 1 1 15 11950 1 1 13 VAL HA H 7.187 7.547 -2.058 1.00 . A B . 13 VAL HA 1 1 15 11951 1 1 13 VAL HB H 5.621 6.550 -3.547 1.00 . A B . 13 VAL HB 1 1 15 11952 1 1 13 VAL HG11 H 6.268 4.235 -3.347 1.00 . A B . 13 VAL HG11 1 1 15 11953 1 1 13 VAL HG12 H 4.533 4.410 -3.099 1.00 . A B . 13 VAL HG12 1 1 15 11954 1 1 13 VAL HG13 H 5.599 4.167 -1.717 1.00 . A B . 13 VAL HG13 1 1 15 11955 1 1 13 VAL HG21 H 3.619 6.617 -2.252 1.00 . A B . 13 VAL HG21 1 1 15 11956 1 1 13 VAL HG22 H 4.755 7.765 -1.543 1.00 . A B . 13 VAL HG22 1 1 15 11957 1 1 13 VAL HG23 H 4.495 6.195 -0.783 1.00 . A B . 13 VAL HG23 1 1 15 11958 1 1 13 VAL N N 8.128 5.854 -2.690 1.00 . A B . 13 VAL N 1 1 15 11959 1 1 13 VAL O O 6.865 6.974 0.376 1.00 . A B . 13 VAL O 1 1 15 11960 1 1 14 CYS C C 9.008 5.382 1.759 1.00 . A B . 14 CYS C 1 1 15 11961 1 1 14 CYS CA C 7.848 4.549 1.240 1.00 . A B . 14 CYS CA 1 1 15 11962 1 1 14 CYS CB C 8.198 3.069 1.378 1.00 . A B . 14 CYS CB 1 1 15 11963 1 1 14 CYS H H 7.665 4.237 -0.859 1.00 . A B . 14 CYS H 1 1 15 11964 1 1 14 CYS HA H 6.970 4.762 1.831 1.00 . A B . 14 CYS HA 1 1 15 11965 1 1 14 CYS HB2 H 8.549 2.705 0.425 1.00 . A B . 14 CYS HB2 1 1 15 11966 1 1 14 CYS HB3 H 8.986 2.964 2.107 1.00 . A B . 14 CYS HB3 1 1 15 11967 1 1 14 CYS N N 7.556 4.907 -0.152 1.00 . A B . 14 CYS N 1 1 15 11968 1 1 14 CYS O O 9.071 5.723 2.939 1.00 . A B . 14 CYS O 1 1 15 11969 1 1 14 CYS SG S 6.824 2.017 1.893 1.00 . A B . 14 CYS SG 1 1 15 11970 1 1 15 ARG C C 10.647 7.934 1.519 1.00 . A B . 15 ARG C 1 1 15 11971 1 1 15 ARG CA C 11.079 6.512 1.172 1.00 . A B . 15 ARG CA 1 1 15 11972 1 1 15 ARG CB C 12.013 6.509 -0.034 1.00 . A B . 15 ARG CB 1 1 15 11973 1 1 15 ARG CD C 14.192 7.110 -1.078 1.00 . A B . 15 ARG CD 1 1 15 11974 1 1 15 ARG CG C 13.348 7.185 0.184 1.00 . A B . 15 ARG CG 1 1 15 11975 1 1 15 ARG CZ C 14.549 5.413 -2.844 1.00 . A B . 15 ARG CZ 1 1 15 11976 1 1 15 ARG H H 9.797 5.376 -0.064 1.00 . A B . 15 ARG H 1 1 15 11977 1 1 15 ARG HA H 11.581 6.073 2.017 1.00 . A B . 15 ARG HA 1 1 15 11978 1 1 15 ARG HB2 H 12.203 5.487 -0.318 1.00 . A B . 15 ARG HB2 1 1 15 11979 1 1 15 ARG HB3 H 11.515 7.009 -0.853 1.00 . A B . 15 ARG HB3 1 1 15 11980 1 1 15 ARG HD2 H 13.732 7.722 -1.838 1.00 . A B . 15 ARG HD2 1 1 15 11981 1 1 15 ARG HD3 H 15.180 7.486 -0.860 1.00 . A B . 15 ARG HD3 1 1 15 11982 1 1 15 ARG HE H 14.163 5.009 -0.924 1.00 . A B . 15 ARG HE 1 1 15 11983 1 1 15 ARG HG2 H 13.178 8.221 0.437 1.00 . A B . 15 ARG HG2 1 1 15 11984 1 1 15 ARG HG3 H 13.868 6.692 0.990 1.00 . A B . 15 ARG HG3 1 1 15 11985 1 1 15 ARG HH11 H 14.764 7.327 -3.470 1.00 . A B . 15 ARG HH11 1 1 15 11986 1 1 15 ARG HH12 H 14.962 6.117 -4.697 1.00 . A B . 15 ARG HH12 1 1 15 11987 1 1 15 ARG HH21 H 14.429 3.408 -2.532 1.00 . A B . 15 ARG HH21 1 1 15 11988 1 1 15 ARG HH22 H 14.761 3.890 -4.169 1.00 . A B . 15 ARG HH22 1 1 15 11989 1 1 15 ARG N N 9.916 5.701 0.855 1.00 . A B . 15 ARG N 1 1 15 11990 1 1 15 ARG NE N 14.302 5.735 -1.575 1.00 . A B . 15 ARG NE 1 1 15 11991 1 1 15 ARG NH1 N 14.775 6.362 -3.742 1.00 . A B . 15 ARG NH1 1 1 15 11992 1 1 15 ARG NH2 N 14.586 4.137 -3.211 1.00 . A B . 15 ARG NH2 1 1 15 11993 1 1 15 ARG O O 11.190 8.562 2.426 1.00 . A B . 15 ARG O 1 1 15 11994 1 1 16 ASP C C 8.071 9.658 2.242 1.00 . A B . 16 ASP C 1 1 15 11995 1 1 16 ASP CA C 9.043 9.720 1.068 1.00 . A B . 16 ASP CA 1 1 15 11996 1 1 16 ASP CB C 8.309 10.245 -0.170 1.00 . A B . 16 ASP CB 1 1 15 11997 1 1 16 ASP CG C 9.242 10.800 -1.227 1.00 . A B . 16 ASP CG 1 1 15 11998 1 1 16 ASP H H 9.349 7.908 0.008 1.00 . A B . 16 ASP H 1 1 15 11999 1 1 16 ASP HA H 9.841 10.404 1.314 1.00 . A B . 16 ASP HA 1 1 15 12000 1 1 16 ASP HB2 H 7.743 9.438 -0.610 1.00 . A B . 16 ASP HB2 1 1 15 12001 1 1 16 ASP HB3 H 7.629 11.029 0.133 1.00 . A B . 16 ASP HB3 1 1 15 12002 1 1 16 ASP N N 9.645 8.418 0.795 1.00 . A B . 16 ASP N 1 1 15 12003 1 1 16 ASP O O 7.391 10.640 2.545 1.00 . A B . 16 ASP O 1 1 15 12004 1 1 16 ASP OD1 O 9.567 12.003 -1.175 1.00 . A B . 16 ASP OD1 1 1 15 12005 1 1 16 ASP OD2 O 9.675 10.026 -2.108 1.00 . A B . 16 ASP OD2 1 1 15 12006 1 1 17 GLY C C 5.666 8.218 3.658 1.00 . A B . 17 GLY C 1 1 15 12007 1 1 17 GLY CA C 7.125 8.354 4.048 1.00 . A B . 17 GLY CA 1 1 15 12008 1 1 17 GLY H H 8.547 7.748 2.596 1.00 . A B . 17 GLY H 1 1 15 12009 1 1 17 GLY HA2 H 7.424 7.474 4.601 1.00 . A B . 17 GLY HA2 1 1 15 12010 1 1 17 GLY HA3 H 7.234 9.221 4.685 1.00 . A B . 17 GLY HA3 1 1 15 12011 1 1 17 GLY N N 7.999 8.505 2.897 1.00 . A B . 17 GLY N 1 1 15 12012 1 1 17 GLY O O 4.773 8.589 4.423 1.00 . A B . 17 GLY O 1 1 15 12013 1 1 18 GLY C C 3.301 6.513 2.823 1.00 . A B . 18 GLY C 1 1 15 12014 1 1 18 GLY CA C 4.083 7.490 1.974 1.00 . A B . 18 GLY CA 1 1 15 12015 1 1 18 GLY H H 6.197 7.478 1.883 1.00 . A B . 18 GLY H 1 1 15 12016 1 1 18 GLY HA2 H 3.563 8.435 1.963 1.00 . A B . 18 GLY HA2 1 1 15 12017 1 1 18 GLY HA3 H 4.133 7.108 0.967 1.00 . A B . 18 GLY HA3 1 1 15 12018 1 1 18 GLY N N 5.433 7.702 2.459 1.00 . A B . 18 GLY N 1 1 15 12019 1 1 18 GLY O O 3.874 5.621 3.452 1.00 . A B . 18 GLY O 1 1 15 12020 1 1 19 GLU C C 0.554 4.684 2.884 1.00 . A B . 19 GLU C 1 1 15 12021 1 1 19 GLU CA C 1.112 5.875 3.654 1.00 . A B . 19 GLU CA 1 1 15 12022 1 1 19 GLU CB C -0.026 6.752 4.177 1.00 . A B . 19 GLU CB 1 1 15 12023 1 1 19 GLU CD C -0.694 8.731 5.600 1.00 . A B . 19 GLU CD 1 1 15 12024 1 1 19 GLU CG C 0.447 7.884 5.082 1.00 . A B . 19 GLU CG 1 1 15 12025 1 1 19 GLU H H 1.593 7.332 2.209 1.00 . A B . 19 GLU H 1 1 15 12026 1 1 19 GLU HA H 1.689 5.509 4.491 1.00 . A B . 19 GLU HA 1 1 15 12027 1 1 19 GLU HB2 H -0.537 7.189 3.331 1.00 . A B . 19 GLU HB2 1 1 15 12028 1 1 19 GLU HB3 H -0.722 6.137 4.729 1.00 . A B . 19 GLU HB3 1 1 15 12029 1 1 19 GLU HG2 H 0.972 7.463 5.927 1.00 . A B . 19 GLU HG2 1 1 15 12030 1 1 19 GLU HG3 H 1.119 8.518 4.523 1.00 . A B . 19 GLU HG3 1 1 15 12031 1 1 19 GLU N N 1.990 6.669 2.815 1.00 . A B . 19 GLU N 1 1 15 12032 1 1 19 GLU O O 0.512 4.691 1.655 1.00 . A B . 19 GLU O 1 1 15 12033 1 1 19 GLU OE1 O -1.349 8.320 6.584 1.00 . A B . 19 GLU OE1 1 1 15 12034 1 1 19 GLU OE2 O -0.950 9.804 5.018 1.00 . A B . 19 GLU OE2 1 1 15 12035 1 1 20 LEU C C -1.936 2.418 3.295 1.00 . A B . 20 LEU C 1 1 15 12036 1 1 20 LEU CA C -0.440 2.468 3.030 1.00 . A B . 20 LEU CA 1 1 15 12037 1 1 20 LEU CB C 0.218 1.211 3.599 1.00 . A B . 20 LEU CB 1 1 15 12038 1 1 20 LEU CD1 C 2.256 -0.218 3.831 1.00 . A B . 20 LEU CD1 1 1 15 12039 1 1 20 LEU CD2 C 1.348 0.273 1.567 1.00 . A B . 20 LEU CD2 1 1 15 12040 1 1 20 LEU CG C 1.557 0.820 2.972 1.00 . A B . 20 LEU CG 1 1 15 12041 1 1 20 LEU H H 0.226 3.716 4.596 1.00 . A B . 20 LEU H 1 1 15 12042 1 1 20 LEU HA H -0.269 2.506 1.965 1.00 . A B . 20 LEU HA 1 1 15 12043 1 1 20 LEU HB2 H 0.375 1.363 4.657 1.00 . A B . 20 LEU HB2 1 1 15 12044 1 1 20 LEU HB3 H -0.466 0.388 3.471 1.00 . A B . 20 LEU HB3 1 1 15 12045 1 1 20 LEU HD11 H 2.424 0.185 4.820 1.00 . A B . 20 LEU HD11 1 1 15 12046 1 1 20 LEU HD12 H 3.203 -0.477 3.382 1.00 . A B . 20 LEU HD12 1 1 15 12047 1 1 20 LEU HD13 H 1.636 -1.100 3.902 1.00 . A B . 20 LEU HD13 1 1 15 12048 1 1 20 LEU HD21 H 0.931 1.042 0.935 1.00 . A B . 20 LEU HD21 1 1 15 12049 1 1 20 LEU HD22 H 0.673 -0.568 1.605 1.00 . A B . 20 LEU HD22 1 1 15 12050 1 1 20 LEU HD23 H 2.297 -0.050 1.163 1.00 . A B . 20 LEU HD23 1 1 15 12051 1 1 20 LEU HG H 2.193 1.693 2.907 1.00 . A B . 20 LEU HG 1 1 15 12052 1 1 20 LEU N N 0.143 3.662 3.621 1.00 . A B . 20 LEU N 1 1 15 12053 1 1 20 LEU O O -2.383 2.592 4.431 1.00 . A B . 20 LEU O 1 1 15 12054 1 1 21 PHE C C -4.593 0.636 2.131 1.00 . A B . 21 PHE C 1 1 15 12055 1 1 21 PHE CA C -4.152 2.073 2.382 1.00 . A B . 21 PHE CA 1 1 15 12056 1 1 21 PHE CB C -4.839 3.045 1.418 1.00 . A B . 21 PHE CB 1 1 15 12057 1 1 21 PHE CD1 C -4.887 5.190 2.725 1.00 . A B . 21 PHE CD1 1 1 15 12058 1 1 21 PHE CD2 C -3.520 5.080 0.771 1.00 . A B . 21 PHE CD2 1 1 15 12059 1 1 21 PHE CE1 C -4.476 6.489 2.942 1.00 . A B . 21 PHE CE1 1 1 15 12060 1 1 21 PHE CE2 C -3.110 6.381 0.982 1.00 . A B . 21 PHE CE2 1 1 15 12061 1 1 21 PHE CG C -4.413 4.469 1.639 1.00 . A B . 21 PHE CG 1 1 15 12062 1 1 21 PHE CZ C -3.589 7.087 2.069 1.00 . A B . 21 PHE CZ 1 1 15 12063 1 1 21 PHE H H -2.295 2.070 1.363 1.00 . A B . 21 PHE H 1 1 15 12064 1 1 21 PHE HA H -4.407 2.341 3.399 1.00 . A B . 21 PHE HA 1 1 15 12065 1 1 21 PHE HB2 H -4.588 2.776 0.402 1.00 . A B . 21 PHE HB2 1 1 15 12066 1 1 21 PHE HB3 H -5.913 2.989 1.551 1.00 . A B . 21 PHE HB3 1 1 15 12067 1 1 21 PHE HD1 H -5.583 4.729 3.408 1.00 . A B . 21 PHE HD1 1 1 15 12068 1 1 21 PHE HD2 H -3.145 4.532 -0.081 1.00 . A B . 21 PHE HD2 1 1 15 12069 1 1 21 PHE HE1 H -4.853 7.040 3.791 1.00 . A B . 21 PHE HE1 1 1 15 12070 1 1 21 PHE HE2 H -2.414 6.846 0.299 1.00 . A B . 21 PHE HE2 1 1 15 12071 1 1 21 PHE HZ H -3.267 8.102 2.240 1.00 . A B . 21 PHE HZ 1 1 15 12072 1 1 21 PHE N N -2.707 2.177 2.250 1.00 . A B . 21 PHE N 1 1 15 12073 1 1 21 PHE O O -5.658 0.369 1.568 1.00 . A B . 21 PHE O 1 1 15 12074 1 1 22 CYS C C -3.772 -2.447 3.704 1.00 . A B . 22 CYS C 1 1 15 12075 1 1 22 CYS CA C -4.010 -1.703 2.402 1.00 . A B . 22 CYS CA 1 1 15 12076 1 1 22 CYS CB C -3.098 -2.280 1.320 1.00 . A B . 22 CYS CB 1 1 15 12077 1 1 22 CYS H H -2.940 -0.005 3.032 1.00 . A B . 22 CYS H 1 1 15 12078 1 1 22 CYS HA H -5.040 -1.825 2.103 1.00 . A B . 22 CYS HA 1 1 15 12079 1 1 22 CYS HB2 H -2.096 -1.907 1.472 1.00 . A B . 22 CYS HB2 1 1 15 12080 1 1 22 CYS HB3 H -3.092 -3.359 1.400 1.00 . A B . 22 CYS HB3 1 1 15 12081 1 1 22 CYS N N -3.756 -0.287 2.570 1.00 . A B . 22 CYS N 1 1 15 12082 1 1 22 CYS O O -2.983 -2.013 4.542 1.00 . A B . 22 CYS O 1 1 15 12083 1 1 22 CYS SG S -3.579 -1.854 -0.378 1.00 . A B . 22 CYS SG 1 1 15 12084 1 1 23 CYS C C -2.940 -5.197 4.784 1.00 . A B . 23 CYS C 1 1 15 12085 1 1 23 CYS CA C -4.239 -4.435 4.998 1.00 . A B . 23 CYS CA 1 1 15 12086 1 1 23 CYS CB C -5.417 -5.405 5.175 1.00 . A B . 23 CYS CB 1 1 15 12087 1 1 23 CYS H H -5.077 -3.844 3.154 1.00 . A B . 23 CYS H 1 1 15 12088 1 1 23 CYS HA H -4.144 -3.811 5.876 1.00 . A B . 23 CYS HA 1 1 15 12089 1 1 23 CYS HB2 H -5.356 -5.863 6.152 1.00 . A B . 23 CYS HB2 1 1 15 12090 1 1 23 CYS HB3 H -6.344 -4.854 5.098 1.00 . A B . 23 CYS HB3 1 1 15 12091 1 1 23 CYS N N -4.447 -3.576 3.851 1.00 . A B . 23 CYS N 1 1 15 12092 1 1 23 CYS O O -2.421 -5.206 3.661 1.00 . A B . 23 CYS O 1 1 15 12093 1 1 23 CYS SG S -5.472 -6.738 3.953 1.00 . A B . 23 CYS SG 1 1 15 12094 1 1 24 ASP C C -1.079 -7.476 4.559 1.00 . A B . 24 ASP C 1 1 15 12095 1 1 24 ASP CA C -1.121 -6.503 5.732 1.00 . A B . 24 ASP CA 1 1 15 12096 1 1 24 ASP CB C -0.781 -7.236 7.031 1.00 . A B . 24 ASP CB 1 1 15 12097 1 1 24 ASP CG C -0.441 -6.284 8.160 1.00 . A B . 24 ASP CG 1 1 15 12098 1 1 24 ASP H H -2.915 -5.851 6.674 1.00 . A B . 24 ASP H 1 1 15 12099 1 1 24 ASP HA H -0.375 -5.741 5.564 1.00 . A B . 24 ASP HA 1 1 15 12100 1 1 24 ASP HB2 H -1.626 -7.837 7.333 1.00 . A B . 24 ASP HB2 1 1 15 12101 1 1 24 ASP HB3 H 0.069 -7.881 6.860 1.00 . A B . 24 ASP HB3 1 1 15 12102 1 1 24 ASP N N -2.418 -5.830 5.825 1.00 . A B . 24 ASP N 1 1 15 12103 1 1 24 ASP O O -0.110 -7.501 3.804 1.00 . A B . 24 ASP O 1 1 15 12104 1 1 24 ASP OD1 O 0.641 -5.660 8.111 1.00 . A B . 24 ASP OD1 1 1 15 12105 1 1 24 ASP OD2 O -1.258 -6.145 9.098 1.00 . A B . 24 ASP OD2 1 1 15 12106 1 1 25 THR C C -2.063 -8.621 1.945 1.00 . A B . 25 THR C 1 1 15 12107 1 1 25 THR CA C -2.214 -9.241 3.336 1.00 . A B . 25 THR CA 1 1 15 12108 1 1 25 THR CB C -3.541 -10.012 3.412 1.00 . A B . 25 THR CB 1 1 15 12109 1 1 25 THR CG2 C -3.506 -11.247 2.526 1.00 . A B . 25 THR CG2 1 1 15 12110 1 1 25 THR H H -2.930 -8.116 4.967 1.00 . A B . 25 THR H 1 1 15 12111 1 1 25 THR HA H -1.407 -9.939 3.497 1.00 . A B . 25 THR HA 1 1 15 12112 1 1 25 THR HB H -4.336 -9.364 3.077 1.00 . A B . 25 THR HB 1 1 15 12113 1 1 25 THR HG1 H -3.084 -10.980 5.073 1.00 . A B . 25 THR HG1 1 1 15 12114 1 1 25 THR HG21 H -3.306 -10.953 1.506 1.00 . A B . 25 THR HG21 1 1 15 12115 1 1 25 THR HG22 H -4.460 -11.750 2.574 1.00 . A B . 25 THR HG22 1 1 15 12116 1 1 25 THR HG23 H -2.731 -11.915 2.868 1.00 . A B . 25 THR HG23 1 1 15 12117 1 1 25 THR N N -2.152 -8.234 4.381 1.00 . A B . 25 THR N 1 1 15 12118 1 1 25 THR O O -1.190 -9.019 1.175 1.00 . A B . 25 THR O 1 1 15 12119 1 1 25 THR OG1 O -3.793 -10.399 4.769 1.00 . A B . 25 THR OG1 1 1 15 12120 1 1 26 CYS C C -1.597 -6.189 0.096 1.00 . A B . 26 CYS C 1 1 15 12121 1 1 26 CYS CA C -2.865 -7.014 0.306 1.00 . A B . 26 CYS CA 1 1 15 12122 1 1 26 CYS CB C -4.087 -6.123 0.080 1.00 . A B . 26 CYS CB 1 1 15 12123 1 1 26 CYS H H -3.515 -7.292 2.310 1.00 . A B . 26 CYS H 1 1 15 12124 1 1 26 CYS HA H -2.876 -7.815 -0.419 1.00 . A B . 26 CYS HA 1 1 15 12125 1 1 26 CYS HB2 H -4.071 -5.323 0.800 1.00 . A B . 26 CYS HB2 1 1 15 12126 1 1 26 CYS HB3 H -4.035 -5.701 -0.913 1.00 . A B . 26 CYS HB3 1 1 15 12127 1 1 26 CYS N N -2.887 -7.623 1.635 1.00 . A B . 26 CYS N 1 1 15 12128 1 1 26 CYS O O -1.065 -6.132 -1.011 1.00 . A B . 26 CYS O 1 1 15 12129 1 1 26 CYS SG S -5.682 -6.958 0.241 1.00 . A B . 26 CYS SG 1 1 15 12130 1 1 27 SER C C 1.307 -5.542 0.728 1.00 . A B . 27 SER C 1 1 15 12131 1 1 27 SER CA C 0.075 -4.712 1.062 1.00 . A B . 27 SER CA 1 1 15 12132 1 1 27 SER CB C 0.296 -3.951 2.372 1.00 . A B . 27 SER CB 1 1 15 12133 1 1 27 SER H H -1.533 -5.680 2.037 1.00 . A B . 27 SER H 1 1 15 12134 1 1 27 SER HA H -0.095 -4.001 0.267 1.00 . A B . 27 SER HA 1 1 15 12135 1 1 27 SER HB2 H -0.590 -3.386 2.613 1.00 . A B . 27 SER HB2 1 1 15 12136 1 1 27 SER HB3 H 0.496 -4.658 3.163 1.00 . A B . 27 SER HB3 1 1 15 12137 1 1 27 SER HG H 1.180 -2.362 1.638 1.00 . A B . 27 SER HG 1 1 15 12138 1 1 27 SER N N -1.105 -5.562 1.160 1.00 . A B . 27 SER N 1 1 15 12139 1 1 27 SER O O 2.214 -5.077 0.048 1.00 . A B . 27 SER O 1 1 15 12140 1 1 27 SER OG O 1.392 -3.056 2.271 1.00 . A B . 27 SER OG 1 1 15 12141 1 1 28 ARG C C 2.400 -8.242 -0.459 1.00 . A B . 28 ARG C 1 1 15 12142 1 1 28 ARG CA C 2.458 -7.661 0.952 1.00 . A B . 28 ARG CA 1 1 15 12143 1 1 28 ARG CB C 2.498 -8.777 1.999 1.00 . A B . 28 ARG CB 1 1 15 12144 1 1 28 ARG CD C 2.717 -9.384 4.438 1.00 . A B . 28 ARG CD 1 1 15 12145 1 1 28 ARG CG C 2.855 -8.284 3.397 1.00 . A B . 28 ARG CG 1 1 15 12146 1 1 28 ARG CZ C 2.369 -9.263 6.884 1.00 . A B . 28 ARG CZ 1 1 15 12147 1 1 28 ARG H H 0.597 -7.088 1.776 1.00 . A B . 28 ARG H 1 1 15 12148 1 1 28 ARG HA H 3.360 -7.073 1.039 1.00 . A B . 28 ARG HA 1 1 15 12149 1 1 28 ARG HB2 H 1.526 -9.246 2.044 1.00 . A B . 28 ARG HB2 1 1 15 12150 1 1 28 ARG HB3 H 3.231 -9.512 1.699 1.00 . A B . 28 ARG HB3 1 1 15 12151 1 1 28 ARG HD2 H 1.703 -9.751 4.423 1.00 . A B . 28 ARG HD2 1 1 15 12152 1 1 28 ARG HD3 H 3.395 -10.187 4.189 1.00 . A B . 28 ARG HD3 1 1 15 12153 1 1 28 ARG HE H 3.777 -8.264 5.869 1.00 . A B . 28 ARG HE 1 1 15 12154 1 1 28 ARG HG2 H 3.876 -7.935 3.394 1.00 . A B . 28 ARG HG2 1 1 15 12155 1 1 28 ARG HG3 H 2.197 -7.469 3.660 1.00 . A B . 28 ARG HG3 1 1 15 12156 1 1 28 ARG HH11 H 1.077 -10.496 5.920 1.00 . A B . 28 ARG HH11 1 1 15 12157 1 1 28 ARG HH12 H 0.851 -10.380 7.636 1.00 . A B . 28 ARG HH12 1 1 15 12158 1 1 28 ARG HH21 H 3.491 -8.124 8.131 1.00 . A B . 28 ARG HH21 1 1 15 12159 1 1 28 ARG HH22 H 2.229 -9.041 8.894 1.00 . A B . 28 ARG HH22 1 1 15 12160 1 1 28 ARG N N 1.334 -6.775 1.210 1.00 . A B . 28 ARG N 1 1 15 12161 1 1 28 ARG NE N 3.029 -8.899 5.783 1.00 . A B . 28 ARG NE 1 1 15 12162 1 1 28 ARG NH1 N 1.353 -10.116 6.807 1.00 . A B . 28 ARG NH1 1 1 15 12163 1 1 28 ARG NH2 N 2.726 -8.770 8.062 1.00 . A B . 28 ARG NH2 1 1 15 12164 1 1 28 ARG O O 3.409 -8.708 -0.988 1.00 . A B . 28 ARG O 1 1 15 12165 1 1 29 VAL C C 1.159 -7.621 -3.463 1.00 . A B . 29 VAL C 1 1 15 12166 1 1 29 VAL CA C 1.063 -8.739 -2.421 1.00 . A B . 29 VAL CA 1 1 15 12167 1 1 29 VAL CB C -0.279 -9.486 -2.592 1.00 . A B . 29 VAL CB 1 1 15 12168 1 1 29 VAL CG1 C -0.388 -10.099 -3.981 1.00 . A B . 29 VAL CG1 1 1 15 12169 1 1 29 VAL CG2 C -0.434 -10.562 -1.531 1.00 . A B . 29 VAL CG2 1 1 15 12170 1 1 29 VAL H H 0.438 -7.869 -0.596 1.00 . A B . 29 VAL H 1 1 15 12171 1 1 29 VAL HA H 1.862 -9.441 -2.596 1.00 . A B . 29 VAL HA 1 1 15 12172 1 1 29 VAL HB H -1.082 -8.775 -2.469 1.00 . A B . 29 VAL HB 1 1 15 12173 1 1 29 VAL HG11 H -0.325 -9.319 -4.725 1.00 . A B . 29 VAL HG11 1 1 15 12174 1 1 29 VAL HG12 H -1.335 -10.610 -4.075 1.00 . A B . 29 VAL HG12 1 1 15 12175 1 1 29 VAL HG13 H 0.417 -10.803 -4.127 1.00 . A B . 29 VAL HG13 1 1 15 12176 1 1 29 VAL HG21 H 0.401 -11.243 -1.586 1.00 . A B . 29 VAL HG21 1 1 15 12177 1 1 29 VAL HG22 H -1.352 -11.106 -1.702 1.00 . A B . 29 VAL HG22 1 1 15 12178 1 1 29 VAL HG23 H -0.464 -10.106 -0.554 1.00 . A B . 29 VAL HG23 1 1 15 12179 1 1 29 VAL N N 1.221 -8.221 -1.067 1.00 . A B . 29 VAL N 1 1 15 12180 1 1 29 VAL O O 1.791 -7.790 -4.504 1.00 . A B . 29 VAL O 1 1 15 12181 1 1 30 PHE C C 1.084 -4.109 -3.454 1.00 . A B . 30 PHE C 1 1 15 12182 1 1 30 PHE CA C 0.531 -5.363 -4.118 1.00 . A B . 30 PHE CA 1 1 15 12183 1 1 30 PHE CB C -0.897 -5.081 -4.612 1.00 . A B . 30 PHE CB 1 1 15 12184 1 1 30 PHE CD1 C -1.224 -6.816 -6.409 1.00 . A B . 30 PHE CD1 1 1 15 12185 1 1 30 PHE CD2 C -2.679 -6.844 -4.518 1.00 . A B . 30 PHE CD2 1 1 15 12186 1 1 30 PHE CE1 C -1.887 -7.905 -6.938 1.00 . A B . 30 PHE CE1 1 1 15 12187 1 1 30 PHE CE2 C -3.345 -7.934 -5.043 1.00 . A B . 30 PHE CE2 1 1 15 12188 1 1 30 PHE CG C -1.610 -6.273 -5.192 1.00 . A B . 30 PHE CG 1 1 15 12189 1 1 30 PHE CZ C -2.949 -8.466 -6.254 1.00 . A B . 30 PHE CZ 1 1 15 12190 1 1 30 PHE H H 0.110 -6.372 -2.301 1.00 . A B . 30 PHE H 1 1 15 12191 1 1 30 PHE HA H 1.157 -5.624 -4.958 1.00 . A B . 30 PHE HA 1 1 15 12192 1 1 30 PHE HB2 H -1.488 -4.721 -3.783 1.00 . A B . 30 PHE HB2 1 1 15 12193 1 1 30 PHE HB3 H -0.858 -4.315 -5.375 1.00 . A B . 30 PHE HB3 1 1 15 12194 1 1 30 PHE HD1 H -0.392 -6.382 -6.946 1.00 . A B . 30 PHE HD1 1 1 15 12195 1 1 30 PHE HD2 H -2.993 -6.426 -3.572 1.00 . A B . 30 PHE HD2 1 1 15 12196 1 1 30 PHE HE1 H -1.577 -8.317 -7.886 1.00 . A B . 30 PHE HE1 1 1 15 12197 1 1 30 PHE HE2 H -4.174 -8.369 -4.505 1.00 . A B . 30 PHE HE2 1 1 15 12198 1 1 30 PHE HZ H -3.470 -9.318 -6.667 1.00 . A B . 30 PHE HZ 1 1 15 12199 1 1 30 PHE N N 0.550 -6.478 -3.176 1.00 . A B . 30 PHE N 1 1 15 12200 1 1 30 PHE O O 0.442 -3.062 -3.467 1.00 . A B . 30 PHE O 1 1 15 12201 1 1 31 HIS C C 2.904 -1.829 -2.896 1.00 . A B . 31 HIS C 1 1 15 12202 1 1 31 HIS CA C 2.880 -3.137 -2.110 1.00 . A B . 31 HIS CA 1 1 15 12203 1 1 31 HIS CB C 4.299 -3.528 -1.680 1.00 . A B . 31 HIS CB 1 1 15 12204 1 1 31 HIS CD2 C 6.074 -1.748 -1.025 1.00 . A B . 31 HIS CD2 1 1 15 12205 1 1 31 HIS CE1 C 5.432 -1.318 0.996 1.00 . A B . 31 HIS CE1 1 1 15 12206 1 1 31 HIS CG C 4.982 -2.523 -0.791 1.00 . A B . 31 HIS CG 1 1 15 12207 1 1 31 HIS H H 2.770 -5.070 -2.972 1.00 . A B . 31 HIS H 1 1 15 12208 1 1 31 HIS HA H 2.278 -2.992 -1.227 1.00 . A B . 31 HIS HA 1 1 15 12209 1 1 31 HIS HB2 H 4.253 -4.464 -1.142 1.00 . A B . 31 HIS HB2 1 1 15 12210 1 1 31 HIS HB3 H 4.906 -3.659 -2.563 1.00 . A B . 31 HIS HB3 1 1 15 12211 1 1 31 HIS HD1 H 3.832 -2.647 0.973 1.00 . A B . 31 HIS HD1 1 1 15 12212 1 1 31 HIS HD2 H 6.628 -1.704 -1.950 1.00 . A B . 31 HIS HD2 1 1 15 12213 1 1 31 HIS HE1 H 5.363 -0.901 1.990 1.00 . A B . 31 HIS HE1 1 1 15 12214 1 1 31 HIS N N 2.279 -4.225 -2.882 1.00 . A B . 31 HIS N 1 1 15 12215 1 1 31 HIS ND1 N 4.589 -2.239 0.498 1.00 . A B . 31 HIS ND1 1 1 15 12216 1 1 31 HIS NE2 N 6.356 -0.986 0.110 1.00 . A B . 31 HIS NE2 1 1 15 12217 1 1 31 HIS O O 2.434 -0.811 -2.409 1.00 . A B . 31 HIS O 1 1 15 12218 1 1 32 GLU C C 2.217 -0.024 -5.222 1.00 . A B . 32 GLU C 1 1 15 12219 1 1 32 GLU CA C 3.562 -0.678 -4.938 1.00 . A B . 32 GLU CA 1 1 15 12220 1 1 32 GLU CB C 4.236 -1.027 -6.263 1.00 . A B . 32 GLU CB 1 1 15 12221 1 1 32 GLU CD C 6.083 -2.279 -7.401 1.00 . A B . 32 GLU CD 1 1 15 12222 1 1 32 GLU CG C 5.625 -1.620 -6.121 1.00 . A B . 32 GLU CG 1 1 15 12223 1 1 32 GLU H H 3.586 -2.757 -4.519 1.00 . A B . 32 GLU H 1 1 15 12224 1 1 32 GLU HA H 4.185 0.011 -4.389 1.00 . A B . 32 GLU HA 1 1 15 12225 1 1 32 GLU HB2 H 3.618 -1.742 -6.787 1.00 . A B . 32 GLU HB2 1 1 15 12226 1 1 32 GLU HB3 H 4.312 -0.130 -6.859 1.00 . A B . 32 GLU HB3 1 1 15 12227 1 1 32 GLU HG2 H 6.318 -0.831 -5.869 1.00 . A B . 32 GLU HG2 1 1 15 12228 1 1 32 GLU HG3 H 5.616 -2.358 -5.334 1.00 . A B . 32 GLU HG3 1 1 15 12229 1 1 32 GLU N N 3.384 -1.883 -4.130 1.00 . A B . 32 GLU N 1 1 15 12230 1 1 32 GLU O O 2.034 1.179 -5.019 1.00 . A B . 32 GLU O 1 1 15 12231 1 1 32 GLU OE1 O 6.674 -1.580 -8.250 1.00 . A B . 32 GLU OE1 1 1 15 12232 1 1 32 GLU OE2 O 5.879 -3.502 -7.559 1.00 . A B . 32 GLU OE2 1 1 15 12233 1 1 33 ASP C C -0.822 0.124 -4.842 1.00 . A B . 33 ASP C 1 1 15 12234 1 1 33 ASP CA C -0.050 -0.381 -6.054 1.00 . A B . 33 ASP CA 1 1 15 12235 1 1 33 ASP CB C -0.824 -1.511 -6.735 1.00 . A B . 33 ASP CB 1 1 15 12236 1 1 33 ASP CG C -0.195 -1.947 -8.043 1.00 . A B . 33 ASP CG 1 1 15 12237 1 1 33 ASP H H 1.485 -1.796 -5.744 1.00 . A B . 33 ASP H 1 1 15 12238 1 1 33 ASP HA H 0.072 0.434 -6.753 1.00 . A B . 33 ASP HA 1 1 15 12239 1 1 33 ASP HB2 H -0.859 -2.363 -6.073 1.00 . A B . 33 ASP HB2 1 1 15 12240 1 1 33 ASP HB3 H -1.831 -1.178 -6.937 1.00 . A B . 33 ASP HB3 1 1 15 12241 1 1 33 ASP N N 1.277 -0.842 -5.670 1.00 . A B . 33 ASP N 1 1 15 12242 1 1 33 ASP O O -1.743 0.930 -4.967 1.00 . A B . 33 ASP O 1 1 15 12243 1 1 33 ASP OD1 O 0.905 -2.531 -8.011 1.00 . A B . 33 ASP OD1 1 1 15 12244 1 1 33 ASP OD2 O -0.801 -1.716 -9.115 1.00 . A B . 33 ASP OD2 1 1 15 12245 1 1 34 CYS C C -0.615 1.410 -1.946 1.00 . A B . 34 CYS C 1 1 15 12246 1 1 34 CYS CA C -1.087 0.036 -2.424 1.00 . A B . 34 CYS CA 1 1 15 12247 1 1 34 CYS CB C -0.847 -1.022 -1.347 1.00 . A B . 34 CYS CB 1 1 15 12248 1 1 34 CYS H H 0.291 -1.018 -3.638 1.00 . A B . 34 CYS H 1 1 15 12249 1 1 34 CYS HA H -2.149 0.093 -2.617 1.00 . A B . 34 CYS HA 1 1 15 12250 1 1 34 CYS HB2 H 0.165 -1.398 -1.434 1.00 . A B . 34 CYS HB2 1 1 15 12251 1 1 34 CYS HB3 H -0.978 -0.574 -0.373 1.00 . A B . 34 CYS HB3 1 1 15 12252 1 1 34 CYS N N -0.442 -0.362 -3.669 1.00 . A B . 34 CYS N 1 1 15 12253 1 1 34 CYS O O -1.091 1.920 -0.929 1.00 . A B . 34 CYS O 1 1 15 12254 1 1 34 CYS SG S -1.974 -2.448 -1.462 1.00 . A B . 34 CYS SG 1 1 15 12255 1 1 35 HIS C C 0.223 4.304 -3.478 1.00 . A B . 35 HIS C 1 1 15 12256 1 1 35 HIS CA C 0.756 3.370 -2.404 1.00 . A B . 35 HIS CA 1 1 15 12257 1 1 35 HIS CB C 2.277 3.480 -2.396 1.00 . A B . 35 HIS CB 1 1 15 12258 1 1 35 HIS CD2 C 3.409 1.492 -1.226 1.00 . A B . 35 HIS CD2 1 1 15 12259 1 1 35 HIS CE1 C 3.854 2.392 0.683 1.00 . A B . 35 HIS CE1 1 1 15 12260 1 1 35 HIS CG C 2.946 2.757 -1.277 1.00 . A B . 35 HIS CG 1 1 15 12261 1 1 35 HIS H H 0.744 1.504 -3.408 1.00 . A B . 35 HIS H 1 1 15 12262 1 1 35 HIS HA H 0.369 3.666 -1.439 1.00 . A B . 35 HIS HA 1 1 15 12263 1 1 35 HIS HB2 H 2.659 3.074 -3.321 1.00 . A B . 35 HIS HB2 1 1 15 12264 1 1 35 HIS HB3 H 2.550 4.523 -2.329 1.00 . A B . 35 HIS HB3 1 1 15 12265 1 1 35 HIS HD1 H 2.962 4.215 0.249 1.00 . A B . 35 HIS HD1 1 1 15 12266 1 1 35 HIS HD2 H 3.355 0.767 -2.025 1.00 . A B . 35 HIS HD2 1 1 15 12267 1 1 35 HIS HE1 H 4.214 2.555 1.687 1.00 . A B . 35 HIS HE1 1 1 15 12268 1 1 35 HIS N N 0.325 2.002 -2.673 1.00 . A B . 35 HIS N 1 1 15 12269 1 1 35 HIS ND1 N 3.226 3.318 -0.052 1.00 . A B . 35 HIS ND1 1 1 15 12270 1 1 35 HIS NE2 N 3.986 1.257 0.011 1.00 . A B . 35 HIS NE2 1 1 15 12271 1 1 35 HIS O O -0.304 5.380 -3.190 1.00 . A B . 35 HIS O 1 1 15 12272 1 1 36 ILE C C -0.763 3.826 -6.886 1.00 . A B . 36 ILE C 1 1 15 12273 1 1 36 ILE CA C -0.006 4.676 -5.869 1.00 . A B . 36 ILE CA 1 1 15 12274 1 1 36 ILE CB C 1.220 5.360 -6.541 1.00 . A B . 36 ILE CB 1 1 15 12275 1 1 36 ILE CD1 C 2.534 3.389 -7.543 1.00 . A B . 36 ILE CD1 1 1 15 12276 1 1 36 ILE CG1 C 2.478 4.472 -6.484 1.00 . A B . 36 ILE CG1 1 1 15 12277 1 1 36 ILE CG2 C 1.501 6.714 -5.900 1.00 . A B . 36 ILE CG2 1 1 15 12278 1 1 36 ILE H H 0.759 2.985 -4.873 1.00 . A B . 36 ILE H 1 1 15 12279 1 1 36 ILE HA H -0.668 5.451 -5.510 1.00 . A B . 36 ILE HA 1 1 15 12280 1 1 36 ILE HB H 0.968 5.536 -7.576 1.00 . A B . 36 ILE HB 1 1 15 12281 1 1 36 ILE HD11 H 1.668 2.751 -7.452 1.00 . A B . 36 ILE HD11 1 1 15 12282 1 1 36 ILE HD12 H 3.430 2.800 -7.409 1.00 . A B . 36 ILE HD12 1 1 15 12283 1 1 36 ILE HD13 H 2.544 3.843 -8.523 1.00 . A B . 36 ILE HD13 1 1 15 12284 1 1 36 ILE HG12 H 3.354 5.091 -6.607 1.00 . A B . 36 ILE HG12 1 1 15 12285 1 1 36 ILE HG13 H 2.522 3.992 -5.519 1.00 . A B . 36 ILE HG13 1 1 15 12286 1 1 36 ILE HG21 H 2.417 7.122 -6.306 1.00 . A B . 36 ILE HG21 1 1 15 12287 1 1 36 ILE HG22 H 1.603 6.596 -4.831 1.00 . A B . 36 ILE HG22 1 1 15 12288 1 1 36 ILE HG23 H 0.687 7.388 -6.111 1.00 . A B . 36 ILE HG23 1 1 15 12289 1 1 36 ILE N N 0.382 3.878 -4.722 1.00 . A B . 36 ILE N 1 1 15 12290 1 1 36 ILE O O -0.383 2.687 -7.156 1.00 . A B . 36 ILE O 1 1 15 12291 1 1 37 PRO C C -3.115 5.651 -5.730 1.00 . A B . 37 PRO C 1 1 15 12292 1 1 37 PRO CA C -2.399 5.668 -7.082 1.00 . A B . 37 PRO CA 1 1 15 12293 1 1 37 PRO CB C -3.392 5.955 -8.210 1.00 . A B . 37 PRO CB 1 1 15 12294 1 1 37 PRO CD C -2.688 3.683 -8.470 1.00 . A B . 37 PRO CD 1 1 15 12295 1 1 37 PRO CG C -3.871 4.605 -8.628 1.00 . A B . 37 PRO CG 1 1 15 12296 1 1 37 PRO HA H -1.622 6.421 -7.071 1.00 . A B . 37 PRO HA 1 1 15 12297 1 1 37 PRO HB2 H -4.205 6.566 -7.832 1.00 . A B . 37 PRO HB2 1 1 15 12298 1 1 37 PRO HB3 H -2.889 6.471 -9.022 1.00 . A B . 37 PRO HB3 1 1 15 12299 1 1 37 PRO HD2 H -3.011 2.707 -8.134 1.00 . A B . 37 PRO HD2 1 1 15 12300 1 1 37 PRO HD3 H -2.144 3.603 -9.401 1.00 . A B . 37 PRO HD3 1 1 15 12301 1 1 37 PRO HG2 H -4.684 4.288 -7.986 1.00 . A B . 37 PRO HG2 1 1 15 12302 1 1 37 PRO HG3 H -4.194 4.628 -9.659 1.00 . A B . 37 PRO HG3 1 1 15 12303 1 1 37 PRO N N -1.867 4.348 -7.439 1.00 . A B . 37 PRO N 1 1 15 12304 1 1 37 PRO O O -3.843 4.708 -5.416 1.00 . A B . 37 PRO O 1 1 15 12305 1 1 38 PRO C C -5.014 7.132 -3.687 1.00 . A B . 38 PRO C 1 1 15 12306 1 1 38 PRO CA C -3.534 6.776 -3.591 1.00 . A B . 38 PRO CA 1 1 15 12307 1 1 38 PRO CB C -2.754 7.892 -2.896 1.00 . A B . 38 PRO CB 1 1 15 12308 1 1 38 PRO CD C -2.036 7.842 -5.189 1.00 . A B . 38 PRO CD 1 1 15 12309 1 1 38 PRO CG C -2.254 8.755 -4.006 1.00 . A B . 38 PRO CG 1 1 15 12310 1 1 38 PRO HA H -3.421 5.858 -3.037 1.00 . A B . 38 PRO HA 1 1 15 12311 1 1 38 PRO HB2 H -3.414 8.438 -2.235 1.00 . A B . 38 PRO HB2 1 1 15 12312 1 1 38 PRO HB3 H -1.940 7.467 -2.328 1.00 . A B . 38 PRO HB3 1 1 15 12313 1 1 38 PRO HD2 H -2.335 8.329 -6.107 1.00 . A B . 38 PRO HD2 1 1 15 12314 1 1 38 PRO HD3 H -1.000 7.538 -5.243 1.00 . A B . 38 PRO HD3 1 1 15 12315 1 1 38 PRO HG2 H -2.994 9.507 -4.245 1.00 . A B . 38 PRO HG2 1 1 15 12316 1 1 38 PRO HG3 H -1.324 9.225 -3.717 1.00 . A B . 38 PRO HG3 1 1 15 12317 1 1 38 PRO N N -2.905 6.685 -4.906 1.00 . A B . 38 PRO N 1 1 15 12318 1 1 38 PRO O O -5.430 7.874 -4.580 1.00 . A B . 38 PRO O 1 1 15 12319 1 1 39 VAL C C -7.462 8.244 -2.050 1.00 . A B . 39 VAL C 1 1 15 12320 1 1 39 VAL CA C -7.233 6.884 -2.728 1.00 . A B . 39 VAL CA 1 1 15 12321 1 1 39 VAL CB C -8.020 5.747 -2.020 1.00 . A B . 39 VAL CB 1 1 15 12322 1 1 39 VAL CG1 C -7.524 5.511 -0.598 1.00 . A B . 39 VAL CG1 1 1 15 12323 1 1 39 VAL CG2 C -9.517 6.026 -2.036 1.00 . A B . 39 VAL CG2 1 1 15 12324 1 1 39 VAL H H -5.432 5.956 -2.133 1.00 . A B . 39 VAL H 1 1 15 12325 1 1 39 VAL HA H -7.585 6.949 -3.746 1.00 . A B . 39 VAL HA 1 1 15 12326 1 1 39 VAL HB H -7.850 4.839 -2.577 1.00 . A B . 39 VAL HB 1 1 15 12327 1 1 39 VAL HG11 H -8.186 4.824 -0.096 1.00 . A B . 39 VAL HG11 1 1 15 12328 1 1 39 VAL HG12 H -7.504 6.448 -0.063 1.00 . A B . 39 VAL HG12 1 1 15 12329 1 1 39 VAL HG13 H -6.530 5.092 -0.627 1.00 . A B . 39 VAL HG13 1 1 15 12330 1 1 39 VAL HG21 H -9.846 6.163 -3.054 1.00 . A B . 39 VAL HG21 1 1 15 12331 1 1 39 VAL HG22 H -9.722 6.918 -1.467 1.00 . A B . 39 VAL HG22 1 1 15 12332 1 1 39 VAL HG23 H -10.042 5.191 -1.596 1.00 . A B . 39 VAL HG23 1 1 15 12333 1 1 39 VAL N N -5.810 6.582 -2.781 1.00 . A B . 39 VAL N 1 1 15 12334 1 1 39 VAL O O -7.871 8.336 -0.895 1.00 . A B . 39 VAL O 1 1 15 12335 1 1 40 GLU C C -8.626 11.200 -2.082 1.00 . A B . 40 GLU C 1 1 15 12336 1 1 40 GLU CA C -7.209 10.659 -2.224 1.00 . A B . 40 GLU CA 1 1 15 12337 1 1 40 GLU CB C -6.362 11.608 -3.073 1.00 . A B . 40 GLU CB 1 1 15 12338 1 1 40 GLU CD C -4.054 12.225 -3.880 1.00 . A B . 40 GLU CD 1 1 15 12339 1 1 40 GLU CG C -4.903 11.194 -3.172 1.00 . A B . 40 GLU CG 1 1 15 12340 1 1 40 GLU H H -6.959 9.188 -3.736 1.00 . A B . 40 GLU H 1 1 15 12341 1 1 40 GLU HA H -6.775 10.598 -1.240 1.00 . A B . 40 GLU HA 1 1 15 12342 1 1 40 GLU HB2 H -6.774 11.644 -4.072 1.00 . A B . 40 GLU HB2 1 1 15 12343 1 1 40 GLU HB3 H -6.406 12.596 -2.641 1.00 . A B . 40 GLU HB3 1 1 15 12344 1 1 40 GLU HG2 H -4.510 11.052 -2.176 1.00 . A B . 40 GLU HG2 1 1 15 12345 1 1 40 GLU HG3 H -4.844 10.264 -3.718 1.00 . A B . 40 GLU HG3 1 1 15 12346 1 1 40 GLU N N -7.188 9.311 -2.788 1.00 . A B . 40 GLU N 1 1 15 12347 1 1 40 GLU O O -8.849 12.210 -1.414 1.00 . A B . 40 GLU O 1 1 15 12348 1 1 40 GLU OE1 O -3.709 13.251 -3.258 1.00 . A B . 40 GLU OE1 1 1 15 12349 1 1 40 GLU OE2 O -3.741 12.019 -5.070 1.00 . A B . 40 GLU OE2 1 1 15 12350 1 1 41 ALA C C -11.485 10.612 -1.171 1.00 . A B . 41 ALA C 1 1 15 12351 1 1 41 ALA CA C -10.981 10.912 -2.576 1.00 . A B . 41 ALA CA 1 1 15 12352 1 1 41 ALA CB C -11.831 10.194 -3.610 1.00 . A B . 41 ALA CB 1 1 15 12353 1 1 41 ALA H H -9.339 9.760 -3.260 1.00 . A B . 41 ALA H 1 1 15 12354 1 1 41 ALA HA H -11.052 11.974 -2.753 1.00 . A B . 41 ALA HA 1 1 15 12355 1 1 41 ALA HB1 H -12.861 10.501 -3.502 1.00 . A B . 41 ALA HB1 1 1 15 12356 1 1 41 ALA HB2 H -11.755 9.127 -3.461 1.00 . A B . 41 ALA HB2 1 1 15 12357 1 1 41 ALA HB3 H -11.483 10.446 -4.599 1.00 . A B . 41 ALA HB3 1 1 15 12358 1 1 41 ALA N N -9.581 10.528 -2.703 1.00 . A B . 41 ALA N 1 1 15 12359 1 1 41 ALA O O -12.384 11.280 -0.661 1.00 . A B . 41 ALA O 1 1 15 12360 1 1 42 GLU C C -10.083 8.381 1.403 1.00 . A B . 42 GLU C 1 1 15 12361 1 1 42 GLU CA C -11.220 9.205 0.802 1.00 . A B . 42 GLU CA 1 1 15 12362 1 1 42 GLU CB C -12.545 8.430 0.834 1.00 . A B . 42 GLU CB 1 1 15 12363 1 1 42 GLU CD C -14.015 6.659 -0.205 1.00 . A B . 42 GLU CD 1 1 15 12364 1 1 42 GLU CG C -12.680 7.375 -0.254 1.00 . A B . 42 GLU CG 1 1 15 12365 1 1 42 GLU H H -10.181 9.117 -1.027 1.00 . A B . 42 GLU H 1 1 15 12366 1 1 42 GLU HA H -11.331 10.106 1.384 1.00 . A B . 42 GLU HA 1 1 15 12367 1 1 42 GLU HB2 H -12.635 7.939 1.790 1.00 . A B . 42 GLU HB2 1 1 15 12368 1 1 42 GLU HB3 H -13.357 9.133 0.723 1.00 . A B . 42 GLU HB3 1 1 15 12369 1 1 42 GLU HG2 H -12.578 7.855 -1.216 1.00 . A B . 42 GLU HG2 1 1 15 12370 1 1 42 GLU HG3 H -11.892 6.648 -0.131 1.00 . A B . 42 GLU HG3 1 1 15 12371 1 1 42 GLU N N -10.884 9.604 -0.555 1.00 . A B . 42 GLU N 1 1 15 12372 1 1 42 GLU O O -10.138 7.151 1.447 1.00 . A B . 42 GLU O 1 1 15 12373 1 1 42 GLU OE1 O -15.030 7.244 -0.642 1.00 . A B . 42 GLU OE1 1 1 15 12374 1 1 42 GLU OE2 O -14.061 5.504 0.269 1.00 . A B . 42 GLU OE2 1 1 15 12375 1 1 43 ARG C C -8.170 7.811 3.759 1.00 . A B . 43 ARG C 1 1 15 12376 1 1 43 ARG CA C -7.862 8.414 2.397 1.00 . A B . 43 ARG CA 1 1 15 12377 1 1 43 ARG CB C -6.683 9.382 2.521 1.00 . A B . 43 ARG CB 1 1 15 12378 1 1 43 ARG CD C -4.854 10.577 1.278 1.00 . A B . 43 ARG CD 1 1 15 12379 1 1 43 ARG CG C -6.279 10.047 1.214 1.00 . A B . 43 ARG CG 1 1 15 12380 1 1 43 ARG CZ C -3.649 11.397 3.274 1.00 . A B . 43 ARG CZ 1 1 15 12381 1 1 43 ARG H H -9.065 10.052 1.807 1.00 . A B . 43 ARG H 1 1 15 12382 1 1 43 ARG HA H -7.587 7.617 1.722 1.00 . A B . 43 ARG HA 1 1 15 12383 1 1 43 ARG HB2 H -6.945 10.158 3.224 1.00 . A B . 43 ARG HB2 1 1 15 12384 1 1 43 ARG HB3 H -5.830 8.840 2.901 1.00 . A B . 43 ARG HB3 1 1 15 12385 1 1 43 ARG HD2 H -4.182 9.741 1.386 1.00 . A B . 43 ARG HD2 1 1 15 12386 1 1 43 ARG HD3 H -4.636 11.094 0.355 1.00 . A B . 43 ARG HD3 1 1 15 12387 1 1 43 ARG HE H -5.300 12.233 2.497 1.00 . A B . 43 ARG HE 1 1 15 12388 1 1 43 ARG HG2 H -6.349 9.323 0.415 1.00 . A B . 43 ARG HG2 1 1 15 12389 1 1 43 ARG HG3 H -6.950 10.870 1.017 1.00 . A B . 43 ARG HG3 1 1 15 12390 1 1 43 ARG HH11 H -2.784 9.798 2.374 1.00 . A B . 43 ARG HH11 1 1 15 12391 1 1 43 ARG HH12 H -1.994 10.343 3.825 1.00 . A B . 43 ARG HH12 1 1 15 12392 1 1 43 ARG HH21 H -4.222 13.018 4.352 1.00 . A B . 43 ARG HH21 1 1 15 12393 1 1 43 ARG HH22 H -2.797 12.209 4.924 1.00 . A B . 43 ARG HH22 1 1 15 12394 1 1 43 ARG N N -9.039 9.073 1.847 1.00 . A B . 43 ARG N 1 1 15 12395 1 1 43 ARG NE N -4.650 11.497 2.397 1.00 . A B . 43 ARG NE 1 1 15 12396 1 1 43 ARG NH1 N -2.734 10.440 3.142 1.00 . A B . 43 ARG NH1 1 1 15 12397 1 1 43 ARG NH2 N -3.547 12.277 4.264 1.00 . A B . 43 ARG NH2 1 1 15 12398 1 1 43 ARG O O -8.361 8.525 4.744 1.00 . A B . 43 ARG O 1 1 15 12399 1 1 44 THR C C -7.425 4.731 5.296 1.00 . A B . 44 THR C 1 1 15 12400 1 1 44 THR CA C -8.502 5.782 5.035 1.00 . A B . 44 THR CA 1 1 15 12401 1 1 44 THR CB C -9.882 5.100 4.977 1.00 . A B . 44 THR CB 1 1 15 12402 1 1 44 THR CG2 C -10.997 6.130 4.892 1.00 . A B . 44 THR CG2 1 1 15 12403 1 1 44 THR H H -8.099 5.981 2.978 1.00 . A B . 44 THR H 1 1 15 12404 1 1 44 THR HA H -8.506 6.498 5.842 1.00 . A B . 44 THR HA 1 1 15 12405 1 1 44 THR HB H -10.014 4.514 5.876 1.00 . A B . 44 THR HB 1 1 15 12406 1 1 44 THR HG1 H -9.162 3.670 3.819 1.00 . A B . 44 THR HG1 1 1 15 12407 1 1 44 THR HG21 H -10.958 6.777 5.755 1.00 . A B . 44 THR HG21 1 1 15 12408 1 1 44 THR HG22 H -11.951 5.625 4.860 1.00 . A B . 44 THR HG22 1 1 15 12409 1 1 44 THR HG23 H -10.871 6.721 3.993 1.00 . A B . 44 THR HG23 1 1 15 12410 1 1 44 THR N N -8.230 6.492 3.802 1.00 . A B . 44 THR N 1 1 15 12411 1 1 44 THR O O -7.487 3.625 4.763 1.00 . A B . 44 THR O 1 1 15 12412 1 1 44 THR OG1 O -9.946 4.235 3.835 1.00 . A B . 44 THR OG1 1 1 15 12413 1 1 45 PRO C C -5.780 2.922 7.194 1.00 . A B . 45 PRO C 1 1 15 12414 1 1 45 PRO CA C -5.310 4.140 6.407 1.00 . A B . 45 PRO CA 1 1 15 12415 1 1 45 PRO CB C -4.333 4.980 7.244 1.00 . A B . 45 PRO CB 1 1 15 12416 1 1 45 PRO CD C -6.247 6.352 6.792 1.00 . A B . 45 PRO CD 1 1 15 12417 1 1 45 PRO CG C -4.768 6.399 7.059 1.00 . A B . 45 PRO CG 1 1 15 12418 1 1 45 PRO HA H -4.820 3.811 5.502 1.00 . A B . 45 PRO HA 1 1 15 12419 1 1 45 PRO HB2 H -4.394 4.680 8.281 1.00 . A B . 45 PRO HB2 1 1 15 12420 1 1 45 PRO HB3 H -3.326 4.829 6.881 1.00 . A B . 45 PRO HB3 1 1 15 12421 1 1 45 PRO HD2 H -6.805 6.371 7.720 1.00 . A B . 45 PRO HD2 1 1 15 12422 1 1 45 PRO HD3 H -6.547 7.170 6.150 1.00 . A B . 45 PRO HD3 1 1 15 12423 1 1 45 PRO HG2 H -4.565 6.966 7.957 1.00 . A B . 45 PRO HG2 1 1 15 12424 1 1 45 PRO HG3 H -4.248 6.834 6.217 1.00 . A B . 45 PRO HG3 1 1 15 12425 1 1 45 PRO N N -6.411 5.062 6.108 1.00 . A B . 45 PRO N 1 1 15 12426 1 1 45 PRO O O -5.172 1.855 7.127 1.00 . A B . 45 PRO O 1 1 15 12427 1 1 46 TRP C C -8.388 1.122 7.929 1.00 . A B . 46 TRP C 1 1 15 12428 1 1 46 TRP CA C -7.431 2.003 8.733 1.00 . A B . 46 TRP CA 1 1 15 12429 1 1 46 TRP CB C -8.144 2.583 9.964 1.00 . A B . 46 TRP CB 1 1 15 12430 1 1 46 TRP CD1 C -10.381 3.619 9.244 1.00 . A B . 46 TRP CD1 1 1 15 12431 1 1 46 TRP CD2 C -8.774 5.119 9.676 1.00 . A B . 46 TRP CD2 1 1 15 12432 1 1 46 TRP CE2 C -9.939 5.806 9.290 1.00 . A B . 46 TRP CE2 1 1 15 12433 1 1 46 TRP CE3 C -7.633 5.859 9.998 1.00 . A B . 46 TRP CE3 1 1 15 12434 1 1 46 TRP CG C -9.076 3.716 9.637 1.00 . A B . 46 TRP CG 1 1 15 12435 1 1 46 TRP CH2 C -8.864 7.892 9.537 1.00 . A B . 46 TRP CH2 1 1 15 12436 1 1 46 TRP CZ2 C -9.995 7.194 9.216 1.00 . A B . 46 TRP CZ2 1 1 15 12437 1 1 46 TRP CZ3 C -7.691 7.239 9.925 1.00 . A B . 46 TRP CZ3 1 1 15 12438 1 1 46 TRP H H -7.340 3.950 7.901 1.00 . A B . 46 TRP H 1 1 15 12439 1 1 46 TRP HA H -6.605 1.395 9.062 1.00 . A B . 46 TRP HA 1 1 15 12440 1 1 46 TRP HB2 H -8.723 1.802 10.438 1.00 . A B . 46 TRP HB2 1 1 15 12441 1 1 46 TRP HB3 H -7.405 2.950 10.663 1.00 . A B . 46 TRP HB3 1 1 15 12442 1 1 46 TRP HD1 H -10.911 2.689 9.116 1.00 . A B . 46 TRP HD1 1 1 15 12443 1 1 46 TRP HE1 H -11.822 5.062 8.739 1.00 . A B . 46 TRP HE1 1 1 15 12444 1 1 46 TRP HE3 H -6.719 5.371 10.301 1.00 . A B . 46 TRP HE3 1 1 15 12445 1 1 46 TRP HH2 H -8.862 8.971 9.491 1.00 . A B . 46 TRP HH2 1 1 15 12446 1 1 46 TRP HZ2 H -10.895 7.713 8.919 1.00 . A B . 46 TRP HZ2 1 1 15 12447 1 1 46 TRP HZ3 H -6.820 7.829 10.169 1.00 . A B . 46 TRP HZ3 1 1 15 12448 1 1 46 TRP N N -6.883 3.081 7.914 1.00 . A B . 46 TRP N 1 1 15 12449 1 1 46 TRP NE1 N -10.902 4.871 9.029 1.00 . A B . 46 TRP NE1 1 1 15 12450 1 1 46 TRP O O -8.996 0.195 8.466 1.00 . A B . 46 TRP O 1 1 15 12451 1 1 47 ASN C C -8.589 0.158 4.558 1.00 . A B . 47 ASN C 1 1 15 12452 1 1 47 ASN CA C -9.380 0.634 5.761 1.00 . A B . 47 ASN CA 1 1 15 12453 1 1 47 ASN CB C -10.576 1.468 5.281 1.00 . A B . 47 ASN CB 1 1 15 12454 1 1 47 ASN CG C -11.544 1.846 6.390 1.00 . A B . 47 ASN CG 1 1 15 12455 1 1 47 ASN H H -7.979 2.139 6.260 1.00 . A B . 47 ASN H 1 1 15 12456 1 1 47 ASN HA H -9.738 -0.220 6.314 1.00 . A B . 47 ASN HA 1 1 15 12457 1 1 47 ASN HB2 H -10.212 2.377 4.828 1.00 . A B . 47 ASN HB2 1 1 15 12458 1 1 47 ASN HB3 H -11.117 0.901 4.537 1.00 . A B . 47 ASN HB3 1 1 15 12459 1 1 47 ASN HD21 H -11.236 0.115 7.323 1.00 . A B . 47 ASN HD21 1 1 15 12460 1 1 47 ASN HD22 H -12.357 1.194 8.085 1.00 . A B . 47 ASN HD22 1 1 15 12461 1 1 47 ASN N N -8.510 1.408 6.641 1.00 . A B . 47 ASN N 1 1 15 12462 1 1 47 ASN ND2 N -11.728 0.964 7.363 1.00 . A B . 47 ASN ND2 1 1 15 12463 1 1 47 ASN O O -7.792 0.912 3.999 1.00 . A B . 47 ASN O 1 1 15 12464 1 1 47 ASN OD1 O -12.139 2.921 6.363 1.00 . A B . 47 ASN OD1 1 1 15 12465 1 1 48 CYS C C -8.899 -1.387 1.752 1.00 . A B . 48 CYS C 1 1 15 12466 1 1 48 CYS CA C -8.074 -1.612 3.015 1.00 . A B . 48 CYS CA 1 1 15 12467 1 1 48 CYS CB C -7.790 -3.110 3.204 1.00 . A B . 48 CYS CB 1 1 15 12468 1 1 48 CYS H H -9.397 -1.667 4.667 1.00 . A B . 48 CYS H 1 1 15 12469 1 1 48 CYS HA H -7.139 -1.079 2.927 1.00 . A B . 48 CYS HA 1 1 15 12470 1 1 48 CYS HB2 H -7.303 -3.260 4.156 1.00 . A B . 48 CYS HB2 1 1 15 12471 1 1 48 CYS HB3 H -8.727 -3.650 3.197 1.00 . A B . 48 CYS HB3 1 1 15 12472 1 1 48 CYS N N -8.779 -1.090 4.168 1.00 . A B . 48 CYS N 1 1 15 12473 1 1 48 CYS O O -10.021 -1.882 1.635 1.00 . A B . 48 CYS O 1 1 15 12474 1 1 48 CYS SG S -6.730 -3.830 1.925 1.00 . A B . 48 CYS SG 1 1 15 12475 1 1 49 ILE C C -8.856 -1.573 -1.422 1.00 . A B . 49 ILE C 1 1 15 12476 1 1 49 ILE CA C -9.024 -0.406 -0.462 1.00 . A B . 49 ILE CA 1 1 15 12477 1 1 49 ILE CB C -8.555 0.897 -1.155 1.00 . A B . 49 ILE CB 1 1 15 12478 1 1 49 ILE CD1 C -6.529 2.083 -2.156 1.00 . A B . 49 ILE CD1 1 1 15 12479 1 1 49 ILE CG1 C -7.031 0.933 -1.305 1.00 . A B . 49 ILE CG1 1 1 15 12480 1 1 49 ILE CG2 C -9.048 2.115 -0.384 1.00 . A B . 49 ILE CG2 1 1 15 12481 1 1 49 ILE H H -7.439 -0.279 0.944 1.00 . A B . 49 ILE H 1 1 15 12482 1 1 49 ILE HA H -10.074 -0.304 -0.233 1.00 . A B . 49 ILE HA 1 1 15 12483 1 1 49 ILE HB H -9.000 0.926 -2.138 1.00 . A B . 49 ILE HB 1 1 15 12484 1 1 49 ILE HD11 H -6.932 1.994 -3.153 1.00 . A B . 49 ILE HD11 1 1 15 12485 1 1 49 ILE HD12 H -5.449 2.054 -2.200 1.00 . A B . 49 ILE HD12 1 1 15 12486 1 1 49 ILE HD13 H -6.847 3.018 -1.722 1.00 . A B . 49 ILE HD13 1 1 15 12487 1 1 49 ILE HG12 H -6.586 1.031 -0.327 1.00 . A B . 49 ILE HG12 1 1 15 12488 1 1 49 ILE HG13 H -6.697 0.011 -1.758 1.00 . A B . 49 ILE HG13 1 1 15 12489 1 1 49 ILE HG21 H -8.652 2.091 0.620 1.00 . A B . 49 ILE HG21 1 1 15 12490 1 1 49 ILE HG22 H -10.127 2.108 -0.346 1.00 . A B . 49 ILE HG22 1 1 15 12491 1 1 49 ILE HG23 H -8.711 3.012 -0.882 1.00 . A B . 49 ILE HG23 1 1 15 12492 1 1 49 ILE N N -8.331 -0.664 0.794 1.00 . A B . 49 ILE N 1 1 15 12493 1 1 49 ILE O O -9.706 -1.809 -2.278 1.00 . A B . 49 ILE O 1 1 15 12494 1 1 50 PHE C C -8.400 -4.629 -1.792 1.00 . A B . 50 PHE C 1 1 15 12495 1 1 50 PHE CA C -7.509 -3.451 -2.137 1.00 . A B . 50 PHE CA 1 1 15 12496 1 1 50 PHE CB C -6.032 -3.846 -2.151 1.00 . A B . 50 PHE CB 1 1 15 12497 1 1 50 PHE CD1 C -4.876 -2.068 -3.491 1.00 . A B . 50 PHE CD1 1 1 15 12498 1 1 50 PHE CD2 C -5.123 -4.229 -4.465 1.00 . A B . 50 PHE CD2 1 1 15 12499 1 1 50 PHE CE1 C -4.219 -1.630 -4.624 1.00 . A B . 50 PHE CE1 1 1 15 12500 1 1 50 PHE CE2 C -4.464 -3.798 -5.597 1.00 . A B . 50 PHE CE2 1 1 15 12501 1 1 50 PHE CG C -5.338 -3.371 -3.398 1.00 . A B . 50 PHE CG 1 1 15 12502 1 1 50 PHE CZ C -4.100 -2.491 -5.725 1.00 . A B . 50 PHE CZ 1 1 15 12503 1 1 50 PHE H H -7.159 -2.125 -0.524 1.00 . A B . 50 PHE H 1 1 15 12504 1 1 50 PHE HA H -7.777 -3.129 -3.134 1.00 . A B . 50 PHE HA 1 1 15 12505 1 1 50 PHE HB2 H -5.528 -3.413 -1.297 1.00 . A B . 50 PHE HB2 1 1 15 12506 1 1 50 PHE HB3 H -5.949 -4.924 -2.112 1.00 . A B . 50 PHE HB3 1 1 15 12507 1 1 50 PHE HD1 H -5.038 -1.387 -2.668 1.00 . A B . 50 PHE HD1 1 1 15 12508 1 1 50 PHE HD2 H -5.478 -5.247 -4.406 1.00 . A B . 50 PHE HD2 1 1 15 12509 1 1 50 PHE HE1 H -3.867 -0.611 -4.684 1.00 . A B . 50 PHE HE1 1 1 15 12510 1 1 50 PHE HE2 H -4.303 -4.479 -6.420 1.00 . A B . 50 PHE HE2 1 1 15 12511 1 1 50 PHE HZ H -3.622 -2.149 -6.630 1.00 . A B . 50 PHE HZ 1 1 15 12512 1 1 50 PHE N N -7.775 -2.324 -1.258 1.00 . A B . 50 PHE N 1 1 15 12513 1 1 50 PHE O O -8.748 -5.412 -2.664 1.00 . A B . 50 PHE O 1 1 15 12514 1 1 51 CYS C C -11.074 -5.564 -0.884 1.00 . A B . 51 CYS C 1 1 15 12515 1 1 51 CYS CA C -9.752 -5.780 -0.145 1.00 . A B . 51 CYS CA 1 1 15 12516 1 1 51 CYS CB C -9.994 -5.794 1.369 1.00 . A B . 51 CYS CB 1 1 15 12517 1 1 51 CYS H H -8.412 -4.153 0.154 1.00 . A B . 51 CYS H 1 1 15 12518 1 1 51 CYS HA H -9.348 -6.739 -0.442 1.00 . A B . 51 CYS HA 1 1 15 12519 1 1 51 CYS HB2 H -9.875 -4.793 1.757 1.00 . A B . 51 CYS HB2 1 1 15 12520 1 1 51 CYS HB3 H -11.004 -6.127 1.560 1.00 . A B . 51 CYS HB3 1 1 15 12521 1 1 51 CYS N N -8.779 -4.758 -0.525 1.00 . A B . 51 CYS N 1 1 15 12522 1 1 51 CYS O O -11.736 -6.521 -1.279 1.00 . A B . 51 CYS O 1 1 15 12523 1 1 51 CYS SG S -8.875 -6.877 2.291 1.00 . A B . 51 CYS SG 1 1 15 12524 1 1 52 ARG C C -12.468 -4.001 -3.303 1.00 . A B . 52 ARG C 1 1 15 12525 1 1 52 ARG CA C -12.678 -3.976 -1.790 1.00 . A B . 52 ARG CA 1 1 15 12526 1 1 52 ARG CB C -13.194 -2.595 -1.368 1.00 . A B . 52 ARG CB 1 1 15 12527 1 1 52 ARG CD C -13.990 -1.070 0.459 1.00 . A B . 52 ARG CD 1 1 15 12528 1 1 52 ARG CG C -13.488 -2.464 0.121 1.00 . A B . 52 ARG CG 1 1 15 12529 1 1 52 ARG CZ C -15.559 0.435 -0.717 1.00 . A B . 52 ARG CZ 1 1 15 12530 1 1 52 ARG H H -10.881 -3.576 -0.748 1.00 . A B . 52 ARG H 1 1 15 12531 1 1 52 ARG HA H -13.410 -4.722 -1.530 1.00 . A B . 52 ARG HA 1 1 15 12532 1 1 52 ARG HB2 H -12.456 -1.854 -1.629 1.00 . A B . 52 ARG HB2 1 1 15 12533 1 1 52 ARG HB3 H -14.105 -2.386 -1.909 1.00 . A B . 52 ARG HB3 1 1 15 12534 1 1 52 ARG HD2 H -14.142 -1.005 1.527 1.00 . A B . 52 ARG HD2 1 1 15 12535 1 1 52 ARG HD3 H -13.244 -0.350 0.159 1.00 . A B . 52 ARG HD3 1 1 15 12536 1 1 52 ARG HE H -15.899 -1.499 -0.314 1.00 . A B . 52 ARG HE 1 1 15 12537 1 1 52 ARG HG2 H -14.245 -3.183 0.396 1.00 . A B . 52 ARG HG2 1 1 15 12538 1 1 52 ARG HG3 H -12.583 -2.657 0.678 1.00 . A B . 52 ARG HG3 1 1 15 12539 1 1 52 ARG HH11 H -13.823 1.327 -0.169 1.00 . A B . 52 ARG HH11 1 1 15 12540 1 1 52 ARG HH12 H -14.950 2.347 -1.001 1.00 . A B . 52 ARG HH12 1 1 15 12541 1 1 52 ARG HH21 H -17.373 -0.149 -1.400 1.00 . A B . 52 ARG HH21 1 1 15 12542 1 1 52 ARG HH22 H -16.967 1.515 -1.687 1.00 . A B . 52 ARG HH22 1 1 15 12543 1 1 52 ARG N N -11.442 -4.303 -1.088 1.00 . A B . 52 ARG N 1 1 15 12544 1 1 52 ARG NE N -15.247 -0.764 -0.222 1.00 . A B . 52 ARG NE 1 1 15 12545 1 1 52 ARG NH1 N -14.709 1.450 -0.619 1.00 . A B . 52 ARG NH1 1 1 15 12546 1 1 52 ARG NH2 N -16.726 0.615 -1.317 1.00 . A B . 52 ARG NH2 1 1 15 12547 1 1 52 ARG O O -13.421 -4.114 -4.072 1.00 . A B . 52 ARG O 1 1 15 12548 1 1 53 MET C C -10.678 -5.276 -5.686 1.00 . A B . 53 MET C 1 1 15 12549 1 1 53 MET CA C -10.880 -3.864 -5.141 1.00 . A B . 53 MET CA 1 1 15 12550 1 1 53 MET CB C -9.617 -3.025 -5.363 1.00 . A B . 53 MET CB 1 1 15 12551 1 1 53 MET CE C -7.490 -1.974 -8.797 1.00 . A B . 53 MET CE 1 1 15 12552 1 1 53 MET CG C -9.178 -2.928 -6.816 1.00 . A B . 53 MET CG 1 1 15 12553 1 1 53 MET H H -10.502 -3.843 -3.052 1.00 . A B . 53 MET H 1 1 15 12554 1 1 53 MET HA H -11.704 -3.405 -5.665 1.00 . A B . 53 MET HA 1 1 15 12555 1 1 53 MET HB2 H -9.797 -2.023 -5.002 1.00 . A B . 53 MET HB2 1 1 15 12556 1 1 53 MET HB3 H -8.809 -3.460 -4.795 1.00 . A B . 53 MET HB3 1 1 15 12557 1 1 53 MET HE1 H -6.631 -1.385 -9.078 1.00 . A B . 