NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
520267 | 2lde | 17661 | cing | 4-filtered-FRED | STAR | entry | full | 412 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lde # This FRED archive file contains, for PDB entry <2lde>: # # - 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_2lde _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lde _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 2959.34 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 $Sarafotoxin_i3 A . 1 1 stop_ save_ save_Sarafotoxin_i3 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Sarafotoxin i3" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code CSCTDMSDLECMNFCHKDVIWVNRN _Entity.Number_of_monomers 25 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 CYS . 1 1 2 SER . 1 1 3 CYS . 1 1 4 THR . 1 1 5 ASP . 1 1 6 MET . 1 1 7 SER . 1 1 8 ASP . 1 1 9 LEU . 1 1 10 GLU . 1 1 11 CYS . 1 1 12 MET . 1 1 13 ASN . 1 1 14 PHE . 1 1 15 CYS . 1 1 16 HIS . 1 1 17 LYS . 1 1 18 ASP . 1 1 19 VAL . 1 1 20 ILE . 1 1 21 TRP . 1 1 22 VAL . 1 1 23 ASN . 1 1 24 ARG . 1 1 25 ASN . 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 CYS 1 1 1 1 SER 2 2 1 1 CYS 3 3 1 1 THR 4 4 1 1 ASP 5 5 1 1 MET 6 6 1 1 SER 7 7 1 1 ASP 8 8 1 1 LEU 9 9 1 1 GLU 10 10 1 1 CYS 11 11 1 1 MET 12 12 1 1 ASN 13 13 1 1 PHE 14 14 1 1 CYS 15 15 1 1 HIS 16 16 1 1 LYS 17 17 1 1 ASP 18 18 1 1 VAL 19 19 1 1 ILE 20 20 1 1 TRP 21 21 1 1 VAL 22 22 1 1 ASN 23 23 1 1 ARG 24 24 1 1 ASN 25 25 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 SER H . 2 . HN 1 1 1 1 2 1 1 2 SER HA . 2 . HA 1 1 2 1 1 1 1 1 CYS HA . 1 . HA 1 1 2 1 2 1 1 2 SER H . 2 . HN 1 1 3 1 1 1 1 2 SER H . 2 . HN 1 1 3 1 2 1 1 2 SER QB . 2 . HB2 1 1 4 1 1 1 1 1 CYS HB2 . 1 . HB2 1 1 4 1 2 1 1 2 SER H . 2 . HN 1 1 5 1 1 1 1 1 CYS HB3 . 1 . HB1 1 1 5 1 2 1 1 2 SER H . 2 . HN 1 1 6 1 1 1 1 3 CYS H . 3 . HN 1 1 6 1 2 1 1 3 CYS HA . 3 . HA 1 1 7 1 1 1 1 3 CYS H . 3 . HN 1 1 7 1 2 1 1 3 CYS HB2 . 3 . HB2 1 1 8 1 1 1 1 15 CYS H . 15 . HN 1 1 8 1 2 1 1 15 CYS HA . 15 . HA 1 1 9 1 1 1 1 14 PHE HA . 14 . HA 1 1 9 1 2 1 1 15 CYS H . 15 . HN 1 1 10 1 1 1 1 15 CYS H . 15 . HN 1 1 10 1 2 1 1 16 HIS QB . 16 . HB2 1 1 11 1 1 1 1 13 ASN QB . 13 . HB2 1 1 11 1 2 1 1 14 PHE H . 14 . HN 1 1 12 1 1 1 1 18 ASP H . 18 . HN 1 1 12 1 2 1 1 18 ASP HB3 . 18 . HB1 1 1 13 1 1 1 1 18 ASP H . 18 . HN 1 1 13 1 2 1 1 18 ASP HA . 18 . HA 1 1 14 1 1 1 1 17 LYS HB3 . 17 . HB1 1 1 14 1 2 1 1 18 ASP H . 18 . HN 1 1 15 1 1 1 1 17 LYS HB2 . 17 . HB2 1 1 15 1 2 1 1 18 ASP H . 18 . HN 1 1 16 1 1 1 1 17 LYS HA . 17 . HA 1 1 16 1 2 1 1 18 ASP H . 18 . HN 1 1 17 1 1 1 1 18 ASP H . 18 . HN 1 1 17 1 2 1 1 19 VAL QG . 19 . HG2% 1 1 18 1 1 1 1 17 LYS QG . 17 . HG2 1 1 18 1 2 1 1 18 ASP H . 18 . HN 1 1 19 1 1 1 1 9 LEU H . 9 . HN 1 1 19 1 2 1 1 9 LEU MD1 . 9 . HD1% 1 1 20 1 1 1 1 9 LEU H . 9 . HN 1 1 20 1 2 1 1 9 LEU MD2 . 9 . HD2% 1 1 21 1 1 1 1 9 LEU H . 9 . HN 1 1 21 1 2 1 1 9 LEU HG . 9 . HG 1 1 22 1 1 1 1 9 LEU H . 9 . HN 1 1 22 1 2 1 1 10 GLU HB2 . 10 . HB2 1 1 23 1 1 1 1 8 ASP HB2 . 8 . HB2 1 1 23 1 2 1 1 9 LEU H . 9 . HN 1 1 24 1 1 1 1 8 ASP HB3 . 8 . HB1 1 1 24 1 2 1 1 9 LEU H . 9 . HN 1 1 25 1 1 1 1 23 ASN H . 23 . HN 1 1 25 1 2 1 1 23 ASN HB3 . 23 . HB1 1 1 26 1 1 1 1 23 ASN H . 23 . HN 1 1 26 1 2 1 1 23 ASN HB2 . 23 . HB2 1 1 27 1 1 1 1 23 ASN H . 23 . HN 1 1 27 1 2 1 1 23 ASN HA . 23 . HA 1 1 28 1 1 1 1 22 VAL HB . 22 . HB 1 1 28 1 2 1 1 23 ASN H . 23 . HN 1 1 29 1 1 1 1 22 VAL QG . 22 . HG1% 1 1 29 1 2 1 1 23 ASN H . 23 . HN 1 1 30 1 1 1 1 24 ARG HA . 24 . HA 1 1 30 1 2 1 1 25 ASN H . 25 . HN 1 1 31 1 1 1 1 24 ARG HB2 . 24 . HB2 1 1 31 1 2 1 1 25 ASN H . 25 . HN 1 1 32 1 1 1 1 20 ILE HA . 20 . HA 1 1 32 1 2 1 1 21 TRP H . 21 . HN 1 1 33 1 1 1 1 21 TRP H . 21 . HN 1 1 33 1 2 1 1 21 TRP HB3 . 21 . HB1 1 1 34 1 1 1 1 21 TRP H . 21 . HN 1 1 34 1 2 1 1 21 TRP HB2 . 21 . HB2 1 1 35 1 1 1 1 20 ILE HB . 20 . HB 1 1 35 1 2 1 1 21 TRP H . 21 . HN 1 1 36 1 1 1 1 19 VAL QG . 19 . HG2% 1 1 36 1 2 1 1 21 TRP H . 21 . HN 1 1 37 1 1 1 1 20 ILE HG12 . 20 . HG11 1 1 37 1 2 1 1 21 TRP H . 21 . HN 1 1 38 1 1 1 1 23 ASN HA . 23 . HA 1 1 38 1 2 1 1 24 ARG H . 24 . HN 1 1 39 1 1 1 1 24 ARG H . 24 . HN 1 1 39 1 2 1 1 24 ARG HA . 24 . HA 1 1 40 1 1 1 1 24 ARG H . 24 . HN 1 1 40 1 2 1 1 24 ARG HB3 . 24 . HB1 1 1 41 1 1 1 1 24 ARG H . 24 . HN 1 1 41 1 2 1 1 24 ARG QG . 24 . HG2 1 1 42 1 1 1 1 24 ARG H . 24 . HN 1 1 42 1 2 1 1 24 ARG HB2 . 24 . HB2 1 1 43 1 1 1 1 12 MET H . 12 . HN 1 1 43 1 2 1 1 12 MET HA . 12 . HA 1 1 44 1 1 1 1 12 MET H . 12 . HN 1 1 44 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 45 1 1 1 1 12 MET H . 12 . HN 1 1 45 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 46 1 1 1 1 12 MET H . 12 . HN 1 1 46 1 2 1 1 12 MET HB2 . 12 . HB2 1 1 47 1 1 1 1 12 MET H . 12 . HN 1 1 47 1 2 1 1 12 MET HB3 . 12 . HB1 1 1 48 1 1 1 1 8 ASP HA . 8 . HA 1 1 48 1 2 1 1 12 MET H . 12 . HN 1 1 49 1 1 1 1 11 CYS QB . 11 . HB2 1 1 49 1 2 1 1 12 MET H . 12 . HN 1 1 50 1 1 1 1 7 SER H . 7 . HN 1 1 50 1 2 1 1 7 SER HA . 7 . HA 1 1 51 1 1 1 1 7 SER H . 7 . HN 1 1 51 1 2 1 1 7 SER HB2 . 7 . HB2 1 1 52 1 1 1 1 6 MET HA . 6 . HA 1 1 52 1 2 1 1 7 SER H . 7 . HN 1 1 53 1 1 1 1 6 MET HG3 . 6 . HG1 1 1 53 1 2 1 1 7 SER H . 7 . HN 1 1 54 1 1 1 1 6 MET HG2 . 6 . HG2 1 1 54 1 2 1 1 7 SER H . 7 . HN 1 1 55 1 1 1 1 7 SER H . 7 . HN 1 1 55 1 2 1 1 10 GLU HB3 . 10 . HB1 1 1 56 1 1 1 1 4 THR H . 4 . HN 1 1 56 1 2 1 1 4 THR HB . 4 . HB 1 1 57 1 1 1 1 4 THR H . 4 . HN 1 1 57 1 2 1 1 4 THR HA . 4 . HA 1 1 58 1 1 1 1 3 CYS HA . 3 . HA 1 1 58 1 2 1 1 4 THR H . 4 . HN 1 1 59 1 1 1 1 4 THR H . 4 . HN 1 1 59 1 2 1 1 4 THR MG . 4 . HG2% 1 1 60 1 1 1 1 2 SER QB . 2 . HB2 1 1 60 1 2 1 1 4 THR H . 4 . HN 1 1 61 1 1 1 1 20 ILE H . 20 . HN 1 1 61 1 2 1 1 20 ILE HA . 20 . HA 1 1 62 1 1 1 1 19 VAL HA . 19 . HA 1 1 62 1 2 1 1 20 ILE H . 20 . HN 1 1 63 1 1 1 1 20 ILE H . 20 . HN 1 1 63 1 2 1 1 20 ILE HB . 20 . HB 1 1 64 1 1 1 1 20 ILE H . 20 . HN 1 1 64 1 2 1 1 20 ILE HG13 . 20 . HG12 1 1 65 1 1 1 1 20 ILE H . 20 . HN 1 1 65 1 2 1 1 20 ILE MG . 20 . HG2% 1 1 66 1 1 1 1 19 VAL QG . 19 . HG2% 1 1 66 1 2 1 1 20 ILE H . 20 . HN 1 1 67 1 1 1 1 20 ILE H . 20 . HN 1 1 67 1 2 1 1 20 ILE HG12 . 20 . HG11 1 1 68 1 1 1 1 17 LYS H . 17 . HN 1 1 68 1 2 1 1 17 LYS HA . 17 . HA 1 1 69 1 1 1 1 16 HIS HA . 16 . HA 1 1 69 1 2 1 1 17 LYS H . 17 . HN 1 1 70 1 1 1 1 12 MET HA . 12 . HA 1 1 70 1 2 1 1 17 LYS H . 17 . HN 1 1 71 1 1 1 1 16 HIS QB . 16 . HB2 1 1 71 1 2 1 1 17 LYS H . 17 . HN 1 1 72 1 1 1 1 17 LYS H . 17 . HN 1 1 72 1 2 1 1 17 LYS QG . 17 . HG2 1 1 73 1 1 1 1 17 LYS H . 17 . HN 1 1 73 1 2 1 1 17 LYS HB2 . 17 . HB2 1 1 74 1 1 1 1 17 LYS H . 17 . HN 1 1 74 1 2 1 1 17 LYS HB3 . 17 . HB1 1 1 75 1 1 1 1 17 LYS H . 17 . HN 1 1 75 1 2 1 1 17 LYS QD . 17 . HD2 1 1 76 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 76 1 2 1 1 17 LYS H . 17 . HN 1 1 77 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 77 1 2 1 1 17 LYS H . 17 . HN 1 1 78 1 1 1 1 14 PHE HA . 14 . HA 1 1 78 1 2 1 1 17 LYS H . 17 . HN 1 1 79 1 1 1 1 19 VAL H . 19 . HN 1 1 79 1 2 1 1 19 VAL HA . 19 . HA 1 1 80 1 1 1 1 18 ASP HA . 18 . HA 1 1 80 1 2 1 1 19 VAL H . 19 . HN 1 1 81 1 1 1 1 4 THR HA . 4 . HA 1 1 81 1 2 1 1 6 MET H . 6 . HN 1 1 82 1 1 1 1 17 LYS HA . 17 . HA 1 1 82 1 2 1 1 19 VAL H . 19 . HN 1 1 83 1 1 1 1 19 VAL H . 19 . HN 1 1 83 1 2 1 1 19 VAL HB . 19 . HB 1 1 84 1 1 1 1 19 VAL H . 19 . HN 1 1 84 1 2 1 1 19 VAL QG . 19 . HG1% 1 1 85 1 1 1 1 18 ASP HB2 . 18 . HB2 1 1 85 1 2 1 1 19 VAL H . 19 . HN 1 1 86 1 1 1 1 16 HIS H . 16 . HN 1 1 86 1 2 1 1 16 HIS QB . 16 . HB2 1 1 87 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 87 1 2 1 1 16 HIS H . 16 . HN 1 1 88 1 1 1 1 16 HIS H . 16 . HN 1 1 88 1 2 1 1 17 LYS HA . 17 . HA 1 1 89 1 1 1 1 13 ASN H . 13 . HN 1 1 89 1 2 1 1 13 ASN HA . 13 . HA 1 1 90 1 1 1 1 12 MET HA . 12 . HA 1 1 90 1 2 1 1 13 ASN H . 13 . HN 1 1 91 1 1 1 1 10 GLU HA . 10 . HA 1 1 91 1 2 1 1 13 ASN H . 13 . HN 1 1 92 1 1 1 1 13 ASN H . 13 . HN 1 1 92 1 2 1 1 13 ASN QB . 13 . HB2 1 1 93 1 1 1 1 12 MET HB2 . 12 . HB2 1 1 93 1 2 1 1 13 ASN H . 13 . HN 1 1 94 1 1 1 1 12 MET HB3 . 12 . HB1 1 1 94 1 2 1 1 13 ASN H . 13 . HN 1 1 95 1 1 1 1 12 MET HG3 . 12 . HG1 1 1 95 1 2 1 1 13 ASN H . 13 . HN 1 1 96 1 1 1 1 12 MET HG2 . 12 . HG2 1 1 96 1 2 1 1 13 ASN H . 13 . HN 1 1 97 1 1 1 1 9 LEU MD2 . 9 . HD2% 1 1 97 1 2 1 1 13 ASN H . 13 . HN 1 1 98 1 1 1 1 9 LEU HB3 . 9 . HB1 1 1 98 1 2 1 1 13 ASN H . 13 . HN 1 1 99 1 1 1 1 22 VAL H . 22 . HN 1 1 99 1 2 1 1 22 VAL HA . 22 . HA 1 1 100 1 1 1 1 21 TRP HA . 21 . HA 1 1 100 1 2 1 1 22 VAL H . 22 . HN 1 1 101 1 1 1 1 22 VAL H . 22 . HN 1 1 101 1 2 1 1 22 VAL QG . 22 . HG1% 1 1 102 1 1 1 1 22 VAL H . 22 . HN 1 1 102 1 2 1 1 22 VAL HB . 22 . HB 1 1 103 1 1 1 1 21 TRP HB2 . 21 . HB2 1 1 103 1 2 1 1 22 VAL H . 22 . HN 1 1 104 1 1 1 1 19 VAL QG . 19 . HG1% 1 1 104 1 2 1 1 22 VAL H . 22 . HN 1 1 105 1 1 1 1 20 ILE HG13 . 20 . HG12 1 1 105 1 2 1 1 22 VAL H . 22 . HN 1 1 106 1 1 1 1 8 ASP HA . 8 . HA 1 1 106 1 2 1 1 10 GLU H . 10 . HN 1 1 107 1 1 1 1 10 GLU H . 10 . HN 1 1 107 1 2 1 1 10 GLU HB2 . 10 . HB2 1 1 108 1 1 1 1 9 LEU HG . 9 . HG 1 1 108 1 2 1 1 10 GLU H . 10 . HN 1 1 109 1 1 1 1 7 SER HA . 7 . HA 1 1 109 1 2 1 1 10 GLU H . 10 . HN 1 1 110 1 1 1 1 19 VAL QG . 19 . HG1% 1 1 110 1 2 1 1 21 TRP HE1 . 21 . HE1 1 1 111 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 111 1 2 1 1 21 TRP HE1 . 21 . HE1 1 1 112 1 1 1 1 16 HIS QB . 16 . HB2 1 1 112 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 113 1 1 1 1 16 HIS HA . 16 . HA 1 1 113 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 114 1 1 1 1 12 MET HA . 12 . HA 1 1 114 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 115 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 115 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 116 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 116 1 2 1 1 16 HIS HD2 . 16 . HD2 1 1 117 1 1 1 1 16 HIS QB . 16 . HB2 1 1 117 1 2 1 1 16 HIS HE1 . 16 . HE1 1 1 118 1 1 1 1 13 ASN HA . 13 . HA 1 1 118 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 119 1 1 1 1 13 ASN HA . 13 . HA 1 1 119 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 120 1 1 1 1 13 ASN QB . 13 . HB2 1 1 120 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 121 1 1 1 1 13 ASN QB . 13 . HB2 1 1 121 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 122 1 1 1 1 10 GLU HA . 10 . HA 1 1 122 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 123 1 1 1 1 10 GLU HA . 10 . HA 1 1 123 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 124 1 1 1 1 9 LEU MD2 . 9 . HD2% 1 1 124 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 125 1 1 1 1 9 LEU MD2 . 9 . HD2% 1 1 125 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 126 1 1 1 1 9 LEU MD1 . 9 . HD1% 1 1 126 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 127 1 1 1 1 9 LEU HG . 9 . HG 1 1 127 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 128 1 1 1 1 9 LEU HB3 . 9 . HB1 1 1 128 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 129 1 1 1 1 19 VAL QG . 