53 MET HE1 1 1 15 12558 1 1 53 MET HE2 H -8.368 -1.593 -9.298 1.00 . A B . 53 MET HE2 1 1 15 12559 1 1 53 MET HE3 H -7.332 -3.004 -9.083 1.00 . A B . 53 MET HE3 1 1 15 12560 1 1 53 MET HG2 H -8.942 -3.919 -7.174 1.00 . A B . 53 MET HG2 1 1 15 12561 1 1 53 MET HG3 H -9.990 -2.519 -7.398 1.00 . A B . 53 MET HG3 1 1 15 12562 1 1 53 MET N N -11.217 -3.897 -3.719 1.00 . A B . 53 MET N 1 1 15 12563 1 1 53 MET O O -11.096 -5.590 -6.800 1.00 . A B . 53 MET O 1 1 15 12564 1 1 53 MET SD S -7.727 -1.877 -7.023 1.00 . A B . 53 MET SD 1 1 15 12565 1 1 54 LYS C C -10.997 -8.385 -5.261 1.00 . A B . 54 LYS C 1 1 15 12566 1 1 54 LYS CA C -9.741 -7.501 -5.259 1.00 . A B . 54 LYS CA 1 1 15 12567 1 1 54 LYS CB C -8.681 -8.052 -4.293 1.00 . A B . 54 LYS CB 1 1 15 12568 1 1 54 LYS CD C -6.822 -9.665 -3.827 1.00 . A B . 54 LYS CD 1 1 15 12569 1 1 54 LYS CE C -6.053 -10.887 -4.301 1.00 . A B . 54 LYS CE 1 1 15 12570 1 1 54 LYS CG C -7.948 -9.293 -4.781 1.00 . A B . 54 LYS CG 1 1 15 12571 1 1 54 LYS H H -9.736 -5.798 -4.006 1.00 . A B . 54 LYS H 1 1 15 12572 1 1 54 LYS HA H -9.328 -7.483 -6.257 1.00 . A B . 54 LYS HA 1 1 15 12573 1 1 54 LYS HB2 H -7.946 -7.281 -4.113 1.00 . A B . 54 LYS HB2 1 1 15 12574 1 1 54 LYS HB3 H -9.164 -8.293 -3.357 1.00 . A B . 54 LYS HB3 1 1 15 12575 1 1 54 LYS HD2 H -6.141 -8.832 -3.751 1.00 . A B . 54 LYS HD2 1 1 15 12576 1 1 54 LYS HD3 H -7.245 -9.873 -2.854 1.00 . A B . 54 LYS HD3 1 1 15 12577 1 1 54 LYS HE2 H -5.685 -10.701 -5.298 1.00 . A B . 54 LYS HE2 1 1 15 12578 1 1 54 LYS HE3 H -5.219 -11.049 -3.635 1.00 . A B . 54 LYS HE3 1 1 15 12579 1 1 54 LYS HG2 H -8.645 -10.116 -4.843 1.00 . A B . 54 LYS HG2 1 1 15 12580 1 1 54 LYS HG3 H -7.531 -9.094 -5.757 1.00 . A B . 54 LYS HG3 1 1 15 12581 1 1 54 LYS HZ1 H -7.293 -12.285 -3.374 1.00 . A B . 54 LYS HZ1 1 1 15 12582 1 1 54 LYS HZ2 H -6.338 -12.929 -4.615 1.00 . A B . 54 LYS HZ2 1 1 15 12583 1 1 54 LYS HZ3 H -7.684 -11.984 -4.992 1.00 . A B . 54 LYS HZ3 1 1 15 12584 1 1 54 LYS N N -10.049 -6.124 -4.879 1.00 . A B . 54 LYS N 1 1 15 12585 1 1 54 LYS NZ N -6.900 -12.105 -4.321 1.00 . A B . 54 LYS NZ 1 1 15 12586 1 1 54 LYS O O -10.911 -9.613 -5.289 1.00 . A B . 54 LYS O 1 1 15 12587 1 1 55 GLU C C -13.694 -8.763 -6.828 1.00 . A B . 55 GLU C 1 1 15 12588 1 1 55 GLU CA C -13.431 -8.464 -5.356 1.00 . A B . 55 GLU CA 1 1 15 12589 1 1 55 GLU CB C -14.579 -7.623 -4.789 1.00 . A B . 55 GLU CB 1 1 15 12590 1 1 55 GLU CD C -14.685 -8.344 -2.362 1.00 . A B . 55 GLU CD 1 1 15 12591 1 1 55 GLU CG C -14.398 -7.218 -3.335 1.00 . A B . 55 GLU CG 1 1 15 12592 1 1 55 GLU H H -12.174 -6.781 -5.142 1.00 . A B . 55 GLU H 1 1 15 12593 1 1 55 GLU HA H -13.359 -9.392 -4.810 1.00 . A B . 55 GLU HA 1 1 15 12594 1 1 55 GLU HB2 H -14.675 -6.727 -5.380 1.00 . A B . 55 GLU HB2 1 1 15 12595 1 1 55 GLU HB3 H -15.492 -8.193 -4.868 1.00 . A B . 55 GLU HB3 1 1 15 12596 1 1 55 GLU HG2 H -13.378 -6.894 -3.191 1.00 . A B . 55 GLU HG2 1 1 15 12597 1 1 55 GLU HG3 H -15.067 -6.397 -3.119 1.00 . A B . 55 GLU HG3 1 1 15 12598 1 1 55 GLU N N -12.165 -7.754 -5.232 1.00 . A B . 55 GLU N 1 1 15 12599 1 1 55 GLU O O -14.537 -8.127 -7.461 1.00 . A B . 55 GLU O 1 1 15 12600 1 1 55 GLU OE1 O -13.847 -9.257 -2.232 1.00 . A B . 55 GLU OE1 1 1 15 12601 1 1 55 GLU OE2 O -15.748 -8.312 -1.711 1.00 . A B . 55 GLU OE2 1 1 15 12602 1 1 56 SER C C -14.194 -10.996 -9.050 1.00 . A B . 56 SER C 1 1 15 12603 1 1 56 SER CA C -13.042 -10.028 -8.788 1.00 . A B . 56 SER CA 1 1 15 12604 1 1 56 SER CB C -11.708 -10.604 -9.270 1.00 . A B . 56 SER CB 1 1 15 12605 1 1 56 SER H H -12.294 -10.181 -6.821 1.00 . A B . 56 SER H 1 1 15 12606 1 1 56 SER HA H -13.236 -9.111 -9.324 1.00 . A B . 56 SER HA 1 1 15 12607 1 1 56 SER HB2 H -11.878 -11.221 -10.139 1.00 . A B . 56 SER HB2 1 1 15 12608 1 1 56 SER HB3 H -11.040 -9.795 -9.528 1.00 . A B . 56 SER HB3 1 1 15 12609 1 1 56 SER HG H -11.565 -12.240 -8.195 1.00 . A B . 56 SER HG 1 1 15 12610 1 1 56 SER N N -12.942 -9.697 -7.378 1.00 . A B . 56 SER N 1 1 15 12611 1 1 56 SER O O -14.006 -12.218 -8.878 1.00 . A B . 56 SER O 1 1 15 12612 1 1 56 SER OXT O -15.293 -10.524 -9.426 1.00 . A B . 56 SER OXT 1 1 15 12613 1 1 56 SER OG O -11.099 -11.396 -8.262 1.00 . A B . 56 SER OG 1 1 15 12614 2 2 1 ZN ZN ZN -6.711 -6.124 2.114 1.00 . B B . 101 ZN ZN 1 1 15 12615 3 2 1 ZN ZN ZN 5.962 0.976 0.045 1.00 . C B . 102 ZN ZN 1 1 16 12616 1 1 1 GLY C C 11.626 -12.862 1.927 1.00 . A B . 1 GLY C 1 1 16 12617 1 1 1 GLY CA C 11.586 -11.478 1.314 1.00 . A B . 1 GLY CA 1 1 16 12618 1 1 1 GLY H1 H 10.217 -10.671 2.661 1.00 . A B . 1 GLY H1 1 1 16 12619 1 1 1 GLY H2 H 9.511 -11.321 1.266 1.00 . A B . 1 GLY H2 1 1 16 12620 1 1 1 GLY H3 H 10.312 -9.834 1.191 1.00 . A B . 1 GLY H3 1 1 16 12621 1 1 1 GLY HA2 H 11.683 -11.567 0.243 1.00 . A B . 1 GLY HA2 1 1 16 12622 1 1 1 GLY HA3 H 12.414 -10.900 1.697 1.00 . A B . 1 GLY HA3 1 1 16 12623 1 1 1 GLY N N 10.320 -10.775 1.629 1.00 . A B . 1 GLY N 1 1 16 12624 1 1 1 GLY O O 10.586 -13.411 2.288 1.00 . A B . 1 GLY O 1 1 16 12625 1 1 2 ALA C C 13.065 -14.676 4.146 1.00 . A B . 2 ALA C 1 1 16 12626 1 1 2 ALA CA C 12.991 -14.753 2.628 1.00 . A B . 2 ALA CA 1 1 16 12627 1 1 2 ALA CB C 14.241 -15.418 2.068 1.00 . A B . 2 ALA CB 1 1 16 12628 1 1 2 ALA H H 13.617 -12.929 1.745 1.00 . A B . 2 ALA H 1 1 16 12629 1 1 2 ALA HA H 12.136 -15.349 2.350 1.00 . A B . 2 ALA HA 1 1 16 12630 1 1 2 ALA HB1 H 14.333 -16.415 2.475 1.00 . A B . 2 ALA HB1 1 1 16 12631 1 1 2 ALA HB2 H 15.110 -14.838 2.342 1.00 . A B . 2 ALA HB2 1 1 16 12632 1 1 2 ALA HB3 H 14.170 -15.472 0.992 1.00 . A B . 2 ALA HB3 1 1 16 12633 1 1 2 ALA N N 12.823 -13.423 2.051 1.00 . A B . 2 ALA N 1 1 16 12634 1 1 2 ALA O O 12.768 -15.643 4.852 1.00 . A B . 2 ALA O 1 1 16 12635 1 1 3 MET C C 13.056 -11.890 6.398 1.00 . A B . 3 MET C 1 1 16 12636 1 1 3 MET CA C 13.574 -13.286 6.071 1.00 . A B . 3 MET CA 1 1 16 12637 1 1 3 MET CB C 15.029 -13.446 6.527 1.00 . A B . 3 MET CB 1 1 16 12638 1 1 3 MET CE C 14.817 -14.203 10.630 1.00 . A B . 3 MET CE 1 1 16 12639 1 1 3 MET CG C 15.218 -13.329 8.036 1.00 . A B . 3 MET CG 1 1 16 12640 1 1 3 MET H H 13.681 -12.786 4.022 1.00 . A B . 3 MET H 1 1 16 12641 1 1 3 MET HA H 12.959 -14.017 6.578 1.00 . A B . 3 MET HA 1 1 16 12642 1 1 3 MET HB2 H 15.384 -14.418 6.216 1.00 . A B . 3 MET HB2 1 1 16 12643 1 1 3 MET HB3 H 15.628 -12.685 6.050 1.00 . A B . 3 MET HB3 1 1 16 12644 1 1 3 MET HE1 H 15.889 -14.294 10.718 1.00 . A B . 3 MET HE1 1 1 16 12645 1 1 3 MET HE2 H 14.340 -14.887 11.317 1.00 . A B . 3 MET HE2 1 1 16 12646 1 1 3 MET HE3 H 14.521 -13.192 10.866 1.00 . A B . 3 MET HE3 1 1 16 12647 1 1 3 MET HG2 H 16.269 -13.421 8.262 1.00 . A B . 3 MET HG2 1 1 16 12648 1 1 3 MET HG3 H 14.869 -12.357 8.354 1.00 . A B . 3 MET HG3 1 1 16 12649 1 1 3 MET N N 13.462 -13.517 4.641 1.00 . A B . 3 MET N 1 1 16 12650 1 1 3 MET O O 13.828 -10.966 6.648 1.00 . A B . 3 MET O 1 1 16 12651 1 1 3 MET SD S 14.320 -14.595 8.953 1.00 . A B . 3 MET SD 1 1 16 12652 1 1 4 GLY C C 10.425 -9.947 5.358 1.00 . A B . 4 GLY C 1 1 16 12653 1 1 4 GLY CA C 11.135 -10.451 6.595 1.00 . A B . 4 GLY CA 1 1 16 12654 1 1 4 GLY H H 11.173 -12.518 6.169 1.00 . A B . 4 GLY H 1 1 16 12655 1 1 4 GLY HA2 H 10.425 -10.533 7.405 1.00 . A B . 4 GLY HA2 1 1 16 12656 1 1 4 GLY HA3 H 11.905 -9.745 6.870 1.00 . A B . 4 GLY HA3 1 1 16 12657 1 1 4 GLY N N 11.742 -11.741 6.365 1.00 . A B . 4 GLY N 1 1 16 12658 1 1 4 GLY O O 10.282 -10.684 4.379 1.00 . A B . 4 GLY O 1 1 16 12659 1 1 5 MET C C 9.702 -6.655 4.090 1.00 . A B . 5 MET C 1 1 16 12660 1 1 5 MET CA C 9.301 -8.115 4.249 1.00 . A B . 5 MET CA 1 1 16 12661 1 1 5 MET CB C 7.785 -8.240 4.394 1.00 . A B . 5 MET CB 1 1 16 12662 1 1 5 MET CE C 6.409 -8.095 0.452 1.00 . A B . 5 MET CE 1 1 16 12663 1 1 5 MET CG C 7.022 -7.824 3.147 1.00 . A B . 5 MET CG 1 1 16 12664 1 1 5 MET H H 10.094 -8.167 6.206 1.00 . A B . 5 MET H 1 1 16 12665 1 1 5 MET HA H 9.615 -8.656 3.368 1.00 . A B . 5 MET HA 1 1 16 12666 1 1 5 MET HB2 H 7.539 -9.270 4.614 1.00 . A B . 5 MET HB2 1 1 16 12667 1 1 5 MET HB3 H 7.459 -7.618 5.215 1.00 . A B . 5 MET HB3 1 1 16 12668 1 1 5 MET HE1 H 6.581 -7.032 0.369 1.00 . A B . 5 MET HE1 1 1 16 12669 1 1 5 MET HE2 H 5.384 -8.272 0.738 1.00 . A B . 5 MET HE2 1 1 16 12670 1 1 5 MET HE3 H 6.605 -8.567 -0.499 1.00 . A B . 5 MET HE3 1 1 16 12671 1 1 5 MET HG2 H 5.967 -7.968 3.321 1.00 . A B . 5 MET HG2 1 1 16 12672 1 1 5 MET HG3 H 7.215 -6.780 2.952 1.00 . A B . 5 MET HG3 1 1 16 12673 1 1 5 MET N N 9.974 -8.703 5.392 1.00 . A B . 5 MET N 1 1 16 12674 1 1 5 MET O O 8.946 -5.740 4.422 1.00 . A B . 5 MET O 1 1 16 12675 1 1 5 MET SD S 7.503 -8.782 1.694 1.00 . A B . 5 MET SD 1 1 16 12676 1 1 6 ARG C C 11.251 -4.698 1.913 1.00 . A B . 6 ARG C 1 1 16 12677 1 1 6 ARG CA C 11.422 -5.105 3.370 1.00 . A B . 6 ARG CA 1 1 16 12678 1 1 6 ARG CB C 12.895 -5.026 3.763 1.00 . A B . 6 ARG CB 1 1 16 12679 1 1 6 ARG CD C 14.617 -5.144 5.582 1.00 . A B . 6 ARG CD 1 1 16 12680 1 1 6 ARG CG C 13.165 -5.386 5.212 1.00 . A B . 6 ARG CG 1 1 16 12681 1 1 6 ARG CZ C 15.633 -4.865 7.812 1.00 . A B . 6 ARG CZ 1 1 16 12682 1 1 6 ARG H H 11.462 -7.219 3.350 1.00 . A B . 6 ARG H 1 1 16 12683 1 1 6 ARG HA H 10.853 -4.426 3.988 1.00 . A B . 6 ARG HA 1 1 16 12684 1 1 6 ARG HB2 H 13.458 -5.702 3.136 1.00 . A B . 6 ARG HB2 1 1 16 12685 1 1 6 ARG HB3 H 13.245 -4.018 3.593 1.00 . A B . 6 ARG HB3 1 1 16 12686 1 1 6 ARG HD2 H 15.248 -5.697 4.902 1.00 . A B . 6 ARG HD2 1 1 16 12687 1 1 6 ARG HD3 H 14.828 -4.088 5.490 1.00 . A B . 6 ARG HD3 1 1 16 12688 1 1 6 ARG HE H 14.533 -6.433 7.234 1.00 . A B . 6 ARG HE 1 1 16 12689 1 1 6 ARG HG2 H 12.536 -4.780 5.848 1.00 . A B . 6 ARG HG2 1 1 16 12690 1 1 6 ARG HG3 H 12.933 -6.431 5.365 1.00 . A B . 6 ARG HG3 1 1 16 12691 1 1 6 ARG HH11 H 15.964 -3.307 6.551 1.00 . A B . 6 ARG HH11 1 1 16 12692 1 1 6 ARG HH12 H 16.678 -3.155 8.125 1.00 . A B . 6 ARG HH12 1 1 16 12693 1 1 6 ARG HH21 H 15.470 -6.226 9.300 1.00 . A B . 6 ARG HH21 1 1 16 12694 1 1 6 ARG HH22 H 16.395 -4.813 9.687 1.00 . A B . 6 ARG HH22 1 1 16 12695 1 1 6 ARG N N 10.904 -6.446 3.586 1.00 . A B . 6 ARG N 1 1 16 12696 1 1 6 ARG NE N 14.904 -5.568 6.948 1.00 . A B . 6 ARG NE 1 1 16 12697 1 1 6 ARG NH1 N 16.132 -3.681 7.469 1.00 . A B . 6 ARG NH1 1 1 16 12698 1 1 6 ARG NH2 N 15.852 -5.341 9.030 1.00 . A B . 6 ARG NH2 1 1 16 12699 1 1 6 ARG O O 12.200 -4.281 1.249 1.00 . A B . 6 ARG O 1 1 16 12700 1 1 7 ASN C C 9.604 -2.951 -0.091 1.00 . A B . 7 ASN C 1 1 16 12701 1 1 7 ASN CA C 9.732 -4.466 0.036 1.00 . A B . 7 ASN CA 1 1 16 12702 1 1 7 ASN CB C 8.444 -5.151 -0.438 1.00 . A B . 7 ASN CB 1 1 16 12703 1 1 7 ASN CG C 8.227 -5.026 -1.936 1.00 . A B . 7 ASN CG 1 1 16 12704 1 1 7 ASN H H 9.317 -5.162 1.998 1.00 . A B . 7 ASN H 1 1 16 12705 1 1 7 ASN HA H 10.556 -4.797 -0.577 1.00 . A B . 7 ASN HA 1 1 16 12706 1 1 7 ASN HB2 H 8.491 -6.202 -0.191 1.00 . A B . 7 ASN HB2 1 1 16 12707 1 1 7 ASN HB3 H 7.598 -4.706 0.067 1.00 . A B . 7 ASN HB3 1 1 16 12708 1 1 7 ASN HD21 H 10.171 -5.242 -2.274 1.00 . A B . 7 ASN HD21 1 1 16 12709 1 1 7 ASN HD22 H 9.191 -5.008 -3.675 1.00 . A B . 7 ASN HD22 1 1 16 12710 1 1 7 ASN N N 10.031 -4.822 1.419 1.00 . A B . 7 ASN N 1 1 16 12711 1 1 7 ASN ND2 N 9.304 -5.104 -2.704 1.00 . A B . 7 ASN ND2 1 1 16 12712 1 1 7 ASN O O 9.709 -2.388 -1.178 1.00 . A B . 7 ASN O 1 1 16 12713 1 1 7 ASN OD1 O 7.094 -4.896 -2.401 1.00 . A B . 7 ASN OD1 1 1 16 12714 1 1 8 LEU C C 10.557 -0.108 0.860 1.00 . A B . 8 LEU C 1 1 16 12715 1 1 8 LEU CA C 9.242 -0.852 1.092 1.00 . A B . 8 LEU CA 1 1 16 12716 1 1 8 LEU CB C 8.609 -0.441 2.429 1.00 . A B . 8 LEU CB 1 1 16 12717 1 1 8 LEU CD1 C 10.488 0.019 4.045 1.00 . A B . 8 LEU CD1 1 1 16 12718 1 1 8 LEU CD2 C 8.361 -1.018 4.857 1.00 . A B . 8 LEU CD2 1 1 16 12719 1 1 8 LEU CG C 9.337 -0.912 3.695 1.00 . A B . 8 LEU CG 1 1 16 12720 1 1 8 LEU H H 9.406 -2.802 1.885 1.00 . A B . 8 LEU H 1 1 16 12721 1 1 8 LEU HA H 8.561 -0.591 0.297 1.00 . A B . 8 LEU HA 1 1 16 12722 1 1 8 LEU HB2 H 8.557 0.639 2.456 1.00 . A B . 8 LEU HB2 1 1 16 12723 1 1 8 LEU HB3 H 7.604 -0.829 2.456 1.00 . A B . 8 LEU HB3 1 1 16 12724 1 1 8 LEU HD11 H 11.018 -0.370 4.900 1.00 . A B . 8 LEU HD11 1 1 16 12725 1 1 8 LEU HD12 H 10.099 0.998 4.278 1.00 . A B . 8 LEU HD12 1 1 16 12726 1 1 8 LEU HD13 H 11.161 0.090 3.204 1.00 . A B . 8 LEU HD13 1 1 16 12727 1 1 8 LEU HD21 H 7.579 -1.720 4.608 1.00 . A B . 8 LEU HD21 1 1 16 12728 1 1 8 LEU HD22 H 7.926 -0.048 5.052 1.00 . A B . 8 LEU HD22 1 1 16 12729 1 1 8 LEU HD23 H 8.885 -1.361 5.737 1.00 . A B . 8 LEU HD23 1 1 16 12730 1 1 8 LEU HG H 9.751 -1.895 3.517 1.00 . A B . 8 LEU HG 1 1 16 12731 1 1 8 LEU N N 9.423 -2.297 1.049 1.00 . A B . 8 LEU N 1 1 16 12732 1 1 8 LEU O O 10.575 1.119 0.767 1.00 . A B . 8 LEU O 1 1 16 12733 1 1 9 ASP C C 13.116 0.178 -0.915 1.00 . A B . 9 ASP C 1 1 16 12734 1 1 9 ASP CA C 12.961 -0.250 0.537 1.00 . A B . 9 ASP CA 1 1 16 12735 1 1 9 ASP CB C 14.087 -1.211 0.927 1.00 . A B . 9 ASP CB 1 1 16 12736 1 1 9 ASP CG C 14.383 -1.194 2.415 1.00 . A B . 9 ASP CG 1 1 16 12737 1 1 9 ASP H H 11.571 -1.826 0.834 1.00 . A B . 9 ASP H 1 1 16 12738 1 1 9 ASP HA H 13.024 0.627 1.158 1.00 . A B . 9 ASP HA 1 1 16 12739 1 1 9 ASP HB2 H 13.807 -2.215 0.649 1.00 . A B . 9 ASP HB2 1 1 16 12740 1 1 9 ASP HB3 H 14.984 -0.932 0.396 1.00 . A B . 9 ASP HB3 1 1 16 12741 1 1 9 ASP N N 11.651 -0.852 0.763 1.00 . A B . 9 ASP N 1 1 16 12742 1 1 9 ASP O O 13.722 1.207 -1.213 1.00 . A B . 9 ASP O 1 1 16 12743 1 1 9 ASP OD1 O 14.836 -0.152 2.930 1.00 . A B . 9 ASP OD1 1 1 16 12744 1 1 9 ASP OD2 O 14.138 -2.220 3.083 1.00 . A B . 9 ASP OD2 1 1 16 12745 1 1 10 GLU C C 11.512 0.737 -3.546 1.00 . A B . 10 GLU C 1 1 16 12746 1 1 10 GLU CA C 12.579 -0.307 -3.238 1.00 . A B . 10 GLU CA 1 1 16 12747 1 1 10 GLU CB C 12.332 -1.576 -4.056 1.00 . A B . 10 GLU CB 1 1 16 12748 1 1 10 GLU CD C 12.942 -4.000 -4.426 1.00 . A B . 10 GLU CD 1 1 16 12749 1 1 10 GLU CG C 13.314 -2.699 -3.750 1.00 . A B . 10 GLU CG 1 1 16 12750 1 1 10 GLU H H 12.187 -1.474 -1.513 1.00 . A B . 10 GLU H 1 1 16 12751 1 1 10 GLU HA H 13.548 0.095 -3.486 1.00 . A B . 10 GLU HA 1 1 16 12752 1 1 10 GLU HB2 H 11.333 -1.933 -3.856 1.00 . A B . 10 GLU HB2 1 1 16 12753 1 1 10 GLU HB3 H 12.411 -1.333 -5.105 1.00 . A B . 10 GLU HB3 1 1 16 12754 1 1 10 GLU HG2 H 14.293 -2.402 -4.092 1.00 . A B . 10 GLU HG2 1 1 16 12755 1 1 10 GLU HG3 H 13.340 -2.859 -2.684 1.00 . A B . 10 GLU HG3 1 1 16 12756 1 1 10 GLU N N 12.573 -0.626 -1.813 1.00 . A B . 10 GLU N 1 1 16 12757 1 1 10 GLU O O 11.577 1.452 -4.547 1.00 . A B . 10 GLU O 1 1 16 12758 1 1 10 GLU OE1 O 13.366 -4.217 -5.583 1.00 . A B . 10 GLU OE1 1 1 16 12759 1 1 10 GLU OE2 O 12.225 -4.813 -3.807 1.00 . A B . 10 GLU OE2 1 1 16 12760 1 1 11 CYS C C 9.847 3.135 -2.355 1.00 . A B . 11 CYS C 1 1 16 12761 1 1 11 CYS CA C 9.420 1.731 -2.778 1.00 . A B . 11 CYS CA 1 1 16 12762 1 1 11 CYS CB C 8.309 1.208 -1.881 1.00 . A B . 11 CYS CB 1 1 16 12763 1 1 11 CYS H H 10.516 0.159 -1.936 1.00 . A B . 11 CYS H 1 1 16 12764 1 1 11 CYS HA H 9.079 1.748 -3.800 1.00 . A B . 11 CYS HA 1 1 16 12765 1 1 11 CYS HB2 H 8.091 0.194 -2.166 1.00 . A B . 11 CYS HB2 1 1 16 12766 1 1 11 CYS HB3 H 8.667 1.210 -0.863 1.00 . A B . 11 CYS HB3 1 1 16 12767 1 1 11 CYS N N 10.526 0.797 -2.673 1.00 . A B . 11 CYS N 1 1 16 12768 1 1 11 CYS O O 9.957 3.434 -1.163 1.00 . A B . 11 CYS O 1 1 16 12769 1 1 11 CYS SG S 6.749 2.111 -1.902 1.00 . A B . 11 CYS SG 1 1 16 12770 1 1 12 GLU C C 9.514 6.183 -2.342 1.00 . A B . 12 GLU C 1 1 16 12771 1 1 12 GLU CA C 10.550 5.351 -3.084 1.00 . A B . 12 GLU CA 1 1 16 12772 1 1 12 GLU CB C 10.936 6.052 -4.384 1.00 . A B . 12 GLU CB 1 1 16 12773 1 1 12 GLU CD C 13.398 5.510 -4.171 1.00 . A B . 12 GLU CD 1 1 16 12774 1 1 12 GLU CG C 12.169 5.468 -5.058 1.00 . A B . 12 GLU CG 1 1 16 12775 1 1 12 GLU H H 9.898 3.716 -4.260 1.00 . A B . 12 GLU H 1 1 16 12776 1 1 12 GLU HA H 11.428 5.273 -2.462 1.00 . A B . 12 GLU HA 1 1 16 12777 1 1 12 GLU HB2 H 10.108 5.986 -5.074 1.00 . A B . 12 GLU HB2 1 1 16 12778 1 1 12 GLU HB3 H 11.131 7.092 -4.170 1.00 . A B . 12 GLU HB3 1 1 16 12779 1 1 12 GLU HG2 H 11.969 4.441 -5.320 1.00 . A B . 12 GLU HG2 1 1 16 12780 1 1 12 GLU HG3 H 12.372 6.033 -5.956 1.00 . A B . 12 GLU HG3 1 1 16 12781 1 1 12 GLU N N 10.073 3.996 -3.339 1.00 . A B . 12 GLU N 1 1 16 12782 1 1 12 GLU O O 9.869 7.094 -1.596 1.00 . A B . 12 GLU O 1 1 16 12783 1 1 12 GLU OE1 O 13.952 6.609 -3.956 1.00 . A B . 12 GLU OE1 1 1 16 12784 1 1 12 GLU OE2 O 13.825 4.442 -3.690 1.00 . A B . 12 GLU OE2 1 1 16 12785 1 1 13 VAL C C 7.171 6.290 -0.371 1.00 . A B . 13 VAL C 1 1 16 12786 1 1 13 VAL CA C 7.190 6.627 -1.862 1.00 . A B . 13 VAL CA 1 1 16 12787 1 1 13 VAL CB C 5.798 6.402 -2.498 1.00 . A B . 13 VAL CB 1 1 16 12788 1 1 13 VAL CG1 C 5.376 4.952 -2.428 1.00 . A B . 13 VAL CG1 1 1 16 12789 1 1 13 VAL CG2 C 4.753 7.286 -1.838 1.00 . A B . 13 VAL CG2 1 1 16 12790 1 1 13 VAL H H 7.993 5.139 -3.134 1.00 . A B . 13 VAL H 1 1 16 12791 1 1 13 VAL HA H 7.436 7.672 -1.966 1.00 . A B . 13 VAL HA 1 1 16 12792 1 1 13 VAL HB H 5.857 6.676 -3.538 1.00 . A B . 13 VAL HB 1 1 16 12793 1 1 13 VAL HG11 H 4.418 4.837 -2.911 1.00 . A B . 13 VAL HG11 1 1 16 12794 1 1 13 VAL HG12 H 5.295 4.650 -1.394 1.00 . A B . 13 VAL HG12 1 1 16 12795 1 1 13 VAL HG13 H 6.108 4.337 -2.928 1.00 . A B . 13 VAL HG13 1 1 16 12796 1 1 13 VAL HG21 H 4.689 7.037 -0.789 1.00 . A B . 13 VAL HG21 1 1 16 12797 1 1 13 VAL HG22 H 3.794 7.121 -2.306 1.00 . A B . 13 VAL HG22 1 1 16 12798 1 1 13 VAL HG23 H 5.038 8.320 -1.947 1.00 . A B . 13 VAL HG23 1 1 16 12799 1 1 13 VAL N N 8.238 5.878 -2.533 1.00 . A B . 13 VAL N 1 1 16 12800 1 1 13 VAL O O 6.912 7.154 0.463 1.00 . A B . 13 VAL O 1 1 16 12801 1 1 14 CYS C C 8.881 5.345 1.941 1.00 . A B . 14 CYS C 1 1 16 12802 1 1 14 CYS CA C 7.651 4.657 1.365 1.00 . A B . 14 CYS CA 1 1 16 12803 1 1 14 CYS CB C 7.774 3.140 1.515 1.00 . A B . 14 CYS CB 1 1 16 12804 1 1 14 CYS H H 7.598 4.365 -0.736 1.00 . A B . 14 CYS H 1 1 16 12805 1 1 14 CYS HA H 6.779 4.992 1.905 1.00 . A B . 14 CYS HA 1 1 16 12806 1 1 14 CYS HB2 H 8.220 2.736 0.621 1.00 . A B . 14 CYS HB2 1 1 16 12807 1 1 14 CYS HB3 H 8.410 2.923 2.358 1.00 . A B . 14 CYS HB3 1 1 16 12808 1 1 14 CYS N N 7.482 5.039 -0.032 1.00 . A B . 14 CYS N 1 1 16 12809 1 1 14 CYS O O 8.929 5.685 3.122 1.00 . A B . 14 CYS O 1 1 16 12810 1 1 14 CYS SG S 6.197 2.289 1.778 1.00 . A B . 14 CYS SG 1 1 16 12811 1 1 15 ARG C C 10.719 7.759 1.722 1.00 . A B . 15 ARG C 1 1 16 12812 1 1 15 ARG CA C 11.065 6.296 1.444 1.00 . A B . 15 ARG CA 1 1 16 12813 1 1 15 ARG CB C 12.103 6.183 0.325 1.00 . A B . 15 ARG CB 1 1 16 12814 1 1 15 ARG CD C 14.374 6.767 -0.562 1.00 . A B . 15 ARG CD 1 1 16 12815 1 1 15 ARG CG C 13.424 6.870 0.621 1.00 . A B . 15 ARG CG 1 1 16 12816 1 1 15 ARG CZ C 16.466 7.868 -1.277 1.00 . A B . 15 ARG CZ 1 1 16 12817 1 1 15 ARG H H 9.767 5.214 0.166 1.00 . A B . 15 ARG H 1 1 16 12818 1 1 15 ARG HA H 11.462 5.854 2.343 1.00 . A B . 15 ARG HA 1 1 16 12819 1 1 15 ARG HB2 H 12.301 5.137 0.141 1.00 . A B . 15 ARG HB2 1 1 16 12820 1 1 15 ARG HB3 H 11.688 6.620 -0.572 1.00 . A B . 15 ARG HB3 1 1 16 12821 1 1 15 ARG HD2 H 14.565 5.724 -0.763 1.00 . A B . 15 ARG HD2 1 1 16 12822 1 1 15 ARG HD3 H 13.903 7.218 -1.422 1.00 . A B . 15 ARG HD3 1 1 16 12823 1 1 15 ARG HE H 15.913 7.577 0.625 1.00 . A B . 15 ARG HE 1 1 16 12824 1 1 15 ARG HG2 H 13.236 7.911 0.831 1.00 . A B . 15 ARG HG2 1 1 16 12825 1 1 15 ARG HG3 H 13.879 6.402 1.481 1.00 . A B . 15 ARG HG3 1 1 16 12826 1 1 15 ARG HH11 H 15.276 7.251 -2.810 1.00 . A B . 15 ARG HH11 1 1 16 12827 1 1 15 ARG HH12 H 16.755 8.033 -3.280 1.00 . A B . 15 ARG HH12 1 1 16 12828 1 1 15 ARG HH21 H 17.860 8.587 0.006 1.00 . A B . 15 ARG HH21 1 1 16 12829 1 1 15 ARG HH22 H 18.232 8.784 -1.678 1.00 . A B . 15 ARG HH22 1 1 16 12830 1 1 15 ARG N N 9.862 5.564 1.078 1.00 . A B . 15 ARG N 1 1 16 12831 1 1 15 ARG NE N 15.649 7.441 -0.314 1.00 . A B . 15 ARG NE 1 1 16 12832 1 1 15 ARG NH1 N 16.141 7.704 -2.557 1.00 . A B . 15 ARG NH1 1 1 16 12833 1 1 15 ARG NH2 N 17.609 8.461 -0.959 1.00 . A B . 15 ARG NH2 1 1 16 12834 1 1 15 ARG O O 11.293 8.388 2.609 1.00 . A B . 15 ARG O 1 1 16 12835 1 1 16 ASP C C 8.315 9.683 2.395 1.00 . A B . 16 ASP C 1 1 16 12836 1 1 16 ASP CA C 9.245 9.636 1.185 1.00 . A B . 16 ASP CA 1 1 16 12837 1 1 16 ASP CB C 8.481 10.153 -0.042 1.00 . A B . 16 ASP CB 1 1 16 12838 1 1 16 ASP CG C 9.377 10.477 -1.221 1.00 . A B . 16 ASP CG 1 1 16 12839 1 1 16 ASP H H 9.429 7.764 0.199 1.00 . A B . 16 ASP H 1 1 16 12840 1 1 16 ASP HA H 10.087 10.284 1.370 1.00 . A B . 16 ASP HA 1 1 16 12841 1 1 16 ASP HB2 H 7.775 9.399 -0.357 1.00 . A B . 16 ASP HB2 1 1 16 12842 1 1 16 ASP HB3 H 7.942 11.049 0.232 1.00 . A B . 16 ASP HB3 1 1 16 12843 1 1 16 ASP N N 9.763 8.285 0.961 1.00 . A B . 16 ASP N 1 1 16 12844 1 1 16 ASP O O 7.761 10.736 2.717 1.00 . A B . 16 ASP O 1 1 16 12845 1 1 16 ASP OD1 O 10.377 11.207 -1.040 1.00 . A B . 16 ASP OD1 1 1 16 12846 1 1 16 ASP OD2 O 9.091 10.002 -2.336 1.00 . A B . 16 ASP OD2 1 1 16 12847 1 1 17 GLY C C 5.804 8.393 3.855 1.00 . A B . 17 GLY C 1 1 16 12848 1 1 17 GLY CA C 7.273 8.496 4.223 1.00 . A B . 17 GLY CA 1 1 16 12849 1 1 17 GLY H H 8.606 7.739 2.757 1.00 . A B . 17 GLY H 1 1 16 12850 1 1 17 GLY HA2 H 7.546 7.638 4.821 1.00 . A B . 17 GLY HA2 1 1 16 12851 1 1 17 GLY HA3 H 7.424 9.392 4.808 1.00 . A B . 17 GLY HA3 1 1 16 12852 1 1 17 GLY N N 8.137 8.548 3.057 1.00 . A B . 17 GLY N 1 1 16 12853 1 1 17 GLY O O 4.937 8.862 4.596 1.00 . A B . 17 GLY O 1 1 16 12854 1 1 18 GLY C C 3.405 6.600 3.140 1.00 . A B . 18 GLY C 1 1 16 12855 1 1 18 GLY CA C 4.161 7.586 2.267 1.00 . A B . 18 GLY CA 1 1 16 12856 1 1 18 GLY H H 6.272 7.519 2.122 1.00 . A B . 18 GLY H 1 1 16 12857 1 1 18 GLY HA2 H 3.642 8.532 2.281 1.00 . A B . 18 GLY HA2 1 1 16 12858 1 1 18 GLY HA3 H 4.174 7.211 1.254 1.00 . A B . 18 GLY HA3 1 1 16 12859 1 1 18 GLY N N 5.530 7.797 2.702 1.00 . A B . 18 GLY N 1 1 16 12860 1 1 18 GLY O O 4.007 5.816 3.882 1.00 . A B . 18 GLY O 1 1 16 12861 1 1 19 GLU C C 0.754 4.570 3.029 1.00 . A B . 19 GLU C 1 1 16 12862 1 1 19 GLU CA C 1.223 5.775 3.830 1.00 . A B . 19 GLU CA 1 1 16 12863 1 1 19 GLU CB C 0.010 6.557 4.336 1.00 . A B . 19 GLU CB 1 1 16 12864 1 1 19 GLU CD C 0.874 6.697 6.704 1.00 . A B . 19 GLU CD 1 1 16 12865 1 1 19 GLU CG C 0.314 7.459 5.520 1.00 . A B . 19 GLU CG 1 1 16 12866 1 1 19 GLU H H 1.677 7.257 2.397 1.00 . A B . 19 GLU H 1 1 16 12867 1 1 19 GLU HA H 1.790 5.429 4.677 1.00 . A B . 19 GLU HA 1 1 16 12868 1 1 19 GLU HB2 H -0.362 7.173 3.531 1.00 . A B . 19 GLU HB2 1 1 16 12869 1 1 19 GLU HB3 H -0.760 5.856 4.627 1.00 . A B . 19 GLU HB3 1 1 16 12870 1 1 19 GLU HG2 H 1.040 8.199 5.215 1.00 . A B . 19 GLU HG2 1 1 16 12871 1 1 19 GLU HG3 H -0.596 7.956 5.827 1.00 . A B . 19 GLU HG3 1 1 16 12872 1 1 19 GLU N N 2.087 6.636 3.038 1.00 . A B . 19 GLU N 1 1 16 12873 1 1 19 GLU O O 0.863 4.536 1.802 1.00 . A B . 19 GLU O 1 1 16 12874 1 1 19 GLU OE1 O 0.133 5.893 7.310 1.00 . A B . 19 GLU OE1 1 1 16 12875 1 1 19 GLU OE2 O 2.060 6.897 7.035 1.00 . A B . 19 GLU OE2 1 1 16 12876 1 1 20 LEU C C -1.837 2.383 3.363 1.00 . A B . 20 LEU C 1 1 16 12877 1 1 20 LEU CA C -0.334 2.401 3.138 1.00 . A B . 20 LEU CA 1 1 16 12878 1 1 20 LEU CB C 0.295 1.138 3.725 1.00 . A B . 20 LEU CB 1 1 16 12879 1 1 20 LEU CD1 C 2.317 -0.305 4.001 1.00 . A B . 20 LEU CD1 1 1 16 12880 1 1 20 LEU CD2 C 1.485 0.235 1.711 1.00 . A B . 20 LEU CD2 1 1 16 12881 1 1 20 LEU CG C 1.653 0.751 3.136 1.00 . A B . 20 LEU CG 1 1 16 12882 1 1 20 LEU H H 0.240 3.660 4.722 1.00 . A B . 20 LEU H 1 1 16 12883 1 1 20 LEU HA H -0.136 2.438 2.079 1.00 . A B . 20 LEU HA 1 1 16 12884 1 1 20 LEU HB2 H 0.419 1.288 4.787 1.00 . A B . 20 LEU HB2 1 1 16 12885 1 1 20 LEU HB3 H -0.387 0.318 3.571 1.00 . A B . 20 LEU HB3 1 1 16 12886 1 1 20 LEU HD11 H 1.692 -1.186 4.036 1.00 . A B . 20 LEU HD11 1 1 16 12887 1 1 20 LEU HD12 H 2.453 0.081 5.000 1.00 . A B . 20 LEU HD12 1 1 16 12888 1 1 20 LEU HD13 H 3.278 -0.562 3.581 1.00 . A B . 20 LEU HD13 1 1 16 12889 1 1 20 LEU HD21 H 0.810 -0.607 1.709 1.00 . A B . 20 LEU HD21 1 1 16 12890 1 1 20 LEU HD22 H 2.445 -0.076 1.327 1.00 . A B . 20 LEU HD22 1 1 16 12891 1 1 20 LEU HD23 H 1.087 1.019 1.083 1.00 . A B . 20 LEU HD23 1 1 16 12892 1 1 20 LEU HG H 2.293 1.623 3.109 1.00 . A B . 20 LEU HG 1 1 16 12893 1 1 20 LEU N N 0.241 3.585 3.745 1.00 . A B . 20 LEU N 1 1 16 12894 1 1 20 LEU O O -2.313 2.664 4.464 1.00 . A B . 20 LEU O 1 1 16 12895 1 1 21 PHE C C -4.529 0.608 2.269 1.00 . A B . 21 PHE C 1 1 16 12896 1 1 21 PHE CA C -4.031 2.042 2.394 1.00 . A B . 21 PHE CA 1 1 16 12897 1 1 21 PHE CB C -4.602 2.922 1.273 1.00 . A B . 21 PHE CB 1 1 16 12898 1 1 21 PHE CD1 C -4.313 5.281 2.105 1.00 . A B . 21 PHE CD1 1 1 16 12899 1 1 21 PHE CD2 C -2.952 4.553 0.285 1.00 . A B . 21 PHE CD2 1 1 16 12900 1 1 21 PHE CE1 C -3.698 6.517 2.072 1.00 . A B . 21 PHE CE1 1 1 16 12901 1 1 21 PHE CE2 C -2.338 5.791 0.248 1.00 . A B . 21 PHE CE2 1 1 16 12902 1 1 21 PHE CG C -3.948 4.282 1.215 1.00 . A B . 21 PHE CG 1 1 16 12903 1 1 21 PHE CZ C -2.711 6.772 1.141 1.00 . A B . 21 PHE CZ 1 1 16 12904 1 1 21 PHE H H -2.143 1.804 1.479 1.00 . A B . 21 PHE H 1 1 16 12905 1 1 21 PHE HA H -4.327 2.440 3.354 1.00 . A B . 21 PHE HA 1 1 16 12906 1 1 21 PHE HB2 H -4.446 2.432 0.320 1.00 . A B . 21 PHE HB2 1 1 16 12907 1 1 21 PHE HB3 H -5.664 3.062 1.429 1.00 . A B . 21 PHE HB3 1 1 16 12908 1 1 21 PHE HD1 H -5.087 5.091 2.833 1.00 . A B . 21 PHE HD1 1 1 16 12909 1 1 21 PHE HD2 H -2.658 3.789 -0.418 1.00 . A B . 21 PHE HD2 1 1 16 12910 1 1 21 PHE HE1 H -3.992 7.284 2.771 1.00 . A B . 21 PHE HE1 1 1 16 12911 1 1 21 PHE HE2 H -1.566 5.990 -0.481 1.00 . A B . 21 PHE HE2 1 1 16 12912 1 1 21 PHE HZ H -2.230 7.739 1.115 1.00 . A B . 21 PHE HZ 1 1 16 12913 1 1 21 PHE N N -2.579 2.053 2.323 1.00 . A B . 21 PHE N 1 1 16 12914 1 1 21 PHE O O -5.585 0.337 1.698 1.00 . A B . 21 PHE O 1 1 16 12915 1 1 22 CYS C C -3.684 -2.490 3.929 1.00 . A B . 22 CYS C 1 1 16 12916 1 1 22 CYS CA C -4.014 -1.729 2.646 1.00 . A B . 22 CYS CA 1 1 16 12917 1 1 22 CYS CB C -3.181 -2.281 1.486 1.00 . A B . 22 CYS CB 1 1 16 12918 1 1 22 CYS H H -2.904 -0.032 3.225 1.00 . A B . 22 CYS H 1 1 16 12919 1 1 22 CYS HA H -5.062 -1.843 2.419 1.00 . A B . 22 CYS HA 1 1 16 12920 1 1 22 CYS HB2 H -2.132 -2.185 1.733 1.00 . A B . 22 CYS HB2 1 1 16 12921 1 1 22 CYS HB3 H -3.419 -3.322 1.336 1.00 . A B . 22 CYS HB3 1 1 16 12922 1 1 22 CYS N N -3.731 -0.314 2.783 1.00 . A B . 22 CYS N 1 1 16 12923 1 1 22 CYS O O -2.941 -1.998 4.779 1.00 . A B . 22 CYS O 1 1 16 12924 1 1 22 CYS SG S -3.445 -1.416 -0.092 1.00 . A B . 22 CYS SG 1 1 16 12925 1 1 23 CYS C C -2.478 -5.096 4.966 1.00 . A B . 23 CYS C 1 1 16 12926 1 1 23 CYS CA C -3.904 -4.597 5.156 1.00 . A B . 23 CYS CA 1 1 16 12927 1 1 23 CYS CB C -4.844 -5.807 5.174 1.00 . A B . 23 CYS CB 1 1 16 12928 1 1 23 CYS H H -4.909 -3.974 3.401 1.00 . A B . 23 CYS H 1 1 16 12929 1 1 23 CYS HA H -3.981 -4.057 6.089 1.00 . A B . 23 CYS HA 1 1 16 12930 1 1 23 CYS HB2 H -4.552 -6.489 4.388 1.00 . A B . 23 CYS HB2 1 1 16 12931 1 1 23 CYS HB3 H -4.756 -6.308 6.130 1.00 . A B . 23 CYS HB3 1 1 16 12932 1 1 23 CYS N N -4.249 -3.692 4.059 1.00 . A B . 23 CYS N 1 1 16 12933 1 1 23 CYS O O -1.941 -4.969 3.870 1.00 . A B . 23 CYS O 1 1 16 12934 1 1 23 CYS SG S -6.582 -5.407 4.921 1.00 . A B . 23 CYS SG 1 1 16 12935 1 1 24 ASP C C -0.434 -7.176 4.695 1.00 . A B . 24 ASP C 1 1 16 12936 1 1 24 ASP CA C -0.521 -6.227 5.882 1.00 . A B . 24 ASP CA 1 1 16 12937 1 1 24 ASP CB C -0.104 -6.968 7.157 1.00 . A B . 24 ASP CB 1 1 16 12938 1 1 24 ASP CG C 0.057 -6.047 8.344 1.00 . A B . 24 ASP CG 1 1 16 12939 1 1 24 ASP H H -2.329 -5.701 6.872 1.00 . A B . 24 ASP H 1 1 16 12940 1 1 24 ASP HA H 0.158 -5.405 5.718 1.00 . A B . 24 ASP HA 1 1 16 12941 1 1 24 ASP HB2 H -0.854 -7.704 7.400 1.00 . A B . 24 ASP HB2 1 1 16 12942 1 1 24 ASP HB3 H 0.839 -7.468 6.983 1.00 . A B . 24 ASP HB3 1 1 16 12943 1 1 24 ASP N N -1.874 -5.670 6.003 1.00 . A B . 24 ASP N 1 1 16 12944 1 1 24 ASP O O 0.401 -7.000 3.808 1.00 . A B . 24 ASP O 1 1 16 12945 1 1 24 ASP OD1 O 1.011 -5.241 8.346 1.00 . A B . 24 ASP OD1 1 1 16 12946 1 1 24 ASP OD2 O -0.776 -6.110 9.273 1.00 . A B . 24 ASP OD2 1 1 16 12947 1 1 25 THR C C -1.569 -8.471 2.232 1.00 . A B . 25 THR C 1 1 16 12948 1 1 25 THR CA C -1.366 -9.137 3.594 1.00 . A B . 25 THR CA 1 1 16 12949 1 1 25 THR CB C -2.484 -10.163 3.840 1.00 . A B . 25 THR CB 1 1 16 12950 1 1 25 THR CG2 C -2.438 -11.280 2.811 1.00 . A B . 25 THR CG2 1 1 16 12951 1 1 25 THR H H -1.991 -8.220 5.385 1.00 . A B . 25 THR H 1 1 16 12952 1 1 25 THR HA H -0.423 -9.658 3.592 1.00 . A B . 25 THR HA 1 1 16 12953 1 1 25 THR HB H -3.436 -9.660 3.764 1.00 . A B . 25 THR HB 1 1 16 12954 1 1 25 THR HG1 H -1.419 -10.684 5.422 1.00 . A B . 25 THR HG1 1 1 16 12955 1 1 25 THR HG21 H -2.577 -10.867 1.824 1.00 . A B . 25 THR HG21 1 1 16 12956 1 1 25 THR HG22 H -3.222 -11.992 3.019 1.00 . A B . 25 THR HG22 1 1 16 12957 1 1 25 THR HG23 H -1.480 -11.776 2.862 1.00 . A B . 25 THR HG23 1 1 16 12958 1 1 25 THR N N -1.335 -8.153 4.662 1.00 . A B . 25 THR N 1 1 16 12959 1 1 25 THR O O -0.834 -8.738 1.284 1.00 . A B . 25 THR O 1 1 16 12960 1 1 25 THR OG1 O -2.348 -10.716 5.156 1.00 . A B . 25 THR OG1 1 1 16 12961 1 1 26 CYS C C -1.705 -5.995 0.460 1.00 . A B . 26 CYS C 1 1 16 12962 1 1 26 CYS CA C -2.865 -6.898 0.902 1.00 . A B . 26 CYS CA 1 1 16 12963 1 1 26 CYS CB C -4.160 -6.091 1.062 1.00 . A B . 26 CYS CB 1 1 16 12964 1 1 26 CYS H H -3.064 -7.362 2.956 1.00 . A B . 26 CYS H 1 1 16 12965 1 1 26 CYS HA H -3.016 -7.659 0.149 1.00 . A B . 26 CYS HA 1 1 16 12966 1 1 26 CYS HB2 H -3.997 -5.298 1.770 1.00 . A B . 26 CYS HB2 1 1 16 12967 1 1 26 CYS HB3 H -4.435 -5.669 0.106 1.00 . A B . 26 CYS HB3 1 1 16 12968 1 1 26 CYS N N -2.547 -7.574 2.154 1.00 . A B . 26 CYS N 1 1 16 12969 1 1 26 CYS O O -1.448 -5.835 -0.732 1.00 . A B . 26 CYS O 1 1 16 12970 1 1 26 CYS SG S -5.560 -7.073 1.656 1.00 . A B . 26 CYS SG 1 1 16 12971 1 1 27 SER C C 1.332 -5.405 0.670 1.00 . A B . 27 SER C 1 1 16 12972 1 1 27 SER CA C 0.154 -4.579 1.173 1.00 . A B . 27 SER CA 1 1 16 12973 1 1 27 SER CB C 0.557 -3.825 2.446 1.00 . A B . 27 SER CB 1 1 16 12974 1 1 27 SER H H -1.281 -5.580 2.367 1.00 . A B . 27 SER H 1 1 16 12975 1 1 27 SER HA H -0.122 -3.864 0.412 1.00 . A B . 27 SER HA 1 1 16 12976 1 1 27 SER HB2 H -0.253 -3.184 2.753 1.00 . A B . 27 SER HB2 1 1 16 12977 1 1 27 SER HB3 H 0.764 -4.538 3.229 1.00 . A B . 27 SER HB3 1 1 16 12978 1 1 27 SER HG H 2.167 -2.904 3.076 1.00 . A B . 27 SER HG 1 1 16 12979 1 1 27 SER N N -1.002 -5.428 1.436 1.00 . A B . 27 SER N 1 1 16 12980 1 1 27 SER O O 2.116 -4.946 -0.150 1.00 . A B . 27 SER O 1 1 16 12981 1 1 27 SER OG O 1.710 -3.028 2.238 1.00 . A B . 27 SER OG 1 1 16 12982 1 1 28 ARG C C 2.358 -8.045 -0.629 1.00 . A B . 28 ARG C 1 1 16 12983 1 1 28 ARG CA C 2.565 -7.485 0.769 1.00 . A B . 28 ARG CA 1 1 16 12984 1 1 28 ARG CB C 2.750 -8.623 1.774 1.00 . A B . 28 ARG CB 1 1 16 12985 1 1 28 ARG CD C 3.489 -9.329 4.076 1.00 . A B . 28 ARG CD 1 1 16 12986 1 1 28 ARG CG C 3.227 -8.157 3.142 1.00 . A B . 28 ARG CG 1 1 16 12987 1 1 28 ARG CZ C 5.234 -11.058 4.331 1.00 . A B . 28 ARG CZ 1 1 16 12988 1 1 28 ARG H H 0.783 -6.969 1.789 1.00 . A B . 28 ARG H 1 1 16 12989 1 1 28 ARG HA H 3.457 -6.876 0.764 1.00 . A B . 28 ARG HA 1 1 16 12990 1 1 28 ARG HB2 H 1.805 -9.130 1.900 1.00 . A B . 28 ARG HB2 1 1 16 12991 1 1 28 ARG HB3 H 3.473 -9.321 1.381 1.00 . A B . 28 ARG HB3 1 1 16 12992 1 1 28 ARG HD2 H 3.799 -8.944 5.035 1.00 . A B . 28 ARG HD2 1 1 16 12993 1 1 28 ARG HD3 H 2.575 -9.891 4.193 1.00 . A B . 28 ARG HD3 1 1 16 12994 1 1 28 ARG HE H 4.723 -10.191 2.599 1.00 . A B . 28 ARG HE 1 1 16 12995 1 1 28 ARG HG2 H 4.141 -7.597 3.021 1.00 . A B . 28 ARG HG2 1 1 16 12996 1 1 28 ARG HG3 H 2.472 -7.522 3.581 1.00 . A B . 28 ARG HG3 1 1 16 12997 1 1 28 ARG HH11 H 4.279 -10.557 6.045 1.00 . A B . 28 ARG HH11 1 1 16 12998 1 1 28 ARG HH12 H 5.523 -11.753 6.210 1.00 . A B . 28 ARG HH12 1 1 16 12999 1 1 28 ARG HH21 H 6.364 -11.774 2.808 1.00 . A B . 28 ARG HH21 1 1 16 13000 1 1 28 ARG HH22 H 6.697 -12.458 4.369 1.00 . A B . 28 ARG HH22 1 1 16 13001 1 1 28 ARG N N 1.454 -6.631 1.158 1.00 . A B . 28 ARG N 1 1 16 13002 1 1 28 ARG NE N 4.534 -10.221 3.566 1.00 . A B . 28 ARG NE 1 1 16 13003 1 1 28 ARG NH1 N 4.992 -11.129 5.633 1.00 . A B . 28 ARG NH1 1 1 16 13004 1 1 28 ARG NH2 N 6.175 -11.822 3.794 1.00 . A B . 28 ARG NH2 1 1 16 13005 1 1 28 ARG O O 3.315 -8.396 -1.316 1.00 . A B . 28 ARG O 1 1 16 13006 1 1 29 VAL C C 0.760 -7.536 -3.409 1.00 . A B . 29 VAL C 1 1 16 13007 1 1 29 VAL CA C 0.784 -8.651 -2.365 1.00 . A B . 29 VAL CA 1 1 16 13008 1 1 29 VAL CB C -0.567 -9.397 -2.362 1.00 . A B . 29 VAL CB 1 1 16 13009 1 1 29 VAL CG1 C -0.878 -9.966 -3.737 1.00 . A B . 29 VAL CG1 1 1 16 13010 1 1 29 VAL CG2 C -0.562 -10.510 -1.329 1.00 . A B . 29 VAL CG2 1 1 16 13011 1 1 29 VAL H H 0.380 -7.830 -0.460 1.00 . A B . 29 VAL H 1 1 16 13012 1 1 29 VAL HA H 1.556 -9.356 -2.631 1.00 . A B . 29 VAL HA 1 1 16 13013 1 1 29 VAL HB H -1.344 -8.696 -2.100 1.00 . A B . 29 VAL HB 1 1 16 13014 1 1 29 VAL HG11 H -0.112 -10.674 -4.013 1.00 . A B . 29 VAL HG11 1 1 16 13015 1 1 29 VAL HG12 H -0.906 -9.166 -4.461 1.00 . A B . 29 VAL HG12 1 1 16 13016 1 1 29 VAL HG13 H -1.836 -10.464 -3.713 1.00 . A B . 29 VAL HG13 1 1 16 13017 1 1 29 VAL HG21 H -0.423 -10.087 -0.345 1.00 . A B . 29 VAL HG21 1 1 16 13018 1 1 29 VAL HG22 H 0.245 -11.195 -1.543 1.00 . A B . 29 VAL HG22 1 1 16 13019 1 1 29 VAL HG23 H -1.503 -11.038 -1.365 1.00 . A B . 29 VAL HG23 1 1 16 13020 1 1 29 VAL N N 1.105 -8.126 -1.049 1.00 . A B . 29 VAL N 1 1 16 13021 1 1 29 VAL O O 1.280 -7.701 -4.515 1.00 . A B . 29 VAL O 1 1 16 13022 1 1 30 PHE C C 0.661 -4.009 -3.430 1.00 . A B . 30 PHE C 1 1 16 13023 1 1 30 PHE CA C 0.045 -5.285 -3.995 1.00 . A B . 30 PHE CA 1 1 16 13024 1 1 30 PHE CB C -1.432 -5.004 -4.309 1.00 . A B . 30 PHE CB 1 1 16 13025 1 1 30 PHE CD1 C -2.007 -6.729 -6.033 1.00 . A B . 30 PHE CD1 1 1 16 13026 1 1 30 PHE CD2 C -3.177 -6.785 -3.952 1.00 . A B . 30 PHE CD2 1 1 16 13027 1 1 30 PHE CE1 C -2.718 -7.829 -6.467 1.00 . A B . 30 PHE CE1 1 1 16 13028 1 1 30 PHE CE2 C -3.892 -7.884 -4.384 1.00 . A B . 30 PHE CE2 1 1 16 13029 1 1 30 PHE CG C -2.226 -6.193 -4.773 1.00 . A B . 30 PHE CG 1 1 16 13030 1 1 30 PHE CZ C -3.724 -8.375 -5.617 1.00 . A B . 30 PHE CZ 1 1 16 13031 1 1 30 PHE H H -0.167 -6.293 -2.140 1.00 . A B . 30 PHE H 1 1 16 13032 1 1 30 PHE HA H 0.557 -5.553 -4.905 1.00 . A B . 30 PHE HA 1 1 16 13033 1 1 30 PHE HB2 H -1.909 -4.628 -3.415 1.00 . A B . 30 PHE HB2 1 1 16 13034 1 1 30 PHE HB3 H -1.488 -4.247 -5.079 1.00 . A B . 30 PHE HB3 1 1 16 13035 1 1 30 PHE HD1 H -1.266 -6.279 -6.678 1.00 . A B . 30 PHE HD1 1 1 16 13036 1 1 30 PHE HD2 H -3.358 -6.379 -2.968 1.00 . A B . 30 PHE HD2 1 1 16 13037 1 1 30 PHE HE1 H -2.536 -8.234 -7.452 1.00 . A B . 30 PHE HE1 1 1 16 13038 1 1 30 PHE HE2 H -4.631 -8.335 -3.738 1.00 . A B . 30 PHE HE2 1 1 16 13039 1 1 30 PHE HZ H -4.307 -9.221 -5.945 1.00 . A B . 30 PHE HZ 1 1 16 13040 1 1 30 PHE N N 0.179 -6.395 -3.055 1.00 . A B . 30 PHE N 1 1 16 13041 1 1 30 PHE O O 0.014 -2.967 -3.412 1.00 . A B . 30 PHE O 1 1 16 13042 1 1 31 HIS C C 2.644 -1.756 -3.317 1.00 . A B . 31 HIS C 1 1 16 13043 1 1 31 HIS CA C 2.554 -2.931 -2.348 1.00 . A B . 31 HIS CA 1 1 16 13044 1 1 31 HIS CB C 3.951 -3.312 -1.847 1.00 . A B . 31 HIS CB 1 1 16 13045 1 1 31 HIS CD2 C 5.680 -1.489 -1.188 1.00 . A B . 31 HIS CD2 1 1 16 13046 1 1 31 HIS CE1 C 4.994 -1.045 0.815 1.00 . A B . 31 HIS CE1 1 1 16 13047 1 1 31 HIS CG C 4.596 -2.277 -0.966 1.00 . A B . 31 HIS CG 1 1 16 13048 1 1 31 HIS H H 2.397 -4.929 -3.051 1.00 . A B . 31 HIS H 1 1 16 13049 1 1 31 HIS HA H 1.950 -2.635 -1.503 1.00 . A B . 31 HIS HA 1 1 16 13050 1 1 31 HIS HB2 H 3.879 -4.229 -1.278 1.00 . A B . 31 HIS HB2 1 1 16 13051 1 1 31 HIS HB3 H 4.595 -3.476 -2.699 1.00 . A B . 31 HIS HB3 1 1 16 13052 1 1 31 HIS HD1 H 3.393 -2.382 0.765 1.00 . A B . 31 HIS HD1 1 1 16 13053 1 1 31 HIS HD2 H 6.248 -1.444 -2.105 1.00 . A B . 31 HIS HD2 1 1 16 13054 1 1 31 HIS HE1 H 4.904 -0.620 1.805 1.00 . A B . 31 HIS HE1 1 1 16 13055 1 1 31 HIS N N 1.905 -4.083 -2.974 1.00 . A B . 31 HIS N 1 1 16 13056 1 1 31 HIS ND1 N 4.171 -1.984 0.310 1.00 . A B . 31 HIS ND1 1 1 16 13057 1 1 31 HIS NE2 N 5.930 -0.710 -0.054 1.00 . A B . 31 HIS NE2 1 1 16 13058 1 1 31 HIS O O 2.226 -0.650 -3.000 1.00 . A B . 31 HIS O 1 1 16 13059 1 1 32 GLU C C 2.060 -0.306 -5.916 1.00 . A B . 32 GLU C 1 1 16 13060 1 1 32 GLU CA C 3.365 -0.973 -5.505 1.00 . A B . 32 GLU CA 1 1 16 13061 1 1 32 GLU CB C 4.051 -1.557 -6.739 1.00 . A B . 32 GLU CB 1 1 16 13062 1 1 32 GLU CD C 6.417 -0.721 -6.532 1.00 . A B . 32 GLU CD 1 1 16 13063 1 1 32 GLU CG C 5.506 -1.928 -6.518 1.00 . A B . 32 GLU CG 1 1 16 13064 1 1 32 GLU H H 3.290 -2.954 -4.765 1.00 . A B . 32 GLU H 1 1 16 13065 1 1 32 GLU HA H 4.010 -0.234 -5.057 1.00 . A B . 32 GLU HA 1 1 16 13066 1 1 32 GLU HB2 H 3.518 -2.445 -7.042 1.00 . A B . 32 GLU HB2 1 1 16 13067 1 1 32 GLU HB3 H 4.005 -0.831 -7.534 1.00 . A B . 32 GLU HB3 1 1 16 13068 1 1 32 GLU HG2 H 5.598 -2.416 -5.560 1.00 . A B . 32 GLU HG2 1 1 16 13069 1 1 32 GLU HG3 H 5.818 -2.607 -7.298 1.00 . A B . 32 GLU HG3 1 1 16 13070 1 1 32 GLU N N 3.127 -2.023 -4.519 1.00 . A B . 32 GLU N 1 1 16 13071 1 1 32 GLU O O 1.988 0.913 -6.069 1.00 . A B . 32 GLU O 1 1 16 13072 1 1 32 GLU OE1 O 6.620 -0.115 -5.455 1.00 . A B . 32 GLU OE1 1 1 16 13073 1 1 32 GLU OE2 O 6.933 -0.366 -7.609 1.00 . A B . 32 GLU OE2 1 1 16 13074 1 1 33 ASP C C -1.024 0.023 -5.392 1.00 . A B . 33 ASP C 1 1 16 13075 1 1 33 ASP CA C -0.262 -0.636 -6.534 1.00 . A B . 33 ASP CA 1 1 16 13076 1 1 33 ASP CB C -1.085 -1.785 -7.122 1.00 . A B . 33 ASP CB 1 1 16 13077 1 1 33 ASP CG C -2.242 -1.295 -7.972 1.00 . A B . 33 ASP CG 1 1 16 13078 1 1 33 ASP H H 1.152 -2.074 -5.888 1.00 . A B . 33 ASP H 1 1 16 13079 1 1 33 ASP HA H -0.087 0.099 -7.303 1.00 . A B . 33 ASP HA 1 1 16 13080 1 1 33 ASP HB2 H -0.447 -2.399 -7.738 1.00 . A B . 33 ASP HB2 1 1 16 13081 1 1 33 ASP HB3 H -1.480 -2.383 -6.314 1.00 . A B . 33 ASP HB3 1 1 16 13082 1 1 33 ASP N N 1.032 -1.121 -6.079 1.00 . A B . 33 ASP N 1 1 16 13083 1 1 33 ASP O O -1.874 0.881 -5.613 1.00 . A B . 33 ASP O 1 1 16 13084 1 1 33 ASP OD1 O -3.313 -0.983 -7.403 1.00 . A B . 33 ASP OD1 1 1 16 13085 1 1 33 ASP OD2 O -2.094 -1.212 -9.206 1.00 . A B . 33 ASP OD2 1 1 16 13086 1 1 34 CYS C C -1.107 1.607 -2.755 1.00 . A B . 34 CYS C 1 1 16 13087 1 1 34 CYS CA C -1.398 0.130 -2.987 1.00 . A B . 34 CYS CA 1 1 16 13088 1 1 34 CYS CB C -1.015 -0.693 -1.749 1.00 . A B . 34 CYS CB 1 1 16 13089 1 1 34 CYS H H 0.041 -1.012 -4.051 1.00 . A B . 34 CYS H 1 1 16 13090 1 1 34 CYS HA H -2.455 0.018 -3.169 1.00 . A B . 34 CYS HA 1 1 16 13091 1 1 34 CYS HB2 H -1.279 -1.728 -1.920 1.00 . A B . 34 CYS HB2 1 1 16 13092 1 1 34 CYS HB3 H 0.052 -0.623 -1.587 1.00 . A B . 34 CYS HB3 1 1 16 13093 1 1 34 CYS N N -0.695 -0.368 -4.167 1.00 . A B . 34 CYS N 1 1 16 13094 1 1 34 CYS O O -1.945 2.343 -2.228 1.00 . A B . 34 CYS O 1 1 16 13095 1 1 34 CYS SG S -1.849 -0.167 -0.216 1.00 . A B . 34 CYS SG 1 1 16 13096 1 1 35 HIS C C -0.174 4.281 -4.144 1.00 . A B . 35 HIS C 1 1 16 13097 1 1 35 HIS CA C 0.452 3.446 -3.033 1.00 . A B . 35 HIS CA 1 1 16 13098 1 1 35 HIS CB C 1.976 3.590 -3.044 1.00 . A B . 35 HIS CB 1 1 16 13099 1 1 35 HIS CD2 C 3.111 1.688 -1.712 1.00 . A B . 35 HIS CD2 1 1 16 13100 1 1 35 HIS CE1 C 3.365 2.672 0.193 1.00 . A B . 35 HIS CE1 1 1 16 13101 1 1 35 HIS CG C 2.632 2.946 -1.858 1.00 . A B . 35 HIS CG 1 1 16 13102 1 1 35 HIS H H 0.693 1.416 -3.601 1.00 . A B . 35 HIS H 1 1 16 13103 1 1 35 HIS HA H 0.076 3.791 -2.080 1.00 . A B . 35 HIS HA 1 1 16 13104 1 1 35 HIS HB2 H 2.366 3.121 -3.936 1.00 . A B . 35 HIS HB2 1 1 16 13105 1 1 35 HIS HB3 H 2.235 4.639 -3.047 1.00 . A B . 35 HIS HB3 1 1 16 13106 1 1 35 HIS HD1 H 2.502 4.467 -0.392 1.00 . A B . 35 HIS HD1 1 1 16 13107 1 1 35 HIS HD2 H 3.150 0.930 -2.483 1.00 . A B . 35 HIS HD2 1 1 16 13108 1 1 35 HIS HE1 H 3.633 2.881 1.219 1.00 . A B . 35 HIS HE1 1 1 16 13109 1 1 35 HIS N N 0.070 2.047 -3.178 1.00 . A B . 35 HIS N 1 1 16 13110 1 1 35 HIS ND1 N 2.796 3.560 -0.633 1.00 . A B . 35 HIS ND1 1 1 16 13111 1 1 35 HIS NE2 N 3.572 1.515 -0.414 1.00 . A B . 35 HIS NE2 1 1 16 13112 1 1 35 HIS O O -0.054 5.505 -4.169 1.00 . A B . 35 HIS O 1 1 16 13113 1 1 36 ILE C C -3.038 4.212 -5.935 1.00 . A B . 36 ILE C 1 1 16 13114 1 1 36 ILE CA C -1.528 4.230 -6.170 1.00 . A B . 36 ILE CA 1 1 16 13115 1 1 36 ILE CB C -1.189 3.500 -7.492 1.00 . A B . 36 ILE CB 1 1 16 13116 1 1 36 ILE CD1 C 0.761 2.838 -9.005 1.00 . A B . 36 ILE CD1 1 1 16 13117 1 1 36 ILE CG1 C 0.328 3.508 -7.718 1.00 . A B . 36 ILE CG1 1 1 16 13118 1 1 36 ILE CG2 C -1.914 4.131 -8.674 1.00 . A B . 36 ILE CG2 1 1 16 13119 1 1 36 ILE H H -0.913 2.621 -4.961 1.00 . A B . 36 ILE H 1 1 16 13120 1 1 36 ILE HA H -1.186 5.253 -6.239 1.00 . A B . 36 ILE HA 1 1 16 13121 1 1 36 ILE HB H -1.523 2.477 -7.404 1.00 . A B . 36 ILE HB 1 1 16 13122 1 1 36 ILE HD11 H 0.408 1.819 -9.017 1.00 . A B . 36 ILE HD11 1 1 16 13123 1 1 36 ILE HD12 H 1.839 2.846 -9.068 1.00 . A B . 36 ILE HD12 1 1 16 13124 1 1 36 ILE HD13 H 0.348 3.374 -9.847 1.00 . A B . 36 ILE HD13 1 1 16 13125 1 1 36 ILE HG12 H 0.677 4.531 -7.745 1.00 . A B . 36 ILE HG12 1 1 16 13126 1 1 36 ILE HG13 H 0.806 2.994 -6.898 1.00 . A B . 36 ILE HG13 1 1 16 13127 1 1 36 ILE HG21 H -1.556 5.138 -8.819 1.00 . A B . 36 ILE HG21 1 1 16 13128 1 1 36 ILE HG22 H -2.976 4.151 -8.474 1.00 . A B . 36 ILE HG22 1 1 16 13129 1 1 36 ILE HG23 H -1.726 3.549 -9.562 1.00 . A B . 36 ILE HG23 1 1 16 13130 1 1 36 ILE N N -0.853 3.596 -5.053 1.00 . A B . 36 ILE N 1 1 16 13131 1 1 36 ILE O O -3.586 3.210 -5.475 1.00 . A B . 36 ILE O 1 1 16 13132 1 1 37 PRO C C -2.465 7.369 -5.587 1.00 . A B . 37 PRO C 1 1 16 13133 1 1 37 PRO CA C -3.125 6.560 -6.705 1.00 . A B . 37 PRO CA 1 1 16 13134 1 1 37 PRO CB C -4.323 7.317 -7.284 1.00 . A B . 37 PRO CB 1 1 16 13135 1 1 37 PRO CD C -5.198 5.448 -6.063 1.00 . A B . 37 PRO CD 1 1 16 13136 1 1 37 PRO CG C -5.478 6.878 -6.449 1.00 . A B . 37 PRO CG 1 1 16 13137 1 1 37 PRO HA H -2.402 6.363 -7.483 1.00 . A B . 37 PRO HA 1 1 16 13138 1 1 37 PRO HB2 H -4.155 8.383 -7.199 1.00 . A B . 37 PRO HB2 1 1 16 13139 1 1 37 PRO HB3 H -4.458 7.047 -8.327 1.00 . A B . 37 PRO HB3 1 1 16 13140 1 1 37 PRO HD2 H -5.498 5.266 -5.039 1.00 . A B . 37 PRO HD2 1 1 16 13141 1 1 37 PRO HD3 H -5.708 4.769 -6.732 1.00 . A B . 37 PRO HD3 1 1 16 13142 1 1 37 PRO HG2 H -5.550 7.499 -5.564 1.00 . A B . 37 PRO HG2 1 1 16 13143 1 1 37 PRO HG3 H -6.393 6.938 -7.022 1.00 . A B . 37 PRO HG3 1 1 16 13144 1 1 37 PRO N N -3.736 5.323 -6.210 1.00 . A B . 37 PRO N 1 1 16 13145 1 1 37 PRO O O -2.930 7.360 -4.443 1.00 . A B . 37 PRO O 1 1 16 13146 1 1 38 PRO C C -1.567 9.999 -4.389 1.00 . A B . 38 PRO C 1 1 16 13147 1 1 38 PRO CA C -0.656 8.909 -4.936 1.00 . A B . 38 PRO CA 1 1 16 13148 1 1 38 PRO CB C 0.503 9.518 -5.737 1.00 . A B . 38 PRO CB 1 1 16 13149 1 1 38 PRO CD C -0.715 8.083 -7.227 1.00 . A B . 38 PRO CD 1 1 16 13150 1 1 38 PRO CG C 0.137 9.324 -7.173 1.00 . A B . 38 PRO CG 1 1 16 13151 1 1 38 PRO HA H -0.265 8.324 -4.118 1.00 . A B . 38 PRO HA 1 1 16 13152 1 1 38 PRO HB2 H 0.597 10.567 -5.491 1.00 . A B . 38 PRO HB2 1 1 16 13153 1 1 38 PRO HB3 H 1.421 9.004 -5.490 1.00 . A B . 38 PRO HB3 1 1 16 13154 1 1 38 PRO HD2 H -1.453 8.161 -8.015 1.00 . A B . 38 PRO HD2 1 1 16 13155 1 1 38 PRO HD3 H -0.100 7.202 -7.367 1.00 . A B . 38 PRO HD3 1 1 16 13156 1 1 38 PRO HG2 H -0.423 10.179 -7.526 1.00 . A B . 38 PRO HG2 1 1 16 13157 1 1 38 PRO HG3 H 1.033 9.193 -7.767 1.00 . A B . 38 PRO HG3 1 1 16 13158 1 1 38 PRO N N -1.360 8.064 -5.904 1.00 . A B . 38 PRO N 1 1 16 13159 1 1 38 PRO O O -2.270 10.668 -5.149 1.00 . A B . 38 PRO O 1 1 16 13160 1 1 39 VAL C C -2.300 12.516 -2.934 1.00 . A B . 39 VAL C 1 1 16 13161 1 1 39 VAL CA C -2.466 11.089 -2.408 1.00 . A B . 39 VAL CA 1 1 16 13162 1 1 39 VAL CB C -2.294 11.057 -0.868 1.00 . A B . 39 VAL CB 1 1 16 13163 1 1 39 VAL CG1 C -0.872 11.401 -0.455 1.00 . A B . 39 VAL CG1 1 1 16 13164 1 1 39 VAL CG2 C -3.292 11.989 -0.194 1.00 . A B . 39 VAL CG2 1 1 16 13165 1 1 39 VAL H H -0.948 9.622 -2.527 1.00 . A B . 39 VAL H 1 1 16 13166 1 1 39 VAL HA H -3.472 10.765 -2.628 1.00 . A B . 39 VAL HA 1 1 16 13167 1 1 39 VAL HB H -2.502 10.053 -0.533 1.00 . A B . 39 VAL HB 1 1 16 13168 1 1 39 VAL HG11 H -0.802 11.403 0.622 1.00 . A B . 39 VAL HG11 1 1 16 13169 1 1 39 VAL HG12 H -0.614 12.377 -0.835 1.00 . A B . 