19 . HG1% 1 1 129 1 2 1 1 21 TRP HZ2 . 21 . HZ2 1 1 130 1 1 1 1 10 GLU QG . 10 . HG2 1 1 130 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 131 1 1 1 1 23 ASN HB3 . 23 . HB1 1 1 131 1 2 1 1 23 ASN HD21 . 23 . HD21 1 1 132 1 1 1 1 23 ASN HB2 . 23 . HB2 1 1 132 1 2 1 1 23 ASN HD21 . 23 . HD21 1 1 133 1 1 1 1 22 VAL QG . 22 . HG1% 1 1 133 1 2 1 1 23 ASN HD21 . 23 . HD21 1 1 134 1 1 1 1 14 PHE HA . 14 . HA 1 1 134 1 2 1 1 14 PHE QE . 14 . HE% 1 1 135 1 1 1 1 14 PHE QE . 14 . HE% 1 1 135 1 2 1 1 15 CYS HA . 15 . HA 1 1 136 1 1 1 1 3 CYS HA . 3 . HA 1 1 136 1 2 1 1 14 PHE QE . 14 . HE% 1 1 137 1 1 1 1 3 CYS HA . 3 . HA 1 1 137 1 2 1 1 14 PHE HZ . 14 . HZ 1 1 138 1 1 1 1 14 PHE HZ . 14 . HZ 1 1 138 1 2 1 1 15 CYS HA . 15 . HA 1 1 139 1 1 1 1 11 CYS HA . 11 . HA 1 1 139 1 2 1 1 14 PHE QE . 14 . HE% 1 1 140 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 140 1 2 1 1 14 PHE HZ . 14 . HZ 1 1 141 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 141 1 2 1 1 14 PHE QE . 14 . HE% 1 1 142 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 142 1 2 1 1 14 PHE QE . 14 . HE% 1 1 143 1 1 1 1 14 PHE HB2 . 14 . HB2 1 1 143 1 2 1 1 14 PHE QD . 14 . HD% 1 1 144 1 1 1 1 21 TRP HB3 . 21 . HB1 1 1 144 1 2 1 1 21 TRP HD1 . 21 . HD1 1 1 145 1 1 1 1 21 TRP HB2 . 21 . HB2 1 1 145 1 2 1 1 21 TRP HD1 . 21 . HD1 1 1 146 1 1 1 1 21 TRP HA . 21 . HA 1 1 146 1 2 1 1 21 TRP HE3 . 21 . HE3 1 1 147 1 1 1 1 21 TRP HE3 . 21 . HE3 1 1 147 1 2 1 1 22 VAL HA . 22 . HA 1 1 148 1 1 1 1 19 VAL QG . 19 . HG2% 1 1 148 1 2 1 1 21 TRP HE3 . 21 . HE3 1 1 149 1 1 1 1 19 VAL QG . 19 . HG1% 1 1 149 1 2 1 1 21 TRP HD1 . 21 . HD1 1 1 150 1 1 1 1 2 SER H . 2 . HN 1 1 150 1 2 1 1 14 PHE HZ . 14 . HZ 1 1 151 1 1 1 1 2 SER H . 2 . HN 1 1 151 1 2 1 1 14 PHE QE . 14 . HE% 1 1 152 1 1 1 1 8 ASP H . 8 . HN 1 1 152 1 2 1 1 9 LEU H . 9 . HN 1 1 153 1 1 1 1 3 CYS H . 3 . HN 1 1 153 1 2 1 1 4 THR H . 4 . HN 1 1 154 1 1 1 1 11 CYS H . 11 . HN 1 1 154 1 2 1 1 12 MET H . 12 . HN 1 1 155 1 1 1 1 10 GLU H . 10 . HN 1 1 155 1 2 1 1 11 CYS H . 11 . HN 1 1 156 1 1 1 1 13 ASN H . 13 . HN 1 1 156 1 2 1 1 14 PHE H . 14 . HN 1 1 157 1 1 1 1 9 LEU H . 9 . HN 1 1 157 1 2 1 1 10 GLU H . 10 . HN 1 1 158 1 1 1 1 22 VAL H . 22 . HN 1 1 158 1 2 1 1 23 ASN H . 23 . HN 1 1 159 1 1 1 1 20 ILE H . 20 . HN 1 1 159 1 2 1 1 21 TRP H . 21 . HN 1 1 160 1 1 1 1 21 TRP H . 21 . HN 1 1 160 1 2 1 1 21 TRP HE3 . 21 . HE3 1 1 161 1 1 1 1 21 TRP H . 21 . HN 1 1 161 1 2 1 1 21 TRP HD1 . 21 . HD1 1 1 162 1 1 1 1 12 MET H . 12 . HN 1 1 162 1 2 1 1 13 ASN H . 13 . HN 1 1 163 1 1 1 1 6 MET H . 6 . HN 1 1 163 1 2 1 1 7 SER H . 7 . HN 1 1 164 1 1 1 1 19 VAL H . 19 . HN 1 1 164 1 2 1 1 20 ILE H . 20 . HN 1 1 165 1 1 1 1 16 HIS H . 16 . HN 1 1 165 1 2 1 1 17 LYS H . 17 . HN 1 1 166 1 1 1 1 13 ASN H . 13 . HN 1 1 166 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 167 1 1 1 1 13 ASN H . 13 . HN 1 1 167 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 168 1 1 1 1 21 TRP HD1 . 21 . HD1 1 1 168 1 2 1 1 22 VAL H . 22 . HN 1 1 169 1 1 1 1 7 SER HA . 7 . HA 1 1 169 1 2 1 1 7 SER HB2 . 7 . HB2 1 1 170 1 1 1 1 7 SER HA . 7 . HA 1 1 170 1 2 1 1 7 SER HB3 . 7 . HB1 1 1 171 1 1 1 1 3 CYS HA . 3 . HA 1 1 171 1 2 1 1 4 THR HA . 4 . HA 1 1 172 1 1 1 1 3 CYS HA . 3 . HA 1 1 172 1 2 1 1 3 CYS HB2 . 3 . HB2 1 1 173 1 1 1 1 3 CYS HA . 3 . HA 1 1 173 1 2 1 1 11 CYS QB . 11 . HB2 1 1 174 1 1 1 1 16 HIS HA . 16 . HA 1 1 174 1 2 1 1 16 HIS QB . 16 . HB2 1 1 175 1 1 1 1 10 GLU HA . 10 . HA 1 1 175 1 2 1 1 10 GLU QG . 10 . HG2 1 1 176 1 1 1 1 6 MET HA . 6 . HA 1 1 176 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 177 1 1 1 1 6 MET HA . 6 . HA 1 1 177 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 178 1 1 1 1 12 MET HA . 12 . HA 1 1 178 1 2 1 1 16 HIS QB . 16 . HB2 1 1 179 1 1 1 1 13 ASN HA . 13 . HA 1 1 179 1 2 1 1 13 ASN QB . 13 . HB2 1 1 180 1 1 1 1 8 ASP HA . 8 . HA 1 1 180 1 2 1 1 11 CYS QB . 11 . HB2 1 1 181 1 1 1 1 13 ASN HA . 13 . HA 1 1 181 1 2 1 1 16 HIS QB . 16 . HB2 1 1 182 1 1 1 1 1 CYS HA . 1 . HA 1 1 182 1 2 1 1 1 CYS HB2 . 1 . HB2 1 1 183 1 1 1 1 8 ASP HA . 8 . HA 1 1 183 1 2 1 1 8 ASP HB2 . 8 . HB2 1 1 184 1 1 1 1 8 ASP HA . 8 . HA 1 1 184 1 2 1 1 8 ASP HB3 . 8 . HB1 1 1 185 1 1 1 1 14 PHE HA . 14 . HA 1 1 185 1 2 1 1 14 PHE HB3 . 14 . HB1 1 1 186 1 1 1 1 23 ASN HA . 23 . HA 1 1 186 1 2 1 1 23 ASN HB3 . 23 . HB1 1 1 187 1 1 1 1 6 MET HA . 6 . HA 1 1 187 1 2 1 1 6 MET HB3 . 6 . HB1 1 1 188 1 1 1 1 6 MET HA . 6 . HA 1 1 188 1 2 1 1 6 MET HB2 . 6 . HB2 1 1 189 1 1 1 1 10 GLU HA . 10 . HA 1 1 189 1 2 1 1 10 GLU HB3 . 10 . HB1 1 1 190 1 1 1 1 9 LEU HA . 9 . HA 1 1 190 1 2 1 1 9 LEU HG . 9 . HG 1 1 191 1 1 1 1 20 ILE HA . 20 . HA 1 1 191 1 2 1 1 20 ILE HB . 20 . HB 1 1 192 1 1 1 1 17 LYS HA . 17 . HA 1 1 192 1 2 1 1 17 LYS HB3 . 17 . HB1 1 1 193 1 1 1 1 19 VAL HA . 19 . HA 1 1 193 1 2 1 1 19 VAL HB . 19 . HB 1 1 194 1 1 1 1 4 THR HA . 4 . HA 1 1 194 1 2 1 1 4 THR MG . 4 . HG2% 1 1 195 1 1 1 1 9 LEU HA . 9 . HA 1 1 195 1 2 1 1 9 LEU MD2 . 9 . HD2% 1 1 196 1 1 1 1 9 LEU HA . 9 . HA 1 1 196 1 2 1 1 9 LEU MD1 . 9 . HD1% 1 1 197 1 1 1 1 22 VAL HA . 22 . HA 1 1 197 1 2 1 1 22 VAL QG . 22 . HG1% 1 1 198 1 1 1 1 19 VAL HA . 19 . HA 1 1 198 1 2 1 1 19 VAL QG . 19 . HG2% 1 1 199 1 1 1 1 17 LYS HA . 17 . HA 1 1 199 1 2 1 1 17 LYS QG . 17 . HG2 1 1 200 1 1 1 1 11 CYS QB . 11 . HB2 1 1 200 1 2 1 1 12 MET HA . 12 . HA 1 1 201 1 1 1 1 1 CYS HA . 1 . HA 1 1 201 1 2 1 1 1 CYS HB3 . 1 . HB1 1 1 202 1 1 1 1 14 PHE HA . 14 . HA 1 1 202 1 2 1 1 14 PHE HB2 . 14 . HB2 1 1 203 1 1 1 1 14 PHE HA . 14 . HA 1 1 203 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 204 1 1 1 1 23 ASN HA . 23 . HA 1 1 204 1 2 1 1 23 ASN HB2 . 23 . HB2 1 1 205 1 1 1 1 20 ILE HA . 20 . HA 1 1 205 1 2 1 1 20 ILE MG . 20 . HG2% 1 1 206 1 1 1 1 20 ILE HA . 20 . HA 1 1 206 1 2 1 1 20 ILE HG13 . 20 . HG12 1 1 207 1 1 1 1 24 ARG HA . 24 . HA 1 1 207 1 2 1 1 24 ARG HB2 . 24 . HB2 1 1 208 1 1 1 1 17 LYS HA . 17 . HA 1 1 208 1 2 1 1 17 LYS HB2 . 17 . HB2 1 1 209 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 209 1 2 1 1 6 MET HB3 . 6 . HB1 1 1 210 1 1 1 1 6 MET ME . 6 . HE% 1 1 210 1 2 1 1 14 PHE HB3 . 14 . HB1 1 1 211 1 1 1 1 12 MET HB3 . 12 . HB1 1 1 211 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 212 1 1 1 1 16 HIS QB . 16 . HB2 1 1 212 1 2 1 1 19 VAL QG . 19 . HG2% 1 1 213 1 1 1 1 18 ASP HB3 . 18 . HB1 1 1 213 1 2 1 1 19 VAL QG . 19 . HG1% 1 1 214 1 1 1 1 19 VAL QG . 19 . HG1% 1 1 214 1 2 1 1 21 TRP HB3 . 21 . HB1 1 1 215 1 1 1 1 4 THR MG . 4 . HG2% 1 1 215 1 2 1 1 5 ASP HB2 . 5 . HB2 1 1 216 1 1 1 1 20 ILE HB . 20 . HB 1 1 216 1 2 1 1 20 ILE MD . 20 . HD1% 1 1 216 1 2 1 1 20 ILE MG . 20 . HG2% 1 1 217 1 1 1 1 20 ILE MD . 20 . HD1% 1 1 217 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 217 1 2 1 1 20 ILE HG13 . 20 . HG12 1 1 218 1 1 1 1 21 TRP HA . 21 . HA 1 1 218 1 2 1 1 22 VAL QG . 22 . HG1% 1 1 219 1 1 1 1 18 ASP HA . 18 . HA 1 1 219 1 2 1 1 19 VAL QG . 19 . HG1% 1 1 220 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 220 1 2 1 1 6 MET HB2 . 6 . HB2 1 1 221 1 1 1 1 24 ARG HA . 24 . HA 1 1 221 1 2 1 1 24 ARG HB3 . 24 . HB1 1 1 222 1 1 1 1 24 ARG HA . 24 . HA 1 1 222 1 2 1 1 24 ARG QG . 24 . HG2 1 1 223 1 1 1 1 1 CYS HA . 1 . HA 1 1 223 1 2 1 1 2 SER HB3 . 2 . HB1 1 1 224 1 1 1 1 18 ASP HA . 18 . HA 1 1 224 1 2 1 1 19 VAL HA . 19 . HA 1 1 225 1 1 1 1 21 TRP HA . 21 . HA 1 1 225 1 2 1 1 22 VAL HA . 22 . HA 1 1 226 1 1 1 1 3 CYS HA . 3 . HA 1 1 226 1 2 1 1 4 THR MG . 4 . HG2% 1 1 227 1 1 1 1 13 ASN HA . 13 . HA 1 1 227 1 2 1 1 16 HIS H . 16 . HN 1 1 228 1 1 1 1 19 VAL HB . 19 . HB 1 1 228 1 2 1 1 21 TRP HE1 . 21 . HE1 1 1 229 1 1 1 1 11 CYS HA . 11 . HA 1 1 229 1 2 1 1 12 MET H . 12 . HN 1 1 230 1 1 1 1 11 CYS H . 11 . HN 1 1 230 1 2 1 1 11 CYS QB . 11 . HB2 1 1 231 1 1 1 1 10 GLU H . 10 . HN 1 1 231 1 2 1 1 11 CYS QB . 11 . HB2 1 1 232 1 1 1 1 16 HIS HD2 . 16 . HD2 1 1 232 1 2 1 1 19 VAL QG . 19 . HG2% 1 1 233 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1 233 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 234 1 1 1 1 21 TRP HA . 21 . HA 1 1 234 1 2 1 1 21 TRP HB2 . 21 . HB2 1 1 235 1 1 1 1 11 CYS QB . 11 . HB2 1 1 235 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 236 1 1 1 1 22 VAL QG . 22 . HG2% 1 1 236 1 2 1 1 23 ASN HB3 . 23 . HB1 1 1 237 1 1 1 1 9 LEU MD2 . 9 . HD2% 1 1 237 1 2 1 1 13 ASN QB . 13 . HB2 1 1 238 1 1 1 1 6 MET HB3 . 6 . HB1 1 1 238 1 2 1 1 11 CYS H . 11 . HN 1 1 239 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 239 1 2 1 1 21 TRP H . 21 . HN 1 1 240 1 1 1 1 4 THR MG . 4 . HG2% 1 1 240 1 2 1 1 5 ASP HB3 . 5 . HB1 1 1 241 1 1 1 1 11 CYS HA . 11 . HA 1 1 241 1 2 1 1 13 ASN H . 13 . HN 1 1 242 1 1 1 1 14 PHE QE . 14 . HE% 1 1 242 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 243 1 1 1 1 3 CYS HA . 3 . HA 1 1 243 1 2 1 1 6 MET ME . 6 . HE% 1 1 244 1 1 1 1 3 CYS HA . 3 . HA 1 1 244 1 2 1 1 6 MET HB3 . 6 . HB1 1 1 245 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 245 1 2 1 1 6 MET ME . 6 . HE% 1 1 246 1 1 1 1 6 MET ME . 6 . HE% 1 1 246 1 2 1 1 14 PHE HB2 . 14 . HB2 1 1 247 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 247 1 2 1 1 21 TRP HB2 . 21 . HB2 1 1 248 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 248 1 2 1 1 21 TRP HB3 . 21 . HB1 1 1 249 1 1 1 1 18 ASP HB2 . 18 . HB2 1 1 249 1 2 1 1 20 ILE MD . 20 . HD1% 1 1 249 1 2 1 1 20 ILE MG . 20 . HG2% 1 1 250 1 1 1 1 18 ASP HB3 . 18 . HB1 1 1 250 1 2 1 1 20 ILE MD . 20 . HD1% 1 1 250 1 2 1 1 20 ILE MG . 20 . HG2% 1 1 251 1 1 1 1 4 THR MG . 4 . HG2% 1 1 251 1 2 1 1 5 ASP H . 5 . HN 1 1 252 1 1 1 1 5 ASP H . 5 . HN 1 1 252 1 2 1 1 5 ASP HB3 . 5 . HB1 1 1 253 1 1 1 1 5 ASP H . 5 . HN 1 1 253 1 2 1 1 5 ASP HB2 . 5 . HB2 1 1 254 1 1 1 1 5 ASP H . 5 . HN 1 1 254 1 2 1 1 5 ASP HA . 5 . HA 1 1 255 1 1 1 1 4 THR HA . 4 . HA 1 1 255 1 2 1 1 5 ASP H . 5 . HN 1 1 256 1 1 1 1 4 THR HB . 4 . HB 1 1 256 1 2 1 1 5 ASP H . 5 . HN 1 1 257 1 1 1 1 7 SER HA . 7 . HA 1 1 257 1 2 1 1 8 ASP H . 8 . HN 1 1 258 1 1 1 1 8 ASP H . 8 . HN 1 1 258 1 2 1 1 8 ASP HA . 8 . HA 1 1 259 1 1 1 1 7 SER HB2 . 7 . HB2 1 1 259 1 2 1 1 8 ASP H . 8 . HN 1 1 260 1 1 1 1 2 SER QB . 2 . HB2 1 1 260 1 2 1 1 3 CYS H . 3 . HN 1 1 261 1 1 1 1 2 SER HA . 2 . HA 1 1 261 1 2 1 1 3 CYS H . 3 . HN 1 1 262 1 1 1 1 7 SER HB3 . 7 . HB1 1 1 262 1 2 1 1 8 ASP H . 8 . HN 1 1 263 1 1 1 1 8 ASP H . 8 . HN 1 1 263 1 2 1 1 8 ASP HB3 . 8 . HB1 1 1 264 1 1 1 1 8 ASP H . 8 . HN 1 1 264 1 2 1 1 8 ASP HB2 . 8 . HB2 1 1 265 1 1 1 1 3 CYS H . 3 . HN 1 1 265 1 2 1 1 3 CYS HB3 . 3 . HB1 1 1 266 1 1 1 1 3 CYS H . 3 . HN 1 1 266 1 2 1 1 11 CYS QB . 11 . HB2 1 1 267 1 1 1 1 11 CYS H . 11 . HN 1 1 267 1 2 1 1 11 CYS HA . 11 . HA 1 1 268 1 1 1 1 10 GLU HA . 10 . HA 1 1 268 1 2 1 1 11 CYS H . 11 . HN 1 1 269 1 1 1 1 8 ASP HA . 8 . HA 1 1 269 1 2 1 1 11 CYS H . 11 . HN 1 1 270 1 1 1 1 11 CYS HA . 11 . HA 1 1 270 1 2 1 1 15 CYS H . 15 . HN 1 1 271 1 1 1 1 13 ASN HA . 13 . HA 1 1 271 1 2 1 1 15 CYS H . 15 . HN 1 1 272 1 1 1 1 12 MET HA . 12 . HA 1 1 272 1 2 1 1 15 CYS H . 15 . HN 1 1 273 1 1 1 1 14 PHE H . 