39 VAL HG12 1 1 16 13170 1 1 39 VAL HG13 H -0.191 10.667 -0.857 1.00 . A B . 39 VAL HG13 1 1 16 13171 1 1 39 VAL HG21 H -3.120 13.002 -0.528 1.00 . A B . 39 VAL HG21 1 1 16 13172 1 1 39 VAL HG22 H -3.166 11.936 0.877 1.00 . A B . 39 VAL HG22 1 1 16 13173 1 1 39 VAL HG23 H -4.296 11.690 -0.454 1.00 . A B . 39 VAL HG23 1 1 16 13174 1 1 39 VAL N N -1.566 10.156 -3.070 1.00 . A B . 39 VAL N 1 1 16 13175 1 1 39 VAL O O -1.215 13.103 -2.885 1.00 . A B . 39 VAL O 1 1 16 13176 1 1 40 GLU C C -4.234 15.289 -3.033 1.00 . A B . 40 GLU C 1 1 16 13177 1 1 40 GLU CA C -3.407 14.420 -3.962 1.00 . A B . 40 GLU CA 1 1 16 13178 1 1 40 GLU CB C -3.955 14.482 -5.390 1.00 . A B . 40 GLU CB 1 1 16 13179 1 1 40 GLU CD C -1.784 15.065 -6.519 1.00 . A B . 40 GLU CD 1 1 16 13180 1 1 40 GLU CG C -2.939 14.090 -6.448 1.00 . A B . 40 GLU CG 1 1 16 13181 1 1 40 GLU H H -4.198 12.508 -3.542 1.00 . A B . 40 GLU H 1 1 16 13182 1 1 40 GLU HA H -2.392 14.782 -3.960 1.00 . A B . 40 GLU HA 1 1 16 13183 1 1 40 GLU HB2 H -4.801 13.816 -5.472 1.00 . A B . 40 GLU HB2 1 1 16 13184 1 1 40 GLU HB3 H -4.283 15.491 -5.594 1.00 . A B . 40 GLU HB3 1 1 16 13185 1 1 40 GLU HG2 H -2.551 13.111 -6.215 1.00 . A B . 40 GLU HG2 1 1 16 13186 1 1 40 GLU HG3 H -3.430 14.064 -7.411 1.00 . A B . 40 GLU HG3 1 1 16 13187 1 1 40 GLU N N -3.386 13.051 -3.475 1.00 . A B . 40 GLU N 1 1 16 13188 1 1 40 GLU O O -3.758 16.309 -2.533 1.00 . A B . 40 GLU O 1 1 16 13189 1 1 40 GLU OE1 O -1.940 16.145 -7.126 1.00 . A B . 40 GLU OE1 1 1 16 13190 1 1 40 GLU OE2 O -0.706 14.755 -5.973 1.00 . A B . 40 GLU OE2 1 1 16 13191 1 1 41 ALA C C -6.253 14.983 -0.487 1.00 . A B . 41 ALA C 1 1 16 13192 1 1 41 ALA CA C -6.339 15.586 -1.881 1.00 . A B . 41 ALA CA 1 1 16 13193 1 1 41 ALA CB C -7.772 15.567 -2.391 1.00 . A B . 41 ALA CB 1 1 16 13194 1 1 41 ALA H H -5.797 14.058 -3.229 1.00 . A B . 41 ALA H 1 1 16 13195 1 1 41 ALA HA H -6.009 16.612 -1.839 1.00 . A B . 41 ALA HA 1 1 16 13196 1 1 41 ALA HB1 H -8.395 16.158 -1.737 1.00 . A B . 41 ALA HB1 1 1 16 13197 1 1 41 ALA HB2 H -8.134 14.549 -2.410 1.00 . A B . 41 ALA HB2 1 1 16 13198 1 1 41 ALA HB3 H -7.804 15.978 -3.389 1.00 . A B . 41 ALA HB3 1 1 16 13199 1 1 41 ALA N N -5.468 14.871 -2.790 1.00 . A B . 41 ALA N 1 1 16 13200 1 1 41 ALA O O -5.748 15.616 0.444 1.00 . A B . 41 ALA O 1 1 16 13201 1 1 42 GLU C C -7.133 11.581 0.705 1.00 . A B . 42 GLU C 1 1 16 13202 1 1 42 GLU CA C -6.715 13.033 0.906 1.00 . A B . 42 GLU CA 1 1 16 13203 1 1 42 GLU CB C -7.651 13.717 1.903 1.00 . A B . 42 GLU CB 1 1 16 13204 1 1 42 GLU CD C -9.932 14.707 2.312 1.00 . A B . 42 GLU CD 1 1 16 13205 1 1 42 GLU CG C -9.076 13.861 1.399 1.00 . A B . 42 GLU CG 1 1 16 13206 1 1 42 GLU H H -7.077 13.292 -1.155 1.00 . A B . 42 GLU H 1 1 16 13207 1 1 42 GLU HA H -5.710 13.057 1.296 1.00 . A B . 42 GLU HA 1 1 16 13208 1 1 42 GLU HB2 H -7.671 13.140 2.816 1.00 . A B . 42 GLU HB2 1 1 16 13209 1 1 42 GLU HB3 H -7.268 14.703 2.118 1.00 . A B . 42 GLU HB3 1 1 16 13210 1 1 42 GLU HG2 H -9.051 14.323 0.423 1.00 . A B . 42 GLU HG2 1 1 16 13211 1 1 42 GLU HG3 H -9.518 12.878 1.320 1.00 . A B . 42 GLU HG3 1 1 16 13212 1 1 42 GLU N N -6.718 13.745 -0.365 1.00 . A B . 42 GLU N 1 1 16 13213 1 1 42 GLU O O -8.032 11.286 -0.085 1.00 . A B . 42 GLU O 1 1 16 13214 1 1 42 GLU OE1 O -9.984 15.940 2.115 1.00 . A B . 42 GLU OE1 1 1 16 13215 1 1 42 GLU OE2 O -10.561 14.142 3.231 1.00 . A B . 42 GLU OE2 1 1 16 13216 1 1 43 ARG C C -6.645 8.661 2.750 1.00 . A B . 43 ARG C 1 1 16 13217 1 1 43 ARG CA C -6.793 9.261 1.359 1.00 . A B . 43 ARG CA 1 1 16 13218 1 1 43 ARG CB C -5.896 8.511 0.367 1.00 . A B . 43 ARG CB 1 1 16 13219 1 1 43 ARG CD C -5.440 7.895 -2.025 1.00 . A B . 43 ARG CD 1 1 16 13220 1 1 43 ARG CG C -6.117 8.888 -1.090 1.00 . A B . 43 ARG CG 1 1 16 13221 1 1 43 ARG CZ C -5.301 5.427 -2.181 1.00 . A B . 43 ARG CZ 1 1 16 13222 1 1 43 ARG H H -5.737 10.973 1.996 1.00 . A B . 43 ARG H 1 1 16 13223 1 1 43 ARG HA H -7.824 9.168 1.046 1.00 . A B . 43 ARG HA 1 1 16 13224 1 1 43 ARG HB2 H -4.864 8.716 0.613 1.00 . A B . 43 ARG HB2 1 1 16 13225 1 1 43 ARG HB3 H -6.075 7.451 0.473 1.00 . A B . 43 ARG HB3 1 1 16 13226 1 1 43 ARG HD2 H -5.626 8.191 -3.047 1.00 . A B . 43 ARG HD2 1 1 16 13227 1 1 43 ARG HD3 H -4.378 7.905 -1.835 1.00 . A B . 43 ARG HD3 1 1 16 13228 1 1 43 ARG HE H -6.819 6.449 -1.371 1.00 . A B . 43 ARG HE 1 1 16 13229 1 1 43 ARG HG2 H -7.178 8.894 -1.293 1.00 . A B . 43 ARG HG2 1 1 16 13230 1 1 43 ARG HG3 H -5.708 9.873 -1.266 1.00 . A B . 43 ARG HG3 1 1 16 13231 1 1 43 ARG HH11 H -3.759 6.391 -3.089 1.00 . A B . 43 ARG HH11 1 1 16 13232 1 1 43 ARG HH12 H -3.668 4.658 -3.106 1.00 . A B . 43 ARG HH12 1 1 16 13233 1 1 43 ARG HH21 H -6.697 4.184 -1.401 1.00 . A B . 43 ARG HH21 1 1 16 13234 1 1 43 ARG HH22 H -5.342 3.405 -2.153 1.00 . A B . 43 ARG HH22 1 1 16 13235 1 1 43 ARG N N -6.466 10.677 1.406 1.00 . A B . 43 ARG N 1 1 16 13236 1 1 43 ARG NE N -5.946 6.537 -1.823 1.00 . A B . 43 ARG NE 1 1 16 13237 1 1 43 ARG NH1 N -4.152 5.497 -2.845 1.00 . A B . 43 ARG NH1 1 1 16 13238 1 1 43 ARG NH2 N -5.820 4.243 -1.891 1.00 . A B . 43 ARG NH2 1 1 16 13239 1 1 43 ARG O O -5.698 8.976 3.470 1.00 . A B . 43 ARG O 1 1 16 13240 1 1 44 THR C C -6.828 5.915 4.534 1.00 . A B . 44 THR C 1 1 16 13241 1 1 44 THR CA C -7.600 7.240 4.466 1.00 . A B . 44 THR CA 1 1 16 13242 1 1 44 THR CB C -9.054 7.034 4.938 1.00 . A B . 44 THR CB 1 1 16 13243 1 1 44 THR CG2 C -9.746 8.375 5.157 1.00 . A B . 44 THR CG2 1 1 16 13244 1 1 44 THR H H -8.269 7.535 2.486 1.00 . A B . 44 THR H 1 1 16 13245 1 1 44 THR HA H -7.134 7.952 5.127 1.00 . A B . 44 THR HA 1 1 16 13246 1 1 44 THR HB H -9.042 6.494 5.874 1.00 . A B . 44 THR HB 1 1 16 13247 1 1 44 THR HG1 H -10.486 5.779 4.416 1.00 . A B . 44 THR HG1 1 1 16 13248 1 1 44 THR HG21 H -9.221 8.931 5.919 1.00 . A B . 44 THR HG21 1 1 16 13249 1 1 44 THR HG22 H -10.766 8.207 5.471 1.00 . A B . 44 THR HG22 1 1 16 13250 1 1 44 THR HG23 H -9.741 8.937 4.234 1.00 . A B . 44 THR HG23 1 1 16 13251 1 1 44 THR N N -7.578 7.803 3.127 1.00 . A B . 44 THR N 1 1 16 13252 1 1 44 THR O O -7.158 4.956 3.834 1.00 . A B . 44 THR O 1 1 16 13253 1 1 44 THR OG1 O -9.790 6.276 3.967 1.00 . A B . 44 THR OG1 1 1 16 13254 1 1 45 PRO C C -5.700 3.488 6.174 1.00 . A B . 45 PRO C 1 1 16 13255 1 1 45 PRO CA C -4.942 4.642 5.522 1.00 . A B . 45 PRO CA 1 1 16 13256 1 1 45 PRO CB C -3.781 5.092 6.424 1.00 . A B . 45 PRO CB 1 1 16 13257 1 1 45 PRO CD C -5.272 6.956 6.207 1.00 . A B . 45 PRO CD 1 1 16 13258 1 1 45 PRO CG C -3.834 6.585 6.436 1.00 . A B . 45 PRO CG 1 1 16 13259 1 1 45 PRO HA H -4.551 4.314 4.571 1.00 . A B . 45 PRO HA 1 1 16 13260 1 1 45 PRO HB2 H -3.915 4.685 7.416 1.00 . A B . 45 PRO HB2 1 1 16 13261 1 1 45 PRO HB3 H -2.846 4.737 6.011 1.00 . A B . 45 PRO HB3 1 1 16 13262 1 1 45 PRO HD2 H -5.808 7.002 7.147 1.00 . A B . 45 PRO HD2 1 1 16 13263 1 1 45 PRO HD3 H -5.340 7.899 5.683 1.00 . A B . 45 PRO HD3 1 1 16 13264 1 1 45 PRO HG2 H -3.500 6.956 7.394 1.00 . A B . 45 PRO HG2 1 1 16 13265 1 1 45 PRO HG3 H -3.214 6.981 5.644 1.00 . A B . 45 PRO HG3 1 1 16 13266 1 1 45 PRO N N -5.768 5.851 5.370 1.00 . A B . 45 PRO N 1 1 16 13267 1 1 45 PRO O O -5.335 2.321 6.014 1.00 . A B . 45 PRO O 1 1 16 13268 1 1 46 TRP C C -8.720 2.341 6.661 1.00 . A B . 46 TRP C 1 1 16 13269 1 1 46 TRP CA C -7.581 2.808 7.564 1.00 . A B . 46 TRP CA 1 1 16 13270 1 1 46 TRP CB C -8.130 3.357 8.888 1.00 . A B . 46 TRP CB 1 1 16 13271 1 1 46 TRP CD1 C -9.862 5.193 8.431 1.00 . A B . 46 TRP CD1 1 1 16 13272 1 1 46 TRP CD2 C -7.863 5.956 9.089 1.00 . A B . 46 TRP CD2 1 1 16 13273 1 1 46 TRP CE2 C -8.712 7.055 8.872 1.00 . A B . 46 TRP CE2 1 1 16 13274 1 1 46 TRP CE3 C -6.551 6.191 9.510 1.00 . A B . 46 TRP CE3 1 1 16 13275 1 1 46 TRP CG C -8.616 4.773 8.800 1.00 . A B . 46 TRP CG 1 1 16 13276 1 1 46 TRP CH2 C -7.005 8.568 9.473 1.00 . A B . 46 TRP CH2 1 1 16 13277 1 1 46 TRP CZ2 C -8.293 8.368 9.061 1.00 . A B . 46 TRP CZ2 1 1 16 13278 1 1 46 TRP CZ3 C -6.137 7.496 9.697 1.00 . A B . 46 TRP CZ3 1 1 16 13279 1 1 46 TRP H H -7.011 4.759 6.972 1.00 . A B . 46 TRP H 1 1 16 13280 1 1 46 TRP HA H -6.945 1.960 7.774 1.00 . A B . 46 TRP HA 1 1 16 13281 1 1 46 TRP HB2 H -8.959 2.744 9.208 1.00 . A B . 46 TRP HB2 1 1 16 13282 1 1 46 TRP HB3 H -7.353 3.318 9.639 1.00 . A B . 46 TRP HB3 1 1 16 13283 1 1 46 TRP HD1 H -10.669 4.534 8.149 1.00 . A B . 46 TRP HD1 1 1 16 13284 1 1 46 TRP HE1 H -10.717 7.105 8.246 1.00 . A B . 46 TRP HE1 1 1 16 13285 1 1 46 TRP HE3 H -5.866 5.377 9.688 1.00 . A B . 46 TRP HE3 1 1 16 13286 1 1 46 TRP HH2 H -6.636 9.568 9.631 1.00 . A B . 46 TRP HH2 1 1 16 13287 1 1 46 TRP HZ2 H -8.951 9.208 8.896 1.00 . A B . 46 TRP HZ2 1 1 16 13288 1 1 46 TRP HZ3 H -5.126 7.699 10.022 1.00 . A B . 46 TRP HZ3 1 1 16 13289 1 1 46 TRP N N -6.764 3.815 6.893 1.00 . A B . 46 TRP N 1 1 16 13290 1 1 46 TRP NE1 N -9.926 6.564 8.469 1.00 . A B . 46 TRP NE1 1 1 16 13291 1 1 46 TRP O O -9.815 2.025 7.125 1.00 . A B . 46 TRP O 1 1 16 13292 1 1 47 ASN C C -8.672 1.040 3.316 1.00 . A B . 47 ASN C 1 1 16 13293 1 1 47 ASN CA C -9.401 1.834 4.383 1.00 . A B . 47 ASN CA 1 1 16 13294 1 1 47 ASN CB C -10.126 3.016 3.731 1.00 . A B . 47 ASN CB 1 1 16 13295 1 1 47 ASN CG C -11.157 2.585 2.701 1.00 . A B . 47 ASN CG 1 1 16 13296 1 1 47 ASN H H -7.556 2.588 5.066 1.00 . A B . 47 ASN H 1 1 16 13297 1 1 47 ASN HA H -10.118 1.200 4.879 1.00 . A B . 47 ASN HA 1 1 16 13298 1 1 47 ASN HB2 H -10.630 3.583 4.495 1.00 . A B . 47 ASN HB2 1 1 16 13299 1 1 47 ASN HB3 H -9.400 3.648 3.242 1.00 . A B . 47 ASN HB3 1 1 16 13300 1 1 47 ASN HD21 H -9.784 2.629 1.265 1.00 . A B . 47 ASN HD21 1 1 16 13301 1 1 47 ASN HD22 H -11.379 2.175 0.765 1.00 . A B . 47 ASN HD22 1 1 16 13302 1 1 47 ASN N N -8.443 2.301 5.370 1.00 . A B . 47 ASN N 1 1 16 13303 1 1 47 ASN ND2 N -10.731 2.448 1.453 1.00 . A B . 47 ASN ND2 1 1 16 13304 1 1 47 ASN O O -7.954 1.615 2.501 1.00 . A B . 47 ASN O 1 1 16 13305 1 1 47 ASN OD1 O -12.328 2.381 3.024 1.00 . A B . 47 ASN OD1 1 1 16 13306 1 1 48 CYS C C -8.929 -1.069 1.030 1.00 . A B . 48 CYS C 1 1 16 13307 1 1 48 CYS CA C -8.171 -1.108 2.343 1.00 . A B . 48 CYS CA 1 1 16 13308 1 1 48 CYS CB C -8.063 -2.551 2.842 1.00 . A B . 48 CYS CB 1 1 16 13309 1 1 48 CYS H H -9.479 -0.678 3.947 1.00 . A B . 48 CYS H 1 1 16 13310 1 1 48 CYS HA H -7.180 -0.704 2.192 1.00 . A B . 48 CYS HA 1 1 16 13311 1 1 48 CYS HB2 H -7.536 -2.562 3.786 1.00 . A B . 48 CYS HB2 1 1 16 13312 1 1 48 CYS HB3 H -9.058 -2.948 2.988 1.00 . A B . 48 CYS HB3 1 1 16 13313 1 1 48 CYS N N -8.850 -0.272 3.314 1.00 . A B . 48 CYS N 1 1 16 13314 1 1 48 CYS O O -10.108 -1.426 0.964 1.00 . A B . 48 CYS O 1 1 16 13315 1 1 48 CYS SG S -7.188 -3.676 1.718 1.00 . A B . 48 CYS SG 1 1 16 13316 1 1 49 ILE C C -9.017 -1.881 -2.001 1.00 . A B . 49 ILE C 1 1 16 13317 1 1 49 ILE CA C -8.855 -0.525 -1.324 1.00 . A B . 49 ILE CA 1 1 16 13318 1 1 49 ILE CB C -8.058 0.434 -2.241 1.00 . A B . 49 ILE CB 1 1 16 13319 1 1 49 ILE CD1 C -5.730 0.977 -3.126 1.00 . A B . 49 ILE CD1 1 1 16 13320 1 1 49 ILE CG1 C -6.553 0.172 -2.142 1.00 . A B . 49 ILE CG1 1 1 16 13321 1 1 49 ILE CG2 C -8.367 1.882 -1.883 1.00 . A B . 49 ILE CG2 1 1 16 13322 1 1 49 ILE H H -7.301 -0.397 0.101 1.00 . A B . 49 ILE H 1 1 16 13323 1 1 49 ILE HA H -9.836 -0.100 -1.176 1.00 . A B . 49 ILE HA 1 1 16 13324 1 1 49 ILE HB H -8.377 0.265 -3.258 1.00 . A B . 49 ILE HB 1 1 16 13325 1 1 49 ILE HD11 H -5.974 0.673 -4.134 1.00 . A B . 49 ILE HD11 1 1 16 13326 1 1 49 ILE HD12 H -4.680 0.807 -2.942 1.00 . A B . 49 ILE HD12 1 1 16 13327 1 1 49 ILE HD13 H -5.951 2.026 -3.004 1.00 . A B . 49 ILE HD13 1 1 16 13328 1 1 49 ILE HG12 H -6.218 0.432 -1.151 1.00 . A B . 49 ILE HG12 1 1 16 13329 1 1 49 ILE HG13 H -6.360 -0.876 -2.322 1.00 . A B . 49 ILE HG13 1 1 16 13330 1 1 49 ILE HG21 H -9.419 2.076 -2.028 1.00 . A B . 49 ILE HG21 1 1 16 13331 1 1 49 ILE HG22 H -7.790 2.540 -2.518 1.00 . A B . 49 ILE HG22 1 1 16 13332 1 1 49 ILE HG23 H -8.106 2.063 -0.850 1.00 . A B . 49 ILE HG23 1 1 16 13333 1 1 49 ILE N N -8.241 -0.651 -0.015 1.00 . A B . 49 ILE N 1 1 16 13334 1 1 49 ILE O O -9.996 -2.116 -2.696 1.00 . A B . 49 ILE O 1 1 16 13335 1 1 50 PHE C C -9.128 -5.024 -1.853 1.00 . A B . 50 PHE C 1 1 16 13336 1 1 50 PHE CA C -8.093 -4.080 -2.445 1.00 . A B . 50 PHE CA 1 1 16 13337 1 1 50 PHE CB C -6.706 -4.723 -2.438 1.00 . A B . 50 PHE CB 1 1 16 13338 1 1 50 PHE CD1 C -5.649 -4.144 -4.643 1.00 . A B . 50 PHE CD1 1 1 16 13339 1 1 50 PHE CD2 C -4.871 -3.041 -2.680 1.00 . A B . 50 PHE CD2 1 1 16 13340 1 1 50 PHE CE1 C -4.752 -3.425 -5.406 1.00 . A B . 50 PHE CE1 1 1 16 13341 1 1 50 PHE CE2 C -3.973 -2.323 -3.436 1.00 . A B . 50 PHE CE2 1 1 16 13342 1 1 50 PHE CG C -5.718 -3.959 -3.269 1.00 . A B . 50 PHE CG 1 1 16 13343 1 1 50 PHE CZ C -3.912 -2.513 -4.800 1.00 . A B . 50 PHE CZ 1 1 16 13344 1 1 50 PHE H H -7.401 -2.611 -1.081 1.00 . A B . 50 PHE H 1 1 16 13345 1 1 50 PHE HA H -8.373 -3.886 -3.472 1.00 . A B . 50 PHE HA 1 1 16 13346 1 1 50 PHE HB2 H -6.334 -4.763 -1.424 1.00 . A B . 50 PHE HB2 1 1 16 13347 1 1 50 PHE HB3 H -6.775 -5.728 -2.833 1.00 . A B . 50 PHE HB3 1 1 16 13348 1 1 50 PHE HD1 H -6.306 -4.857 -5.118 1.00 . A B . 50 PHE HD1 1 1 16 13349 1 1 50 PHE HD2 H -4.915 -2.888 -1.612 1.00 . A B . 50 PHE HD2 1 1 16 13350 1 1 50 PHE HE1 H -4.705 -3.578 -6.475 1.00 . A B . 50 PHE HE1 1 1 16 13351 1 1 50 PHE HE2 H -3.319 -1.612 -2.959 1.00 . A B . 50 PHE HE2 1 1 16 13352 1 1 50 PHE HZ H -3.211 -1.948 -5.395 1.00 . A B . 50 PHE HZ 1 1 16 13353 1 1 50 PHE N N -8.081 -2.791 -1.760 1.00 . A B . 50 PHE N 1 1 16 13354 1 1 50 PHE O O -9.703 -5.839 -2.568 1.00 . A B . 50 PHE O 1 1 16 13355 1 1 51 CYS C C -11.742 -5.567 -0.443 1.00 . A B . 51 CYS C 1 1 16 13356 1 1 51 CYS CA C -10.336 -5.783 0.107 1.00 . A B . 51 CYS CA 1 1 16 13357 1 1 51 CYS CB C -10.322 -5.568 1.621 1.00 . A B . 51 CYS CB 1 1 16 13358 1 1 51 CYS H H -8.909 -4.224 -0.031 1.00 . A B . 51 CYS H 1 1 16 13359 1 1 51 CYS HA H -10.044 -6.803 -0.102 1.00 . A B . 51 CYS HA 1 1 16 13360 1 1 51 CYS HB2 H -9.998 -4.560 1.830 1.00 . A B . 51 CYS HB2 1 1 16 13361 1 1 51 CYS HB3 H -11.321 -5.706 2.007 1.00 . A B . 51 CYS HB3 1 1 16 13362 1 1 51 CYS N N -9.372 -4.912 -0.552 1.00 . A B . 51 CYS N 1 1 16 13363 1 1 51 CYS O O -12.409 -6.516 -0.838 1.00 . A B . 51 CYS O 1 1 16 13364 1 1 51 CYS SG S -9.221 -6.689 2.517 1.00 . A B . 51 CYS SG 1 1 16 13365 1 1 52 ARG C C -13.674 -3.920 -2.443 1.00 . A B . 52 ARG C 1 1 16 13366 1 1 52 ARG CA C -13.543 -4.019 -0.922 1.00 . A B . 52 ARG CA 1 1 16 13367 1 1 52 ARG CB C -14.041 -2.740 -0.245 1.00 . A B . 52 ARG CB 1 1 16 13368 1 1 52 ARG CD C -13.529 -0.404 0.509 1.00 . A B . 52 ARG CD 1 1 16 13369 1 1 52 ARG CG C -13.112 -1.546 -0.404 1.00 . A B . 52 ARG CG 1 1 16 13370 1 1 52 ARG CZ C -14.395 -0.358 2.825 1.00 . A B . 52 ARG CZ 1 1 16 13371 1 1 52 ARG H H -11.592 -3.584 -0.235 1.00 . A B . 52 ARG H 1 1 16 13372 1 1 52 ARG HA H -14.159 -4.840 -0.590 1.00 . A B . 52 ARG HA 1 1 16 13373 1 1 52 ARG HB2 H -14.999 -2.479 -0.666 1.00 . A B . 52 ARG HB2 1 1 16 13374 1 1 52 ARG HB3 H -14.163 -2.934 0.810 1.00 . A B . 52 ARG HB3 1 1 16 13375 1 1 52 ARG HD2 H -12.841 0.418 0.377 1.00 . A B . 52 ARG HD2 1 1 16 13376 1 1 52 ARG HD3 H -14.524 -0.086 0.237 1.00 . A B . 52 ARG HD3 1 1 16 13377 1 1 52 ARG HE H -12.845 -1.461 2.198 1.00 . A B . 52 ARG HE 1 1 16 13378 1 1 52 ARG HG2 H -12.107 -1.848 -0.150 1.00 . A B . 52 ARG HG2 1 1 16 13379 1 1 52 ARG HG3 H -13.143 -1.209 -1.430 1.00 . A B . 52 ARG HG3 1 1 16 13380 1 1 52 ARG HH11 H -15.339 0.918 1.561 1.00 . A B . 52 ARG HH11 1 1 16 13381 1 1 52 ARG HH12 H -15.966 0.878 3.179 1.00 . A B . 52 ARG HH12 1 1 16 13382 1 1 52 ARG HH21 H -13.653 -1.502 4.324 1.00 . A B . 52 ARG HH21 1 1 16 13383 1 1 52 ARG HH22 H -14.995 -0.489 4.758 1.00 . A B . 52 ARG HH22 1 1 16 13384 1 1 52 ARG N N -12.180 -4.318 -0.500 1.00 . A B . 52 ARG N 1 1 16 13385 1 1 52 ARG NE N -13.527 -0.805 1.917 1.00 . A B . 52 ARG NE 1 1 16 13386 1 1 52 ARG NH1 N -15.304 0.555 2.495 1.00 . A B . 52 ARG NH1 1 1 16 13387 1 1 52 ARG NH2 N -14.344 -0.818 4.069 1.00 . A B . 52 ARG NH2 1 1 16 13388 1 1 52 ARG O O -14.706 -3.492 -2.958 1.00 . A B . 52 ARG O 1 1 16 13389 1 1 53 MET C C -12.506 -5.854 -5.047 1.00 . A B . 53 MET C 1 1 16 13390 1 1 53 MET CA C -12.692 -4.408 -4.612 1.00 . A B . 53 MET CA 1 1 16 13391 1 1 53 MET CB C -11.621 -3.529 -5.262 1.00 . A B . 53 MET CB 1 1 16 13392 1 1 53 MET CE C -10.424 -1.491 -7.403 1.00 . A B . 53 MET CE 1 1 16 13393 1 1 53 MET CG C -11.869 -2.040 -5.093 1.00 . A B . 53 MET CG 1 1 16 13394 1 1 53 MET H H -11.791 -4.521 -2.699 1.00 . A B . 53 MET H 1 1 16 13395 1 1 53 MET HA H -13.666 -4.071 -4.926 1.00 . A B . 53 MET HA 1 1 16 13396 1 1 53 MET HB2 H -10.664 -3.764 -4.821 1.00 . A B . 53 MET HB2 1 1 16 13397 1 1 53 MET HB3 H -11.585 -3.750 -6.318 1.00 . A B . 53 MET HB3 1 1 16 13398 1 1 53 MET HE1 H -9.634 -0.941 -7.892 1.00 . A B . 53 MET HE1 1 1 16 13399 1 1 53 MET HE2 H -11.367 -1.261 -7.872 1.00 . A B . 53 MET HE2 1 1 16 13400 1 1 53 MET HE3 H -10.229 -2.549 -7.484 1.00 . A B . 53 MET HE3 1 1 16 13401 1 1 53 MET HG2 H -12.752 -1.772 -5.653 1.00 . A B . 53 MET HG2 1 1 16 13402 1 1 53 MET HG3 H -12.032 -1.835 -4.046 1.00 . A B . 53 MET HG3 1 1 16 13403 1 1 53 MET N N -12.630 -4.310 -3.157 1.00 . A B . 53 MET N 1 1 16 13404 1 1 53 MET O O -13.047 -6.293 -6.063 1.00 . A B . 53 MET O 1 1 16 13405 1 1 53 MET SD S -10.489 -1.028 -5.674 1.00 . A B . 53 MET SD 1 1 16 13406 1 1 54 LYS C C -11.617 -8.806 -3.264 1.00 . A B . 54 LYS C 1 1 16 13407 1 1 54 LYS CA C -11.443 -7.985 -4.536 1.00 . A B . 54 LYS CA 1 1 16 13408 1 1 54 LYS CB C -10.000 -8.134 -5.045 1.00 . A B . 54 LYS CB 1 1 16 13409 1 1 54 LYS CD C -8.206 -7.433 -6.654 1.00 . A B . 54 LYS CD 1 1 16 13410 1 1 54 LYS CE C -7.844 -6.569 -7.852 1.00 . A B . 54 LYS CE 1 1 16 13411 1 1 54 LYS CG C -9.682 -7.336 -6.304 1.00 . A B . 54 LYS CG 1 1 16 13412 1 1 54 LYS H H -11.368 -6.180 -3.446 1.00 . A B . 54 LYS H 1 1 16 13413 1 1 54 LYS HA H -12.132 -8.339 -5.288 1.00 . A B . 54 LYS HA 1 1 16 13414 1 1 54 LYS HB2 H -9.327 -7.812 -4.265 1.00 . A B . 54 LYS HB2 1 1 16 13415 1 1 54 LYS HB3 H -9.813 -9.180 -5.253 1.00 . A B . 54 LYS HB3 1 1 16 13416 1 1 54 LYS HD2 H -7.624 -7.109 -5.804 1.00 . A B . 54 LYS HD2 1 1 16 13417 1 1 54 LYS HD3 H -7.968 -8.462 -6.881 1.00 . A B . 54 LYS HD3 1 1 16 13418 1 1 54 LYS HE2 H -8.118 -5.546 -7.637 1.00 . A B . 54 LYS HE2 1 1 16 13419 1 1 54 LYS HE3 H -6.778 -6.626 -8.009 1.00 . A B . 54 LYS HE3 1 1 16 13420 1 1 54 LYS HG2 H -10.262 -7.729 -7.125 1.00 . A B . 54 LYS HG2 1 1 16 13421 1 1 54 LYS HG3 H -9.939 -6.300 -6.143 1.00 . A B . 54 LYS HG3 1 1 16 13422 1 1 54 LYS HZ1 H -8.324 -8.001 -9.294 1.00 . A B . 54 LYS HZ1 1 1 16 13423 1 1 54 LYS HZ2 H -8.226 -6.428 -9.899 1.00 . A B . 54 LYS HZ2 1 1 16 13424 1 1 54 LYS HZ3 H -9.569 -6.899 -8.986 1.00 . A B . 54 LYS HZ3 1 1 16 13425 1 1 54 LYS N N -11.741 -6.590 -4.258 1.00 . A B . 54 LYS N 1 1 16 13426 1 1 54 LYS NZ N -8.539 -7.004 -9.093 1.00 . A B . 54 LYS NZ 1 1 16 13427 1 1 54 LYS O O -10.655 -9.379 -2.747 1.00 . A B . 54 LYS O 1 1 16 13428 1 1 55 GLU C C -13.242 -11.026 -1.714 1.00 . A B . 55 GLU C 1 1 16 13429 1 1 55 GLU CA C -13.104 -9.526 -1.493 1.00 . A B . 55 GLU CA 1 1 16 13430 1 1 55 GLU CB C -14.360 -8.960 -0.831 1.00 . A B . 55 GLU CB 1 1 16 13431 1 1 55 GLU CD C -15.732 -8.750 1.269 1.00 . A B . 55 GLU CD 1 1 16 13432 1 1 55 GLU CG C -14.541 -9.405 0.610 1.00 . A B . 55 GLU CG 1 1 16 13433 1 1 55 GLU H H -13.577 -8.425 -3.238 1.00 . A B . 55 GLU H 1 1 16 13434 1 1 55 GLU HA H -12.262 -9.349 -0.843 1.00 . A B . 55 GLU HA 1 1 16 13435 1 1 55 GLU HB2 H -14.302 -7.883 -0.847 1.00 . A B . 55 GLU HB2 1 1 16 13436 1 1 55 GLU HB3 H -15.223 -9.275 -1.395 1.00 . A B . 55 GLU HB3 1 1 16 13437 1 1 55 GLU HG2 H -14.682 -10.476 0.628 1.00 . A B . 55 GLU HG2 1 1 16 13438 1 1 55 GLU HG3 H -13.653 -9.149 1.168 1.00 . A B . 55 GLU HG3 1 1 16 13439 1 1 55 GLU N N -12.838 -8.850 -2.753 1.00 . A B . 55 GLU N 1 1 16 13440 1 1 55 GLU O O -14.332 -11.535 -1.982 1.00 . A B . 55 GLU O 1 1 16 13441 1 1 55 GLU OE1 O -15.651 -7.548 1.594 1.00 . A B . 55 GLU OE1 1 1 16 13442 1 1 55 GLU OE2 O -16.758 -9.432 1.465 1.00 . A B . 55 GLU OE2 1 1 16 13443 1 1 56 SER C C -10.790 -13.701 -1.220 1.00 . A B . 56 SER C 1 1 16 13444 1 1 56 SER CA C -12.066 -13.146 -1.841 1.00 . A B . 56 SER CA 1 1 16 13445 1 1 56 SER CB C -12.110 -13.437 -3.346 1.00 . A B . 56 SER CB 1 1 16 13446 1 1 56 SER H H -11.297 -11.249 -1.363 1.00 . A B . 56 SER H 1 1 16 13447 1 1 56 SER HA H -12.921 -13.599 -1.363 1.00 . A B . 56 SER HA 1 1 16 13448 1 1 56 SER HB2 H -12.909 -12.868 -3.796 1.00 . A B . 56 SER HB2 1 1 16 13449 1 1 56 SER HB3 H -11.169 -13.148 -3.791 1.00 . A B . 56 SER HB3 1 1 16 13450 1 1 56 SER HG H -11.480 -15.252 -3.737 1.00 . A B . 56 SER HG 1 1 16 13451 1 1 56 SER N N -12.121 -11.718 -1.610 1.00 . A B . 56 SER N 1 1 16 13452 1 1 56 SER O O -10.863 -14.252 -0.103 1.00 . A B . 56 SER O 1 1 16 13453 1 1 56 SER OXT O -9.711 -13.546 -1.831 1.00 . A B . 56 SER OXT 1 1 16 13454 1 1 56 SER OG O -12.332 -14.815 -3.604 1.00 . A B . 56 SER OG 1 1 16 13455 2 2 1 ZN ZN ZN -7.134 -5.745 2.710 1.00 . B B . 101 ZN ZN 1 1 16 13456 3 2 1 ZN ZN ZN 5.534 1.253 -0.160 1.00 . C B . 102 ZN ZN 1 1 17 13457 1 1 1 GLY C C 16.405 -6.853 0.343 1.00 . A B . 1 GLY C 1 1 17 13458 1 1 1 GLY CA C 16.400 -7.784 1.538 1.00 . A B . 1 GLY CA 1 1 17 13459 1 1 1 GLY H1 H 18.250 -7.209 2.303 1.00 . A B . 1 GLY H1 1 1 17 13460 1 1 1 GLY H2 H 17.229 -7.923 3.445 1.00 . A B . 1 GLY H2 1 1 17 13461 1 1 1 GLY H3 H 16.945 -6.339 2.931 1.00 . A B . 1 GLY H3 1 1 17 13462 1 1 1 GLY HA2 H 16.755 -8.755 1.228 1.00 . A B . 1 GLY HA2 1 1 17 13463 1 1 1 GLY HA3 H 15.388 -7.880 1.906 1.00 . A B . 1 GLY HA3 1 1 17 13464 1 1 1 GLY N N 17.265 -7.280 2.632 1.00 . A B . 1 GLY N 1 1 17 13465 1 1 1 GLY O O 16.690 -5.662 0.477 1.00 . A B . 1 GLY O 1 1 17 13466 1 1 2 ALA C C 14.758 -6.834 -2.801 1.00 . A B . 2 ALA C 1 1 17 13467 1 1 2 ALA CA C 16.060 -6.596 -2.046 1.00 . A B . 2 ALA CA 1 1 17 13468 1 1 2 ALA CB C 17.261 -6.910 -2.930 1.00 . A B . 2 ALA CB 1 1 17 13469 1 1 2 ALA H H 15.901 -8.349 -0.876 1.00 . A B . 2 ALA H 1 1 17 13470 1 1 2 ALA HA H 16.112 -5.554 -1.764 1.00 . A B . 2 ALA HA 1 1 17 13471 1 1 2 ALA HB1 H 17.224 -7.947 -3.230 1.00 . A B . 2 ALA HB1 1 1 17 13472 1 1 2 ALA HB2 H 18.172 -6.727 -2.380 1.00 . A B . 2 ALA HB2 1 1 17 13473 1 1 2 ALA HB3 H 17.236 -6.281 -3.808 1.00 . A B . 2 ALA HB3 1 1 17 13474 1 1 2 ALA N N 16.101 -7.392 -0.829 1.00 . A B . 2 ALA N 1 1 17 13475 1 1 2 ALA O O 14.059 -5.890 -3.161 1.00 . A B . 2 ALA O 1 1 17 13476 1 1 3 MET C C 12.199 -9.045 -2.721 1.00 . A B . 3 MET C 1 1 17 13477 1 1 3 MET CA C 13.201 -8.474 -3.714 1.00 . A B . 3 MET CA 1 1 17 13478 1 1 3 MET CB C 13.476 -9.511 -4.805 1.00 . A B . 3 MET CB 1 1 17 13479 1 1 3 MET CE C 15.546 -11.536 -6.126 1.00 . A B . 3 MET CE 1 1 17 13480 1 1 3 MET CG C 14.398 -9.020 -5.910 1.00 . A B . 3 MET CG 1 1 17 13481 1 1 3 MET H H 15.048 -8.808 -2.732 1.00 . A B . 3 MET H 1 1 17 13482 1 1 3 MET HA H 12.785 -7.586 -4.163 1.00 . A B . 3 MET HA 1 1 17 13483 1 1 3 MET HB2 H 13.928 -10.381 -4.351 1.00 . A B . 3 MET HB2 1 1 17 13484 1 1 3 MET HB3 H 12.537 -9.800 -5.253 1.00 . A B . 3 MET HB3 1 1 17 13485 1 1 3 MET HE1 H 16.406 -11.101 -5.638 1.00 . A B . 3 MET HE1 1 1 17 13486 1 1 3 MET HE2 H 15.863 -12.358 -6.749 1.00 . A B . 3 MET HE2 1 1 17 13487 1 1 3 MET HE3 H 14.853 -11.897 -5.380 1.00 . A B . 3 MET HE3 1 1 17 13488 1 1 3 MET HG2 H 13.933 -8.180 -6.403 1.00 . A B . 3 MET HG2 1 1 17 13489 1 1 3 MET HG3 H 15.333 -8.704 -5.468 1.00 . A B . 3 MET HG3 1 1 17 13490 1 1 3 MET N N 14.436 -8.102 -3.029 1.00 . A B . 3 MET N 1 1 17 13491 1 1 3 MET O O 11.044 -9.304 -3.059 1.00 . A B . 3 MET O 1 1 17 13492 1 1 3 MET SD S 14.743 -10.295 -7.138 1.00 . A B . 3 MET SD 1 1 17 13493 1 1 4 GLY C C 12.393 -9.533 0.902 1.00 . A B . 4 GLY C 1 1 17 13494 1 1 4 GLY CA C 11.817 -9.803 -0.466 1.00 . A B . 4 GLY CA 1 1 17 13495 1 1 4 GLY H H 13.577 -8.984 -1.284 1.00 . A B . 4 GLY H 1 1 17 13496 1 1 4 GLY HA2 H 10.830 -9.366 -0.531 1.00 . A B . 4 GLY HA2 1 1 17 13497 1 1 4 GLY HA3 H 11.744 -10.869 -0.615 1.00 . A B . 4 GLY HA3 1 1 17 13498 1 1 4 GLY N N 12.655 -9.237 -1.498 1.00 . A B . 4 GLY N 1 1 17 13499 1 1 4 GLY O O 13.416 -8.851 1.004 1.00 . A B . 4 GLY O 1 1 17 13500 1 1 5 MET C C 12.146 -8.366 3.652 1.00 . A B . 5 MET C 1 1 17 13501 1 1 5 MET CA C 12.183 -9.853 3.320 1.00 . A B . 5 MET CA 1 1 17 13502 1 1 5 MET CB C 13.589 -10.423 3.563 1.00 . A B . 5 MET CB 1 1 17 13503 1 1 5 MET CE C 15.480 -12.112 5.552 1.00 . A B . 5 MET CE 1 1 17 13504 1 1 5 MET CG C 13.662 -11.938 3.454 1.00 . A B . 5 MET CG 1 1 17 13505 1 1 5 MET H H 10.956 -10.616 1.770 1.00 . A B . 5 MET H 1 1 17 13506 1 1 5 MET HA H 11.484 -10.364 3.966 1.00 . A B . 5 MET HA 1 1 17 13507 1 1 5 MET HB2 H 14.264 -9.998 2.836 1.00 . A B . 5 MET HB2 1 1 17 13508 1 1 5 MET HB3 H 13.915 -10.136 4.551 1.00 . A B . 5 MET HB3 1 1 17 13509 1 1 5 MET HE1 H 15.450 -11.035 5.631 1.00 . A B . 5 MET HE1 1 1 17 13510 1 1 5 MET HE2 H 16.425 -12.473 5.930 1.00 . A B . 5 MET HE2 1 1 17 13511 1 1 5 MET HE3 H 14.675 -12.538 6.132 1.00 . A B . 5 MET HE3 1 1 17 13512 1 1 5 MET HG2 H 12.952 -12.370 4.142 1.00 . A B . 5 MET HG2 1 1 17 13513 1 1 5 MET HG3 H 13.401 -12.228 2.447 1.00 . A B . 5 MET HG3 1 1 17 13514 1 1 5 MET N N 11.754 -10.070 1.938 1.00 . A B . 5 MET N 1 1 17 13515 1 1 5 MET O O 13.175 -7.687 3.628 1.00 . A B . 5 MET O 1 1 17 13516 1 1 5 MET SD S 15.300 -12.594 3.835 1.00 . A B . 5 MET SD 1 1 17 13517 1 1 6 ARG C C 11.023 -5.677 2.913 1.00 . A B . 6 ARG C 1 1 17 13518 1 1 6 ARG CA C 10.710 -6.455 4.185 1.00 . A B . 6 ARG CA 1 1 17 13519 1 1 6 ARG CB C 11.550 -5.930 5.353 1.00 . A B . 6 ARG CB 1 1 17 13520 1 1 6 ARG CD C 12.159 -6.090 7.784 1.00 . A B . 6 ARG CD 1 1 17 13521 1 1 6 ARG CG C 11.266 -6.625 6.676 1.00 . A B . 6 ARG CG 1 1 17 13522 1 1 6 ARG CZ C 14.553 -5.525 7.994 1.00 . A B . 6 ARG CZ 1 1 17 13523 1 1 6 ARG H H 10.191 -8.499 4.043 1.00 . A B . 6 ARG H 1 1 17 13524 1 1 6 ARG HA H 9.664 -6.327 4.418 1.00 . A B . 6 ARG HA 1 1 17 13525 1 1 6 ARG HB2 H 12.595 -6.069 5.118 1.00 . A B . 6 ARG HB2 1 1 17 13526 1 1 6 ARG HB3 H 11.354 -4.875 5.475 1.00 . A B . 6 ARG HB3 1 1 17 13527 1 1 6 ARG HD2 H 11.962 -5.036 7.910 1.00 . A B . 6 ARG HD2 1 1 17 13528 1 1 6 ARG HD3 H 11.927 -6.609 8.703 1.00 . A B . 6 ARG HD3 1 1 17 13529 1 1 6 ARG HE H 13.809 -6.984 6.841 1.00 . A B . 6 ARG HE 1 1 17 13530 1 1 6 ARG HG2 H 10.233 -6.460 6.945 1.00 . A B . 6 ARG HG2 1 1 17 13531 1 1 6 ARG HG3 H 11.445 -7.684 6.560 1.00 . A B . 6 ARG HG3 1 1 17 13532 1 1 6 ARG HH11 H 13.326 -4.423 9.175 1.00 . A B . 6 ARG HH11 1 1 17 13533 1 1 6 ARG HH12 H 15.006 -4.005 9.263 1.00 . A B . 6 ARG HH12 1 1 17 13534 1 1 6 ARG HH21 H 16.026 -6.452 6.951 1.00 . A B . 6 ARG HH21 1 1 17 13535 1 1 6 ARG HH22 H 16.550 -5.173 8.000 1.00 . A B . 6 ARG HH22 1 1 17 13536 1 1 6 ARG N N 10.946 -7.878 3.962 1.00 . A B . 6 ARG N 1 1 17 13537 1 1 6 ARG NE N 13.576 -6.271 7.479 1.00 . A B . 6 ARG NE 1 1 17 13538 1 1 6 ARG NH1 N 14.274 -4.577 8.883 1.00 . A B . 6 ARG NH1 1 1 17 13539 1 1 6 ARG NH2 N 15.810 -5.734 7.620 1.00 . A B . 6 ARG NH2 1 1 17 13540 1 1 6 ARG O O 11.971 -4.893 2.859 1.00 . A B . 6 ARG O 1 1 17 13541 1 1 7 ASN C C 9.793 -3.935 0.478 1.00 . A B . 7 ASN C 1 1 17 13542 1 1 7 ASN CA C 10.454 -5.306 0.581 1.00 . A B . 7 ASN CA 1 1 17 13543 1 1 7 ASN CB C 9.952 -6.231 -0.536 1.00 . A B . 7 ASN CB 1 1 17 13544 1 1 7 ASN CG C 10.125 -5.633 -1.926 1.00 . A B . 7 ASN CG 1 1 17 13545 1 1 7 ASN H H 9.437 -6.485 2.016 1.00 . A B . 7 ASN H 1 1 17 13546 1 1 7 ASN HA H 11.521 -5.178 0.471 1.00 . A B . 7 ASN HA 1 1 17 13547 1 1 7 ASN HB2 H 10.493 -7.163 -0.493 1.00 . A B . 7 ASN HB2 1 1 17 13548 1 1 7 ASN HB3 H 8.902 -6.425 -0.380 1.00 . A B . 7 ASN HB3 1 1 17 13549 1 1 7 ASN HD21 H 11.964 -6.366 -2.081 1.00 . A B . 7 ASN HD21 1 1 17 13550 1 1 7 ASN HD22 H 11.398 -5.469 -3.450 1.00 . A B . 7 ASN HD22 1 1 17 13551 1 1 7 ASN N N 10.219 -5.906 1.887 1.00 . A B . 7 ASN N 1 1 17 13552 1 1 7 ASN ND2 N 11.278 -5.845 -2.541 1.00 . A B . 7 ASN ND2 1 1 17 13553 1 1 7 ASN O O 8.638 -3.812 0.069 1.00 . A B . 7 ASN O 1 1 17 13554 1 1 7 ASN OD1 O 9.221 -4.981 -2.446 1.00 . A B . 7 ASN OD1 1 1 17 13555 1 1 8 LEU C C 11.299 -0.724 0.188 1.00 . A B . 8 LEU C 1 1 17 13556 1 1 8 LEU CA C 10.115 -1.535 0.690 1.00 . A B . 8 LEU CA 1 1 17 13557 1 1 8 LEU CB C 9.544 -0.917 1.974 1.00 . A B . 8 LEU CB 1 1 17 13558 1 1 8 LEU CD1 C 10.163 0.022 4.208 1.00 . A B . 8 LEU CD1 1 1 17 13559 1 1 8 LEU CD2 C 9.992 -2.439 3.916 1.00 . A B . 8 LEU CD2 1 1 17 13560 1 1 8 LEU CG C 10.374 -1.130 3.242 1.00 . A B . 8 LEU CG 1 1 17 13561 1 1 8 LEU H H 11.369 -3.097 1.360 1.00 . A B . 8 LEU H 1 1 17 13562 1 1 8 LEU HA H 9.351 -1.532 -0.071 1.00 . A B . 8 LEU HA 1 1 17 13563 1 1 8 LEU HB2 H 9.442 0.147 1.816 1.00 . A B . 8 LEU HB2 1 1 17 13564 1 1 8 LEU HB3 H 8.562 -1.331 2.140 1.00 . A B . 8 LEU HB3 1 1 17 13565 1 1 8 LEU HD11 H 9.110 0.122 4.425 1.00 . A B . 8 LEU HD11 1 1 17 13566 1 1 8 LEU HD12 H 10.528 0.936 3.764 1.00 . A B . 8 LEU HD12 1 1 17 13567 1 1 8 LEU HD13 H 10.703 -0.173 5.122 1.00 . A B . 8 LEU HD13 1 1 17 13568 1 1 8 LEU HD21 H 8.955 -2.402 4.212 1.00 . A B . 8 LEU HD21 1 1 17 13569 1 1 8 LEU HD22 H 10.611 -2.590 4.786 1.00 . A B . 8 LEU HD22 1 1 17 13570 1 1 8 LEU HD23 H 10.139 -3.254 3.222 1.00 . A B . 8 LEU HD23 1 1 17 13571 1 1 8 LEU HG H 11.421 -1.174 2.982 1.00 . A B . 8 LEU HG 1 1 17 13572 1 1 8 LEU N N 10.527 -2.916 0.890 1.00 . A B . 8 LEU N 1 1 17 13573 1 1 8 LEU O O 11.335 0.501 0.299 1.00 . A B . 8 LEU O 1 1 17 13574 1 1 9 ASP C C 13.335 -0.209 -2.216 1.00 . A B . 9 ASP C 1 1 17 13575 1 1 9 ASP CA C 13.505 -0.841 -0.846 1.00 . A B . 9 ASP CA 1 1 17 13576 1 1 9 ASP CB C 14.610 -1.896 -0.899 1.00 . A B . 9 ASP CB 1 1 17 13577 1 1 9 ASP CG C 14.949 -2.436 0.470 1.00 . A B . 9 ASP CG 1 1 17 13578 1 1 9 ASP H H 12.119 -2.399 -0.503 1.00 . A B . 9 ASP H 1 1 17 13579 1 1 9 ASP HA H 13.787 -0.075 -0.144 1.00 . A B . 9 ASP HA 1 1 17 13580 1 1 9 ASP HB2 H 14.285 -2.719 -1.518 1.00 . A B . 9 ASP HB2 1 1 17 13581 1 1 9 ASP HB3 H 15.499 -1.458 -1.325 1.00 . A B . 9 ASP HB3 1 1 17 13582 1 1 9 ASP N N 12.258 -1.437 -0.384 1.00 . A B . 9 ASP N 1 1 17 13583 1 1 9 ASP O O 13.886 0.853 -2.494 1.00 . A B . 9 ASP O 1 1 17 13584 1 1 9 ASP OD1 O 14.281 -3.388 0.918 1.00 . A B . 9 ASP OD1 1 1 17 13585 1 1 9 ASP OD2 O 15.877 -1.901 1.110 1.00 . A B . 9 ASP OD2 1 1 17 13586 1 1 10 GLU C C 11.126 0.578 -4.434 1.00 . A B . 10 GLU C 1 1 17 13587 1 1 10 GLU CA C 12.309 -0.379 -4.413 1.00 . A B . 10 GLU CA 1 1 17 13588 1 1 10 GLU CB C 12.057 -1.564 -5.343 1.00 . A B . 10 GLU CB 1 1 17 13589 1 1 10 GLU CD C 10.851 -3.755 -5.658 1.00 . A B . 10 GLU CD 1 1 17 13590 1 1 10 GLU CG C 10.904 -2.448 -4.903 1.00 . A B . 10 GLU CG 1 1 17 13591 1 1 10 GLU H H 12.108 -1.679 -2.762 1.00 . A B . 10 GLU H 1 1 17 13592 1 1 10 GLU HA H 13.191 0.147 -4.740 1.00 . A B . 10 GLU HA 1 1 17 13593 1 1 10 GLU HB2 H 11.839 -1.191 -6.333 1.00 . A B . 10 GLU HB2 1 1 17 13594 1 1 10 GLU HB3 H 12.950 -2.170 -5.385 1.00 . A B . 10 GLU HB3 1 1 17 13595 1 1 10 GLU HG2 H 11.013 -2.661 -3.851 1.00 . A B . 10 GLU HG2 1 1 17 13596 1 1 10 GLU HG3 H 9.978 -1.916 -5.065 1.00 . A B . 10 GLU HG3 1 1 17 13597 1 1 10 GLU N N 12.547 -0.857 -3.058 1.00 . A B . 10 GLU N 1 1 17 13598 1 1 10 GLU O O 10.686 1.033 -5.487 1.00 . A B . 10 GLU O 1 1 17 13599 1 1 10 GLU OE1 O 10.354 -3.764 -6.804 1.00 . A B . 10 GLU OE1 1 1 17 13600 1 1 10 GLU OE2 O 11.285 -4.785 -5.104 1.00 . A B . 10 GLU OE2 1 1 17 13601 1 1 11 CYS C C 9.919 3.117 -2.630 1.00 . A B . 11 CYS C 1 1 17 13602 1 1 11 CYS CA C 9.478 1.735 -3.096 1.00 . A B . 11 CYS CA 1 1 17 13603 1 1 11 CYS CB C 8.533 1.094 -2.088 1.00 . A B . 11 CYS CB 1 1 17 13604 1 1 11 CYS H H 11.075 0.537 -2.451 1.00 . A B . 11 CYS H 1 1 17 13605 1 1 11 CYS HA H 8.985 1.820 -4.051 1.00 . A B . 11 CYS HA 1 1 17 13606 1 1 11 CYS HB2 H 8.357 0.076 -2.383 1.00 . A B . 11 CYS HB2 1 1 17 13607 1 1 11 CYS HB3 H 9.010 1.097 -1.119 1.00 . A B . 11 CYS HB3 1 1 17 13608 1 1 11 CYS N N 10.630 0.882 -3.250 1.00 . A B . 11 CYS N 1 1 17 13609 1 1 11 CYS O O 10.075 3.360 -1.430 1.00 . A B . 11 CYS O 1 1 17 13610 1 1 11 CYS SG S 6.919 1.883 -1.900 1.00 . A B . 11 CYS SG 1 1 17 13611 1 1 12 GLU C C 9.521 6.128 -2.496 1.00 . A B . 12 GLU C 1 1 17 13612 1 1 12 GLU CA C 10.575 5.365 -3.278 1.00 . A B . 12 GLU CA 1 1 17 13613 1 1 12 GLU CB C 10.925 6.127 -4.553 1.00 . A B . 12 GLU CB 1 1 17 13614 1 1 12 GLU CD C 13.400 5.627 -4.401 1.00 . A B . 12 GLU CD 1 1 17 13615 1 1 12 GLU CG C 12.156 5.592 -5.269 1.00 . A B . 12 GLU CG 1 1 17 13616 1 1 12 GLU H H 9.964 3.765 -4.516 1.00 . A B . 12 GLU H 1 1 17 13617 1 1 12 GLU HA H 11.461 5.286 -2.666 1.00 . A B . 12 GLU HA 1 1 17 13618 1 1 12 GLU HB2 H 10.085 6.071 -5.230 1.00 . A B . 12 GLU HB2 1 1 17 13619 1 1 12 GLU HB3 H 11.104 7.161 -4.301 1.00 . A B . 12 GLU HB3 1 1 17 13620 1 1 12 GLU HG2 H 11.972 4.571 -5.564 1.00 . A B . 12 GLU HG2 1 1 17 13621 1 1 12 GLU HG3 H 12.332 6.193 -6.148 1.00 . A B . 12 GLU HG3 1 1 17 13622 1 1 12 GLU N N 10.124 4.015 -3.581 1.00 . A B . 12 GLU N 1 1 17 13623 1 1 12 GLU O O 9.841 7.039 -1.734 1.00 . A B . 12 GLU O 1 1 17 13624 1 1 12 GLU OE1 O 14.037 6.697 -4.306 1.00 . A B . 12 GLU OE1 1 1 17 13625 1 1 12 GLU OE2 O 13.748 4.585 -3.812 1.00 . A B . 12 GLU OE2 1 1 17 13626 1 1 13 VAL C C 7.231 6.008 -0.463 1.00 . A B . 13 VAL C 1 1 17 13627 1 1 13 VAL CA C 7.192 6.401 -1.944 1.00 . A B . 13 VAL CA 1 1 17 13628 1 1 13 VAL CB C 5.807 6.119 -2.579 1.00 . A B . 13 VAL CB 1 1 17 13629 1 1 13 VAL CG1 C 5.537 4.636 -2.698 1.00 . A B . 13 VAL CG1 1 1 17 13630 1 1 13 VAL CG2 C 4.700 6.793 -1.790 1.00 . A B . 13 VAL CG2 1 1 17 13631 1 1 13 VAL H H 8.049 5.034 -3.305 1.00 . A B . 13 VAL H 1 1 17 13632 1 1 13 VAL HA H 7.372 7.464 -2.010 1.00 . A B . 13 VAL HA 1 1 17 13633 1 1 13 VAL HB H 5.807 6.533 -3.575 1.00 . A B . 13 VAL HB 1 1 17 13634 1 1 13 VAL HG11 H 5.473 4.200 -1.712 1.00 . A B . 13 VAL HG11 1 1 17 13635 1 1 13 VAL HG12 H 6.336 4.165 -3.249 1.00 . A B . 13 VAL HG12 1 1 17 13636 1 1 13 VAL HG13 H 4.605 4.483 -3.219 1.00 . A B . 13 VAL HG13 1 1 17 13637 1 1 13 VAL HG21 H 4.640 6.344 -0.810 1.00 . A B . 13 VAL HG21 1 1 17 13638 1 1 13 VAL HG22 H 3.760 6.663 -2.304 1.00 . A B . 13 VAL HG22 1 1 17 13639 1 1 13 VAL HG23 H 4.916 7.844 -1.692 1.00 . A B . 13 VAL HG23 1 1 17 13640 1 1 13 VAL N N 8.264 5.753 -2.671 1.00 . A B . 13 VAL N 1 1 17 13641 1 1 13 VAL O O 6.946 6.829 0.404 1.00 . A B . 13 VAL O 1 1 17 13642 1 1 14 CYS C C 9.006 5.203 1.805 1.00 . A B . 14 CYS C 1 1 17 13643 1 1 14 CYS CA C 7.877 4.364 1.221 1.00 . A B . 14 CYS CA 1 1 17 13644 1 1 14 CYS CB C 8.248 2.881 1.319 1.00 . A B . 14 CYS CB 1 1 17 13645 1 1 14 CYS H H 7.750 4.116 -0.891 1.00 . A B . 14 CYS H 1 1 17 13646 1 1 14 CYS HA H 6.976 4.544 1.786 1.00 . A B . 14 CYS HA 1 1 17 13647 1 1 14 CYS HB2 H 8.604 2.548 0.357 1.00 . A B . 14 CYS HB2 1 1 17 13648 1 1 14 CYS HB3 H 9.038 2.770 2.044 1.00 . A B . 14 CYS HB3 1 1 17 13649 1 1 14 CYS N N 7.629 4.767 -0.168 1.00 . A B . 14 CYS N 1 1 17 13650 1 1 14 CYS O O 8.999 5.552 2.984 1.00 . A B . 14 CYS O 1 1 17 13651 1 1 14 CYS SG S 6.890 1.786 1.806 1.00 . A B . 14 CYS SG 1 1 17 13652 1 1 15 ARG C C 10.671 7.763 1.679 1.00 . A B . 15 ARG C 1 1 17 13653 1 1 15 ARG CA C 11.109 6.341 1.337 1.00 . A B . 15 ARG CA 1 1 17 13654 1 1 15 ARG CB C 12.123 6.350 0.193 1.00 . A B . 15 ARG CB 1 1 17 13655 1 1 15 ARG CD C 14.246 7.234 -0.787 1.00 . A B . 15 ARG CD 1 1 17 13656 1 1 15 ARG CG C 13.353 7.203 0.441 1.00 . A B . 15 ARG CG 1 1 17 13657 1 1 15 ARG CZ C 16.411 8.176 -1.491 1.00 . A B . 15 ARG CZ 1 1 17 13658 1 1 15 ARG H H 9.884 5.223 0.022 1.00 . A B . 15 ARG H 1 1 17 13659 1 1 15 ARG HA H 11.557 5.891 2.206 1.00 . A B . 15 ARG HA 1 1 17 13660 1 1 15 ARG HB2 H 12.450 5.337 0.014 1.00 . A B . 15 ARG HB2 1 1 17 13661 1 1 15 ARG HB3 H 11.632 6.719 -0.697 1.00 . A B . 15 ARG HB3 1 1 17 13662 1 1 15 ARG HD2 H 14.522 6.221 -1.040 1.00 . A B . 15 ARG HD2 1 1 17 13663 1 1 15 ARG HD3 H 13.692 7.668 -1.607 1.00 . A B . 15 ARG HD3 1 1 17 13664 1 1 15 ARG HE H 15.581 8.422 0.317 1.00 . A B . 15 ARG HE 1 1 17 13665 1 1 15 ARG HG2 H 13.040 8.209 0.675 1.00 . A B . 15 ARG HG2 1 1 17 13666 1 1 15 ARG HG3 H 13.908 6.790 1.271 1.00 . A B . 15 ARG HG3 1 1 17 13667 1 1 15 ARG HH11 H 15.413 7.184 -2.965 1.00 . A B . 15 ARG HH11 1 1 17 13668 1 1 15 ARG HH12 H 16.976 7.799 -3.407 1.00 . A B . 15 ARG HH12 1 1 17 13669 1 1 15 ARG HH21 H 17.628 9.245 -0.275 1.00 . A B . 15 ARG HH21 1 1 17 13670 1 1 15 ARG HH22 H 18.230 8.979 -1.876 1.00 . A B . 15 ARG HH22 1 1 17 13671 1 1 15 ARG N N 9.961 5.534 0.949 1.00 . A B . 15 ARG N 1 1 17 13672 1 1 15 ARG NE N 15.461 8.012 -0.571 1.00 . A B . 15 ARG NE 1 1 17 13673 1 1 15 ARG NH1 N 16.254 7.682 -2.719 1.00 . A B . 15 ARG NH1 1 1 17 13674 1 1 15 ARG NH2 N 17.510 8.854 -1.191 1.00 . A B . 15 ARG NH2 1 1 17 13675 1 1 15 ARG O O 11.185 8.373 2.613 1.00 . A B . 15 ARG O 1 1 17 13676 1 1 16 ASP C C 8.180 9.580 2.377 1.00 . A B . 16 ASP C 1 1 17 13677 1 1 16 ASP CA C 9.136 9.597 1.190 1.00 . A B . 16 ASP CA 1 1 17 13678 1 1 16 ASP CB C 8.409 10.144 -0.043 1.00 . A B . 16 ASP CB 1 1 17 13679 1 1 16 ASP CG C 9.342 10.844 -1.009 1.00 . A B . 16 ASP CG 1 1 17 13680 1 1 16 ASP H H 9.408 7.771 0.136 1.00 . A B . 16 ASP H 1 1 17 13681 1 1 16 ASP HA H 9.956 10.256 1.427 1.00 . A B . 16 ASP HA 1 1 17 13682 1 1 16 ASP HB2 H 7.932 9.325 -0.562 1.00 . A B . 16 ASP HB2 1 1 17 13683 1 1 16 ASP HB3 H 7.656 10.849 0.276 1.00 . A B . 16 ASP HB3 1 1 17 13684 1 1 16 ASP N N 9.703 8.274 0.925 1.00 . A B . 16 ASP N 1 1 17 13685 1 1 16 ASP O O 7.684 10.624 2.798 1.00 . A B . 16 ASP O 1 1 17 13686 1 1 16 ASP OD1 O 10.022 11.805 -0.591 1.00 . A B . 16 ASP OD1 1 1 17 13687 1 1 16 ASP OD2 O 9.406 10.441 -2.189 1.00 . A B . 16 ASP OD2 1 1 17 13688 1 1 17 GLY C C 5.587 8.138 3.639 1.00 . A B . 17 GLY C 1 1 17 13689 1 1 17 GLY CA C 7.037 8.281 4.056 1.00 . A B . 17 GLY CA 1 1 17 13690 1 1 17 GLY H H 8.379 7.602 2.563 1.00 . A B . 17 GLY H 1 1 17 13691 1 1 17 GLY HA2 H 7.321 7.415 4.637 1.00 . A B . 17 GLY HA2 1 1 17 13692 1 1 17 GLY HA3 H 7.137 9.164 4.671 1.00 . A B . 17 GLY HA3 1 1 17 13693 1 1 17 GLY N N 7.933 8.398 2.922 1.00 . A B . 17 GLY N 1 1 17 13694 1 1 17 GLY O O 4.681 8.576 4.353 1.00 . A B . 17 GLY O 1 1 17 13695 1 1 18 GLY C C 3.275 6.314 2.903 1.00 . A B . 18 GLY C 1 1 17 13696 1 1 18 GLY CA C 4.021 7.285 2.010 1.00 . A B . 18 GLY CA 1 1 17 13697 1 1 18 GLY H H 6.134 7.290 1.915 1.00 . A B . 18 GLY H 1 1 17 13698 1 1 18 GLY HA2 H 3.478 8.217 1.979 1.00 . A B . 18 GLY HA2 1 1 17 13699 1 1 18 GLY HA3 H 4.068 6.875 1.015 1.00 . A B . 18 GLY HA3 1 1 17 13700 1 1 18 GLY N N 5.368 7.541 2.477 1.00 . A B . 18 GLY N 1 1 17 13701 1 1 18 GLY O O 3.873 5.406 3.488 1.00 . A B . 18 GLY O 1 1 17 13702 1 1 19 GLU C C 0.515 4.532 3.023 1.00 . A B . 19 GLU C 1 1 17 13703 1 1 19 GLU CA C 1.125 5.664 3.839 1.00 . A B . 19 GLU CA 1 1 17 13704 1 1 19 GLU CB C 0.017 6.503 4.484 1.00 . A B . 19 GLU CB 1 1 17 13705 1 1 19 GLU CD C 1.006 6.570 6.811 1.00 . A B . 19 GLU CD 1 1 17 13706 1 1 19 GLU CG C 0.496 7.378 5.635 1.00 . A B . 19 GLU CG 1 1 17 13707 1 1 19 GLU H H 1.562 7.230 2.489 1.00 . A B . 19 GLU H 1 1 17 13708 1 1 19 GLU HA H 1.743 5.240 4.616 1.00 . A B . 19 GLU HA 1 1 17 13709 1 1 19 GLU HB2 H -0.412 7.145 3.729 1.00 . A B . 19 GLU HB2 1 1 17 13710 1 1 19 GLU HB3 H -0.751 5.839 4.857 1.00 . A B . 19 GLU HB3 1 1 17 13711 1 1 19 GLU HG2 H 1.297 8.008 5.281 1.00 . A B . 19 GLU HG2 1 1 17 13712 1 1 19 GLU HG3 H -0.325 7.997 5.970 1.00 . A B . 19 GLU HG3 1 1 17 13713 1 1 19 GLU N N 1.970 6.506 3.003 1.00 . A B . 19 GLU N 1 1 17 13714 1 1 19 GLU O O 0.309 4.662 1.814 1.00 . A B . 19 GLU O 1 1 17 13715 1 1 19 GLU OE1 O 0.193 5.875 7.459 1.00 . A B . 19 GLU OE1 1 1 17 13716 1 1 19 GLU OE2 O 2.223 6.622 7.098 1.00 . A B . 19 GLU OE2 1 1 17 13717 1 1 20 LEU C C -1.857 2.221 3.260 1.00 . A B . 20 LEU C 1 1 17 13718 1 1 20 LEU CA C -0.350 2.258 3.050 1.00 . A B . 20 LEU CA 1 1 17 13719 1 1 20 LEU CB C 0.274 0.977 3.604 1.00 . A B . 20 LEU CB 1 1 17 13720 1 1 20 LEU CD1 C 2.310 -0.450 3.881 1.00 . A B . 20 LEU CD1 1 1 17 13721 1 1 20 LEU CD2 C 1.473 0.079 1.595 1.00 . A B . 20 LEU CD2 1 1 17 13722 1 1 20 LEU CG C 1.635 0.600 3.016 1.00 . A B . 20 LEU CG 1 1 17 13723 1 1 20 LEU H H 0.404 3.400 4.660 1.00 . A B . 20 LEU H 1 1 17 13724 1 1 20 LEU HA H -0.142 2.322 1.993 1.00 . A B . 20 LEU HA 1 1 17 13725 1 1 20 LEU HB2 H 0.389 1.094 4.672 1.00 . A B . 20 LEU HB2 1 1 17 13726 1 1 20 LEU HB3 H -0.411 0.163 3.420 1.00 . A B . 20 LEU HB3 1 1 17 13727 1 1 20 LEU HD11 H 1.662 -1.307 3.977 1.00 . A B . 20 LEU HD11 1 1 17 13728 1 1 20 LEU HD12 H 2.506 -0.038 4.859 1.00 . A B . 20 LEU HD12 1 1 17 13729 1 1 20 LEU HD13 H 3.240 -0.750 3.423 1.00 . A B . 20 LEU HD13 1 1 17 13730 1 1 20 LEU HD21 H 0.788 -0.755 1.593 1.00 . A B . 20 LEU HD21 1 1 17 13731 1 1 20 LEU HD22 H 2.435 -0.245 1.221 1.00 . A B . 20 LEU HD22 1 1 17 13732 1 1 20 LEU HD23 H 1.088 0.865 0.960 1.00 . A B . 20 LEU HD23 1 1 17 13733 1 1 20 LEU HG H 2.269 1.478 2.988 1.00 . A B . 20 LEU HG 1 1 17 13734 1 1 20 LEU N N 0.232 3.426 3.694 1.00 . A B . 20 LEU N 1 1 17 13735 1 1 20 LEU O O -2.343 2.466 4.364 1.00 . A B . 20 LEU O 1 1 17 13736 1 1 21 PHE C C -4.519 0.417 2.008 1.00 . A B . 21 PHE C 1 1 17 13737 1 1 21 PHE CA C -4.044 1.839 2.274 1.00 . A B . 21 PHE CA 1 1 17 13738 1 1 21 PHE CB C -4.662 2.822 1.278 1.00 . A B . 21 PHE CB 1 1 17 13739 1 1 21 PHE CD1 C -5.085 4.962 2.533 1.00 . A B . 21 PHE CD1 1 1 17 13740 1 1 21 PHE CD2 C -3.285 4.889 0.968 1.00 . A B . 21 PHE CD2 1 1 17 13741 1 1 21 PHE CE1 C -4.795 6.284 2.807 1.00 . A B . 21 PHE CE1 1 1 17 13742 1 1 21 PHE CE2 C -2.990 6.205 1.243 1.00 . A B . 21 PHE CE2 1 1 17 13743 1 1 21 PHE CG C -4.333 4.249 1.609 1.00 . A B . 21 PHE CG 1 1 17 13744 1 1 21 PHE CZ C -3.700 6.867 2.285 1.00 . A B . 21 PHE CZ 1 1 17 13745 1 1 21 PHE H H -2.145 1.734 1.342 1.00 . A B . 21 PHE H 1 1 17 13746 1 1 21 PHE HA H -4.336 2.122 3.278 1.00 . A B . 21 PHE HA 1 1 17 13747 1 1 21 PHE HB2 H -4.285 2.609 0.286 1.00 . A B . 21 PHE HB2 1 1 17 13748 1 1 21 PHE HB3 H -5.738 2.712 1.284 1.00 . A B . 21 PHE HB3 1 1 17 13749 1 1 21 PHE HD1 H -5.905 4.477 3.042 1.00 . A B . 21 PHE HD1 1 1 17 13750 1 1 21 PHE HD2 H -2.689 4.347 0.249 1.00 . A B . 21 PHE HD2 1 1 17 13751 1 1 21 PHE HE1 H -5.388 6.830 3.527 1.00 . A B . 21 PHE HE1 1 1 17 13752 1 1 21 PHE HE2 H -2.170 6.685 0.735 1.00 . A B . 21 PHE HE2 1 1 17 13753 1 1 21 PHE HZ H -3.454 7.885 2.550 1.00 . A B . 21 PHE HZ 1 1 17 13754 1 1 21 PHE N N -2.591 1.912 2.202 1.00 . A B . 21 PHE N 1 1 17 13755 1 1 21 PHE O O -5.492 0.188 1.289 1.00 . A B . 21 PHE O 1 1 17 13756 1 1 22 CYS C C -3.893 -2.719 3.707 1.00 . A B . 22 CYS C 1 1 17 13757 1 1 22 CYS CA C -4.114 -1.943 2.407 1.00 . A B . 22 CYS CA 1 1 17 13758 1 1 22 CYS CB C -3.241 -2.517 1.289 1.00 . A B . 22 CYS CB 1 1 17 13759 1 1 22 CYS H H -3.012 -0.284 3.101 1.00 . A B . 22 CYS H 1 1 17 13760 1 1 22 CYS HA H -5.150 -2.022 2.120 1.00 . A B . 22 CYS HA 1 1 17 13761 1 1 22 CYS HB2 H -2.228 -2.156 1.419 1.00 . A B . 22 CYS HB2 1 1 17 13762 1 1 22 CYS HB3 H -3.241 -3.592 1.351 1.00 . A B . 22 CYS HB3 1 1 17 13763 1 1 22 CYS N N -3.802 -0.536 2.579 1.00 . A B . 22 CYS N 1 1 17 13764 1 1 22 CYS O O -3.249 -2.220 4.632 1.00 . A B . 22 CYS O 1 1 17 13765 1 1 22 CYS SG S -3.768 -2.056 -0.392 1.00 . A B . 22 CYS SG 1 1 17 13766 1 1 23 CYS C C -2.732 -5.254 4.885 1.00 . A B . 23 CYS C 1 1 17 13767 1 1 23 CYS CA C -4.194 -4.834 4.901 1.00 . A B . 23 CYS CA 1 1 17 13768 1 1 23 CYS CB C -5.065 -6.094 4.806 1.00 . A B . 23 CYS CB 1 1 17 13769 1 1 23 CYS H H -5.027 -4.228 3.052 1.00 . A B . 23 CYS H 1 1 17 13770 1 1 23 CYS HA H -4.411 -4.305 5.820 1.00 . A B . 23 CYS HA 1 1 17 13771 1 1 23 CYS HB2 H -4.674 -6.731 4.026 1.00 . A B . 23 CYS HB2 1 1 17 13772 1 1 23 CYS HB3 H -5.022 -6.623 5.749 1.00 . A B . 23 CYS HB3 1 1 17 13773 1 1 23 CYS N N -4.447 -3.934 3.775 1.00 . A B . 23 CYS N 1 1 17 13774 1 1 23 CYS O O -2.098 -5.160 3.842 1.00 . A B . 23 CYS O 1 1 17 13775 1 1 23 CYS SG S -6.800 -5.786 4.430 1.00 . A B . 23 CYS SG 1 1 17 13776 1 1 24 ASP C C -0.513 -7.167 4.941 1.00 . A B . 24 ASP C 1 1 17 13777 1 1 24 ASP CA C -0.803 -6.163 6.057 1.00 . A B . 24 ASP CA 1 1 17 13778 1 1 24 ASP CB C -0.478 -6.777 7.424 1.00 . A B . 24 ASP CB 1 1 17 13779 1 1 24 ASP CG C -0.620 -5.778 8.558 1.00 . A B . 24 ASP CG 1 1 17 13780 1 1 24 ASP H H -2.743 -5.756 6.823 1.00 . A B . 24 ASP H 1 1 17 13781 1 1 24 ASP HA H -0.179 -5.294 5.909 1.00 . A B . 24 ASP HA 1 1 17 13782 1 1 24 ASP HB2 H -1.150 -7.601 7.609 1.00 . A B . 24 ASP HB2 1 1 17 13783 1 1 24 ASP HB3 H 0.538 -7.142 7.416 1.00 . A B . 24 ASP HB3 1 1 17 13784 1 1 24 ASP N N -2.200 -5.721 6.006 1.00 . A B . 24 ASP N 1 1 17 13785 1 1 24 ASP O O 0.476 -7.038 4.215 1.00 . A B . 24 ASP O 1 1 17 13786 1 1 24 ASP OD1 O 0.350 -5.037 8.829 1.00 . A B . 24 ASP OD1 1 1 17 13787 1 1 24 ASP OD2 O -1.699 -5.731 9.185 1.00 . A B . 24 ASP OD2 1 1 17 13788 1 1 25 THR C C -1.390 -8.472 2.350 1.00 . A B . 25 THR C 1 1 17 13789 1 1 25 THR CA C -1.282 -9.133 3.729 1.00 . A B . 25 THR CA 1 1 17 13790 1 1 25 THR CB C -2.370 -10.214 3.863 1.00 . A B . 25 THR CB 1 1 17 13791 1 1 25 THR CG2 C -2.188 -11.312 2.822 1.00 . A B . 25 THR CG2 1 1 17 13792 1 1 25 THR H H -2.123 -8.229 5.448 1.00 . A B . 25 THR H 1 1 17 13793 1 1 25 THR HA H -0.316 -9.610 3.814 1.00 . A B . 25 THR HA 1 1 17 13794 1 1 25 THR HB H -3.334 -9.753 3.714 1.00 . A B . 25 THR HB 1 1 17 13795 1 1 25 THR HG1 H -3.027 -10.403 5.718 1.00 . A B . 25 THR HG1 1 1 17 13796 1 1 25 THR HG21 H -1.226 -11.784 2.961 1.00 . A B . 25 THR HG21 1 1 17 13797 1 1 25 THR HG22 H -2.238 -10.882 1.834 1.00 . A B . 25 THR HG22 1 1 17 13798 1 1 25 THR HG23 H -2.970 -12.048 2.935 1.00 . A B . 25 THR HG23 1 1 17 13799 1 1 25 THR N N -1.393 -8.149 4.797 1.00 . A B . 25 THR N 1 1 17 13800 1 1 25 THR O O -0.560 -8.709 1.474 1.00 . A B . 25 THR O 1 1 17 13801 1 1 25 THR OG1 O -2.326 -10.786 5.177 1.00 . A B . 25 THR OG1 1 1 17 13802 1 1 26 CYS C C -1.476 -6.055 0.507 1.00 . A B . 26 CYS C 1 1 17 13803 1 1 26 CYS CA C -2.642 -6.974 0.889 1.00 . A B . 26 CYS CA 1 1 17 13804 1 1 26 CYS CB C -3.956 -6.179 0.924 1.00 . A B . 26 CYS CB 1 1 17 13805 1 1 26 CYS H H -2.981 -7.414 2.935 1.00 . A B . 26 CYS H 1 1 17 13806 1 1 26 CYS HA H -2.724 -7.754 0.144 1.00 . A B . 26 CYS HA 1 1 17 13807 1 1 26 CYS HB2 H -3.914 -5.472 1.735 1.00 . A B . 26 CYS HB2 1 1 17 13808 1 1 26 CYS HB3 H -4.073 -5.648 -0.010 1.00 . A B . 26 CYS HB3 1 1 17 13809 1 1 26 CYS N N -2.399 -7.622 2.177 1.00 . A B . 26 CYS N 1 1 17 13810 1 1 26 CYS O O -1.058 -6.017 -0.648 1.00 . A B . 26 CYS O 1 1 17 13811 1 1 26 CYS SG S -5.437 -7.187 1.173 1.00 . A B . 26 CYS SG 1 1 17 13812 1 1 27 SER C C 1.443 -5.123 0.900 1.00 . A B . 27 SER C 1 1 17 13813 1 1 27 SER CA C 0.151 -4.402 1.275 1.00 . A B . 27 SER CA 1 1 17 13814 1 1 27 SER CB C 0.389 -3.561 2.527 1.00 . A B . 27 SER CB 1 1 17 13815 1 1 27 SER H H -1.330 -5.424 2.395 1.00 . A B . 27 SER H 1 1 17 13816 1 1 27 SER HA H -0.127 -3.749 0.463 1.00 . A B . 27 SER HA 1 1 17 13817 1 1 27 SER HB2 H 0.652 -4.210 3.348 1.00 . A B . 27 SER HB2 1 1 17 13818 1 1 27 SER HB3 H 1.197 -2.870 2.341 1.00 . A B . 27 SER HB3 1 1 17 13819 1 1 27 SER HG H -0.721 -2.599 3.820 1.00 . A B . 27 SER HG 1 1 17 13820 1 1 27 SER N N -0.950 -5.336 1.492 1.00 . A B . 27 SER N 1 1 17 13821 1 1 27 SER O O 2.334 -4.530 0.304 1.00 . A B . 27 SER O 1 1 17 13822 1 1 27 SER OG O -0.767 -2.826 2.885 1.00 . A B . 27 SER OG 1 1 17 13823 1 1 28 ARG C C 2.643 -7.710 -0.480 1.00 . A B . 28 ARG C 1 1 17 13824 1 1 28 ARG CA C 2.742 -7.158 0.941 1.00 . A B . 28 ARG CA 1 1 17 13825 1 1 28 ARG CB C 2.926 -8.291 1.952 1.00 . A B . 28 ARG CB 1 1 17 13826 1 1 28 ARG CD C 4.336 -10.183 2.806 1.00 . A B . 28 ARG CD 1 1 17 13827 1 1 28 ARG CG C 4.233 -9.055 1.794 1.00 . A B . 28 ARG CG 1 1 17 13828 1 1 28 ARG CZ C 2.405 -11.527 3.563 1.00 . A B . 28 ARG CZ 1 1 17 13829 1 1 28 ARG H H 0.841 -6.806 1.796 1.00 . A B . 28 ARG H 1 1 17 13830 1 1 28 ARG HA H 3.592 -6.495 0.996 1.00 . A B . 28 ARG HA 1 1 17 13831 1 1 28 ARG HB2 H 2.898 -7.874 2.948 1.00 . A B . 28 ARG HB2 1 1 17 13832 1 1 28 ARG HB3 H 2.111 -8.990 1.843 1.00 . A B . 28 ARG HB3 1 1 17 13833 1 1 28 ARG HD2 H 5.296 -10.667 2.693 1.00 . A B . 28 ARG HD2 1 1 17 13834 1 1 28 ARG HD3 H 4.258 -9.766 3.798 1.00 . A B . 28 ARG HD3 1 1 17 13835 1 1 28 ARG HE H 3.221 -11.607 1.736 1.00 . A B . 28 ARG HE 1 1 17 13836 1 1 28 ARG HG2 H 4.277 -9.472 0.799 1.00 . A B . 28 ARG HG2 1 1 17 13837 1 1 28 ARG HG3 H 5.058 -8.374 1.939 1.00 . A B . 28 ARG HG3 1 1 17 13838 1 1 28 ARG HH11 H 3.119 -10.247 4.968 1.00 . A B . 28 ARG HH11 1 1 17 13839 1 1 28 ARG HH12 H 1.779 -11.228 5.471 1.00 . A B . 28 ARG HH12 1 1 17 13840 1 1 28 ARG HH21 H 1.454 -12.887 2.396 1.00 . A B . 28 ARG HH21 1 1 17 13841 1 1 28 ARG HH22 H 0.822 -12.713 4.005 1.00 . A B . 28 ARG HH22 1 1 17 13842 1 1 28 ARG N N 1.556 -6.388 1.270 1.00 . A B . 28 ARG N 1 1 17 13843 1 1 28 ARG NE N 3.279 -11.174 2.621 1.00 . A B . 28 ARG NE 1 1 17 13844 1 1 28 ARG NH1 N 2.437 -10.953 4.762 1.00 . A B . 28 ARG NH1 1 1 17 13845 1 1 28 ARG NH2 N 1.488 -12.450 3.302 1.00 . A B . 28 ARG NH2 1 1 17 13846 1 1 28 ARG O O 3.652 -7.961 -1.134 1.00 . A B . 28 ARG O 1 1 17 13847 1 1 29 VAL C C 1.060 -7.308 -3.327 1.00 . A B . 29 VAL C 1 1 17 13848 1 1 29 VAL CA C 1.188 -8.422 -2.289 1.00 . A B . 29 VAL CA 1 1 17 13849 1 1 29 VAL CB C -0.076 -9.308 -2.326 1.00 . A B . 29 VAL CB 1 1 17 13850 1 1 29 VAL CG1 C -0.284 -9.900 -3.711 1.00 . A B . 29 VAL CG1 1 1 17 13851 1 1 29 VAL CG2 C 0.015 -10.416 -1.290 1.00 . A B . 29 VAL CG2 1 1 17 13852 1 1 29 VAL H H 0.654 -7.607 -0.405 1.00 . A B . 29 VAL H 1 1 17 13853 1 1 29 VAL HA H 2.037 -9.036 -2.542 1.00 . A B . 29 VAL HA 1 1 17 13854 1 1 29 VAL HB H -0.931 -8.692 -2.086 1.00 . A B . 29 VAL HB 1 1 17 13855 1 1 29 VAL HG11 H 0.554 -10.533 -3.961 1.00 . A B . 29 VAL HG11 1 1 17 13856 1 1 29 VAL HG12 H -0.362 -9.103 -4.437 1.00 . A B . 29 VAL HG12 1 1 17 13857 1 1 29 VAL HG13 H -1.193 -10.485 -3.721 1.00 . A B . 29 VAL HG13 1 1 17 13858 1 1 29 VAL HG21 H 0.895 -11.012 -1.480 1.00 . A B . 29 VAL HG21 1 1 17 13859 1 1 29 VAL HG22 H -0.862 -11.040 -1.355 1.00 . A B . 29 VAL HG22 1 1 17 13860 1 1 29 VAL HG23 H 0.078 -9.984 -0.304 1.00 . A B . 29 VAL HG23 1 1 17 13861 1 1 29 VAL N N 1.418 -7.872 -0.959 1.00 . A B . 29 VAL N 1 1 17 13862 1 1 29 VAL O O 1.702 -7.342 -4.378 1.00 . A B . 29 VAL O 1 1 17 13863 1 1 30 PHE C C 0.630 -3.941 -3.474 1.00 . A B . 30 PHE C 1 1 17 13864 1 1 30 PHE CA C -0.019 -5.227 -3.958 1.00 . A B . 30 PHE CA 1 1 17 13865 1 1 30 PHE CB C -1.528 -5.014 -4.116 1.00 . A B . 30 PHE CB 1 1 17 13866 1 1 30 PHE CD1 C -2.196 -6.864 -5.673 1.00 . A B . 30 PHE CD1 1 1 17 13867 1 1 30 PHE CD2 C -3.128 -6.850 -3.477 1.00 . A B . 30 PHE CD2 1 1 17 13868 1 1 30 PHE CE1 C -2.896 -8.016 -5.968 1.00 . A B . 30 PHE CE1 1 1 17 13869 1 1 30 PHE CE2 C -3.831 -8.004 -3.768 1.00 . A B . 30 PHE CE2 1 1 17 13870 1 1 30 PHE CG C -2.302 -6.267 -4.426 1.00 . A B . 30 PHE CG 1 1 17 13871 1 1 30 PHE CZ C -3.744 -8.577 -4.983 1.00 . A B . 30 PHE CZ 1 1 17 13872 1 1 30 PHE H H -0.167 -6.283 -2.127 1.00 . A B . 30 PHE H 1 1 17 13873 1 1 30 PHE HA H 0.406 -5.499 -4.911 1.00 . A B . 30 PHE HA 1 1 17 13874 1 1 30 PHE HB2 H -1.924 -4.603 -3.197 1.00 . A B . 30 PHE HB2 1 1 17 13875 1 1 30 PHE HB3 H -1.700 -4.309 -4.919 1.00 . A B . 30 PHE HB3 1 1 17 13876 1 1 30 PHE HD1 H -1.552 -6.421 -6.417 1.00 . A B . 30 PHE HD1 1 1 17 13877 1 1 30 PHE HD2 H -3.220 -6.396 -2.501 1.00 . A B . 30 PHE HD2 1 1 17 13878 1 1 30 PHE HE1 H -2.803 -8.469 -6.945 1.00 . A B . 30 PHE HE1 1 1 17 13879 1 1 30 PHE HE2 H -4.470 -8.449 -3.021 1.00 . A B . 30 PHE HE2 1 1 17 13880 1 1 30 PHE HZ H -4.305 -9.473 -5.199 1.00 . A B . 30 PHE HZ 1 1 17 13881 1 1 30 PHE N N 0.251 -6.308 -3.019 1.00 . A B . 30 PHE N 1 1 17 13882 1 1 30 PHE O O 0.078 -2.857 -3.640 1.00 . A B . 30 PHE O 1 1 17 13883 1 1 31 HIS C C 2.576 -1.744 -3.174 1.00 . A B . 31 HIS C 1 1 17 13884 1 1 31 HIS CA C 2.545 -2.975 -2.274 1.00 . A B . 31 HIS CA 1 1 17 13885 1 1 31 HIS CB C 3.972 -3.432 -1.950 1.00 . A B . 31 HIS CB 1 1 17 13886 1 1 31 HIS CD2 C 5.823 -1.715 -1.354 1.00 . A B . 31 HIS CD2 1 1 17 13887 1 1 31 HIS CE1 C 5.425 -1.468 0.758 1.00 . A B . 31 HIS CE1 1 1 17 13888 1 1 31 HIS CG C 4.754 -2.499 -1.067 1.00 . A B . 31 HIS CG 1 1 17 13889 1 1 31 HIS H H 2.226 -4.975 -2.883 1.00 . A B . 31 HIS H 1 1 17 13890 1 1 31 HIS HA H 2.041 -2.723 -1.354 1.00 . A B . 31 HIS HA 1 1 17 13891 1 1 31 HIS HB2 H 3.926 -4.388 -1.452 1.00 . A B . 31 HIS HB2 1 1 17 13892 1 1 31 HIS HB3 H 4.516 -3.546 -2.878 1.00 . A B . 31 HIS HB3 1 1 17 13893 1 1 31 HIS HD1 H 3.800 -2.774 0.793 1.00 . A B . 31 HIS HD1 1 1 17 13894 1 1 31 HIS HD2 H 6.264 -1.586 -2.331 1.00 . A B . 31 HIS HD2 1 1 17 13895 1 1 31 HIS HE1 H 5.475 -1.142 1.789 1.00 . A B . 31 HIS HE1 1 1 17 13896 1 1 31 HIS N N 1.819 -4.084 -2.896 1.00 . A B . 31 HIS N 1 1 17 13897 1 1 31 HIS ND1 N 4.512 -2.333 0.277 1.00 . A B . 31 HIS ND1 1 1 17 13898 1 1 31 HIS NE2 N 6.249 -1.062 -0.193 1.00 . A B . 31 HIS NE2 1 1 17 13899 1 1 31 HIS O O 2.231 -0.652 -2.747 1.00 . A B . 31 HIS O 1 1 17 13900 1 1 32 GLU C C 1.832 -0.056 -5.562 1.00 . A B . 32 GLU C 1 1 17 13901 1 1 32 GLU CA C 3.125 -0.848 -5.367 1.00 . A B . 32 GLU CA 1 1 17 13902 1 1 32 GLU CB C 3.599 -1.391 -6.717 1.00 . A B . 32 GLU CB 1 1 17 13903 1 1 32 GLU CD C 6.105 -1.288 -6.403 1.00 . A B . 32 GLU CD 1 1 17 13904 1 1 32 GLU CG C 4.903 -2.171 -6.647 1.00 . A B . 32 GLU CG 1 1 17 13905 1 1 32 GLU H H 3.024 -2.869 -4.750 1.00 . A B . 32 GLU H 1 1 17 13906 1 1 32 GLU HA H 3.881 -0.193 -4.960 1.00 . A B . 32 GLU HA 1 1 17 13907 1 1 32 GLU HB2 H 2.836 -2.044 -7.112 1.00 . A B . 32 GLU HB2 1 1 17 13908 1 1 32 GLU HB3 H 3.737 -0.561 -7.395 1.00 . A B . 32 GLU HB3 1 1 17 13909 1 1 32 GLU HG2 H 4.838 -2.882 -5.840 1.00 . A B . 32 GLU HG2 1 1 17 13910 1 1 32 GLU HG3 H 5.045 -2.698 -7.579 1.00 . A B . 32 GLU HG3 1 1 17 13911 1 1 32 GLU N N 2.928 -1.949 -4.432 1.00 . A B . 32 GLU N 1 1 17 13912 1 1 32 GLU O O 1.823 1.173 -5.503 1.00 . A B . 32 GLU O 1 1 17 13913 1 1 32 GLU OE1 O 6.336 -0.908 -5.236 1.00 . A B . 32 GLU OE1 1 1 17 13914 1 1 32 GLU OE2 O 6.814 -0.962 -7.372 1.00 . A B . 32 GLU OE2 1 1 17 13915 1 1 33 ASP C C -1.185 0.369 -4.769 1.00 . A B . 33 ASP C 1 1 17 13916 1 1 33 ASP CA C -0.546 -0.149 -6.053 1.00 . A B . 33 ASP CA 1 1 17 13917 1 1 33 ASP CB C -1.483 -1.143 -6.738 1.00 . A B . 33 ASP CB 1 1 17 13918 1 1 33 ASP CG C -2.694 -0.473 -7.366 1.00 . A B . 33 ASP CG 1 1 17 13919 1 1 33 ASP H H 0.802 -1.756 -5.723 1.00 . A B . 33 ASP H 1 1 17 13920 1 1 33 ASP HA H -0.371 0.687 -6.716 1.00 . A B . 33 ASP HA 1 1 17 13921 1 1 33 ASP HB2 H -0.941 -1.662 -7.515 1.00 . A B . 33 ASP HB2 1 1 17 13922 1 1 33 ASP HB3 H -1.826 -1.861 -6.008 1.00 . A B . 33 ASP HB3 1 1 17 13923 1 1 33 ASP N N 0.739 -0.776 -5.771 1.00 . A B . 33 ASP N 1 1 17 13924 1 1 33 ASP O O -1.962 1.320 -4.786 1.00 . A B . 33 ASP O 1 1 17 13925 1 1 33 ASP OD1 O -3.684 -0.236 -6.639 1.00 . A B . 33 ASP OD1 1 1 17 13926 1 1 33 ASP OD2 O -2.668 -0.174 -8.575 1.00 . A B . 33 ASP OD2 1 1 17 13927 1 1 34 CYS C C -0.830 1.469 -1.873 1.00 . A B . 34 CYS C 1 1 17 13928 1 1 34 CYS CA C -1.376 0.125 -2.353 1.00 . A B . 34 CYS CA 1 1 17 13929 1 1 34 CYS CB C -1.091 -0.970 -1.322 1.00 . A B . 34 CYS CB 1 1 17 13930 1 1 34 CYS H H -0.167 -0.980 -3.697 1.00 . A B . 34 CYS H 1 1 17 13931 1 1 34 CYS HA H -2.445 0.216 -2.473 1.00 . A B . 34 CYS HA 1 1 17 13932 1 1 34 CYS HB2 H -0.058 -1.282 -1.413 1.00 . A B . 34 CYS HB2 1 1 17 13933 1 1 34 CYS HB3 H -1.258 -0.577 -0.330 1.00 . A B . 34 CYS HB3 1 1 17 13934 1 1 34 CYS N N -0.823 -0.247 -3.650 1.00 . A B . 34 CYS N 1 1 17 13935 1 1 34 CYS O O -1.245 1.982 -0.831 1.00 . A B . 34 CYS O 1 1 17 13936 1 1 34 CYS SG S -2.130 -2.458 -1.519 1.00 . A B . 34 CYS SG 1 1 17 13937 1 1 35 HIS C C 0.054 4.422 -3.235 1.00 . A B . 35 HIS C 1 1 17 13938 1 1 35 HIS CA C 0.644 3.351 -2.325 1.00 . A B . 35 HIS CA 1 1 17 13939 1 1 35 HIS CB C 2.164 3.367 -2.478 1.00 . A B . 35 HIS CB 1 1 17 13940 1 1 35 HIS CD2 C 3.341 1.426 -1.270 1.00 . A B . 35 HIS CD2 1 1 17 13941 1 1 35 HIS CE1 C 3.866 2.408 0.578 1.00 . A B . 35 HIS CE1 1 1 17 13942 1 1 35 HIS CG C 2.892 2.693 -1.364 1.00 . A B . 35 HIS CG 1 1 17 13943 1 1 35 HIS H H 0.449 1.544 -3.409 1.00 . A B . 35 HIS H 1 1 17 13944 1 1 35 HIS HA H 0.395 3.582 -1.300 1.00 . A B . 35 HIS HA 1 1 17 13945 1 1 35 HIS HB2 H 2.428 2.863 -3.396 1.00 . A B . 35 HIS HB2 1 1 17 13946 1 1 35 HIS HB3 H 2.502 4.393 -2.524 1.00 . A B . 35 HIS HB3 1 1 17 13947 1 1 35 HIS HD1 H 2.998 4.230 0.082 1.00 . A B . 35 HIS HD1 1 1 17 13948 1 1 35 HIS HD2 H 3.257 0.664 -2.036 1.00 . A B . 35 HIS HD2 1 1 17 13949 1 1 35 HIS HE1 H 4.253 2.608 1.564 1.00 . A B . 35 HIS HE1 1 1 17 13950 1 1 35 HIS N N 0.105 2.034 -2.631 1.00 . A B . 35 HIS N 1 1 17 13951 1 1 35 HIS ND1 N 3.226 3.307 -0.179 1.00 . A B . 35 HIS ND1 1 1 17 13952 1 1 35 HIS NE2 N 3.960 1.243 -0.044 1.00 . A B . 35 HIS NE2 1 1 17 13953 1 1 35 HIS O O -0.163 5.554 -2.809 1.00 . A B . 35 HIS O 1 1 17 13954 1 1 36 ILE C C -1.841 4.664 -6.225 1.00 . A B . 36 ILE C 1 1 17 13955 1 1 36 ILE CA C -0.537 5.027 -5.516 1.00 . A B . 36 ILE CA 1 1 17 13956 1 1 36 ILE CB C 0.600 5.103 -6.559 1.00 . A B . 36 ILE CB 1 1 17 13957 1 1 36 ILE CD1 C 3.131 5.365 -6.792 1.00 . A B . 36 ILE CD1 1 1 17 13958 1 1 36 ILE CG1 C 1.931 5.428 -5.871 1.00 . A B . 36 ILE CG1 1 1 17 13959 1 1 36 ILE CG2 C 0.286 6.136 -7.633 1.00 . A B . 36 ILE CG2 1 1 17 13960 1 1 36 ILE H H -0.177 3.107 -4.717 1.00 . A B . 36 ILE H 1 1 17 13961 1 1 36 ILE HA H -0.641 5.994 -5.050 1.00 . A B . 36 ILE HA 1 1 17 13962 1 1 36 ILE HB H 0.680 4.138 -7.037 1.00 . A B . 36 ILE HB 1 1 17 13963 1 1 36 ILE HD11 H 4.023 5.631 -6.243 1.00 . A B . 36 ILE HD11 1 1 17 13964 1 1 36 ILE HD12 H 2.994 6.056 -7.613 1.00 . A B . 36 ILE HD12 1 1 17 13965 1 1 36 ILE HD13 H 3.236 4.362 -7.180 1.00 . A B . 36 ILE HD13 1 1 17 13966 1 1 36 ILE HG12 H 1.880 6.424 -5.460 1.00 . A B . 36 ILE HG12 1 1 17 13967 1 1 36 ILE HG13 H 2.090 4.721 -5.069 1.00 . A B . 36 ILE HG13 1 1 17 13968 1 1 36 ILE HG21 H -0.634 5.868 -8.131 1.00 . A B . 36 ILE HG21 1 1 17 13969 1 1 36 ILE HG22 H 1.091 6.162 -8.351 1.00 . A B . 36 ILE HG22 1 1 17 13970 1 1 36 ILE HG23 H 0.180 7.110 -7.177 1.00 . A B . 36 ILE HG23 1 1 17 13971 1 1 36 ILE N N -0.203 4.056 -4.484 1.00 . A B . 36 ILE N 1 1 17 13972 1 1 36 ILE O O -2.046 3.511 -6.599 1.00 . A B . 36 ILE O 1 1 17 13973 1 1 37 PRO C C -2.916 7.059 -4.387 1.00 . A B . 37 PRO C 1 1 17 13974 1 1 37 PRO CA C -2.602 6.996 -5.884 1.00 . A B . 37 PRO CA 1 1 17 13975 1 1 37 PRO CB C -3.628 7.803 -6.684 1.00 . A B . 37 PRO CB 1 1 17 13976 1 1 37 PRO CD C -3.981 5.484 -7.211 1.00 . A B . 37 PRO CD 1 1 17 13977 1 1 37 PRO CG C -4.675 6.815 -7.078 1.00 . A B . 37 PRO CG 1 1 17 13978 1 1 37 PRO HA H -1.612 7.385 -6.064 1.00 . A B . 37 PRO HA 1 1 17 13979 1 1 37 PRO HB2 H -4.038 8.587 -6.059 1.00 . A B . 37 PRO HB2 1 1 17 13980 1 1 37 PRO HB3 H -3.151 8.237 -7.552 1.00 . A B . 37 PRO HB3 1 1 17 13981 1 1 37 PRO HD2 H -4.600 4.694 -6.811 1.00 . A B . 37 PRO HD2 1 1 17 13982 1 1 37 PRO HD3 H -3.745 5.285 -8.248 1.00 . A B . 37 PRO HD3 1 1 17 13983 1 1 37 PRO HG2 H -5.437 6.765 -6.314 1.00 . A B . 37 PRO HG2 1 1 17 13984 1 1 37 PRO HG3 H -5.113 7.104 -8.023 1.00 . A B . 37 PRO HG3 1 1 17 13985 1 1 37 PRO N N -2.750 5.637 -6.416 1.00 . A B . 37 PRO N 1 1 17 13986 1 1 37 PRO O O -3.848 6.403 -3.918 1.00 . A B . 37 PRO O 1 1 17 13987 1 1 38 PRO C C -3.611 8.732 -1.822 1.00 . A B . 38 PRO C 1 1 17 13988 1 1 38 PRO CA C -2.346 7.952 -2.169 1.00 . A B . 38 PRO CA 1 1 17 13989 1 1 38 PRO CB C -1.109 8.717 -1.671 1.00 . A B . 38 PRO CB 1 1 17 13990 1 1 38 PRO CD C -1.000 8.638 -4.068 1.00 . A B . 38 PRO CD 1 1 17 13991 1 1 38 PRO CG C -0.157 8.743 -2.824 1.00 . A B . 38 PRO CG 1 1 17 13992 1 1 38 PRO HA H -2.383 6.982 -1.698 1.00 . A B . 38 PRO HA 1 1 17 13993 1 1 38 PRO HB2 H -1.401 9.716 -1.376 1.00 . A B . 38 PRO HB2 1 1 17 13994 1 1 38 PRO HB3 H -0.685 8.201 -0.822 1.00 . A B . 38 PRO HB3 1 1 17 13995 1 1 38 PRO HD2 H -1.322 9.618 -4.395 1.00 . A B . 38 PRO HD2 1 1 17 13996 1 1 38 PRO HD3 H -0.455 8.134 -4.852 1.00 . A B . 38 PRO HD3 1 1 17 13997 1 1 38 PRO HG2 H 0.397 9.670 -2.822 1.00 . A B . 38 PRO HG2 1 1 17 13998 1 1 38 PRO HG3 H 0.519 7.902 -2.758 1.00 . A B . 38 PRO HG3 1 1 17 13999 1 1 38 PRO N N -2.140 7.833 -3.614 1.00 . A B . 38 PRO N 1 1 17 14000 1 1 38 PRO O O -3.857 9.810 -2.365 1.00 . A B . 38 PRO O 1 1 17 14001 1 1 39 VAL C C -5.192 9.908 0.610 1.00 . A B . 39 VAL C 1 1 17 14002 1 1 39 VAL CA C -5.595 8.865 -0.427 1.00 . A B . 39 VAL CA 1 1 17 14003 1 1 39 VAL CB C -6.609 7.881 0.197 1.00 . A B . 39 VAL CB 1 1 17 14004 1 1 39 VAL CG1 C -7.867 8.611 0.638 1.00 . A B . 39 VAL CG1 1 1 17 14005 1 1 39 VAL CG2 C -6.955 6.765 -0.777 1.00 . A B . 39 VAL CG2 1 1 17 14006 1 1 39 VAL H H -4.193 7.292 -0.571 1.00 . A B . 39 VAL H 1 1 17 14007 1 1 39 VAL HA H -6.065 9.361 -1.261 1.00 . A B . 39 VAL HA 1 1 17 14008 1 1 39 VAL HB H -6.153 7.440 1.068 1.00 . A B . 39 VAL HB 1 1 17 14009 1 1 39 VAL HG11 H -7.616 9.326 1.408 1.00 . A B . 39 VAL HG11 1 1 17 14010 1 1 39 VAL HG12 H -8.579 7.898 1.026 1.00 . A B . 39 VAL HG12 1 1 17 14011 1 1 39 VAL HG13 H -8.297 9.129 -0.206 1.00 . A B . 39 VAL HG13 1 1 17 14012 1 1 39 VAL HG21 H -7.389 7.188 -1.671 1.00 . A B . 39 VAL HG21 1 1 17 14013 1 1 39 VAL HG22 H -7.666 6.095 -0.317 1.00 . A B . 39 VAL HG22 1 1 17 14014 1 1 39 VAL HG23 H -6.062 6.219 -1.033 1.00 . A B . 39 VAL HG23 1 1 17 14015 1 1 39 VAL N N -4.410 8.181 -0.919 1.00 . A B . 39 VAL N 1 1 17 14016 1 1 39 VAL O O -5.061 9.607 1.796 1.00 . A B . 39 VAL O 1 1 17 14017 1 1 40 GLU C C -5.655 12.887 1.738 1.00 . A B . 40 GLU C 1 1 17 14018 1 1 40 GLU CA C -4.498 12.193 1.030 1.00 . A B . 40 GLU CA 1 1 17 14019 1 1 40 GLU CB C -3.665 13.209 0.247 1.00 . A B . 40 GLU CB 1 1 17 14020 1 1 40 GLU CD C -1.602 13.638 -1.152 1.00 . A B . 40 GLU CD 1 1 17 14021 1 1 40 GLU CG C -2.387 12.628 -0.342 1.00 . A B . 40 GLU CG 1 1 17 14022 1 1 40 GLU H H -5.141 11.324 -0.792 1.00 . A B . 40 GLU H 1 1 17 14023 1 1 40 GLU HA H -3.874 11.734 1.779 1.00 . A B . 40 GLU HA 1 1 17 14024 1 1 40 GLU HB2 H -4.264 13.600 -0.562 1.00 . A B . 40 GLU HB2 1 1 17 14025 1 1 40 GLU HB3 H -3.396 14.021 0.906 1.00 . A B . 40 GLU HB3 1 1 17 14026 1 1 40 GLU HG2 H -1.760 12.276 0.464 1.00 . A B . 40 GLU HG2 1 1 17 14027 1 1 40 GLU HG3 H -2.647 11.799 -0.983 1.00 . A B . 40 GLU HG3 1 1 17 14028 1 1 40 GLU N N -4.973 11.131 0.155 1.00 . A B . 40 GLU N 1 1 17 14029 1 1 40 GLU O O -5.444 13.644 2.684 1.00 . A B . 40 GLU O 1 1 17 14030 1 1 40 GLU OE1 O -0.934 14.505 -0.549 1.00 . A B . 40 GLU OE1 1 1 17 14031 1 1 40 GLU OE2 O -1.650 13.569 -2.400 1.00 . A B . 40 GLU OE2 1 1 17 14032 1 1 41 ALA C C -8.179 12.571 3.335 1.00 . A B . 41 ALA C 1 1 17 14033 1 1 41 ALA CA C -8.059 13.157 1.934 1.00 . A B . 41 ALA CA 1 1 17 14034 1 1 41 ALA CB C -9.306 12.846 1.117 1.00 . A B . 41 ALA CB 1 1 17 14035 1 1 41 ALA H H -6.966 12.083 0.468 1.00 . A B . 41 ALA H 1 1 17 14036 1 1 41 ALA HA H -7.958 14.228 2.007 1.00 . A B . 41 ALA HA 1 1 17 14037 1 1 41 ALA HB1 H -9.412 11.776 1.014 1.00 . A B . 41 ALA HB1 1 1 17 14038 1 1 41 ALA HB2 H -9.217 13.296 0.139 1.00 . A B . 41 ALA HB2 1 1 17 14039 1 1 41 ALA HB3 H -10.174 13.246 1.619 1.00 . A B . 41 ALA HB3 1 1 17 14040 1 1 41 ALA N N -6.869 12.632 1.275 1.00 . A B . 41 ALA N 1 1 17 14041 1 1 41 ALA O O -8.156 13.295 4.332 1.00 . A B . 41 ALA O 1 1 17 14042 1 1 42 GLU C C -7.248 9.453 4.646 1.00 . A B . 42 GLU C 1 1 17 14043 1 1 42 GLU CA C -8.313 10.543 4.664 1.00 . A B . 42 GLU CA 1 1 17 14044 1 1 42 GLU CB C -9.696 9.943 4.924 1.00 . A B . 42 GLU CB 1 1 17 14045 1 1 42 GLU CD C -12.140 10.392 5.389 1.00 . A B . 42 GLU CD 1 1 17 14046 1 1 42 GLU CG C -10.803 10.983 4.994 1.00 . A B . 42 GLU CG 1 1 17 14047 1 1 42 GLU H H -8.359 10.744 2.568 1.00 . A B . 42 GLU H 1 1 17 14048 1 1 42 GLU HA H -8.080 11.249 5.445 1.00 . A B . 42 GLU HA 1 1 17 14049 1 1 42 GLU HB2 H -9.932 9.248 4.131 1.00 . A B . 42 GLU HB2 1 1 17 14050 1 1 42 GLU HB3 H -9.673 9.409 5.864 1.00 . A B . 42 GLU HB3 1 1 17 14051 1 1 42 GLU HG2 H -10.530 11.733 5.722 1.00 . A B . 42 GLU HG2 1 1 17 14052 1 1 42 GLU HG3 H -10.902 11.447 4.022 1.00 . A B . 42 GLU HG3 1 1 17 14053 1 1 42 GLU N N -8.292 11.254 3.399 1.00 . A B . 42 GLU N 1 1 17 14054 1 1 42 GLU O O -7.465 8.367 4.106 1.00 . A B . 42 GLU O 1 1 17 14055 1 1 42 GLU OE1 O -12.284 9.951 6.550 1.00 . A B . 42 GLU OE1 1 1 17 14056 1 1 42 GLU OE2 O -13.047 10.346 4.533 1.00 . A B . 42 GLU OE2 1 1 17 14057 1 1 43 ARG C C -5.074 7.735 6.206 1.00 . A B . 43 ARG C 1 1 17 14058 1 1 43 ARG CA C -4.942 8.855 5.177 1.00 . A B . 43 ARG CA 1 1 17 14059 1 1 43 ARG CB C -3.645 9.633 5.412 1.00 . A B . 43 ARG CB 1 1 17 14060 1 1 43 ARG CD C -2.107 11.463 4.651 1.00 . A B . 43 ARG CD 1 1 17 14061 1 1 43 ARG CG C -3.478 10.829 4.491 1.00 . A B . 43 ARG CG 1 1 17 14062 1 1 43 ARG CZ C -0.848 13.279 3.548 1.00 . A B . 43 ARG CZ 1 1 17 14063 1 1 43 ARG H H -6.014 10.600 5.719 1.00 . A B . 43 ARG H 1 1 17 14064 1 1 43 ARG HA H -4.913 8.420 4.193 1.00 . A B . 43 ARG HA 1 1 17 14065 1 1 43 ARG HB2 H -3.631 9.986 6.432 1.00 . A B . 43 ARG HB2 1 1 17 14066 1 1 43 ARG HB3 H -2.807 8.969 5.259 1.00 . A B . 43 ARG HB3 1 1 17 14067 1 1 43 ARG HD2 H -1.926 11.639 5.701 1.00 . A B . 43 ARG HD2 1 1 17 14068 1 1 43 ARG HD3 H -1.363 10.778 4.269 1.00 . A B . 43 ARG HD3 1 1 17 14069 1 1 43 ARG HE H -2.840 13.207 3.737 1.00 . A B . 43 ARG HE 1 1 17 14070 1 1 43 ARG HG2 H -3.599 10.506 3.468 1.00 . A B . 43 ARG HG2 1 1 17 14071 1 1 43 ARG HG3 H -4.233 11.565 4.729 1.00 . A B . 43 ARG HG3 1 1 17 14072 1 1 43 ARG HH11 H 0.313 11.795 4.292 1.00 . A B . 43 ARG HH11 1 1 17 14073 1 1 43 ARG HH12 H 1.170 13.088 3.517 1.00 . A B . 43 ARG HH12 1 1 17 14074 1 1 43 ARG HH21 H -1.707 14.914 2.721 1.00 . A B . 43 ARG HH21 1 1 17 14075 1 1 43 ARG HH22 H 0.023 14.855 2.622 1.00 . A B . 43 ARG HH22 1 1 17 14076 1 1 43 ARG N N -6.093 9.753 5.229 1.00 . A B . 43 ARG N 1 1 17 14077 1 1 43 ARG NE N -2.000 12.731 3.932 1.00 . A B . 43 ARG NE 1 1 17 14078 1 1 43 ARG NH1 N 0.302 12.671 3.806 1.00 . A B . 43 ARG NH1 1 1 17 14079 1 1 43 ARG NH2 N -0.845 14.441 2.914 1.00 . A B . 43 ARG NH2 1 1 17 14080 1 1 43 ARG O O -4.225 7.572 7.084 1.00 . A B . 43 ARG O 1 1 17 14081 1 1 44 THR C C -5.852 4.566 6.566 1.00 . A B . 44 THR C 1 1 17 14082 1 1 44 THR CA C -6.445 5.903 7.016 1.00 . A B . 44 THR CA 1 1 17 14083 1 1 44 THR CB C -7.969 5.756 7.173 1.00 . A B . 44 THR CB 1 1 17 14084 1 1 44 THR CG2 C -8.570 7.004 7.802 1.00 . A B . 44 THR CG2 1 1 17 14085 1 1 44 THR H H -6.735 7.110 5.308 1.00 . A B . 44 THR H 1 1 17 14086 1 1 44 THR HA H -6.030 6.175 7.973 1.00 . A B . 44 THR HA 1 1 17 14087 1 1 44 THR HB H -8.174 4.910 7.815 1.00 . A B . 44 THR HB 1 1 17 14088 1 1 44 THR HG1 H -7.956 5.027 5.337 1.00 . A B . 44 THR HG1 1 1 17 14089 1 1 44 THR HG21 H -8.137 7.159 8.778 1.00 . A B . 44 THR HG21 1 1 17 14090 1 1 44 THR HG22 H -9.638 6.883 7.896 1.00 . A B . 44 THR HG22 1 1 17 14091 1 1 44 THR HG23 H -8.359 7.859 7.176 1.00 . A B . 44 THR HG23 1 1 17 14092 1 1 44 THR N N -6.136 6.961 6.072 1.00 . A B . 44 THR N 1 1 17 14093 1 1 44 THR O O -6.250 4.026 5.533 1.00 . A B . 44 THR O 1 1 17 14094 1 1 44 THR OG1 O -8.570 5.531 5.890 1.00 . A B . 44 THR OG1 1 1 17 14095 1 1 45 PRO C C -5.217 1.549 7.150 1.00 . A B . 45 PRO C 1 1 17 14096 1 1 45 PRO CA C -4.260 2.730 6.999 1.00 . A B . 45 PRO CA 1 1 17 14097 1 1 45 PRO CB C -3.106 2.607 8.004 1.00 . A B . 45 PRO CB 1 1 17 14098 1 1 45 PRO CD C -4.339 4.589 8.564 1.00 . A B . 45 PRO CD 1 1 17 14099 1 1 45 PRO CG C -2.980 3.950 8.647 1.00 . A B . 45 PRO CG 1 1 17 14100 1 1 45 PRO HA H -3.866 2.740 5.994 1.00 . A B . 45 PRO HA 1 1 17 14101 1 1 45 PRO HB2 H -3.342 1.845 8.732 1.00 . A B . 45 PRO HB2 1 1 17 14102 1 1 45 PRO HB3 H -2.199 2.338 7.479 1.00 . A B . 45 PRO HB3 1 1 17 14103 1 1 45 PRO HD2 H -4.938 4.320 9.424 1.00 . A B . 45 PRO HD2 1 1 17 14104 1 1 45 PRO HD3 H -4.249 5.663 8.483 1.00 . A B . 45 PRO HD3 1 1 17 14105 1 1 45 PRO HG2 H -2.681 3.837 9.679 1.00 . A B . 45 PRO HG2 1 1 17 14106 1 1 45 PRO HG3 H -2.254 4.545 8.111 1.00 . A B . 45 PRO HG3 1 1 17 14107 1 1 45 PRO N N -4.896 4.012 7.331 1.00 . A B . 45 PRO N 1 1 17 14108 1 1 45 PRO O O -5.013 0.490 6.555 1.00 . A B . 45 PRO O 1 1 17 14109 1 1 46 TRP C C -8.407 0.764 7.195 1.00 . A B . 46 TRP C 1 1 17 14110 1 1 46 TRP CA C -7.246 0.683 8.185 1.00 . A B . 46 TRP CA 1 1 17 14111 1 1 46 TRP CB C -7.763 0.747 9.631 1.00 . A B . 46 TRP CB 1 1 17 14112 1 1 46 TRP CD1 C -9.522 2.603 9.860 1.00 . A B . 46 TRP CD1 1 1 17 14113 1 1 46 TRP CD2 C -7.521 3.123 10.721 1.00 . A B . 46 TRP CD2 1 1 17 14114 1 1 46 TRP CE2 C -8.389 4.214 10.909 1.00 . A B . 46 TRP CE2 1 1 17 14115 1 1 46 TRP CE3 C -6.206 3.222 11.187 1.00 . A B . 46 TRP CE3 1 1 17 14116 1 1 46 TRP CG C -8.265 2.101 10.043 1.00 . A B . 46 TRP CG 1 1 17 14117 1 1 46 TRP CH2 C -6.695 5.455 11.986 1.00 . A B . 46 TRP CH2 1 1 17 14118 1 1 46 TRP CZ2 C -7.986 5.386 11.540 1.00 . A B . 46 TRP CZ2 1 1 17 14119 1 1 46 TRP CZ3 C -5.808 4.388 11.814 1.00 . A B . 46 TRP CZ3 1 1 17 14120 1 1 46 TRP H H -6.396 2.617 8.357 1.00 . A B . 46 TRP H 1 1 17 14121 1 1 46 TRP HA H -6.741 -0.262 8.038 1.00 . A B . 46 TRP HA 1 1 17 14122 1 1 46 TRP HB2 H -8.580 0.047 9.743 1.00 . A B . 46 TRP HB2 1 1 17 14123 1 1 46 TRP HB3 H -6.966 0.468 10.303 1.00 . A B . 46 TRP HB3 1 1 17 14124 1 1 46 TRP HD1 H -10.326 2.071 9.374 1.00 . A B . 46 TRP HD1 1 1 17 14125 1 1 46 TRP HE1 H -10.403 4.443 10.359 1.00 . A B . 46 TRP HE1 1 1 17 14126 1 1 46 TRP HE3 H -5.507 2.409 11.063 1.00 . A B . 46 TRP HE3 1 1 17 14127 1 1 46 TRP HH2 H -6.338 6.346 12.480 1.00 . A B . 46 TRP HH2 1 1 17 14128 1 1 46 TRP HZ2 H -8.658 6.217 11.683 1.00 . A B . 46 TRP HZ2 1 1 17 14129 1 1 46 TRP HZ3 H -4.797 4.484 12.182 1.00 . A B . 46 TRP HZ3 1 1 17 14130 1 1 46 TRP N N -6.271 1.741 7.936 1.00 . A B . 46 TRP N 1 1 17 14131 1 1 46 TRP NE1 N -9.601 3.873 10.372 1.00 . A B . 46 TRP NE1 1 1 17 14132 1 1 46 TRP O O -9.555 0.474 7.531 1.00 . A B . 46 TRP O 1 1 17 14133 1 1 47 ASN C C -8.425 0.663 3.644 1.00 . A B . 47 ASN C 1 1 17 14134 1 1 47 ASN CA C -9.075 1.204 4.905 1.00 . A B . 47 ASN CA 1 1 17 14135 1 1 47 ASN CB C -9.595 2.630 4.674 1.00 . A B . 47 ASN CB 1 1 17 14136 1 1 47 ASN CG C -10.778 2.683 3.713 1.00 . A B . 47 ASN CG 1 1 17 14137 1 1 47 ASN H H -7.173 1.439 5.788 1.00 . A B . 47 ASN H 1 1 17 14138 1 1 47 ASN HA H -9.899 0.563 5.183 1.00 . A B . 47 ASN HA 1 1 17 14139 1 1 47 ASN HB2 H -9.903 3.048 5.622 1.00 . A B . 47 ASN HB2 1 1 17 14140 1 1 47 ASN HB3 H -8.793 3.233 4.266 1.00 . A B . 47 ASN HB3 1 1 17 14141 1 1 47 ASN HD21 H -11.496 4.308 4.613 1.00 . A B . 47 ASN HD21 1 1 17 14142 1 1 47 ASN HD22 H -12.417 3.721 3.271 1.00 . A B . 47 ASN HD22 1 1 17 14143 1 1 47 ASN N N -8.096 1.170 5.979 1.00 . A B . 47 ASN N 1 1 17 14144 1 1 47 ASN ND2 N -11.651 3.668 3.885 1.00 . A B . 47 ASN ND2 1 1 17 14145 1 1 47 ASN O O -7.691 1.373 2.957 1.00 . A B . 47 ASN O 1 1 17 14146 1 1 47 ASN OD1 O -10.910 1.850 2.818 1.00 . A B . 47 ASN OD1 1 1 17 14147 1 1 48 CYS C C -8.724 -1.046 0.955 1.00 . A B . 48 CYS C 1 1 17 14148 1 1 48 CYS CA C -8.004 -1.285 2.270 1.00 . A B . 48 CYS CA 1 1 17 14149 1 1 48 CYS CB C -7.947 -2.782 2.571 1.00 . A B . 48 CYS CB 1 1 17 14150 1 1 48 CYS H H -9.358 -1.082 3.877 1.00 . A B . 48 CYS H 1 1 17 14151 1 1 48 CYS HA H -7.001 -0.896 2.203 1.00 . A B . 48 CYS HA 1 1 17 14152 1 1 48 CYS HB2 H -7.449 -2.930 3.518 1.00 . A B . 48 CYS HB2 1 1 17 14153 1 1 48 CYS HB3 H -8.958 -3.158 2.645 1.00 . A B . 48 CYS HB3 1 1 17 14154 1 1 48 CYS N N -8.679 -0.602 3.357 1.00 . A B . 48 CYS N 1 1 17 14155 1 1 48 CYS O O -9.899 -1.384 0.803 1.00 . A B . 48 CYS O 1 1 17 14156 1 1 48 CYS SG S -7.083 -3.796 1.346 1.00 . A B . 48 CYS SG 1 1 17 14157 1 1 49 ILE C C -8.679 -1.483 -2.153 1.00 . A B . 49 ILE C 1 1 17 14158 1 1 49 ILE CA C -8.558 -0.218 -1.313 1.00 . A B . 49 ILE CA 1 1 17 14159 1 1 49 ILE CB C -7.727 0.834 -2.085 1.00 . A B . 49 ILE CB 1 1 17 14160 1 1 49 ILE CD1 C -5.377 1.432 -2.867 1.00 . A B . 49 ILE CD1 1 1 17 14161 1 1 49 ILE CG1 C -6.233 0.495 -2.045 1.00 . A B . 49 ILE CG1 1 1 17 14162 1 1 49 ILE CG2 C -7.974 2.227 -1.520 1.00 . A B . 49 ILE CG2 1 1 17 14163 1 1 49 ILE H H -7.059 -0.268 0.180 1.00 . A B . 49 ILE H 1 1 17 14164 1 1 49 ILE HA H -9.548 0.185 -1.160 1.00 . A B . 49 ILE HA 1 1 17 14165 1 1 49 ILE HB H -8.058 0.829 -3.113 1.00 . A B . 49 ILE HB 1 1 17 14166 1 1 49 ILE HD11 H -4.345 1.124 -2.809 1.00 . A B . 49 ILE HD11 1 1 17 14167 1 1 49 ILE HD12 H -5.474 2.438 -2.483 1.00 . A B . 49 ILE HD12 1 1 17 14168 1 1 49 ILE HD13 H -5.702 1.407 -3.898 1.00 . A B . 49 ILE HD13 1 1 17 14169 1 1 49 ILE HG12 H -5.889 0.550 -1.024 1.00 . A B . 49 ILE HG12 1 1 17 14170 1 1 49 ILE HG13 H -6.087 -0.508 -2.418 1.00 . A B . 49 ILE HG13 1 1 17 14171 1 1 49 ILE HG21 H -7.357 2.943 -2.047 1.00 . A B . 49 ILE HG21 1 1 17 14172 1 1 49 ILE HG22 H -7.723 2.242 -0.471 1.00 . A B . 49 ILE HG22 1 1 17 14173 1 1 49 ILE HG23 H -9.013 2.488 -1.645 1.00 . A B . 49 ILE HG23 1 1 17 14174 1 1 49 ILE N N -7.996 -0.503 -0.005 1.00 . A B . 49 ILE N 1 1 17 14175 1 1 49 ILE O O -9.528 -1.566 -3.033 1.00 . A B . 49 ILE O 1 1 17 14176 1 1 50 PHE C C -8.984 -4.630 -2.190 1.00 . A B . 50 PHE C 1 1 17 14177 1 1 50 PHE CA C -7.859 -3.715 -2.643 1.00 . A B . 50 PHE CA 1 1 17 14178 1 1 50 PHE CB C -6.515 -4.439 -2.600 1.00 . A B . 50 PHE CB 1 1 17 14179 1 1 50 PHE CD1 C -4.822 -3.068 -3.826 1.00 . A B . 50 PHE CD1 1 1 17 14180 1 1 50 PHE CD2 C -5.749 -4.970 -4.925 1.00 . A B . 50 PHE CD2 1 1 17 14181 1 1 50 PHE CE1 C -4.039 -2.805 -4.931 1.00 . A B . 50 PHE CE1 1 1 17 14182 1 1 50 PHE CE2 C -4.967 -4.715 -6.028 1.00 . A B . 50 PHE CE2 1 1 17 14183 1 1 50 PHE CG C -5.689 -4.149 -3.814 1.00 . A B . 50 PHE CG 1 1 17 14184 1 1 50 PHE CZ C -4.207 -3.590 -6.090 1.00 . A B . 50 PHE CZ 1 1 17 14185 1 1 50 PHE H H -7.206 -2.374 -1.133 1.00 . A B . 50 PHE H 1 1 17 14186 1 1 50 PHE HA H -8.058 -3.442 -3.670 1.00 . A B . 50 PHE HA 1 1 17 14187 1 1 50 PHE HB2 H -5.960 -4.123 -1.727 1.00 . A B . 50 PHE HB2 1 1 17 14188 1 1 50 PHE HB3 H -6.684 -5.506 -2.556 1.00 . A B . 50 PHE HB3 1 1 17 14189 1 1 50 PHE HD1 H -4.768 -2.422 -2.963 1.00 . A B . 50 PHE HD1 1 1 17 14190 1 1 50 PHE HD2 H -6.421 -5.814 -4.928 1.00 . A B . 50 PHE HD2 1 1 17 14191 1 1 50 PHE HE1 H -3.370 -1.957 -4.931 1.00 . A B . 50 PHE HE1 1 1 17 14192 1 1 50 PHE HE2 H -5.021 -5.366 -6.886 1.00 . A B . 50 PHE HE2 1 1 17 14193 1 1 50 PHE HZ H -3.629 -3.370 -6.977 1.00 . A B . 50 PHE HZ 1 1 17 14194 1 1 50 PHE N N -7.832 -2.470 -1.880 1.00 . A B . 50 PHE N 1 1 17 14195 1 1 50 PHE O O -9.569 -5.345 -2.999 1.00 . A B . 50 PHE O 1 1 17 14196 1 1 51 CYS C C -11.727 -4.804 -0.845 1.00 . A B . 51 CYS C 1 1 17 14197 1 1 51 CYS CA C -10.398 -5.410 -0.403 1.00 . A B . 51 CYS CA 1 1 17 14198 1 1 51 CYS CB C -10.334 -5.570 1.123 1.00 . A B . 51 CYS CB 1 1 17 14199 1 1 51 CYS H H -8.777 -4.045 -0.289 1.00 . A B . 51 CYS H 1 1 17 14200 1 1 51 CYS HA H -10.312 -6.390 -0.857 1.00 . A B . 51 CYS HA 1 1 17 14201 1 1 51 CYS HB2 H -10.023 -4.636 1.567 1.00 . A B . 51 CYS HB2 1 1 17 14202 1 1 51 CYS HB3 H -11.316 -5.828 1.494 1.00 . A B . 51 CYS HB3 1 1 17 14203 1 1 51 CYS N N -9.292 -4.610 -0.904 1.00 . A B . 51 CYS N 1 1 17 14204 1 1 51 CYS O O -12.584 -5.507 -1.381 1.00 . A B . 51 CYS O 1 1 17 14205 1 1 51 CYS SG S -9.181 -6.854 1.674 1.00 . A B . 51 CYS SG 1 1 17 14206 1 1 52 ARG C C -13.134 -2.712 -2.637 1.00 . A B . 52 ARG C 1 1 17 14207 1 1 52 ARG CA C -13.084 -2.796 -1.112 1.00 . A B . 52 ARG CA 1 1 17 14208 1 1 52 ARG CB C -13.159 -1.387 -0.515 1.00 . A B . 52 ARG CB 1 1 17 14209 1 1 52 ARG CD C -13.465 0.052 1.523 1.00 . A B . 52 ARG CD 1 1 17 14210 1 1 52 ARG CG C -13.288 -1.364 1.001 1.00 . A B . 52 ARG CG 1 1 17 14211 1 1 52 ARG CZ C -14.187 1.095 3.639 1.00 . A B . 52 ARG CZ 1 1 17 14212 1 1 52 ARG H H -11.214 -2.995 -0.143 1.00 . A B . 52 ARG H 1 1 17 14213 1 1 52 ARG HA H -13.938 -3.363 -0.775 1.00 . A B . 52 ARG HA 1 1 17 14214 1 1 52 ARG HB2 H -12.265 -0.846 -0.786 1.00 . A B . 52 ARG HB2 1 1 17 14215 1 1 52 ARG HB3 H -14.016 -0.880 -0.935 1.00 . A B . 52 ARG HB3 1 1 17 14216 1 1 52 ARG HD2 H -12.589 0.630 1.266 1.00 . A B . 52 ARG HD2 1 1 17 14217 1 1 52 ARG HD3 H -14.335 0.490 1.056 1.00 . A B . 52 ARG HD3 1 1 17 14218 1 1 52 ARG HE H -13.334 -0.711 3.476 1.00 . A B . 52 ARG HE 1 1 17 14219 1 1 52 ARG HG2 H -14.146 -1.951 1.291 1.00 . A B . 52 ARG HG2 1 1 17 14220 1 1 52 ARG HG3 H -12.394 -1.788 1.435 1.00 . A B . 52 ARG HG3 1 1 17 14221 1 1 52 ARG HH11 H -14.533 2.225 1.987 1.00 . A B . 52 ARG HH11 1 1 17 14222 1 1 52 ARG HH12 H -15.039 2.931 3.488 1.00 . A B . 52 ARG HH12 1 1 17 14223 1 1 52 ARG HH21 H -13.987 0.228 5.463 1.00 . A B . 52 ARG HH21 1 1 17 14224 1 1 52 ARG HH22 H -14.708 1.806 5.464 1.00 . A B . 52 ARG HH22 1 1 17 14225 1 1 52 ARG N N -11.884 -3.495 -0.652 1.00 . A B . 52 ARG N 1 1 17 14226 1 1 52 ARG NE N -13.642 0.077 2.973 1.00 . A B . 52 ARG NE 1 1 17 14227 1 1 52 ARG NH1 N -14.619 2.171 2.985 1.00 . A B . 52 ARG NH1 1 1 17 14228 1 1 52 ARG NH2 N -14.306 1.037 4.960 1.00 . A B . 52 ARG NH2 1 1 17 14229 1 1 52 ARG O O -14.140 -2.291 -3.207 1.00 . A B . 52 ARG O 1 1 17 14230 1 1 53 MET C C -12.963 -4.213 -5.270 1.00 . A B . 53 MET C 1 1 17 14231 1 1 53 MET CA C -12.009 -3.144 -4.752 1.00 . A B . 53 MET CA 1 1 17 14232 1 1 53 MET CB C -10.584 -3.413 -5.251 1.00 . A B . 53 MET CB 1 1 17 14233 1 1 53 MET CE C -10.841 -2.737 -9.356 1.00 . A B . 53 MET CE 1 1 17 14234 1 1 53 MET CG C -10.481 -3.598 -6.756 1.00 . A B . 53 MET CG 1 1 17 14235 1 1 53 MET H H -11.257 -3.373 -2.783 1.00 . A B . 53 MET H 1 1 17 14236 1 1 53 MET HA H -12.336 -2.182 -5.116 1.00 . A B . 53 MET HA 1 1 17 14237 1 1 53 MET HB2 H -9.955 -2.579 -4.975 1.00 . A B . 53 MET HB2 1 1 17 14238 1 1 53 MET HB3 H -10.211 -4.307 -4.774 1.00 . A B . 53 MET HB3 1 1 17 14239 1 1 53 MET HE1 H -11.388 -3.656 -9.501 1.00 . A B . 53 MET HE1 1 1 17 14240 1 1 53 MET HE2 H -9.791 -2.912 -9.537 1.00 . A B . 53 MET HE2 1 1 17 14241 1 1 53 MET HE3 H -11.204 -1.989 -10.044 1.00 . A B . 53 MET HE3 1 1 17 14242 1 1 53 MET HG2 H -9.446 -3.773 -7.014 1.00 . A B . 53 MET HG2 1 1 17 14243 1 1 53 MET HG3 H -11.071 -4.457 -7.039 1.00 . A B . 53 MET HG3 1 1 17 14244 1 1 53 MET N N -12.049 -3.105 -3.292 1.00 . A B . 53 MET N 1 1 17 14245 1 1 53 MET O O -13.505 -4.108 -6.370 1.00 . A B . 53 MET O 1 1 17 14246 1 1 53 MET SD S -11.070 -2.164 -7.676 1.00 . A B . 53 MET SD 1 1 17 14247 1 1 54 LYS C C -15.418 -6.082 -4.072 1.00 . A B . 54 LYS C 1 1 17 14248 1 1 54 LYS CA C -14.098 -6.297 -4.805 1.00 . A B . 54 LYS CA 1 1 17 14249 1 1 54 LYS CB C -13.497 -7.664 -4.458 1.00 . A B . 54 LYS CB 1 1 17 14250 1 1 54 LYS CD C -14.514 -8.789 -6.460 1.00 . A B . 54 LYS CD 1 1 17 14251 1 1 54 LYS CE C -15.397 -9.918 -6.956 1.00 . A B . 54 LYS CE 1 1 17 14252 1 1 54 LYS CG C -14.327 -8.840 -4.953 1.00 . A B . 54 LYS CG 1 1 17 14253 1 1 54 LYS H H -12.713 -5.267 -3.598 1.00 . A B . 54 LYS H 1 1 17 14254 1 1 54 LYS HA H -14.277 -6.247 -5.869 1.00 . A B . 54 LYS HA 1 1 17 14255 1 1 54 LYS HB2 H -12.513 -7.735 -4.899 1.00 . A B . 54 LYS HB2 1 1 17 14256 1 1 54 LYS HB3 H -13.407 -7.739 -3.384 1.00 . A B . 54 LYS HB3 1 1 17 14257 1 1 54 LYS HD2 H -14.974 -7.849 -6.725 1.00 . A B . 54 LYS HD2 1 1 17 14258 1 1 54 LYS HD3 H -13.547 -8.863 -6.936 1.00 . A B . 54 LYS HD3 1 1 17 14259 1 1 54 LYS HE2 H -14.926 -10.859 -6.719 1.00 . A B . 54 LYS HE2 1 1 17 14260 1 1 54 LYS HE3 H -16.353 -9.856 -6.456 1.00 . A B . 54 LYS HE3 1 1 17 14261 1 1 54 LYS HG2 H -13.822 -9.758 -4.693 1.00 . A B . 54 LYS HG2 1 1 17 14262 1 1 54 LYS HG3 H -15.296 -8.811 -4.477 1.00 . A B . 54 LYS HG3 1 1 17 14263 1 1 54 LYS HZ1 H -16.132 -8.970 -8.665 1.00 . A B . 54 LYS HZ1 1 1 17 14264 1 1 54 LYS HZ2 H -16.165 -10.658 -8.746 1.00 . A B . 54 LYS HZ2 1 1 17 14265 1 1 54 LYS HZ3 H -14.701 -9.834 -8.920 1.00 . A B . 54 LYS HZ3 1 1 17 14266 1 1 54 LYS N N -13.175 -5.235 -4.460 1.00 . A B . 54 LYS N 1 1 17 14267 1 1 54 LYS NZ N -15.614 -9.841 -8.422 1.00 . A B . 54 LYS NZ 1 1 17 14268 1 1 54 LYS O O -15.775 -6.829 -3.159 1.00 . A B . 54 LYS O 1 1 17 14269 1 1 55 GLU C C -18.529 -5.412 -4.630 1.00 . A B . 55 GLU C 1 1 17 14270 1 1 55 GLU CA C -17.410 -4.714 -3.865 1.00 . A B . 55 GLU CA 1 1 17 14271 1 1 55 GLU CB C -17.634 -3.198 -3.831 1.00 . A B . 55 GLU CB 1 1 17 14272 1 1 55 GLU CD C -17.771 -1.045 -5.135 1.00 . A B . 55 GLU CD 1 1 17 14273 1 1 55 GLU CG C -17.382 -2.505 -5.160 1.00 . A B . 55 GLU CG 1 1 17 14274 1 1 55 GLU H H -15.766 -4.449 -5.161 1.00 . A B . 55 GLU H 1 1 17 14275 1 1 55 GLU HA H -17.403 -5.088 -2.852 1.00 . A B . 55 GLU HA 1 1 17 14276 1 1 55 GLU HB2 H -18.655 -3.006 -3.539 1.00 . A B . 55 GLU HB2 1 1 17 14277 1 1 55 GLU HB3 H -16.972 -2.766 -3.095 1.00 . A B . 55 GLU HB3 1 1 17 14278 1 1 55 GLU HG2 H -16.331 -2.576 -5.393 1.00 . A B . 55 GLU HG2 1 1 17 14279 1 1 55 GLU HG3 H -17.955 -3.004 -5.928 1.00 . A B . 55 GLU HG3 1 1 17 14280 1 1 55 GLU N N -16.121 -5.029 -4.456 1.00 . A B . 55 GLU N 1 1 17 14281 1 1 55 GLU O O -18.949 -4.968 -5.699 1.00 . A B . 55 GLU O 1 1 17 14282 1 1 55 GLU OE1 O -16.948 -0.213 -4.707 1.00 . A B . 55 GLU OE1 1 1 17 14283 1 1 55 GLU OE2 O -18.904 -0.719 -5.539 1.00 . A B . 55 GLU OE2 1 1 17 14284 1 1 56 SER C C -21.306 -7.251 -3.862 1.00 . A B . 56 SER C 1 1 17 14285 1 1 56 SER CA C -20.049 -7.279 -4.726 1.00 . A B . 56 SER CA 1 1 17 14286 1 1 56 SER CB C -19.586 -8.714 -4.957 1.00 . A B . 56 SER CB 1 1 17 14287 1 1 56 SER H H -18.620 -6.836 -3.241 1.00 . A B . 56 SER H 1 1 17 14288 1 1 56 SER HA H -20.266 -6.819 -5.678 1.00 . A B . 56 SER HA 1 1 17 14289 1 1 56 SER HB2 H -19.521 -9.228 -4.011 1.00 . A B . 56 SER HB2 1 1 17 14290 1 1 56 SER HB3 H -20.295 -9.220 -5.595 1.00 . A B . 56 SER HB3 1 1 17 14291 1 1 56 SER HG H -18.256 -8.033 -6.235 1.00 . A B . 56 SER HG 1 1 17 14292 1 1 56 SER N N -18.994 -6.520 -4.091 1.00 . A B . 56 SER N 1 1 17 14293 1 1 56 SER O O -21.539 -8.213 -3.100 1.00 . A B . 56 SER O 1 1 17 14294 1 1 56 SER OXT O -22.044 -6.248 -3.926 1.00 . A B . 56 SER OXT 1 1 17 14295 1 1 56 SER OG O -18.310 -8.743 -5.582 1.00 . A B . 56 SER OG 1 1 17 14296 2 2 1 ZN ZN ZN -7.121 -5.942 2.156 1.00 . B B . 101 ZN ZN 1 1 17 14297 3 2 1 ZN ZN ZN 5.923 0.910 -0.079 1.00 . C B . 102 ZN ZN 1 1 18 14298 1 1 1 GLY C C 10.216 -10.038 -6.763 1.00 . A B . 1 GLY C 1 1 18 14299 1 1 1 GLY CA C 11.653 -10.467 -6.977 1.00 . A B . 1 GLY CA 1 1 18 14300 1 1 1 GLY H1 H 13.589 -9.829 -6.533 1.00 . A B . 1 GLY H1 1 1 18 14301 1 1 1 GLY H2 H 12.457 -9.471 -5.331 1.00 . A B . 1 GLY H2 1 1 18 14302 1 1 1 GLY H3 H 12.486 -8.569 -6.759 1.00 . A B . 1 GLY H3 1 1 18 14303 1 1 1 GLY HA2 H 11.846 -10.521 -8.037 1.00 . A B . 1 GLY HA2 1 1 18 14304 1 1 1 GLY HA3 H 11.795 -11.446 -6.545 1.00 . A B . 1 GLY HA3 1 1 18 14305 1 1 1 GLY N N 12.613 -9.520 -6.357 1.00 . A B . 1 GLY N 1 1 18 14306 1 1 1 GLY O O 9.813 -8.958 -7.204 1.00 . A B . 1 GLY O 1 1 18 14307 1 1 2 ALA C C 7.587 -11.215 -4.510 1.00 . A B . 2 ALA C 1 1 18 14308 1 1 2 ALA CA C 8.044 -10.562 -5.809 1.00 . A B . 2 ALA CA 1 1 18 14309 1 1 2 ALA CB C 7.157 -11.005 -6.965 1.00 . A B . 2 ALA CB 1 1 18 14310 1 1 2 ALA H H 9.813 -11.728 -5.771 1.00 . A B . 2 ALA H 1 1 18 14311 1 1 2 ALA HA H 7.957 -9.491 -5.707 1.00 . A B . 2 ALA HA 1 1 18 14312 1 1 2 ALA HB1 H 7.518 -10.568 -7.885 1.00 . A B . 2 ALA HB1 1 1 18 14313 1 1 2 ALA HB2 H 6.143 -10.678 -6.787 1.00 . A B . 2 ALA HB2 1 1 18 14314 1 1 2 ALA HB3 H 7.178 -12.082 -7.045 1.00 . A B . 2 ALA HB3 1 1 18 14315 1 1 2 ALA N N 9.439 -10.874 -6.088 1.00 . A B . 2 ALA N 1 1 18 14316 1 1 2 ALA O O 6.397 -11.452 -4.307 1.00 . A B . 2 ALA O 1 1 18 14317 1 1 3 MET C C 9.327 -11.847 -1.346 1.00 . A B . 3 MET C 1 1 18 14318 1 1 3 MET CA C 8.218 -12.127 -2.354 1.00 . A B . 3 MET CA 1 1 18 14319 1 1 3 MET CB C 8.016 -13.639 -2.522 1.00 . A B . 3 MET CB 1 1 18 14320 1 1 3 MET CE C 8.933 -16.557 -1.447 1.00 . A B . 3 MET CE 1 1 18 14321 1 1 3 MET CG C 7.329 -14.299 -1.331 1.00 . A B . 3 MET CG 1 1 18 14322 1 1 3 MET H H 9.473 -11.296 -3.844 1.00 . A B . 3 MET H 1 1 18 14323 1 1 3 MET HA H 7.302 -11.687 -1.994 1.00 . A B . 3 MET HA 1 1 18 14324 1 1 3 MET HB2 H 7.414 -13.815 -3.403 1.00 . A B . 3 MET HB2 1 1 18 14325 1 1 3 MET HB3 H 8.980 -14.105 -2.658 1.00 . A B . 3 MET HB3 1 1 18 14326 1 1 3 MET HE1 H 9.376 -16.201 -0.528 1.00 . A B . 3 MET HE1 1 1 18 14327 1 1 3 MET HE2 H 9.450 -16.118 -2.288 1.00 . A B . 3 MET HE2 1 1 18 14328 1 1 3 MET HE3 H 9.017 -17.632 -1.494 1.00 . A B . 3 MET HE3 1 1 18 14329 1 1 3 MET HG2 H 7.892 -14.076 -0.438 1.00 . A B . 3 MET HG2 1 1 18 14330 1 1 3 MET HG3 H 6.333 -13.892 -1.235 1.00 . A B . 3 MET HG3 1 1 18 14331 1 1 3 MET N N 8.536 -11.508 -3.633 1.00 . A B . 3 MET N 1 1 18 14332 1 1 3 MET O O 9.781 -12.738 -0.626 1.00 . A B . 3 MET O 1 1 18 14333 1 1 3 MET SD S 7.204 -16.091 -1.496 1.00 . A B . 3 MET SD 1 1 18 14334 1 1 4 GLY C C 10.306 -9.662 0.906 1.00 . A B . 4 GLY C 1 1 18 14335 1 1 4 GLY CA C 10.833 -10.229 -0.396 1.00 . A B . 4 GLY CA 1 1 18 14336 1 1 4 GLY H H 9.351 -9.919 -1.875 1.00 . A B . 4 GLY H 1 1 18 14337 1 1 4 GLY HA2 H 11.429 -11.103 -0.184 1.00 . A B . 4 GLY HA2 1 1 18 14338 1 1 4 GLY HA3 H 11.457 -9.486 -0.873 1.00 . A B . 4 GLY HA3 1 1 18 14339 1 1 4 GLY N N 9.766 -10.600 -1.300 1.00 . A B . 4 GLY N 1 1 18 14340 1 1 4 GLY O O 9.359 -8.871 0.902 1.00 . A B . 4 GLY O 1 1 18 14341 1 1 5 MET C C 10.918 -8.090 3.444 1.00 . A B . 5 MET C 1 1 18 14342 1 1 5 MET CA C 10.522 -9.555 3.328 1.00 . A B . 5 MET CA 1 1 18 14343 1 1 5 MET CB C 11.178 -10.363 4.455 1.00 . A B . 5 MET CB 1 1 18 14344 1 1 5 MET CE C 11.030 -11.763 7.297 1.00 . A B . 5 MET CE 1 1 18 14345 1 1 5 MET CG C 10.698 -11.805 4.537 1.00 . A B . 5 MET CG 1 1 18 14346 1 1 5 MET H H 11.619 -10.742 1.960 1.00 . A B . 5 MET H 1 1 18 14347 1 1 5 MET HA H 9.448 -9.633 3.414 1.00 . A B . 5 MET HA 1 1 18 14348 1 1 5 MET HB2 H 12.247 -10.370 4.303 1.00 . A B . 5 MET HB2 1 1 18 14349 1 1 5 MET HB3 H 10.962 -9.879 5.397 1.00 . A B . 5 MET HB3 1 1 18 14350 1 1 5 MET HE1 H 11.426 -12.226 8.189 1.00 . A B . 5 MET HE1 1 1 18 14351 1 1 5 MET HE2 H 9.954 -11.719 7.363 1.00 . A B . 5 MET HE2 1 1 18 14352 1 1 5 MET HE3 H 11.428 -10.764 7.204 1.00 . A B . 5 MET HE3 1 1 18 14353 1 1 5 MET HG2 H 9.633 -11.808 4.712 1.00 . A B . 5 MET HG2 1 1 18 14354 1 1 5 MET HG3 H 10.908 -12.295 3.598 1.00 . A B . 5 MET HG3 1 1 18 14355 1 1 5 MET N N 10.902 -10.074 2.020 1.00 . A B . 5 MET N 1 1 18 14356 1 1 5 MET O O 12.092 -7.749 3.304 1.00 . A B . 5 MET O 1 1 18 14357 1 1 5 MET SD S 11.500 -12.732 5.864 1.00 . A B . 5 MET SD 1 1 18 14358 1 1 6 ARG C C 10.774 -5.266 2.488 1.00 . A B . 6 ARG C 1 1 18 14359 1 1 6 ARG CA C 10.139 -5.793 3.767 1.00 . A B . 6 ARG CA 1 1 18 14360 1 1 6 ARG CB C 10.997 -5.428 4.982 1.00 . A B . 6 ARG CB 1 1 18 14361 1 1 6 ARG CD C 9.142 -4.591 6.457 1.00 . A B . 6 ARG CD 1 1 18 14362 1 1 6 ARG CG C 10.276 -5.596 6.308 1.00 . A B . 6 ARG CG 1 1 18 14363 1 1 6 ARG CZ C 7.770 -3.921 8.397 1.00 . A B . 6 ARG CZ 1 1 18 14364 1 1 6 ARG H H 9.025 -7.586 3.843 1.00 . A B . 6 ARG H 1 1 18 14365 1 1 6 ARG HA H 9.169 -5.333 3.877 1.00 . A B . 6 ARG HA 1 1 18 14366 1 1 6 ARG HB2 H 11.872 -6.060 4.992 1.00 . A B . 6 ARG HB2 1 1 18 14367 1 1 6 ARG HB3 H 11.308 -4.398 4.892 1.00 . A B . 6 ARG HB3 1 1 18 14368 1 1 6 ARG HD2 H 9.566 -3.602 6.552 1.00 . A B . 6 ARG HD2 1 1 18 14369 1 1 6 ARG HD3 H 8.522 -4.631 5.575 1.00 . A B . 6 ARG HD3 1 1 18 14370 1 1 6 ARG HE H 8.142 -5.809 7.848 1.00 . A B . 6 ARG HE 1 1 18 14371 1 1 6 ARG HG2 H 9.869 -6.594 6.361 1.00 . A B . 6 ARG HG2 1 1 18 14372 1 1 6 ARG HG3 H 10.983 -5.452 7.112 1.00 . A B . 6 ARG HG3 1 1 18 14373 1 1 6 ARG HH11 H 8.611 -2.368 7.397 1.00 . A B . 6 ARG HH11 1 1 18 14374 1 1 6 ARG HH12 H 7.604 -1.929 8.735 1.00 . A B . 6 ARG HH12 1 1 18 14375 1 1 6 ARG HH21 H 6.820 -5.235 9.613 1.00 . A B . 6 ARG HH21 1 1 18 14376 1 1 6 ARG HH22 H 6.575 -3.560 9.998 1.00 . A B . 6 ARG HH22 1 1 18 14377 1 1 6 ARG N N 9.928 -7.234 3.694 1.00 . A B . 6 ARG N 1 1 18 14378 1 1 6 ARG NE N 8.315 -4.864 7.631 1.00 . A B . 6 ARG NE 1 1 18 14379 1 1 6 ARG NH1 N 8.014 -2.638 8.156 1.00 . A B . 6 ARG NH1 1 1 18 14380 1 1 6 ARG NH2 N 6.993 -4.266 9.418 1.00 . A B . 6 ARG NH2 1 1 18 14381 1 1 6 ARG O O 11.725 -4.480 2.526 1.00 . A B . 6 ARG O 1 1 18 14382 1 1 7 ASN C C 10.109 -3.878 -0.247 1.00 . A B . 7 ASN C 1 1 18 14383 1 1 7 ASN CA C 10.721 -5.232 0.064 1.00 . A B . 7 ASN CA 1 1 18 14384 1 1 7 ASN CB C 10.417 -6.238 -1.052 1.00 . A B . 7 ASN CB 1 1 18 14385 1 1 7 ASN CG C 10.942 -5.784 -2.409 1.00 . A B . 