14 . HN 1 1 273 1 2 1 1 14 PHE HA . 14 . HA 1 1 274 1 1 1 1 13 ASN HA . 13 . HA 1 1 274 1 2 1 1 14 PHE H . 14 . HN 1 1 275 1 1 1 1 11 CYS HA . 11 . HA 1 1 275 1 2 1 1 14 PHE H . 14 . HN 1 1 276 1 1 1 1 8 ASP HA . 8 . HA 1 1 276 1 2 1 1 9 LEU H . 9 . HN 1 1 277 1 1 1 1 9 LEU H . 9 . HN 1 1 277 1 2 1 1 9 LEU HA . 9 . HA 1 1 278 1 1 1 1 7 SER HA . 7 . HA 1 1 278 1 2 1 1 9 LEU H . 9 . HN 1 1 279 1 1 1 1 7 SER HB2 . 7 . HB2 1 1 279 1 2 1 1 9 LEU H . 9 . HN 1 1 280 1 1 1 1 22 VAL HA . 22 . HA 1 1 280 1 2 1 1 23 ASN H . 23 . HN 1 1 281 1 1 1 1 9 LEU HA . 9 . HA 1 1 281 1 2 1 1 12 MET H . 12 . HN 1 1 282 1 1 1 1 7 SER H . 7 . HN 1 1 282 1 2 1 1 7 SER HB3 . 7 . HB1 1 1 283 1 1 1 1 2 SER HA . 2 . HA 1 1 283 1 2 1 1 4 THR H . 4 . HN 1 1 284 1 1 1 1 13 ASN HA . 13 . HA 1 1 284 1 2 1 1 17 LYS H . 17 . HN 1 1 285 1 1 1 1 6 MET H . 6 . HN 1 1 285 1 2 1 1 6 MET HA . 6 . HA 1 1 286 1 1 1 1 5 ASP HA . 5 . HA 1 1 286 1 2 1 1 6 MET H . 6 . HN 1 1 287 1 1 1 1 14 PHE HA . 14 . HA 1 1 287 1 2 1 1 16 HIS H . 16 . HN 1 1 288 1 1 1 1 12 MET HA . 12 . HA 1 1 288 1 2 1 1 16 HIS H . 16 . HN 1 1 289 1 1 1 1 10 GLU H . 10 . HN 1 1 289 1 2 1 1 10 GLU HA . 10 . HA 1 1 290 1 1 1 1 7 SER HB2 . 7 . HB2 1 1 290 1 2 1 1 10 GLU H . 10 . HN 1 1 291 1 1 1 1 10 GLU HB3 . 10 . HB1 1 1 291 1 2 1 1 11 CYS H . 11 . HN 1 1 292 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1 292 1 2 1 1 11 CYS H . 11 . HN 1 1 293 1 1 1 1 15 CYS H . 15 . HN 1 1 293 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 294 1 1 1 1 14 PHE H . 14 . HN 1 1 294 1 2 1 1 14 PHE QB . 14 . HB2 1 1 295 1 1 1 1 18 ASP H . 18 . HN 1 1 295 1 2 1 1 18 ASP HB2 . 18 . HB2 1 1 296 1 1 1 1 21 TRP HB2 . 21 . HB2 1 1 296 1 2 1 1 23 ASN H . 23 . HN 1 1 297 1 1 1 1 7 SER H . 7 . HN 1 1 297 1 2 1 1 10 GLU HB2 . 10 . HB2 1 1 298 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 298 1 2 1 1 4 THR H . 4 . HN 1 1 299 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 299 1 2 1 1 4 THR H . 4 . HN 1 1 300 1 1 1 1 4 THR H . 4 . HN 1 1 300 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 301 1 1 1 1 4 THR H . 4 . HN 1 1 301 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 302 1 1 1 1 6 MET H . 6 . HN 1 1 302 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 303 1 1 1 1 6 MET H . 6 . HN 1 1 303 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 304 1 1 1 1 6 MET H . 6 . HN 1 1 304 1 2 1 1 6 MET HB2 . 6 . HB2 1 1 305 1 1 1 1 15 CYS HB3 . 15 . HB1 1 1 305 1 2 1 1 16 HIS H . 16 . HN 1 1 306 1 1 1 1 18 ASP HB3 . 18 . HB1 1 1 306 1 2 1 1 19 VAL H . 19 . HN 1 1 307 1 1 1 1 11 CYS QB . 11 . HB2 1 1 307 1 2 1 1 13 ASN H . 13 . HN 1 1 308 1 1 1 1 21 TRP HB3 . 21 . HB1 1 1 308 1 2 1 1 22 VAL H . 22 . HN 1 1 309 1 1 1 1 10 GLU H . 10 . HN 1 1 309 1 2 1 1 10 GLU HB3 . 10 . HB1 1 1 310 1 1 1 1 10 GLU H . 10 . HN 1 1 310 1 2 1 1 10 GLU QG . 10 . HG2 1 1 311 1 1 1 1 9 LEU H . 9 . HN 1 1 311 1 2 1 1 9 LEU QB . 9 . HB2 1 1 312 1 1 1 1 9 LEU H . 9 . HN 1 1 312 1 2 1 1 10 GLU HB3 . 10 . HB1 1 1 313 1 1 1 1 6 MET HB3 . 6 . HB1 1 1 313 1 2 1 1 7 SER H . 7 . HN 1 1 314 1 1 1 1 21 TRP H . 21 . HN 1 1 314 1 2 1 1 22 VAL QG . 22 . HG1% 1 1 315 1 1 1 1 20 ILE HG13 . 20 . HG12 1 1 315 1 2 1 1 21 TRP H . 21 . HN 1 1 316 1 1 1 1 19 VAL HB . 19 . HB 1 1 316 1 2 1 1 21 TRP H . 21 . HN 1 1 317 1 1 1 1 19 VAL HB . 19 . HB 1 1 317 1 2 1 1 20 ILE H . 20 . HN 1 1 318 1 1 1 1 6 MET H . 6 . HN 1 1 318 1 2 1 1 6 MET HB3 . 6 . HB1 1 1 319 1 1 1 1 17 LYS HG2 . 17 . HG2 1 1 319 1 2 1 1 19 VAL H . 19 . HN 1 1 320 1 1 1 1 17 LYS HB3 . 17 . HB1 1 1 320 1 2 1 1 19 VAL H . 19 . HN 1 1 321 1 1 1 1 9 LEU MD1 . 9 . HD1% 1 1 321 1 2 1 1 13 ASN H . 13 . HN 1 1 322 1 1 1 1 9 LEU HG . 9 . HG 1 1 322 1 2 1 1 13 ASN H . 13 . HN 1 1 323 1 1 1 1 9 LEU QB . 9 . HB2 1 1 323 1 2 1 1 13 ASN H . 13 . HN 1 1 324 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 324 1 2 1 1 22 VAL H . 22 . HN 1 1 325 1 1 1 1 9 LEU QB . 9 . HB2 1 1 325 1 2 1 1 10 GLU H . 10 . HN 1 1 326 1 1 1 1 9 LEU MD2 . 9 . HD2% 1 1 326 1 2 1 1 10 GLU H . 10 . HN 1 1 327 1 1 1 1 9 LEU MD1 . 9 . HD1% 1 1 327 1 2 1 1 10 GLU H . 10 . HN 1 1 328 1 1 1 1 9 LEU HB3 . 9 . HB1 1 1 328 1 2 1 1 13 ASN HD22 . 13 . HD22 1 1 329 1 1 1 1 9 LEU MD1 . 9 . HD1% 1 1 329 1 2 1 1 13 ASN HD21 . 13 . HD21 1 1 330 1 1 1 1 6 MET ME . 6 . HE% 1 1 330 1 2 1 1 14 PHE QR . 14 . HD% 1 1 331 1 1 1 1 6 MET ME . 6 . HE% 1 1 331 1 2 1 1 14 PHE HZ . 14 . HZ 1 1 332 1 1 1 1 21 TRP HB2 . 21 . HB2 1 1 332 1 2 1 1 21 TRP HE3 . 21 . HE3 1 1 333 1 1 1 1 21 TRP HB3 . 21 . HB1 1 1 333 1 2 1 1 21 TRP HE3 . 21 . HE3 1 1 334 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 334 1 2 1 1 21 TRP HE3 . 21 . HE3 1 1 335 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 335 1 2 1 1 21 TRP HD1 . 21 . HD1 1 1 336 1 1 1 1 19 VAL QG . 19 . HG2% 1 1 336 1 2 1 1 21 TRP HZ3 . 21 . HZ3 1 1 337 1 1 1 1 4 THR H . 4 . HN 1 1 337 1 2 1 1 5 ASP H . 5 . HN 1 1 338 1 1 1 1 5 ASP H . 5 . HN 1 1 338 1 2 1 1 6 MET H . 6 . HN 1 1 339 1 1 1 1 2 SER H . 2 . HN 1 1 339 1 2 1 1 3 CYS H . 3 . HN 1 1 340 1 1 1 1 7 SER H . 7 . HN 1 1 340 1 2 1 1 8 ASP H . 8 . HN 1 1 341 1 1 1 1 15 CYS H . 15 . HN 1 1 341 1 2 1 1 16 HIS H . 16 . HN 1 1 342 1 1 1 1 17 LYS H . 17 . HN 1 1 342 1 2 1 1 18 ASP H . 18 . HN 1 1 343 1 1 1 1 18 ASP H . 18 . HN 1 1 343 1 2 1 1 19 VAL H . 19 . HN 1 1 344 1 1 1 1 15 CYS H . 15 . HN 1 1 344 1 2 1 1 17 LYS H . 17 . HN 1 1 345 1 1 1 1 21 TRP H . 21 . HN 1 1 345 1 2 1 1 22 VAL H . 22 . HN 1 1 346 1 1 1 1 2 SER HA . 2 . HA 1 1 346 1 2 1 1 2 SER QB . 2 . HB2 1 1 347 1 1 1 1 4 THR HA . 4 . HA 1 1 347 1 2 1 1 4 THR HB . 4 . HB 1 1 348 1 1 1 1 3 CYS HA . 3 . HA 1 1 348 1 2 1 1 3 CYS HB3 . 3 . HB1 1 1 349 1 1 1 1 5 ASP HA . 5 . HA 1 1 349 1 2 1 1 5 ASP HB2 . 5 . HB2 1 1 350 1 1 1 1 14 PHE HA . 14 . HA 1 1 350 1 2 1 1 14 PHE QB . 14 . HB2 1 1 351 1 1 1 1 11 CYS HA . 11 . HA 1 1 351 1 2 1 1 11 CYS QB . 11 . HB2 1 1 352 1 1 1 1 17 LYS HA . 17 . HA 1 1 352 1 2 1 1 18 ASP HB3 . 18 . HB1 1 1 353 1 1 1 1 17 LYS HA . 17 . HA 1 1 353 1 2 1 1 18 ASP HB2 . 18 . HB2 1 1 354 1 1 1 1 4 THR HB . 4 . HB 1 1 354 1 2 1 1 4 THR MG . 4 . HG2% 1 1 355 1 1 1 1 12 MET HB3 . 12 . HB1 1 1 355 1 2 1 1 13 ASN HA . 13 . HA 1 1 356 1 1 1 1 10 GLU HA . 10 . HA 1 1 356 1 2 1 1 13 ASN QB . 13 . HB2 1 1 357 1 1 1 1 12 MET HA . 12 . HA 1 1 357 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 358 1 1 1 1 12 MET HA . 12 . HA 1 1 358 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 359 1 1 1 1 9 LEU HA . 9 . HA 1 1 359 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 360 1 1 1 1 6 MET HG3 . 6 . HG1 1 1 360 1 2 1 1 10 GLU QG . 10 . HG2 1 1 361 1 1 1 1 11 CYS QB . 11 . HB2 1 1 361 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 362 1 1 1 1 11 CYS HB3 . 11 . HB1 1 1 362 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 363 1 1 1 1 6 MET HB3 . 6 . HB1 1 1 363 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 364 1 1 1 1 6 MET HB3 . 6 . HB1 1 1 364 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 365 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1 365 1 2 1 1 10 GLU QG . 10 . HG2 1 1 366 1 1 1 1 12 MET HB2 . 12 . HB2 1 1 366 1 2 1 1 12 MET HG2 . 12 . HG2 1 1 367 1 1 1 1 6 MET HB3 . 6 . HB1 1 1 367 1 2 1 1 11 CYS QB . 11 . HB2 1 1 368 1 1 1 1 20 ILE HA . 20 . HA 1 1 368 1 2 1 1 20 ILE HG12 . 20 . HG11 1 1 369 1 1 1 1 19 VAL QG . 19 . HG1% 1 1 369 1 2 1 1 20 ILE HA . 20 . HA 1 1 370 1 1 1 1 9 LEU HA . 9 . HA 1 1 370 1 2 1 1 9 LEU QB . 9 . HB2 1 1 371 1 1 1 1 19 VAL HA . 19 . HA 1 1 371 1 2 1 1 20 ILE HB . 20 . HB 1 1 372 1 1 1 1 12 MET HA . 12 . HA 1 1 372 1 2 1 1 12 MET HB3 . 12 . HB1 1 1 373 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 373 1 2 1 1 6 MET HB3 . 6 . HB1 1 1 374 1 1 1 1 10 GLU HB3 . 10 . HB1 1 1 374 1 2 1 1 11 CYS QB . 11 . HB2 1 1 375 1 1 1 1 11 CYS QB . 11 . HB2 1 1 375 1 2 1 1 12 MET HB2 . 12 . HB2 1 1 376 1 1 1 1 12 MET HB3 . 12 . HB1 1 1 376 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 377 1 1 1 1 12 MET HB2 . 12 . HB2 1 1 377 1 2 1 1 12 MET HG3 . 12 . HG1 1 1 378 1 1 1 1 21 TRP HB2 . 21 . HB2 1 1 378 1 2 1 1 22 VAL QG . 22 . HG1% 1 1 379 1 1 1 1 21 TRP HB3 . 21 . HB1 1 1 379 1 2 1 1 22 VAL QG . 22 . HG1% 1 1 380 1 1 1 1 22 VAL QG . 22 . HG2% 1 1 380 1 2 1 1 23 ASN HB2 . 23 . HB2 1 1 381 1 1 1 1 18 ASP HB3 . 18 . HB1 1 1 381 1 2 1 1 20 ILE MD . 20 . HD1% 1 1 382 1 1 1 1 19 VAL QG . 19 . HG1% 1 1 382 1 2 1 1 21 TRP HB2 . 21 . HB2 1 1 383 1 1 1 1 18 ASP HB2 . 18 . HB2 1 1 383 1 2 1 1 19 VAL QG . 19 . HG1% 1 1 384 1 1 1 1 18 ASP HB2 . 18 . HB2 1 1 384 1 2 1 1 20 ILE MD . 20 . HD1% 1 1 385 1 1 1 1 20 ILE HB . 20 . HB 1 1 385 1 2 1 1 20 ILE MG . 20 . HG2% 1 1 386 1 1 1 1 20 ILE MD . 20 . HD1% 1 1 386 1 1 1 1 20 ILE MG . 20 . HG2% 1 1 386 1 2 1 1 20 ILE HG12 . 20 . HG11 1 1 387 1 1 1 1 11 CYS HA . 11 . HA 1 1 387 1 2 1 1 14 PHE QB . 14 . HB2 1 1 388 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 388 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 389 1 1 1 1 6 MET HB2 . 6 . HB2 1 1 389 1 2 1 1 7 SER H . 7 . HN 1 1 390 1 1 1 1 6 MET HG2 . 6 . HG2 1 1 390 1 2 1 1 11 CYS H . 11 . HN 1 1 391 1 1 1 1 14 PHE QD . 14 . HD% 1 1 391 1 2 1 1 15 CYS HB3 . 15 . HB1 1 1 392 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 392 1 2 1 1 4 THR HA . 4 . HA 1 1 393 1 1 1 1 6 MET ME . 6 . HE% 1 1 393 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 394 1 1 1 1 6 MET ME . 6 . HE% 1 1 394 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 395 1 1 1 1 6 MET HB2 . 6 . HB2 1 1 395 1 2 1 1 6 MET ME . 6 . HE% 1 1 396 1 1 1 1 2 SER QB . 2 . HB2 1 1 396 1 2 1 1 4 THR MG . 4 . HG2% 1 1 397 1 1 1 1 3 CYS HA . 3 . HA 1 1 397 1 2 1 1 6 MET HG2 . 6 . HG2 1 1 398 1 1 1 1 3 CYS HA . 3 . HA 1 1 398 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 399 1 1 1 1 6 MET HG3 . 6 . HG1 1 1 399 1 2 1 1 11 CYS QB . 11 . HB2 1 1 400 1 1 1 1 6 MET ME . 6 . HE% 1 1 400 1 2 1 1 14 PHE QB . 14 . HB2 1 1 401 1 1 1 1 6 MET ME . 6 . HE% 1 1 401 1 2 1 1 11 CYS QB . 11 . HB2 1 1 402 1 1 1 1 9 LEU HA . 9 . HA 1 1 402 1 2 1 1 12 MET ME . 12 . HE% 1 1 403 1 1 1 1 9 LEU MD1 . 9 . HD1% 1 1 403 1 2 1 1 12 MET ME . 12 . HE% 1 1 404 1 1 1 1 9 LEU HG . 9 . HG 1 1 404 1 2 1 1 12 MET ME . 12 . HE% 1 1 405 1 1 1 1 9 LEU QB . 9 . HB2 1 1 405 1 2 1 1 12 MET ME . 12 . HE% 1 1 406 1 1 1 1 6 MET HB2 . 6 . HB2 1 1 406 1 2 1 1 6 MET HG3 . 6 . HG1 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.8 1.8 3.8 1 1 2 1 . . . . . 2.1 1.5 2.7 1 1 3 1 . . . . . 2.5 1.7 3.3 1 1 4 1 . . . . . 3.4 2.0 4.8 1 1 5 1 . . . . . 3.2 1.9 4.5 1 1 6 1 . . . . . 2.8 1.8 3.8 1 1 7 1 . . . . . 3.0 1.9 4.1 1 1 8 1 . . . . . 2.8 1.8 3.8 1 1 9 1 . . . . . 3.2 1.9 4.5 1 1 10 1 . . . . . 4.4 2.0 6.0 1 1 11 1 . . . . . 2.6 1.8 3.4 1 1 12 1 . . . . . 2.8 1.8 3.8 1 1 13 1 . . . . . 2.4 1.7 3.1 1 1 14 1 . . . . . 3.3 2.0 4.6 1 1 15 1 . . . . . 3.1 1.9 4.3 1 1 16 1 . . . . . 2.3 1.6 3.0 1 1 17 1 . . . . . 4.0 2.0 6.0 1 1 18 1 . . . . . 3.7 2.0 5.4 1 1 19 1 . . . . . 4.4 2.0 6.0 1 1 20 1 . . . . . 4.2 2.0 6.0 1 1 21 1 . . . . . 3.5 1.9 5.1 1 1 22 1 . . . . . 4.5 2.0 6.0 1 1 23 1 . . . . . 