7 ASN CG 1 1 18 14386 1 1 7 ASN H H 9.501 -6.341 1.392 1.00 . A B . 7 ASN H 1 1 18 14387 1 1 7 ASN HA H 11.791 -5.110 0.142 1.00 . A B . 7 ASN HA 1 1 18 14388 1 1 7 ASN HB2 H 10.872 -7.187 -0.809 1.00 . A B . 7 ASN HB2 1 1 18 14389 1 1 7 ASN HB3 H 9.347 -6.366 -1.127 1.00 . A B . 7 ASN HB3 1 1 18 14390 1 1 7 ASN HD21 H 12.751 -6.491 -1.993 1.00 . A B . 7 ASN HD21 1 1 18 14391 1 1 7 ASN HD22 H 12.575 -5.741 -3.541 1.00 . A B . 7 ASN HD22 1 1 18 14392 1 1 7 ASN N N 10.240 -5.700 1.355 1.00 . A B . 7 ASN N 1 1 18 14393 1 1 7 ASN ND2 N 12.216 -6.032 -2.674 1.00 . A B . 7 ASN ND2 1 1 18 14394 1 1 7 ASN O O 9.146 -3.758 -1.003 1.00 . A B . 7 ASN O 1 1 18 14395 1 1 7 ASN OD1 O 10.212 -5.201 -3.208 1.00 . A B . 7 ASN OD1 1 1 18 14396 1 1 8 LEU C C 11.430 -0.633 -0.168 1.00 . A B . 8 LEU C 1 1 18 14397 1 1 8 LEU CA C 10.229 -1.499 0.178 1.00 . A B . 8 LEU CA 1 1 18 14398 1 1 8 LEU CB C 9.477 -0.970 1.408 1.00 . A B . 8 LEU CB 1 1 18 14399 1 1 8 LEU CD1 C 11.279 -0.619 3.136 1.00 . A B . 8 LEU CD1 1 1 18 14400 1 1 8 LEU CD2 C 8.971 -1.264 3.847 1.00 . A B . 8 LEU CD2 1 1 18 14401 1 1 8 LEU CG C 10.033 -1.407 2.768 1.00 . A B . 8 LEU CG 1 1 18 14402 1 1 8 LEU H H 11.361 -3.050 1.050 1.00 . A B . 8 LEU H 1 1 18 14403 1 1 8 LEU HA H 9.559 -1.502 -0.667 1.00 . A B . 8 LEU HA 1 1 18 14404 1 1 8 LEU HB2 H 9.492 0.109 1.370 1.00 . A B . 8 LEU HB2 1 1 18 14405 1 1 8 LEU HB3 H 8.451 -1.300 1.344 1.00 . A B . 8 LEU HB3 1 1 18 14406 1 1 8 LEU HD11 H 11.033 0.431 3.202 1.00 . A B . 8 LEU HD11 1 1 18 14407 1 1 8 LEU HD12 H 12.034 -0.764 2.379 1.00 . A B . 8 LEU HD12 1 1 18 14408 1 1 8 LEU HD13 H 11.652 -0.961 4.089 1.00 . A B . 8 LEU HD13 1 1 18 14409 1 1 8 LEU HD21 H 9.376 -1.581 4.797 1.00 . A B . 8 LEU HD21 1 1 18 14410 1 1 8 LEU HD22 H 8.118 -1.879 3.596 1.00 . A B . 8 LEU HD22 1 1 18 14411 1 1 8 LEU HD23 H 8.662 -0.232 3.914 1.00 . A B . 8 LEU HD23 1 1 18 14412 1 1 8 LEU HG H 10.311 -2.450 2.712 1.00 . A B . 8 LEU HG 1 1 18 14413 1 1 8 LEU N N 10.653 -2.866 0.394 1.00 . A B . 8 LEU N 1 1 18 14414 1 1 8 LEU O O 11.382 0.596 -0.096 1.00 . A B . 8 LEU O 1 1 18 14415 1 1 9 ASP C C 13.498 -0.003 -2.359 1.00 . A B . 9 ASP C 1 1 18 14416 1 1 9 ASP CA C 13.725 -0.634 -0.997 1.00 . A B . 9 ASP CA 1 1 18 14417 1 1 9 ASP CB C 14.892 -1.623 -1.071 1.00 . A B . 9 ASP CB 1 1 18 14418 1 1 9 ASP CG C 15.281 -2.181 0.281 1.00 . A B . 9 ASP CG 1 1 18 14419 1 1 9 ASP H H 12.456 -2.281 -0.588 1.00 . A B . 9 ASP H 1 1 18 14420 1 1 9 ASP HA H 13.955 0.140 -0.282 1.00 . A B . 9 ASP HA 1 1 18 14421 1 1 9 ASP HB2 H 14.614 -2.448 -1.708 1.00 . A B . 9 ASP HB2 1 1 18 14422 1 1 9 ASP HB3 H 15.751 -1.124 -1.494 1.00 . A B . 9 ASP HB3 1 1 18 14423 1 1 9 ASP N N 12.502 -1.303 -0.568 1.00 . A B . 9 ASP N 1 1 18 14424 1 1 9 ASP O O 14.029 1.064 -2.670 1.00 . A B . 9 ASP O 1 1 18 14425 1 1 9 ASP OD1 O 14.627 -3.136 0.749 1.00 . A B . 9 ASP OD1 1 1 18 14426 1 1 9 ASP OD2 O 16.243 -1.663 0.889 1.00 . A B . 9 ASP OD2 1 1 18 14427 1 1 10 GLU C C 11.068 0.668 -4.420 1.00 . A B . 10 GLU C 1 1 18 14428 1 1 10 GLU CA C 12.319 -0.196 -4.485 1.00 . A B . 10 GLU CA 1 1 18 14429 1 1 10 GLU CB C 12.085 -1.372 -5.434 1.00 . A B . 10 GLU CB 1 1 18 14430 1 1 10 GLU CD C 10.571 -3.264 -6.122 1.00 . A B . 10 GLU CD 1 1 18 14431 1 1 10 GLU CG C 10.898 -2.247 -5.055 1.00 . A B . 10 GLU CG 1 1 18 14432 1 1 10 GLU H H 12.302 -1.520 -2.840 1.00 . A B . 10 GLU H 1 1 18 14433 1 1 10 GLU HA H 13.138 0.401 -4.855 1.00 . A B . 10 GLU HA 1 1 18 14434 1 1 10 GLU HB2 H 11.916 -0.987 -6.427 1.00 . A B . 10 GLU HB2 1 1 18 14435 1 1 10 GLU HB3 H 12.969 -1.991 -5.443 1.00 . A B . 10 GLU HB3 1 1 18 14436 1 1 10 GLU HG2 H 11.128 -2.771 -4.140 1.00 . A B . 10 GLU HG2 1 1 18 14437 1 1 10 GLU HG3 H 10.035 -1.616 -4.901 1.00 . A B . 10 GLU HG3 1 1 18 14438 1 1 10 GLU N N 12.676 -0.673 -3.157 1.00 . A B . 10 GLU N 1 1 18 14439 1 1 10 GLU O O 10.512 1.063 -5.446 1.00 . A B . 10 GLU O 1 1 18 14440 1 1 10 GLU OE1 O 11.335 -4.244 -6.270 1.00 . A B . 10 GLU OE1 1 1 18 14441 1 1 10 GLU OE2 O 9.551 -3.093 -6.819 1.00 . A B . 10 GLU OE2 1 1 18 14442 1 1 11 CYS C C 9.850 3.147 -2.593 1.00 . A B . 11 CYS C 1 1 18 14443 1 1 11 CYS CA C 9.436 1.746 -2.998 1.00 . A B . 11 CYS CA 1 1 18 14444 1 1 11 CYS CB C 8.559 1.106 -1.923 1.00 . A B . 11 CYS CB 1 1 18 14445 1 1 11 CYS H H 11.138 0.646 -2.429 1.00 . A B . 11 CYS H 1 1 18 14446 1 1 11 CYS HA H 8.893 1.788 -3.929 1.00 . A B . 11 CYS HA 1 1 18 14447 1 1 11 CYS HB2 H 8.406 0.071 -2.174 1.00 . A B . 11 CYS HB2 1 1 18 14448 1 1 11 CYS HB3 H 9.076 1.165 -0.977 1.00 . A B . 11 CYS HB3 1 1 18 14449 1 1 11 CYS N N 10.626 0.951 -3.205 1.00 . A B . 11 CYS N 1 1 18 14450 1 1 11 CYS O O 10.075 3.432 -1.413 1.00 . A B . 11 CYS O 1 1 18 14451 1 1 11 CYS SG S 6.929 1.865 -1.708 1.00 . A B . 11 CYS SG 1 1 18 14452 1 1 12 GLU C C 9.424 6.105 -2.463 1.00 . A B . 12 GLU C 1 1 18 14453 1 1 12 GLU CA C 10.395 5.381 -3.373 1.00 . A B . 12 GLU CA 1 1 18 14454 1 1 12 GLU CB C 10.486 6.105 -4.710 1.00 . A B . 12 GLU CB 1 1 18 14455 1 1 12 GLU CD C 11.407 6.126 -7.057 1.00 . A B . 12 GLU CD 1 1 18 14456 1 1 12 GLU CG C 11.295 5.358 -5.759 1.00 . A B . 12 GLU CG 1 1 18 14457 1 1 12 GLU H H 9.765 3.715 -4.498 1.00 . A B . 12 GLU H 1 1 18 14458 1 1 12 GLU HA H 11.366 5.364 -2.909 1.00 . A B . 12 GLU HA 1 1 18 14459 1 1 12 GLU HB2 H 9.485 6.248 -5.093 1.00 . A B . 12 GLU HB2 1 1 18 14460 1 1 12 GLU HB3 H 10.942 7.070 -4.554 1.00 . A B . 12 GLU HB3 1 1 18 14461 1 1 12 GLU HG2 H 12.290 5.186 -5.375 1.00 . A B . 12 GLU HG2 1 1 18 14462 1 1 12 GLU HG3 H 10.818 4.410 -5.958 1.00 . A B . 12 GLU HG3 1 1 18 14463 1 1 12 GLU N N 9.964 4.011 -3.585 1.00 . A B . 12 GLU N 1 1 18 14464 1 1 12 GLU O O 9.813 6.961 -1.668 1.00 . A B . 12 GLU O 1 1 18 14465 1 1 12 GLU OE1 O 10.388 6.252 -7.769 1.00 . A B . 12 GLU OE1 1 1 18 14466 1 1 12 GLU OE2 O 12.512 6.614 -7.372 1.00 . A B . 12 GLU OE2 1 1 18 14467 1 1 13 VAL C C 7.219 5.988 -0.310 1.00 . A B . 13 VAL C 1 1 18 14468 1 1 13 VAL CA C 7.128 6.375 -1.792 1.00 . A B . 13 VAL CA 1 1 18 14469 1 1 13 VAL CB C 5.726 6.094 -2.382 1.00 . A B . 13 VAL CB 1 1 18 14470 1 1 13 VAL CG1 C 5.475 4.612 -2.545 1.00 . A B . 13 VAL CG1 1 1 18 14471 1 1 13 VAL CG2 C 4.641 6.730 -1.532 1.00 . A B . 13 VAL CG2 1 1 18 14472 1 1 13 VAL H H 7.926 5.004 -3.175 1.00 . A B . 13 VAL H 1 1 18 14473 1 1 13 VAL HA H 7.304 7.436 -1.865 1.00 . A B . 13 VAL HA 1 1 18 14474 1 1 13 VAL HB H 5.685 6.542 -3.363 1.00 . A B . 13 VAL HB 1 1 18 14475 1 1 13 VAL HG11 H 4.501 4.461 -2.984 1.00 . A B . 13 VAL HG11 1 1 18 14476 1 1 13 VAL HG12 H 5.511 4.132 -1.579 1.00 . A B . 13 VAL HG12 1 1 18 14477 1 1 13 VAL HG13 H 6.228 4.186 -3.189 1.00 . A B . 13 VAL HG13 1 1 18 14478 1 1 13 VAL HG21 H 4.594 6.223 -0.581 1.00 . A B . 13 VAL HG21 1 1 18 14479 1 1 13 VAL HG22 H 3.692 6.645 -2.037 1.00 . A B . 13 VAL HG22 1 1 18 14480 1 1 13 VAL HG23 H 4.875 7.772 -1.374 1.00 . A B . 13 VAL HG23 1 1 18 14481 1 1 13 VAL N N 8.163 5.733 -2.566 1.00 . A B . 13 VAL N 1 1 18 14482 1 1 13 VAL O O 6.962 6.816 0.556 1.00 . A B . 13 VAL O 1 1 18 14483 1 1 14 CYS C C 9.036 5.158 1.947 1.00 . A B . 14 CYS C 1 1 18 14484 1 1 14 CYS CA C 7.879 4.358 1.381 1.00 . A B . 14 CYS CA 1 1 18 14485 1 1 14 CYS CB C 8.213 2.873 1.505 1.00 . A B . 14 CYS CB 1 1 18 14486 1 1 14 CYS H H 7.744 4.093 -0.731 1.00 . A B . 14 CYS H 1 1 18 14487 1 1 14 CYS HA H 6.991 4.570 1.955 1.00 . A B . 14 CYS HA 1 1 18 14488 1 1 14 CYS HB2 H 8.563 2.513 0.551 1.00 . A B . 14 CYS HB2 1 1 18 14489 1 1 14 CYS HB3 H 8.996 2.751 2.237 1.00 . A B . 14 CYS HB3 1 1 18 14490 1 1 14 CYS N N 7.623 4.751 -0.011 1.00 . A B . 14 CYS N 1 1 18 14491 1 1 14 CYS O O 9.037 5.547 3.114 1.00 . A B . 14 CYS O 1 1 18 14492 1 1 14 CYS SG S 6.825 1.834 2.004 1.00 . A B . 14 CYS SG 1 1 18 14493 1 1 15 ARG C C 10.829 7.598 1.769 1.00 . A B . 15 ARG C 1 1 18 14494 1 1 15 ARG CA C 11.195 6.149 1.485 1.00 . A B . 15 ARG CA 1 1 18 14495 1 1 15 ARG CB C 12.250 6.044 0.386 1.00 . A B . 15 ARG CB 1 1 18 14496 1 1 15 ARG CD C 13.463 4.415 -1.123 1.00 . A B . 15 ARG CD 1 1 18 14497 1 1 15 ARG CG C 12.786 4.630 0.222 1.00 . A B . 15 ARG CG 1 1 18 14498 1 1 15 ARG CZ C 15.539 5.146 -2.234 1.00 . A B . 15 ARG CZ 1 1 18 14499 1 1 15 ARG H H 9.932 5.066 0.179 1.00 . A B . 15 ARG H 1 1 18 14500 1 1 15 ARG HA H 11.583 5.708 2.387 1.00 . A B . 15 ARG HA 1 1 18 14501 1 1 15 ARG HB2 H 11.812 6.358 -0.551 1.00 . A B . 15 ARG HB2 1 1 18 14502 1 1 15 ARG HB3 H 13.075 6.695 0.628 1.00 . A B . 15 ARG HB3 1 1 18 14503 1 1 15 ARG HD2 H 13.872 3.415 -1.145 1.00 . A B . 15 ARG HD2 1 1 18 14504 1 1 15 ARG HD3 H 12.722 4.511 -1.899 1.00 . A B . 15 ARG HD3 1 1 18 14505 1 1 15 ARG HE H 14.513 6.227 -0.894 1.00 . A B . 15 ARG HE 1 1 18 14506 1 1 15 ARG HG2 H 13.502 4.437 1.005 1.00 . A B . 15 ARG HG2 1 1 18 14507 1 1 15 ARG HG3 H 11.961 3.938 0.313 1.00 . A B . 15 ARG HG3 1 1 18 14508 1 1 15 ARG HH11 H 14.927 3.274 -2.732 1.00 . A B . 15 ARG HH11 1 1 18 14509 1 1 15 ARG HH12 H 16.370 3.820 -3.523 1.00 . A B . 15 ARG HH12 1 1 18 14510 1 1 15 ARG HH21 H 16.413 6.954 -1.952 1.00 . A B . 15 ARG HH21 1 1 18 14511 1 1 15 ARG HH22 H 17.213 5.915 -3.088 1.00 . A B . 15 ARG HH22 1 1 18 14512 1 1 15 ARG N N 10.015 5.401 1.099 1.00 . A B . 15 ARG N 1 1 18 14513 1 1 15 ARG NE N 14.542 5.369 -1.378 1.00 . A B . 15 ARG NE 1 1 18 14514 1 1 15 ARG NH1 N 15.617 3.988 -2.883 1.00 . A B . 15 ARG NH1 1 1 18 14515 1 1 15 ARG NH2 N 16.461 6.079 -2.440 1.00 . A B . 15 ARG NH2 1 1 18 14516 1 1 15 ARG O O 11.389 8.231 2.663 1.00 . A B . 15 ARG O 1 1 18 14517 1 1 16 ASP C C 8.417 9.492 2.438 1.00 . A B . 16 ASP C 1 1 18 14518 1 1 16 ASP CA C 9.352 9.455 1.225 1.00 . A B . 16 ASP CA 1 1 18 14519 1 1 16 ASP CB C 8.627 9.952 -0.034 1.00 . A B . 16 ASP CB 1 1 18 14520 1 1 16 ASP CG C 7.938 11.289 0.165 1.00 . A B . 16 ASP CG 1 1 18 14521 1 1 16 ASP H H 9.571 7.592 0.226 1.00 . A B . 16 ASP H 1 1 18 14522 1 1 16 ASP HA H 10.191 10.103 1.424 1.00 . A B . 16 ASP HA 1 1 18 14523 1 1 16 ASP HB2 H 9.346 10.063 -0.832 1.00 . A B . 16 ASP HB2 1 1 18 14524 1 1 16 ASP HB3 H 7.884 9.224 -0.325 1.00 . A B . 16 ASP HB3 1 1 18 14525 1 1 16 ASP N N 9.882 8.111 1.001 1.00 . A B . 16 ASP N 1 1 18 14526 1 1 16 ASP O O 8.131 10.556 2.987 1.00 . A B . 16 ASP O 1 1 18 14527 1 1 16 ASP OD1 O 8.644 12.315 0.292 1.00 . A B . 16 ASP OD1 1 1 18 14528 1 1 16 ASP OD2 O 6.688 11.320 0.189 1.00 . A B . 16 ASP OD2 1 1 18 14529 1 1 17 GLY C C 5.631 8.228 3.649 1.00 . A B . 17 GLY C 1 1 18 14530 1 1 17 GLY CA C 7.097 8.251 4.036 1.00 . A B . 17 GLY CA 1 1 18 14531 1 1 17 GLY H H 8.268 7.500 2.435 1.00 . A B . 17 GLY H 1 1 18 14532 1 1 17 GLY HA2 H 7.326 7.353 4.593 1.00 . A B . 17 GLY HA2 1 1 18 14533 1 1 17 GLY HA3 H 7.278 9.109 4.667 1.00 . A B . 17 GLY HA3 1 1 18 14534 1 1 17 GLY N N 7.980 8.322 2.884 1.00 . A B . 17 GLY N 1 1 18 14535 1 1 17 GLY O O 4.765 8.607 4.440 1.00 . A B . 17 GLY O 1 1 18 14536 1 1 18 GLY C C 3.153 6.722 2.746 1.00 . A B . 18 GLY C 1 1 18 14537 1 1 18 GLY CA C 3.992 7.695 1.941 1.00 . A B . 18 GLY CA 1 1 18 14538 1 1 18 GLY H H 6.106 7.564 1.828 1.00 . A B . 18 GLY H 1 1 18 14539 1 1 18 GLY HA2 H 3.532 8.669 1.989 1.00 . A B . 18 GLY HA2 1 1 18 14540 1 1 18 GLY HA3 H 4.010 7.370 0.913 1.00 . A B . 18 GLY HA3 1 1 18 14541 1 1 18 GLY N N 5.358 7.797 2.424 1.00 . A B . 18 GLY N 1 1 18 14542 1 1 18 GLY O O 3.683 5.877 3.469 1.00 . A B . 18 GLY O 1 1 18 14543 1 1 19 GLU C C 0.402 4.841 2.623 1.00 . A B . 19 GLU C 1 1 18 14544 1 1 19 GLU CA C 0.907 6.055 3.396 1.00 . A B . 19 GLU CA 1 1 18 14545 1 1 19 GLU CB C -0.268 6.941 3.809 1.00 . A B . 19 GLU CB 1 1 18 14546 1 1 19 GLU CD C -0.999 9.041 5.006 1.00 . A B . 19 GLU CD 1 1 18 14547 1 1 19 GLU CG C 0.108 8.032 4.805 1.00 . A B . 19 GLU CG 1 1 18 14548 1 1 19 GLU H H 1.490 7.454 1.929 1.00 . A B . 19 GLU H 1 1 18 14549 1 1 19 GLU HA H 1.420 5.717 4.280 1.00 . A B . 19 GLU HA 1 1 18 14550 1 1 19 GLU HB2 H -0.665 7.418 2.926 1.00 . A B . 19 GLU HB2 1 1 18 14551 1 1 19 GLU HB3 H -1.038 6.324 4.250 1.00 . A B . 19 GLU HB3 1 1 18 14552 1 1 19 GLU HG2 H 0.332 7.575 5.758 1.00 . A B . 19 GLU HG2 1 1 18 14553 1 1 19 GLU HG3 H 0.983 8.549 4.441 1.00 . A B . 19 GLU HG3 1 1 18 14554 1 1 19 GLU N N 1.844 6.835 2.602 1.00 . A B . 19 GLU N 1 1 18 14555 1 1 19 GLU O O 0.326 4.858 1.394 1.00 . A B . 19 GLU O 1 1 18 14556 1 1 19 GLU OE1 O -1.898 8.777 5.831 1.00 . A B . 19 GLU OE1 1 1 18 14557 1 1 19 GLU OE2 O -0.984 10.097 4.342 1.00 . A B . 19 GLU OE2 1 1 18 14558 1 1 20 LEU C C -2.003 2.565 2.964 1.00 . A B . 20 LEU C 1 1 18 14559 1 1 20 LEU CA C -0.492 2.579 2.787 1.00 . A B . 20 LEU CA 1 1 18 14560 1 1 20 LEU CB C 0.107 1.340 3.455 1.00 . A B . 20 LEU CB 1 1 18 14561 1 1 20 LEU CD1 C 2.099 -0.121 3.848 1.00 . A B . 20 LEU CD1 1 1 18 14562 1 1 20 LEU CD2 C 1.273 0.236 1.529 1.00 . A B . 20 LEU CD2 1 1 18 14563 1 1 20 LEU CG C 1.454 0.874 2.900 1.00 . A B . 20 LEU CG 1 1 18 14564 1 1 20 LEU H H 0.213 3.835 4.331 1.00 . A B . 20 LEU H 1 1 18 14565 1 1 20 LEU HA H -0.256 2.565 1.735 1.00 . A B . 20 LEU HA 1 1 18 14566 1 1 20 LEU HB2 H 0.232 1.552 4.507 1.00 . A B . 20 LEU HB2 1 1 18 14567 1 1 20 LEU HB3 H -0.599 0.530 3.352 1.00 . A B . 20 LEU HB3 1 1 18 14568 1 1 20 LEU HD11 H 1.452 -0.978 3.962 1.00 . A B . 20 LEU HD11 1 1 18 14569 1 1 20 LEU HD12 H 2.253 0.345 4.808 1.00 . A B . 20 LEU HD12 1 1 18 14570 1 1 20 LEU HD13 H 3.048 -0.439 3.445 1.00 . A B . 20 LEU HD13 1 1 18 14571 1 1 20 LEU HD21 H 0.591 -0.596 1.606 1.00 . A B . 20 LEU HD21 1 1 18 14572 1 1 20 LEU HD22 H 2.229 -0.118 1.169 1.00 . A B . 20 LEU HD22 1 1 18 14573 1 1 20 LEU HD23 H 0.878 0.965 0.837 1.00 . A B . 20 LEU HD23 1 1 18 14574 1 1 20 LEU HG H 2.114 1.725 2.797 1.00 . A B . 20 LEU HG 1 1 18 14575 1 1 20 LEU N N 0.075 3.791 3.363 1.00 . A B . 20 LEU N 1 1 18 14576 1 1 20 LEU O O -2.512 2.902 4.034 1.00 . A B . 20 LEU O 1 1 18 14577 1 1 21 PHE C C -4.618 0.640 1.852 1.00 . A B . 21 PHE C 1 1 18 14578 1 1 21 PHE CA C -4.176 2.092 1.999 1.00 . A B . 21 PHE CA 1 1 18 14579 1 1 21 PHE CB C -4.821 2.977 0.926 1.00 . A B . 21 PHE CB 1 1 18 14580 1 1 21 PHE CD1 C -4.964 5.233 2.020 1.00 . A B . 21 PHE CD1 1 1 18 14581 1 1 21 PHE CD2 C -3.443 4.954 0.203 1.00 . A B . 21 PHE CD2 1 1 18 14582 1 1 21 PHE CE1 C -4.568 6.547 2.151 1.00 . A B . 21 PHE CE1 1 1 18 14583 1 1 21 PHE CE2 C -3.049 6.270 0.330 1.00 . A B . 21 PHE CE2 1 1 18 14584 1 1 21 PHE CG C -4.406 4.418 1.047 1.00 . A B . 21 PHE CG 1 1 18 14585 1 1 21 PHE CZ C -3.613 7.067 1.305 1.00 . A B . 21 PHE CZ 1 1 18 14586 1 1 21 PHE H H -2.270 1.964 1.075 1.00 . A B . 21 PHE H 1 1 18 14587 1 1 21 PHE HA H -4.474 2.446 2.977 1.00 . A B . 21 PHE HA 1 1 18 14588 1 1 21 PHE HB2 H -4.532 2.621 -0.053 1.00 . A B . 21 PHE HB2 1 1 18 14589 1 1 21 PHE HB3 H -5.898 2.927 1.021 1.00 . A B . 21 PHE HB3 1 1 18 14590 1 1 21 PHE HD1 H -5.713 4.831 2.685 1.00 . A B . 21 PHE HD1 1 1 18 14591 1 1 21 PHE HD2 H -2.998 4.335 -0.564 1.00 . A B . 21 PHE HD2 1 1 18 14592 1 1 21 PHE HE1 H -5.010 7.169 2.914 1.00 . A B . 21 PHE HE1 1 1 18 14593 1 1 21 PHE HE2 H -2.299 6.675 -0.332 1.00 . A B . 21 PHE HE2 1 1 18 14594 1 1 21 PHE HZ H -3.305 8.096 1.407 1.00 . A B . 21 PHE HZ 1 1 18 14595 1 1 21 PHE N N -2.722 2.183 1.922 1.00 . A B . 21 PHE N 1 1 18 14596 1 1 21 PHE O O -5.673 0.335 1.293 1.00 . A B . 21 PHE O 1 1 18 14597 1 1 22 CYS C C -3.745 -2.331 3.635 1.00 . A B . 22 CYS C 1 1 18 14598 1 1 22 CYS CA C -4.049 -1.673 2.305 1.00 . A B . 22 CYS CA 1 1 18 14599 1 1 22 CYS CB C -3.193 -2.322 1.221 1.00 . A B . 22 CYS CB 1 1 18 14600 1 1 22 CYS H H -2.979 0.063 2.816 1.00 . A B . 22 CYS H 1 1 18 14601 1 1 22 CYS HA H -5.092 -1.816 2.067 1.00 . A B . 22 CYS HA 1 1 18 14602 1 1 22 CYS HB2 H -2.179 -1.952 1.307 1.00 . A B . 22 CYS HB2 1 1 18 14603 1 1 22 CYS HB3 H -3.192 -3.393 1.363 1.00 . A B . 22 CYS HB3 1 1 18 14604 1 1 22 CYS N N -3.791 -0.250 2.369 1.00 . A B . 22 CYS N 1 1 18 14605 1 1 22 CYS O O -3.009 -1.783 4.456 1.00 . A B . 22 CYS O 1 1 18 14606 1 1 22 CYS SG S -3.745 -1.994 -0.475 1.00 . A B . 22 CYS SG 1 1 18 14607 1 1 23 CYS C C -2.713 -5.022 4.850 1.00 . A B . 23 CYS C 1 1 18 14608 1 1 23 CYS CA C -4.037 -4.285 5.027 1.00 . A B . 23 CYS CA 1 1 18 14609 1 1 23 CYS CB C -5.181 -5.274 5.287 1.00 . A B . 23 CYS CB 1 1 18 14610 1 1 23 CYS H H -4.901 -3.875 3.151 1.00 . A B . 23 CYS H 1 1 18 14611 1 1 23 CYS HA H -3.953 -3.600 5.861 1.00 . A B . 23 CYS HA 1 1 18 14612 1 1 23 CYS HB2 H -5.082 -5.674 6.286 1.00 . A B . 23 CYS HB2 1 1 18 14613 1 1 23 CYS HB3 H -6.123 -4.748 5.207 1.00 . A B . 23 CYS HB3 1 1 18 14614 1 1 23 CYS N N -4.304 -3.512 3.834 1.00 . A B . 23 CYS N 1 1 18 14615 1 1 23 CYS O O -2.196 -5.079 3.728 1.00 . A B . 23 CYS O 1 1 18 14616 1 1 23 CYS SG S -5.238 -6.677 4.143 1.00 . A B . 23 CYS SG 1 1 18 14617 1 1 24 ASP C C -0.815 -7.282 4.747 1.00 . A B . 24 ASP C 1 1 18 14618 1 1 24 ASP CA C -0.873 -6.258 5.879 1.00 . A B . 24 ASP CA 1 1 18 14619 1 1 24 ASP CB C -0.558 -6.943 7.215 1.00 . A B . 24 ASP CB 1 1 18 14620 1 1 24 ASP CG C -0.121 -5.969 8.296 1.00 . A B . 24 ASP CG 1 1 18 14621 1 1 24 ASP H H -2.672 -5.559 6.775 1.00 . A B . 24 ASP H 1 1 18 14622 1 1 24 ASP HA H -0.124 -5.501 5.694 1.00 . A B . 24 ASP HA 1 1 18 14623 1 1 24 ASP HB2 H -1.439 -7.460 7.562 1.00 . A B . 24 ASP HB2 1 1 18 14624 1 1 24 ASP HB3 H 0.235 -7.660 7.064 1.00 . A B . 24 ASP HB3 1 1 18 14625 1 1 24 ASP N N -2.177 -5.586 5.927 1.00 . A B . 24 ASP N 1 1 18 14626 1 1 24 ASP O O 0.166 -7.345 4.002 1.00 . A B . 24 ASP O 1 1 18 14627 1 1 24 ASP OD1 O -0.944 -5.135 8.731 1.00 . A B . 24 ASP OD1 1 1 18 14628 1 1 24 ASP OD2 O 1.045 -6.047 8.741 1.00 . A B . 24 ASP OD2 1 1 18 14629 1 1 25 THR C C -1.838 -8.548 2.175 1.00 . A B . 25 THR C 1 1 18 14630 1 1 25 THR CA C -1.952 -9.103 3.600 1.00 . A B . 25 THR CA 1 1 18 14631 1 1 25 THR CB C -3.265 -9.895 3.738 1.00 . A B . 25 THR CB 1 1 18 14632 1 1 25 THR CG2 C -3.246 -11.146 2.873 1.00 . A B . 25 THR CG2 1 1 18 14633 1 1 25 THR H H -2.666 -7.903 5.180 1.00 . A B . 25 THR H 1 1 18 14634 1 1 25 THR HA H -1.130 -9.778 3.778 1.00 . A B . 25 THR HA 1 1 18 14635 1 1 25 THR HB H -4.081 -9.265 3.416 1.00 . A B . 25 THR HB 1 1 18 14636 1 1 25 THR HG1 H -2.652 -10.621 5.473 1.00 . A B . 25 THR HG1 1 1 18 14637 1 1 25 THR HG21 H -2.431 -11.784 3.184 1.00 . A B . 25 THR HG21 1 1 18 14638 1 1 25 THR HG22 H -3.109 -10.868 1.839 1.00 . A B . 25 THR HG22 1 1 18 14639 1 1 25 THR HG23 H -4.180 -11.676 2.983 1.00 . A B . 25 THR HG23 1 1 18 14640 1 1 25 THR N N -1.889 -8.048 4.598 1.00 . A B . 25 THR N 1 1 18 14641 1 1 25 THR O O -0.983 -8.982 1.400 1.00 . A B . 25 THR O 1 1 18 14642 1 1 25 THR OG1 O -3.473 -10.261 5.108 1.00 . A B . 25 THR OG1 1 1 18 14643 1 1 26 CYS C C -1.467 -6.190 0.194 1.00 . A B . 26 CYS C 1 1 18 14644 1 1 26 CYS CA C -2.700 -7.042 0.473 1.00 . A B . 26 CYS CA 1 1 18 14645 1 1 26 CYS CB C -3.961 -6.215 0.218 1.00 . A B . 26 CYS CB 1 1 18 14646 1 1 26 CYS H H -3.291 -7.213 2.508 1.00 . A B . 26 CYS H 1 1 18 14647 1 1 26 CYS HA H -2.695 -7.885 -0.204 1.00 . A B . 26 CYS HA 1 1 18 14648 1 1 26 CYS HB2 H -3.969 -5.377 0.893 1.00 . A B . 26 CYS HB2 1 1 18 14649 1 1 26 CYS HB3 H -3.943 -5.848 -0.797 1.00 . A B . 26 CYS HB3 1 1 18 14650 1 1 26 CYS N N -2.680 -7.576 1.835 1.00 . A B . 26 CYS N 1 1 18 14651 1 1 26 CYS O O -0.971 -6.170 -0.928 1.00 . A B . 26 CYS O 1 1 18 14652 1 1 26 CYS SG S -5.510 -7.111 0.454 1.00 . A B . 26 CYS SG 1 1 18 14653 1 1 27 SER C C 1.422 -5.499 0.689 1.00 . A B . 27 SER C 1 1 18 14654 1 1 27 SER CA C 0.212 -4.655 1.071 1.00 . A B . 27 SER CA 1 1 18 14655 1 1 27 SER CB C 0.489 -3.902 2.379 1.00 . A B . 27 SER CB 1 1 18 14656 1 1 27 SER H H -1.401 -5.561 2.100 1.00 . A B . 27 SER H 1 1 18 14657 1 1 27 SER HA H 0.016 -3.940 0.285 1.00 . A B . 27 SER HA 1 1 18 14658 1 1 27 SER HB2 H -0.359 -3.283 2.622 1.00 . A B . 27 SER HB2 1 1 18 14659 1 1 27 SER HB3 H 0.648 -4.617 3.172 1.00 . A B . 27 SER HB3 1 1 18 14660 1 1 27 SER HG H 1.964 -2.873 3.156 1.00 . A B . 27 SER HG 1 1 18 14661 1 1 27 SER N N -0.970 -5.500 1.218 1.00 . A B . 27 SER N 1 1 18 14662 1 1 27 SER O O 2.322 -5.042 -0.011 1.00 . A B . 27 SER O 1 1 18 14663 1 1 27 SER OG O 1.635 -3.075 2.272 1.00 . A B . 27 SER OG 1 1 18 14664 1 1 28 ARG C C 2.466 -8.102 -0.603 1.00 . A B . 28 ARG C 1 1 18 14665 1 1 28 ARG CA C 2.512 -7.658 0.857 1.00 . A B . 28 ARG CA 1 1 18 14666 1 1 28 ARG CB C 2.420 -8.878 1.774 1.00 . A B . 28 ARG CB 1 1 18 14667 1 1 28 ARG CD C 4.752 -8.851 2.677 1.00 . A B . 28 ARG CD 1 1 18 14668 1 1 28 ARG CG C 3.719 -9.651 1.903 1.00 . A B . 28 ARG CG 1 1 18 14669 1 1 28 ARG CZ C 4.671 -7.434 4.699 1.00 . A B . 28 ARG CZ 1 1 18 14670 1 1 28 ARG H H 0.704 -7.034 1.742 1.00 . A B . 28 ARG H 1 1 18 14671 1 1 28 ARG HA H 3.444 -7.148 1.038 1.00 . A B . 28 ARG HA 1 1 18 14672 1 1 28 ARG HB2 H 2.125 -8.550 2.760 1.00 . A B . 28 ARG HB2 1 1 18 14673 1 1 28 ARG HB3 H 1.666 -9.546 1.389 1.00 . A B . 28 ARG HB3 1 1 18 14674 1 1 28 ARG HD2 H 5.652 -9.440 2.772 1.00 . A B . 28 ARG HD2 1 1 18 14675 1 1 28 ARG HD3 H 4.970 -7.945 2.133 1.00 . A B . 28 ARG HD3 1 1 18 14676 1 1 28 ARG HE H 3.591 -9.090 4.413 1.00 . A B . 28 ARG HE 1 1 18 14677 1 1 28 ARG HG2 H 3.527 -10.578 2.424 1.00 . A B . 28 ARG HG2 1 1 18 14678 1 1 28 ARG HG3 H 4.101 -9.860 0.915 1.00 . A B . 28 ARG HG3 1 1 18 14679 1 1 28 ARG HH11 H 6.016 -6.815 3.311 1.00 . A B . 28 ARG HH11 1 1 18 14680 1 1 28 ARG HH12 H 5.895 -5.817 4.726 1.00 . A B . 28 ARG HH12 1 1 18 14681 1 1 28 ARG HH21 H 3.441 -7.799 6.265 1.00 . A B . 28 ARG HH21 1 1 18 14682 1 1 28 ARG HH22 H 4.437 -6.386 6.418 1.00 . A B . 28 ARG HH22 1 1 18 14683 1 1 28 ARG N N 1.430 -6.739 1.155 1.00 . A B . 28 ARG N 1 1 18 14684 1 1 28 ARG NE N 4.269 -8.499 4.011 1.00 . A B . 28 ARG NE 1 1 18 14685 1 1 28 ARG NH1 N 5.603 -6.626 4.207 1.00 . A B . 28 ARG NH1 1 1 18 14686 1 1 28 ARG NH2 N 4.143 -7.185 5.889 1.00 . A B . 28 ARG NH2 1 1 18 14687 1 1 28 ARG O O 3.492 -8.446 -1.187 1.00 . A B . 28 ARG O 1 1 18 14688 1 1 29 VAL C C 1.093 -7.430 -3.569 1.00 . A B . 29 VAL C 1 1 18 14689 1 1 29 VAL CA C 1.088 -8.573 -2.551 1.00 . A B . 29 VAL CA 1 1 18 14690 1 1 29 VAL CB C -0.229 -9.373 -2.688 1.00 . A B . 29 VAL CB 1 1 18 14691 1 1 29 VAL CG1 C -0.363 -9.969 -4.081 1.00 . A B . 29 VAL CG1 1 1 18 14692 1 1 29 VAL CG2 C -0.308 -10.470 -1.637 1.00 . A B . 29 VAL CG2 1 1 18 14693 1 1 29 VAL H H 0.501 -7.739 -0.696 1.00 . A B . 29 VAL H 1 1 18 14694 1 1 29 VAL HA H 1.906 -9.237 -2.773 1.00 . A B . 29 VAL HA 1 1 18 14695 1 1 29 VAL HB H -1.053 -8.696 -2.530 1.00 . A B . 29 VAL HB 1 1 18 14696 1 1 29 VAL HG11 H -1.294 -10.514 -4.152 1.00 . A B . 29 VAL HG11 1 1 18 14697 1 1 29 VAL HG12 H 0.461 -10.644 -4.265 1.00 . A B . 29 VAL HG12 1 1 18 14698 1 1 29 VAL HG13 H -0.351 -9.178 -4.816 1.00 . A B . 29 VAL HG13 1 1 18 14699 1 1 29 VAL HG21 H -1.193 -11.065 -1.807 1.00 . A B . 29 VAL HG21 1 1 18 14700 1 1 29 VAL HG22 H -0.357 -10.024 -0.656 1.00 . A B . 29 VAL HG22 1 1 18 14701 1 1 29 VAL HG23 H 0.568 -11.098 -1.706 1.00 . A B . 29 VAL HG23 1 1 18 14702 1 1 29 VAL N N 1.274 -8.086 -1.189 1.00 . A B . 29 VAL N 1 1 18 14703 1 1 29 VAL O O 1.693 -7.543 -4.638 1.00 . A B . 29 VAL O 1 1 18 14704 1 1 30 PHE C C 0.905 -3.950 -3.517 1.00 . A B . 30 PHE C 1 1 18 14705 1 1 30 PHE CA C 0.314 -5.199 -4.150 1.00 . A B . 30 PHE CA 1 1 18 14706 1 1 30 PHE CB C -1.156 -4.937 -4.505 1.00 . A B . 30 PHE CB 1 1 18 14707 1 1 30 PHE CD1 C -1.610 -6.567 -6.365 1.00 . A B . 30 PHE CD1 1 1 18 14708 1 1 30 PHE CD2 C -2.836 -6.788 -4.332 1.00 . A B . 30 PHE CD2 1 1 18 14709 1 1 30 PHE CE1 C -2.283 -7.651 -6.889 1.00 . A B . 30 PHE CE1 1 1 18 14710 1 1 30 PHE CE2 C -3.510 -7.873 -4.852 1.00 . A B . 30 PHE CE2 1 1 18 14711 1 1 30 PHE CG C -1.878 -6.123 -5.080 1.00 . A B . 30 PHE CG 1 1 18 14712 1 1 30 PHE CZ C -3.233 -8.305 -6.132 1.00 . A B . 30 PHE CZ 1 1 18 14713 1 1 30 PHE H H 0.034 -6.262 -2.337 1.00 . A B . 30 PHE H 1 1 18 14714 1 1 30 PHE HA H 0.865 -5.436 -5.048 1.00 . A B . 30 PHE HA 1 1 18 14715 1 1 30 PHE HB2 H -1.683 -4.635 -3.612 1.00 . A B . 30 PHE HB2 1 1 18 14716 1 1 30 PHE HB3 H -1.203 -4.135 -5.229 1.00 . A B . 30 PHE HB3 1 1 18 14717 1 1 30 PHE HD1 H -0.866 -6.059 -6.961 1.00 . A B . 30 PHE HD1 1 1 18 14718 1 1 30 PHE HD2 H -3.058 -6.449 -3.332 1.00 . A B . 30 PHE HD2 1 1 18 14719 1 1 30 PHE HE1 H -2.066 -7.986 -7.893 1.00 . A B . 30 PHE HE1 1 1 18 14720 1 1 30 PHE HE2 H -4.255 -8.382 -4.257 1.00 . A B . 30 PHE HE2 1 1 18 14721 1 1 30 PHE HZ H -3.759 -9.155 -6.541 1.00 . A B . 30 PHE HZ 1 1 18 14722 1 1 30 PHE N N 0.435 -6.329 -3.233 1.00 . A B . 30 PHE N 1 1 18 14723 1 1 30 PHE O O 0.264 -2.903 -3.479 1.00 . A B . 30 PHE O 1 1 18 14724 1 1 31 HIS C C 2.759 -1.671 -3.018 1.00 . A B . 31 HIS C 1 1 18 14725 1 1 31 HIS CA C 2.762 -3.002 -2.264 1.00 . A B . 31 HIS CA 1 1 18 14726 1 1 31 HIS CB C 4.188 -3.415 -1.898 1.00 . A B . 31 HIS CB 1 1 18 14727 1 1 31 HIS CD2 C 5.999 -1.756 -1.079 1.00 . A B . 31 HIS CD2 1 1 18 14728 1 1 31 HIS CE1 C 5.273 -1.384 0.923 1.00 . A B . 31 HIS CE1 1 1 18 14729 1 1 31 HIS CG C 4.869 -2.489 -0.933 1.00 . A B . 31 HIS CG 1 1 18 14730 1 1 31 HIS H H 2.629 -4.895 -3.196 1.00 . A B . 31 HIS H 1 1 18 14731 1 1 31 HIS HA H 2.194 -2.879 -1.356 1.00 . A B . 31 HIS HA 1 1 18 14732 1 1 31 HIS HB2 H 4.163 -4.398 -1.448 1.00 . A B . 31 HIS HB2 1 1 18 14733 1 1 31 HIS HB3 H 4.783 -3.454 -2.800 1.00 . A B . 31 HIS HB3 1 1 18 14734 1 1 31 HIS HD1 H 3.608 -2.622 0.756 1.00 . A B . 31 HIS HD1 1 1 18 14735 1 1 31 HIS HD2 H 6.604 -1.703 -1.971 1.00 . A B . 31 HIS HD2 1 1 18 14736 1 1 31 HIS HE1 H 5.173 -1.009 1.931 1.00 . A B . 31 HIS HE1 1 1 18 14737 1 1 31 HIS N N 2.132 -4.067 -3.034 1.00 . A B . 31 HIS N 1 1 18 14738 1 1 31 HIS ND1 N 4.419 -2.244 0.345 1.00 . A B . 31 HIS ND1 1 1 18 14739 1 1 31 HIS NE2 N 6.254 -1.057 0.099 1.00 . A B . 31 HIS NE2 1 1 18 14740 1 1 31 HIS O O 2.298 -0.666 -2.495 1.00 . A B . 31 HIS O 1 1 18 14741 1 1 32 GLU C C 1.979 0.163 -5.350 1.00 . A B . 32 GLU C 1 1 18 14742 1 1 32 GLU CA C 3.338 -0.459 -5.051 1.00 . A B . 32 GLU CA 1 1 18 14743 1 1 32 GLU CB C 4.074 -0.744 -6.356 1.00 . A B . 32 GLU CB 1 1 18 14744 1 1 32 GLU CD C 6.140 0.684 -6.161 1.00 . A B . 32 GLU CD 1 1 18 14745 1 1 32 GLU CG C 5.589 -0.727 -6.227 1.00 . A B . 32 GLU CG 1 1 18 14746 1 1 32 GLU H H 3.404 -2.548 -4.686 1.00 . A B . 32 GLU H 1 1 18 14747 1 1 32 GLU HA H 3.919 0.239 -4.468 1.00 . A B . 32 GLU HA 1 1 18 14748 1 1 32 GLU HB2 H 3.775 -1.717 -6.719 1.00 . A B . 32 GLU HB2 1 1 18 14749 1 1 32 GLU HB3 H 3.789 0.002 -7.081 1.00 . A B . 32 GLU HB3 1 1 18 14750 1 1 32 GLU HG2 H 5.865 -1.252 -5.325 1.00 . A B . 32 GLU HG2 1 1 18 14751 1 1 32 GLU HG3 H 6.020 -1.228 -7.081 1.00 . A B . 32 GLU HG3 1 1 18 14752 1 1 32 GLU N N 3.201 -1.688 -4.267 1.00 . A B . 32 GLU N 1 1 18 14753 1 1 32 GLU O O 1.823 1.388 -5.338 1.00 . A B . 32 GLU O 1 1 18 14754 1 1 32 GLU OE1 O 6.323 1.312 -7.218 1.00 . A B . 32 GLU OE1 1 1 18 14755 1 1 32 GLU OE2 O 6.393 1.170 -5.036 1.00 . A B . 32 GLU OE2 1 1 18 14756 1 1 33 ASP C C -1.054 0.277 -4.682 1.00 . A B . 33 ASP C 1 1 18 14757 1 1 33 ASP CA C -0.349 -0.231 -5.928 1.00 . A B . 33 ASP CA 1 1 18 14758 1 1 33 ASP CB C -1.174 -1.359 -6.554 1.00 . A B . 33 ASP CB 1 1 18 14759 1 1 33 ASP CG C -0.751 -1.689 -7.968 1.00 . A B . 33 ASP CG 1 1 18 14760 1 1 33 ASP H H 1.186 -1.650 -5.575 1.00 . A B . 33 ASP H 1 1 18 14761 1 1 33 ASP HA H -0.264 0.580 -6.637 1.00 . A B . 33 ASP HA 1 1 18 14762 1 1 33 ASP HB2 H -1.065 -2.247 -5.952 1.00 . A B . 33 ASP HB2 1 1 18 14763 1 1 33 ASP HB3 H -2.216 -1.069 -6.569 1.00 . A B . 33 ASP HB3 1 1 18 14764 1 1 33 ASP N N 0.999 -0.687 -5.608 1.00 . A B . 33 ASP N 1 1 18 14765 1 1 33 ASP O O -1.971 1.091 -4.760 1.00 . A B . 33 ASP O 1 1 18 14766 1 1 33 ASP OD1 O -1.233 -1.021 -8.910 1.00 . A B . 33 ASP OD1 1 1 18 14767 1 1 33 ASP OD2 O 0.052 -2.630 -8.150 1.00 . A B . 33 ASP OD2 1 1 18 14768 1 1 34 CYS C C -0.715 1.473 -1.725 1.00 . A B . 34 CYS C 1 1 18 14769 1 1 34 CYS CA C -1.236 0.143 -2.269 1.00 . A B . 34 CYS CA 1 1 18 14770 1 1 34 CYS CB C -1.019 -0.987 -1.263 1.00 . A B . 34 CYS CB 1 1 18 14771 1 1 34 CYS H H 0.143 -0.835 -3.539 1.00 . A B . 34 CYS H 1 1 18 14772 1 1 34 CYS HA H -2.299 0.244 -2.448 1.00 . A B . 34 CYS HA 1 1 18 14773 1 1 34 CYS HB2 H 0.009 -1.326 -1.324 1.00 . A B . 34 CYS HB2 1 1 18 14774 1 1 34 CYS HB3 H -1.218 -0.621 -0.267 1.00 . A B . 34 CYS HB3 1 1 18 14775 1 1 34 CYS N N -0.617 -0.208 -3.536 1.00 . A B . 34 CYS N 1 1 18 14776 1 1 34 CYS O O -1.134 1.921 -0.654 1.00 . A B . 34 CYS O 1 1 18 14777 1 1 34 CYS SG S -2.091 -2.429 -1.557 1.00 . A B . 34 CYS SG 1 1 18 14778 1 1 35 HIS C C 0.047 4.454 -3.085 1.00 . A B . 35 HIS C 1 1 18 14779 1 1 35 HIS CA C 0.662 3.438 -2.131 1.00 . A B . 35 HIS CA 1 1 18 14780 1 1 35 HIS CB C 2.187 3.530 -2.214 1.00 . A B . 35 HIS CB 1 1 18 14781 1 1 35 HIS CD2 C 3.336 1.508 -1.101 1.00 . A B . 35 HIS CD2 1 1 18 14782 1 1 35 HIS CE1 C 3.862 2.385 0.799 1.00 . A B . 35 HIS CE1 1 1 18 14783 1 1 35 HIS CG C 2.906 2.788 -1.133 1.00 . A B . 35 HIS CG 1 1 18 14784 1 1 35 HIS H H 0.571 1.642 -3.245 1.00 . A B . 35 HIS H 1 1 18 14785 1 1 35 HIS HA H 0.348 3.663 -1.122 1.00 . A B . 35 HIS HA 1 1 18 14786 1 1 35 HIS HB2 H 2.509 3.122 -3.162 1.00 . A B . 35 HIS HB2 1 1 18 14787 1 1 35 HIS HB3 H 2.479 4.568 -2.157 1.00 . A B . 35 HIS HB3 1 1 18 14788 1 1 35 HIS HD1 H 3.021 4.240 0.395 1.00 . A B . 35 HIS HD1 1 1 18 14789 1 1 35 HIS HD2 H 3.241 0.790 -1.901 1.00 . A B . 35 HIS HD2 1 1 18 14790 1 1 35 HIS HE1 H 4.252 2.531 1.796 1.00 . A B . 35 HIS HE1 1 1 18 14791 1 1 35 HIS N N 0.197 2.096 -2.462 1.00 . A B . 35 HIS N 1 1 18 14792 1 1 35 HIS ND1 N 3.240 3.334 0.086 1.00 . A B . 35 HIS ND1 1 1 18 14793 1 1 35 HIS NE2 N 3.943 1.252 0.121 1.00 . A B . 35 HIS NE2 1 1 18 14794 1 1 35 HIS O O -0.471 5.490 -2.669 1.00 . A B . 35 HIS O 1 1 18 14795 1 1 36 ILE C C -1.374 4.325 -6.299 1.00 . A B . 36 ILE C 1 1 18 14796 1 1 36 ILE CA C -0.348 5.034 -5.419 1.00 . A B . 36 ILE CA 1 1 18 14797 1 1 36 ILE CB C 0.845 5.499 -6.288 1.00 . A B . 36 ILE CB 1 1 18 14798 1 1 36 ILE CD1 C 3.198 6.476 -6.163 1.00 . A B . 36 ILE CD1 1 1 18 14799 1 1 36 ILE CG1 C 1.944 6.095 -5.404 1.00 . A B . 36 ILE CG1 1 1 18 14800 1 1 36 ILE CG2 C 0.401 6.508 -7.340 1.00 . A B . 36 ILE CG2 1 1 18 14801 1 1 36 ILE H H 0.474 3.267 -4.628 1.00 . A B . 36 ILE H 1 1 18 14802 1 1 36 ILE HA H -0.802 5.897 -4.957 1.00 . A B . 36 ILE HA 1 1 18 14803 1 1 36 ILE HB H 1.239 4.635 -6.801 1.00 . A B . 36 ILE HB 1 1 18 14804 1 1 36 ILE HD11 H 3.626 5.596 -6.619 1.00 . A B . 36 ILE HD11 1 1 18 14805 1 1 36 ILE HD12 H 3.914 6.914 -5.483 1.00 . A B . 36 ILE HD12 1 1 18 14806 1 1 36 ILE HD13 H 2.949 7.193 -6.932 1.00 . A B . 36 ILE HD13 1 1 18 14807 1 1 36 ILE HG12 H 1.565 6.984 -4.922 1.00 . A B . 36 ILE HG12 1 1 18 14808 1 1 36 ILE HG13 H 2.218 5.370 -4.649 1.00 . A B . 36 ILE HG13 1 1 18 14809 1 1 36 ILE HG21 H 0.022 7.394 -6.853 1.00 . A B . 36 ILE HG21 1 1 18 14810 1 1 36 ILE HG22 H -0.376 6.075 -7.951 1.00 . A B . 36 ILE HG22 1 1 18 14811 1 1 36 ILE HG23 H 1.243 6.773 -7.962 1.00 . A B . 36 ILE HG23 1 1 18 14812 1 1 36 ILE N N 0.111 4.137 -4.371 1.00 . A B . 36 ILE N 1 1 18 14813 1 1 36 ILE O O -1.176 3.167 -6.668 1.00 . A B . 36 ILE O 1 1 18 14814 1 1 37 PRO C C -3.465 6.454 -4.880 1.00 . A B . 37 PRO C 1 1 18 14815 1 1 37 PRO CA C -2.764 6.373 -6.239 1.00 . A B . 37 PRO CA 1 1 18 14816 1 1 37 PRO CB C -3.693 6.861 -7.348 1.00 . A B . 37 PRO CB 1 1 18 14817 1 1 37 PRO CD C -3.547 4.460 -7.522 1.00 . A B . 37 PRO CD 1 1 18 14818 1 1 37 PRO CG C -4.456 5.645 -7.762 1.00 . A B . 37 PRO CG 1 1 18 14819 1 1 37 PRO HA H -1.870 6.975 -6.225 1.00 . A B . 37 PRO HA 1 1 18 14820 1 1 37 PRO HB2 H -4.350 7.631 -6.960 1.00 . A B . 37 PRO HB2 1 1 18 14821 1 1 37 PRO HB3 H -3.106 7.256 -8.168 1.00 . A B . 37 PRO HB3 1 1 18 14822 1 1 37 PRO HD2 H -4.085 3.666 -7.022 1.00 . A B . 37 PRO HD2 1 1 18 14823 1 1 37 PRO HD3 H -3.136 4.105 -8.456 1.00 . A B . 37 PRO HD3 1 1 18 14824 1 1 37 PRO HG2 H -5.351 5.555 -7.162 1.00 . A B . 37 PRO HG2 1 1 18 14825 1 1 37 PRO HG3 H -4.713 5.712 -8.809 1.00 . A B . 37 PRO HG3 1 1 18 14826 1 1 37 PRO N N -2.481 4.996 -6.654 1.00 . A B . 37 PRO N 1 1 18 14827 1 1 37 PRO O O -4.347 5.645 -4.576 1.00 . A B . 37 PRO O 1 1 18 14828 1 1 38 PRO C C -5.186 8.058 -2.927 1.00 . A B . 38 PRO C 1 1 18 14829 1 1 38 PRO CA C -3.725 7.664 -2.748 1.00 . A B . 38 PRO CA 1 1 18 14830 1 1 38 PRO CB C -2.934 8.830 -2.140 1.00 . A B . 38 PRO CB 1 1 18 14831 1 1 38 PRO CD C -1.952 8.356 -4.267 1.00 . A B . 38 PRO CD 1 1 18 14832 1 1 38 PRO CG C -1.637 8.846 -2.879 1.00 . A B . 38 PRO CG 1 1 18 14833 1 1 38 PRO HA H -3.656 6.801 -2.105 1.00 . A B . 38 PRO HA 1 1 18 14834 1 1 38 PRO HB2 H -3.484 9.750 -2.279 1.00 . A B . 38 PRO HB2 1 1 18 14835 1 1 38 PRO HB3 H -2.784 8.653 -1.084 1.00 . A B . 38 PRO HB3 1 1 18 14836 1 1 38 PRO HD2 H -2.257 9.177 -4.904 1.00 . A B . 38 PRO HD2 1 1 18 14837 1 1 38 PRO HD3 H -1.101 7.842 -4.691 1.00 . A B . 38 PRO HD3 1 1 18 14838 1 1 38 PRO HG2 H -1.244 9.854 -2.913 1.00 . A B . 38 PRO HG2 1 1 18 14839 1 1 38 PRO HG3 H -0.932 8.183 -2.396 1.00 . A B . 38 PRO HG3 1 1 18 14840 1 1 38 PRO N N -3.070 7.425 -4.038 1.00 . A B . 38 PRO N 1 1 18 14841 1 1 38 PRO O O -5.511 8.892 -3.774 1.00 . A B . 38 PRO O 1 1 18 14842 1 1 39 VAL C C -7.788 9.147 -1.705 1.00 . A B . 39 VAL C 1 1 18 14843 1 1 39 VAL CA C -7.491 7.747 -2.234 1.00 . A B . 39 VAL CA 1 1 18 14844 1 1 39 VAL CB C -8.341 6.726 -1.454 1.00 . A B . 39 VAL CB 1 1 18 14845 1 1 39 VAL CG1 C -9.824 6.985 -1.673 1.00 . A B . 39 VAL CG1 1 1 18 14846 1 1 39 VAL CG2 C -7.987 5.303 -1.849 1.00 . A B . 39 VAL CG2 1 1 18 14847 1 1 39 VAL H H -5.753 6.811 -1.476 1.00 . A B . 39 VAL H 1 1 18 14848 1 1 39 VAL HA H -7.770 7.698 -3.274 1.00 . A B . 39 VAL HA 1 1 18 14849 1 1 39 VAL HB H -8.131 6.848 -0.404 1.00 . A B . 39 VAL HB 1 1 18 14850 1 1 39 VAL HG11 H -10.061 6.848 -2.718 1.00 . A B . 39 VAL HG11 1 1 18 14851 1 1 39 VAL HG12 H -10.059 7.996 -1.382 1.00 . A B . 39 VAL HG12 1 1 18 14852 1 1 39 VAL HG13 H -10.403 6.294 -1.080 1.00 . A B . 39 VAL HG13 1 1 18 14853 1 1 39 VAL HG21 H -8.113 5.183 -2.914 1.00 . A B . 39 VAL HG21 1 1 18 14854 1 1 39 VAL HG22 H -8.639 4.616 -1.331 1.00 . A B . 39 VAL HG22 1 1 18 14855 1 1 39 VAL HG23 H -6.963 5.095 -1.581 1.00 . A B . 39 VAL HG23 1 1 18 14856 1 1 39 VAL N N -6.066 7.459 -2.137 1.00 . A B . 39 VAL N 1 1 18 14857 1 1 39 VAL O O -7.705 9.397 -0.501 1.00 . A B . 39 VAL O 1 1 18 14858 1 1 40 GLU C C -9.832 11.581 -1.707 1.00 . A B . 40 GLU C 1 1 18 14859 1 1 40 GLU CA C -8.413 11.433 -2.246 1.00 . A B . 40 GLU CA 1 1 18 14860 1 1 40 GLU CB C -8.197 12.359 -3.444 1.00 . A B . 40 GLU CB 1 1 18 14861 1 1 40 GLU CD C -5.955 13.259 -2.731 1.00 . A B . 40 GLU CD 1 1 18 14862 1 1 40 GLU CG C -6.734 12.537 -3.812 1.00 . A B . 40 GLU CG 1 1 18 14863 1 1 40 GLU H H -8.197 9.781 -3.549 1.00 . A B . 40 GLU H 1 1 18 14864 1 1 40 GLU HA H -7.720 11.709 -1.466 1.00 . A B . 40 GLU HA 1 1 18 14865 1 1 40 GLU HB2 H -8.717 11.952 -4.298 1.00 . A B . 40 GLU HB2 1 1 18 14866 1 1 40 GLU HB3 H -8.608 13.330 -3.212 1.00 . A B . 40 GLU HB3 1 1 18 14867 1 1 40 GLU HG2 H -6.291 11.565 -3.966 1.00 . A B . 40 GLU HG2 1 1 18 14868 1 1 40 GLU HG3 H -6.672 13.110 -4.725 1.00 . A B . 40 GLU HG3 1 1 18 14869 1 1 40 GLU N N -8.130 10.051 -2.609 1.00 . A B . 40 GLU N 1 1 18 14870 1 1 40 GLU O O -10.693 12.198 -2.341 1.00 . A B . 40 GLU O 1 1 18 14871 1 1 40 GLU OE1 O -5.630 12.634 -1.701 1.00 . A B . 40 GLU OE1 1 1 18 14872 1 1 40 GLU OE2 O -5.681 14.467 -2.895 1.00 . A B . 40 GLU OE2 1 1 18 14873 1 1 41 ALA C C -11.216 10.510 1.542 1.00 . A B . 41 ALA C 1 1 18 14874 1 1 41 ALA CA C -11.346 11.051 0.130 1.00 . A B . 41 ALA CA 1 1 18 14875 1 1 41 ALA CB C -12.375 10.246 -0.651 1.00 . A B . 41 ALA CB 1 1 18 14876 1 1 41 ALA H H -9.311 10.545 -0.090 1.00 . A B . 41 ALA H 1 1 18 14877 1 1 41 ALA HA H -11.675 12.078 0.173 1.00 . A B . 41 ALA HA 1 1 18 14878 1 1 41 ALA HB1 H -13.334 10.310 -0.160 1.00 . A B . 41 ALA HB1 1 1 18 14879 1 1 41 ALA HB2 H -12.061 9.215 -0.698 1.00 . A B . 41 ALA HB2 1 1 18 14880 1 1 41 ALA HB3 H -12.454 10.643 -1.652 1.00 . A B . 41 ALA HB3 1 1 18 14881 1 1 41 ALA N N -10.053 11.010 -0.533 1.00 . A B . 41 ALA N 1 1 18 14882 1 1 41 ALA O O -11.197 11.263 2.512 1.00 . A B . 41 ALA O 1 1 18 14883 1 1 42 GLU C C -9.530 7.952 3.033 1.00 . A B . 42 GLU C 1 1 18 14884 1 1 42 GLU CA C -10.931 8.534 2.920 1.00 . A B . 42 GLU CA 1 1 18 14885 1 1 42 GLU CB C -11.968 7.423 3.077 1.00 . A B . 42 GLU CB 1 1 18 14886 1 1 42 GLU CD C -13.740 8.752 4.282 1.00 . A B . 42 GLU CD 1 1 18 14887 1 1 42 GLU CG C -13.400 7.923 3.062 1.00 . A B . 42 GLU CG 1 1 18 14888 1 1 42 GLU H H -11.120 8.658 0.829 1.00 . A B . 42 GLU H 1 1 18 14889 1 1 42 GLU HA H -11.076 9.266 3.700 1.00 . A B . 42 GLU HA 1 1 18 14890 1 1 42 GLU HB2 H -11.846 6.716 2.270 1.00 . A B . 42 GLU HB2 1 1 18 14891 1 1 42 GLU HB3 H -11.795 6.919 4.015 1.00 . A B . 42 GLU HB3 1 1 18 14892 1 1 42 GLU HG2 H -13.541 8.534 2.181 1.00 . A B . 42 GLU HG2 1 1 18 14893 1 1 42 GLU HG3 H -14.065 7.075 3.022 1.00 . A B . 42 GLU HG3 1 1 18 14894 1 1 42 GLU N N -11.095 9.199 1.642 1.00 . A B . 42 GLU N 1 1 18 14895 1 1 42 GLU O O -9.291 6.802 2.662 1.00 . A B . 42 GLU O 1 1 18 14896 1 1 42 GLU OE1 O -13.928 8.164 5.369 1.00 . A B . 42 GLU OE1 1 1 18 14897 1 1 42 GLU OE2 O -13.823 9.992 4.162 1.00 . A B . 42 GLU OE2 1 1 18 14898 1 1 43 ARG C C -7.126 7.612 5.097 1.00 . A B . 43 ARG C 1 1 18 14899 1 1 43 ARG CA C -7.238 8.286 3.736 1.00 . A B . 43 ARG CA 1 1 18 14900 1 1 43 ARG CB C -6.237 9.440 3.623 1.00 . A B . 43 ARG CB 1 1 18 14901 1 1 43 ARG CD C -4.954 10.928 2.047 1.00 . A B . 43 ARG CD 1 1 18 14902 1 1 43 ARG CG C -6.217 10.103 2.253 1.00 . A B . 43 ARG CG 1 1 18 14903 1 1 43 ARG CZ C -3.665 12.644 3.266 1.00 . A B . 43 ARG CZ 1 1 18 14904 1 1 43 ARG H H -8.839 9.670 3.775 1.00 . A B . 43 ARG H 1 1 18 14905 1 1 43 ARG HA H -7.023 7.555 2.971 1.00 . A B . 43 ARG HA 1 1 18 14906 1 1 43 ARG HB2 H -6.490 10.189 4.356 1.00 . A B . 43 ARG HB2 1 1 18 14907 1 1 43 ARG HB3 H -5.246 9.064 3.832 1.00 . A B . 43 ARG HB3 1 1 18 14908 1 1 43 ARG HD2 H -4.101 10.270 2.091 1.00 . A B . 43 ARG HD2 1 1 18 14909 1 1 43 ARG HD3 H -4.998 11.391 1.072 1.00 . A B . 43 ARG HD3 1 1 18 14910 1 1 43 ARG HE H -5.582 12.177 3.618 1.00 . A B . 43 ARG HE 1 1 18 14911 1 1 43 ARG HG2 H -6.262 9.337 1.495 1.00 . A B . 43 ARG HG2 1 1 18 14912 1 1 43 ARG HG3 H -7.079 10.750 2.166 1.00 . A B . 43 ARG HG3 1 1 18 14913 1 1 43 ARG HH11 H -2.625 11.687 1.813 1.00 . A B . 43 ARG HH11 1 1 18 14914 1 1 43 ARG HH12 H -1.738 12.896 2.688 1.00 . A B . 43 ARG HH12 1 1 18 14915 1 1 43 ARG HH21 H -4.416 13.767 4.777 1.00 . A B . 43 ARG HH21 1 1 18 14916 1 1 43 ARG HH22 H -2.757 14.073 4.378 1.00 . A B . 43 ARG HH22 1 1 18 14917 1 1 43 ARG N N -8.600 8.751 3.529 1.00 . A B . 43 ARG N 1 1 18 14918 1 1 43 ARG NE N -4.797 11.970 3.059 1.00 . A B . 43 ARG NE 1 1 18 14919 1 1 43 ARG NH1 N -2.591 12.390 2.530 1.00 . A B . 43 ARG NH1 1 1 18 14920 1 1 43 ARG NH2 N -3.608 13.571 4.214 1.00 . A B . 43 ARG NH2 1 1 18 14921 1 1 43 ARG O O -6.332 8.013 5.950 1.00 . A B . 43 ARG O 1 1 18 14922 1 1 44 THR C C -7.136 4.620 6.525 1.00 . A B . 44 THR C 1 1 18 14923 1 1 44 THR CA C -8.014 5.876 6.546 1.00 . A B . 44 THR CA 1 1 18 14924 1 1 44 THR CB C -9.477 5.502 6.853 1.00 . A B . 44 THR CB 1 1 18 14925 1 1 44 THR CG2 C -10.272 6.734 7.261 1.00 . A B . 44 THR CG2 1 1 18 14926 1 1 44 THR H H -8.504 6.287 4.540 1.00 . A B . 44 THR H 1 1 18 14927 1 1 44 THR HA H -7.666 6.540 7.320 1.00 . A B . 44 THR HA 1 1 18 14928 1 1 44 THR HB H -9.491 4.792 7.668 1.00 . A B . 44 THR HB 1 1 18 14929 1 1 44 THR HG1 H -10.772 4.290 5.982 1.00 . A B . 44 THR HG1 1 1 18 14930 1 1 44 THR HG21 H -9.855 7.150 8.166 1.00 . A B . 44 THR HG21 1 1 18 14931 1 1 44 THR HG22 H -11.302 6.458 7.430 1.00 . A B . 44 THR HG22 1 1 18 14932 1 1 44 THR HG23 H -10.223 7.470 6.471 1.00 . A B . 44 THR HG23 1 1 18 14933 1 1 44 THR N N -7.936 6.585 5.284 1.00 . A B . 44 THR N 1 1 18 14934 1 1 44 THR O O -7.368 3.700 5.739 1.00 . A B . 44 THR O 1 1 18 14935 1 1 44 THR OG1 O -10.085 4.908 5.698 1.00 . A B . 44 THR OG1 1 1 18 14936 1 1 45 PRO C C -5.740 2.109 7.707 1.00 . A B . 45 PRO C 1 1 18 14937 1 1 45 PRO CA C -5.128 3.474 7.403 1.00 . A B . 45 PRO CA 1 1 18 14938 1 1 45 PRO CB C -4.143 3.858 8.514 1.00 . A B . 45 PRO CB 1 1 18 14939 1 1 45 PRO CD C -5.829 5.564 8.446 1.00 . A B . 45 PRO CD 1 1 18 14940 1 1 45 PRO CG C -4.389 5.303 8.792 1.00 . A B . 45 PRO CG 1 1 18 14941 1 1 45 PRO HA H -4.602 3.421 6.462 1.00 . A B . 45 PRO HA 1 1 18 14942 1 1 45 PRO HB2 H -4.331 3.251 9.388 1.00 . A B . 45 PRO HB2 1 1 18 14943 1 1 45 PRO HB3 H -3.130 3.693 8.171 1.00 . A B . 45 PRO HB3 1 1 18 14944 1 1 45 PRO HD2 H -6.460 5.408 9.312 1.00 . A B . 45 PRO HD2 1 1 18 14945 1 1 45 PRO HD3 H -5.947 6.569 8.066 1.00 . A B . 45 PRO HD3 1 1 18 14946 1 1 45 PRO HG2 H -4.212 5.510 9.839 1.00 . A B . 45 PRO HG2 1 1 18 14947 1 1 45 PRO HG3 H -3.741 5.910 8.177 1.00 . A B . 45 PRO HG3 1 1 18 14948 1 1 45 PRO N N -6.112 4.566 7.399 1.00 . A B . 45 PRO N 1 1 18 14949 1 1 45 PRO O O -5.206 1.080 7.300 1.00 . A B . 45 PRO O 1 1 18 14950 1 1 46 TRP C C -8.537 0.358 7.843 1.00 . A B . 46 TRP C 1 1 18 14951 1 1 46 TRP CA C -7.489 0.852 8.839 1.00 . A B . 46 TRP CA 1 1 18 14952 1 1 46 TRP CB C -8.122 1.023 10.225 1.00 . A B . 46 TRP CB 1 1 18 14953 1 1 46 TRP CD1 C -10.378 2.221 9.986 1.00 . A B . 46 TRP CD1 1 1 18 14954 1 1 46 TRP CD2 C -8.728 3.514 10.773 1.00 . A B . 46 TRP CD2 1 1 18 14955 1 1 46 TRP CE2 C -9.903 4.283 10.690 1.00 . A B . 46 TRP CE2 1 1 18 14956 1 1 46 TRP CE3 C -7.559 4.120 11.243 1.00 . A B . 46 TRP CE3 1 1 18 14957 1 1 46 TRP CG C -9.053 2.195 10.318 1.00 . A B . 46 TRP CG 1 1 18 14958 1 1 46 TRP CH2 C -8.784 6.190 11.517 1.00 . A B . 46 TRP CH2 1 1 18 14959 1 1 46 TRP CZ2 C -9.943 5.624 11.060 1.00 . A B . 46 TRP CZ2 1 1 18 14960 1 1 46 TRP CZ3 C -7.599 5.453 11.608 1.00 . A B . 46 TRP CZ3 1 1 18 14961 1 1 46 TRP H H -7.293 2.956 8.636 1.00 . A B . 46 TRP H 1 1 18 14962 1 1 46 TRP HA H -6.707 0.110 8.903 1.00 . A B . 46 TRP HA 1 1 18 14963 1 1 46 TRP HB2 H -8.685 0.132 10.469 1.00 . A B . 46 TRP HB2 1 1 18 14964 1 1 46 TRP HB3 H -7.341 1.157 10.960 1.00 . A B . 46 TRP HB3 1 1 18 14965 1 1 46 TRP HD1 H -10.926 1.373 9.602 1.00 . A B . 46 TRP HD1 1 1 18 14966 1 1 46 TRP HE1 H -11.825 3.740 10.042 1.00 . A B . 46 TRP HE1 1 1 18 14967 1 1 46 TRP HE3 H -6.635 3.568 11.321 1.00 . A B . 46 TRP HE3 1 1 18 14968 1 1 46 TRP HH2 H -8.766 7.228 11.811 1.00 . A B . 46 TRP HH2 1 1 18 14969 1 1 46 TRP HZ2 H -10.850 6.206 10.999 1.00 . A B . 46 TRP HZ2 1 1 18 14970 1 1 46 TRP HZ3 H -6.707 5.940 11.974 1.00 . A B . 46 TRP HZ3 1 1 18 14971 1 1 46 TRP N N -6.869 2.103 8.406 1.00 . A B . 46 TRP N 1 1 18 14972 1 1 46 TRP NE1 N -10.894 3.470 10.206 1.00 . A B . 46 TRP NE1 1 1 18 14973 1 1 46 TRP O O -9.310 -0.548 8.147 1.00 . A B . 46 TRP O 1 1 18 14974 1 1 47 ASN C C -8.719 0.077 4.386 1.00 . A B . 47 ASN C 1 1 18 14975 1 1 47 ASN CA C -9.488 0.523 5.618 1.00 . A B . 47 ASN CA 1 1 18 14976 1 1 47 ASN CB C -10.468 1.648 5.255 1.00 . A B . 47 ASN CB 1 1 18 14977 1 1 47 ASN CG C -11.496 1.918 6.343 1.00 . A B . 47 ASN CG 1 1 18 14978 1 1 47 ASN H H -7.916 1.663 6.464 1.00 . A B . 47 ASN H 1 1 18 14979 1 1 47 ASN HA H -10.045 -0.318 6.003 1.00 . A B . 47 ASN HA 1 1 18 14980 1 1 47 ASN HB2 H -9.912 2.557 5.082 1.00 . A B . 47 ASN HB2 1 1 18 14981 1 1 47 ASN HB3 H -10.992 1.380 4.349 1.00 . A B . 47 ASN HB3 1 1 18 14982 1 1 47 ASN HD21 H -11.595 -0.017 6.796 1.00 . A B . 47 ASN HD21 1 1 18 14983 1 1 47 ASN HD22 H -12.610 1.028 7.734 1.00 . A B . 47 ASN HD22 1 1 18 14984 1 1 47 ASN N N -8.556 0.944 6.657 1.00 . A B . 47 ASN N 1 1 18 14985 1 1 47 ASN ND2 N -11.944 0.873 7.024 1.00 . A B . 47 ASN ND2 1 1 18 14986 1 1 47 ASN O O -7.991 0.864 3.783 1.00 . A B . 47 ASN O 1 1 18 14987 1 1 47 ASN OD1 O -11.903 3.061 6.553 1.00 . A B . 47 ASN OD1 1 1 18 14988 1 1 48 CYS C C -8.944 -1.607 1.625 1.00 . A B . 48 CYS C 1 1 18 14989 1 1 48 CYS CA C -8.117 -1.731 2.905 1.00 . A B . 48 CYS CA 1 1 18 14990 1 1 48 CYS CB C -7.764 -3.201 3.176 1.00 . A B . 48 CYS CB 1 1 18 14991 1 1 48 CYS H H -9.447 -1.780 4.548 1.00 . A B . 48 CYS H 1 1 18 14992 1 1 48 CYS HA H -7.207 -1.160 2.795 1.00 . A B . 48 CYS HA 1 1 18 14993 1 1 48 CYS HB2 H -7.278 -3.274 4.137 1.00 . A B . 48 CYS HB2 1 1 18 14994 1 1 48 CYS HB3 H -8.674 -3.783 3.196 1.00 . A B . 48 CYS HB3 1 1 18 14995 1 1 48 CYS N N -8.849 -1.192 4.033 1.00 . A B . 48 CYS N 1 1 18 14996 1 1 48 CYS O O -10.051 -2.138 1.534 1.00 . A B . 48 CYS O 1 1 18 14997 1 1 48 CYS SG S -6.664 -3.948 1.956 1.00 . A B . 48 CYS SG 1 1 18 14998 1 1 49 ILE C C -8.959 -1.982 -1.519 1.00 . A B . 49 ILE C 1 1 18 14999 1 1 49 ILE CA C -9.083 -0.741 -0.645 1.00 . A B . 49 ILE CA 1 1 18 15000 1 1 49 ILE CB C -8.565 0.489 -1.435 1.00 . A B . 49 ILE CB 1 1 18 15001 1 1 49 ILE CD1 C -6.492 1.510 -2.524 1.00 . A B . 49 ILE CD1 1 1 18 15002 1 1 49 ILE CG1 C -7.041 0.453 -1.584 1.00 . A B . 49 ILE CG1 1 1 18 15003 1 1 49 ILE CG2 C -9.006 1.781 -0.761 1.00 . A B . 49 ILE CG2 1 1 18 15004 1 1 49 ILE H H -7.505 -0.512 0.759 1.00 . A B . 49 ILE H 1 1 18 15005 1 1 49 ILE HA H -10.129 -0.581 -0.425 1.00 . A B . 49 ILE HA 1 1 18 15006 1 1 49 ILE HB H -9.011 0.460 -2.419 1.00 . A B . 49 ILE HB 1 1 18 15007 1 1 49 ILE HD11 H -6.887 1.349 -3.517 1.00 . A B . 49 ILE HD11 1 1 18 15008 1 1 49 ILE HD12 H -5.413 1.447 -2.550 1.00 . A B . 49 ILE HD12 1 1 18 15009 1 1 49 ILE HD13 H -6.787 2.489 -2.175 1.00 . A B . 49 ILE HD13 1 1 18 15010 1 1 49 ILE HG12 H -6.592 0.614 -0.617 1.00 . A B . 49 ILE HG12 1 1 18 15011 1 1 49 ILE HG13 H -6.742 -0.516 -1.959 1.00 . A B . 49 ILE HG13 1 1 18 15012 1 1 49 ILE HG21 H -8.613 2.623 -1.311 1.00 . A B . 49 ILE HG21 1 1 18 15013 1 1 49 ILE HG22 H -8.632 1.808 0.250 1.00 . A B . 49 ILE HG22 1 1 18 15014 1 1 49 ILE HG23 H -10.085 1.834 -0.748 1.00 . A B . 49 ILE HG23 1 1 18 15015 1 1 49 ILE N N -8.391 -0.921 0.629 1.00 . A B . 49 ILE N 1 1 18 15016 1 1 49 ILE O O -9.850 -2.287 -2.311 1.00 . A B . 49 ILE O 1 1 18 15017 1 1 50 PHE C C -8.460 -5.067 -1.715 1.00 . A B . 50 PHE C 1 1 18 15018 1 1 50 PHE CA C -7.618 -3.889 -2.175 1.00 . A B . 50 PHE CA 1 1 18 15019 1 1 50 PHE CB C -6.133 -4.251 -2.242 1.00 . A B . 50 PHE CB 1 1 18 15020 1 1 50 PHE CD1 C -5.523 -4.627 -4.646 1.00 . A B . 50 PHE CD1 1 1 18 15021 1 1 50 PHE CD2 C -4.913 -2.551 -3.643 1.00 . A B . 50 PHE CD2 1 1 18 15022 1 1 50 PHE CE1 C -4.968 -4.216 -5.842 1.00 . A B . 50 PHE CE1 1 1 18 15023 1 1 50 PHE CE2 C -4.355 -2.136 -4.837 1.00 . A B . 50 PHE CE2 1 1 18 15024 1 1 50 PHE CG C -5.502 -3.801 -3.532 1.00 . A B . 50 PHE CG 1 1 18 15025 1 1 50 PHE CZ C -4.384 -2.969 -5.938 1.00 . A B . 50 PHE CZ 1 1 18 15026 1 1 50 PHE H H -7.238 -2.481 -0.639 1.00 . A B . 50 PHE H 1 1 18 15027 1 1 50 PHE HA H -7.943 -3.636 -3.177 1.00 . A B . 50 PHE HA 1 1 18 15028 1 1 50 PHE HB2 H -5.605 -3.781 -1.424 1.00 . A B . 50 PHE HB2 1 1 18 15029 1 1 50 PHE HB3 H -6.024 -5.325 -2.173 1.00 . A B . 50 PHE HB3 1 1 18 15030 1 1 50 PHE HD1 H -5.979 -5.603 -4.572 1.00 . A B . 50 PHE HD1 1 1 18 15031 1 1 50 PHE HD2 H -4.886 -1.899 -2.786 1.00 . A B . 50 PHE HD2 1 1 18 15032 1 1 50 PHE HE1 H -4.991 -4.870 -6.701 1.00 . A B . 50 PHE HE1 1 1 18 15033 1 1 50 PHE HE2 H -3.900 -1.160 -4.908 1.00 . A B . 50 PHE HE2 1 1 18 15034 1 1 50 PHE HZ H -3.951 -2.645 -6.873 1.00 . A B . 50 PHE HZ 1 1 18 15035 1 1 50 PHE N N -7.865 -2.713 -1.355 1.00 . A B . 50 PHE N 1 1 18 15036 1 1 50 PHE O O -8.807 -5.923 -2.515 1.00 . A B . 50 PHE O 1 1 18 15037 1 1 51 CYS C C -11.048 -6.048 -0.594 1.00 . A B . 51 CYS C 1 1 18 15038 1 1 51 CYS CA C -9.680 -6.157 0.075 1.00 . A B . 51 CYS CA 1 1 18 15039 1 1 51 CYS CB C -9.839 -6.065 1.593 1.00 . A B . 51 CYS CB 1 1 18 15040 1 1 51 CYS H H -8.419 -4.452 0.194 1.00 . A B . 51 CYS H 1 1 18 15041 1 1 51 CYS HA H -9.248 -7.117 -0.178 1.00 . A B . 51 CYS HA 1 1 18 15042 1 1 51 CYS HB2 H -9.695 -5.040 1.900 1.00 . A B . 51 CYS HB2 1 1 18 15043 1 1 51 CYS HB3 H -10.838 -6.378 1.863 1.00 . A B . 51 CYS HB3 1 1 18 15044 1 1 51 CYS N N -8.779 -5.123 -0.424 1.00 . A B . 51 CYS N 1 1 18 15045 1 1 51 CYS O O -11.678 -7.056 -0.903 1.00 . A B . 51 CYS O 1 1 18 15046 1 1 51 CYS SG S -8.669 -7.080 2.522 1.00 . A B . 51 CYS SG 1 1 18 15047 1 1 52 ARG C C -12.717 -4.665 -2.954 1.00 . A B . 52 ARG C 1 1 18 15048 1 1 52 ARG CA C -12.801 -4.590 -1.433 1.00 . A B . 52 ARG CA 1 1 18 15049 1 1 52 ARG CB C -13.356 -3.226 -1.007 1.00 . A B . 52 ARG CB 1 1 18 15050 1 1 52 ARG CD C -14.020 -1.686 0.876 1.00 . A B . 52 ARG CD 1 1 18 15051 1 1 52 ARG CG C -13.407 -3.026 0.502 1.00 . A B . 52 ARG CG 1 1 18 15052 1 1 52 ARG CZ C -13.000 0.568 0.857 1.00 . A B . 52 ARG CZ 1 1 18 15053 1 1 52 ARG H H -10.936 -4.052 -0.596 1.00 . A B . 52 ARG H 1 1 18 15054 1 1 52 ARG HA H -13.464 -5.366 -1.085 1.00 . A B . 52 ARG HA 1 1 18 15055 1 1 52 ARG HB2 H -12.736 -2.450 -1.430 1.00 . A B . 52 ARG HB2 1 1 18 15056 1 1 52 ARG HB3 H -14.358 -3.123 -1.396 1.00 . A B . 52 ARG HB3 1 1 18 15057 1 1 52 ARG HD2 H -15.056 -1.682 0.575 1.00 . A B . 52 ARG HD2 1 1 18 15058 1 1 52 ARG HD3 H -13.959 -1.566 1.946 1.00 . A B . 52 ARG HD3 1 1 18 15059 1 1 52 ARG HE H -13.135 -0.651 -0.724 1.00 . A B . 52 ARG HE 1 1 18 15060 1 1 52 ARG HG2 H -14.001 -3.815 0.941 1.00 . A B . 52 ARG HG2 1 1 18 15061 1 1 52 ARG HG3 H -12.402 -3.072 0.896 1.00 . A B . 52 ARG HG3 1 1 18 15062 1 1 52 ARG HH11 H -13.662 -0.016 2.687 1.00 . A B . 52 ARG HH11 1 1 18 15063 1 1 52 ARG HH12 H -12.977 1.578 2.617 1.00 . A B . 52 ARG HH12 1 1 18 15064 1 1 52 ARG HH21 H -12.244 1.438 -0.807 1.00 . A B . 52 ARG HH21 1 1 18 15065 1 1 52 ARG HH22 H -12.170 2.403 0.635 1.00 . A B . 52 ARG HH22 1 1 18 15066 1 1 52 ARG N N -11.493 -4.820 -0.834 1.00 . A B . 52 ARG N 1 1 18 15067 1 1 52 ARG NE N -13.336 -0.564 0.235 1.00 . A B . 52 ARG NE 1 1 18 15068 1 1 52 ARG NH1 N -13.231 0.721 2.159 1.00 . A B . 52 ARG NH1 1 1 18 15069 1 1 52 ARG NH2 N -12.424 1.546 0.174 1.00 . A B . 52 ARG NH2 1 1 18 15070 1 1 52 ARG O O -13.731 -4.584 -3.651 1.00 . A B . 52 ARG O 1 1 18 15071 1 1 53 MET C C -10.428 -6.135 -5.219 1.00 . A B . 53 MET C 1 1 18 15072 1 1 53 MET CA C -11.278 -4.906 -4.899 1.00 . A B . 53 MET CA 1 1 18 15073 1 1 53 MET CB C -10.597 -3.625 -5.397 1.00 . A B . 53 MET CB 1 1 18 15074 1 1 53 MET CE C -8.126 -2.156 -6.814 1.00 . A B . 53 MET CE 1 1 18 15075 1 1 53 MET CG C -10.567 -3.477 -6.911 1.00 . A B . 53 MET CG 1 1 18 15076 1 1 53 MET H H -10.736 -4.872 -2.854 1.00 . A B . 53 MET H 1 1 18 15077 1 1 53 MET HA H -12.236 -5.011 -5.381 1.00 . A B . 53 MET HA 1 1 18 15078 1 1 53 MET HB2 H -11.122 -2.774 -4.987 1.00 . A B . 53 MET HB2 1 1 18 15079 1 1 53 MET HB3 H -9.580 -3.612 -5.035 1.00 . A B . 53 MET HB3 1 1 18 15080 1 1 53 MET HE1 H -8.156 -2.259 -5.740 1.00 . A B . 53 MET HE1 1 1 18 15081 1 1 53 MET HE2 H -7.526 -1.297 -7.077 1.00 . A B . 53 MET HE2 1 1 18 15082 1 1 53 MET HE3 H -7.692 -3.044 -7.248 1.00 . A B . 53 MET HE3 1 1 18 15083 1 1 53 MET HG2 H -10.014 -4.305 -7.327 1.00 . A B . 53 MET HG2 1 1 18 15084 1 1 53 MET HG3 H -11.581 -3.500 -7.282 1.00 . A B . 53 MET HG3 1 1 18 15085 1 1 53 MET N N -11.504 -4.818 -3.462 1.00 . A B . 53 MET N 1 1 18 15086 1 1 53 MET O O -9.718 -6.185 -6.222 1.00 . A B . 53 MET O 1 1 18 15087 1 1 53 MET SD S -9.791 -1.937 -7.441 1.00 . A B . 53 MET SD 1 1 18 15088 1 1 54 LYS C C -10.335 -9.177 -5.650 1.00 . A B . 54 LYS C 1 1 18 15089 1 1 54 LYS CA C -9.749 -8.358 -4.510 1.00 . A B . 54 LYS CA 1 1 18 15090 1 1 54 LYS CB C -9.766 -9.169 -3.205 1.00 . A B . 54 LYS CB 1 1 18 15091 1 1 54 LYS CD C -8.955 -11.168 -1.912 1.00 . A B . 54 LYS CD 1 1 18 15092 1 1 54 LYS CE C -7.952 -12.312 -1.856 1.00 . A B . 54 LYS CE 1 1 18 15093 1 1 54 LYS CG C -8.872 -10.404 -3.224 1.00 . A B . 54 LYS CG 1 1 18 15094 1 1 54 LYS H H -11.089 -7.026 -3.561 1.00 . A B . 54 LYS H 1 1 18 15095 1 1 54 LYS HA H -8.732 -8.091 -4.754 1.00 . A B . 54 LYS HA 1 1 18 15096 1 1 54 LYS HB2 H -9.448 -8.533 -2.393 1.00 . A B . 54 LYS HB2 1 1 18 15097 1 1 54 LYS HB3 H -10.780 -9.492 -3.016 1.00 . A B . 54 LYS HB3 1 1 18 15098 1 1 54 LYS HD2 H -8.752 -10.488 -1.097 1.00 . A B . 54 LYS HD2 1 1 18 15099 1 1 54 LYS HD3 H -9.952 -11.571 -1.805 1.00 . A B . 54 LYS HD3 1 1 18 15100 1 1 54 LYS HE2 H -6.956 -11.906 -1.948 1.00 . A B . 54 LYS HE2 1 1 18 15101 1 1 54 LYS HE3 H -8.046 -12.809 -0.901 1.00 . A B . 54 LYS HE3 1 1 18 15102 1 1 54 LYS HG2 H -9.190 -11.053 -4.027 1.00 . A B . 54 LYS HG2 1 1 18 15103 1 1 54 LYS HG3 H -7.849 -10.098 -3.389 1.00 . A B . 54 LYS HG3 1 1 18 15104 1 1 54 LYS HZ1 H -7.471 -14.079 -2.855 1.00 . A B . 54 LYS HZ1 1 1 18 15105 1 1 54 LYS HZ2 H -8.056 -12.860 -3.868 1.00 . A B . 54 LYS HZ2 1 1 18 15106 1 1 54 LYS HZ3 H -9.122 -13.711 -2.872 1.00 . A B . 54 LYS HZ3 1 1 18 15107 1 1 54 LYS N N -10.510 -7.129 -4.345 1.00 . A B . 54 LYS N 1 1 18 15108 1 1 54 LYS NZ N -8.167 -13.309 -2.939 1.00 . A B . 54 LYS NZ 1 1 18 15109 1 1 54 LYS O O -9.624 -9.904 -6.345 1.00 . A B . 54 LYS O 1 1 18 15110 1 1 55 GLU C C -13.411 -8.839 -7.484 1.00 . A B . 55 GLU C 1 1 18 15111 1 1 55 GLU CA C -12.351 -9.748 -6.875 1.00 . A B . 55 GLU CA 1 1 18 15112 1 1 55 GLU CB C -13.003 -10.996 -6.279 1.00 . A B . 55 GLU CB 1 1 18 15113 1 1 55 GLU CD C -14.589 -12.912 -6.615 1.00 . A B . 55 GLU CD 1 1 18 15114 1 1 55 GLU CG C -13.759 -11.844 -7.284 1.00 . A B . 55 GLU CG 1 1 18 15115 1 1 55 GLU H H -12.130 -8.405 -5.269 1.00 . A B . 55 GLU H 1 1 18 15116 1 1 55 GLU HA H -11.648 -10.041 -7.637 1.00 . A B . 55 GLU HA 1 1 18 15117 1 1 55 GLU HB2 H -12.233 -11.609 -5.837 1.00 . A B . 55 GLU HB2 1 1 18 15118 1 1 55 GLU HB3 H -13.693 -10.691 -5.506 1.00 . A B . 55 GLU HB3 1 1 18 15119 1 1 55 GLU HG2 H -14.413 -11.205 -7.860 1.00 . A B . 55 GLU HG2 1 1 18 15120 1 1 55 GLU HG3 H -13.048 -12.319 -7.943 1.00 . A B . 55 GLU HG3 1 1 18 15121 1 1 55 GLU N N -11.634 -9.031 -5.842 1.00 . A B . 55 GLU N 1 1 18 15122 1 1 55 GLU O O -13.970 -7.984 -6.796 1.00 . A B . 55 GLU O 1 1 18 15123 1 1 55 GLU OE1 O -15.740 -12.624 -6.224 1.00 . A B . 55 GLU OE1 1 1 18 15124 1 1 55 GLU OE2 O -14.099 -14.052 -6.482 1.00 . A B . 55 GLU OE2 1 1 18 15125 1 1 56 SER C C -15.778 -9.111 -10.004 1.00 . A B . 56 SER C 1 1 18 15126 1 1 56 SER CA C -14.681 -8.212 -9.444 1.00 . A B . 56 SER CA 1 1 18 15127 1 1 56 SER CB C -14.034 -7.383 -10.553 1.00 . A B . 56 SER CB 1 1 18 15128 1 1 56 SER H H -13.196 -9.701 -9.271 1.00 . A B . 56 SER H 1 1 18 15129 1 1 56 SER HA H -15.118 -7.545 -8.716 1.00 . A B . 56 SER HA 1 1 18 15130 1 1 56 SER HB2 H -13.647 -8.041 -11.316 1.00 . A B . 56 SER HB2 1 1 18 15131 1 1 56 SER HB3 H -14.772 -6.724 -10.986 1.00 . A B . 56 SER HB3 1 1 18 15132 1 1 56 SER HG H -12.166 -7.136 -10.010 1.00 . A B . 56 SER HG 1 1 18 15133 1 1 56 SER N N -13.676 -9.011 -8.767 1.00 . A B . 56 SER N 1 1 18 15134 1 1 56 SER O O -15.707 -9.490 -11.190 1.00 . A B . 56 SER O 1 1 18 15135 1 1 56 SER OXT O -16.698 -9.461 -9.236 1.00 . A B . 56 SER OXT 1 1 18 15136 1 1 56 SER OG O -12.967 -6.599 -10.038 1.00 . A B . 56 SER OG 1 1 18 15137 2 2 1 ZN ZN ZN -6.548 -6.221 2.299 1.00 . B B . 101 ZN ZN 1 1 18 15138 3 2 1 ZN ZN ZN 5.912 0.915 0.119 1.00 . C B . 102 ZN ZN 1 1 19 15139 1 1 1 GLY C C 15.310 -4.936 8.971 1.00 . A B . 1 GLY C 1 1 19 15140 1 1 1 GLY CA C 16.340 -5.253 10.031 1.00 . A B . 1 GLY CA 1 1 19 15141 1 1 1 GLY H1 H 17.522 -3.572 9.708 1.00 . A B . 1 GLY H1 1 1 19 15142 1 1 1 GLY H2 H 17.764 -4.299 11.213 1.00 . A B . 1 GLY H2 1 1 19 15143 1 1 1 GLY H3 H 16.375 -3.377 10.932 1.00 . A B . 1 GLY H3 1 1 19 15144 1 1 1 GLY HA2 H 17.062 -5.943 9.622 1.00 . A B . 1 GLY HA2 1 1 19 15145 1 1 1 GLY HA3 H 15.847 -5.719 10.870 1.00 . A B . 1 GLY HA3 1 1 19 15146 1 1 1 GLY N N 17.049 -4.043 10.504 1.00 . A B . 1 GLY N 1 1 19 15147 1 1 1 GLY O O 14.107 -5.065 9.203 1.00 . A B . 1 GLY O 1 1 19 15148 1 1 2 ALA C C 15.701 -4.251 5.385 1.00 . A B . 2 ALA C 1 1 19 15149 1 1 2 ALA CA C 14.916 -4.192 6.688 1.00 . A B . 2 ALA CA 1 1 19 15150 1 1 2 ALA CB C 14.290 -2.816 6.872 1.00 . A B . 2 ALA CB 1 1 19 15151 1 1 2 ALA H H 16.756 -4.409 7.697 1.00 . A B . 2 ALA H 1 1 19 15152 1 1 2 ALA HA H 14.125 -4.927 6.656 1.00 . A B . 2 ALA HA 1 1 19 15153 1 1 2 ALA HB1 H 13.622 -2.612 6.047 1.00 . A B . 2 ALA HB1 1 1 19 15154 1 1 2 ALA HB2 H 15.068 -2.067 6.897 1.00 . A B . 2 ALA HB2 1 1 19 15155 1 1 2 ALA HB3 H 13.737 -2.792 7.798 1.00 . A B . 2 ALA HB3 1 1 19 15156 1 1 2 ALA N N 15.785 -4.511 7.808 1.00 . A B . 2 ALA N 1 1 19 15157 1 1 2 ALA O O 15.518 -3.421 4.497 1.00 . A B . 2 ALA O 1 1 19 15158 1 1 3 MET C C 17.459 -6.826 3.634 1.00 . A B . 3 MET C 1 1 19 15159 1 1 3 MET CA C 17.432 -5.377 4.110 1.00 . A B . 3 MET CA 1 1 19 15160 1 1 3 MET CB C 18.854 -4.900 4.429 1.00 . A B . 3 MET CB 1 1 19 15161 1 1 3 MET CE C 22.260 -4.639 2.040 1.00 . A B . 3 MET CE 1 1 19 15162 1 1 3 MET CG C 19.783 -4.916 3.224 1.00 . A B . 3 MET CG 1 1 19 15163 1 1 3 MET H H 16.641 -5.903 6.000 1.00 . A B . 3 MET H 1 1 19 15164 1 1 3 MET HA H 17.023 -4.757 3.326 1.00 . A B . 3 MET HA 1 1 19 15165 1 1 3 MET HB2 H 18.807 -3.890 4.808 1.00 . A B . 3 MET HB2 1 1 19 15166 1 1 3 MET HB3 H 19.276 -5.542 5.190 1.00 . A B . 3 MET HB3 1 1 19 15167 1 1 3 MET HE1 H 21.808 -3.951 1.341 1.00 . A B . 3 MET HE1 1 1 19 15168 1 1 3 MET HE2 H 22.130 -5.651 1.684 1.00 . A B . 3 MET HE2 1 1 19 15169 1 1 3 MET HE3 H 23.313 -4.421 2.130 1.00 . A B . 3 MET HE3 1 1 19 15170 1 1 3 MET HG2 H 19.786 -5.908 2.798 1.00 . A B . 3 MET HG2 1 1 19 15171 1 1 3 MET HG3 H 19.411 -4.215 2.492 1.00 . A B . 3 MET HG3 1 1 19 15172 1 1 3 MET N N 16.576 -5.240 5.278 1.00 . A B . 3 MET N 1 1 19 15173 1 1 3 MET O O 18.268 -7.635 4.098 1.00 . A B . 3 MET O 1 1 19 15174 1 1 3 MET SD S 21.477 -4.465 3.640 1.00 . A B . 3 MET SD 1 1 19 15175 1 1 4 GLY C C 15.122 -9.003 1.958 1.00 . A B . 4 GLY C 1 1 19 15176 1 1 4 GLY CA C 16.531 -8.488 2.154 1.00 . A B . 4 GLY CA 1 1 19 15177 1 1 4 GLY H H 15.899 -6.493 2.430 1.00 . A B . 4 GLY H 1 1 19 15178 1 1 4 GLY HA2 H 17.033 -8.471 1.199 1.00 . A B . 4 GLY HA2 1 1 19 15179 1 1 4 GLY HA3 H 17.057 -9.161 2.814 1.00 . A B . 4 GLY HA3 1 1 19 15180 1 1 4 GLY N N 16.558 -7.159 2.723 1.00 . A B . 4 GLY N 1 1 19 15181 1 1 4 GLY O O 14.752 -9.432 0.864 1.00 . A B . 4 GLY O 1 1 19 15182 1 1 5 MET C C 11.936 -8.360 2.918 1.00 . A B . 5 MET C 1 1 19 15183 1 1 5 MET CA C 12.973 -9.480 2.995 1.00 . A B . 5 MET CA 1 1 19 15184 1 1 5 MET CB C 12.730 -10.351 4.237 1.00 . A B . 5 MET CB 1 1 19 15185 1 1 5 MET CE C 13.568 -7.870 7.502 1.00 . A B . 5 MET CE 1 1 19 15186 1 1 5 MET CG C 12.610 -9.577 5.551 1.00 . A B . 5 MET CG 1 1 19 15187 1 1 5 MET H H 14.666 -8.529 3.842 1.00 . A B . 5 MET H 1 1 19 15188 1 1 5 MET HA H 12.879 -10.094 2.114 1.00 . A B . 5 MET HA 1 1 19 15189 1 1 5 MET HB2 H 11.817 -10.908 4.094 1.00 . A B . 5 MET HB2 1 1 19 15190 1 1 5 MET HB3 H 13.548 -11.047 4.333 1.00 . A B . 5 MET HB3 1 1 19 15191 1 1 5 MET HE1 H 14.348 -7.218 7.867 1.00 . A B . 5 MET HE1 1 1 19 15192 1 1 5 MET HE2 H 13.397 -8.662 8.214 1.00 . A B . 5 MET HE2 1 1 19 15193 1 1 5 MET HE3 H 12.658 -7.302 7.370 1.00 . A B . 5 MET HE3 1 1 19 15194 1 1 5 MET HG2 H 11.753 -8.923 5.488 1.00 . A B . 5 MET HG2 1 1 19 15195 1 1 5 MET HG3 H 12.459 -10.284 6.354 1.00 . A B . 5 MET HG3 1 1 19 15196 1 1 5 MET N N 14.329 -8.943 3.016 1.00 . A B . 5 MET N 1 1 19 15197 1 1 5 MET O O 10.845 -8.458 3.483 1.00 . A B . 5 MET O 1 1 19 15198 1 1 5 MET SD S 14.061 -8.574 5.933 1.00 . A B . 5 MET SD 1 1 19 15199 1 1 6 ARG C C 11.176 -5.773 0.649 1.00 . A B . 6 ARG C 1 1 19 15200 1 1 6 ARG CA C 11.403 -6.141 2.112 1.00 . A B . 6 ARG CA 1 1 19 15201 1 1 6 ARG CB C 12.005 -4.953 2.865 1.00 . A B . 6 ARG CB 1 1 19 15202 1 1 6 ARG CD C 11.024 -5.147 5.192 1.00 . A B . 6 ARG CD 1 1 19 15203 1 1 6 ARG CG C 12.285 -5.221 4.338 1.00 . A B . 6 ARG CG 1 1 19 15204 1 1 6 ARG CZ C 8.778 -6.164 5.243 1.00 . A B . 6 ARG CZ 1 1 19 15205 1 1 6 ARG H H 13.140 -7.287 1.744 1.00 . A B . 6 ARG H 1 1 19 15206 1 1 6 ARG HA H 10.456 -6.400 2.562 1.00 . A B . 6 ARG HA 1 1 19 15207 1 1 6 ARG HB2 H 12.938 -4.683 2.391 1.00 . A B . 6 ARG HB2 1 1 19 15208 1 1 6 ARG HB3 H 11.325 -4.118 2.796 1.00 . A B . 6 ARG HB3 1 1 19 15209 1 1 6 ARG HD2 H 11.307 -5.221 6.231 1.00 . A B . 6 ARG HD2 1 1 19 15210 1 1 6 ARG HD3 H 10.550 -4.192 5.021 1.00 . A B . 6 ARG HD3 1 1 19 15211 1 1 6 ARG HE H 10.401 -7.005 4.412 1.00 . A B . 6 ARG HE 1 1 19 15212 1 1 6 ARG HG2 H 12.710 -6.210 4.434 1.00 . A B . 6 ARG HG2 1 1 19 15213 1 1 6 ARG HG3 H 12.995 -4.490 4.695 1.00 . A B . 6 ARG HG3 1 1 19 15214 1 1 6 ARG HH11 H 8.903 -4.341 6.121 1.00 . A B . 6 ARG HH11 1 1 19 15215 1 1 6 ARG HH12 H 7.330 -5.074 6.153 1.00 . A B . 6 ARG HH12 1 1 19 15216 1 1 6 ARG HH21 H 8.326 -7.982 4.468 1.00 . A B . 6 ARG HH21 1 1 19 15217 1 1 6 ARG HH22 H 7.002 -7.136 5.208 1.00 . A B . 6 ARG HH22 1 1 19 15218 1 1 6 ARG N N 12.280 -7.295 2.217 1.00 . A B . 6 ARG N 1 1 19 15219 1 1 6 ARG NE N 10.064 -6.210 4.893 1.00 . A B . 6 ARG NE 1 1 19 15220 1 1 6 ARG NH1 N 8.300 -5.109 5.890 1.00 . A B . 6 ARG NH1 1 1 19 15221 1 1 6 ARG NH2 N 7.973 -7.176 4.951 1.00 . A B . 6 ARG NH2 1 1 19 15222 1 1 6 ARG O O 12.101 -5.793 -0.160 1.00 . A B . 6 ARG O 1 1 19 15223 1 1 7 ASN C C 9.558 -3.528 -1.164 1.00 . A B . 7 ASN C 1 1 19 15224 1 1 7 ASN CA C 9.592 -5.052 -1.053 1.00 . A B . 7 ASN CA 1 1 19 15225 1 1 7 ASN CB C 8.236 -5.656 -1.452 1.00 . A B . 7 ASN CB 1 1 19 15226 1 1 7 ASN CG C 7.850 -5.388 -2.900 1.00 . A B . 7 ASN CG 1 1 19 15227 1 1 7 ASN H H 9.234 -5.495 0.993 1.00 . A B . 7 ASN H 1 1 19 15228 1 1 7 ASN HA H 10.356 -5.433 -1.714 1.00 . A B . 7 ASN HA 1 1 19 15229 1 1 7 ASN HB2 H 8.273 -6.725 -1.306 1.00 . A B . 7 ASN HB2 1 1 19 15230 1 1 7 ASN HB3 H 7.468 -5.241 -0.814 1.00 . A B . 7 ASN HB3 1 1 19 15231 1 1 7 ASN HD21 H 9.752 -5.458 -3.479 1.00 . A B . 7 ASN HD21 1 1 19 15232 1 1 7 ASN HD22 H 8.602 -5.141 -4.728 1.00 . A B . 7 ASN HD22 1 1 19 15233 1 1 7 ASN N N 9.938 -5.450 0.312 1.00 . A B . 7 ASN N 1 1 19 15234 1 1 7 ASN ND2 N 8.832 -5.326 -3.791 1.00 . A B . 7 ASN ND2 1 1 19 15235 1 1 7 ASN O O 9.459 -2.964 -2.254 1.00 . A B . 7 ASN O 1 1 19 15236 1 1 7 ASN OD1 O 6.667 -5.262 -3.219 1.00 . A B . 7 ASN OD1 1 1 19 15237 1 1 8 LEU C C 10.935 -0.743 -0.218 1.00 . A B . 8 LEU C 1 1 19 15238 1 1 8 LEU CA C 9.588 -1.413 0.040 1.00 . A B . 8 LEU CA 1 1 19 15239 1 1 8 LEU CB C 9.018 -0.985 1.399 1.00 . A B . 8 LEU CB 1 1 19 15240 1 1 8 LEU CD1 C 10.689 -0.468 3.204 1.00 . A B . 8 LEU CD1 1 1 19 15241 1 1 8 LEU CD2 C 8.766 -1.992 3.681 1.00 . A B . 8 LEU CD2 1 1 19 15242 1 1 8 LEU CG C 9.757 -1.520 2.628 1.00 . A B . 8 LEU CG 1 1 19 15243 1 1 8 LEU H H 9.849 -3.370 0.798 1.00 . A B . 8 LEU H 1 1 19 15244 1 1 8 LEU HA H 8.903 -1.106 -0.733 1.00 . A B . 8 LEU HA 1 1 19 15245 1 1 8 LEU HB2 H 9.029 0.096 1.444 1.00 . A B . 8 LEU HB2 1 1 19 15246 1 1 8 LEU HB3 H 7.993 -1.315 1.454 1.00 . A B . 8 LEU HB3 1 1 19 15247 1 1 8 LEU HD11 H 10.112 0.381 3.539 1.00 . A B . 8 LEU HD11 1 1 19 15248 1 1 8 LEU HD12 H 11.388 -0.151 2.444 1.00 . A B . 8 LEU HD12 1 1 19 15249 1 1 8 LEU HD13 H 11.231 -0.884 4.040 1.00 . A B . 8 LEU HD13 1 1 19 15250 1 1 8 LEU HD21 H 8.135 -1.167 3.976 1.00 . A B . 8 LEU HD21 1 1 19 15251 1 1 8 LEU HD22 H 9.302 -2.361 4.542 1.00 . A B . 8 LEU HD22 1 1 19 15252 1 1 8 LEU HD23 H 8.154 -2.784 3.271 1.00 . A B . 8 LEU HD23 1 1 19 15253 1 1 8 LEU HG H 10.358 -2.367 2.333 1.00 . A B . 8 LEU HG 1 1 19 15254 1 1 8 LEU N N 9.685 -2.867 -0.024 1.00 . A B . 8 LEU N 1 1 19 15255 1 1 8 LEU O O 11.075 0.470 -0.062 1.00 . A B . 8 LEU O 1 1 19 15256 1 1 9 ASP C C 13.266 -0.277 -2.257 1.00 . A B . 9 ASP C 1 1 19 15257 1 1 9 ASP CA C 13.244 -1.011 -0.928 1.00 . A B . 9 ASP CA 1 1 19 15258 1 1 9 ASP CB C 14.281 -2.132 -0.932 1.00 . A B . 9 ASP CB 1 1 19 15259 1 1 9 ASP CG C 14.617 -2.605 0.463 1.00 . A B . 9 ASP CG 1 1 19 15260 1 1 9 ASP H H 11.720 -2.481 -0.781 1.00 . A B . 9 ASP H 1 1 19 15261 1 1 9 ASP HA H 13.492 -0.311 -0.145 1.00 . A B . 9 ASP HA 1 1 19 15262 1 1 9 ASP HB2 H 13.893 -2.968 -1.491 1.00 . A B . 9 ASP HB2 1 1 19 15263 1 1 9 ASP HB3 H 15.186 -1.777 -1.401 1.00 . A B . 9 ASP HB3 1 1 19 15264 1 1 9 ASP N N 11.910 -1.531 -0.645 1.00 . A B . 9 ASP N 1 1 19 15265 1 1 9 ASP O O 13.977 0.712 -2.421 1.00 . A B . 9 ASP O 1 1 19 15266 1 1 9 ASP OD1 O 13.869 -3.444 1.005 1.00 . A B . 9 ASP OD1 1 1 19 15267 1 1 9 ASP OD2 O 15.638 -2.156 1.017 1.00 . A B . 9 ASP OD2 1 1 19 15268 1 1 10 GLU C C 11.164 0.802 -4.546 1.00 . A B . 10 GLU C 1 1 19 15269 1 1 10 GLU CA C 12.366 -0.137 -4.512 1.00 . A B . 10 GLU CA 1 1 19 15270 1 1 10 GLU CB C 12.228 -1.197 -5.604 1.00 . A B . 10 GLU CB 1 1 19 15271 1 1 10 GLU CD C 14.713 -1.627 -5.811 1.00 . A B . 10 GLU CD 1 1 19 15272 1 1 10 GLU CG C 13.341 -2.234 -5.604 1.00 . A B . 10 GLU CG 1 1 19 15273 1 1 10 GLU H H 11.976 -1.587 -3.016 1.00 . A B . 10 GLU H 1 1 19 15274 1 1 10 GLU HA H 13.263 0.436 -4.684 1.00 . A B . 10 GLU HA 1 1 19 15275 1 1 10 GLU HB2 H 11.287 -1.711 -5.471 1.00 . A B . 10 GLU HB2 1 1 19 15276 1 1 10 GLU HB3 H 12.225 -0.705 -6.566 1.00 . A B . 10 GLU HB3 1 1 19 15277 1 1 10 GLU HG2 H 13.334 -2.748 -4.654 1.00 . A B . 10 GLU HG2 1 1 19 15278 1 1 10 GLU HG3 H 13.154 -2.944 -6.397 1.00 . A B . 10 GLU HG3 1 1 19 15279 1 1 10 GLU N N 12.478 -0.767 -3.201 1.00 . A B . 10 GLU N 1 1 19 15280 1 1 10 GLU O O 10.744 1.268 -5.604 1.00 . A B . 10 GLU O 1 1 19 15281 1 1 10 GLU OE1 O 15.061 -1.314 -6.968 1.00 . A B . 10 GLU OE1 1 1 19 15282 1 1 10 GLU OE2 O 15.449 -1.455 -4.818 1.00 . A B . 10 GLU OE2 1 1 19 15283 1 1 11 CYS C C 9.821 3.287 -2.757 1.00 . A B . 11 CYS C 1 1 19 15284 1 1 11 CYS CA C 9.438 1.893 -3.238 1.00 . A B . 11 CYS CA 1 1 19 15285 1 1 11 CYS CB C 8.482 1.220 -2.261 1.00 . A B . 11 CYS CB 1 1 19 15286 1 1 11 CYS H H 11.044 0.711 -2.567 1.00 . A B . 11 CYS H 1 1 19 15287 1 1 11 CYS HA H 8.967 1.968 -4.206 1.00 . A B . 11 CYS HA 1 1 19 15288 1 1 11 CYS HB2 H 8.328 0.204 -2.578 1.00 . A B . 11 CYS HB2 1 1 19 15289 1 1 11 CYS HB3 H 8.937 1.213 -1.281 1.00 . A B . 11 CYS HB3 1 1 19 15290 1 1 11 CYS N N 10.623 1.071 -3.373 1.00 . A B . 11 CYS N 1 1 19 15291 1 1 11 CYS O O 9.983 3.520 -1.557 1.00 . A B . 11 CYS O 1 1 19 15292 1 1 11 CYS SG S 6.853 1.986 -2.101 1.00 . A B . 11 CYS SG 1 1 19 15293 1 1 12 GLU C C 9.435 6.231 -2.426 1.00 . A B . 12 GLU C 1 1 19 15294 1 1 12 GLU CA C 10.372 5.576 -3.421 1.00 . A B . 12 GLU CA 1 1 19 15295 1 1 12 GLU CB C 10.376 6.394 -4.705 1.00 . A B . 12 GLU CB 1 1 19 15296 1 1 12 GLU CD C 10.965 6.403 -7.142 1.00 . A B . 12 GLU CD 1 1 19 15297 1 1 12 GLU CG C 11.304 5.856 -5.776 1.00 . A B . 12 GLU CG 1 1 19 15298 1 1 12 GLU H H 9.812 3.942 -4.640 1.00 . A B . 12 GLU H 1 1 19 15299 1 1 12 GLU HA H 11.366 5.560 -3.010 1.00 . A B . 12 GLU HA 1 1 19 15300 1 1 12 GLU HB2 H 9.373 6.414 -5.105 1.00 . A B . 12 GLU HB2 1 1 19 15301 1 1 12 GLU HB3 H 10.679 7.404 -4.472 1.00 . A B . 12 GLU HB3 1 1 19 15302 1 1 12 GLU HG2 H 12.320 6.136 -5.533 1.00 . A B . 12 GLU HG2 1 1 19 15303 1 1 12 GLU HG3 H 11.222 4.780 -5.804 1.00 . A B . 12 GLU HG3 1 1 19 15304 1 1 12 GLU N N 9.971 4.202 -3.706 1.00 . A B . 12 GLU N 1 1 19 15305 1 1 12 GLU O O 9.869 6.931 -1.515 1.00 . A B . 12 GLU O 1 1 19 15306 1 1 12 GLU OE1 O 11.114 7.628 -7.348 1.00 . A B . 12 GLU OE1 1 1 19 15307 1 1 12 GLU OE2 O 10.557 5.615 -8.018 1.00 . A B . 12 GLU OE2 1 1 19 15308 1 1 13 VAL C C 7.250 6.117 -0.308 1.00 . A B . 13 VAL C 1 1 19 15309 1 1 13 VAL CA C 7.148 6.612 -1.755 1.00 . A B . 13 VAL CA 1 1 19 15310 1 1 13 VAL CB C 5.730 6.383 -2.326 1.00 . A B . 13 VAL CB 1 1 19 15311 1 1 13 VAL CG1 C 5.427 4.908 -2.467 1.00 . A B . 13 VAL CG1 1 1 19 15312 1 1 13 VAL CG2 C 4.680 7.055 -1.467 1.00 . A B . 13 VAL CG2 1 1 19 15313 1 1 13 VAL H H 7.859 5.371 -3.299 1.00 . A B . 13 VAL H 1 1 19 15314 1 1 13 VAL HA H 7.342 7.674 -1.764 1.00 . A B . 13 VAL HA 1 1 19 15315 1 1 13 VAL HB H 5.691 6.823 -3.310 1.00 . A B . 13 VAL HB 1 1 19 15316 1 1 13 VAL HG11 H 6.162 4.446 -3.108 1.00 . A B . 13 VAL HG11 1 1 19 15317 1 1 13 VAL HG12 H 4.447 4.786 -2.899 1.00 . A B . 13 VAL HG12 1 1 19 15318 1 1 13 VAL HG13 H 5.451 4.440 -1.494 1.00 . A B . 13 VAL HG13 1 1 19 15319 1 1 13 VAL HG21 H 4.908 8.107 -1.379 1.00 . A B . 13 VAL HG21 1 1 19 15320 1 1 13 VAL HG22 H 4.679 6.602 -0.488 1.00 . A B . 13 VAL HG22 1 1 19 15321 1 1 13 VAL HG23 H 3.709 6.932 -1.924 1.00 . A B . 13 VAL HG23 1 1 19 15322 1 1 13 VAL N N 8.149 5.986 -2.593 1.00 . A B . 13 VAL N 1 1 19 15323 1 1 13 VAL O O 6.954 6.852 0.628 1.00 . A B . 13 VAL O 1 1 19 15324 1 1 14 CYS C C 9.134 5.068 1.856 1.00 . A B . 14 CYS C 1 1 19 15325 1 1 14 CYS CA C 7.945 4.363 1.220 1.00 . A B . 14 CYS CA 1 1 19 15326 1 1 14 CYS CB C 8.181 2.857 1.205 1.00 . A B . 14 CYS CB 1 1 19 15327 1 1 14 CYS H H 7.901 4.316 -0.901 1.00 . A B . 14 CYS H 1 1 19 15328 1 1 14 CYS HA H 7.066 4.571 1.810 1.00 . A B . 14 CYS HA 1 1 19 15329 1 1 14 CYS HB2 H 8.504 2.562 0.220 1.00 . A B . 14 CYS HB2 1 1 19 15330 1 1 14 CYS HB3 H 8.953 2.617 1.919 1.00 . A B . 14 CYS HB3 1 1 19 15331 1 1 14 CYS N N 7.706 4.880 -0.123 1.00 . A B . 14 CYS N 1 1 19 15332 1 1 14 CYS O O 9.185 5.255 3.070 1.00 . A B . 14 CYS O 1 1 19 15333 1 1 14 CYS SG S 6.718 1.881 1.621 1.00 . A B . 14 CYS SG 1 1 19 15334 1 1 15 ARG C C 10.813 7.566 2.005 1.00 . A B . 15 ARG C 1 1 19 15335 1 1 15 ARG CA C 11.247 6.205 1.490 1.00 . A B . 15 ARG CA 1 1 19 15336 1 1 15 ARG CB C 12.269 6.374 0.369 1.00 . A B . 15 ARG CB 1 1 19 15337 1 1 15 ARG CD C 13.645 5.296 -1.429 1.00 . A B . 15 ARG CD 1 1 19 15338 1 1 15 ARG CG C 12.676 5.066 -0.286 1.00 . A B . 15 ARG CG 1 1 19 15339 1 1 15 ARG CZ C 14.408 3.978 -3.374 1.00 . A B . 15 ARG CZ 1 1 19 15340 1 1 15 ARG H H 9.979 5.280 0.063 1.00 . A B . 15 ARG H 1 1 19 15341 1 1 15 ARG HA H 11.690 5.648 2.298 1.00 . A B . 15 ARG HA 1 1 19 15342 1 1 15 ARG HB2 H 11.847 7.015 -0.391 1.00 . A B . 15 ARG HB2 1 1 19 15343 1 1 15 ARG HB3 H 13.155 6.842 0.772 1.00 . A B . 15 ARG HB3 1 1 19 15344 1 1 15 ARG HD2 H 13.180 5.955 -2.145 1.00 . A B . 15 ARG HD2 1 1 19 15345 1 1 15 ARG HD3 H 14.537 5.761 -1.040 1.00 . A B . 15 ARG HD3 1 1 19 15346 1 1 15 ARG HE H 13.966 3.223 -1.570 1.00 . A B . 15 ARG HE 1 1 19 15347 1 1 15 ARG HG2 H 13.148 4.436 0.451 1.00 . A B . 15 ARG HG2 1 1 19 15348 1 1 15 ARG HG3 H 11.792 4.578 -0.666 1.00 . A B . 15 ARG HG3 1 1 19 15349 1 1 15 ARG HH11 H 14.242 5.968 -3.739 1.00 . A B . 15 ARG HH11 1 1 19 15350 1 1 15 ARG HH12 H 14.781 5.010 -5.081 1.00 . A B . 15 ARG HH12 1 1 19 15351 1 1 15 ARG HH21 H 14.665 1.966 -3.346 1.00 . A B . 15 ARG HH21 1 1 19 15352 1 1 15 ARG HH22 H 15.028 2.746 -4.859 1.00 . A B . 15 ARG HH22 1 1 19 15353 1 1 15 ARG N N 10.080 5.472 1.021 1.00 . A B . 15 ARG N 1 1 19 15354 1 1 15 ARG NE N 14.013 4.051 -2.102 1.00 . A B . 15 ARG NE 1 1 19 15355 1 1 15 ARG NH1 N 14.481 5.072 -4.123 1.00 . A B . 15 ARG NH1 1 1 19 15356 1 1 15 ARG NH2 N 14.724 2.805 -3.902 1.00 . A B . 15 ARG NH2 1 1 19 15357 1 1 15 ARG O O 11.339 8.070 2.998 1.00 . A B . 15 ARG O 1 1 19 15358 1 1 16 ASP C C 8.336 9.232 2.961 1.00 . A B . 16 ASP C 1 1 19 15359 1 1 16 ASP CA C 9.229 9.406 1.738 1.00 . A B . 16 ASP CA 1 1 19 15360 1 1 16 ASP CB C 8.413 10.017 0.596 1.00 . A B . 16 ASP CB 1 1 19 15361 1 1 16 ASP CG C 9.273 10.686 -0.453 1.00 . A B . 16 ASP CG 1 1 19 15362 1 1 16 ASP H H 9.508 7.706 0.501 1.00 . A B . 16 ASP H 1 1 19 15363 1 1 16 ASP HA H 10.034 10.079 1.991 1.00 . A B . 16 ASP HA 1 1 19 15364 1 1 16 ASP HB2 H 7.840 9.236 0.116 1.00 . A B . 16 ASP HB2 1 1 19 15365 1 1 16 ASP HB3 H 7.734 10.753 1.003 1.00 . A B . 16 ASP HB3 1 1 19 15366 1 1 16 ASP N N 9.825 8.139 1.328 1.00 . A B . 16 ASP N 1 1 19 15367 1 1 16 ASP O O 7.873 10.210 3.547 1.00 . A B . 16 ASP O 1 1 19 15368 1 1 16 ASP OD1 O 9.629 11.869 -0.265 1.00 . A B . 16 ASP OD1 1 1 19 15369 1 1 16 ASP OD2 O 9.592 10.042 -1.476 1.00 . A B . 16 ASP OD2 1 1 19 15370 1 1 17 GLY C C 5.772 7.760 4.090 1.00 . A B . 17 GLY C 1 1 19 15371 1 1 17 GLY CA C 7.235 7.706 4.474 1.00 . A B . 17 GLY CA 1 1 19 15372 1 1 17 GLY H H 8.530 7.245 2.864 1.00 . A B . 17 GLY H 1 1 19 15373 1 1 17 GLY HA2 H 7.464 6.721 4.859 1.00 . A B . 17 GLY HA2 1 1 19 15374 1 1 17 GLY HA3 H 7.421 8.438 5.247 1.00 . A B . 17 GLY HA3 1 1 19 15375 1 1 17 GLY N N 8.102 7.985 3.346 1.00 . A B . 17 GLY N 1 1 19 15376 1 1 17 GLY O O 4.917 8.084 4.915 1.00 . A B . 17 GLY O 1 1 19 15377 1 1 18 GLY C C 3.249 6.425 3.004 1.00 . A B . 18 GLY C 1 1 19 15378 1 1 18 GLY CA C 4.128 7.461 2.336 1.00 . A B . 18 GLY CA 1 1 19 15379 1 1 18 GLY H H 6.224 7.225 2.218 1.00 . A B . 18 GLY H 1 1 19 15380 1 1 18 GLY HA2 H 3.702 8.438 2.506 1.00 . A B . 18 GLY HA2 1 1 19 15381 1 1 18 GLY HA3 H 4.143 7.268 1.276 1.00 . A B . 18 GLY HA3 1 1 19 15382 1 1 18 GLY N N 5.490 7.452 2.830 1.00 . A B . 18 GLY N 1 1 19 15383 1 1 18 GLY O O 3.740 5.437 3.554 1.00 . A B . 18 GLY O 1 1 19 15384 1 1 19 GLU C C 0.596 4.616 2.711 1.00 . A B . 19 GLU C 1 1 19 15385 1 1 19 GLU CA C 0.981 5.791 3.599 1.00 . A B . 19 GLU CA 1 1 19 15386 1 1 19 GLU CB C -0.271 6.597 3.960 1.00 . A B . 19 GLU CB 1 1 19 15387 1 1 19 GLU CD C -1.233 8.579 5.201 1.00 . A B . 19 GLU CD 1 1 19 15388 1 1 19 GLU CG C 0.024 7.860 4.754 1.00 . A B . 19 GLU CG 1 1 19 15389 1 1 19 GLU H H 1.627 7.405 2.408 1.00 . A B . 19 GLU H 1 1 19 15390 1 1 19 GLU HA H 1.432 5.413 4.503 1.00 . A B . 19 GLU HA 1 1 19 15391 1 1 19 GLU HB2 H -0.767 6.885 3.045 1.00 . A B . 19 GLU HB2 1 1 19 15392 1 1 19 GLU HB3 H -0.936 5.974 4.540 1.00 . A B . 19 GLU HB3 1 1 19 15393 1 1 19 GLU HG2 H 0.599 7.599 5.630 1.00 . A B . 19 GLU HG2 1 1 19 15394 1 1 19 GLU HG3 H 0.603 8.532 4.135 1.00 . A B . 19 GLU HG3 1 1 19 15395 1 1 19 GLU N N 1.949 6.646 2.934 1.00 . A B . 19 GLU N 1 1 19 15396 1 1 19 GLU O O 0.848 4.620 1.504 1.00 . A B . 19 GLU O 1 1 19 15397 1 1 19 GLU OE1 O -2.012 9.001 4.321 1.00 . A B . 19 GLU OE1 1 1 19 15398 1 1 19 GLU OE2 O -1.444 8.725 6.422 1.00 . A B . 19 GLU OE2 1 1 19 15399 1 1 20 LEU C C -2.018 2.402 2.706 1.00 . A B . 20 LEU C 1 1 19 15400 1 1 20 LEU CA C -0.501 2.449 2.615 1.00 . A B . 20 LEU CA 1 1 19 15401 1 1 20 LEU CB C 0.090 1.172 3.212 1.00 . A B . 20 LEU CB 1 1 19 15402 1 1 20 LEU CD1 C 2.137 -0.203 3.650 1.00 . A B . 20 LEU CD1 1 1 19 15403 1 1 20 LEU CD2 C 1.394 0.201 1.308 1.00 . A B . 20 LEU CD2 1 1 19 15404 1 1 20 LEU CG C 1.483 0.793 2.707 1.00 . A B . 20 LEU CG 1 1 19 15405 1 1 20 LEU H H -0.116 3.653 4.298 1.00 . A B . 20 LEU H 1 1 19 15406 1 1 20 LEU HA H -0.207 2.531 1.579 1.00 . A B . 20 LEU HA 1 1 19 15407 1 1 20 LEU HB2 H 0.143 1.295 4.283 1.00 . A B . 20 LEU HB2 1 1 19 15408 1 1 20 LEU HB3 H -0.582 0.357 2.993 1.00 . A B . 20 LEU HB3 1 1 19 15409 1 1 20 LEU HD11 H 1.486 -1.053 3.781 1.00 . A B . 20 LEU HD11 1 1 19 15410 1 1 20 LEU HD12 H 2.313 0.268 4.607 1.00 . A B . 20 LEU HD12 1 1 19 15411 1 1 20 LEU HD13 H 3.077 -0.530 3.231 1.00 . A B . 20 LEU HD13 1 1 19 15412 1 1 20 LEU HD21 H 0.722 -0.641 1.315 1.00 . A B . 20 LEU HD21 1 1 19 15413 1 1 20 LEU HD22 H 2.375 -0.128 0.996 1.00 . A B . 20 LEU HD22 1 1 19 15414 1 1 20 LEU HD23 H 1.030 0.948 0.618 1.00 . A B . 20 LEU HD23 1 1 19 15415 1 1 20 LEU HG H 2.102 1.679 2.664 1.00 . A B . 20 LEU HG 1 1 19 15416 1 1 20 LEU N N 0.000 3.611 3.326 1.00 . A B . 20 LEU N 1 1 19 15417 1 1 20 LEU O O -2.579 2.562 3.790 1.00 . A B . 20 LEU O 1 1 19 15418 1 1 21 PHE C C -4.575 0.662 1.515 1.00 . A B . 21 PHE C 1 1 19 15419 1 1 21 PHE CA C -4.139 2.118 1.562 1.00 . A B . 21 PHE CA 1 1 19 15420 1 1 21 PHE CB C -4.677 2.888 0.353 1.00 . A B . 21 PHE CB 1 1 19 15421 1 1 21 PHE CD1 C -4.098 5.200 1.140 1.00 . A B . 21 PHE CD1 1 1 19 15422 1 1 21 PHE CD2 C -3.227 4.458 -0.953 1.00 . A B . 21 PHE CD2 1 1 19 15423 1 1 21 PHE CE1 C -3.448 6.404 0.986 1.00 . A B . 21 PHE CE1 1 1 19 15424 1 1 21 PHE CE2 C -2.578 5.664 -1.112 1.00 . A B . 21 PHE CE2 1 1 19 15425 1 1 21 PHE CG C -3.996 4.213 0.172 1.00 . A B . 21 PHE CG 1 1 19 15426 1 1 21 PHE CZ C -2.687 6.637 -0.141 1.00 . A B . 21 PHE CZ 1 1 19 15427 1 1 21 PHE H H -2.192 2.057 0.737 1.00 . A B . 21 PHE H 1 1 19 15428 1 1 21 PHE HA H -4.508 2.568 2.474 1.00 . A B . 21 PHE HA 1 1 19 15429 1 1 21 PHE HB2 H -4.515 2.304 -0.542 1.00 . A B . 21 PHE HB2 1 1 19 15430 1 1 21 PHE HB3 H -5.737 3.067 0.480 1.00 . A B . 21 PHE HB3 1 1 19 15431 1 1 21 PHE HD1 H -4.695 5.023 2.022 1.00 . A B . 21 PHE HD1 1 1 19 15432 1 1 21 PHE HD2 H -3.141 3.698 -1.715 1.00 . A B . 21 PHE HD2 1 1 19 15433 1 1 21 PHE HE1 H -3.535 7.164 1.748 1.00 . A B . 21 PHE HE1 1 1 19 15434 1 1 21 PHE HE2 H -1.984 5.845 -1.996 1.00 . A B . 21 PHE HE2 1 1 19 15435 1 1 21 PHE HZ H -2.176 7.581 -0.262 1.00 . A B . 21 PHE HZ 1 1 19 15436 1 1 21 PHE N N -2.682 2.182 1.583 1.00 . A B . 21 PHE N 1 1 19 15437 1 1 21 PHE O O -5.584 0.300 0.907 1.00 . A B . 21 PHE O 1 1 19 15438 1 1 22 CYS C C -3.715 -2.136 3.583 1.00 . A B . 22 CYS C 1 1 19 15439 1 1 22 CYS CA C -4.003 -1.594 2.195 1.00 . A B . 22 CYS CA 1 1 19 15440 1 1 22 CYS CB C -3.106 -2.286 1.167 1.00 . A B . 22 CYS CB 1 1 19 15441 1 1 22 CYS H H -3.007 0.197 2.638 1.00 . A B . 22 CYS H 1 1 19 15442 1 1 22 CYS HA H -5.036 -1.780 1.947 1.00 . A B . 22 CYS HA 1 1 19 15443 1 1 22 CYS HB2 H -2.110 -1.868 1.233 1.00 . A B . 22 CYS HB2 1 1 19 15444 1 1 22 CYS HB3 H -3.061 -3.343 1.387 1.00 . A B . 22 CYS HB3 1 1 19 15445 1 1 22 CYS N N -3.780 -0.167 2.162 1.00 . A B . 22 CYS N 1 1 19 15446 1 1 22 CYS O O -3.033 -1.492 4.384 1.00 . A B . 22 CYS O 1 1 19 15447 1 1 22 CYS SG S -3.665 -2.100 -0.553 1.00 . A B . 22 CYS SG 1 1 19 15448 1 1 23 CYS C C -2.677 -4.781 4.948 1.00 . A B . 23 CYS C 1 1 19 15449 1 1 23 CYS CA C -3.971 -3.990 5.111 1.00 . A B . 23 CYS CA 1 1 19 15450 1 1 23 CYS CB C -5.138 -4.914 5.472 1.00 . A B . 23 CYS CB 1 1 19 15451 1 1 23 CYS H H -4.800 -3.754 3.191 1.00 . A B . 23 CYS H 1 1 19 15452 1 1 23 CYS HA H -3.839 -3.242 5.882 1.00 . A B . 23 CYS HA 1 1 19 15453 1 1 23 CYS HB2 H -5.041 -5.222 6.505 1.00 . A B . 23 CYS HB2 1 1 19 15454 1 1 23 CYS HB3 H -6.069 -4.377 5.346 1.00 . A B . 23 CYS HB3 1 1 19 15455 1 1 23 CYS N N -4.240 -3.315 3.861 1.00 . A B . 23 CYS N 1 1 19 15456 1 1 23 CYS O O -2.223 -4.967 3.819 1.00 . A B . 23 CYS O 1 1 19 15457 1 1 23 CYS SG S -5.224 -6.407 4.463 1.00 . A B . 23 CYS SG 1 1 19 15458 1 1 24 ASP C C -0.670 -6.982 4.954 1.00 . A B . 24 ASP C 1 1 19 15459 1 1 24 ASP CA C -0.777 -5.887 6.013 1.00 . A B . 24 ASP CA 1 1 19 15460 1 1 24 ASP CB C -0.400 -6.451 7.382 1.00 . A B . 24 ASP CB 1 1 19 15461 1 1 24 ASP CG C -0.057 -5.365 8.378 1.00 . A B . 24 ASP CG 1 1 19 15462 1 1 24 ASP H H -2.610 -5.238 6.891 1.00 . A B . 24 ASP H 1 1 19 15463 1 1 24 ASP HA H -0.072 -5.109 5.763 1.00 . A B . 24 ASP HA 1 1 19 15464 1 1 24 ASP HB2 H -1.226 -7.023 7.772 1.00 . A B . 24 ASP HB2 1 1 19 15465 1 1 24 ASP HB3 H 0.458 -7.097 7.273 1.00 . A B . 24 ASP HB3 1 1 19 15466 1 1 24 ASP N N -2.110 -5.269 6.046 1.00 . A B . 24 ASP N 1 1 19 15467 1 1 24 ASP O O 0.328 -7.063 4.237 1.00 . A B . 24 ASP O 1 1 19 15468 1 1 24 ASP OD1 O 1.123 -4.969 8.452 1.00 . A B . 24 ASP OD1 1 1 19 15469 1 1 24 ASP OD2 O -0.962 -4.905 9.103 1.00 . A B . 24 ASP OD2 1 1 19 15470 1 1 25 THR C C -1.631 -8.373 2.442 1.00 . A B . 25 THR C 1 1 19 15471 1 1 25 THR CA C -1.718 -8.891 3.882 1.00 . A B . 25 THR CA 1 1 19 15472 1 1 25 THR CB C -2.986 -9.748 4.041 1.00 . A B . 25 THR CB 1 1 19 15473 1 1 25 THR CG2 C -2.924 -10.984 3.157 1.00 . A B . 25 THR CG2 1 1 19 15474 1 1 25 THR H H -2.478 -7.675 5.438 1.00 . A B . 25 THR H 1 1 19 15475 1 1 25 THR HA H -0.860 -9.515 4.077 1.00 . A B . 25 THR HA 1 1 19 15476 1 1 25 THR HB H -3.839 -9.156 3.750 1.00 . A B . 25 THR HB 1 1 19 15477 1 1 25 THR HG1 H -2.273 -10.122 5.851 1.00 . A B . 25 THR HG1 1 1 19 15478 1 1 25 THR HG21 H -2.078 -11.590 3.445 1.00 . A B . 25 THR HG21 1 1 19 15479 1 1 25 THR HG22 H -2.818 -10.685 2.125 1.00 . A B . 25 THR HG22 1 1 19 15480 1 1 25 THR HG23 H -3.832 -11.557 3.273 1.00 . A B . 25 THR HG23 1 1 19 15481 1 1 25 THR N N -1.707 -7.801 4.845 1.00 . A B . 25 THR N 1 1 19 15482 1 1 25 THR O O -0.751 -8.774 1.682 1.00 . A B . 25 THR O 1 1 19 15483 1 1 25 THR OG1 O -3.138 -10.141 5.412 1.00 . A B . 25 THR OG1 1 1 19 15484 1 1 26 CYS C C -1.385 -6.077 0.384 1.00 . A B . 26 CYS C 1 1 19 15485 1 1 26 CYS CA C -2.587 -6.966 0.709 1.00 . A B . 26 CYS CA 1 1 19 15486 1 1 26 CYS CB C -3.887 -6.193 0.472 1.00 . A B . 26 CYS CB 1 1 19 15487 1 1 26 CYS H H -3.119 -7.080 2.761 1.00 . A B . 26 CYS H 1 1 19 15488 1 1 26 CYS HA H -2.565 -7.827 0.057 1.00 . A B . 26 CYS HA 1 1 19 15489 1 1 26 CYS HB2 H -3.895 -5.324 1.107 1.00 . A B . 26 CYS HB2 1 1 19 15490 1 1 26 CYS HB3 H -3.927 -5.875 -0.559 1.00 . A B . 26 CYS HB3 1 1 19 15491 1 1 26 CYS N N -2.518 -7.452 2.084 1.00 . A B . 26 CYS N 1 1 19 15492 1 1 26 CYS O O -0.894 -6.074 -0.745 1.00 . A B . 26 CYS O 1 1 19 15493 1 1 26 CYS SG S -5.397 -7.123 0.820 1.00 . A B . 26 CYS SG 1 1 19 15494 1 1 27 SER C C 1.491 -5.157 0.810 1.00 . A B . 27 SER C 1 1 19 15495 1 1 27 SER CA C 0.216 -4.422 1.206 1.00 . A B . 27 SER CA 1 1 19 15496 1 1 27 SER CB C 0.469 -3.640 2.492 1.00 . A B . 27 SER CB 1 1 19 15497 1 1 27 SER H H -1.334 -5.401 2.269 1.00 . A B . 27 SER H 1 1 19 15498 1 1 27 SER HA H -0.044 -3.731 0.420 1.00 . A B . 27 SER HA 1 1 19 15499 1 1 27 SER HB2 H 0.672 -4.332 3.294 1.00 . A B . 27 SER HB2 1 1 19 15500 1 1 27 SER HB3 H 1.320 -2.994 2.351 1.00 . A B . 27 SER HB3 1 1 19 15501 1 1 27 SER HG H -0.499 -2.461 3.718 1.00 . A B . 27 SER HG 1 1 19 15502 1 1 27 SER N N -0.908 -5.338 1.384 1.00 . A B . 27 SER N 1 1 19 15503 1 1 27 SER O O 2.386 -4.574 0.205 1.00 . A B . 27 SER O 1 1 19 15504 1 1 27 SER OG O -0.650 -2.850 2.849 1.00 . A B . 27 SER OG 1 1 19 15505 1 1 28 ARG C C 2.631 -7.837 -0.544 1.00 . A B . 28 ARG C 1 1 19 15506 1 1 28 ARG CA C 2.758 -7.218 0.842 1.00 . A B . 28 ARG CA 1 1 19 15507 1 1 28 ARG CB C 2.966 -8.304 1.899 1.00 . A B . 28 ARG CB 1 1 19 15508 1 1 28 ARG CD C 3.418 -8.835 4.319 1.00 . A B . 28 ARG CD 1 1 19 15509 1 1 28 ARG CG C 3.391 -7.754 3.251 1.00 . A B . 28 ARG CG 1 1 19 15510 1 1 28 ARG CZ C 4.679 -10.876 4.871 1.00 . A B . 28 ARG CZ 1 1 19 15511 1 1 28 ARG H H 0.850 -6.843 1.669 1.00 . A B . 28 ARG H 1 1 19 15512 1 1 28 ARG HA H 3.611 -6.556 0.847 1.00 . A B . 28 ARG HA 1 1 19 15513 1 1 28 ARG HB2 H 2.039 -8.843 2.029 1.00 . A B . 28 ARG HB2 1 1 19 15514 1 1 28 ARG HB3 H 3.727 -8.987 1.554 1.00 . A B . 28 ARG HB3 1 1 19 15515 1 1 28 ARG HD2 H 3.686 -8.381 5.260 1.00 . A B . 28 ARG HD2 1 1 19 15516 1 1 28 ARG HD3 H 2.431 -9.268 4.399 1.00 . A B . 28 ARG HD3 1 1 19 15517 1 1 28 ARG HE H 4.819 -9.877 3.140 1.00 . A B . 28 ARG HE 1 1 19 15518 1 1 28 ARG HG2 H 4.381 -7.331 3.161 1.00 . A B . 28 ARG HG2 1 1 19 15519 1 1 28 ARG HG3 H 2.696 -6.983 3.551 1.00 . A B . 28 ARG HG3 1 1 19 15520 1 1 28 ARG HH11 H 3.423 -10.219 6.324 1.00 . A B . 28 ARG HH11 1 1 19 15521 1 1 28 ARG HH12 H 4.303 -11.665 6.702 1.00 . A B . 28 ARG HH12 1 1 19 15522 1 1 28 ARG HH21 H 6.010 -11.776 3.635 1.00 . A B . 28 ARG HH21 1 1 19 15523 1 1 28 ARG HH22 H 5.793 -12.542 5.176 1.00 . A B . 28 ARG HH22 1 1 19 15524 1 1 28 ARG N N 1.583 -6.427 1.167 1.00 . A B . 28 ARG N 1 1 19 15525 1 1 28 ARG NE N 4.379 -9.896 4.022 1.00 . A B . 28 ARG NE 1 1 19 15526 1 1 28 ARG NH1 N 4.092 -10.922 6.062 1.00 . A B . 28 ARG NH1 1 1 19 15527 1 1 28 ARG NH2 N 5.563 -11.805 4.534 1.00 . A B . 28 ARG NH2 1 1 19 15528 1 1 28 ARG O O 3.628 -8.201 -1.171 1.00 . A B . 28 ARG O 1 1 19 15529 1 1 29 VAL C C 1.065 -7.528 -3.435 1.00 . A B . 29 VAL C 1 1 19 15530 1 1 29 VAL CA C 1.136 -8.561 -2.308 1.00 . A B . 29 VAL CA 1 1 19 15531 1 1 29 VAL CB C -0.173 -9.379 -2.274 1.00 . A B . 29 VAL CB 1 1 19 15532 1 1 29 VAL CG1 C -0.359 -10.158 -3.567 1.00 . A B . 29 VAL CG1 1 1 19 15533 1 1 29 VAL CG2 C -0.188 -10.321 -1.083 1.00 . A B . 29 VAL CG2 1 1 19 15534 1 1 29 VAL H H 0.658 -7.548 -0.515 1.00 . A B . 29 VAL H 1 1 19 15535 1 1 29 VAL HA H 1.950 -9.239 -2.512 1.00 . A B . 29 VAL HA 1 1 19 15536 1 1 29 VAL HB H -0.999 -8.693 -2.170 1.00 . A B . 29 VAL HB 1 1 19 15537 1 1 29 VAL HG11 H -0.375 -9.474 -4.401 1.00 . A B . 29 VAL HG11 1 1 19 15538 1 1 29 VAL HG12 H -1.292 -10.700 -3.528 1.00 . A B . 29 VAL HG12 1 1 19 15539 1 1 29 VAL HG13 H 0.457 -10.855 -3.687 1.00 . A B . 29 VAL HG13 1 1 19 15540 1 1 29 VAL HG21 H -0.132 -9.750 -0.169 1.00 . A B . 29 VAL HG21 1 1 19 15541 1 1 29 VAL HG22 H 0.659 -10.990 -1.143 1.00 . A B . 29 VAL HG22 1 1 19 15542 1 1 29 VAL HG23 H -1.101 -10.895 -1.092 1.00 . A B . 29 VAL HG23 1 1 19 15543 1 1 29 VAL N N 1.402 -7.926 -1.029 1.00 . A B . 29 VAL N 1 1 19 15544 1 1 29 VAL O O 1.670 -7.710 -4.491 1.00 . A B . 29 VAL O 1 1 19 15545 1 1 30 PHE C C 0.737 -4.086 -3.735 1.00 . A B . 30 PHE C 1 1 19 15546 1 1 30 PHE CA C 0.166 -5.409 -4.228 1.00 . A B . 30 PHE CA 1 1 19 15547 1 1 30 PHE CB C -1.317 -5.232 -4.576 1.00 . A B . 30 PHE CB 1 1 19 15548 1 1 30 PHE CD1 C -1.779 -7.209 -6.074 1.00 . A B . 30 PHE CD1 1 1 19 15549 1 1 30 PHE CD2 C -2.976 -7.031 -4.017 1.00 . A B . 30 PHE CD2 1 1 19 15550 1 1 30 PHE CE1 C -2.445 -8.385 -6.361 1.00 . A B . 30 PHE CE1 1 1 19 15551 1 1 30 PHE CE2 C -3.645 -8.206 -4.300 1.00 . A B . 30 PHE CE2 1 1 19 15552 1 1 30 PHE CG C -2.035 -6.517 -4.898 1.00 . A B . 30 PHE CG 1 1 19 15553 1 1 30 PHE CZ C -3.379 -8.885 -5.473 1.00 . A B . 30 PHE CZ 1 1 19 15554 1 1 30 PHE H H -0.083 -6.316 -2.325 1.00 . A B . 30 PHE H 1 1 19 15555 1 1 30 PHE HA H 0.708 -5.717 -5.111 1.00 . A B . 30 PHE HA 1 1 19 15556 1 1 30 PHE HB2 H -1.820 -4.775 -3.737 1.00 . A B . 30 PHE HB2 1 1 19 15557 1 1 30 PHE HB3 H -1.399 -4.580 -5.436 1.00 . A B . 30 PHE HB3 1 1 19 15558 1 1 30 PHE HD1 H -1.049 -6.823 -6.771 1.00 . A B . 30 PHE HD1 1 1 19 15559 1 1 30 PHE HD2 H -3.188 -6.501 -3.102 1.00 . A B . 30 PHE HD2 1 1 19 15560 1 1 30 PHE HE1 H -2.238 -8.914 -7.280 1.00 . A B . 30 PHE HE1 1 1 19 15561 1 1 30 PHE HE2 H -4.374 -8.593 -3.604 1.00 . A B . 30 PHE HE2 1 1 19 15562 1 1 30 PHE HZ H -3.900 -9.804 -5.697 1.00 . A B . 30 PHE HZ 1 1 19 15563 1 1 30 PHE N N 0.341 -6.439 -3.206 1.00 . A B . 30 PHE N 1 1 19 15564 1 1 30 PHE O O 0.127 -3.031 -3.908 1.00 . A B . 30 PHE O 1 1 19 15565 1 1 31 HIS C C 2.547 -1.772 -3.341 1.00 . A B . 31 HIS C 1 1 19 15566 1 1 31 HIS CA C 2.569 -3.036 -2.480 1.00 . A B . 31 HIS CA 1 1 19 15567 1 1 31 HIS CB C 4.012 -3.418 -2.134 1.00 . A B . 31 HIS CB 1 1 19 15568 1 1 31 HIS CD2 C 5.814 -1.658 -1.511 1.00 . A B . 31 HIS CD2 1 1 19 15569 1 1 31 HIS CE1 C 5.289 -1.330 0.562 1.00 . A B . 31 HIS CE1 1 1 19 15570 1 1 31 HIS CG C 4.733 -2.438 -1.253 1.00 . A B . 31 HIS CG 1 1 19 15571 1 1 31 HIS H H 2.372 -5.040 -3.131 1.00 . A B . 31 HIS H 1 1 19 15572 1 1 31 HIS HA H 2.034 -2.839 -1.564 1.00 . A B . 31 HIS HA 1 1 19 15573 1 1 31 HIS HB2 H 4.006 -4.370 -1.625 1.00 . A B . 31 HIS HB2 1 1 19 15574 1 1 31 HIS HB3 H 4.575 -3.516 -3.053 1.00 . A B . 31 HIS HB3 1 1 19 15575 1 1 31 HIS HD1 H 3.673 -2.639 0.557 1.00 . A B . 31 HIS HD1 1 1 19 15576 1 1 31 HIS HD2 H 6.314 -1.568 -2.463 1.00 . A B . 31 HIS HD2 1 1 19 15577 1 1 31 HIS HE1 H 5.273 -0.961 1.577 1.00 . A B . 31 HIS HE1 1 1 19 15578 1 1 31 HIS N N 1.920 -4.170 -3.139 1.00 . A B . 31 HIS N 1 1 19 15579 1 1 31 HIS ND1 N 4.413 -2.218 0.066 1.00 . A B . 31 HIS ND1 1 1 19 15580 1 1 31 HIS NE2 N 6.168 -0.959 -0.356 1.00 . A B . 31 HIS NE2 1 1 19 15581 1 1 31 HIS O O 2.125 -0.717 -2.880 1.00 . A B . 31 HIS O 1 1 19 15582 1 1 32 GLU C C 1.750 -0.043 -5.698 1.00 . A B . 32 GLU C 1 1 19 15583 1 1 32 GLU CA C 3.089 -0.743 -5.478 1.00 . A B . 32 GLU CA 1 1 19 15584 1 1 32 GLU CB C 3.674 -1.174 -6.824 1.00 . A B . 32 GLU CB 1 1 19 15585 1 1 32 GLU CD C 4.264 -0.484 -9.181 1.00 . A B . 32 GLU CD 1 1 19 15586 1 1 32 GLU CG C 3.886 -0.020 -7.792 1.00 . A B . 32 GLU CG 1 1 19 15587 1 1 32 GLU H H 3.118 -2.794 -4.953 1.00 . A B . 32 GLU H 1 1 19 15588 1 1 32 GLU HA H 3.769 -0.051 -5.004 1.00 . A B . 32 GLU HA 1 1 19 15589 1 1 32 GLU HB2 H 4.627 -1.654 -6.655 1.00 . A B . 32 GLU HB2 1 1 19 15590 1 1 32 GLU HB3 H 3.001 -1.883 -7.283 1.00 . A B . 32 GLU HB3 1 1 19 15591 1 1 32 GLU HG2 H 2.972 0.552 -7.857 1.00 . A B . 32 GLU HG2 1 1 19 15592 1 1 32 GLU HG3 H 4.677 0.611 -7.411 1.00 . A B . 32 GLU HG3 1 1 19 15593 1 1 32 GLU N N 2.944 -1.899 -4.599 1.00 . A B . 32 GLU N 1 1 19 15594 1 1 32 GLU O O 1.662 1.184 -5.640 1.00 . A B . 32 GLU O 1 1 19 15595 1 1 32 GLU OE1 O 3.351 -0.773 -9.982 1.00 . A B . 32 GLU OE1 1 1 19 15596 1 1 32 GLU OE2 O 5.471 -0.558 -9.486 1.00 . A B . 32 GLU OE2 1 1 19 15597 1 1 33 ASP C C -1.253 0.249 -4.950 1.00 . A B . 33 ASP C 1 1 19 15598 1 1 33 ASP CA C -0.612 -0.286 -6.224 1.00 . A B . 33 ASP CA 1 1 19 15599 1 1 33 ASP CB C -1.503 -1.362 -6.848 1.00 . A B . 33 ASP CB 1 1 19 15600 1 1 33 ASP CG C -2.723 -0.785 -7.545 1.00 . A B . 33 ASP CG 1 1 19 15601 1 1 33 ASP H H 0.825 -1.804 -5.887 1.00 . A B . 33 ASP H 1 1 19 15602 1 1 33 ASP HA H -0.492 0.526 -6.925 1.00 . A B . 33 ASP HA 1 1 19 15603 1 1 33 ASP HB2 H -0.930 -1.920 -7.572 1.00 . A B . 33 ASP HB2 1 1 19 15604 1 1 33 ASP HB3 H -1.837 -2.033 -6.071 1.00 . A B . 33 ASP HB3 1 1 19 15605 1 1 33 ASP N N 0.708 -0.831 -5.930 1.00 . A B . 33 ASP N 1 1 19 15606 1 1 33 ASP O O -2.076 1.161 -4.985 1.00 . A B . 