2.8 1.8 3.8 1 1 24 1 . . . . . 2.9 1.9 3.9 1 1 25 1 . . . . . 2.9 1.8 4.0 1 1 26 1 . . . . . 2.8 1.8 3.8 1 1 27 1 . . . . . 2.6 1.7 3.5 1 1 28 1 . . . . . 3.4 1.9 4.9 1 1 29 1 . . . . . 2.7 1.9 3.6 1 1 30 1 . . . . . 2.6 1.8 3.4 1 1 31 1 . . . . . 3.9 2.0 5.8 1 1 32 1 . . . . . 2.6 1.7 3.5 1 1 33 1 . . . . . 2.6 1.7 3.5 1 1 34 1 . . . . . 2.7 1.8 3.6 1 1 35 1 . . . . . 3.5 2.0 5.0 1 1 36 1 . . . . . 3.9 2.0 5.6 1 1 37 1 . . . . . 4.1 2.0 6.0 1 1 38 1 . . . . . 2.6 1.8 3.4 1 1 39 1 . . . . . 2.8 1.8 3.8 1 1 40 1 . . . . . 3.0 1.9 4.1 1 1 41 1 . . . . . 3.8 2.0 5.6 1 1 42 1 . . . . . 3.2 2.0 4.4 1 1 43 1 . . . . . 2.5 1.7 3.3 1 1 44 1 . . . . . 3.0 1.9 4.1 1 1 45 1 . . . . . 2.4 1.7 3.1 1 1 46 1 . . . . . 2.3 1.6 3.0 1 1 47 1 . . . . . 3.0 1.9 4.1 1 1 48 1 . . . . . 3.5 2.0 5.0 1 1 49 1 . . . . . 2.4 1.7 3.1 1 1 50 1 . . . . . 2.5 1.7 3.3 1 1 51 1 . . . . . 2.8 1.8 3.8 1 1 52 1 . . . . . 2.3 1.6 3.0 1 1 53 1 . . . . . 3.4 2.0 4.8 1 1 54 1 . . . . . 3.7 2.0 5.4 1 1 55 1 . . . . . 2.4 1.7 3.1 1 1 56 1 . . . . . 2.7 1.8 3.6 1 1 57 1 . . . . . 2.5 1.7 3.3 1 1 58 1 . . . . . 2.2 1.6 2.8 1 1 59 1 . . . . . 2.9 1.9 3.9 1 1 60 1 . . . . . 3.6 2.0 5.2 1 1 61 1 . . . . . 2.6 1.8 3.4 1 1 62 1 . . . . . 2.0 1.5 2.5 1 1 63 1 . . . . . 2.2 1.6 2.8 1 1 64 1 . . . . . 3.4 1.9 4.9 1 1 65 1 . . . . . 2.9 1.8 4.0 1 1 66 1 . . . . . 3.7 2.0 4.3 1 1 67 1 . . . . . 3.2 0.0 6.0 1 1 68 1 . . . . . 2.5 1.7 3.3 1 1 69 1 . . . . . 3.0 1.9 4.1 1 1 70 1 . . . . . 3.1 0.0 6.0 1 1 71 1 . . . . . 2.8 1.8 3.8 1 1 72 1 . . . . . 2.7 1.8 3.6 1 1 73 1 . . . . . 3.1 1.9 4.3 1 1 74 1 . . . . . 2.7 0.0 6.0 1 1 75 1 . . . . . 4.6 2.0 6.0 1 1 76 1 . . . . . 3.8 2.0 5.6 1 1 77 1 . . . . . 4.2 2.0 6.0 1 1 78 1 . . . . . 3.6 2.0 5.2 1 1 79 1 . . . . . 2.6 1.8 3.4 1 1 80 1 . . . . . 2.4 1.7 3.1 1 1 81 1 . . . . . 4.3 2.0 6.0 1 1 82 1 . . . . . 5.2 1.9 6.0 1 1 83 1 . . . . . 2.7 1.8 3.6 1 1 84 1 . . . . . 3.0 1.9 3.3 1 1 85 1 . . . . . 3.2 2.0 4.4 1 1 86 1 . . . . . 2.4 1.7 3.1 1 1 87 1 . . . . . 3.7 2.0 5.4 1 1 88 1 . . . . . 6.0 1.4 6.0 1 1 89 1 . . . . . 2.6 1.7 3.5 1 1 90 1 . . . . . 2.9 1.9 3.9 1 1 91 1 . . . . . 3.2 1.9 4.5 1 1 92 1 . . . . . 2.1 1.5 2.7 1 1 93 1 . . . . . 2.8 1.8 3.8 1 1 94 1 . . . . . 3.3 1.9 4.7 1 1 95 1 . . . . . 4.9 1.9 6.0 1 1 96 1 . . . . . 5.6 1.7 6.0 1 1 97 1 . . . . . 5.1 1.8 6.0 1 1 98 1 . . . . . 5.1 1.8 6.0 1 1 99 1 . . . . . 2.8 1.8 3.8 1 1 100 1 . . . . . 2.2 1.6 2.8 1 1 101 1 . . . . . 2.5 1.7 3.3 1 1 102 1 . . . . . 2.8 1.8 3.8 1 1 103 1 . . . . . 3.5 2.0 5.0 1 1 104 1 . . . . . 4.4 2.0 6.0 1 1 105 1 . . . . . 5.2 1.9 6.0 1 1 106 1 . . . . . 5.1 1.9 6.0 1 1 107 1 . . . . . 2.4 1.7 3.1 1 1 108 1 . . . . . 3.1 1.9 4.3 1 1 109 1 . . . . . 4.6 1.9 6.0 1 1 110 1 . . . . . 4.5 2.0 6.0 1 1 111 1 . . . . . 4.9 1.9 6.0 1 1 112 1 . . . . . 2.7 1.8 3.6 1 1 113 1 . . . . . 3.4 1.9 4.9 1 1 114 1 . . . . . 3.2 1.9 4.5 1 1 115 1 . . . . . 4.5 2.0 6.0 1 1 116 1 . . . . . 3.3 1.9 4.7 1 1 117 1 . . . . . 4.3 1.9 6.0 1 1 118 1 . . . . . 4.6 1.9 6.0 1 1 119 1 . . . . . 4.7 1.9 6.0 1 1 120 1 . . . . . 2.9 1.8 4.0 1 1 121 1 . . . . . 3.4 2.0 4.8 1 1 122 1 . . . . . 3.9 2.0 5.8 1 1 123 1 . . . . . 3.3 1.9 4.7 1 1 124 1 . . . . . 3.8 2.0 5.6 1 1 125 1 . . . . . 3.6 2.0 5.2 1 1 126 1 . . . . . 4.8 1.9 6.0 1 1 127 1 . . . . . 5.6 1.7 6.0 1 1 128 1 . . . . . 3.7 2.0 5.4 1 1 129 1 . . . . . 3.8 2.0 5.5 1 1 130 1 . . . . . 4.2 2.0 6.0 1 1 131 1 . . . . . 4.2 2.0 6.0 1 1 132 1 . . . . . 4.4 2.0 6.0 1 1 133 1 . . . . . 3.8 2.0 5.6 1 1 134 1 . . . . . 2.7 0.0 6.0 1 1 135 1 . . . . . 3.4 1.9 4.9 1 1 136 1 . . . . . 3.0 1.8 4.2 1 1 137 1 . . . . . 3.8 2.0 5.6 1 1 138 1 . . . . . 5.1 1.8 6.0 1 1 139 1 . . . . . 2.7 1.8 3.6 1 1 140 1 . . . . . 4.5 2.0 6.0 1 1 141 1 . . . . . 3.2 1.9 4.5 1 1 142 1 . . . . . 3.9 2.0 5.8 1 1 143 1 . . . . . 2.8 1.9 3.7 1 1 144 1 . . . . . 2.4 1.7 3.1 1 1 145 1 . . . . . 3.6 2.0 5.2 1 1 146 1 . . . . . 3.4 1.9 4.9 1 1 147 1 . . . . . 4.3 2.0 6.0 1 1 148 1 . . . . . 3.4 2.0 4.9 1 1 149 1 . . . . . 3.7 2.0 5.2 1 1 150 1 . . . . . 3.7 2.0 5.4 1 1 151 1 . . . . . 3.5 2.0 5.0 1 1 152 1 . . . . . 2.8 1.8 3.8 1 1 153 1 . . . . . 3.3 1.9 4.7 1 1 154 1 . . . . . 2.4 1.7 3.1 1 1 155 1 . . . . . 2.6 1.8 3.4 1 1 156 1 . . . . . 2.4 1.7 3.1 1 1 157 1 . . . . . 2.6 1.8 3.4 1 1 158 1 . . . . . 3.1 1.9 4.3 1 1 159 1 . . . . . 2.8 1.8 3.8 1 1 160 1 . . . . . 3.2 1.9 4.5 1 1 161 1 . . . . . 2.9 1.8 4.0 1 1 162 1 . . . . . 2.6 1.8 3.4 1 1 163 1 . . . . . 4.2 2.0 6.0 1 1 164 1 . . . . . 3.7 2.0 5.4 1 1 165 1 . . . . . 2.5 1.7 3.3 1 1 166 1 . . . . . 4.0 2.0 6.0 1 1 167 1 . . . . . 4.8 1.9 6.0 1 1 168 1 . . . . . 2.9 0.0 6.0 1 1 169 1 . . . . . 2.3 1.7 2.9 1 1 170 1 . . . . . 2.6 1.7 3.5 1 1 171 1 . . . . . 3.9 2.0 5.8 1 1 172 1 . . . . . 2.7 1.8 3.6 1 1 173 1 . . . . . 3.7 2.0 5.4 1 1 174 1 . . . . . 2.2 1.6 2.8 1 1 175 1 . . . . . 2.3 1.7 2.9 1 1 176 1 . . . . . 2.6 1.8 3.4 1 1 177 1 . . . . . 3.0 1.9 4.1 1 1 178 1 . . . . . 2.8 1.9 3.8 1 1 179 1 . . . . . 2.2 1.6 2.8 1 1 180 1 . . . . . 2.3 1.6 3.0 1 1 181 1 . . . . . 3.0 1.8 4.2 1 1 182 1 . . . . . 2.2 1.6 2.8 1 1 183 1 . . . . . 2.8 1.9 3.7 1 1 184 1 . . . . . 2.7 1.8 3.6 1 1 185 1 . . . . . 2.7 1.8 3.6 1 1 186 1 . . . . . 2.8 1.8 3.8 1 1 187 1 . . . . . 2.6 1.8 3.4 1 1 188 1 . . . . . 2.3 1.6 3.0 1 1 189 1 . . . . . 2.3 1.6 3.0 1 1 190 1 . . . . . 2.4 1.7 3.1 1 1 191 1 . . . . . 2.4 1.7 3.1 1 1 192 1 . . . . . 2.8 1.9 3.7 1 1 193 1 . . . . . 2.5 1.7 3.3 1 1 194 1 . . . . . 2.4 1.7 3.1 1 1 195 1 . . . . . 3.0 1.9 4.1 1 1 196 1 . . . . . 2.4 1.7 3.1 1 1 197 1 . . . . . 2.6 1.8 3.4 1 1 198 1 . . . . . 2.6 1.7 3.0 1 1 199 1 . . . . . 2.8 1.8 3.8 1 1 200 1 . . . . . 3.0 1.9 4.1 1 1 201 1 . . . . . 2.5 1.7 3.3 1 1 202 1 . . . . . 2.3 1.7 2.9 1 1 203 1 . . . . . 3.0 0.0 6.0 1 1 204 1 . . . . . 2.4 1.7 3.1 1 1 205 1 . . . . . 2.4 1.7 3.1 1 1 206 1 . . . . . 3.3 1.9 4.7 1 1 207 1 . . . . . 2.4 1.7 3.1 1 1 208 1 . . . . . 2.3 1.6 3.0 1 1 209 1 . . . . . 3.6 0.0 6.0 1 1 210 1 . . . . . 3.2 1.9 4.5 1 1 211 1 . . . . . 2.2 1.6 2.8 1 1 212 1 . . . . . 3.0 2.0 4.1 1 1 213 1 . . . . . 4.4 2.0 6.0 1 1 214 1 . . . . . 3.8 2.0 5.6 1 1 215 1 . . . . . 3.1 1.9 4.3 1 1 216 1 . . . . . 2.1 1.5 2.7 1 1 217 1 . . . . . 2.3 1.7 2.9 1 1 218 1 . . . . . 3.2 2.0 4.4 1 1 219 1 . . . . . 3.7 1.9 5.5 1 1 220 1 . . . . . 3.8 2.0 5.6 1 1 221 1 . . . . . 2.5 1.7 3.3 1 1 222 1 . . . . . 4.1 2.0 6.0 1 1 223 1 . . . . . 3.8 2.0 5.6 1 1 224 1 . . . . . 3.7 2.0 5.4 1 1 225 1 . . . . . 4.1 2.0 6.0 1 1 226 1 . . . . . 4.6 2.0 6.0 1 1 227 1 . . . . . 3.4 2.0 4.8 1 1 228 1 . . . . . 5.5 1.7 6.0 1 1 229 1 . . . . . 2.9 1.8 4.0 1 1 230 1 . . . . . 2.4 1.7 3.1 1 1 231 1 . . . . . 4.8 1.9 6.0 1 1 232 1 . . . . . 4.0 2.0 6.0 1 1 233 1 . . . . . 4.2 2.0 6.0 1 1 234 1 . . . . . 2.8 1.8 3.8 1 1 235 1 . . . . . 3.7 2.0 5.4 1 1 236 1 . . . . . 4.1 2.0 6.0 1 1 237 1 . . . . . 4.3 2.0 6.0 1 1 238 1 . . . . . 5.6 1.7 6.0 1 1 239 1 . . . . . 2.7 1.8 3.6 1 1 240 1 . . . . . 3.2 1.9 4.5 1 1 241 1 . . . . . 4.4 2.0 6.0 1 1 242 1 . . . . . 4.0 2.0 6.0 1 1 243 1 . . . . . 2.9 1.8 4.0 1 1 244 1 . . . . . 4.4 2.0 6.0 1 1 245 1 . . . . . 3.7 2.0 5.4 1 1 246 1 . . . . . 3.1 1.9 4.3 1 1 247 1 . . . . . 4.3 2.0 6.0 1 1 248 1 . . . . . 3.3 1.9 4.7 1 1 249 1 . . . . . 3.6 0.0 6.0 1 1 250 1 . . . . . 4.2 2.0 6.0 1 1 251 1 . . . . . 3.1 1.9 4.3 1 1 252 1 . . . . . 3.1 1.9 4.3 1 1 253 1 . . . . . 3.5 2.0 5.0 1 1 254 1 . . . . . 2.5 1.7 3.3 1 1 255 1 . . . . . 2.4 1.7 3.1 1 1 256 1 . . . . . 3.8 2.0 5.6 1 1 257 1 . . . . . 2.6 1.8 3.4 1 1 258 1 . . . . . 3.0 1.9 4.1 1 1 259 1 . . . . . 3.0 1.9 4.1 1 1 260 1 . . . . . 3.2 1.9 4.5 1 1 261 1 . . . . . 2.2 1.6 2.8 1 1 262 1 . . . . . 3.3 1.9 4.7 1 1 263 1 . . . . . 2.9 1.8 4.0 1 1 264 1 . . . . . 3.2 1.9 4.5 1 1 265 1 . . . . . 2.7 1.8 3.6 1 1 266 1 . . . . . 3.7 2.0 5.4 1 1 267 1 . . . . . 2.8 1.8 3.8 1 1 268 1 . . . . . 3.1 1.9 4.3 1 1 269 1 . . . . . 3.3 1.9 4.7 1 1 270 1 . . . . . 3.0 1.9 4.1 1 1 271 1 . . . . . 3.8 2.0 5.6 1 1 272 1 . . . . . 3.1 1.9 4.3 1 1 273 1 . . . . . 2.5 1.7 3.3 1 1 274 1 . . . . . 2.9 1.9 3.9 1 1 275 1 . . . . . 3.5 2.0 5.0 1 1 276 1 . . . . . 2.7 1.8 3.6 1 1 277 1 . . . . . 2.7 1.8 3.6 1 1 278 1 . . . . . 3.7 1.9 5.5 1 1 279 1 . . . . . 3.5 2.0 5.0 1 1 280 1 . . . . . 2.3 1.7 2.9 1 1 281 1 . . . . . 2.9 1.9 3.9 1 1 282 1 . . . . . 2.4 1.7 3.1 1 1 283 1 . . . . . 3.8 2.0 5.6 1 1 284 1 . . . . . 3.8 2.0 5.6 1 1 285 1 . . . . . 2.7 1.8 3.6 1 1 286 1 . . . . . 2.6 1.8 3.4 1 1 287 1 . . . . . 4.2 2.0 6.0 1 1 288 1 . . . . . 2.9 1.9 3.9 1 1 289 1 . . . . . 2.5 1.7 3.3 1 1 290 1 . . . . . 4.0 2.0 6.0 1 1 291 1 . . . . . 2.7 1.8 3.6 1 1 292 1 . . . . . 3.5 2.0 5.0 1 1 293 1 . . . . . 2.2 1.6 2.8 1 1 294 1 . . . . . 2.4 1.7 3.1 1 1 295 1 . . . . . 2.9 1.9 3.9 1 1 296 1 . . . . . 3.3 1.9 4.7 1 1 297 1 . . . . . 2.7 1.8 3.6 1 1 298 1 . . . . . 3.3 1.9 4.7 1 1 299 1 . . . . . 3.9 2.0 5.8 1 1 300 1 . . . . . 3.9 2.0 5.8 1 1 301 1 . . . . . 4.3 1.9 6.0 1 1 302 1 . . . . . 3.2 2.0 4.4 1 1 303 1 . . . . . 3.5 2.0 5.0 1 1 304 1 . . . . . 3.1 1.9 4.3 1 1 305 1 . . . . . 2.9 1.9 3.9 1 1 306 1 . . . . . 3.2 1.9 4.5 1 1 307 1 . . . . . 4.5 2.0 6.0 1 1 308 1 . . . . . 3.7 2.0 5.4 1 1 309 1 . . . . . 2.4 1.7 3.1 1 1 310 1 . . . . . 3.5 2.0 5.0 1 1 311 1 . . . . . 2.3 1.6 3.0 1 1 312 1 . . . . . 4.1 2.0 6.0 1 1 313 1 . . . . . 2.9 1.8 4.0 1 1 314 1 . . . . . 3.9 2.0 5.8 1 1 315 1 . . . . . 3.4 1.9 4.9 1 1 316 1 . . . . . 4.1 2.0 6.0 1 1 317 1 . . . . . 3.1 1.9 4.3 1 1 318 1 . . . . . 2.6 1.8 3.4 1 1 319 1 . . . . . 4.3 2.0 6.0 1 1 320 1 . . . . . 3.7 0.0 6.0 1 1 321 1 . . . . . 5.8 1.6 6.0 1 1 322 1 . . . . . 5.6 1.6 6.0 1 1 323 1 . . . . . 5.4 1.7 6.0 1 1 324 1 . . . . . 3.4 2.0 4.8 1 1 325 1 . . . . . 3.0 1.9 4.1 1 1 326 1 . . . . . 6.0 1.2 6.0 1 1 327 1 . . . . . 6.0 1.0 6.0 1 1 328 1 . . . . . 4.4 2.0 6.0 1 1 329 1 . . . . . 4.9 1.9 6.0 1 1 330 1 . . . . . 2.5 1.7 3.3 1 1 331 1 . . . . . 3.3 2.0 4.6 1 1 332 1 . . . . . 2.7 1.8 3.6 1 1 333 1 . . . . . 3.9 2.0 5.8 1 1 334 1 . . . . . 4.0 2.0 6.0 1 1 335 1 . . . . . 3.9 2.0 5.8 1 1 336 1 . . . . . 4.0 2.0 6.0 1 1 337 1 . . . . . 3.0 1.8 4.2 1 1 338 1 . . . . . 2.9 1.8 4.0 1 1 339 1 . . . . . 3.3 1.9 4.7 1 1 340 1 . . . . . 2.9 1.8 4.0 1 1 341 1 . . . . . 2.2 1.6 2.8 1 1 342 1 . . . . . 2.6 1.8 3.4 1 1 343 1 . . . . . 2.6 1.7 3.5 1 1 344 1 . . . . . 3.0 1.8 4.2 1 1 345 1 . . . . . 2.6 1.7 3.5 1 1 346 1 . . . . . 2.5 1.7 3.3 1 1 347 1 . . . . . 2.2 1.6 2.8 1 1 348 1 . . . . . 2.5 1.7 3.3 1 1 349 1 . . . . . 2.7 1.8 3.6 1 1 350 1 . . . . . 2.6 1.8 3.4 1 1 351 1 . . . . . 2.1 1.5 2.7 1 1 352 1 . . . . . 4.5 2.0 6.0 1 1 353 1 . . . . . 4.3 2.0 6.0 1 1 354 1 . . . . . 2.2 1.6 2.8 1 1 355 1 . . . . . 3.6 2.0 5.2 1 1 356 1 . . . . . 2.2 1.6 2.8 1 1 357 1 . . . . . 2.9 1.9 3.9 1 1 358 1 . . . . . 2.8 1.8 3.8 1 1 359 1 . . . . . 3.6 2.0 5.2 1 1 360 1 . . . . . 2.6 1.7 3.5 1 1 361 1 . . . . . 2.7 1.8 3.6 1 1 362 1 . . . . . 3.1 1.9 4.3 1 1 363 1 . . . . . 2.4 1.7 3.1 1 1 364 1 . . . . . 2.5 1.7 3.3 1 1 365 1 . . . . . 2.2 1.6 2.8 1 1 366 1 . . . . . 2.6 1.8 3.4 1 1 367 1 . . . . . 3.0 1.9 4.1 1 1 368 1 . . . . . 