33 ASP O 1 1 19 15607 1 1 33 ASP OD1 O -3.722 -0.474 -6.869 1.00 . A B . 33 ASP OD1 1 1 19 15608 1 1 33 ASP OD2 O -2.684 -0.648 -8.787 1.00 . A B . 33 ASP OD2 1 1 19 15609 1 1 34 CYS C C -0.838 1.442 -2.078 1.00 . A B . 34 CYS C 1 1 19 15610 1 1 34 CYS CA C -1.362 0.075 -2.521 1.00 . A B . 34 CYS CA 1 1 19 15611 1 1 34 CYS CB C -1.013 -0.995 -1.483 1.00 . A B . 34 CYS CB 1 1 19 15612 1 1 34 CYS H H -0.143 -1.008 -3.866 1.00 . A B . 34 CYS H 1 1 19 15613 1 1 34 CYS HA H -2.438 0.133 -2.610 1.00 . A B . 34 CYS HA 1 1 19 15614 1 1 34 CYS HB2 H 0.028 -1.271 -1.594 1.00 . A B . 34 CYS HB2 1 1 19 15615 1 1 34 CYS HB3 H -1.171 -0.592 -0.494 1.00 . A B . 34 CYS HB3 1 1 19 15616 1 1 34 CYS N N -0.833 -0.309 -3.823 1.00 . A B . 34 CYS N 1 1 19 15617 1 1 34 CYS O O -1.216 1.944 -1.016 1.00 . A B . 34 CYS O 1 1 19 15618 1 1 34 CYS SG S -2.001 -2.518 -1.632 1.00 . A B . 34 CYS SG 1 1 19 15619 1 1 35 HIS C C -0.102 4.386 -3.576 1.00 . A B . 35 HIS C 1 1 19 15620 1 1 35 HIS CA C 0.534 3.380 -2.625 1.00 . A B . 35 HIS CA 1 1 19 15621 1 1 35 HIS CB C 2.052 3.440 -2.774 1.00 . A B . 35 HIS CB 1 1 19 15622 1 1 35 HIS CD2 C 3.259 1.511 -1.559 1.00 . A B . 35 HIS CD2 1 1 19 15623 1 1 35 HIS CE1 C 3.719 2.489 0.310 1.00 . A B . 35 HIS CE1 1 1 19 15624 1 1 35 HIS CG C 2.786 2.774 -1.655 1.00 . A B . 35 HIS CG 1 1 19 15625 1 1 35 HIS H H 0.377 1.538 -3.660 1.00 . A B . 35 HIS H 1 1 19 15626 1 1 35 HIS HA H 0.272 3.640 -1.609 1.00 . A B . 35 HIS HA 1 1 19 15627 1 1 35 HIS HB2 H 2.332 2.947 -3.695 1.00 . A B . 35 HIS HB2 1 1 19 15628 1 1 35 HIS HB3 H 2.363 4.473 -2.813 1.00 . A B . 35 HIS HB3 1 1 19 15629 1 1 35 HIS HD1 H 2.816 4.293 -0.186 1.00 . A B . 35 HIS HD1 1 1 19 15630 1 1 35 HIS HD2 H 3.207 0.753 -2.330 1.00 . A B . 35 HIS HD2 1 1 19 15631 1 1 35 HIS HE1 H 4.087 2.694 1.306 1.00 . A B . 35 HIS HE1 1 1 19 15632 1 1 35 HIS N N 0.041 2.030 -2.882 1.00 . A B . 35 HIS N 1 1 19 15633 1 1 35 HIS ND1 N 3.079 3.384 -0.456 1.00 . A B . 35 HIS ND1 1 1 19 15634 1 1 35 HIS NE2 N 3.850 1.330 -0.316 1.00 . A B . 35 HIS NE2 1 1 19 15635 1 1 35 HIS O O 0.199 5.576 -3.528 1.00 . A B . 35 HIS O 1 1 19 15636 1 1 36 ILE C C -3.115 4.790 -5.221 1.00 . A B . 36 ILE C 1 1 19 15637 1 1 36 ILE CA C -1.606 4.738 -5.453 1.00 . A B . 36 ILE CA 1 1 19 15638 1 1 36 ILE CB C -1.304 4.199 -6.872 1.00 . A B . 36 ILE CB 1 1 19 15639 1 1 36 ILE CD1 C 0.612 3.564 -8.446 1.00 . A B . 36 ILE CD1 1 1 19 15640 1 1 36 ILE CG1 C 0.213 4.116 -7.091 1.00 . A B . 36 ILE CG1 1 1 19 15641 1 1 36 ILE CG2 C -1.952 5.071 -7.939 1.00 . A B . 36 ILE CG2 1 1 19 15642 1 1 36 ILE H H -1.211 2.948 -4.405 1.00 . A B . 36 ILE H 1 1 19 15643 1 1 36 ILE HA H -1.198 5.735 -5.367 1.00 . A B . 36 ILE HA 1 1 19 15644 1 1 36 ILE HB H -1.724 3.208 -6.949 1.00 . A B . 36 ILE HB 1 1 19 15645 1 1 36 ILE HD11 H 0.210 4.195 -9.225 1.00 . A B . 36 ILE HD11 1 1 19 15646 1 1 36 ILE HD12 H 0.222 2.563 -8.558 1.00 . A B . 36 ILE HD12 1 1 19 15647 1 1 36 ILE HD13 H 1.691 3.539 -8.522 1.00 . A B . 36 ILE HD13 1 1 19 15648 1 1 36 ILE HG12 H 0.637 5.106 -7.000 1.00 . A B . 36 ILE HG12 1 1 19 15649 1 1 36 ILE HG13 H 0.642 3.478 -6.333 1.00 . A B . 36 ILE HG13 1 1 19 15650 1 1 36 ILE HG21 H -1.530 6.064 -7.899 1.00 . A B . 36 ILE HG21 1 1 19 15651 1 1 36 ILE HG22 H -3.015 5.123 -7.763 1.00 . A B . 36 ILE HG22 1 1 19 15652 1 1 36 ILE HG23 H -1.768 4.642 -8.913 1.00 . A B . 36 ILE HG23 1 1 19 15653 1 1 36 ILE N N -0.975 3.899 -4.446 1.00 . A B . 36 ILE N 1 1 19 15654 1 1 36 ILE O O -3.735 3.759 -4.962 1.00 . A B . 36 ILE O 1 1 19 15655 1 1 37 PRO C C -2.202 7.743 -4.432 1.00 . A B . 37 PRO C 1 1 19 15656 1 1 37 PRO CA C -3.061 7.254 -5.596 1.00 . A B . 37 PRO CA 1 1 19 15657 1 1 37 PRO CB C -4.221 8.239 -5.841 1.00 . A B . 37 PRO CB 1 1 19 15658 1 1 37 PRO CD C -5.175 6.181 -5.093 1.00 . A B . 37 PRO CD 1 1 19 15659 1 1 37 PRO CG C -5.450 7.394 -5.930 1.00 . A B . 37 PRO CG 1 1 19 15660 1 1 37 PRO HA H -2.452 7.176 -6.484 1.00 . A B . 37 PRO HA 1 1 19 15661 1 1 37 PRO HB2 H -4.282 8.935 -5.012 1.00 . A B . 37 PRO HB2 1 1 19 15662 1 1 37 PRO HB3 H -4.049 8.784 -6.762 1.00 . A B . 37 PRO HB3 1 1 19 15663 1 1 37 PRO HD2 H -5.399 6.374 -4.052 1.00 . A B . 37 PRO HD2 1 1 19 15664 1 1 37 PRO HD3 H -5.739 5.329 -5.453 1.00 . A B . 37 PRO HD3 1 1 19 15665 1 1 37 PRO HG2 H -6.299 7.937 -5.538 1.00 . A B . 37 PRO HG2 1 1 19 15666 1 1 37 PRO HG3 H -5.627 7.111 -6.958 1.00 . A B . 37 PRO HG3 1 1 19 15667 1 1 37 PRO N N -3.739 5.982 -5.295 1.00 . A B . 37 PRO N 1 1 19 15668 1 1 37 PRO O O -2.637 7.724 -3.283 1.00 . A B . 37 PRO O 1 1 19 15669 1 1 38 PRO C C -0.562 9.683 -2.766 1.00 . A B . 38 PRO C 1 1 19 15670 1 1 38 PRO CA C 0.001 8.631 -3.717 1.00 . A B . 38 PRO CA 1 1 19 15671 1 1 38 PRO CB C 1.164 9.215 -4.530 1.00 . A B . 38 PRO CB 1 1 19 15672 1 1 38 PRO CD C -0.433 8.341 -6.092 1.00 . A B . 38 PRO CD 1 1 19 15673 1 1 38 PRO CG C 0.641 9.380 -5.920 1.00 . A B . 38 PRO CG 1 1 19 15674 1 1 38 PRO HA H 0.355 7.790 -3.142 1.00 . A B . 38 PRO HA 1 1 19 15675 1 1 38 PRO HB2 H 1.456 10.165 -4.103 1.00 . A B . 38 PRO HB2 1 1 19 15676 1 1 38 PRO HB3 H 2.003 8.533 -4.500 1.00 . A B . 38 PRO HB3 1 1 19 15677 1 1 38 PRO HD2 H -1.196 8.691 -6.776 1.00 . A B . 38 PRO HD2 1 1 19 15678 1 1 38 PRO HD3 H -0.011 7.407 -6.439 1.00 . A B . 38 PRO HD3 1 1 19 15679 1 1 38 PRO HG2 H 0.229 10.373 -6.040 1.00 . A B . 38 PRO HG2 1 1 19 15680 1 1 38 PRO HG3 H 1.438 9.219 -6.633 1.00 . A B . 38 PRO HG3 1 1 19 15681 1 1 38 PRO N N -0.972 8.201 -4.733 1.00 . A B . 38 PRO N 1 1 19 15682 1 1 38 PRO O O -1.401 10.504 -3.152 1.00 . A B . 38 PRO O 1 1 19 15683 1 1 39 VAL C C -0.275 11.980 -0.742 1.00 . A B . 39 VAL C 1 1 19 15684 1 1 39 VAL CA C -0.588 10.516 -0.469 1.00 . A B . 39 VAL CA 1 1 19 15685 1 1 39 VAL CB C 0.013 10.126 0.896 1.00 . A B . 39 VAL CB 1 1 19 15686 1 1 39 VAL CG1 C -0.518 11.020 2.003 1.00 . A B . 39 VAL CG1 1 1 19 15687 1 1 39 VAL CG2 C -0.268 8.672 1.212 1.00 . A B . 39 VAL CG2 1 1 19 15688 1 1 39 VAL H H 0.665 9.049 -1.327 1.00 . A B . 39 VAL H 1 1 19 15689 1 1 39 VAL HA H -1.658 10.385 -0.419 1.00 . A B . 39 VAL HA 1 1 19 15690 1 1 39 VAL HB H 1.080 10.259 0.845 1.00 . A B . 39 VAL HB 1 1 19 15691 1 1 39 VAL HG11 H -0.087 10.718 2.946 1.00 . A B . 39 VAL HG11 1 1 19 15692 1 1 39 VAL HG12 H -1.593 10.931 2.052 1.00 . A B . 39 VAL HG12 1 1 19 15693 1 1 39 VAL HG13 H -0.249 12.045 1.796 1.00 . A B . 39 VAL HG13 1 1 19 15694 1 1 39 VAL HG21 H 0.121 8.046 0.424 1.00 . A B . 39 VAL HG21 1 1 19 15695 1 1 39 VAL HG22 H -1.333 8.522 1.301 1.00 . A B . 39 VAL HG22 1 1 19 15696 1 1 39 VAL HG23 H 0.209 8.411 2.143 1.00 . A B . 39 VAL HG23 1 1 19 15697 1 1 39 VAL N N -0.077 9.658 -1.529 1.00 . A B . 39 VAL N 1 1 19 15698 1 1 39 VAL O O 0.884 12.357 -0.916 1.00 . A B . 39 VAL O 1 1 19 15699 1 1 40 GLU C C -1.274 14.984 0.320 1.00 . A B . 40 GLU C 1 1 19 15700 1 1 40 GLU CA C -1.145 14.226 -0.997 1.00 . A B . 40 GLU CA 1 1 19 15701 1 1 40 GLU CB C -2.170 14.732 -2.013 1.00 . A B . 40 GLU CB 1 1 19 15702 1 1 40 GLU CD C -3.194 14.431 -4.297 1.00 . A B . 40 GLU CD 1 1 19 15703 1 1 40 GLU CG C -2.068 14.048 -3.365 1.00 . A B . 40 GLU CG 1 1 19 15704 1 1 40 GLU H H -2.215 12.435 -0.660 1.00 . A B . 40 GLU H 1 1 19 15705 1 1 40 GLU HA H -0.151 14.383 -1.389 1.00 . A B . 40 GLU HA 1 1 19 15706 1 1 40 GLU HB2 H -3.163 14.567 -1.623 1.00 . A B . 40 GLU HB2 1 1 19 15707 1 1 40 GLU HB3 H -2.023 15.792 -2.158 1.00 . A B . 40 GLU HB3 1 1 19 15708 1 1 40 GLU HG2 H -1.133 14.325 -3.826 1.00 . A B . 40 GLU HG2 1 1 19 15709 1 1 40 GLU HG3 H -2.091 12.979 -3.215 1.00 . A B . 40 GLU HG3 1 1 19 15710 1 1 40 GLU N N -1.313 12.800 -0.779 1.00 . A B . 40 GLU N 1 1 19 15711 1 1 40 GLU O O -0.523 15.925 0.577 1.00 . A B . 40 GLU O 1 1 19 15712 1 1 40 GLU OE1 O -3.059 15.445 -5.016 1.00 . A B . 40 GLU OE1 1 1 19 15713 1 1 40 GLU OE2 O -4.219 13.720 -4.315 1.00 . A B . 40 GLU OE2 1 1 19 15714 1 1 41 ALA C C -3.155 14.198 3.394 1.00 . A B . 41 ALA C 1 1 19 15715 1 1 41 ALA CA C -2.419 15.162 2.465 1.00 . A B . 41 ALA CA 1 1 19 15716 1 1 41 ALA CB C -3.193 16.464 2.339 1.00 . A B . 41 ALA CB 1 1 19 15717 1 1 41 ALA H H -2.822 13.842 0.866 1.00 . A B . 41 ALA H 1 1 19 15718 1 1 41 ALA HA H -1.447 15.383 2.881 1.00 . A B . 41 ALA HA 1 1 19 15719 1 1 41 ALA HB1 H -3.318 16.905 3.316 1.00 . A B . 41 ALA HB1 1 1 19 15720 1 1 41 ALA HB2 H -4.161 16.266 1.908 1.00 . A B . 41 ALA HB2 1 1 19 15721 1 1 41 ALA HB3 H -2.648 17.146 1.704 1.00 . A B . 41 ALA HB3 1 1 19 15722 1 1 41 ALA N N -2.224 14.564 1.152 1.00 . A B . 41 ALA N 1 1 19 15723 1 1 41 ALA O O -4.142 14.574 4.026 1.00 . A B . 41 ALA O 1 1 19 15724 1 1 42 GLU C C -4.651 11.512 3.800 1.00 . A B . 42 GLU C 1 1 19 15725 1 1 42 GLU CA C -3.250 11.891 4.287 1.00 . A B . 42 GLU CA 1 1 19 15726 1 1 42 GLU CB C -3.299 12.306 5.760 1.00 . A B . 42 GLU CB 1 1 19 15727 1 1 42 GLU CD C -2.003 13.045 7.793 1.00 . A B . 42 GLU CD 1 1 19 15728 1 1 42 GLU CG C -1.933 12.622 6.342 1.00 . A B . 42 GLU CG 1 1 19 15729 1 1 42 GLU H H -1.852 12.756 2.948 1.00 . A B . 42 GLU H 1 1 19 15730 1 1 42 GLU HA H -2.614 11.022 4.199 1.00 . A B . 42 GLU HA 1 1 19 15731 1 1 42 GLU HB2 H -3.920 13.183 5.854 1.00 . A B . 42 GLU HB2 1 1 19 15732 1 1 42 GLU HB3 H -3.736 11.501 6.334 1.00 . A B . 42 GLU HB3 1 1 19 15733 1 1 42 GLU HG2 H -1.315 11.739 6.271 1.00 . A B . 42 GLU HG2 1 1 19 15734 1 1 42 GLU HG3 H -1.486 13.421 5.767 1.00 . A B . 42 GLU HG3 1 1 19 15735 1 1 42 GLU N N -2.657 12.959 3.462 1.00 . A B . 42 GLU N 1 1 19 15736 1 1 42 GLU O O -5.558 12.347 3.759 1.00 . A B . 42 GLU O 1 1 19 15737 1 1 42 GLU OE1 O -2.326 14.221 8.061 1.00 . A B . 42 GLU OE1 1 1 19 15738 1 1 42 GLU OE2 O -1.730 12.204 8.675 1.00 . A B . 42 GLU OE2 1 1 19 15739 1 1 43 ARG C C -6.449 8.366 3.316 1.00 . A B . 43 ARG C 1 1 19 15740 1 1 43 ARG CA C -6.127 9.806 2.917 1.00 . A B . 43 ARG CA 1 1 19 15741 1 1 43 ARG CB C -6.192 9.977 1.392 1.00 . A B . 43 ARG CB 1 1 19 15742 1 1 43 ARG CD C -5.206 9.468 -0.862 1.00 . A B . 43 ARG CD 1 1 19 15743 1 1 43 ARG CG C -4.997 9.410 0.641 1.00 . A B . 43 ARG CG 1 1 19 15744 1 1 43 ARG CZ C -6.948 8.768 -2.463 1.00 . A B . 43 ARG CZ 1 1 19 15745 1 1 43 ARG H H -4.106 9.598 3.548 1.00 . A B . 43 ARG H 1 1 19 15746 1 1 43 ARG HA H -6.879 10.445 3.356 1.00 . A B . 43 ARG HA 1 1 19 15747 1 1 43 ARG HB2 H -7.080 9.482 1.030 1.00 . A B . 43 ARG HB2 1 1 19 15748 1 1 43 ARG HB3 H -6.264 11.030 1.166 1.00 . A B . 43 ARG HB3 1 1 19 15749 1 1 43 ARG HD2 H -5.397 10.493 -1.146 1.00 . A B . 43 ARG HD2 1 1 19 15750 1 1 43 ARG HD3 H -4.310 9.121 -1.355 1.00 . A B . 43 ARG HD3 1 1 19 15751 1 1 43 ARG HE H -6.651 7.952 -0.659 1.00 . A B . 43 ARG HE 1 1 19 15752 1 1 43 ARG HG2 H -4.118 9.985 0.893 1.00 . A B . 43 ARG HG2 1 1 19 15753 1 1 43 ARG HG3 H -4.854 8.381 0.937 1.00 . A B . 43 ARG HG3 1 1 19 15754 1 1 43 ARG HH11 H -5.750 10.260 -3.129 1.00 . A B . 43 ARG HH11 1 1 19 15755 1 1 43 ARG HH12 H -7.002 9.768 -4.224 1.00 . A B . 43 ARG HH12 1 1 19 15756 1 1 43 ARG HH21 H -8.291 7.290 -2.106 1.00 . A B . 43 ARG HH21 1 1 19 15757 1 1 43 ARG HH22 H -8.446 8.087 -3.643 1.00 . A B . 43 ARG HH22 1 1 19 15758 1 1 43 ARG N N -4.840 10.249 3.441 1.00 . A B . 43 ARG N 1 1 19 15759 1 1 43 ARG NE N -6.333 8.641 -1.289 1.00 . A B . 43 ARG NE 1 1 19 15760 1 1 43 ARG NH1 N -6.532 9.669 -3.343 1.00 . A B . 43 ARG NH1 1 1 19 15761 1 1 43 ARG NH2 N -7.975 7.984 -2.762 1.00 . A B . 43 ARG NH2 1 1 19 15762 1 1 43 ARG O O -6.140 7.418 2.597 1.00 . A B . 43 ARG O 1 1 19 15763 1 1 44 THR C C -6.553 5.822 4.922 1.00 . A B . 44 THR C 1 1 19 15764 1 1 44 THR CA C -7.582 6.958 5.003 1.00 . A B . 44 THR CA 1 1 19 15765 1 1 44 THR CB C -8.889 6.522 4.299 1.00 . A B . 44 THR CB 1 1 19 15766 1 1 44 THR CG2 C -10.050 7.414 4.711 1.00 . A B . 44 THR CG2 1 1 19 15767 1 1 44 THR H H -7.238 9.048 5.006 1.00 . A B . 44 THR H 1 1 19 15768 1 1 44 THR HA H -7.816 7.117 6.046 1.00 . A B . 44 THR HA 1 1 19 15769 1 1 44 THR HB H -9.113 5.508 4.597 1.00 . A B . 44 THR HB 1 1 19 15770 1 1 44 THR HG1 H -7.792 6.558 2.653 1.00 . A B . 44 THR HG1 1 1 19 15771 1 1 44 THR HG21 H -9.844 8.431 4.416 1.00 . A B . 44 THR HG21 1 1 19 15772 1 1 44 THR HG22 H -10.177 7.370 5.782 1.00 . A B . 44 THR HG22 1 1 19 15773 1 1 44 THR HG23 H -10.954 7.076 4.228 1.00 . A B . 44 THR HG23 1 1 19 15774 1 1 44 THR N N -7.087 8.238 4.475 1.00 . A B . 44 THR N 1 1 19 15775 1 1 44 THR O O -6.652 4.937 4.069 1.00 . A B . 44 THR O 1 1 19 15776 1 1 44 THR OG1 O -8.736 6.564 2.874 1.00 . A B . 44 THR OG1 1 1 19 15777 1 1 45 PRO C C -5.050 3.511 6.582 1.00 . A B . 45 PRO C 1 1 19 15778 1 1 45 PRO CA C -4.539 4.777 5.891 1.00 . A B . 45 PRO CA 1 1 19 15779 1 1 45 PRO CB C -3.409 5.417 6.715 1.00 . A B . 45 PRO CB 1 1 19 15780 1 1 45 PRO CD C -5.333 6.850 6.845 1.00 . A B . 45 PRO CD 1 1 19 15781 1 1 45 PRO CG C -3.838 6.830 6.977 1.00 . A B . 45 PRO CG 1 1 19 15782 1 1 45 PRO HA H -4.174 4.522 4.907 1.00 . A B . 45 PRO HA 1 1 19 15783 1 1 45 PRO HB2 H -3.281 4.868 7.637 1.00 . A B . 45 PRO HB2 1 1 19 15784 1 1 45 PRO HB3 H -2.489 5.387 6.146 1.00 . A B . 45 PRO HB3 1 1 19 15785 1 1 45 PRO HD2 H -5.802 6.582 7.784 1.00 . A B . 45 PRO HD2 1 1 19 15786 1 1 45 PRO HD3 H -5.679 7.816 6.505 1.00 . A B . 45 PRO HD3 1 1 19 15787 1 1 45 PRO HG2 H -3.547 7.122 7.977 1.00 . A B . 45 PRO HG2 1 1 19 15788 1 1 45 PRO HG3 H -3.388 7.489 6.249 1.00 . A B . 45 PRO HG3 1 1 19 15789 1 1 45 PRO N N -5.562 5.823 5.827 1.00 . A B . 45 PRO N 1 1 19 15790 1 1 45 PRO O O -4.454 2.440 6.471 1.00 . A B . 45 PRO O 1 1 19 15791 1 1 46 TRP C C -7.943 1.960 7.206 1.00 . A B . 46 TRP C 1 1 19 15792 1 1 46 TRP CA C -6.771 2.521 8.006 1.00 . A B . 46 TRP CA 1 1 19 15793 1 1 46 TRP CB C -7.231 2.961 9.403 1.00 . A B . 46 TRP CB 1 1 19 15794 1 1 46 TRP CD1 C -9.186 4.598 9.100 1.00 . A B . 46 TRP CD1 1 1 19 15795 1 1 46 TRP CD2 C -7.269 5.562 9.744 1.00 . A B . 46 TRP CD2 1 1 19 15796 1 1 46 TRP CE2 C -8.250 6.559 9.607 1.00 . A B . 46 TRP CE2 1 1 19 15797 1 1 46 TRP CE3 C -5.981 5.935 10.145 1.00 . A B . 46 TRP CE3 1 1 19 15798 1 1 46 TRP CG C -7.887 4.311 9.412 1.00 . A B . 46 TRP CG 1 1 19 15799 1 1 46 TRP CH2 C -6.718 8.238 10.241 1.00 . A B . 46 TRP CH2 1 1 19 15800 1 1 46 TRP CZ2 C -7.985 7.902 9.853 1.00 . A B . 46 TRP CZ2 1 1 19 15801 1 1 46 TRP CZ3 C -5.721 7.270 10.389 1.00 . A B . 46 TRP CZ3 1 1 19 15802 1 1 46 TRP H H -6.594 4.520 7.334 1.00 . A B . 46 TRP H 1 1 19 15803 1 1 46 TRP HA H -6.021 1.748 8.107 1.00 . A B . 46 TRP HA 1 1 19 15804 1 1 46 TRP HB2 H -7.944 2.243 9.783 1.00 . A B . 46 TRP HB2 1 1 19 15805 1 1 46 TRP HB3 H -6.377 2.999 10.064 1.00 . A B . 46 TRP HB3 1 1 19 15806 1 1 46 TRP HD1 H -9.918 3.862 8.803 1.00 . A B . 46 TRP HD1 1 1 19 15807 1 1 46 TRP HE1 H -10.264 6.400 9.043 1.00 . A B . 46 TRP HE1 1 1 19 15808 1 1 46 TRP HE3 H -5.197 5.201 10.265 1.00 . A B . 46 TRP HE3 1 1 19 15809 1 1 46 TRP HH2 H -6.468 9.269 10.440 1.00 . A B . 46 TRP HH2 1 1 19 15810 1 1 46 TRP HZ2 H -8.744 8.660 9.742 1.00 . A B . 46 TRP HZ2 1 1 19 15811 1 1 46 TRP HZ3 H -4.733 7.580 10.698 1.00 . A B . 46 TRP HZ3 1 1 19 15812 1 1 46 TRP N N -6.162 3.642 7.294 1.00 . A B . 46 TRP N 1 1 19 15813 1 1 46 TRP NE1 N -9.409 5.946 9.213 1.00 . A B . 46 TRP NE1 1 1 19 15814 1 1 46 TRP O O -8.992 1.615 7.752 1.00 . A B . 46 TRP O 1 1 19 15815 1 1 47 ASN C C -8.090 0.600 3.885 1.00 . A B . 47 ASN C 1 1 19 15816 1 1 47 ASN CA C -8.764 1.393 4.989 1.00 . A B . 47 ASN CA 1 1 19 15817 1 1 47 ASN CB C -9.548 2.571 4.390 1.00 . A B . 47 ASN CB 1 1 19 15818 1 1 47 ASN CG C -10.553 2.138 3.330 1.00 . A B . 47 ASN CG 1 1 19 15819 1 1 47 ASN H H -6.876 2.145 5.539 1.00 . A B . 47 ASN H 1 1 19 15820 1 1 47 ASN HA H -9.437 0.750 5.538 1.00 . A B . 47 ASN HA 1 1 19 15821 1 1 47 ASN HB2 H -10.079 3.082 5.178 1.00 . A B . 47 ASN HB2 1 1 19 15822 1 1 47 ASN HB3 H -8.851 3.261 3.933 1.00 . A B . 47 ASN HB3 1 1 19 15823 1 1 47 ASN HD21 H -11.972 1.909 4.707 1.00 . A B . 47 ASN HD21 1 1 19 15824 1 1 47 ASN HD22 H -12.439 1.571 3.076 1.00 . A B . 47 ASN HD22 1 1 19 15825 1 1 47 ASN N N -7.748 1.882 5.904 1.00 . A B . 47 ASN N 1 1 19 15826 1 1 47 ASN ND2 N -11.775 1.841 3.747 1.00 . A B . 47 ASN ND2 1 1 19 15827 1 1 47 ASN O O -7.178 1.106 3.237 1.00 . A B . 47 ASN O 1 1 19 15828 1 1 47 ASN OD1 O -10.234 2.075 2.142 1.00 . A B . 47 ASN OD1 1 1 19 15829 1 1 48 CYS C C -8.779 -1.424 1.391 1.00 . A B . 48 CYS C 1 1 19 15830 1 1 48 CYS CA C -7.896 -1.444 2.633 1.00 . A B . 48 CYS CA 1 1 19 15831 1 1 48 CYS CB C -7.658 -2.893 3.105 1.00 . A B . 48 CYS CB 1 1 19 15832 1 1 48 CYS H H -9.242 -1.012 4.208 1.00 . A B . 48 CYS H 1 1 19 15833 1 1 48 CYS HA H -6.946 -0.989 2.390 1.00 . A B . 48 CYS HA 1 1 19 15834 1 1 48 CYS HB2 H -7.202 -2.880 4.083 1.00 . A B . 48 CYS HB2 1 1 19 15835 1 1 48 CYS HB3 H -8.608 -3.408 3.161 1.00 . A B . 48 CYS HB3 1 1 19 15836 1 1 48 CYS N N -8.505 -0.643 3.676 1.00 . A B . 48 CYS N 1 1 19 15837 1 1 48 CYS O O -9.937 -1.840 1.432 1.00 . A B . 48 CYS O 1 1 19 15838 1 1 48 CYS SG S -6.577 -3.841 2.000 1.00 . A B . 48 CYS SG 1 1 19 15839 1 1 49 ILE C C -8.998 -2.209 -1.692 1.00 . A B . 49 ILE C 1 1 19 15840 1 1 49 ILE CA C -8.969 -0.868 -0.966 1.00 . A B . 49 ILE CA 1 1 19 15841 1 1 49 ILE CB C -8.405 0.223 -1.914 1.00 . A B . 49 ILE CB 1 1 19 15842 1 1 49 ILE CD1 C -6.280 1.075 -3.041 1.00 . A B . 49 ILE CD1 1 1 19 15843 1 1 49 ILE CG1 C -6.881 0.126 -2.025 1.00 . A B . 49 ILE CG1 1 1 19 15844 1 1 49 ILE CG2 C -8.816 1.611 -1.441 1.00 . A B . 49 ILE CG2 1 1 19 15845 1 1 49 ILE H H -7.289 -0.645 0.310 1.00 . A B . 49 ILE H 1 1 19 15846 1 1 49 ILE HA H -9.984 -0.598 -0.714 1.00 . A B . 49 ILE HA 1 1 19 15847 1 1 49 ILE HB H -8.833 0.065 -2.891 1.00 . A B . 49 ILE HB 1 1 19 15848 1 1 49 ILE HD11 H -5.205 0.959 -3.053 1.00 . A B . 49 ILE HD11 1 1 19 15849 1 1 49 ILE HD12 H -6.530 2.092 -2.776 1.00 . A B . 49 ILE HD12 1 1 19 15850 1 1 49 ILE HD13 H -6.677 0.851 -4.020 1.00 . A B . 49 ILE HD13 1 1 19 15851 1 1 49 ILE HG12 H -6.446 0.358 -1.066 1.00 . A B . 49 ILE HG12 1 1 19 15852 1 1 49 ILE HG13 H -6.607 -0.882 -2.305 1.00 . A B . 49 ILE HG13 1 1 19 15853 1 1 49 ILE HG21 H -9.891 1.701 -1.475 1.00 . A B . 49 ILE HG21 1 1 19 15854 1 1 49 ILE HG22 H -8.372 2.356 -2.085 1.00 . A B . 49 ILE HG22 1 1 19 15855 1 1 49 ILE HG23 H -8.473 1.764 -0.428 1.00 . A B . 49 ILE HG23 1 1 19 15856 1 1 49 ILE N N -8.221 -0.958 0.281 1.00 . A B . 49 ILE N 1 1 19 15857 1 1 49 ILE O O -9.937 -2.507 -2.427 1.00 . A B . 49 ILE O 1 1 19 15858 1 1 50 PHE C C -8.827 -5.339 -1.503 1.00 . A B . 50 PHE C 1 1 19 15859 1 1 50 PHE CA C -7.903 -4.318 -2.142 1.00 . A B . 50 PHE CA 1 1 19 15860 1 1 50 PHE CB C -6.464 -4.828 -2.218 1.00 . A B . 50 PHE CB 1 1 19 15861 1 1 50 PHE CD1 C -5.112 -3.044 -3.352 1.00 . A B . 50 PHE CD1 1 1 19 15862 1 1 50 PHE CD2 C -5.707 -4.982 -4.604 1.00 . A B . 50 PHE CD2 1 1 19 15863 1 1 50 PHE CE1 C -4.467 -2.526 -4.454 1.00 . A B . 50 PHE CE1 1 1 19 15864 1 1 50 PHE CE2 C -5.066 -4.467 -5.712 1.00 . A B . 50 PHE CE2 1 1 19 15865 1 1 50 PHE CG C -5.738 -4.276 -3.412 1.00 . A B . 50 PHE CG 1 1 19 15866 1 1 50 PHE CZ C -4.445 -3.238 -5.637 1.00 . A B . 50 PHE CZ 1 1 19 15867 1 1 50 PHE H H -7.369 -2.826 -0.729 1.00 . A B . 50 PHE H 1 1 19 15868 1 1 50 PHE HA H -8.254 -4.149 -3.152 1.00 . A B . 50 PHE HA 1 1 19 15869 1 1 50 PHE HB2 H -5.926 -4.533 -1.327 1.00 . A B . 50 PHE HB2 1 1 19 15870 1 1 50 PHE HB3 H -6.469 -5.908 -2.298 1.00 . A B . 50 PHE HB3 1 1 19 15871 1 1 50 PHE HD1 H -5.129 -2.486 -2.428 1.00 . A B . 50 PHE HD1 1 1 19 15872 1 1 50 PHE HD2 H -6.192 -5.945 -4.662 1.00 . A B . 50 PHE HD2 1 1 19 15873 1 1 50 PHE HE1 H -3.985 -1.563 -4.394 1.00 . A B . 50 PHE HE1 1 1 19 15874 1 1 50 PHE HE2 H -5.049 -5.027 -6.635 1.00 . A B . 50 PHE HE2 1 1 19 15875 1 1 50 PHE HZ H -3.945 -2.831 -6.504 1.00 . A B . 50 PHE HZ 1 1 19 15876 1 1 50 PHE N N -7.991 -3.036 -1.454 1.00 . A B . 50 PHE N 1 1 19 15877 1 1 50 PHE O O -9.373 -6.202 -2.180 1.00 . A B . 50 PHE O 1 1 19 15878 1 1 51 CYS C C -11.361 -5.917 0.069 1.00 . A B . 51 CYS C 1 1 19 15879 1 1 51 CYS CA C -9.921 -6.114 0.519 1.00 . A B . 51 CYS CA 1 1 19 15880 1 1 51 CYS CB C -9.818 -5.889 2.026 1.00 . A B . 51 CYS CB 1 1 19 15881 1 1 51 CYS H H -8.558 -4.513 0.299 1.00 . A B . 51 CYS H 1 1 19 15882 1 1 51 CYS HA H -9.625 -7.128 0.295 1.00 . A B . 51 CYS HA 1 1 19 15883 1 1 51 CYS HB2 H -9.548 -4.860 2.210 1.00 . A B . 51 CYS HB2 1 1 19 15884 1 1 51 CYS HB3 H -10.779 -6.087 2.479 1.00 . A B . 51 CYS HB3 1 1 19 15885 1 1 51 CYS N N -9.020 -5.220 -0.194 1.00 . A B . 51 CYS N 1 1 19 15886 1 1 51 CYS O O -12.180 -6.830 0.162 1.00 . A B . 51 CYS O 1 1 19 15887 1 1 51 CYS SG S -8.594 -6.932 2.845 1.00 . A B . 51 CYS SG 1 1 19 15888 1 1 52 ARG C C -13.170 -4.463 -2.349 1.00 . A B . 52 ARG C 1 1 19 15889 1 1 52 ARG CA C -13.023 -4.412 -0.833 1.00 . A B . 52 ARG CA 1 1 19 15890 1 1 52 ARG CB C -13.416 -3.027 -0.315 1.00 . A B . 52 ARG CB 1 1 19 15891 1 1 52 ARG CD C -13.768 -1.523 1.667 1.00 . A B . 52 ARG CD 1 1 19 15892 1 1 52 ARG CG C -13.395 -2.920 1.202 1.00 . A B . 52 ARG CG 1 1 19 15893 1 1 52 ARG CZ C -15.768 -0.077 1.622 1.00 . A B . 52 ARG CZ 1 1 19 15894 1 1 52 ARG H H -10.978 -4.044 -0.530 1.00 . A B . 52 ARG H 1 1 19 15895 1 1 52 ARG HA H -13.678 -5.147 -0.395 1.00 . A B . 52 ARG HA 1 1 19 15896 1 1 52 ARG HB2 H -12.731 -2.295 -0.717 1.00 . A B . 52 ARG HB2 1 1 19 15897 1 1 52 ARG HB3 H -14.412 -2.799 -0.658 1.00 . A B . 52 ARG HB3 1 1 19 15898 1 1 52 ARG HD2 H -13.821 -1.519 2.744 1.00 . A B . 52 ARG HD2 1 1 19 15899 1 1 52 ARG HD3 H -13.002 -0.833 1.342 1.00 . A B . 52 ARG HD3 1 1 19 15900 1 1 52 ARG HE H -15.397 -1.565 0.336 1.00 . A B . 52 ARG HE 1 1 19 15901 1 1 52 ARG HG2 H -14.100 -3.624 1.616 1.00 . A B . 52 ARG HG2 1 1 19 15902 1 1 52 ARG HG3 H -12.400 -3.154 1.556 1.00 . A B . 52 ARG HG3 1 1 19 15903 1 1 52 ARG HH11 H -14.557 0.229 3.220 1.00 . A B . 52 ARG HH11 1 1 19 15904 1 1 52 ARG HH12 H -15.913 1.305 3.099 1.00 . A B . 52 ARG HH12 1 1 19 15905 1 1 52 ARG HH21 H -17.198 -0.170 0.185 1.00 . A B . 52 ARG HH21 1 1 19 15906 1 1 52 ARG HH22 H -17.421 1.073 1.377 1.00 . A B . 52 ARG HH22 1 1 19 15907 1 1 52 ARG N N -11.669 -4.729 -0.427 1.00 . A B . 52 ARG N 1 1 19 15908 1 1 52 ARG NE N -15.057 -1.089 1.129 1.00 . A B . 52 ARG NE 1 1 19 15909 1 1 52 ARG NH1 N -15.382 0.532 2.738 1.00 . A B . 52 ARG NH1 1 1 19 15910 1 1 52 ARG NH2 N -16.886 0.304 1.015 1.00 . A B . 52 ARG NH2 1 1 19 15911 1 1 52 ARG O O -14.103 -3.886 -2.905 1.00 . A B . 52 ARG O 1 1 19 15912 1 1 53 MET C C -13.570 -6.002 -4.905 1.00 . A B . 53 MET C 1 1 19 15913 1 1 53 MET CA C -12.291 -5.289 -4.472 1.00 . A B . 53 MET CA 1 1 19 15914 1 1 53 MET CB C -11.065 -6.052 -5.004 1.00 . A B . 53 MET CB 1 1 19 15915 1 1 53 MET CE C -8.258 -7.637 -4.954 1.00 . A B . 53 MET CE 1 1 19 15916 1 1 53 MET CG C -11.011 -7.522 -4.602 1.00 . A B . 53 MET CG 1 1 19 15917 1 1 53 MET H H -11.475 -5.515 -2.526 1.00 . A B . 53 MET H 1 1 19 15918 1 1 53 MET HA H -12.294 -4.298 -4.898 1.00 . A B . 53 MET HA 1 1 19 15919 1 1 53 MET HB2 H -11.067 -5.999 -6.082 1.00 . A B . 53 MET HB2 1 1 19 15920 1 1 53 MET HB3 H -10.172 -5.570 -4.634 1.00 . A B . 53 MET HB3 1 1 19 15921 1 1 53 MET HE1 H -8.189 -7.696 -3.878 1.00 . A B . 53 MET HE1 1 1 19 15922 1 1 53 MET HE2 H -8.284 -6.601 -5.257 1.00 . A B . 53 MET HE2 1 1 19 15923 1 1 53 MET HE3 H -7.401 -8.121 -5.396 1.00 . A B . 53 MET HE3 1 1 19 15924 1 1 53 MET HG2 H -10.790 -7.586 -3.548 1.00 . A B . 53 MET HG2 1 1 19 15925 1 1 53 MET HG3 H -11.977 -7.969 -4.793 1.00 . A B . 53 MET HG3 1 1 19 15926 1 1 53 MET N N -12.236 -5.139 -3.016 1.00 . A B . 53 MET N 1 1 19 15927 1 1 53 MET O O -14.079 -5.745 -5.997 1.00 . A B . 53 MET O 1 1 19 15928 1 1 53 MET SD S -9.754 -8.456 -5.499 1.00 . A B . 53 MET SD 1 1 19 15929 1 1 54 LYS C C -15.349 -8.233 -5.666 1.00 . A B . 54 LYS C 1 1 19 15930 1 1 54 LYS CA C -15.331 -7.593 -4.278 1.00 . A B . 54 LYS CA 1 1 19 15931 1 1 54 LYS CB C -16.525 -6.647 -4.107 1.00 . A B . 54 LYS CB 1 1 19 15932 1 1 54 LYS CD C -19.019 -6.340 -4.031 1.00 . A B . 54 LYS CD 1 1 19 15933 1 1 54 LYS CE C -20.369 -7.032 -3.992 1.00 . A B . 54 LYS CE 1 1 19 15934 1 1 54 LYS CG C -17.881 -7.340 -4.162 1.00 . A B . 54 LYS CG 1 1 19 15935 1 1 54 LYS H H -13.606 -7.038 -3.198 1.00 . A B . 54 LYS H 1 1 19 15936 1 1 54 LYS HA H -15.400 -8.379 -3.539 1.00 . A B . 54 LYS HA 1 1 19 15937 1 1 54 LYS HB2 H -16.437 -6.145 -3.154 1.00 . A B . 54 LYS HB2 1 1 19 15938 1 1 54 LYS HB3 H -16.493 -5.909 -4.893 1.00 . A B . 54 LYS HB3 1 1 19 15939 1 1 54 LYS HD2 H -18.887 -5.780 -3.119 1.00 . A B . 54 LYS HD2 1 1 19 15940 1 1 54 LYS HD3 H -18.992 -5.667 -4.877 1.00 . A B . 54 LYS HD3 1 1 19 15941 1 1 54 LYS HE2 H -20.484 -7.625 -4.887 1.00 . A B . 54 LYS HE2 1 1 19 15942 1 1 54 LYS HE3 H -20.402 -7.680 -3.126 1.00 . A B . 54 LYS HE3 1 1 19 15943 1 1 54 LYS HG2 H -17.973 -7.855 -5.107 1.00 . A B . 54 LYS HG2 1 1 19 15944 1 1 54 LYS HG3 H -17.947 -8.053 -3.353 1.00 . A B . 54 LYS HG3 1 1 19 15945 1 1 54 LYS HZ1 H -22.396 -6.563 -3.833 1.00 . A B . 54 LYS HZ1 1 1 19 15946 1 1 54 LYS HZ2 H -21.508 -5.459 -4.756 1.00 . A B . 54 LYS HZ2 1 1 19 15947 1 1 54 LYS HZ3 H -21.374 -5.450 -3.072 1.00 . A B . 54 LYS HZ3 1 1 19 15948 1 1 54 LYS N N -14.083 -6.875 -4.037 1.00 . A B . 54 LYS N 1 1 19 15949 1 1 54 LYS NZ N -21.490 -6.059 -3.907 1.00 . A B . 54 LYS NZ 1 1 19 15950 1 1 54 LYS O O -16.042 -7.763 -6.577 1.00 . A B . 54 LYS O 1 1 19 15951 1 1 55 GLU C C -14.560 -11.505 -6.864 1.00 . A B . 55 GLU C 1 1 19 15952 1 1 55 GLU CA C -14.512 -10.005 -7.094 1.00 . A B . 55 GLU CA 1 1 19 15953 1 1 55 GLU CB C -13.244 -9.646 -7.868 1.00 . A B . 55 GLU CB 1 1 19 15954 1 1 55 GLU CD C -12.125 -8.045 -9.453 1.00 . A B . 55 GLU CD 1 1 19 15955 1 1 55 GLU CG C -13.254 -8.249 -8.468 1.00 . A B . 55 GLU CG 1 1 19 15956 1 1 55 GLU H H -14.054 -9.627 -5.066 1.00 . A B . 55 GLU H 1 1 19 15957 1 1 55 GLU HA H -15.370 -9.716 -7.679 1.00 . A B . 55 GLU HA 1 1 19 15958 1 1 55 GLU HB2 H -12.400 -9.717 -7.201 1.00 . A B . 55 GLU HB2 1 1 19 15959 1 1 55 GLU HB3 H -13.115 -10.355 -8.671 1.00 . A B . 55 GLU HB3 1 1 19 15960 1 1 55 GLU HG2 H -14.193 -8.096 -8.981 1.00 . A B . 55 GLU HG2 1 1 19 15961 1 1 55 GLU HG3 H -13.156 -7.525 -7.673 1.00 . A B . 55 GLU HG3 1 1 19 15962 1 1 55 GLU N N -14.578 -9.295 -5.827 1.00 . A B . 55 GLU N 1 1 19 15963 1 1 55 GLU O O -13.833 -12.034 -6.022 1.00 . A B . 55 GLU O 1 1 19 15964 1 1 55 GLU OE1 O -12.303 -8.382 -10.642 1.00 . A B . 55 GLU OE1 1 1 19 15965 1 1 55 GLU OE2 O -11.051 -7.563 -9.041 1.00 . A B . 55 GLU OE2 1 1 19 15966 1 1 56 SER C C -14.334 -14.271 -8.231 1.00 . A B . 56 SER C 1 1 19 15967 1 1 56 SER CA C -15.526 -13.623 -7.528 1.00 . A B . 56 SER CA 1 1 19 15968 1 1 56 SER CB C -16.847 -14.078 -8.154 1.00 . A B . 56 SER CB 1 1 19 15969 1 1 56 SER H H -16.022 -11.692 -8.209 1.00 . A B . 56 SER H 1 1 19 15970 1 1 56 SER HA H -15.514 -13.906 -6.485 1.00 . A B . 56 SER HA 1 1 19 15971 1 1 56 SER HB2 H -16.826 -15.147 -8.299 1.00 . A B . 56 SER HB2 1 1 19 15972 1 1 56 SER HB3 H -17.664 -13.821 -7.496 1.00 . A B . 56 SER HB3 1 1 19 15973 1 1 56 SER HG H -16.238 -13.498 -9.926 1.00 . A B . 56 SER HG 1 1 19 15974 1 1 56 SER N N -15.428 -12.179 -7.598 1.00 . A B . 56 SER N 1 1 19 15975 1 1 56 SER O O -14.395 -14.452 -9.467 1.00 . A B . 56 SER O 1 1 19 15976 1 1 56 SER OXT O -13.332 -14.571 -7.553 1.00 . A B . 56 SER OXT 1 1 19 15977 1 1 56 SER OG O -17.055 -13.450 -9.410 1.00 . A B . 56 SER OG 1 1 19 15978 2 2 1 ZN ZN ZN -6.477 -6.079 2.557 1.00 . B B . 101 ZN ZN 1 1 19 15979 3 2 1 ZN ZN ZN 5.819 1.012 -0.299 1.00 . C B . 102 ZN ZN 1 1 20 15980 1 1 1 GLY C C 6.834 -13.394 7.113 1.00 . A B . 1 GLY C 1 1 20 15981 1 1 1 GLY CA C 7.433 -14.468 6.236 1.00 . A B . 1 GLY CA 1 1 20 15982 1 1 1 GLY H1 H 6.278 -16.033 6.967 1.00 . A B . 1 GLY H1 1 1 20 15983 1 1 1 GLY H2 H 7.758 -15.843 7.759 1.00 . A B . 1 GLY H2 1 1 20 15984 1 1 1 GLY H3 H 7.709 -16.530 6.216 1.00 . A B . 1 GLY H3 1 1 20 15985 1 1 1 GLY HA2 H 8.482 -14.260 6.093 1.00 . A B . 1 GLY HA2 1 1 20 15986 1 1 1 GLY HA3 H 6.939 -14.455 5.276 1.00 . A B . 1 GLY HA3 1 1 20 15987 1 1 1 GLY N N 7.285 -15.811 6.835 1.00 . A B . 1 GLY N 1 1 20 15988 1 1 1 GLY O O 7.108 -13.357 8.315 1.00 . A B . 1 GLY O 1 1 20 15989 1 1 2 ALA C C 6.349 -10.359 7.641 1.00 . A B . 2 ALA C 1 1 20 15990 1 1 2 ALA CA C 5.349 -11.427 7.213 1.00 . A B . 2 ALA CA 1 1 20 15991 1 1 2 ALA CB C 4.547 -11.931 8.411 1.00 . A B . 2 ALA CB 1 1 20 15992 1 1 2 ALA H H 5.842 -12.644 5.551 1.00 . A B . 2 ALA H 1 1 20 15993 1 1 2 ALA HA H 4.654 -10.978 6.518 1.00 . A B . 2 ALA HA 1 1 20 15994 1 1 2 ALA HB1 H 4.042 -11.100 8.882 1.00 . A B . 2 ALA HB1 1 1 20 15995 1 1 2 ALA HB2 H 5.213 -12.397 9.121 1.00 . A B . 2 ALA HB2 1 1 20 15996 1 1 2 ALA HB3 H 3.816 -12.651 8.077 1.00 . A B . 2 ALA HB3 1 1 20 15997 1 1 2 ALA N N 6.011 -12.533 6.511 1.00 . A B . 2 ALA N 1 1 20 15998 1 1 2 ALA O O 6.402 -9.278 7.057 1.00 . A B . 2 ALA O 1 1 20 15999 1 1 3 MET C C 9.498 -10.014 8.479 1.00 . A B . 3 MET C 1 1 20 16000 1 1 3 MET CA C 8.150 -9.740 9.149 1.00 . A B . 3 MET CA 1 1 20 16001 1 1 3 MET CB C 8.252 -9.865 10.675 1.00 . A B . 3 MET CB 1 1 20 16002 1 1 3 MET CE C 10.361 -7.687 13.540 1.00 . A B . 3 MET CE 1 1 20 16003 1 1 3 MET CG C 9.107 -8.793 11.337 1.00 . A B . 3 MET CG 1 1 20 16004 1 1 3 MET H H 7.086 -11.567 9.046 1.00 . A B . 3 MET H 1 1 20 16005 1 1 3 MET HA H 7.829 -8.740 8.894 1.00 . A B . 3 MET HA 1 1 20 16006 1 1 3 MET HB2 H 7.257 -9.810 11.095 1.00 . A B . 3 MET HB2 1 1 20 16007 1 1 3 MET HB3 H 8.674 -10.829 10.914 1.00 . A B . 3 MET HB3 1 1 20 16008 1 1 3 MET HE1 H 11.295 -7.876 13.031 1.00 . A B . 3 MET HE1 1 1 20 16009 1 1 3 MET HE2 H 10.529 -7.680 14.607 1.00 . A B . 3 MET HE2 1 1 20 16010 1 1 3 MET HE3 H 9.969 -6.730 13.230 1.00 . A B . 3 MET HE3 1 1 20 16011 1 1 3 MET HG2 H 10.110 -8.854 10.939 1.00 . A B . 3 MET HG2 1 1 20 16012 1 1 3 MET HG3 H 8.689 -7.824 11.106 1.00 . A B . 3 MET HG3 1 1 20 16013 1 1 3 MET N N 7.154 -10.673 8.642 1.00 . A B . 3 MET N 1 1 20 16014 1 1 3 MET O O 10.560 -9.648 8.985 1.00 . A B . 3 MET O 1 1 20 16015 1 1 3 MET SD S 9.186 -8.975 13.129 1.00 . A B . 3 MET SD 1 1 20 16016 1 1 4 GLY C C 10.609 -10.454 5.177 1.00 . A B . 4 GLY C 1 1 20 16017 1 1 4 GLY CA C 10.647 -10.985 6.591 1.00 . A B . 4 GLY CA 1 1 20 16018 1 1 4 GLY H H 8.567 -10.905 6.955 1.00 . A B . 4 GLY H 1 1 20 16019 1 1 4 GLY HA2 H 11.496 -10.556 7.103 1.00 . A B . 4 GLY HA2 1 1 20 16020 1 1 4 GLY HA3 H 10.761 -12.059 6.559 1.00 . A B . 4 GLY HA3 1 1 20 16021 1 1 4 GLY N N 9.442 -10.657 7.321 1.00 . A B . 4 GLY N 1 1 20 16022 1 1 4 GLY O O 11.126 -11.082 4.253 1.00 . A B . 4 GLY O 1 1 20 16023 1 1 5 MET C C 10.310 -7.221 3.770 1.00 . A B . 5 MET C 1 1 20 16024 1 1 5 MET CA C 9.879 -8.679 3.697 1.00 . A B . 5 MET CA 1 1 20 16025 1 1 5 MET CB C 8.446 -8.782 3.166 1.00 . A B . 5 MET CB 1 1 20 16026 1 1 5 MET CE C 6.303 -10.104 1.217 1.00 . A B . 5 MET CE 1 1 20 16027 1 1 5 MET CG C 8.281 -8.239 1.753 1.00 . A B . 5 MET CG 1 1 20 16028 1 1 5 MET H H 9.598 -8.845 5.785 1.00 . A B . 5 MET H 1 1 20 16029 1 1 5 MET HA H 10.542 -9.204 3.028 1.00 . A B . 5 MET HA 1 1 20 16030 1 1 5 MET HB2 H 8.147 -9.819 3.168 1.00 . A B . 5 MET HB2 1 1 20 16031 1 1 5 MET HB3 H 7.790 -8.227 3.820 1.00 . A B . 5 MET HB3 1 1 20 16032 1 1 5 MET HE1 H 5.311 -10.322 0.851 1.00 . A B . 5 MET HE1 1 1 20 16033 1 1 5 MET HE2 H 6.394 -10.449 2.236 1.00 . A B . 5 MET HE2 1 1 20 16034 1 1 5 MET HE3 H 7.033 -10.605 0.601 1.00 . A B . 5 MET HE3 1 1 20 16035 1 1 5 MET HG2 H 8.590 -7.204 1.741 1.00 . A B . 5 MET HG2 1 1 20 16036 1 1 5 MET HG3 H 8.916 -8.807 1.089 1.00 . A B . 5 MET HG3 1 1 20 16037 1 1 5 MET N N 9.988 -9.299 5.006 1.00 . A B . 5 MET N 1 1 20 16038 1 1 5 MET O O 9.484 -6.310 3.844 1.00 . A B . 5 MET O 1 1 20 16039 1 1 5 MET SD S 6.584 -8.335 1.156 1.00 . A B . 5 MET SD 1 1 20 16040 1 1 6 ARG C C 12.550 -5.233 2.392 1.00 . A B . 6 ARG C 1 1 20 16041 1 1 6 ARG CA C 12.141 -5.650 3.795 1.00 . A B . 6 ARG CA 1 1 20 16042 1 1 6 ARG CB C 13.329 -5.541 4.753 1.00 . A B . 6 ARG CB 1 1 20 16043 1 1 6 ARG CD C 12.055 -4.714 6.785 1.00 . A B . 6 ARG CD 1 1 20 16044 1 1 6 ARG CG C 12.976 -5.791 6.216 1.00 . A B . 6 ARG CG 1 1 20 16045 1 1 6 ARG CZ C 9.838 -3.763 6.246 1.00 . A B . 6 ARG CZ 1 1 20 16046 1 1 6 ARG H H 12.229 -7.763 3.761 1.00 . A B . 6 ARG H 1 1 20 16047 1 1 6 ARG HA H 11.355 -4.993 4.135 1.00 . A B . 6 ARG HA 1 1 20 16048 1 1 6 ARG HB2 H 14.077 -6.261 4.460 1.00 . A B . 6 ARG HB2 1 1 20 16049 1 1 6 ARG HB3 H 13.747 -4.549 4.672 1.00 . A B . 6 ARG HB3 1 1 20 16050 1 1 6 ARG HD2 H 11.993 -4.844 7.856 1.00 . A B . 6 ARG HD2 1 1 20 16051 1 1 6 ARG HD3 H 12.481 -3.744 6.569 1.00 . A B . 6 ARG HD3 1 1 20 16052 1 1 6 ARG HE H 10.429 -5.623 5.804 1.00 . A B . 6 ARG HE 1 1 20 16053 1 1 6 ARG HG2 H 12.477 -6.746 6.292 1.00 . A B . 6 ARG HG2 1 1 20 16054 1 1 6 ARG HG3 H 13.888 -5.815 6.793 1.00 . A B . 6 ARG HG3 1 1 20 16055 1 1 6 ARG HH11 H 11.058 -2.502 7.263 1.00 . A B . 6 ARG HH11 1 1 20 16056 1 1 6 ARG HH12 H 9.500 -1.858 6.850 1.00 . A B . 6 ARG HH12 1 1 20 16057 1 1 6 ARG HH21 H 8.386 -4.770 5.250 1.00 . A B . 6 ARG HH21 1 1 20 16058 1 1 6 ARG HH22 H 7.986 -3.143 5.713 1.00 . A B . 6 ARG HH22 1 1 20 16059 1 1 6 ARG N N 11.611 -7.000 3.776 1.00 . A B . 6 ARG N 1 1 20 16060 1 1 6 ARG NE N 10.705 -4.775 6.224 1.00 . A B . 6 ARG NE 1 1 20 16061 1 1 6 ARG NH1 N 10.159 -2.616 6.830 1.00 . A B . 6 ARG NH1 1 1 20 16062 1 1 6 ARG NH2 N 8.643 -3.903 5.690 1.00 . A B . 6 ARG NH2 1 1 20 16063 1 1 6 ARG O O 13.728 -5.279 2.033 1.00 . A B . 6 ARG O 1 1 20 16064 1 1 7 ASN C C 10.994 -3.178 -0.111 1.00 . A B . 7 ASN C 1 1 20 16065 1 1 7 ASN CA C 11.829 -4.406 0.233 1.00 . A B . 7 ASN CA 1 1 20 16066 1 1 7 ASN CB C 11.561 -5.523 -0.778 1.00 . A B . 7 ASN CB 1 1 20 16067 1 1 7 ASN CG C 12.034 -5.146 -2.174 1.00 . A B . 7 ASN CG 1 1 20 16068 1 1 7 ASN H H 10.643 -4.869 1.924 1.00 . A B . 7 ASN H 1 1 20 16069 1 1 7 ASN HA H 12.871 -4.134 0.177 1.00 . A B . 7 ASN HA 1 1 20 16070 1 1 7 ASN HB2 H 12.084 -6.416 -0.464 1.00 . A B . 7 ASN HB2 1 1 20 16071 1 1 7 ASN HB3 H 10.501 -5.721 -0.813 1.00 . A B . 7 ASN HB3 1 1 20 16072 1 1 7 ASN HD21 H 10.574 -6.207 -3.012 1.00 . A B . 7 ASN HD21 1 1 20 16073 1 1 7 ASN HD22 H 11.636 -5.387 -4.108 1.00 . A B . 7 ASN HD22 1 1 20 16074 1 1 7 ASN N N 11.565 -4.852 1.592 1.00 . A B . 7 ASN N 1 1 20 16075 1 1 7 ASN ND2 N 11.348 -5.632 -3.197 1.00 . A B . 7 ASN ND2 1 1 20 16076 1 1 7 ASN O O 10.207 -3.177 -1.055 1.00 . A B . 7 ASN O 1 1 20 16077 1 1 7 ASN OD1 O 13.008 -4.408 -2.329 1.00 . A B . 7 ASN OD1 1 1 20 16078 1 1 8 LEU C C 11.614 0.065 -0.256 1.00 . A B . 8 LEU C 1 1 20 16079 1 1 8 LEU CA C 10.563 -0.843 0.362 1.00 . A B . 8 LEU CA 1 1 20 16080 1 1 8 LEU CB C 9.913 -0.207 1.601 1.00 . A B . 8 LEU CB 1 1 20 16081 1 1 8 LEU CD1 C 11.823 0.880 2.850 1.00 . A B . 8 LEU CD1 1 1 20 16082 1 1 8 LEU CD2 C 9.853 -0.022 4.100 1.00 . A B . 8 LEU CD2 1 1 20 16083 1 1 8 LEU CG C 10.753 -0.203 2.887 1.00 . A B . 8 LEU CG 1 1 20 16084 1 1 8 LEU H H 11.709 -2.227 1.487 1.00 . A B . 8 LEU H 1 1 20 16085 1 1 8 LEU HA H 9.798 -1.022 -0.378 1.00 . A B . 8 LEU HA 1 1 20 16086 1 1 8 LEU HB2 H 9.671 0.819 1.359 1.00 . A B . 8 LEU HB2 1 1 20 16087 1 1 8 LEU HB3 H 8.992 -0.733 1.803 1.00 . A B . 8 LEU HB3 1 1 20 16088 1 1 8 LEU HD11 H 12.439 0.807 3.734 1.00 . A B . 8 LEU HD11 1 1 20 16089 1 1 8 LEU HD12 H 11.353 1.851 2.820 1.00 . A B . 8 LEU HD12 1 1 20 16090 1 1 8 LEU HD13 H 12.438 0.751 1.971 1.00 . A B . 8 LEU HD13 1 1 20 16091 1 1 8 LEU HD21 H 10.450 -0.041 4.999 1.00 . A B . 8 LEU HD21 1 1 20 16092 1 1 8 LEU HD22 H 9.129 -0.824 4.131 1.00 . A B . 8 LEU HD22 1 1 20 16093 1 1 8 LEU HD23 H 9.339 0.925 4.029 1.00 . A B . 8 LEU HD23 1 1 20 16094 1 1 8 LEU HG H 11.250 -1.155 2.983 1.00 . A B . 8 LEU HG 1 1 20 16095 1 1 8 LEU N N 11.163 -2.131 0.676 1.00 . A B . 8 LEU N 1 1 20 16096 1 1 8 LEU O O 11.434 1.276 -0.377 1.00 . A B . 8 LEU O 1 1 20 16097 1 1 9 ASP C C 13.517 0.476 -2.732 1.00 . A B . 9 ASP C 1 1 20 16098 1 1 9 ASP CA C 13.822 0.144 -1.284 1.00 . A B . 9 ASP CA 1 1 20 16099 1 1 9 ASP CB C 15.103 -0.687 -1.194 1.00 . A B . 9 ASP CB 1 1 20 16100 1 1 9 ASP CG C 15.624 -0.808 0.224 1.00 . A B . 9 ASP CG 1 1 20 16101 1 1 9 ASP H H 12.714 -1.540 -0.629 1.00 . A B . 9 ASP H 1 1 20 16102 1 1 9 ASP HA H 13.960 1.065 -0.739 1.00 . A B . 9 ASP HA 1 1 20 16103 1 1 9 ASP HB2 H 14.906 -1.679 -1.569 1.00 . A B . 9 ASP HB2 1 1 20 16104 1 1 9 ASP HB3 H 15.868 -0.224 -1.801 1.00 . A B . 9 ASP HB3 1 1 20 16105 1 1 9 ASP N N 12.697 -0.563 -0.689 1.00 . A B . 9 ASP N 1 1 20 16106 1 1 9 ASP O O 14.077 1.408 -3.303 1.00 . A B . 9 ASP O 1 1 20 16107 1 1 9 ASP OD1 O 16.392 0.076 0.656 1.00 . A B . 9 ASP OD1 1 1 20 16108 1 1 9 ASP OD2 O 15.258 -1.781 0.919 1.00 . A B . 9 ASP OD2 1 1 20 16109 1 1 10 GLU C C 10.961 0.875 -4.677 1.00 . A B . 10 GLU C 1 1 20 16110 1 1 10 GLU CA C 12.171 -0.049 -4.682 1.00 . A B . 10 GLU CA 1 1 20 16111 1 1 10 GLU CB C 11.825 -1.364 -5.381 1.00 . A B . 10 GLU CB 1 1 20 16112 1 1 10 GLU CD C 12.637 -3.616 -6.183 1.00 . A B . 10 GLU CD 1 1 20 16113 1 1 10 GLU CG C 12.968 -2.366 -5.395 1.00 . A B . 10 GLU CG 1 1 20 16114 1 1 10 GLU H H 12.221 -1.039 -2.816 1.00 . A B . 10 GLU H 1 1 20 16115 1 1 10 GLU HA H 12.978 0.434 -5.209 1.00 . A B . 10 GLU HA 1 1 20 16116 1 1 10 GLU HB2 H 10.982 -1.816 -4.879 1.00 . A B . 10 GLU HB2 1 1 20 16117 1 1 10 GLU HB3 H 11.550 -1.150 -6.403 1.00 . A B . 10 GLU HB3 1 1 20 16118 1 1 10 GLU HG2 H 13.833 -1.899 -5.841 1.00 . A B . 10 GLU HG2 1 1 20 16119 1 1 10 GLU HG3 H 13.196 -2.646 -4.377 1.00 . A B . 10 GLU HG3 1 1 20 16120 1 1 10 GLU N N 12.609 -0.292 -3.317 1.00 . A B . 10 GLU N 1 1 20 16121 1 1 10 GLU O O 10.461 1.281 -5.725 1.00 . A B . 10 GLU O 1 1 20 16122 1 1 10 GLU OE1 O 12.004 -4.528 -5.612 1.00 . A B . 10 GLU OE1 1 1 20 16123 1 1 10 GLU OE2 O 13.007 -3.698 -7.373 1.00 . A B . 10 GLU OE2 1 1 20 16124 1 1 11 CYS C C 9.824 3.451 -2.881 1.00 . A B . 11 CYS C 1 1 20 16125 1 1 11 CYS CA C 9.358 2.061 -3.302 1.00 . A B . 11 CYS CA 1 1 20 16126 1 1 11 CYS CB C 8.439 1.451 -2.248 1.00 . A B . 11 CYS CB 1 1 20 16127 1 1 11 CYS H H 11.002 0.902 -2.692 1.00 . A B . 11 CYS H 1 1 20 16128 1 1 11 CYS HA H 8.835 2.128 -4.243 1.00 . A B . 11 CYS HA 1 1 20 16129 1 1 11 CYS HB2 H 8.312 0.403 -2.464 1.00 . A B . 11 CYS HB2 1 1 20 16130 1 1 11 CYS HB3 H 8.907 1.555 -1.281 1.00 . A B . 11 CYS HB3 1 1 20 16131 1 1 11 CYS N N 10.511 1.207 -3.480 1.00 . A B . 11 CYS N 1 1 20 16132 1 1 11 CYS O O 10.015 3.721 -1.692 1.00 . A B . 11 CYS O 1 1 20 16133 1 1 11 CYS SG S 6.791 2.186 -2.141 1.00 . A B . 11 CYS SG 1 1 20 16134 1 1 12 GLU C C 9.551 6.438 -2.718 1.00 . A B . 12 GLU C 1 1 20 16135 1 1 12 GLU CA C 10.505 5.671 -3.615 1.00 . A B . 12 GLU CA 1 1 20 16136 1 1 12 GLU CB C 10.675 6.417 -4.934 1.00 . A B . 12 GLU CB 1 1 20 16137 1 1 12 GLU CD C 11.654 6.436 -7.255 1.00 . A B . 12 GLU CD 1 1 20 16138 1 1 12 GLU CG C 11.545 5.689 -5.946 1.00 . A B . 12 GLU CG 1 1 20 16139 1 1 12 GLU H H 9.811 4.055 -4.783 1.00 . A B . 12 GLU H 1 1 20 16140 1 1 12 GLU HA H 11.460 5.593 -3.125 1.00 . A B . 12 GLU HA 1 1 20 16141 1 1 12 GLU HB2 H 9.700 6.569 -5.373 1.00 . A B . 12 GLU HB2 1 1 20 16142 1 1 12 GLU HB3 H 11.122 7.380 -4.734 1.00 . A B . 12 GLU HB3 1 1 20 16143 1 1 12 GLU HG2 H 12.537 5.571 -5.533 1.00 . A B . 12 GLU HG2 1 1 20 16144 1 1 12 GLU HG3 H 11.118 4.715 -6.136 1.00 . A B . 12 GLU HG3 1 1 20 16145 1 1 12 GLU N N 10.008 4.324 -3.861 1.00 . A B . 12 GLU N 1 1 20 16146 1 1 12 GLU O O 9.968 7.239 -1.883 1.00 . A B . 12 GLU O 1 1 20 16147 1 1 12 GLU OE1 O 10.708 6.367 -8.067 1.00 . A B . 12 GLU OE1 1 1 20 16148 1 1 12 GLU OE2 O 12.691 7.089 -7.488 1.00 . A B . 12 GLU OE2 1 1 20 16149 1 1 13 VAL C C 7.314 6.471 -0.643 1.00 . A B . 13 VAL C 1 1 20 16150 1 1 13 VAL CA C 7.241 6.842 -2.127 1.00 . A B . 13 VAL CA 1 1 20 16151 1 1 13 VAL CB C 5.839 6.548 -2.713 1.00 . A B . 13 VAL CB 1 1 20 16152 1 1 13 VAL CG1 C 5.578 5.061 -2.807 1.00 . A B . 13 VAL CG1 1 1 20 16153 1 1 13 VAL CG2 C 4.751 7.218 -1.896 1.00 . A B . 13 VAL CG2 1 1 20 16154 1 1 13 VAL H H 8.016 5.493 -3.555 1.00 . A B . 13 VAL H 1 1 20 16155 1 1 13 VAL HA H 7.423 7.903 -2.216 1.00 . A B . 13 VAL HA 1 1 20 16156 1 1 13 VAL HB H 5.804 6.954 -3.714 1.00 . A B . 13 VAL HB 1 1 20 16157 1 1 13 VAL HG11 H 4.642 4.894 -3.313 1.00 . A B . 13 VAL HG11 1 1 20 16158 1 1 13 VAL HG12 H 5.529 4.641 -1.814 1.00 . A B . 13 VAL HG12 1 1 20 16159 1 1 13 VAL HG13 H 6.374 4.587 -3.360 1.00 . A B . 13 VAL HG13 1 1 20 16160 1 1 13 VAL HG21 H 3.787 6.975 -2.315 1.00 . A B . 13 VAL HG21 1 1 20 16161 1 1 13 VAL HG22 H 4.894 8.287 -1.916 1.00 . A B . 13 VAL HG22 1 1 20 16162 1 1 13 VAL HG23 H 4.803 6.865 -0.878 1.00 . A B . 13 VAL HG23 1 1 20 16163 1 1 13 VAL N N 8.272 6.166 -2.888 1.00 . A B . 13 VAL N 1 1 20 16164 1 1 13 VAL O O 7.038 7.299 0.222 1.00 . A B . 13 VAL O 1 1 20 16165 1 1 14 CYS C C 9.065 5.519 1.695 1.00 . A B . 14 CYS C 1 1 20 16166 1 1 14 CYS CA C 7.894 4.807 1.040 1.00 . A B . 14 CYS CA 1 1 20 16167 1 1 14 CYS CB C 8.076 3.297 1.137 1.00 . A B . 14 CYS CB 1 1 20 16168 1 1 14 CYS H H 7.909 4.605 -1.074 1.00 . A B . 14 CYS H 1 1 20 16169 1 1 14 CYS HA H 7.000 5.077 1.571 1.00 . A B . 14 CYS HA 1 1 20 16170 1 1 14 CYS HB2 H 8.419 2.923 0.186 1.00 . A B . 14 CYS HB2 1 1 20 16171 1 1 14 CYS HB3 H 8.815 3.081 1.893 1.00 . A B . 14 CYS HB3 1 1 20 16172 1 1 14 CYS N N 7.722 5.237 -0.347 1.00 . A B . 14 CYS N 1 1 20 16173 1 1 14 CYS O O 9.085 5.711 2.911 1.00 . A B . 14 CYS O 1 1 20 16174 1 1 14 CYS SG S 6.565 2.406 1.571 1.00 . A B . 14 CYS SG 1 1 20 16175 1 1 15 ARG C C 10.692 8.041 1.875 1.00 . A B . 15 ARG C 1 1 20 16176 1 1 15 ARG CA C 11.168 6.684 1.375 1.00 . A B . 15 ARG CA 1 1 20 16177 1 1 15 ARG CB C 12.213 6.860 0.277 1.00 . A B . 15 ARG CB 1 1 20 16178 1 1 15 ARG CD C 13.773 5.745 -1.348 1.00 . A B . 15 ARG CD 1 1 20 16179 1 1 15 ARG CG C 12.917 5.570 -0.104 1.00 . A B . 15 ARG CG 1 1 20 16180 1 1 15 ARG CZ C 15.541 7.254 -2.186 1.00 . A B . 15 ARG CZ 1 1 20 16181 1 1 15 ARG H H 9.977 5.677 -0.066 1.00 . A B . 15 ARG H 1 1 20 16182 1 1 15 ARG HA H 11.605 6.145 2.199 1.00 . A B . 15 ARG HA 1 1 20 16183 1 1 15 ARG HB2 H 11.727 7.254 -0.603 1.00 . A B . 15 ARG HB2 1 1 20 16184 1 1 15 ARG HB3 H 12.957 7.566 0.613 1.00 . A B . 15 ARG HB3 1 1 20 16185 1 1 15 ARG HD2 H 14.273 4.813 -1.558 1.00 . A B . 15 ARG HD2 1 1 20 16186 1 1 15 ARG HD3 H 13.129 6.001 -2.175 1.00 . A B . 15 ARG HD3 1 1 20 16187 1 1 15 ARG HE H 14.885 7.188 -0.293 1.00 . A B . 15 ARG HE 1 1 20 16188 1 1 15 ARG HG2 H 13.550 5.264 0.714 1.00 . A B . 15 ARG HG2 1 1 20 16189 1 1 15 ARG HG3 H 12.173 4.810 -0.291 1.00 . A B . 15 ARG HG3 1 1 20 16190 1 1 15 ARG HH11 H 14.802 5.975 -3.579 1.00 . A B . 15 ARG HH11 1 1 20 16191 1 1 15 ARG HH12 H 16.017 7.073 -4.152 1.00 . A B . 15 ARG HH12 1 1 20 16192 1 1 15 ARG HH21 H 16.497 8.632 -1.051 1.00 . A B . 15 ARG HH21 1 1 20 16193 1 1 15 ARG HH22 H 16.984 8.576 -2.715 1.00 . A B . 15 ARG HH22 1 1 20 16194 1 1 15 ARG N N 10.034 5.912 0.885 1.00 . A B . 15 ARG N 1 1 20 16195 1 1 15 ARG NE N 14.779 6.797 -1.191 1.00 . A B . 15 ARG NE 1 1 20 16196 1 1 15 ARG NH1 N 15.445 6.724 -3.401 1.00 . A B . 15 ARG NH1 1 1 20 16197 1 1 15 ARG NH2 N 16.409 8.232 -1.965 1.00 . A B . 15 ARG NH2 1 1 20 16198 1 1 15 ARG O O 11.205 8.574 2.858 1.00 . A B . 15 ARG O 1 1 20 16199 1 1 16 ASP C C 8.061 9.653 2.699 1.00 . A B . 16 ASP C 1 1 20 16200 1 1 16 ASP CA C 9.084 9.849 1.583 1.00 . A B . 16 ASP CA 1 1 20 16201 1 1 16 ASP CB C 8.413 10.512 0.377 1.00 . A B . 16 ASP CB 1 1 20 16202 1 1 16 ASP CG C 9.407 11.180 -0.550 1.00 . A B . 16 ASP CG 1 1 20 16203 1 1 16 ASP H H 9.391 8.137 0.370 1.00 . A B . 16 ASP H 1 1 20 16204 1 1 16 ASP HA H 9.869 10.495 1.944 1.00 . A B . 16 ASP HA 1 1 20 16205 1 1 16 ASP HB2 H 7.878 9.759 -0.184 1.00 . A B . 16 ASP HB2 1 1 20 16206 1 1 16 ASP HB3 H 7.716 11.258 0.727 1.00 . A B . 16 ASP HB3 1 1 20 16207 1 1 16 ASP N N 9.697 8.583 1.190 1.00 . A B . 16 ASP N 1 1 20 16208 1 1 16 ASP O O 7.476 10.618 3.191 1.00 . A B . 16 ASP O 1 1 20 16209 1 1 16 ASP OD1 O 10.222 10.462 -1.172 1.00 . A B . 16 ASP OD1 1 1 20 16210 1 1 16 ASP OD2 O 9.390 12.423 -0.655 1.00 . A B . 16 ASP OD2 1 1 20 16211 1 1 17 GLY C C 5.992 6.952 3.775 1.00 . A B . 17 GLY C 1 1 20 16212 1 1 17 GLY CA C 6.899 8.106 4.148 1.00 . A B . 17 GLY CA 1 1 20 16213 1 1 17 GLY H H 8.367 7.679 2.685 1.00 . A B . 17 GLY H 1 1 20 16214 1 1 17 GLY HA2 H 7.437 7.852 5.050 1.00 . A B . 17 GLY HA2 1 1 20 16215 1 1 17 GLY HA3 H 6.294 8.982 4.331 1.00 . A B . 