2.7 1.8 3.6 1 1 369 1 . . . . . 4.1 2.0 6.0 1 1 370 1 . . . . . 2.2 1.6 2.8 1 1 371 1 . . . . . 3.8 2.0 5.6 1 1 372 1 . . . . . 2.3 1.6 3.0 1 1 373 1 . . . . . 3.0 1.8 4.2 1 1 374 1 . . . . . 3.3 2.0 4.6 1 1 375 1 . . . . . 4.4 2.0 6.0 1 1 376 1 . . . . . 2.4 1.7 3.1 1 1 377 1 . . . . . 2.1 1.5 2.7 1 1 378 1 . . . . . 3.7 2.0 5.4 1 1 379 1 . . . . . 3.7 2.0 5.4 1 1 380 1 . . . . . 3.8 2.0 5.6 1 1 381 1 . . . . . 4.7 1.9 6.0 1 1 382 1 . . . . . 5.5 1.7 6.0 1 1 383 1 . . . . . . 2.0 5.2 1 1 384 1 . . . . . 3.8 0.0 6.0 1 1 385 1 . . . . . 2.2 1.6 2.8 1 1 386 1 . . . . . 2.0 1.5 2.5 1 1 387 1 . . . . . 2.6 0.0 6.0 1 1 388 1 . . . . . 3.1 1.9 4.3 1 1 389 1 . . . . . 2.5 0.0 6.0 1 1 390 1 . . . . . 6.0 1.5 6.0 1 1 391 1 . . . . . 3.8 2.0 5.6 1 1 392 1 . . . . . 4.3 2.0 6.0 1 1 393 1 . . . . . 2.7 1.8 3.6 1 1 394 1 . . . . . 2.5 1.7 3.3 1 1 395 1 . . . . . 2.4 1.7 3.1 1 1 396 1 . . . . . 4.7 2.0 6.0 1 1 397 1 . . . . . 4.9 1.9 6.0 1 1 398 1 . . . . . 6.0 1.3 6.0 1 1 399 1 . . . . . 3.0 1.9 4.1 1 1 400 1 . . . . . 2.7 1.8 3.6 1 1 401 1 . . . . . 3.5 2.0 5.0 1 1 402 1 . . . . . 3.3 2.0 4.6 1 1 403 1 . . . . . 3.3 1.9 4.7 1 1 404 1 . . . . . 3.6 2.0 5.2 1 1 405 1 . . . . . 4.4 2.0 6.0 1 1 406 1 . . . . . 2.3 1.7 2.9 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 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 9 LEU O . 9 . O 1 2 1 1 2 1 1 13 ASN H . 13 . HN 1 2 2 1 1 1 1 10 GLU O . 10 . O 1 2 2 1 2 1 1 14 PHE H . 14 . HN 1 2 3 1 1 1 1 11 CYS O . 11 . O 1 2 3 1 2 1 1 15 CYS H . 15 . HN 1 2 4 1 1 1 1 9 LEU O . 9 . O 1 2 4 1 2 1 1 13 ASN N . 13 . N 1 2 5 1 1 1 1 10 GLU O . 10 . O 1 2 5 1 2 1 1 14 PHE N . 14 . N 1 2 6 1 1 1 1 11 CYS O . 11 . O 1 2 6 1 2 1 1 15 CYS N . 15 . N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.9 1.55 2.25 1 2 2 1 . . . . . 1.9 1.55 2.25 1 2 3 1 . . . . . 1.9 1.55 2.25 1 2 4 1 . . . . . 2.9 2.4 3.4 1 2 5 1 . . . . . 2.9 2.4 3.4 1 2 6 1 . . . . . 2.9 2.4 3.4 1 2 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 CYS C C 5.312 6.036 -4.906 1.00 . A A . 1 CYS C 1 1 1 2 1 1 1 CYS CA C 4.024 6.512 -4.244 1.00 . A A . 1 CYS CA 1 1 1 3 1 1 1 CYS CB C 2.988 5.385 -4.228 1.00 . A A . 1 CYS CB 1 1 1 4 1 1 1 CYS H1 H 4.184 8.452 -4.986 1.00 . A A . 1 CYS H1 1 1 1 5 1 1 1 CYS H2 H 2.620 8.031 -4.484 1.00 . A A . 1 CYS H2 1 1 1 6 1 1 1 CYS H3 H 3.233 7.423 -5.940 1.00 . A A . 1 CYS H3 1 1 1 7 1 1 1 CYS HA H 4.245 6.807 -3.229 1.00 . A A . 1 CYS HA 1 1 1 8 1 1 1 CYS HB2 H 2.094 5.738 -3.736 1.00 . A A . 1 CYS HB2 1 1 1 9 1 1 1 CYS HB3 H 2.748 5.114 -5.247 1.00 . A A . 1 CYS HB3 1 1 1 10 1 1 1 CYS N N 3.477 7.684 -4.963 1.00 . A A . 1 CYS N 1 1 1 11 1 1 1 CYS O O 5.300 5.570 -6.044 1.00 . A A . 1 CYS O 1 1 1 12 1 1 1 CYS SG S 3.531 3.875 -3.369 1.00 . A A . 1 CYS SG 1 1 1 13 1 1 2 SER C C 8.433 4.813 -3.772 1.00 . A A . 2 SER C 1 1 1 14 1 1 2 SER CA C 7.718 5.762 -4.731 1.00 . A A . 2 SER CA 1 1 1 15 1 1 2 SER CB C 8.595 6.992 -4.982 1.00 . A A . 2 SER CB 1 1 1 16 1 1 2 SER H H 6.382 6.563 -3.294 1.00 . A A . 2 SER H 1 1 1 17 1 1 2 SER HA H 7.548 5.252 -5.668 1.00 . A A . 2 SER HA 1 1 1 18 1 1 2 SER HB2 H 8.806 7.476 -4.041 1.00 . A A . 2 SER HB2 1 1 1 19 1 1 2 SER HB3 H 9.521 6.680 -5.441 1.00 . A A . 2 SER HB3 1 1 1 20 1 1 2 SER HG H 8.522 8.706 -5.938 1.00 . A A . 2 SER HG 1 1 1 21 1 1 2 SER N N 6.426 6.170 -4.200 1.00 . A A . 2 SER N 1 1 1 22 1 1 2 SER O O 8.860 5.217 -2.688 1.00 . A A . 2 SER O 1 1 1 23 1 1 2 SER OG O 7.951 7.927 -5.835 1.00 . A A . 2 SER OG 1 1 1 24 1 1 3 CYS C C 10.375 1.920 -4.219 1.00 . A A . 3 CYS C 1 1 1 25 1 1 3 CYS CA C 9.288 2.582 -3.376 1.00 . A A . 3 CYS CA 1 1 1 26 1 1 3 CYS CB C 8.337 1.537 -2.790 1.00 . A A . 3 CYS CB 1 1 1 27 1 1 3 CYS H H 8.125 3.257 -4.999 1.00 . A A . 3 CYS H 1 1 1 28 1 1 3 CYS HA H 9.762 3.114 -2.565 1.00 . A A . 3 CYS HA 1 1 1 29 1 1 3 CYS HB2 H 8.918 0.730 -2.383 1.00 . A A . 3 CYS HB2 1 1 1 30 1 1 3 CYS HB3 H 7.761 1.993 -1.998 1.00 . A A . 3 CYS HB3 1 1 1 31 1 1 3 CYS N N 8.551 3.552 -4.162 1.00 . A A . 3 CYS N 1 1 1 32 1 1 3 CYS O O 10.131 0.948 -4.929 1.00 . A A . 3 CYS O 1 1 1 33 1 1 3 CYS SG S 7.164 0.813 -3.983 1.00 . A A . 3 CYS SG 1 1 1 34 1 1 4 THR C C 13.921 1.829 -3.984 1.00 . A A . 4 THR C 1 1 1 35 1 1 4 THR CA C 12.707 1.940 -4.898 1.00 . A A . 4 THR CA 1 1 1 36 1 1 4 THR CB C 13.026 2.785 -6.151 1.00 . A A . 4 THR CB 1 1 1 37 1 1 4 THR CG2 C 13.407 4.207 -5.774 1.00 . A A . 4 THR CG2 1 1 1 38 1 1 4 THR H H 11.690 3.274 -3.599 1.00 . A A . 4 THR H 1 1 1 39 1 1 4 THR HA H 12.441 0.958 -5.213 1.00 . A A . 4 THR HA 1 1 1 40 1 1 4 THR HB H 12.142 2.823 -6.769 1.00 . A A . 4 THR HB 1 1 1 41 1 1 4 THR HG1 H 14.301 2.752 -7.656 1.00 . A A . 4 THR HG1 1 1 1 42 1 1 4 THR HG21 H 13.607 4.777 -6.669 1.00 . A A . 4 THR HG21 1 1 1 43 1 1 4 THR HG22 H 14.291 4.187 -5.153 1.00 . A A . 4 THR HG22 1 1 1 44 1 1 4 THR HG23 H 12.596 4.663 -5.229 1.00 . A A . 4 THR HG23 1 1 1 45 1 1 4 THR N N 11.571 2.480 -4.158 1.00 . A A . 4 THR N 1 1 1 46 1 1 4 THR O O 14.803 0.991 -4.169 1.00 . A A . 4 THR O 1 1 1 47 1 1 4 THR OG1 O 14.086 2.186 -6.903 1.00 . A A . 4 THR OG1 1 1 1 48 1 1 5 ASP C C 14.194 1.785 -0.771 1.00 . A A . 5 ASP C 1 1 1 49 1 1 5 ASP CA C 14.859 2.599 -1.868 1.00 . A A . 5 ASP CA 1 1 1 50 1 1 5 ASP CB C 15.183 4.003 -1.354 1.00 . A A . 5 ASP CB 1 1 1 51 1 1 5 ASP CG C 13.969 4.693 -0.756 1.00 . A A . 5 ASP CG 1 1 1 52 1 1 5 ASP H H 13.276 3.401 -2.993 1.00 . A A . 5 ASP H 1 1 1 53 1 1 5 ASP HA H 15.760 2.105 -2.198 1.00 . A A . 5 ASP HA 1 1 1 54 1 1 5 ASP HB2 H 15.946 3.934 -0.595 1.00 . A A . 5 ASP HB2 1 1 1 55 1 1 5 ASP HB3 H 15.548 4.604 -2.174 1.00 . A A . 5 ASP HB3 1 1 1 56 1 1 5 ASP N N 13.928 2.682 -2.984 1.00 . A A . 5 ASP N 1 1 1 57 1 1 5 ASP O O 14.522 1.892 0.412 1.00 . A A . 5 ASP O 1 1 1 58 1 1 5 ASP OD1 O 12.959 4.865 -1.476 1.00 . A A . 5 ASP OD1 1 1 1 59 1 1 5 ASP OD2 O 14.018 5.072 0.434 1.00 . A A . 5 ASP OD2 1 1 1 60 1 1 6 MET C C 11.981 -1.097 -0.917 1.00 . A A . 6 MET C 1 1 1 61 1 1 6 MET CA C 12.338 0.267 -0.334 1.00 . A A . 6 MET CA 1 1 1 62 1 1 6 MET CB C 11.083 1.138 -0.188 1.00 . A A . 6 MET CB 1 1 1 63 1 1 6 MET CE C 9.256 2.819 1.913 1.00 . A A . 6 MET CE 1 1 1 64 1 1 6 MET CG C 9.948 0.483 0.569 1.00 . A A . 6 MET CG 1 1 1 65 1 1 6 MET H H 13.228 0.761 -2.169 1.00 . A A . 6 MET H 1 1 1 66 1 1 6 MET HA H 12.804 0.139 0.630 1.00 . A A . 6 MET HA 1 1 1 67 1 1 6 MET HB2 H 11.350 2.046 0.331 1.00 . A A . 6 MET HB2 1 1 1 68 1 1 6 MET HB3 H 10.726 1.393 -1.175 1.00 . A A . 6 MET HB3 1 1 1 69 1 1 6 MET HE1 H 8.502 3.550 2.176 1.00 . A A . 6 MET HE1 1 1 1 70 1 1 6 MET HE2 H 10.076 3.312 1.413 1.00 . A A . 6 MET HE2 1 1 1 71 1 1 6 MET HE3 H 9.617 2.337 2.808 1.00 . A A . 6 MET HE3 1 1 1 72 1 1 6 MET HG2 H 9.608 -0.382 0.015 1.00 . A A . 6 MET HG2 1 1 1 73 1 1 6 MET HG3 H 10.315 0.169 1.526 1.00 . A A . 6 MET HG3 1 1 1 74 1 1 6 MET N N 13.270 0.947 -1.209 1.00 . A A . 6 MET N 1 1 1 75 1 1 6 MET O O 11.957 -1.265 -2.140 1.00 . A A . 6 MET O 1 1 1 76 1 1 6 MET SD S 8.546 1.590 0.821 1.00 . A A . 6 MET SD 1 1 1 77 1 1 7 SER C C 9.945 -3.499 -0.942 1.00 . A A . 7 SER C 1 1 1 78 1 1 7 SER CA C 11.389 -3.405 -0.474 1.00 . A A . 7 SER CA 1 1 1 79 1 1 7 SER CB C 11.625 -4.377 0.685 1.00 . A A . 7 SER CB 1 1 1 80 1 1 7 SER H H 11.698 -1.872 0.903 1.00 . A A . 7 SER H 1 1 1 81 1 1 7 SER HA H 12.044 -3.662 -1.291 1.00 . A A . 7 SER HA 1 1 1 82 1 1 7 SER HB2 H 11.374 -5.378 0.369 1.00 . A A . 7 SER HB2 1 1 1 83 1 1 7 SER HB3 H 12.664 -4.341 0.977 1.00 . A A . 7 SER HB3 1 1 1 84 1 1 7 SER HG H 11.389 -3.932 2.589 1.00 . A A . 7 SER HG 1 1 1 85 1 1 7 SER N N 11.701 -2.064 -0.051 1.00 . A A . 7 SER N 1 1 1 86 1 1 7 SER O O 9.227 -2.499 -1.025 1.00 . A A . 7 SER O 1 1 1 87 1 1 7 SER OG O 10.822 -4.036 1.805 1.00 . A A . 7 SER OG 1 1 1 88 1 1 8 ASP C C 7.176 -4.931 -0.562 1.00 . A A . 8 ASP C 1 1 1 89 1 1 8 ASP CA C 8.178 -4.975 -1.706 1.00 . A A . 8 ASP CA 1 1 1 90 1 1 8 ASP CB C 8.108 -6.332 -2.424 1.00 . A A . 8 ASP CB 1 1 1 91 1 1 8 ASP CG C 8.415 -7.512 -1.519 1.00 . A A . 8 ASP CG 1 1 1 92 1 1 8 ASP H H 10.143 -5.453 -1.066 1.00 . A A . 8 ASP H 1 1 1 93 1 1 8 ASP HA H 7.931 -4.195 -2.411 1.00 . A A . 8 ASP HA 1 1 1 94 1 1 8 ASP HB2 H 7.113 -6.466 -2.825 1.00 . A A . 8 ASP HB2 1 1 1 95 1 1 8 ASP HB3 H 8.819 -6.334 -3.238 1.00 . A A . 8 ASP HB3 1 1 1 96 1 1 8 ASP N N 9.526 -4.711 -1.214 1.00 . A A . 8 ASP N 1 1 1 97 1 1 8 ASP O O 6.138 -4.276 -0.658 1.00 . A A . 8 ASP O 1 1 1 98 1 1 8 ASP OD1 O 9.575 -7.637 -1.074 1.00 . A A . 8 ASP OD1 1 1 1 99 1 1 8 ASP OD2 O 7.501 -8.315 -1.247 1.00 . A A . 8 ASP OD2 1 1 1 100 1 1 9 LEU C C 6.480 -4.273 2.296 1.00 . A A . 9 LEU C 1 1 1 101 1 1 9 LEU CA C 6.644 -5.662 1.698 1.00 . A A . 9 LEU CA 1 1 1 102 1 1 9 LEU CB C 7.216 -6.628 2.741 1.00 . A A . 9 LEU CB 1 1 1 103 1 1 9 LEU CD1 C 4.996 -7.416 3.608 1.00 . A A . 9 LEU CD1 1 1 1 104 1 1 9 LEU CD2 C 7.055 -7.719 4.992 1.00 . A A . 9 LEU CD2 1 1 1 105 1 1 9 LEU CG C 6.348 -6.828 3.985 1.00 . A A . 9 LEU CG 1 1 1 106 1 1 9 LEU H H 8.362 -6.092 0.545 1.00 . A A . 9 LEU H 1 1 1 107 1 1 9 LEU HA H 5.677 -6.021 1.380 1.00 . A A . 9 LEU HA 1 1 1 108 1 1 9 LEU HB2 H 7.361 -7.590 2.269 1.00 . A A . 9 LEU HB2 1 1 1 109 1 1 9 LEU HB3 H 8.178 -6.254 3.056 1.00 . A A . 9 LEU HB3 1 1 1 110 1 1 9 LEU HD11 H 4.397 -7.546 4.497 1.00 . A A . 9 LEU HD11 1 1 1 111 1 1 9 LEU HD12 H 5.142 -8.372 3.127 1.00 . A A . 9 LEU HD12 1 1 1 112 1 1 9 LEU HD13 H 4.491 -6.745 2.930 1.00 . A A . 9 LEU HD13 1 1 1 113 1 1 9 LEU HD21 H 7.958 -7.234 5.329 1.00 . A A . 9 LEU HD21 1 1 1 114 1 1 9 LEU HD22 H 7.307 -8.660 4.526 1.00 . A A . 9 LEU HD22 1 1 1 115 1 1 9 LEU HD23 H 6.405 -7.899 5.835 1.00 . A A . 9 LEU HD23 1 1 1 116 1 1 9 LEU HG H 6.174 -5.869 4.451 1.00 . A A . 9 LEU HG 1 1 1 117 1 1 9 LEU N N 7.510 -5.607 0.531 1.00 . A A . 9 LEU N 1 1 1 118 1 1 9 LEU O O 5.367 -3.837 2.585 1.00 . A A . 9 LEU O 1 1 1 119 1 1 10 GLU C C 6.783 -1.273 2.134 1.00 . A A . 10 GLU C 1 1 1 120 1 1 10 GLU CA C 7.583 -2.231 3.017 1.00 . A A . 10 GLU CA 1 1 1 121 1 1 10 GLU CB C 9.012 -1.724 3.207 1.00 . A A . 10 GLU CB 1 1 1 122 1 1 10 GLU CD C 8.631 -0.534 5.405 1.00 . A A . 10 GLU CD 1 1 1 123 1 1 10 GLU CG C 9.104 -0.415 3.971 1.00 . A A . 10 GLU CG 1 1 1 124 1 1 10 GLU H H 8.452 -3.959 2.154 1.00 . A A . 10 GLU H 1 1 1 125 1 1 10 GLU HA H 7.103 -2.294 3.980 1.00 . A A . 10 GLU HA 1 1 1 126 1 1 10 GLU HB2 H 9.576 -2.470 3.745 1.00 . A A . 10 GLU HB2 1 1 1 127 1 1 10 GLU HB3 H 9.461 -1.580 2.235 1.00 . A A . 10 GLU HB3 1 1 1 128 1 1 10 GLU HG2 H 10.135 -0.093 3.979 1.00 . A A . 10 GLU HG2 1 1 1 129 1 1 10 GLU HG3 H 8.502 0.326 3.468 1.00 . A A . 10 GLU HG3 1 1 1 130 1 1 10 GLU N N 7.597 -3.568 2.441 1.00 . A A . 10 GLU N 1 1 1 131 1 1 10 GLU O O 6.081 -0.386 2.634 1.00 . A A . 10 GLU O 1 1 1 132 1 1 10 GLU OE1 O 7.432 -0.816 5.624 1.00 . A A . 10 GLU OE1 1 1 1 133 1 1 10 GLU OE2 O 9.445 -0.310 6.323 1.00 . A A . 10 GLU OE2 1 1 1 134 1 1 11 CYS C C 4.636 -0.893 0.048 1.00 . A A . 11 CYS C 1 1 1 135 1 1 11 CYS CA C 6.127 -0.645 -0.120 1.00 . A A . 11 CYS CA 1 1 1 136 1 1 11 CYS CB C 6.545 -0.936 -1.563 1.00 . A A . 