17 GLY HA3 1 1 20 16216 1 1 17 GLY N N 7.855 8.405 3.099 1.00 . A B . 17 GLY N 1 1 20 16217 1 1 17 GLY O O 5.758 6.055 4.583 1.00 . A B . 17 GLY O 1 1 20 16218 1 1 18 GLY C C 3.453 5.612 2.881 1.00 . A B . 18 GLY C 1 1 20 16219 1 1 18 GLY CA C 4.645 5.939 2.002 1.00 . A B . 18 GLY CA 1 1 20 16220 1 1 18 GLY H H 5.828 7.703 1.944 1.00 . A B . 18 GLY H 1 1 20 16221 1 1 18 GLY HA2 H 4.280 6.262 1.042 1.00 . A B . 18 GLY HA2 1 1 20 16222 1 1 18 GLY HA3 H 5.222 5.039 1.861 1.00 . A B . 18 GLY HA3 1 1 20 16223 1 1 18 GLY N N 5.524 6.977 2.532 1.00 . A B . 18 GLY N 1 1 20 16224 1 1 18 GLY O O 3.536 4.744 3.752 1.00 . A B . 18 GLY O 1 1 20 16225 1 1 19 GLU C C 0.400 4.790 2.730 1.00 . A B . 19 GLU C 1 1 20 16226 1 1 19 GLU CA C 1.114 5.979 3.370 1.00 . A B . 19 GLU CA 1 1 20 16227 1 1 19 GLU CB C 0.199 7.204 3.393 1.00 . A B . 19 GLU CB 1 1 20 16228 1 1 19 GLU CD C 1.002 8.152 5.596 1.00 . A B . 19 GLU CD 1 1 20 16229 1 1 19 GLU CG C 0.794 8.405 4.118 1.00 . A B . 19 GLU CG 1 1 20 16230 1 1 19 GLU H H 2.309 6.951 1.929 1.00 . A B . 19 GLU H 1 1 20 16231 1 1 19 GLU HA H 1.389 5.721 4.382 1.00 . A B . 19 GLU HA 1 1 20 16232 1 1 19 GLU HB2 H -0.014 7.497 2.376 1.00 . A B . 19 GLU HB2 1 1 20 16233 1 1 19 GLU HB3 H -0.725 6.935 3.884 1.00 . A B . 19 GLU HB3 1 1 20 16234 1 1 19 GLU HG2 H 1.749 8.641 3.676 1.00 . A B . 19 GLU HG2 1 1 20 16235 1 1 19 GLU HG3 H 0.128 9.249 4.003 1.00 . A B . 19 GLU HG3 1 1 20 16236 1 1 19 GLU N N 2.333 6.271 2.636 1.00 . A B . 19 GLU N 1 1 20 16237 1 1 19 GLU O O 0.067 4.819 1.545 1.00 . A B . 19 GLU O 1 1 20 16238 1 1 19 GLU OE1 O 0.017 8.216 6.355 1.00 . A B . 19 GLU OE1 1 1 20 16239 1 1 19 GLU OE2 O 2.153 7.897 6.009 1.00 . A B . 19 GLU OE2 1 1 20 16240 1 1 20 LEU C C -1.913 2.466 3.394 1.00 . A B . 20 LEU C 1 1 20 16241 1 1 20 LEU CA C -0.440 2.523 3.016 1.00 . A B . 20 LEU CA 1 1 20 16242 1 1 20 LEU CB C 0.279 1.293 3.570 1.00 . A B . 20 LEU CB 1 1 20 16243 1 1 20 LEU CD1 C 2.351 -0.102 3.701 1.00 . A B . 20 LEU CD1 1 1 20 16244 1 1 20 LEU CD2 C 1.365 0.424 1.477 1.00 . A B . 20 LEU CD2 1 1 20 16245 1 1 20 LEU CG C 1.604 0.941 2.891 1.00 . A B . 20 LEU CG 1 1 20 16246 1 1 20 LEU H H 0.438 3.797 4.457 1.00 . A B . 20 LEU H 1 1 20 16247 1 1 20 LEU HA H -0.353 2.523 1.942 1.00 . A B . 20 LEU HA 1 1 20 16248 1 1 20 LEU HB2 H 0.473 1.462 4.619 1.00 . A B . 20 LEU HB2 1 1 20 16249 1 1 20 LEU HB3 H -0.384 0.446 3.478 1.00 . A B . 20 LEU HB3 1 1 20 16250 1 1 20 LEU HD11 H 1.745 -0.992 3.784 1.00 . A B . 20 LEU HD11 1 1 20 16251 1 1 20 LEU HD12 H 2.558 0.287 4.685 1.00 . A B . 20 LEU HD12 1 1 20 16252 1 1 20 LEU HD13 H 3.280 -0.344 3.206 1.00 . A B . 20 LEU HD13 1 1 20 16253 1 1 20 LEU HD21 H 0.920 1.201 0.873 1.00 . A B . 20 LEU HD21 1 1 20 16254 1 1 20 LEU HD22 H 0.702 -0.429 1.511 1.00 . A B . 20 LEU HD22 1 1 20 16255 1 1 20 LEU HD23 H 2.308 0.125 1.041 1.00 . A B . 20 LEU HD23 1 1 20 16256 1 1 20 LEU HG H 2.220 1.829 2.828 1.00 . A B . 20 LEU HG 1 1 20 16257 1 1 20 LEU N N 0.185 3.743 3.513 1.00 . A B . 20 LEU N 1 1 20 16258 1 1 20 LEU O O -2.293 2.821 4.510 1.00 . A B . 20 LEU O 1 1 20 16259 1 1 21 PHE C C -4.613 0.457 2.392 1.00 . A B . 21 PHE C 1 1 20 16260 1 1 21 PHE CA C -4.166 1.881 2.699 1.00 . A B . 21 PHE CA 1 1 20 16261 1 1 21 PHE CB C -4.939 2.896 1.852 1.00 . A B . 21 PHE CB 1 1 20 16262 1 1 21 PHE CD1 C -5.010 4.932 3.317 1.00 . A B . 21 PHE CD1 1 1 20 16263 1 1 21 PHE CD2 C -3.711 5.024 1.317 1.00 . A B . 21 PHE CD2 1 1 20 16264 1 1 21 PHE CE1 C -4.642 6.225 3.618 1.00 . A B . 21 PHE CE1 1 1 20 16265 1 1 21 PHE CE2 C -3.342 6.321 1.615 1.00 . A B . 21 PHE CE2 1 1 20 16266 1 1 21 PHE CG C -4.551 4.315 2.164 1.00 . A B . 21 PHE CG 1 1 20 16267 1 1 21 PHE CZ C -3.809 6.922 2.768 1.00 . A B . 21 PHE CZ 1 1 20 16268 1 1 21 PHE H H -2.372 1.802 1.571 1.00 . A B . 21 PHE H 1 1 20 16269 1 1 21 PHE HA H -4.343 2.085 3.747 1.00 . A B . 21 PHE HA 1 1 20 16270 1 1 21 PHE HB2 H -4.737 2.713 0.805 1.00 . A B . 21 PHE HB2 1 1 20 16271 1 1 21 PHE HB3 H -6.000 2.786 2.036 1.00 . A B . 21 PHE HB3 1 1 20 16272 1 1 21 PHE HD1 H -5.665 4.391 3.986 1.00 . A B . 21 PHE HD1 1 1 20 16273 1 1 21 PHE HD2 H -3.343 4.558 0.414 1.00 . A B . 21 PHE HD2 1 1 20 16274 1 1 21 PHE HE1 H -5.006 6.691 4.521 1.00 . A B . 21 PHE HE1 1 1 20 16275 1 1 21 PHE HE2 H -2.693 6.864 0.946 1.00 . A B . 21 PHE HE2 1 1 20 16276 1 1 21 PHE HZ H -3.523 7.936 3.002 1.00 . A B . 21 PHE HZ 1 1 20 16277 1 1 21 PHE N N -2.737 2.023 2.457 1.00 . A B . 21 PHE N 1 1 20 16278 1 1 21 PHE O O -5.625 0.227 1.731 1.00 . A B . 21 PHE O 1 1 20 16279 1 1 22 CYS C C -3.892 -2.730 3.882 1.00 . A B . 22 CYS C 1 1 20 16280 1 1 22 CYS CA C -4.104 -1.903 2.617 1.00 . A B . 22 CYS CA 1 1 20 16281 1 1 22 CYS CB C -3.183 -2.413 1.509 1.00 . A B . 22 CYS CB 1 1 20 16282 1 1 22 CYS H H -3.001 -0.247 3.327 1.00 . A B . 22 CYS H 1 1 20 16283 1 1 22 CYS HA H -5.130 -1.993 2.296 1.00 . A B . 22 CYS HA 1 1 20 16284 1 1 22 CYS HB2 H -2.157 -2.318 1.836 1.00 . A B . 22 CYS HB2 1 1 20 16285 1 1 22 CYS HB3 H -3.400 -3.450 1.310 1.00 . A B . 22 CYS HB3 1 1 20 16286 1 1 22 CYS N N -3.823 -0.499 2.855 1.00 . A B . 22 CYS N 1 1 20 16287 1 1 22 CYS O O -3.186 -2.302 4.794 1.00 . A B . 22 CYS O 1 1 20 16288 1 1 22 CYS SG S -3.334 -1.506 -0.058 1.00 . A B . 22 CYS SG 1 1 20 16289 1 1 23 CYS C C -2.808 -5.334 4.930 1.00 . A B . 23 CYS C 1 1 20 16290 1 1 23 CYS CA C -4.256 -4.869 5.009 1.00 . A B . 23 CYS CA 1 1 20 16291 1 1 23 CYS CB C -5.163 -6.103 4.887 1.00 . A B . 23 CYS CB 1 1 20 16292 1 1 23 CYS H H -5.153 -4.140 3.234 1.00 . A B . 23 CYS H 1 1 20 16293 1 1 23 CYS HA H -4.429 -4.378 5.956 1.00 . A B . 23 CYS HA 1 1 20 16294 1 1 23 CYS HB2 H -4.801 -6.720 4.076 1.00 . A B . 23 CYS HB2 1 1 20 16295 1 1 23 CYS HB3 H -5.114 -6.667 5.807 1.00 . A B . 23 CYS HB3 1 1 20 16296 1 1 23 CYS N N -4.511 -3.913 3.930 1.00 . A B . 23 CYS N 1 1 20 16297 1 1 23 CYS O O -2.187 -5.190 3.879 1.00 . A B . 23 CYS O 1 1 20 16298 1 1 23 CYS SG S -6.898 -5.752 4.557 1.00 . A B . 23 CYS SG 1 1 20 16299 1 1 24 ASP C C -0.702 -7.354 4.812 1.00 . A B . 24 ASP C 1 1 20 16300 1 1 24 ASP CA C -0.912 -6.422 6.002 1.00 . A B . 24 ASP CA 1 1 20 16301 1 1 24 ASP CB C -0.607 -7.160 7.309 1.00 . A B . 24 ASP CB 1 1 20 16302 1 1 24 ASP CG C -0.670 -6.250 8.516 1.00 . A B . 24 ASP CG 1 1 20 16303 1 1 24 ASP H H -2.794 -5.921 6.844 1.00 . A B . 24 ASP H 1 1 20 16304 1 1 24 ASP HA H -0.234 -5.588 5.906 1.00 . A B . 24 ASP HA 1 1 20 16305 1 1 24 ASP HB2 H -1.326 -7.953 7.444 1.00 . A B . 24 ASP HB2 1 1 20 16306 1 1 24 ASP HB3 H 0.384 -7.585 7.251 1.00 . A B . 24 ASP HB3 1 1 20 16307 1 1 24 ASP N N -2.275 -5.890 6.010 1.00 . A B . 24 ASP N 1 1 20 16308 1 1 24 ASP O O 0.216 -7.161 4.016 1.00 . A B . 24 ASP O 1 1 20 16309 1 1 24 ASP OD1 O 0.341 -5.582 8.816 1.00 . A B . 24 ASP OD1 1 1 20 16310 1 1 24 ASP OD2 O -1.728 -6.196 9.175 1.00 . A B . 24 ASP OD2 1 1 20 16311 1 1 25 THR C C -1.628 -8.559 2.220 1.00 . A B . 25 THR C 1 1 20 16312 1 1 25 THR CA C -1.515 -9.281 3.568 1.00 . A B . 25 THR CA 1 1 20 16313 1 1 25 THR CB C -2.623 -10.343 3.678 1.00 . A B . 25 THR CB 1 1 20 16314 1 1 25 THR CG2 C -2.462 -11.413 2.606 1.00 . A B . 25 THR CG2 1 1 20 16315 1 1 25 THR H H -2.282 -8.449 5.355 1.00 . A B . 25 THR H 1 1 20 16316 1 1 25 THR HA H -0.563 -9.782 3.616 1.00 . A B . 25 THR HA 1 1 20 16317 1 1 25 THR HB H -3.580 -9.861 3.547 1.00 . A B . 25 THR HB 1 1 20 16318 1 1 25 THR HG1 H -3.430 -10.833 5.415 1.00 . A B . 25 THR HG1 1 1 20 16319 1 1 25 THR HG21 H -3.249 -12.145 2.705 1.00 . A B . 25 THR HG21 1 1 20 16320 1 1 25 THR HG22 H -1.503 -11.898 2.720 1.00 . A B . 25 THR HG22 1 1 20 16321 1 1 25 THR HG23 H -2.518 -10.954 1.630 1.00 . A B . 25 THR HG23 1 1 20 16322 1 1 25 THR N N -1.581 -8.340 4.676 1.00 . A B . 25 THR N 1 1 20 16323 1 1 25 THR O O -0.820 -8.781 1.320 1.00 . A B . 25 THR O 1 1 20 16324 1 1 25 THR OG1 O -2.578 -10.953 4.975 1.00 . A B . 25 THR OG1 1 1 20 16325 1 1 26 CYS C C -1.656 -6.045 0.496 1.00 . A B . 26 CYS C 1 1 20 16326 1 1 26 CYS CA C -2.842 -6.953 0.849 1.00 . A B . 26 CYS CA 1 1 20 16327 1 1 26 CYS CB C -4.141 -6.139 0.938 1.00 . A B . 26 CYS CB 1 1 20 16328 1 1 26 CYS H H -3.176 -7.478 2.875 1.00 . A B . 26 CYS H 1 1 20 16329 1 1 26 CYS HA H -2.949 -7.695 0.071 1.00 . A B . 26 CYS HA 1 1 20 16330 1 1 26 CYS HB2 H -4.052 -5.418 1.732 1.00 . A B . 26 CYS HB2 1 1 20 16331 1 1 26 CYS HB3 H -4.300 -5.625 0.002 1.00 . A B . 26 CYS HB3 1 1 20 16332 1 1 26 CYS N N -2.606 -7.666 2.102 1.00 . A B . 26 CYS N 1 1 20 16333 1 1 26 CYS O O -1.308 -5.889 -0.673 1.00 . A B . 26 CYS O 1 1 20 16334 1 1 26 CYS SG S -5.610 -7.139 1.275 1.00 . A B . 26 CYS SG 1 1 20 16335 1 1 27 SER C C 1.346 -5.414 0.914 1.00 . A B . 27 SER C 1 1 20 16336 1 1 27 SER CA C 0.125 -4.602 1.336 1.00 . A B . 27 SER CA 1 1 20 16337 1 1 27 SER CB C 0.424 -3.842 2.633 1.00 . A B . 27 SER CB 1 1 20 16338 1 1 27 SER H H -1.372 -5.627 2.430 1.00 . A B . 27 SER H 1 1 20 16339 1 1 27 SER HA H -0.110 -3.893 0.555 1.00 . A B . 27 SER HA 1 1 20 16340 1 1 27 SER HB2 H -0.439 -3.266 2.920 1.00 . A B . 27 SER HB2 1 1 20 16341 1 1 27 SER HB3 H 0.658 -4.549 3.415 1.00 . A B . 27 SER HB3 1 1 20 16342 1 1 27 SER HG H 1.303 -2.289 1.823 1.00 . A B . 27 SER HG 1 1 20 16343 1 1 27 SER N N -1.034 -5.469 1.519 1.00 . A B . 27 SER N 1 1 20 16344 1 1 27 SER O O 2.177 -4.946 0.147 1.00 . A B . 27 SER O 1 1 20 16345 1 1 27 SER OG O 1.522 -2.960 2.478 1.00 . A B . 27 SER OG 1 1 20 16346 1 1 28 ARG C C 2.451 -8.049 -0.328 1.00 . A B . 28 ARG C 1 1 20 16347 1 1 28 ARG CA C 2.558 -7.512 1.096 1.00 . A B . 28 ARG CA 1 1 20 16348 1 1 28 ARG CB C 2.622 -8.670 2.095 1.00 . A B . 28 ARG CB 1 1 20 16349 1 1 28 ARG CD C 2.842 -9.287 4.535 1.00 . A B . 28 ARG CD 1 1 20 16350 1 1 28 ARG CG C 3.198 -8.278 3.449 1.00 . A B . 28 ARG CG 1 1 20 16351 1 1 28 ARG CZ C 2.831 -11.732 4.881 1.00 . A B . 28 ARG CZ 1 1 20 16352 1 1 28 ARG H H 0.731 -6.966 2.009 1.00 . A B . 28 ARG H 1 1 20 16353 1 1 28 ARG HA H 3.462 -6.929 1.178 1.00 . A B . 28 ARG HA 1 1 20 16354 1 1 28 ARG HB2 H 1.623 -9.051 2.249 1.00 . A B . 28 ARG HB2 1 1 20 16355 1 1 28 ARG HB3 H 3.235 -9.455 1.680 1.00 . A B . 28 ARG HB3 1 1 20 16356 1 1 28 ARG HD2 H 3.399 -9.045 5.427 1.00 . A B . 28 ARG HD2 1 1 20 16357 1 1 28 ARG HD3 H 1.785 -9.212 4.746 1.00 . A B . 28 ARG HD3 1 1 20 16358 1 1 28 ARG HE H 3.621 -10.800 3.293 1.00 . A B . 28 ARG HE 1 1 20 16359 1 1 28 ARG HG2 H 4.272 -8.223 3.367 1.00 . A B . 28 ARG HG2 1 1 20 16360 1 1 28 ARG HG3 H 2.808 -7.311 3.728 1.00 . A B . 28 ARG HG3 1 1 20 16361 1 1 28 ARG HH11 H 1.955 -10.662 6.363 1.00 . A B . 28 ARG HH11 1 1 20 16362 1 1 28 ARG HH12 H 1.960 -12.381 6.590 1.00 . A B . 28 ARG HH12 1 1 20 16363 1 1 28 ARG HH21 H 3.636 -13.067 3.588 1.00 . A B . 28 ARG HH21 1 1 20 16364 1 1 28 ARG HH22 H 2.912 -13.753 5.011 1.00 . A B . 28 ARG HH22 1 1 20 16365 1 1 28 ARG N N 1.436 -6.639 1.413 1.00 . A B . 28 ARG N 1 1 20 16366 1 1 28 ARG NE N 3.151 -10.664 4.147 1.00 . A B . 28 ARG NE 1 1 20 16367 1 1 28 ARG NH1 N 2.197 -11.581 6.035 1.00 . A B . 28 ARG NH1 1 1 20 16368 1 1 28 ARG NH2 N 3.151 -12.947 4.460 1.00 . A B . 28 ARG NH2 1 1 20 16369 1 1 28 ARG O O 3.454 -8.408 -0.944 1.00 . A B . 28 ARG O 1 1 20 16370 1 1 29 VAL C C 1.009 -7.480 -3.221 1.00 . A B . 29 VAL C 1 1 20 16371 1 1 29 VAL CA C 1.011 -8.614 -2.193 1.00 . A B . 29 VAL CA 1 1 20 16372 1 1 29 VAL CB C -0.311 -9.408 -2.294 1.00 . A B . 29 VAL CB 1 1 20 16373 1 1 29 VAL CG1 C -0.496 -9.974 -3.691 1.00 . A B . 29 VAL CG1 1 1 20 16374 1 1 29 VAL CG2 C -0.346 -10.529 -1.269 1.00 . A B . 29 VAL CG2 1 1 20 16375 1 1 29 VAL H H 0.465 -7.827 -0.307 1.00 . A B . 29 VAL H 1 1 20 16376 1 1 29 VAL HA H 1.822 -9.285 -2.425 1.00 . A B . 29 VAL HA 1 1 20 16377 1 1 29 VAL HB H -1.130 -8.736 -2.087 1.00 . A B . 29 VAL HB 1 1 20 16378 1 1 29 VAL HG11 H -1.432 -10.509 -3.742 1.00 . A B . 29 VAL HG11 1 1 20 16379 1 1 29 VAL HG12 H 0.317 -10.650 -3.915 1.00 . A B . 29 VAL HG12 1 1 20 16380 1 1 29 VAL HG13 H -0.503 -9.169 -4.409 1.00 . A B . 29 VAL HG13 1 1 20 16381 1 1 29 VAL HG21 H 0.503 -11.181 -1.420 1.00 . A B . 29 VAL HG21 1 1 20 16382 1 1 29 VAL HG22 H -1.259 -11.095 -1.388 1.00 . A B . 29 VAL HG22 1 1 20 16383 1 1 29 VAL HG23 H -0.307 -10.112 -0.275 1.00 . A B . 29 VAL HG23 1 1 20 16384 1 1 29 VAL N N 1.233 -8.109 -0.846 1.00 . A B . 29 VAL N 1 1 20 16385 1 1 29 VAL O O 1.631 -7.592 -4.275 1.00 . A B . 29 VAL O 1 1 20 16386 1 1 30 PHE C C 0.789 -3.997 -3.238 1.00 . A B . 30 PHE C 1 1 20 16387 1 1 30 PHE CA C 0.208 -5.271 -3.842 1.00 . A B . 30 PHE CA 1 1 20 16388 1 1 30 PHE CB C -1.263 -5.017 -4.205 1.00 . A B . 30 PHE CB 1 1 20 16389 1 1 30 PHE CD1 C -1.791 -6.856 -5.846 1.00 . A B . 30 PHE CD1 1 1 20 16390 1 1 30 PHE CD2 C -3.016 -6.764 -3.801 1.00 . A B . 30 PHE CD2 1 1 20 16391 1 1 30 PHE CE1 C -2.512 -7.971 -6.227 1.00 . A B . 30 PHE CE1 1 1 20 16392 1 1 30 PHE CE2 C -3.738 -7.877 -4.178 1.00 . A B . 30 PHE CE2 1 1 20 16393 1 1 30 PHE CG C -2.034 -6.240 -4.627 1.00 . A B . 30 PHE CG 1 1 20 16394 1 1 30 PHE CZ C -3.486 -8.482 -5.392 1.00 . A B . 30 PHE CZ 1 1 20 16395 1 1 30 PHE H H -0.084 -6.311 -2.016 1.00 . A B . 30 PHE H 1 1 20 16396 1 1 30 PHE HA H 0.760 -5.522 -4.737 1.00 . A B . 30 PHE HA 1 1 20 16397 1 1 30 PHE HB2 H -1.764 -4.600 -3.344 1.00 . A B . 30 PHE HB2 1 1 20 16398 1 1 30 PHE HB3 H -1.305 -4.301 -5.015 1.00 . A B . 30 PHE HB3 1 1 20 16399 1 1 30 PHE HD1 H -1.030 -6.459 -6.502 1.00 . A B . 30 PHE HD1 1 1 20 16400 1 1 30 PHE HD2 H -3.218 -6.290 -2.850 1.00 . A B . 30 PHE HD2 1 1 20 16401 1 1 30 PHE HE1 H -2.316 -8.441 -7.178 1.00 . A B . 30 PHE HE1 1 1 20 16402 1 1 30 PHE HE2 H -4.500 -8.274 -3.523 1.00 . A B . 30 PHE HE2 1 1 20 16403 1 1 30 PHE HZ H -4.050 -9.353 -5.690 1.00 . A B . 30 PHE HZ 1 1 20 16404 1 1 30 PHE N N 0.332 -6.382 -2.905 1.00 . A B . 30 PHE N 1 1 20 16405 1 1 30 PHE O O 0.115 -2.970 -3.185 1.00 . A B . 30 PHE O 1 1 20 16406 1 1 31 HIS C C 2.725 -1.699 -2.994 1.00 . A B . 31 HIS C 1 1 20 16407 1 1 31 HIS CA C 2.662 -2.934 -2.100 1.00 . A B . 31 HIS CA 1 1 20 16408 1 1 31 HIS CB C 4.070 -3.320 -1.628 1.00 . A B . 31 HIS CB 1 1 20 16409 1 1 31 HIS CD2 C 5.814 -1.438 -1.234 1.00 . A B . 31 HIS CD2 1 1 20 16410 1 1 31 HIS CE1 C 5.381 -0.955 0.829 1.00 . A B . 31 HIS CE1 1 1 20 16411 1 1 31 HIS CG C 4.790 -2.246 -0.856 1.00 . A B . 31 HIS CG 1 1 20 16412 1 1 31 HIS H H 2.541 -4.895 -2.898 1.00 . A B . 31 HIS H 1 1 20 16413 1 1 31 HIS HA H 2.059 -2.703 -1.236 1.00 . A B . 31 HIS HA 1 1 20 16414 1 1 31 HIS HB2 H 3.997 -4.189 -0.988 1.00 . A B . 31 HIS HB2 1 1 20 16415 1 1 31 HIS HB3 H 4.670 -3.568 -2.491 1.00 . A B . 31 HIS HB3 1 1 20 16416 1 1 31 HIS HD1 H 3.845 -2.350 1.027 1.00 . A B . 31 HIS HD1 1 1 20 16417 1 1 31 HIS HD2 H 6.267 -1.412 -2.213 1.00 . A B . 31 HIS HD2 1 1 20 16418 1 1 31 HIS HE1 H 5.410 -0.504 1.811 1.00 . A B . 31 HIS HE1 1 1 20 16419 1 1 31 HIS N N 2.034 -4.064 -2.784 1.00 . A B . 31 HIS N 1 1 20 16420 1 1 31 HIS ND1 N 4.526 -1.928 0.458 1.00 . A B . 31 HIS ND1 1 1 20 16421 1 1 31 HIS NE2 N 6.185 -0.623 -0.165 1.00 . A B . 31 HIS NE2 1 1 20 16422 1 1 31 HIS O O 2.261 -0.635 -2.608 1.00 . A B . 31 HIS O 1 1 20 16423 1 1 32 GLU C C 2.164 -0.080 -5.520 1.00 . A B . 32 GLU C 1 1 20 16424 1 1 32 GLU CA C 3.475 -0.725 -5.094 1.00 . A B . 32 GLU CA 1 1 20 16425 1 1 32 GLU CB C 4.252 -1.167 -6.334 1.00 . A B . 32 GLU CB 1 1 20 16426 1 1 32 GLU CD C 6.342 -2.189 -7.284 1.00 . A B . 32 GLU CD 1 1 20 16427 1 1 32 GLU CG C 5.645 -1.694 -6.038 1.00 . A B . 32 GLU CG 1 1 20 16428 1 1 32 GLU H H 3.412 -2.770 -4.525 1.00 . A B . 32 GLU H 1 1 20 16429 1 1 32 GLU HA H 4.059 0.003 -4.552 1.00 . A B . 32 GLU HA 1 1 20 16430 1 1 32 GLU HB2 H 3.696 -1.948 -6.830 1.00 . A B . 32 GLU HB2 1 1 20 16431 1 1 32 GLU HB3 H 4.345 -0.325 -7.003 1.00 . A B . 32 GLU HB3 1 1 20 16432 1 1 32 GLU HG2 H 6.234 -0.898 -5.607 1.00 . A B . 32 GLU HG2 1 1 20 16433 1 1 32 GLU HG3 H 5.572 -2.510 -5.335 1.00 . A B . 32 GLU HG3 1 1 20 16434 1 1 32 GLU N N 3.230 -1.862 -4.207 1.00 . A B . 32 GLU N 1 1 20 16435 1 1 32 GLU O O 2.030 1.143 -5.520 1.00 . A B . 32 GLU O 1 1 20 16436 1 1 32 GLU OE1 O 6.126 -3.357 -7.666 1.00 . A B . 32 GLU OE1 1 1 20 16437 1 1 32 GLU OE2 O 7.115 -1.416 -7.886 1.00 . A B . 32 GLU OE2 1 1 20 16438 1 1 33 ASP C C -0.906 0.125 -5.182 1.00 . A B . 33 ASP C 1 1 20 16439 1 1 33 ASP CA C -0.092 -0.453 -6.337 1.00 . A B . 33 ASP CA 1 1 20 16440 1 1 33 ASP CB C -0.851 -1.595 -7.019 1.00 . A B . 33 ASP CB 1 1 20 16441 1 1 33 ASP CG C -2.012 -1.103 -7.863 1.00 . A B . 33 ASP CG 1 1 20 16442 1 1 33 ASP H H 1.375 -1.882 -5.805 1.00 . A B . 33 ASP H 1 1 20 16443 1 1 33 ASP HA H 0.085 0.332 -7.060 1.00 . A B . 33 ASP HA 1 1 20 16444 1 1 33 ASP HB2 H -0.172 -2.140 -7.659 1.00 . A B . 33 ASP HB2 1 1 20 16445 1 1 33 ASP HB3 H -1.234 -2.262 -6.262 1.00 . A B . 33 ASP HB3 1 1 20 16446 1 1 33 ASP N N 1.203 -0.918 -5.865 1.00 . A B . 33 ASP N 1 1 20 16447 1 1 33 ASP O O -1.807 0.934 -5.388 1.00 . A B . 33 ASP O 1 1 20 16448 1 1 33 ASP OD1 O -1.769 -0.353 -8.832 1.00 . A B . 33 ASP OD1 1 1 20 16449 1 1 33 ASP OD2 O -3.168 -1.483 -7.584 1.00 . A B . 33 ASP OD2 1 1 20 16450 1 1 34 CYS C C -0.990 1.663 -2.522 1.00 . A B . 34 CYS C 1 1 20 16451 1 1 34 CYS CA C -1.263 0.182 -2.762 1.00 . A B . 34 CYS CA 1 1 20 16452 1 1 34 CYS CB C -0.825 -0.620 -1.528 1.00 . A B . 34 CYS CB 1 1 20 16453 1 1 34 CYS H H 0.151 -0.951 -3.869 1.00 . A B . 34 CYS H 1 1 20 16454 1 1 34 CYS HA H -2.321 0.051 -2.913 1.00 . A B . 34 CYS HA 1 1 20 16455 1 1 34 CYS HB2 H -0.936 -1.680 -1.722 1.00 . A B . 34 CYS HB2 1 1 20 16456 1 1 34 CYS HB3 H 0.216 -0.410 -1.327 1.00 . A B . 34 CYS HB3 1 1 20 16457 1 1 34 CYS N N -0.574 -0.296 -3.965 1.00 . A B . 34 CYS N 1 1 20 16458 1 1 34 CYS O O -1.777 2.355 -1.878 1.00 . A B . 34 CYS O 1 1 20 16459 1 1 34 CYS SG S -1.762 -0.228 -0.013 1.00 . A B . 34 CYS SG 1 1 20 16460 1 1 35 HIS C C -0.126 4.423 -3.942 1.00 . A B . 35 HIS C 1 1 20 16461 1 1 35 HIS CA C 0.495 3.546 -2.858 1.00 . A B . 35 HIS CA 1 1 20 16462 1 1 35 HIS CB C 2.019 3.708 -2.879 1.00 . A B . 35 HIS CB 1 1 20 16463 1 1 35 HIS CD2 C 3.222 1.776 -1.648 1.00 . A B . 35 HIS CD2 1 1 20 16464 1 1 35 HIS CE1 C 3.592 2.721 0.256 1.00 . A B . 35 HIS CE1 1 1 20 16465 1 1 35 HIS CG C 2.724 3.032 -1.738 1.00 . A B . 35 HIS CG 1 1 20 16466 1 1 35 HIS H H 0.704 1.566 -3.578 1.00 . A B . 35 HIS H 1 1 20 16467 1 1 35 HIS HA H 0.122 3.860 -1.892 1.00 . A B . 35 HIS HA 1 1 20 16468 1 1 35 HIS HB2 H 2.400 3.286 -3.798 1.00 . A B . 35 HIS HB2 1 1 20 16469 1 1 35 HIS HB3 H 2.258 4.762 -2.845 1.00 . A B . 35 HIS HB3 1 1 20 16470 1 1 35 HIS HD1 H 2.682 4.521 -0.244 1.00 . A B . 35 HIS HD1 1 1 20 16471 1 1 35 HIS HD2 H 3.212 1.036 -2.433 1.00 . A B . 35 HIS HD2 1 1 20 16472 1 1 35 HIS HE1 H 3.915 2.910 1.269 1.00 . A B . 35 HIS HE1 1 1 20 16473 1 1 35 HIS N N 0.123 2.153 -3.047 1.00 . A B . 35 HIS N 1 1 20 16474 1 1 35 HIS ND1 N 2.963 3.621 -0.517 1.00 . A B . 35 HIS ND1 1 1 20 16475 1 1 35 HIS NE2 N 3.771 1.578 -0.386 1.00 . A B . 35 HIS NE2 1 1 20 16476 1 1 35 HIS O O 0.033 5.642 -3.932 1.00 . A B . 35 HIS O 1 1 20 16477 1 1 36 ILE C C -2.827 4.129 -6.288 1.00 . A B . 36 ILE C 1 1 20 16478 1 1 36 ILE CA C -1.362 4.501 -6.037 1.00 . A B . 36 ILE CA 1 1 20 16479 1 1 36 ILE CB C -0.545 4.157 -7.304 1.00 . A B . 36 ILE CB 1 1 20 16480 1 1 36 ILE CD1 C 1.833 3.909 -8.199 1.00 . A B . 36 ILE CD1 1 1 20 16481 1 1 36 ILE CG1 C 0.953 4.376 -7.059 1.00 . A B . 36 ILE CG1 1 1 20 16482 1 1 36 ILE CG2 C -1.020 4.991 -8.484 1.00 . A B . 36 ILE CG2 1 1 20 16483 1 1 36 ILE H H -1.002 2.835 -4.787 1.00 . A B . 36 ILE H 1 1 20 16484 1 1 36 ILE HA H -1.281 5.557 -5.855 1.00 . A B . 36 ILE HA 1 1 20 16485 1 1 36 ILE HB H -0.715 3.117 -7.537 1.00 . A B . 36 ILE HB 1 1 20 16486 1 1 36 ILE HD11 H 1.556 4.427 -9.105 1.00 . A B . 36 ILE HD11 1 1 20 16487 1 1 36 ILE HD12 H 1.707 2.845 -8.340 1.00 . A B . 36 ILE HD12 1 1 20 16488 1 1 36 ILE HD13 H 2.867 4.120 -7.966 1.00 . A B . 36 ILE HD13 1 1 20 16489 1 1 36 ILE HG12 H 1.136 5.429 -6.909 1.00 . A B . 36 ILE HG12 1 1 20 16490 1 1 36 ILE HG13 H 1.243 3.836 -6.170 1.00 . A B . 36 ILE HG13 1 1 20 16491 1 1 36 ILE HG21 H -2.062 4.782 -8.673 1.00 . A B . 36 ILE HG21 1 1 20 16492 1 1 36 ILE HG22 H -0.439 4.741 -9.359 1.00 . A B . 36 ILE HG22 1 1 20 16493 1 1 36 ILE HG23 H -0.898 6.039 -8.258 1.00 . A B . 36 ILE HG23 1 1 20 16494 1 1 36 ILE N N -0.831 3.796 -4.879 1.00 . A B . 36 ILE N 1 1 20 16495 1 1 36 ILE O O -3.117 2.996 -6.668 1.00 . A B . 36 ILE O 1 1 20 16496 1 1 37 PRO C C -3.714 6.509 -4.075 1.00 . A B . 37 PRO C 1 1 20 16497 1 1 37 PRO CA C -3.536 6.411 -5.592 1.00 . A B . 37 PRO CA 1 1 20 16498 1 1 37 PRO CB C -4.622 7.211 -6.311 1.00 . A B . 37 PRO CB 1 1 20 16499 1 1 37 PRO CD C -5.212 4.861 -6.384 1.00 . A B . 37 PRO CD 1 1 20 16500 1 1 37 PRO CG C -5.780 6.267 -6.423 1.00 . A B . 37 PRO CG 1 1 20 16501 1 1 37 PRO HA H -2.561 6.780 -5.871 1.00 . A B . 37 PRO HA 1 1 20 16502 1 1 37 PRO HB2 H -4.878 8.086 -5.722 1.00 . A B . 37 PRO HB2 1 1 20 16503 1 1 37 PRO HB3 H -4.269 7.517 -7.289 1.00 . A B . 37 PRO HB3 1 1 20 16504 1 1 37 PRO HD2 H -5.685 4.283 -5.603 1.00 . A B . 37 PRO HD2 1 1 20 16505 1 1 37 PRO HD3 H -5.343 4.376 -7.341 1.00 . A B . 37 PRO HD3 1 1 20 16506 1 1 37 PRO HG2 H -6.453 6.419 -5.591 1.00 . A B . 37 PRO HG2 1 1 20 16507 1 1 37 PRO HG3 H -6.298 6.435 -7.356 1.00 . A B . 37 PRO HG3 1 1 20 16508 1 1 37 PRO N N -3.782 5.060 -6.093 1.00 . A B . 37 PRO N 1 1 20 16509 1 1 37 PRO O O -4.581 5.850 -3.493 1.00 . A B . 37 PRO O 1 1 20 16510 1 1 38 PRO C C -4.167 8.372 -1.555 1.00 . A B . 38 PRO C 1 1 20 16511 1 1 38 PRO CA C -2.973 7.512 -1.965 1.00 . A B . 38 PRO CA 1 1 20 16512 1 1 38 PRO CB C -1.660 8.217 -1.626 1.00 . A B . 38 PRO CB 1 1 20 16513 1 1 38 PRO CD C -1.838 8.164 -4.019 1.00 . A B . 38 PRO CD 1 1 20 16514 1 1 38 PRO CG C -1.327 8.987 -2.859 1.00 . A B . 38 PRO CG 1 1 20 16515 1 1 38 PRO HA H -3.019 6.564 -1.453 1.00 . A B . 38 PRO HA 1 1 20 16516 1 1 38 PRO HB2 H -1.807 8.868 -0.775 1.00 . A B . 38 PRO HB2 1 1 20 16517 1 1 38 PRO HB3 H -0.901 7.483 -1.398 1.00 . A B . 38 PRO HB3 1 1 20 16518 1 1 38 PRO HD2 H -2.248 8.804 -4.788 1.00 . A B . 38 PRO HD2 1 1 20 16519 1 1 38 PRO HD3 H -1.048 7.545 -4.424 1.00 . A B . 38 PRO HD3 1 1 20 16520 1 1 38 PRO HG2 H -1.823 9.947 -2.832 1.00 . A B . 38 PRO HG2 1 1 20 16521 1 1 38 PRO HG3 H -0.257 9.119 -2.934 1.00 . A B . 38 PRO HG3 1 1 20 16522 1 1 38 PRO N N -2.896 7.333 -3.412 1.00 . A B . 38 PRO N 1 1 20 16523 1 1 38 PRO O O -4.455 9.389 -2.188 1.00 . A B . 38 PRO O 1 1 20 16524 1 1 39 VAL C C -5.352 9.967 0.753 1.00 . A B . 39 VAL C 1 1 20 16525 1 1 39 VAL CA C -5.949 8.743 0.061 1.00 . A B . 39 VAL CA 1 1 20 16526 1 1 39 VAL CB C -6.781 7.925 1.073 1.00 . A B . 39 VAL CB 1 1 20 16527 1 1 39 VAL CG1 C -7.950 8.738 1.598 1.00 . A B . 39 VAL CG1 1 1 20 16528 1 1 39 VAL CG2 C -7.274 6.629 0.448 1.00 . A B . 39 VAL CG2 1 1 20 16529 1 1 39 VAL H H -4.648 7.085 -0.108 1.00 . A B . 39 VAL H 1 1 20 16530 1 1 39 VAL HA H -6.592 9.065 -0.741 1.00 . A B . 39 VAL HA 1 1 20 16531 1 1 39 VAL HB H -6.144 7.676 1.905 1.00 . A B . 39 VAL HB 1 1 20 16532 1 1 39 VAL HG11 H -8.506 8.149 2.312 1.00 . A B . 39 VAL HG11 1 1 20 16533 1 1 39 VAL HG12 H -8.595 9.012 0.777 1.00 . A B . 39 VAL HG12 1 1 20 16534 1 1 39 VAL HG13 H -7.579 9.630 2.078 1.00 . A B . 39 VAL HG13 1 1 20 16535 1 1 39 VAL HG21 H -6.433 5.998 0.209 1.00 . A B . 39 VAL HG21 1 1 20 16536 1 1 39 VAL HG22 H -7.824 6.853 -0.454 1.00 . A B . 39 VAL HG22 1 1 20 16537 1 1 39 VAL HG23 H -7.921 6.118 1.146 1.00 . A B . 39 VAL HG23 1 1 20 16538 1 1 39 VAL N N -4.868 7.950 -0.510 1.00 . A B . 39 VAL N 1 1 20 16539 1 1 39 VAL O O -4.865 9.881 1.880 1.00 . A B . 39 VAL O 1 1 20 16540 1 1 40 GLU C C -5.165 12.980 1.685 1.00 . A B . 40 GLU C 1 1 20 16541 1 1 40 GLU CA C -4.603 12.260 0.460 1.00 . A B . 40 GLU CA 1 1 20 16542 1 1 40 GLU CB C -4.487 13.235 -0.714 1.00 . A B . 40 GLU CB 1 1 20 16543 1 1 40 GLU CD C -3.456 15.350 -1.616 1.00 . A B . 40 GLU CD 1 1 20 16544 1 1 40 GLU CG C -3.624 14.449 -0.416 1.00 . A B . 40 GLU CG 1 1 20 16545 1 1 40 GLU H H -5.968 11.156 -0.723 1.00 . A B . 40 GLU H 1 1 20 16546 1 1 40 GLU HA H -3.615 11.903 0.704 1.00 . A B . 40 GLU HA 1 1 20 16547 1 1 40 GLU HB2 H -4.058 12.716 -1.560 1.00 . A B . 40 GLU HB2 1 1 20 16548 1 1 40 GLU HB3 H -5.474 13.582 -0.981 1.00 . A B . 40 GLU HB3 1 1 20 16549 1 1 40 GLU HG2 H -4.088 15.015 0.378 1.00 . A B . 40 GLU HG2 1 1 20 16550 1 1 40 GLU HG3 H -2.649 14.116 -0.094 1.00 . A B . 40 GLU HG3 1 1 20 16551 1 1 40 GLU N N -5.391 11.098 0.068 1.00 . A B . 40 GLU N 1 1 20 16552 1 1 40 GLU O O -4.415 13.321 2.601 1.00 . A B . 40 GLU O 1 1 20 16553 1 1 40 GLU OE1 O -2.553 15.086 -2.440 1.00 . A B . 40 GLU OE1 1 1 20 16554 1 1 40 GLU OE2 O -4.221 16.327 -1.742 1.00 . A B . 40 GLU OE2 1 1 20 16555 1 1 41 ALA C C -7.442 13.181 3.975 1.00 . A B . 41 ALA C 1 1 20 16556 1 1 41 ALA CA C -7.068 14.021 2.762 1.00 . A B . 41 ALA CA 1 1 20 16557 1 1 41 ALA CB C -8.284 14.765 2.233 1.00 . A B . 41 ALA CB 1 1 20 16558 1 1 41 ALA H H -7.040 12.828 1.012 1.00 . A B . 41 ALA H 1 1 20 16559 1 1 41 ALA HA H -6.339 14.754 3.065 1.00 . A B . 41 ALA HA 1 1 20 16560 1 1 41 ALA HB1 H -9.042 14.056 1.935 1.00 . A B . 41 ALA HB1 1 1 20 16561 1 1 41 ALA HB2 H -7.998 15.363 1.382 1.00 . A B . 41 ALA HB2 1 1 20 16562 1 1 41 ALA HB3 H -8.677 15.406 3.007 1.00 . A B . 41 ALA HB3 1 1 20 16563 1 1 41 ALA N N -6.467 13.213 1.708 1.00 . A B . 41 ALA N 1 1 20 16564 1 1 41 ALA O O -6.962 13.432 5.082 1.00 . A B . 41 ALA O 1 1 20 16565 1 1 42 GLU C C -7.709 10.552 5.524 1.00 . A B . 42 GLU C 1 1 20 16566 1 1 42 GLU CA C -8.807 11.375 4.859 1.00 . A B . 42 GLU CA 1 1 20 16567 1 1 42 GLU CB C -9.928 10.464 4.359 1.00 . A B . 42 GLU CB 1 1 20 16568 1 1 42 GLU CD C -11.855 11.905 5.111 1.00 . A B . 42 GLU CD 1 1 20 16569 1 1 42 GLU CG C -11.177 11.222 3.941 1.00 . A B . 42 GLU CG 1 1 20 16570 1 1 42 GLU H H -8.553 11.972 2.843 1.00 . A B . 42 GLU H 1 1 20 16571 1 1 42 GLU HA H -9.216 12.055 5.590 1.00 . A B . 42 GLU HA 1 1 20 16572 1 1 42 GLU HB2 H -9.572 9.900 3.509 1.00 . A B . 42 GLU HB2 1 1 20 16573 1 1 42 GLU HB3 H -10.198 9.777 5.148 1.00 . A B . 42 GLU HB3 1 1 20 16574 1 1 42 GLU HG2 H -10.901 11.974 3.217 1.00 . A B . 42 GLU HG2 1 1 20 16575 1 1 42 GLU HG3 H -11.873 10.529 3.494 1.00 . A B . 42 GLU HG3 1 1 20 16576 1 1 42 GLU N N -8.281 12.178 3.761 1.00 . A B . 42 GLU N 1 1 20 16577 1 1 42 GLU O O -7.646 10.481 6.751 1.00 . A B . 42 GLU O 1 1 20 16578 1 1 42 GLU OE1 O -11.522 13.073 5.404 1.00 . A B . 42 GLU OE1 1 1 20 16579 1 1 42 GLU OE2 O -12.720 11.270 5.751 1.00 . A B . 42 GLU OE2 1 1 20 16580 1 1 43 ARG C C -6.203 8.156 6.285 1.00 . A B . 43 ARG C 1 1 20 16581 1 1 43 ARG CA C -5.737 9.125 5.199 1.00 . A B . 43 ARG CA 1 1 20 16582 1 1 43 ARG CB C -4.592 9.994 5.727 1.00 . A B . 43 ARG CB 1 1 20 16583 1 1 43 ARG CD C -2.681 11.521 5.157 1.00 . A B . 43 ARG CD 1 1 20 16584 1 1 43 ARG CG C -3.979 10.899 4.672 1.00 . A B . 43 ARG CG 1 1 20 16585 1 1 43 ARG CZ C -0.793 12.791 4.186 1.00 . A B . 43 ARG CZ 1 1 20 16586 1 1 43 ARG H H -6.943 10.082 3.743 1.00 . A B . 43 ARG H 1 1 20 16587 1 1 43 ARG HA H -5.372 8.547 4.363 1.00 . A B . 43 ARG HA 1 1 20 16588 1 1 43 ARG HB2 H -4.968 10.614 6.528 1.00 . A B . 43 ARG HB2 1 1 20 16589 1 1 43 ARG HB3 H -3.816 9.351 6.114 1.00 . A B . 43 ARG HB3 1 1 20 16590 1 1 43 ARG HD2 H -2.887 12.131 6.023 1.00 . A B . 43 ARG HD2 1 1 20 16591 1 1 43 ARG HD3 H -2.000 10.727 5.430 1.00 . A B . 43 ARG HD3 1 1 20 16592 1 1 43 ARG HE H -2.603 12.586 3.347 1.00 . A B . 43 ARG HE 1 1 20 16593 1 1 43 ARG HG2 H -3.779 10.318 3.785 1.00 . A B . 43 ARG HG2 1 1 20 16594 1 1 43 ARG HG3 H -4.679 11.689 4.437 1.00 . A B . 43 ARG HG3 1 1 20 16595 1 1 43 ARG HH11 H -0.404 11.963 5.998 1.00 . A B . 43 ARG HH11 1 1 20 16596 1 1 43 ARG HH12 H 0.910 12.840 5.284 1.00 . A B . 43 ARG HH12 1 1 20 16597 1 1 43 ARG HH21 H -0.859 13.736 2.392 1.00 . A B . 43 ARG HH21 1 1 20 16598 1 1 43 ARG HH22 H 0.651 13.860 3.236 1.00 . A B . 43 ARG HH22 1 1 20 16599 1 1 43 ARG N N -6.842 9.953 4.708 1.00 . A B . 43 ARG N 1 1 20 16600 1 1 43 ARG NE N -2.053 12.351 4.128 1.00 . A B . 43 ARG NE 1 1 20 16601 1 1 43 ARG NH1 N -0.035 12.508 5.240 1.00 . A B . 43 ARG NH1 1 1 20 16602 1 1 43 ARG NH2 N -0.295 13.518 3.191 1.00 . A B . 43 ARG NH2 1 1 20 16603 1 1 43 ARG O O -5.808 8.262 7.448 1.00 . A B . 43 ARG O 1 1 20 16604 1 1 44 THR C C -6.935 4.907 6.722 1.00 . A B . 44 THR C 1 1 20 16605 1 1 44 THR CA C -7.616 6.271 6.842 1.00 . A B . 44 THR CA 1 1 20 16606 1 1 44 THR CB C -9.130 6.120 6.610 1.00 . A B . 44 THR CB 1 1 20 16607 1 1 44 THR CG2 C -9.861 7.405 6.976 1.00 . A B . 44 THR CG2 1 1 20 16608 1 1 44 THR H H -7.307 7.167 4.958 1.00 . A B . 44 THR H 1 1 20 16609 1 1 44 THR HA H -7.463 6.659 7.837 1.00 . A B . 44 THR HA 1 1 20 16610 1 1 44 THR HB H -9.500 5.319 7.234 1.00 . A B . 44 THR HB 1 1 20 16611 1 1 44 THR HG1 H -8.776 5.101 4.956 1.00 . A B . 44 THR HG1 1 1 20 16612 1 1 44 THR HG21 H -9.718 7.616 8.025 1.00 . A B . 44 THR HG21 1 1 20 16613 1 1 44 THR HG22 H -10.914 7.291 6.770 1.00 . A B . 44 THR HG22 1 1 20 16614 1 1 44 THR HG23 H -9.467 8.221 6.389 1.00 . A B . 44 THR HG23 1 1 20 16615 1 1 44 THR N N -7.052 7.221 5.901 1.00 . A B . 44 THR N 1 1 20 16616 1 1 44 THR O O -7.105 4.216 5.717 1.00 . A B . 44 THR O 1 1 20 16617 1 1 44 THR OG1 O -9.381 5.802 5.233 1.00 . A B . 44 THR OG1 1 1 20 16618 1 1 45 PRO C C -6.362 2.022 7.810 1.00 . A B . 45 PRO C 1 1 20 16619 1 1 45 PRO CA C -5.426 3.224 7.722 1.00 . A B . 45 PRO CA 1 1 20 16620 1 1 45 PRO CB C -4.520 3.286 8.963 1.00 . A B . 45 PRO CB 1 1 20 16621 1 1 45 PRO CD C -5.899 5.251 8.980 1.00 . A B . 45 PRO CD 1 1 20 16622 1 1 45 PRO CG C -4.577 4.701 9.439 1.00 . A B . 45 PRO CG 1 1 20 16623 1 1 45 PRO HA H -4.817 3.133 6.834 1.00 . A B . 45 PRO HA 1 1 20 16624 1 1 45 PRO HB2 H -4.891 2.602 9.714 1.00 . A B . 45 PRO HB2 1 1 20 16625 1 1 45 PRO HB3 H -3.513 3.007 8.686 1.00 . A B . 45 PRO HB3 1 1 20 16626 1 1 45 PRO HD2 H -6.668 5.058 9.715 1.00 . A B . 45 PRO HD2 1 1 20 16627 1 1 45 PRO HD3 H -5.820 6.310 8.780 1.00 . A B . 45 PRO HD3 1 1 20 16628 1 1 45 PRO HG2 H -4.516 4.728 10.517 1.00 . A B . 45 PRO HG2 1 1 20 16629 1 1 45 PRO HG3 H -3.767 5.266 9.003 1.00 . A B . 45 PRO HG3 1 1 20 16630 1 1 45 PRO N N -6.152 4.501 7.741 1.00 . A B . 45 PRO N 1 1 20 16631 1 1 45 PRO O O -5.993 0.904 7.457 1.00 . A B . 45 PRO O 1 1 20 16632 1 1 46 TRP C C -9.493 1.202 7.164 1.00 . A B . 46 TRP C 1 1 20 16633 1 1 46 TRP CA C -8.578 1.208 8.386 1.00 . A B . 46 TRP CA 1 1 20 16634 1 1 46 TRP CB C -9.394 1.377 9.675 1.00 . A B . 46 TRP CB 1 1 20 16635 1 1 46 TRP CD1 C -11.065 3.301 9.372 1.00 . A B . 46 TRP CD1 1 1 20 16636 1 1 46 TRP CD2 C -9.325 3.799 10.689 1.00 . A B . 46 TRP CD2 1 1 20 16637 1 1 46 TRP CE2 C -10.164 4.928 10.603 1.00 . A B . 46 TRP CE2 1 1 20 16638 1 1 46 TRP CE3 C -8.167 3.881 11.465 1.00 . A B . 46 TRP CE3 1 1 20 16639 1 1 46 TRP CG C -9.921 2.768 9.890 1.00 . A B . 46 TRP CG 1 1 20 16640 1 1 46 TRP CH2 C -8.739 6.169 12.016 1.00 . A B . 46 TRP CH2 1 1 20 16641 1 1 46 TRP CZ2 C -9.880 6.118 11.263 1.00 . A B . 46 TRP CZ2 1 1 20 16642 1 1 46 TRP CZ3 C -7.887 5.065 12.121 1.00 . A B . 46 TRP CZ3 1 1 20 16643 1 1 46 TRP H H -7.814 3.172 8.540 1.00 . A B . 46 TRP H 1 1 20 16644 1 1 46 TRP HA H -8.053 0.262 8.425 1.00 . A B . 46 TRP HA 1 1 20 16645 1 1 46 TRP HB2 H -10.242 0.709 9.641 1.00 . A B . 46 TRP HB2 1 1 20 16646 1 1 46 TRP HB3 H -8.775 1.119 10.522 1.00 . A B . 46 TRP HB3 1 1 20 16647 1 1 46 TRP HD1 H -11.743 2.768 8.723 1.00 . A B . 46 TRP HD1 1 1 20 16648 1 1 46 TRP HE1 H -11.965 5.189 9.556 1.00 . A B . 46 TRP HE1 1 1 20 16649 1 1 46 TRP HE3 H -7.497 3.040 11.558 1.00 . A B . 46 TRP HE3 1 1 20 16650 1 1 46 TRP HH2 H -8.477 7.073 12.544 1.00 . A B . 46 TRP HH2 1 1 20 16651 1 1 46 TRP HZ2 H -10.530 6.978 11.194 1.00 . A B . 46 TRP HZ2 1 1 20 16652 1 1 46 TRP HZ3 H -6.995 5.148 12.725 1.00 . A B . 46 TRP HZ3 1 1 20 16653 1 1 46 TRP N N -7.579 2.261 8.272 1.00 . A B . 46 TRP N 1 1 20 16654 1 1 46 TRP NE1 N -11.217 4.597 9.795 1.00 . A B . 46 TRP NE1 1 1 20 16655 1 1 46 TRP O O -10.713 1.076 7.279 1.00 . A B . 46 TRP O 1 1 20 16656 1 1 47 ASN C C -8.788 0.772 3.633 1.00 . A B . 47 ASN C 1 1 20 16657 1 1 47 ASN CA C -9.637 1.367 4.745 1.00 . A B . 47 ASN CA 1 1 20 16658 1 1 47 ASN CB C -10.055 2.798 4.386 1.00 . A B . 47 ASN CB 1 1 20 16659 1 1 47 ASN CG C -10.818 2.876 3.077 1.00 . A B . 47 ASN CG 1 1 20 16660 1 1 47 ASN H H -7.915 1.429 5.968 1.00 . A B . 47 ASN H 1 1 20 16661 1 1 47 ASN HA H -10.521 0.761 4.876 1.00 . A B . 47 ASN HA 1 1 20 16662 1 1 47 ASN HB2 H -10.685 3.192 5.168 1.00 . A B . 47 ASN HB2 1 1 20 16663 1 1 47 ASN HB3 H -9.171 3.412 4.300 1.00 . A B . 47 ASN HB3 1 1 20 16664 1 1 47 ASN HD21 H -10.193 4.739 2.789 1.00 . A B . 47 ASN HD21 1 1 20 16665 1 1 47 ASN HD22 H -11.223 4.096 1.562 1.00 . A B . 47 ASN HD22 1 1 20 16666 1 1 47 ASN N N -8.892 1.348 5.995 1.00 . A B . 47 ASN N 1 1 20 16667 1 1 47 ASN ND2 N -10.735 4.018 2.411 1.00 . A B . 47 ASN ND2 1 1 20 16668 1 1 47 ASN O O -8.026 1.479 2.974 1.00 . A B . 47 ASN O 1 1 20 16669 1 1 47 ASN OD1 O -11.489 1.926 2.674 1.00 . A B . 47 ASN OD1 1 1 20 16670 1 1 48 CYS C C -8.826 -1.026 1.076 1.00 . A B . 48 CYS C 1 1 20 16671 1 1 48 CYS CA C -8.153 -1.223 2.419 1.00 . A B . 48 CYS CA 1 1 20 16672 1 1 48 CYS CB C -8.067 -2.714 2.745 1.00 . A B . 48 CYS CB 1 1 20 16673 1 1 48 CYS H H -9.524 -1.043 4.016 1.00 . A B . 48 CYS H 1 1 20 16674 1 1 48 CYS HA H -7.158 -0.802 2.386 1.00 . A B . 48 CYS HA 1 1 20 16675 1 1 48 CYS HB2 H -7.544 -2.841 3.681 1.00 . A B . 48 CYS HB2 1 1 20 16676 1 1 48 CYS HB3 H -9.070 -3.105 2.850 1.00 . A B . 48 CYS HB3 1 1 20 16677 1 1 48 CYS N N -8.905 -0.534 3.451 1.00 . A B . 48 CYS N 1 1 20 16678 1 1 48 CYS O O -9.982 -1.412 0.882 1.00 . A B . 48 CYS O 1 1 20 16679 1 1 48 CYS SG S -7.218 -3.730 1.508 1.00 . A B . 48 CYS SG 1 1 20 16680 1 1 49 ILE C C -8.808 -1.434 -2.012 1.00 . A B . 49 ILE C 1 1 20 16681 1 1 49 ILE CA C -8.629 -0.170 -1.180 1.00 . A B . 49 ILE CA 1 1 20 16682 1 1 49 ILE CB C -7.767 0.855 -1.955 1.00 . A B . 49 ILE CB 1 1 20 16683 1 1 49 ILE CD1 C -5.384 1.463 -2.636 1.00 . A B . 49 ILE CD1 1 1 20 16684 1 1 49 ILE CG1 C -6.273 0.534 -1.833 1.00 . A B . 49 ILE CG1 1 1 20 16685 1 1 49 ILE CG2 C -8.054 2.267 -1.457 1.00 . A B . 49 ILE CG2 1 1 20 16686 1 1 49 ILE H H -7.168 -0.189 0.343 1.00 . A B . 49 ILE H 1 1 20 16687 1 1 49 ILE HA H -9.604 0.270 -1.033 1.00 . A B . 49 ILE HA 1 1 20 16688 1 1 49 ILE HB H -8.050 0.806 -2.996 1.00 . A B . 49 ILE HB 1 1 20 16689 1 1 49 ILE HD11 H -5.528 2.479 -2.294 1.00 . A B . 49 ILE HD11 1 1 20 16690 1 1 49 ILE HD12 H -5.640 1.395 -3.682 1.00 . A B . 49 ILE HD12 1 1 20 16691 1 1 49 ILE HD13 H -4.351 1.181 -2.497 1.00 . A B . 49 ILE HD13 1 1 20 16692 1 1 49 ILE HG12 H -5.979 0.617 -0.799 1.00 . A B . 49 ILE HG12 1 1 20 16693 1 1 49 ILE HG13 H -6.096 -0.476 -2.175 1.00 . A B . 49 ILE HG13 1 1 20 16694 1 1 49 ILE HG21 H -7.896 2.314 -0.390 1.00 . A B . 49 ILE HG21 1 1 20 16695 1 1 49 ILE HG22 H -9.079 2.529 -1.682 1.00 . A B . 49 ILE HG22 1 1 20 16696 1 1 49 ILE HG23 H -7.390 2.962 -1.949 1.00 . A B . 49 ILE HG23 1 1 20 16697 1 1 49 ILE N N -8.089 -0.457 0.137 1.00 . A B . 49 ILE N 1 1 20 16698 1 1 49 ILE O O -9.714 -1.506 -2.831 1.00 . A B . 49 ILE O 1 1 20 16699 1 1 50 PHE C C -9.191 -4.559 -2.104 1.00 . A B . 50 PHE C 1 1 20 16700 1 1 50 PHE CA C -8.045 -3.674 -2.568 1.00 . A B . 50 PHE CA 1 1 20 16701 1 1 50 PHE CB C -6.726 -4.445 -2.524 1.00 . A B . 50 PHE CB 1 1 20 16702 1 1 50 PHE CD1 C -5.512 -3.926 -4.653 1.00 . A B . 50 PHE CD1 1 1 20 16703 1 1 50 PHE CD2 C -4.757 -2.913 -2.635 1.00 . A B . 50 PHE CD2 1 1 20 16704 1 1 50 PHE CE1 C -4.525 -3.271 -5.354 1.00 . A B . 50 PHE CE1 1 1 20 16705 1 1 50 PHE CE2 C -3.767 -2.260 -3.329 1.00 . A B . 50 PHE CE2 1 1 20 16706 1 1 50 PHE CG C -5.639 -3.753 -3.284 1.00 . A B . 50 PHE CG 1 1 20 16707 1 1 50 PHE CZ C -3.649 -2.436 -4.691 1.00 . A B . 50 PHE CZ 1 1 20 16708 1 1 50 PHE H H -7.285 -2.349 -1.091 1.00 . A B . 50 PHE H 1 1 20 16709 1 1 50 PHE HA H -8.238 -3.391 -3.594 1.00 . A B . 50 PHE HA 1 1 20 16710 1 1 50 PHE HB2 H -6.404 -4.550 -1.496 1.00 . A B . 50 PHE HB2 1 1 20 16711 1 1 50 PHE HB3 H -6.869 -5.427 -2.955 1.00 . A B . 50 PHE HB3 1 1 20 16712 1 1 50 PHE HD1 H -6.197 -4.579 -5.174 1.00 . A B . 50 PHE HD1 1 1 20 16713 1 1 50 PHE HD2 H -4.847 -2.770 -1.570 1.00 . A B . 50 PHE HD2 1 1 20 16714 1 1 50 PHE HE1 H -4.434 -3.411 -6.420 1.00 . A B . 50 PHE HE1 1 1 20 16715 1 1 50 PHE HE2 H -3.085 -1.611 -2.807 1.00 . A B . 50 PHE HE2 1 1 20 16716 1 1 50 PHE HZ H -2.877 -1.920 -5.237 1.00 . A B . 50 PHE HZ 1 1 20 16717 1 1 50 PHE N N -7.964 -2.437 -1.792 1.00 . A B . 50 PHE N 1 1 20 16718 1 1 50 PHE O O -9.849 -5.203 -2.919 1.00 . A B . 50 PHE O 1 1 20 16719 1 1 51 CYS C C -11.877 -4.820 -0.730 1.00 . A B . 51 CYS C 1 1 20 16720 1 1 51 CYS CA C -10.535 -5.391 -0.279 1.00 . A B . 51 CYS CA 1 1 20 16721 1 1 51 CYS CB C -10.466 -5.506 1.248 1.00 . A B . 51 CYS CB 1 1 20 16722 1 1 51 CYS H H -8.895 -4.047 -0.192 1.00 . A B . 51 CYS H 1 1 20 16723 1 1 51 CYS HA H -10.434 -6.381 -0.705 1.00 . A B . 51 CYS HA 1 1 20 16724 1 1 51 CYS HB2 H -10.138 -4.565 1.663 1.00 . A B . 51 CYS HB2 1 1 20 16725 1 1 51 CYS HB3 H -11.451 -5.737 1.631 1.00 . A B . 51 CYS HB3 1 1 20 16726 1 1 51 CYS N N -9.442 -4.586 -0.803 1.00 . A B . 51 CYS N 1 1 20 16727 1 1 51 CYS O O -12.714 -5.545 -1.257 1.00 . A B . 51 CYS O 1 1 20 16728 1 1 51 CYS SG S -9.330 -6.791 1.834 1.00 . A B . 51 CYS SG 1 1 20 16729 1 1 52 ARG C C -13.377 -2.822 -2.528 1.00 . A B . 52 ARG C 1 1 20 16730 1 1 52 ARG CA C -13.295 -2.863 -1.000 1.00 . A B . 52 ARG CA 1 1 20 16731 1 1 52 ARG CB C -13.406 -1.445 -0.427 1.00 . A B . 52 ARG CB 1 1 20 16732 1 1 52 ARG CD C -12.451 0.871 -0.252 1.00 . A B . 52 ARG CD 1 1 20 16733 1 1 52 ARG CG C -12.350 -0.478 -0.943 1.00 . A B . 52 ARG CG 1 1 20 16734 1 1 52 ARG CZ C -14.329 2.375 0.302 1.00 . A B . 52 ARG CZ 1 1 20 16735 1 1 52 ARG H H -11.410 -2.999 -0.039 1.00 . A B . 52 ARG H 1 1 20 16736 1 1 52 ARG HA H -14.123 -3.447 -0.634 1.00 . A B . 52 ARG HA 1 1 20 16737 1 1 52 ARG HB2 H -14.376 -1.045 -0.678 1.00 . A B . 52 ARG HB2 1 1 20 16738 1 1 52 ARG HB3 H -13.318 -1.498 0.648 1.00 . A B . 52 ARG HB3 1 1 20 16739 1 1 52 ARG HD2 H -12.372 0.719 0.816 1.00 . A B . 52 ARG HD2 1 1 20 16740 1 1 52 ARG HD3 H -11.636 1.495 -0.585 1.00 . A B . 52 ARG HD3 1 1 20 16741 1 1 52 ARG HE H -14.127 1.370 -1.419 1.00 . A B . 52 ARG HE 1 1 20 16742 1 1 52 ARG HG2 H -11.371 -0.894 -0.759 1.00 . A B . 52 ARG HG2 1 1 20 16743 1 1 52 ARG HG3 H -12.491 -0.340 -2.006 1.00 . A B . 52 ARG HG3 1 1 20 16744 1 1 52 ARG HH11 H -12.939 2.196 1.771 1.00 . A B . 52 ARG HH11 1 1 20 16745 1 1 52 ARG HH12 H -14.275 3.243 2.133 1.00 . A B . 52 ARG HH12 1 1 20 16746 1 1 52 ARG HH21 H -15.870 2.769 -0.952 1.00 . A B . 52 ARG HH21 1 1 20 16747 1 1 52 ARG HH22 H -15.937 3.579 0.582 1.00 . A B . 52 ARG HH22 1 1 20 16748 1 1 52 ARG N N -12.070 -3.518 -0.544 1.00 . A B . 52 ARG N 1 1 20 16749 1 1 52 ARG NE N -13.715 1.545 -0.541 1.00 . A B . 52 ARG NE 1 1 20 16750 1 1 52 ARG NH1 N -13.807 2.628 1.495 1.00 . A B . 52 ARG NH1 1 1 20 16751 1 1 52 ARG NH2 N -15.469 2.954 -0.051 1.00 . A B . 52 ARG NH2 1 1 20 16752 1 1 52 ARG O O -14.447 -2.597 -3.094 1.00 . A B . 52 ARG O 1 1 20 16753 1 1 53 MET C C -12.861 -4.305 -5.196 1.00 . A B . 53 MET C 1 1 20 16754 1 1 53 MET CA C -12.193 -3.052 -4.648 1.00 . A B . 53 MET CA 1 1 20 16755 1 1 53 MET CB C -10.740 -2.983 -5.131 1.00 . A B . 53 MET CB 1 1 20 16756 1 1 53 MET CE C -8.258 -1.504 -6.445 1.00 . A B . 53 MET CE 1 1 20 16757 1 1 53 MET CG C -10.581 -3.014 -6.643 1.00 . A B . 53 MET CG 1 1 20 16758 1 1 53 MET H H -11.423 -3.194 -2.678 1.00 . A B . 53 MET H 1 1 20 16759 1 1 53 MET HA H -12.727 -2.188 -5.007 1.00 . A B . 53 MET HA 1 1 20 16760 1 1 53 MET HB2 H -10.298 -2.065 -4.771 1.00 . A B . 53 MET HB2 1 1 20 16761 1 1 53 MET HB3 H -10.196 -3.818 -4.717 1.00 . A B . 53 MET HB3 1 1 20 16762 1 1 53 MET HE1 H -8.353 -1.543 -5.371 1.00 . A B . 53 MET HE1 1 1 20 16763 1 1 53 MET HE2 H -8.844 -0.681 -6.828 1.00 . A B . 53 MET HE2 1 1 20 16764 1 1 53 MET HE3 H -7.221 -1.360 -6.710 1.00 . A B . 53 MET HE3 1 1 20 16765 1 1 53 MET HG2 H -11.068 -3.899 -7.022 1.00 . A B . 53 MET HG2 1 1 20 16766 1 1 53 MET HG3 H -11.053 -2.138 -7.061 1.00 . A B . 53 MET HG3 1 1 20 16767 1 1 53 MET N N -12.245 -3.040 -3.187 1.00 . A B . 53 MET N 1 1 20 16768 1 1 53 MET O O -13.502 -4.274 -6.248 1.00 . A B . 53 MET O 1 1 20 16769 1 1 53 MET SD S -8.850 -3.040 -7.154 1.00 . A B . 53 MET SD 1 1 20 16770 1 1 54 LYS C C -13.738 -7.466 -3.676 1.00 . A B . 54 LYS C 1 1 20 16771 1 1 54 LYS CA C -13.292 -6.665 -4.893 1.00 . A B . 54 LYS CA 1 1 20 16772 1 1 54 LYS CB C -12.279 -7.470 -5.715 1.00 . A B . 54 LYS CB 1 1 20 16773 1 1 54 LYS CD C -13.947 -8.389 -7.355 1.00 . A B . 54 LYS CD 1 1 20 16774 1 1 54 LYS CE C -14.637 -9.635 -7.882 1.00 . A B . 54 LYS CE 1 1 20 16775 1 1 54 LYS CG C -12.867 -8.727 -6.341 1.00 . A B . 54 LYS CG 1 1 20 16776 1 1 54 LYS H H -12.219 -5.362 -3.632 1.00 . A B . 54 LYS H 1 1 20 16777 1 1 54 LYS HA H -14.153 -6.449 -5.506 1.00 . A B . 54 LYS HA 1 1 20 16778 1 1 54 LYS HB2 H -11.896 -6.843 -6.508 1.00 . A B . 54 LYS HB2 1 1 20 16779 1 1 54 LYS HB3 H -11.462 -7.760 -5.072 1.00 . A B . 54 LYS HB3 1 1 20 16780 1 1 54 LYS HD2 H -14.684 -7.760 -6.882 1.00 . A B . 54 LYS HD2 1 1 20 16781 1 1 54 LYS HD3 H -13.497 -7.860 -8.182 1.00 . A B . 54 LYS HD3 1 1 20 16782 1 1 54 LYS HE2 H -13.897 -10.281 -8.331 1.00 . A B . 54 LYS HE2 1 1 20 16783 1 1 54 LYS HE3 H -15.107 -10.147 -7.054 1.00 . A B . 54 LYS HE3 1 1 20 16784 1 1 54 LYS HG2 H -12.078 -9.272 -6.838 1.00 . A B . 54 LYS HG2 1 1 20 16785 1 1 54 LYS HG3 H -13.296 -9.338 -5.561 1.00 . A B . 54 LYS HG3 1 1 20 16786 1 1 54 LYS HZ1 H -16.170 -10.161 -9.194 1.00 . A B . 54 LYS HZ1 1 1 20 16787 1 1 54 LYS HZ2 H -15.232 -8.862 -9.726 1.00 . A B . 54 LYS HZ2 1 1 20 16788 1 1 54 LYS HZ3 H -16.363 -8.635 -8.492 1.00 . A B . 54 LYS HZ3 1 1 20 16789 1 1 54 LYS N N -12.716 -5.403 -4.476 1.00 . A B . 54 LYS N 1 1 20 16790 1 1 54 LYS NZ N -15.671 -9.301 -8.893 1.00 . A B . 54 LYS NZ 1 1 20 16791 1 1 54 LYS O O -12.974 -8.260 -3.123 1.00 . A B . 54 LYS O 1 1 20 16792 1 1 55 GLU C C -16.959 -8.371 -2.398 1.00 . A B . 55 GLU C 1 1 20 16793 1 1 55 GLU CA C -15.528 -7.941 -2.109 1.00 . A B . 55 GLU CA 1 1 20 16794 1 1 55 GLU CB C -15.488 -7.054 -0.862 1.00 . A B . 55 GLU CB 1 1 20 16795 1 1 55 GLU CD C -16.044 -6.810 1.593 1.00 . A B . 55 GLU CD 1 1 20 16796 1 1 55 GLU CG C -16.059 -7.720 0.381 1.00 . A B . 55 GLU CG 1 1 20 16797 1 1 55 GLU H H -15.537 -6.609 -3.749 1.00 . A B . 55 GLU H 1 1 20 16798 1 1 55 GLU HA H -14.929 -8.820 -1.933 1.00 . A B . 55 GLU HA 1 1 20 16799 1 1 55 GLU HB2 H -14.461 -6.787 -0.661 1.00 . A B . 55 GLU HB2 1 1 20 16800 1 1 55 GLU HB3 H -16.053 -6.155 -1.056 1.00 . A B . 55 GLU HB3 1 1 20 16801 1 1 55 GLU HG2 H -17.081 -8.009 0.182 1.00 . A B . 55 GLU HG2 1 1 20 16802 1 1 55 GLU HG3 H -15.475 -8.601 0.604 1.00 . A B . 55 GLU HG3 1 1 20 16803 1 1 55 GLU N N -14.973 -7.246 -3.258 1.00 . A B . 55 GLU N 1 1 20 16804 1 1 55 GLU O O -17.862 -7.535 -2.493 1.00 . A B . 55 GLU O 1 1 20 16805 1 1 55 GLU OE1 O -16.973 -5.988 1.739 1.00 . A B . 55 GLU OE1 1 1 20 16806 1 1 55 GLU OE2 O -15.101 -6.912 2.406 1.00 . A B . 55 GLU OE2 1 1 20 16807 1 1 56 SER C C -18.571 -11.620 -2.182 1.00 . A B . 56 SER C 1 1 20 16808 1 1 56 SER CA C -18.472 -10.223 -2.793 1.00 . A B . 56 SER CA 1 1 20 16809 1 1 56 SER CB C -18.786 -10.248 -4.291 1.00 . A B . 56 SER CB 1 1 20 16810 1 1 56 SER H H -16.382 -10.273 -2.543 1.00 . A B . 56 SER H 1 1 20 16811 1 1 56 SER HA H -19.185 -9.581 -2.299 1.00 . A B . 56 SER HA 1 1 20 16812 1 1 56 SER HB2 H -19.660 -10.859 -4.463 1.00 . A B . 56 SER HB2 1 1 20 16813 1 1 56 SER HB3 H -18.979 -9.242 -4.632 1.00 . A B . 56 SER HB3 1 1 20 16814 1 1 56 SER HG H -16.895 -10.308 -4.813 1.00 . A B . 56 SER HG 1 1 20 16815 1 1 56 SER N N -17.153 -9.667 -2.565 1.00 . A B . 56 SER N 1 1 20 16816 1 1 56 SER O O -17.931 -12.554 -2.714 1.00 . A B . 56 SER O 1 1 20 16817 1 1 56 SER OXT O -19.285 -11.777 -1.170 1.00 . A B . 56 SER OXT 1 1 20 16818 1 1 56 SER OG O -17.705 -10.782 -5.041 1.00 . A B . 56 SER OG 1 1 20 16819 2 2 1 ZN ZN ZN -7.266 -5.886 2.293 1.00 . B B . 101 ZN ZN 1 1 20 16820 3 2 1 ZN ZN ZN 5.753 1.329 -0.283 1.00 . C B . 102 ZN ZN 1 1 stop_ save_
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