11 CYS CB 1 1 1 137 1 1 11 CYS H H 7.477 -2.165 0.480 1.00 . A A . 11 CYS H 1 1 1 138 1 1 11 CYS HA H 6.333 0.392 0.106 1.00 . A A . 11 CYS HA 1 1 1 139 1 1 11 CYS HB2 H 7.604 -0.750 -1.665 1.00 . A A . 11 CYS HB2 1 1 1 140 1 1 11 CYS HB3 H 6.341 -1.975 -1.787 1.00 . A A . 11 CYS HB3 1 1 1 141 1 1 11 CYS N N 6.880 -1.463 0.822 1.00 . A A . 11 CYS N 1 1 1 142 1 1 11 CYS O O 3.851 0.050 0.152 1.00 . A A . 11 CYS O 1 1 1 143 1 1 11 CYS SG S 5.678 0.079 -2.810 1.00 . A A . 11 CYS SG 1 1 1 144 1 1 12 MET C C 2.311 -1.968 1.586 1.00 . A A . 12 MET C 1 1 1 145 1 1 12 MET CA C 2.850 -2.526 0.277 1.00 . A A . 12 MET CA 1 1 1 146 1 1 12 MET CB C 2.658 -4.044 0.232 1.00 . A A . 12 MET CB 1 1 1 147 1 1 12 MET CE C 3.448 -7.128 0.137 1.00 . A A . 12 MET CE 1 1 1 148 1 1 12 MET CG C 3.043 -4.671 -1.099 1.00 . A A . 12 MET CG 1 1 1 149 1 1 12 MET H H 4.927 -2.878 0.035 1.00 . A A . 12 MET H 1 1 1 150 1 1 12 MET HA H 2.299 -2.082 -0.539 1.00 . A A . 12 MET HA 1 1 1 151 1 1 12 MET HB2 H 3.265 -4.495 1.005 1.00 . A A . 12 MET HB2 1 1 1 152 1 1 12 MET HB3 H 1.621 -4.270 0.424 1.00 . A A . 12 MET HB3 1 1 1 153 1 1 12 MET HE1 H 4.507 -6.986 -0.020 1.00 . A A . 12 MET HE1 1 1 1 154 1 1 12 MET HE2 H 3.230 -8.184 0.193 1.00 . A A . 12 MET HE2 1 1 1 155 1 1 12 MET HE3 H 3.154 -6.651 1.061 1.00 . A A . 12 MET HE3 1 1 1 156 1 1 12 MET HG2 H 2.571 -4.113 -1.895 1.00 . A A . 12 MET HG2 1 1 1 157 1 1 12 MET HG3 H 4.116 -4.610 -1.210 1.00 . A A . 12 MET HG3 1 1 1 158 1 1 12 MET N N 4.251 -2.166 0.108 1.00 . A A . 12 MET N 1 1 1 159 1 1 12 MET O O 1.144 -1.603 1.678 1.00 . A A . 12 MET O 1 1 1 160 1 1 12 MET SD S 2.545 -6.401 -1.229 1.00 . A A . 12 MET SD 1 1 1 161 1 1 13 ASN C C 2.313 0.107 3.763 1.00 . A A . 13 ASN C 1 1 1 162 1 1 13 ASN CA C 2.784 -1.334 3.884 1.00 . A A . 13 ASN CA 1 1 1 163 1 1 13 ASN CB C 3.941 -1.407 4.883 1.00 . A A . 13 ASN CB 1 1 1 164 1 1 13 ASN CG C 4.240 -2.818 5.344 1.00 . A A . 13 ASN CG 1 1 1 165 1 1 13 ASN H H 4.091 -2.203 2.460 1.00 . A A . 13 ASN H 1 1 1 166 1 1 13 ASN HA H 1.966 -1.932 4.255 1.00 . A A . 13 ASN HA 1 1 1 167 1 1 13 ASN HB2 H 4.833 -1.006 4.421 1.00 . A A . 13 ASN HB2 1 1 1 168 1 1 13 ASN HB3 H 3.694 -0.811 5.748 1.00 . A A . 13 ASN HB3 1 1 1 169 1 1 13 ASN HD21 H 6.153 -2.339 5.610 1.00 . A A . 13 ASN HD21 1 1 1 170 1 1 13 ASN HD22 H 5.722 -3.976 5.998 1.00 . A A . 13 ASN HD22 1 1 1 171 1 1 13 ASN N N 3.172 -1.879 2.589 1.00 . A A . 13 ASN N 1 1 1 172 1 1 13 ASN ND2 N 5.496 -3.070 5.681 1.00 . A A . 13 ASN ND2 1 1 1 173 1 1 13 ASN O O 1.139 0.399 3.984 1.00 . A A . 13 ASN O 1 1 1 174 1 1 13 ASN OD1 O 3.352 -3.669 5.407 1.00 . A A . 13 ASN OD1 1 1 1 175 1 1 14 PHE C C 2.007 2.840 2.244 1.00 . A A . 14 PHE C 1 1 1 176 1 1 14 PHE CA C 2.916 2.436 3.406 1.00 . A A . 14 PHE CA 1 1 1 177 1 1 14 PHE CB C 4.213 3.268 3.377 1.00 . A A . 14 PHE CB 1 1 1 178 1 1 14 PHE CD1 C 5.316 2.673 1.192 1.00 . A A . 14 PHE CD1 1 1 1 179 1 1 14 PHE CD2 C 4.554 4.909 1.507 1.00 . A A . 14 PHE CD2 1 1 1 180 1 1 14 PHE CE1 C 5.760 3.002 -0.074 1.00 . A A . 14 PHE CE1 1 1 1 181 1 1 14 PHE CE2 C 4.997 5.243 0.243 1.00 . A A . 14 PHE CE2 1 1 1 182 1 1 14 PHE CG C 4.706 3.621 1.998 1.00 . A A . 14 PHE CG 1 1 1 183 1 1 14 PHE CZ C 5.602 4.288 -0.549 1.00 . A A . 14 PHE CZ 1 1 1 184 1 1 14 PHE H H 4.105 0.700 3.083 1.00 . A A . 14 PHE H 1 1 1 185 1 1 14 PHE HA H 2.398 2.640 4.332 1.00 . A A . 14 PHE HA 1 1 1 186 1 1 14 PHE HB2 H 4.049 4.193 3.910 1.00 . A A . 14 PHE HB2 1 1 1 187 1 1 14 PHE HB3 H 4.994 2.711 3.875 1.00 . A A . 14 PHE HB3 1 1 1 188 1 1 14 PHE HD1 H 5.440 1.665 1.562 1.00 . A A . 14 PHE HD1 1 1 1 189 1 1 14 PHE HD2 H 4.081 5.658 2.124 1.00 . A A . 14 PHE HD2 1 1 1 190 1 1 14 PHE HE1 H 6.232 2.254 -0.692 1.00 . A A . 14 PHE HE1 1 1 1 191 1 1 14 PHE HE2 H 4.872 6.250 -0.126 1.00 . A A . 14 PHE HE2 1 1 1 192 1 1 14 PHE HZ H 5.950 4.547 -1.540 1.00 . A A . 14 PHE HZ 1 1 1 193 1 1 14 PHE N N 3.217 1.005 3.383 1.00 . A A . 14 PHE N 1 1 1 194 1 1 14 PHE O O 1.254 3.812 2.342 1.00 . A A . 14 PHE O 1 1 1 195 1 1 15 CYS C C 0.008 1.832 -0.186 1.00 . A A . 15 CYS C 1 1 1 196 1 1 15 CYS CA C 1.380 2.488 -0.071 1.00 . A A . 15 CYS CA 1 1 1 197 1 1 15 CYS CB C 2.241 2.121 -1.278 1.00 . A A . 15 CYS CB 1 1 1 198 1 1 15 CYS H H 2.595 1.262 1.161 1.00 . A A . 15 CYS H 1 1 1 199 1 1 15 CYS HA H 1.252 3.558 -0.048 1.00 . A A . 15 CYS HA 1 1 1 200 1 1 15 CYS HB2 H 3.267 2.361 -1.057 1.00 . A A . 15 CYS HB2 1 1 1 201 1 1 15 CYS HB3 H 2.160 1.058 -1.456 1.00 . A A . 15 CYS HB3 1 1 1 202 1 1 15 CYS N N 2.067 2.092 1.152 1.00 . A A . 15 CYS N 1 1 1 203 1 1 15 CYS O O -0.859 2.314 -0.916 1.00 . A A . 15 CYS O 1 1 1 204 1 1 15 CYS SG S 1.795 2.978 -2.820 1.00 . A A . 15 CYS SG 1 1 1 205 1 1 16 HIS C C -2.174 0.026 1.807 1.00 . A A . 16 HIS C 1 1 1 206 1 1 16 HIS CA C -1.459 0.011 0.462 1.00 . A A . 16 HIS CA 1 1 1 207 1 1 16 HIS CB C -1.238 -1.438 -0.002 1.00 . A A . 16 HIS CB 1 1 1 208 1 1 16 HIS CD2 C -0.090 -0.830 -2.258 1.00 . A A . 16 HIS CD2 1 1 1 209 1 1 16 HIS CE1 C -0.883 -2.467 -3.473 1.00 . A A . 16 HIS CE1 1 1 1 210 1 1 16 HIS CG C -0.886 -1.578 -1.457 1.00 . A A . 16 HIS CG 1 1 1 211 1 1 16 HIS H H 0.517 0.408 1.126 1.00 . A A . 16 HIS H 1 1 1 212 1 1 16 HIS HA H -2.084 0.517 -0.262 1.00 . A A . 16 HIS HA 1 1 1 213 1 1 16 HIS HB2 H -0.431 -1.869 0.575 1.00 . A A . 16 HIS HB2 1 1 1 214 1 1 16 HIS HB3 H -2.140 -2.004 0.178 1.00 . A A . 16 HIS HB3 1 1 1 215 1 1 16 HIS HD1 H -1.963 -3.331 -1.961 1.00 . A A . 16 HIS HD1 1 1 1 216 1 1 16 HIS HD2 H 0.456 0.057 -1.968 1.00 . A A . 16 HIS HD2 1 1 1 217 1 1 16 HIS HE1 H -1.094 -3.119 -4.308 1.00 . A A . 16 HIS HE1 1 1 1 218 1 1 16 HIS HE2 H 0.301 -1.021 -4.317 1.00 . A A . 16 HIS HE2 1 1 1 219 1 1 16 HIS N N -0.194 0.736 0.531 1.00 . A A . 16 HIS N 1 1 1 220 1 1 16 HIS ND1 N -1.366 -2.597 -2.253 1.00 . A A . 16 HIS ND1 1 1 1 221 1 1 16 HIS NE2 N -0.108 -1.404 -3.502 1.00 . A A . 16 HIS NE2 1 1 1 222 1 1 16 HIS O O -3.026 -0.815 2.072 1.00 . A A . 16 HIS O 1 1 1 223 1 1 17 LYS C C -3.715 2.030 3.872 1.00 . A A . 17 LYS C 1 1 1 224 1 1 17 LYS CA C -2.510 1.121 3.951 1.00 . A A . 17 LYS CA 1 1 1 225 1 1 17 LYS CB C -1.552 1.640 5.025 1.00 . A A . 17 LYS CB 1 1 1 226 1 1 17 LYS CD C -0.435 3.700 5.942 1.00 . A A . 17 LYS CD 1 1 1 227 1 1 17 LYS CE C -1.601 4.239 6.761 1.00 . A A . 17 LYS CE 1 1 1 228 1 1 17 LYS CG C -0.918 2.983 4.691 1.00 . A A . 17 LYS CG 1 1 1 229 1 1 17 LYS H H -1.170 1.664 2.387 1.00 . A A . 17 LYS H 1 1 1 230 1 1 17 LYS HA H -2.857 0.149 4.226 1.00 . A A . 17 LYS HA 1 1 1 231 1 1 17 LYS HB2 H -2.095 1.744 5.950 1.00 . A A . 17 LYS HB2 1 1 1 232 1 1 17 LYS HB3 H -0.760 0.918 5.162 1.00 . A A . 17 LYS HB3 1 1 1 233 1 1 17 LYS HD2 H 0.128 3.006 6.547 1.00 . A A . 17 LYS HD2 1 1 1 234 1 1 17 LYS HD3 H 0.201 4.526 5.651 1.00 . A A . 17 LYS HD3 1 1 1 235 1 1 17 LYS HE2 H -2.311 3.441 6.923 1.00 . A A . 17 LYS HE2 1 1 1 236 1 1 17 LYS HE3 H -1.227 4.585 7.713 1.00 . A A . 17 LYS HE3 1 1 1 237 1 1 17 LYS HG2 H -0.077 2.821 4.035 1.00 . A A . 17 LYS HG2 1 1 1 238 1 1 17 LYS HG3 H -1.652 3.602 4.193 1.00 . A A . 17 LYS HG3 1 1 1 239 1 1 17 LYS HZ1 H -3.113 5.679 6.635 1.00 . A A . 17 LYS HZ1 1 1 1 240 1 1 17 LYS HZ2 H -2.622 5.076 5.128 1.00 . A A . 17 LYS HZ2 1 1 1 241 1 1 17 LYS HZ3 H -1.635 6.173 5.969 1.00 . A A . 17 LYS HZ3 1 1 1 242 1 1 17 LYS N N -1.854 1.004 2.648 1.00 . A A . 17 LYS N 1 1 1 243 1 1 17 LYS NZ N -2.292 5.367 6.074 1.00 . A A . 17 LYS NZ 1 1 1 244 1 1 17 LYS O O -4.284 2.428 4.888 1.00 . A A . 17 LYS O 1 1 1 245 1 1 18 ASP C C -6.117 2.636 1.323 1.00 . A A . 18 ASP C 1 1 1 246 1 1 18 ASP CA C -5.250 3.202 2.432 1.00 . A A . 18 ASP CA 1 1 1 247 1 1 18 ASP CB C -4.811 4.617 2.075 1.00 . A A . 18 ASP CB 1 1 1 248 1 1 18 ASP CG C -4.104 5.329 3.214 1.00 . A A . 18 ASP CG 1 1 1 249 1 1 18 ASP H H -3.591 2.013 1.898 1.00 . A A . 18 ASP H 1 1 1 250 1 1 18 ASP HA H -5.827 3.231 3.343 1.00 . A A . 18 ASP HA 1 1 1 251 1 1 18 ASP HB2 H -4.150 4.578 1.227 1.00 . A A . 18 ASP HB2 1 1 1 252 1 1 18 ASP HB3 H -5.682 5.182 1.815 1.00 . A A . 18 ASP HB3 1 1 1 253 1 1 18 ASP N N -4.100 2.352 2.660 1.00 . A A . 18 ASP N 1 1 1 254 1 1 18 ASP O O -6.953 3.340 0.752 1.00 . A A . 18 ASP O 1 1 1 255 1 1 18 ASP OD1 O -4.790 5.984 4.023 1.00 . A A . 18 ASP OD1 1 1 1 256 1 1 18 ASP OD2 O -2.861 5.233 3.311 1.00 . A A . 18 ASP OD2 1 1 1 257 1 1 19 VAL C C -8.152 0.538 0.525 1.00 . A A . 19 VAL C 1 1 1 258 1 1 19 VAL CA C -6.728 0.689 0.019 1.00 . A A . 19 VAL CA 1 1 1 259 1 1 19 VAL CB C -6.163 -0.692 -0.364 1.00 . A A . 19 VAL CB 1 1 1 260 1 1 19 VAL CG1 C -4.923 -0.542 -1.227 1.00 . A A . 19 VAL CG1 1 1 1 261 1 1 19 VAL CG2 C -5.851 -1.509 0.877 1.00 . A A . 19 VAL CG2 1 1 1 262 1 1 19 VAL H H -5.224 0.858 1.492 1.00 . A A . 19 VAL H 1 1 1 263 1 1 19 VAL HA H -6.740 1.309 -0.867 1.00 . A A . 19 VAL HA 1 1 1 264 1 1 19 VAL HB H -6.913 -1.218 -0.937 1.00 . A A . 19 VAL HB 1 1 1 265 1 1 19 VAL HG11 H -4.530 -1.520 -1.463 1.00 . A A . 19 VAL HG11 1 1 1 266 1 1 19 VAL HG12 H -4.177 0.027 -0.693 1.00 . A A . 19 VAL HG12 1 1 1 267 1 1 19 VAL HG13 H -5.183 -0.029 -2.142 1.00 . A A . 19 VAL HG13 1 1 1 268 1 1 19 VAL HG21 H -5.139 -0.974 1.489 1.00 . A A . 19 VAL HG21 1 1 1 269 1 1 19 VAL HG22 H -5.432 -2.462 0.585 1.00 . A A . 19 VAL HG22 1 1 1 270 1 1 19 VAL HG23 H -6.757 -1.671 1.440 1.00 . A A . 19 VAL HG23 1 1 1 271 1 1 19 VAL N N -5.917 1.361 1.019 1.00 . A A . 19 VAL N 1 1 1 272 1 1 19 VAL O O -8.382 0.220 1.695 1.00 . A A . 19 VAL O 1 1 1 273 1 1 20 ILE C C -11.162 -0.545 -0.198 1.00 . A A . 20 ILE C 1 1 1 274 1 1 20 ILE CA C -10.497 0.808 0.042 1.00 . A A . 20 ILE CA 1 1 1 275 1 1 20 ILE CB C -11.259 1.922 -0.716 1.00 . A A . 20 ILE CB 1 1 1 276 1 1 20 ILE CD1 C -11.666 3.276 1.394 1.00 . A A . 20 ILE CD1 1 1 1 277 1 1 20 ILE CG1 C -12.291 2.573 0.206 1.00 . A A . 20 ILE CG1 1 1 1 278 1 1 20 ILE CG2 C -11.922 1.375 -1.976 1.00 . A A . 20 ILE CG2 1 1 1 279 1 1 20 ILE H H -8.859 0.960 -1.293 1.00 . A A . 20 ILE H 1 1 1 280 1 1 20 ILE HA H -10.537 1.031 1.095 1.00 . A A . 20 ILE HA 1 1 1 281 1 1 20 ILE HB H -10.541 2.669 -1.019 1.00 . A A . 20 ILE HB 1 1 1 282 1 1 20 ILE HD11 H -10.987 4.041 1.043 1.00 . A A . 20 ILE HD11 1 1 1 283 1 1 20 ILE HD12 H -11.119 2.559 1.988 1.00 . A A . 20 ILE HD12 1 1 1 284 1 1 20 ILE HD13 H -12.441 3.729 1.996 1.00 . A A . 20 ILE HD13 1 1 1 285 1 1 20 ILE HG12 H -12.859 3.303 -0.352 1.00 . A A . 20 ILE HG12 1 1 1 286 1 1 20 ILE HG13 H -12.958 1.814 0.583 1.00 . A A . 20 ILE HG13 1 1 1 287 1 1 20 ILE HG21 H -11.165 0.970 -2.632 1.00 . A A . 20 ILE HG21 1 1 1 288 1 1 20 ILE HG22 H -12.452 2.169 -2.480 1.00 . A A . 20 ILE HG22 1 1 1 289 1 1 20 ILE HG23 H -12.617 0.593 -1.704 1.00 . A A . 20 ILE HG23 1 1 1 290 1 1 20 ILE N N -9.103 0.782 -0.351 1.00 . A A . 20 ILE N 1 1 1 291 1 1 20 ILE O O -12.225 -0.830 0.352 1.00 . A A . 20 ILE O 1 1 1 292 1 1 21 TRP C C -10.919 -3.747 -0.330 1.00 . A A . 21 TRP C 1 1 1 293 1 1 21 TRP CA C -11.091 -2.665 -1.394 1.00 . A A . 21 TRP CA 1 1 1 294 1 1 21 TRP CB C -10.500 -3.119 -2.739 1.00 . A A . 21 TRP CB 1 1 1 295 1 1 21 TRP CD1 C -8.226 -2.150 -3.414 1.00 . A A . 21 TRP CD1 1 1 1 296 1 1 21 TRP CD2 C -8.096 -4.068 -2.268 1.00 . A A . 21 TRP CD2 1 1 1 297 1 1 21 TRP CE2 C -6.796 -3.648 -2.583 1.00 . A A . 21 TRP CE2 1 1 1 298 1 1 21 TRP CE3 C -8.264 -5.252 -1.550 1.00 . A A . 21 TRP CE3 1 1 1 299 1 1 21 TRP CG C -9.001 -3.096 -2.808 1.00 . A A . 21 TRP CG 1 1 1 300 1 1 21 TRP CH2 C -5.863 -5.526 -1.499 1.00 . A A . 21 TRP CH2 1 1 1 301 1 1 21 TRP CZ2 C -5.668 -4.370 -2.204 1.00 . A A . 21 TRP CZ2 1 1 1 302 1 1 21 TRP CZ3 C -7.148 -5.970 -1.171 1.00 . A A . 21 TRP CZ3 1 1 1 303 1 1 21 TRP H H -9.610 -1.155 -1.301 1.00 . A A . 21 TRP H 1 1 1 304 1 1 21 TRP HA H -12.145 -2.499 -1.521 1.00 . A A . 21 TRP HA 1 1 1 305 1 1 21 TRP HB2 H -10.817 -4.130 -2.939 1.00 . A A . 21 TRP HB2 1 1 1 306 1 1 21 TRP HB3 H -10.875 -2.474 -3.521 1.00 . A A . 21 TRP HB3 1 1 1 307 1 1 21 TRP HD1 H -8.612 -1.278 -3.920 1.00 . A A . 21 TRP HD1 1 1 1 308 1 1 21 TRP HE1 H -6.138 -1.950 -3.638 1.00 . A A . 21 TRP HE1 1 1 1 309 1 1 21 TRP HE3 H -9.250 -5.604 -1.288 1.00 . A A . 21 TRP HE3 1 1 1 310 1 1 21 TRP HH2 H -5.014 -6.117 -1.184 1.00 . A A . 21 TRP HH2 1 1 1 311 1 1 21 TRP HZ2 H -4.669 -4.040 -2.449 1.00 . A A . 21 TRP HZ2 1 1 1 312 1 1 21 TRP HZ3 H -7.262 -6.888 -0.613 1.00 . A A . 21 TRP HZ3 1 1 1 313 1 1 21 TRP N N -10.507 -1.393 -0.986 1.00 . A A . 21 TRP N 1 1 1 314 1 1 21 TRP NE1 N -6.898 -2.476 -3.283 1.00 . A A . 21 TRP NE1 1 1 1 315 1 1 21 TRP O O -11.033 -4.939 -0.611 1.00 . A A . 21 TRP O 1 1 1 316 1 1 22 VAL C C -11.832 -4.609 2.674 1.00 . A A . 22 VAL C 1 1 1 317 1 1 22 VAL CA C -10.510 -4.238 2.020 1.00 . A A . 22 VAL CA 1 1 1 318 1 1 22 VAL CB C -9.564 -3.652 3.085 1.00 . A A . 22 VAL CB 1 1 1 319 1 1 22 VAL CG1 C -8.160 -3.520 2.531 1.00 . A A . 22 VAL CG1 1 1 1 320 1 1 22 VAL CG2 C -10.074 -2.308 3.588 1.00 . A A . 22 VAL CG2 1 1 1 321 1 1 22 VAL H H -10.718 -2.352 1.068 1.00 . A A . 22 VAL H 1 1 1 322 1 1 22 VAL HA H -10.062 -5.134 1.624 1.00 . A A . 22 VAL HA 1 1 1 323 1 1 22 VAL HB H -9.533 -4.336 3.923 1.00 . A A . 22 VAL HB 1 1 1 324 1 1 22 VAL HG11 H -8.177 -2.884 1.659 1.00 . A A . 22 VAL HG11 1 1 1 325 1 1 22 VAL HG12 H -7.789 -4.497 2.260 1.00 . A A . 22 VAL HG12 1 1 1 326 1 1 22 VAL HG13 H -7.515 -3.085 3.281 1.00 . A A . 22 VAL HG13 1 1 1 327 1 1 22 VAL HG21 H -11.058 -2.435 4.016 1.00 . A A . 22 VAL HG21 1 1 1 328 1 1 22 VAL HG22 H -10.127 -1.613 2.763 1.00 . A A . 22 VAL HG22 1 1 1 329 1 1 22 VAL HG23 H -9.400 -1.926 4.340 1.00 . A A . 22 VAL HG23 1 1 1 330 1 1 22 VAL N N -10.712 -3.316 0.903 1.00 . A A . 22 VAL N 1 1 1 331 1 1 22 VAL O O -11.871 -5.104 3.800 1.00 . A A . 22 VAL O 1 1 1 332 1 1 23 ASN C C -15.117 -5.073 1.209 1.00 . A A . 23 ASN C 1 1 1 333 1 1 23 ASN CA C -14.249 -4.696 2.398 1.00 . A A . 23 ASN CA 1 1 1 334 1 1 23 ASN CB C -14.858 -3.506 3.149 1.00 . A A . 23 ASN CB 1 1 1 335 1 1 23 ASN CG C -16.303 -3.742 3.559 1.00 . A A . 23 ASN CG 1 1 1 336 1 1 23 ASN H H -12.782 -4.004 1.045 1.00 . A A . 23 ASN H 1 1 1 337 1 1 23 ASN HA H -14.186 -5.539 3.061 1.00 . A A . 23 ASN HA 1 1 1 338 1 1 23 ASN HB2 H -14.279 -3.319 4.041 1.00 . A A . 23 ASN HB2 1 1 1 339 1 1 23 ASN HB3 H -14.822 -2.635 2.510 1.00 . A A . 23 ASN HB3 1 1 1 340 1 1 23 ASN HD21 H -15.722 -4.448 5.329 1.00 . A A . 23 ASN HD21 1 1 1 341 1 1 23 ASN HD22 H -17.434 -4.419 5.049 1.00 . A A . 23 ASN HD22 1 1 1 342 1 1 23 ASN N N -12.903 -4.381 1.939 1.00 . A A . 23 ASN N 1 1 1 343 1 1 23 ASN ND2 N -16.508 -4.250 4.764 1.00 . A A . 23 ASN ND2 1 1 1 344 1 1 23 ASN O O -15.706 -6.154 1.164 1.00 . A A . 23 ASN O 1 1 1 345 1 1 23 ASN OD1 O -17.228 -3.456 2.800 1.00 . A A . 23 ASN OD1 1 1 1 346 1 1 24 ARG C C -14.950 -4.408 -2.177 1.00 . A A . 24 ARG C 1 1 1 347 1 1 24 ARG CA C -15.905 -4.400 -0.991 1.00 . A A . 24 ARG CA 1 1 1 348 1 1 24 ARG CB C -16.965 -3.314 -1.204 1.00 . A A . 24 ARG CB 1 1 1 349 1 1 24 ARG CD C -18.405 -2.090 -2.862 1.00 . A A . 24 ARG CD 1 1 1 350 1 1 24 ARG CG C -17.560 -3.322 -2.603 1.00 . A A . 24 ARG CG 1 1 1 351 1 1 24 ARG CZ C -19.075 -0.801 -4.852 1.00 . A A . 24 ARG CZ 1 1 1 352 1 1 24 ARG H H -14.724 -3.312 0.380 1.00 . A A . 24 ARG H 1 1 1 353 1 1 24 ARG HA H -16.391 -5.360 -0.922 1.00 . A A . 24 ARG HA 1 1 1 354 1 1 24 ARG HB2 H -17.764 -3.461 -0.493 1.00 . A A . 24 ARG HB2 1 1 1 355 1 1 24 ARG HB3 H -16.515 -2.347 -1.034 1.00 . A A . 24 ARG HB3 1 1 1 356 1 1 24 ARG HD2 H -19.326 -2.174 -2.304 1.00 . A A . 24 ARG HD2 1 1 1 357 1 1 24 ARG HD3 H -17.860 -1.219 -2.532 1.00 . A A . 24 ARG HD3 1 1 1 358 1 1 24 ARG HE H -18.650 -2.757 -4.842 1.00 . A A . 24 ARG HE 1 1 1 359 1 1 24 ARG HG2 H -16.757 -3.351 -3.322 1.00 . A A . 24 ARG HG2 1 1 1 360 1 1 24 ARG HG3 H -18.177 -4.201 -2.715 1.00 . A A . 24 ARG HG3 1 1 1 361 1 1 24 ARG HH11 H -18.943 0.293 -3.145 1.00 . A A . 24 ARG HH11 1 1 1 362 1 1 24 ARG HH12 H -19.450 1.171 -4.558 1.00 . A A . 24 ARG HH12 1 1 1 363 1 1 24 ARG HH21 H -19.255 -1.591 -6.705 1.00 . A A . 24 ARG HH21 1 1 1 364 1 1 24 ARG HH22 H -19.589 0.109 -6.590 1.00 . A A . 24 ARG HH22 1 1 1 365 1 1 24 ARG N N -15.179 -4.170 0.248 1.00 . A A . 24 ARG N 1 1 1 366 1 1 24 ARG NE N -18.720 -1.947 -4.281 1.00 . A A . 24 ARG NE 1 1 1 367 1 1 24 ARG NH1 N -19.159 0.310 -4.130 1.00 . A A . 24 ARG NH1 1 1 1 368 1 1 24 ARG NH2 N -19.331 -0.761 -6.152 1.00 . A A . 24 ARG NH2 1 1 1 369 1 1 24 ARG O O -14.087 -3.536 -2.295 1.00 . A A . 24 ARG O 1 1 1 370 1 1 25 ASN C C -15.156 -6.260 -5.311 1.00 . A A . 25 ASN C 1 1 1 371 1 1 25 ASN CA C -14.373 -5.440 -4.299 1.00 . A A . 25 ASN CA 1 1 1 372 1 1 25 ASN CB C -12.968 -6.023 -4.117 1.00 . A A . 25 ASN CB 1 1 1 373 1 1 25 ASN CG C -12.165 -5.980 -5.409 1.00 . A A . 25 ASN CG 1 1 1 374 1 1 25 ASN H H -15.746 -6.113 -2.843 1.00 . A A . 25 ASN H 1 1 1 375 1 1 25 ASN HA H -14.290 -4.428 -4.666 1.00 . A A . 25 ASN HA 1 1 1 376 1 1 25 ASN HB2 H -12.443 -5.454 -3.364 1.00 . A A . 25 ASN HB2 1 1 1 377 1 1 25 ASN HB3 H -13.049 -7.051 -3.797 1.00 . A A . 25 ASN HB3 1 1 1 378 1 1 25 ASN HD21 H -11.101 -7.571 -4.855 1.00 . A A . 25 ASN HD21 1 1 1 379 1 1 25 ASN HD22 H -10.698 -6.890 -6.395 1.00 . A A . 25 ASN HD22 1 1 1 380 1 1 25 ASN N N -15.107 -5.394 -3.045 1.00 . A A . 25 ASN N 1 1 1 381 1 1 25 ASN ND2 N -11.230 -6.907 -5.570 1.00 . A A . 25 ASN ND2 1 1 1 382 1 1 25 ASN O O -15.929 -5.663 -6.085 1.00 . A A . 25 ASN O 1 1 1 383 1 1 25 ASN OXT O -15.027 -7.502 -5.307 1.00 . A A . 25 ASN OXT 1 1 1 384 1 1 25 ASN OD1 O -12.378 -5.113 -6.258 1.00 . A A . 25 ASN OD1 1 1 2 385 1 1 1 CYS C C 4.567 3.437 -5.284 1.00 . A A . 1 CYS C 1 1 2 386 1 1 1 CYS CA C 3.110 3.134 -4.955 1.00 . A A . 1 CYS CA 1 1 2 387 1 1 1 CYS CB C 2.990 1.742 -4.335 1.00 . A A . 1 CYS CB 1 1 2 388 1 1 1 CYS H1 H 2.619 2.549 -6.892 1.00 . A A . 1 CYS H1 1 1 2 389 1 1 1 CYS H2 H 2.324 4.187 -6.560 1.00 . A A . 1 CYS H2 1 1 2 390 1 1 1 CYS H3 H 1.284 2.999 -5.948 1.00 . A A . 1 CYS H3 1 1 2 391 1 1 1 CYS HA H 2.755 3.867 -4.246 1.00 . A A . 1 CYS HA 1 1 2 392 1 1 1 CYS HB2 H 3.341 1.009 -5.044 1.00 . A A . 1 CYS HB2 1 1 2 393 1 1 1 CYS HB3 H 3.602 1.698 -3.446 1.00 . A A . 1 CYS HB3 1 1 2 394 1 1 1 CYS N N 2.277 3.222 -6.171 1.00 . A A . 1 CYS N 1 1 2 395 1 1 1 CYS O O 5.210 2.702 -6.034 1.00 . A A . 1 CYS O 1 1 2 396 1 1 1 CYS SG S 1.288 1.289 -3.859 1.00 . A A . 1 CYS SG 1 1 2 397 1 1 2 SER C C 7.349 4.382 -3.829 1.00 . A A . 2 SER C 1 1 2 398 1 1 2 SER CA C 6.467 4.920 -4.952 1.00 . A A . 2 SER CA 1 1 2 399 1 1 2 SER CB C 6.590 6.444 -5.018 1.00 . A A . 2 SER CB 1 1 2 400 1 1 2 SER H H 4.512 5.087 -4.154 1.00 . A A . 2 SER H 1 1 2 401 1 1 2 SER HA H 6.790 4.496 -5.890 1.00 . A A . 2 SER HA 1 1 2 402 1 1 2 SER HB2 H 6.314 6.867 -4.062 1.00 . A A . 2 SER HB2 1 1 2 403 1 1 2 SER HB3 H 7.612 6.710 -5.246 1.00 . A A . 2 SER HB3 1 1 2 404 1 1 2 SER HG H 5.765 6.427 -6.805 1.00 . A A . 2 SER HG 1 1 2 405 1 1 2 SER N N 5.081 4.529 -4.734 1.00 . A A . 2 SER N 1 1 2 406 1 1 2 SER O O 7.312 4.879 -2.705 1.00 . A A . 2 SER O 1 1 2 407 1 1 2 SER OG O 5.740 6.991 -6.015 1.00 . A A . 2 SER OG 1 1 2 408 1 1 3 CYS C C 10.404 3.287 -3.267 1.00 . A A . 3 CYS C 1 1 2 409 1 1 3 CYS CA C 8.987 2.739 -3.139 1.00 . A A . 3 CYS CA 1 1 2 410 1 1 3 CYS CB C 8.987 1.221 -3.325 1.00 . A A . 3 CYS CB 1 1 2 411 1 1 3 CYS H H 8.128 3.003 -5.048 1.00 . A A . 3 CYS H 1 1 2 412 1 1 3 CYS HA H 8.600 2.978 -2.160 1.00 . A A . 3 CYS HA 1 1 2 413 1 1 3 CYS HB2 H 9.812 0.942 -3.964 1.00 . A A . 3 CYS HB2 1 1 2 414 1 1 3 CYS HB3 H 9.111 0.748 -2.358 1.00 . A A . 3 CYS HB3 1 1 2 415 1 1 3 CYS N N 8.128 3.356 -4.132 1.00 . A A . 3 CYS N 1 1 2 416 1 1 3 CYS O O 11.232 2.727 -3.985 1.00 . A A . 3 CYS O 1 1 2 417 1 1 3 CYS SG S 7.455 0.566 -4.075 1.00 . A A . 3 CYS SG 1 1 2 418 1 1 4 THR C C 13.029 4.221 -1.939 1.00 . A A . 4 THR C 1 1 2 419 1 1 4 THR CA C 11.973 5.046 -2.667 1.00 . A A . 4 THR CA 1 1 2 420 1 1 4 THR CB C 11.911 6.456 -2.073 1.00 . A A . 4 THR CB 1 1 2 421 1 1 4 THR CG2 C 13.195 7.226 -2.342 1.00 . A A . 4 THR CG2 1 1 2 422 1 1 4 THR H H 9.972 4.800 -2.037 1.00 . A A . 4 THR H 1 1 2 423 1 1 4 THR HA H 12.248 5.132 -3.700 1.00 . A A . 4 THR HA 1 1 2 424 1 1 4 THR HB H 11.773 6.367 -1.014 1.00 . A A . 4 THR HB 1 1 2 425 1 1 4 THR HG1 H 10.835 7.096 -3.610 1.00 . A A . 4 THR HG1 1 1 2 426 1 1 4 THR HG21 H 13.326 7.344 -3.408 1.00 . A A . 4 THR HG21 1 1 2 427 1 1 4 THR HG22 H 14.032 6.677 -1.936 1.00 . A A . 4 THR HG22 1 1 2 428 1 1 4 THR HG23 H 13.138 8.196 -1.874 1.00 . A A . 4 THR HG23 1 1 2 429 1 1 4 THR N N 10.669 4.400 -2.596 1.00 . A A . 4 THR N 1 1 2 430 1 1 4 THR O O 13.168 4.316 -0.716 1.00 . A A . 4 THR O 1 1 2 431 1 1 4 THR OG1 O 10.801 7.166 -2.640 1.00 . A A . 4 THR OG1 1 1 2 432 1 1 5 ASP C C 14.156 1.693 -1.009 1.00 . A A . 5 ASP C 1 1 2 433 1 1 5 ASP CA C 14.746 2.470 -2.182 1.00 . A A . 5 ASP CA 1 1 2 434 1 1 5 ASP CB C 16.028 3.205 -1.771 1.00 . A A . 5 ASP CB 1 1 2 435 1 1 5 ASP CG C 17.201 2.258 -1.616 1.00 . A A . 5 ASP CG 1 1 2 436 1 1 5 ASP H H 13.587 3.418 -3.685 1.00 . A A . 5 ASP H 1 1 2 437 1 1 5 ASP HA H 14.982 1.769 -2.971 1.00 . A A . 5 ASP HA 1 1 2 438 1 1 5 ASP HB2 H 16.276 3.939 -2.526 1.00 . A A . 5 ASP HB2 1 1 2 439 1 1 5 ASP HB3 H 15.865 3.708 -0.828 1.00 . A A . 5 ASP HB3 1 1 2 440 1 1 5 ASP N N 13.747 3.401 -2.710 1.00 . A A . 5 ASP N 1 1 2 441 1 1 5 ASP O O 14.720 1.631 0.084 1.00 . A A . 5 ASP O 1 1 2 442 1 1 5 ASP OD1 O 17.554 1.583 -2.606 1.00 . A A . 5 ASP OD1 1 1 2 443 1 1 5 ASP OD2 O 17.789 2.200 -0.511 1.00 . A A . 5 ASP OD2 1 1 2 444 1 1 6 MET C C 11.968 -1.000 -0.570 1.00 . A A . 6 MET C 1 1 2 445 1 1 6 MET CA C 12.214 0.462 -0.223 1.00 . A A . 6 MET CA 1 1 2 446 1 1 6 MET CB C 10.884 1.206 -0.073 1.00 . A A . 6 MET CB 1 1 2 447 1 1 6 MET CE C 8.942 2.947 1.850 1.00 . A A . 6 MET CE 1 1 2 448 1 1 6 MET CG C 9.889 0.533 0.854 1.00 . A A . 6 MET CG 1 1 2 449 1 1 6 MET H H 12.664 1.096 -2.180 1.00 . A A . 6 MET H 1 1 2 450 1 1 6 MET HA H 12.761 0.522 0.705 1.00 . A A . 6 MET HA 1 1 2 451 1 1 6 MET HB2 H 11.081 2.195 0.310 1.00 . A A . 6 MET HB2 1 1 2 452 1 1 6 MET HB3 H 10.425 1.295 -1.047 1.00 . A A . 6 MET HB3 1 1 2 453 1 1 6 MET HE1 H 8.107 3.610 2.030 1.00 . A A . 6 MET HE1 1 1 2 454 1 1 6 MET HE2 H 9.671 3.447 1.225 1.00 . A A . 6 MET HE2 1 1 2 455 1 1 6 MET HE3 H 9.398 2.678 2.792 1.00 . A A . 6 MET HE3 1 1 2 456 1 1 6 MET HG2 H 9.653 -0.439 0.454 1.00 . A A . 6 MET HG2 1 1 2 457 1 1 6 MET HG3 H 10.341 0.422 1.823 1.00 . A A . 6 MET HG3 1 1 2 458 1 1 6 MET N N 13.000 1.104 -1.260 1.00 . A A . 6 MET N 1 1 2 459 1 1 6 MET O O 11.892 -1.354 -1.745 1.00 . A A . 6 MET O 1 1 2 460 1 1 6 MET SD S 8.359 1.466 1.028 1.00 . A A . 6 MET SD 1 1 2 461 1 1 7 SER C C 10.187 -3.348 -0.382 1.00 . A A . 7 SER C 1 1 2 462 1 1 7 SER CA C 11.552 -3.230 0.263 1.00 . A A . 7 SER CA 1 1 2 463 1 1 7 SER CB C 11.585 -3.946 1.609 1.00 . A A . 7 SER CB 1 1 2 464 1 1 7 SER H H 11.988 -1.523 1.346 1.00 . A A . 7 SER H 1 1 2 465 1 1 7 SER HA H 12.294 -3.659 -0.392 1.00 . A A . 7 SER HA 1 1 2 466 1 1 7 SER HB2 H 10.715 -3.674 2.187 1.00 . A A . 7 SER HB2 1 1 2 467 1 1 7 SER HB3 H 11.594 -5.014 1.448 1.00 . A A . 7 SER HB3 1 1 2 468 1 1 7 SER HG H 12.621 -3.792 3.270 1.00 . A A . 7 SER HG 1 1 2 469 1 1 7 SER N N 11.862 -1.842 0.448 1.00 . A A . 7 SER N 1 1 2 470 1 1 7 SER O O 9.236 -2.677 0.017 1.00 . A A . 7 SER O 1 1 2 471 1 1 7 SER OG O 12.749 -3.583 2.332 1.00 . A A . 7 SER OG 1 1 2 472 1 1 8 ASP C C 7.702 -4.719 -1.310 1.00 . A A . 8 ASP C 1 1 2 473 1 1 8 ASP CA C 8.902 -4.342 -2.187 1.00 . A A . 8 ASP CA 1 1 2 474 1 1 8 ASP CB C 9.114 -5.388 -3.292 1.00 . A A . 8 ASP CB 1 1 2 475 1 1 8 ASP CG C 9.047 -6.820 -2.798 1.00 . A A . 8 ASP CG 1 1 2 476 1 1 8 ASP H H 10.926 -4.684 -1.611 1.00 . A A . 8 ASP H 1 1 2 477 1 1 8 ASP HA H 8.692 -3.390 -2.653 1.00 . A A . 8 ASP HA 1 1 2 478 1 1 8 ASP HB2 H 8.354 -5.258 -4.046 1.00 . A A . 8 ASP HB2 1 1 2 479 1 1 8 ASP HB3 H 10.085 -5.229 -3.739 1.00 . A A . 8 ASP HB3 1 1 2 480 1 1 8 ASP N N 10.119 -4.175 -1.387 1.00 . A A . 8 ASP N 1 1 2 481 1 1 8 ASP O O 6.593 -4.225 -1.517 1.00 . A A . 8 ASP O 1 1 2 482 1 1 8 ASP OD1 O 9.905 -7.222 -1.989 1.00 . A A . 8 ASP OD1 1 1 2 483 1 1 8 ASP OD2 O 8.137 -7.558 -3.236 1.00 . A A . 8 ASP OD2 1 1 2 484 1 1 9 LEU C C 6.551 -4.781 1.551 1.00 . A A . 9 LEU C 1 1 2 485 1 1 9 LEU CA C 6.886 -5.950 0.627 1.00 . A A . 9 LEU CA 1 1 2 486 1 1 9 LEU CB C 7.321 -7.169 1.444 1.00 . A A . 9 LEU CB 1 1 2 487 1 1 9 LEU CD1 C 5.057 -8.227 1.638 1.00 . A A . 9 LEU CD1 1 1 2 488 1 1 9 LEU CD2 C 6.862 -8.832 3.249 1.00 . A A . 9 LEU CD2 1 1 2 489 1 1 9 LEU CG C 6.268 -7.723 2.402 1.00 . A A . 9 LEU CG 1 1 2 490 1 1 9 LEU H H 8.839 -5.945 -0.209 1.00 . A A . 9 LEU H 1 1 2 491 1 1 9 LEU HA H 6.006 -6.203 0.054 1.00 . A A . 9 LEU HA 1 1 2 492 1 1 9 LEU HB2 H 7.601 -7.953 0.755 1.00 . A A . 9 LEU HB2 1 1 2 493 1 1 9 LEU HB3 H 8.191 -6.897 2.022 1.00 . A A . 9 LEU HB3 1 1 2 494 1 1 9 LEU HD11 H 4.313 -8.575 2.336 1.00 . A A . 9 LEU HD11 1 1 2 495 1 1 9 LEU HD12 H 5.352 -9.039 0.990 1.00 . A A . 9 LEU HD12 1 1 2 496 1 1 9 LEU HD13 H 4.647 -7.423 1.046 1.00 . A A . 9 LEU HD13 1 1 2 497 1 1 9 LEU HD21 H 7.214 -9.626 2.605 1.00 . A A . 9 LEU HD21 1 1 2 498 1 1 9 LEU HD22 H 6.106 -9.218 3.918 1.00 . A A . 9 LEU HD22 1 1 2 499 1 1 9 LEU HD23 H 7.688 -8.440 3.825 1.00 . A A . 9 LEU HD23 1 1 2 500 1 1 9 LEU HG H 5.940 -6.933 3.065 1.00 . A A . 9 LEU HG 1 1 2 501 1 1 9 LEU N N 7.934 -5.563 -0.311 1.00 . A A . 9 LEU N 1 1 2 502 1 1 9 LEU O O 5.386 -4.535 1.867 1.00 . A A . 9 LEU O 1 1 2 503 1 1 10 GLU C C 6.570 -1.828 2.079 1.00 . A A . 10 GLU C 1 1 2 504 1 1 10 GLU CA C 7.420 -2.874 2.802 1.00 . A A . 10 GLU CA 1 1 2 505 1 1 10 GLU CB C 8.793 -2.283 3.147 1.00 . A A . 10 GLU CB 1 1 2 506 1 1 10 GLU CD C 10.144 -0.660 4.536 1.00 . A A . 10 GLU CD 1 1 2 507 1 1 10 GLU CG C 8.766 -1.222 4.238 1.00 . A A . 10 GLU CG 1 1 2 508 1 1 10 GLU H H 8.486 -4.306 1.662 1.00 . A A . 10 GLU H 1 1 2 509 1 1 10 GLU HA H 6.920 -3.176 3.709 1.00 . A A . 10 GLU HA 1 1 2 510 1 1 10 GLU HB2 H 9.448 -3.080 3.465 1.00 . A A . 10 GLU HB2 1 1 2 511 1 1 10 GLU HB3 H 9.202 -1.834 2.253 1.00 . A A . 10 GLU HB3 1 1 2 512 1 1 10 GLU HG2 H 8.124 -0.413 3.921 1.00 . A A . 10 GLU HG2 1 1 2 513 1 1 10 GLU HG3 H 8.370 -1.662 5.141 1.00 . A A . 10 GLU HG3 1 1 2 514 1 1 10 GLU N N 7.585 -4.051 1.954 1.00 . A A . 10 GLU N 1 1 2 515 1 1 10 GLU O O 5.697 -1.190 2.672 1.00 . A A . 10 GLU O 1 1 2 516 1 1 10 GLU OE1 O 10.925 -1.330 5.241 1.00 . A A . 10 GLU OE1 1 1 2 517 1 1 10 GLU OE2 O 10.452 0.458 4.067 1.00 . A A . 10 GLU OE2 1 1 2 518 1 1 11 CYS C C 4.636 -1.072 -0.130 1.00 . A A . 11 CYS C 1 1 2 519 1 1 11 CYS CA C 6.122 -0.737 -0.057 1.00 . A A . 11 CYS CA 1 1 2 520 1 1 11 CYS CB C 6.736 -0.740 -1.458 1.00 . A A . 11 CYS CB 1 1 2 521 1 1 11 CYS H H 7.532 -2.246 0.382 1.00 . A A . 11 CYS H 1 1 2 522 1 1 11 CYS HA H 6.239 0.245 0.377 1.00 . A A . 11 CYS HA 1 1 2 523 1 1 11 CYS HB2 H 7.806 -0.615 -1.373 1.00 . A A . 11 CYS HB2 1 1 2 524 1 1 11 CYS HB3 H 6.530 -1.691 -1.930 1.00 . A A . 11 CYS HB3 1 1 2 525 1 1 11 CYS N N 6.827 -1.691 0.786 1.00 . A A . 11 CYS N 1 1 2 526 1 1 11 CYS O O 3.780 -0.199 0.014 1.00 . A A . 11 CYS O 1 1 2 527 1 1 11 CYS SG S 6.115 0.571 -2.553 1.00 . A A . 11 CYS SG 1 1 2 528 1 1 12 MET C C 2.255 -2.636 0.942 1.00 . A A . 12 MET C 1 1 2 529 1 1 12 MET CA C 2.945 -2.792 -0.404 1.00 . A A . 12 MET CA 1 1 2 530 1 1 12 MET CB C 2.864 -4.242 -0.888 1.00 . A A . 12 MET CB 1 1 2 531 1 1 12 MET CE C 4.117 -7.066 -1.854 1.00 . A A . 12 MET CE 1 1 2 532 1 1 12 MET CG C 3.364 -4.435 -2.311 1.00 . A A . 12 MET CG 1 1 2 533 1 1 12 MET H H 5.052 -3.006 -0.426 1.00 . A A . 12 MET H 1 1 2 534 1 1 12 MET HA H 2.435 -2.159 -1.114 1.00 . A A . 12 MET HA 1 1 2 535 1 1 12 MET HB2 H 3.455 -4.863 -0.233 1.00 . A A . 12 MET HB2 1 1 2 536 1 1 12 MET HB3 H 1.833 -4.566 -0.844 1.00 . A A . 12 MET HB3 1 1 2 537 1 1 12 MET HE1 H 3.811 -6.917 -0.831 1.00 . A A . 12 MET HE1 1 1 2 538 1 1 12 MET HE2 H 5.144 -6.751 -1.971 1.00 . A A . 12 MET HE2 1 1 2 539 1 1 12 MET HE3 H 4.030 -8.112 -2.107 1.00 . A A . 12 MET HE3 1 1 2 540 1 1 12 MET HG2 H 2.860 -3.729 -2.954 1.00 . A A . 12 MET HG2 1 1 2 541 1 1 12 MET HG3 H 4.428 -4.244 -2.332 1.00 . A A . 12 MET HG3 1 1 2 542 1 1 12 MET N N 4.329 -2.348 -0.327 1.00 . A A . 12 MET N 1 1 2 543 1 1 12 MET O O 1.041 -2.506 1.008 1.00 . A A . 12 MET O 1 1 2 544 1 1 12 MET SD S 3.068 -6.099 -2.939 1.00 . A A . 12 MET SD 1 1 2 545 1 1 13 ASN C C 2.133 -0.945 3.563 1.00 . A A . 13 ASN C 1 1 2 546 1 1 13 ASN CA C 2.474 -2.412 3.336 1.00 . A A . 13 ASN CA 1 1 2 547 1 1 13 ASN CB C 3.435 -2.907 4.416 1.00 . A A . 13 ASN CB 1 1 2 548 1 1 13 ASN CG C 3.193 -4.360 4.785 1.00 . A A . 13 ASN CG 1 1 2 549 1 1 13 ASN H H 3.999 -2.761 1.909 1.00 . A A . 13 ASN H 1 1 2 550 1 1 13 ASN HA H 1.560 -2.985 3.397 1.00 . A A . 13 ASN HA 1 1 2 551 1 1 13 ASN HB2 H 4.452 -2.808 4.060 1.00 . A A . 13 ASN HB2 1 1 2 552 1 1 13 ASN HB3 H 3.310 -2.304 5.303 1.00 . A A . 13 ASN HB3 1 1 2 553 1 1 13 ASN HD21 H 4.422 -4.976 3.350 1.00 . A A . 13 ASN HD21 1 1 2 554 1 1 13 ASN HD22 H 3.684 -6.226 4.302 1.00 . A A . 13 ASN HD22 1 1 2 555 1 1 13 ASN N N 3.031 -2.622 2.012 1.00 . A A . 13 ASN N 1 1 2 556 1 1 13 ASN ND2 N 3.831 -5.276 4.075 1.00 . A A . 13 ASN ND2 1 1 2 557 1 1 13 ASN O O 0.990 -0.611 3.861 1.00 . A A . 13 ASN O 1 1 2 558 1 1 13 ASN OD1 O 2.424 -4.656 5.699 1.00 . A A . 13 ASN OD1 1 1 2 559 1 1 14 PHE C C 1.986 2.031 2.712 1.00 . A A . 14 PHE C 1 1 2 560 1 1 14 PHE CA C 2.928 1.348 3.708 1.00 . A A . 14 PHE CA 1 1 2 561 1 1 14 PHE CB C 4.284 2.080 3.766 1.00 . A A . 14 PHE CB 1 1 2 562 1 1 14 PHE CD1 C 5.134 2.310 1.406 1.00 . A A . 14 PHE CD1 1 1 2 563 1 1 14 PHE CD2 C 4.426 4.281 2.546 1.00 . A A . 14 PHE CD2 1 1 2 564 1 1 14 PHE CE1 C 5.443 3.063 0.288 1.00 . A A . 14 PHE CE1 1 1 2 565 1 1 14 PHE CE2 C 4.734 5.039 1.430 1.00 . A A . 14 PHE CE2 1 1 2 566 1 1 14 PHE CG C 4.617 2.909 2.547 1.00 . A A . 14 PHE CG 1 1 2 567 1 1 14 PHE CZ C 5.210 4.440 0.300 1.00 . A A . 14 PHE CZ 1 1 2 568 1 1 14 PHE H H 3.987 -0.373 3.052 1.00 . A A . 14 PHE H 1 1 2 569 1 1 14 PHE HA H 2.474 1.397 4.686 1.00 . A A . 14 PHE HA 1 1 2 570 1 1 14 PHE HB2 H 4.287 2.739 4.620 1.00 . A A . 14 PHE HB2 1 1 2 571 1 1 14 PHE HB3 H 5.069 1.346 3.889 1.00 . A A . 14 PHE HB3 1 1 2 572 1 1 14 PHE HD1 H 5.287 1.240 1.393 1.00 . A A . 14 PHE HD1 1 1 2 573 1 1 14 PHE HD2 H 4.025 4.760 3.427 1.00 . A A . 14 PHE HD2 1 1 2 574 1 1 14 PHE HE1 H 5.842 2.584 -0.593 1.00 . A A . 14 PHE HE1 1 1 2 575 1 1 14 PHE HE2 H 4.578 6.107 1.443 1.00 . A A . 14 PHE HE2 1 1 2 576 1 1 14 PHE HZ H 5.443 5.035 -0.571 1.00 . A A . 14 PHE HZ 1 1 2 577 1 1 14 PHE N N 3.114 -0.065 3.390 1.00 . A A . 14 PHE N 1 1 2 578 1 1 14 PHE O O 1.239 2.932 3.081 1.00 . A A . 14 PHE O 1 1 2 579 1 1 15 CYS C C -0.230 1.760 0.444 1.00 . A A . 15 CYS C 1 1 2 580 1 1 15 CYS CA C 1.218 2.239 0.418 1.00 . A A . 15 CYS CA 1 1 2 581 1 1 15 CYS CB C 1.834 1.972 -0.955 1.00 . A A . 15 CYS CB 1 1 2 582 1 1 15 CYS H H 2.599 0.843 1.221 1.00 . A A . 15 CYS H 1 1 2 583 1 1 15 CYS HA H 1.232 3.303 0.602 1.00 . A A . 15 CYS HA 1 1 2 584 1 1 15 CYS HB2 H 2.799 2.451 -1.006 1.00 . A A . 15 CYS HB2 1 1 2 585 1 1 15 CYS HB3 H 1.961 0.905 -1.082 1.00 . A A . 15 CYS HB3 1 1 2 586 1 1 15 CYS N N 2.014 1.599 1.458 1.00 . A A . 15 CYS N 1 1 2 587 1 1 15 CYS O O -1.161 2.563 0.362 1.00 . A A . 15 CYS O 1 1 2 588 1 1 15 CYS SG S 0.844 2.582 -2.357 1.00 . A A . 15 CYS SG 1 1 2 589 1 1 16 HIS C C -2.609 0.137 1.707 1.00 . A A . 16 HIS C 1 1 2 590 1 1 16 HIS CA C -1.750 -0.137 0.476 1.00 . A A . 16 HIS CA 1 1 2 591 1 1 16 HIS CB C -1.656 -1.647 0.239 1.00 . A A . 16 HIS CB 1 1 2 592 1 1 16 HIS CD2 C -0.468 -1.373 -2.054 1.00 . A A . 16 HIS CD2 1 1 2 593 1 1 16 HIS CE1 C -0.959 -3.333 -2.898 1.00 . A A . 16 HIS CE1 1 1 2 594 1 1 16 HIS CG C -1.210 -2.035 -1.138 1.00 . A A . 16 HIS CG 1 1 2 595 1 1 16 HIS H H 0.346 -0.120 0.806 1.00 . A A . 16 HIS H 1 1 2 596 1 1 16 HIS HA H -2.230 0.316 -0.381 1.00 . A A . 16 HIS HA 1 1 2 597 1 1 16 HIS HB2 H -0.945 -2.066 0.936 1.00 . A A . 16 HIS HB2 1 1 2 598 1 1 16 HIS HB3 H -2.627 -2.089 0.413 1.00 . A A . 16 HIS HB3 1 1 2 599 1 1 16 HIS HD1 H -2.039 -3.978 -1.277 1.00 . A A . 16 HIS HD1 1 1 2 600 1 1 16 HIS HD2 H -0.053 -0.379 -1.946 1.00 . A A . 16 HIS HD2 1 1 2 601 1 1 16 HIS HE1 H -1.019 -4.178 -3.569 1.00 . A A . 16 HIS HE1 1 1 2 602 1 1 16 HIS HE2 H 0.292 -2.049 -3.900 1.00 . A A . 16 HIS HE2 1 1 2 603 1 1 16 HIS N N -0.420 0.456 0.594 1.00 . A A . 16 HIS N 1 1 2 604 1 1 16 HIS ND1 N -1.502 -3.258 -1.700 1.00 . A A . 16 HIS ND1 1 1 2 605 1 1 16 HIS NE2 N -0.325 -2.201 -3.139 1.00 . A A . 16 HIS NE2 1 1 2 606 1 1 16 HIS O O -3.822 -0.048 1.669 1.00 . A A . 16 HIS O 1 1 2 607 1 1 17 LYS C C -3.338 2.211 4.073 1.00 . A A . 17 LYS C 1 1 2 608 1 1 17 LYS CA C -2.732 0.826 4.031 1.00 . A A . 17 LYS CA 1 1 2 609 1 1 17 LYS CB C -1.840 0.607 5.260 1.00 . A A . 17 LYS CB 1 1 2 610 1 1 17 LYS CD C 0.113 1.398 6.636 1.00 . A A . 17 LYS CD 1 1 2 611 1 1 17 LYS CE C 1.274 2.379 6.724 1.00 . A A . 17 LYS CE 1 1 2 612 1 1 17 LYS CG C -0.689 1.594 5.360 1.00 . A A . 17 LYS CG 1 1 2 613 1 1 17 LYS H H -1.031 0.784 2.758 1.00 . A A . 17 LYS H 1 1 2 614 1 1 17 LYS HA H -3.534 0.131 4.053 1.00 . A A . 17 LYS HA 1 1 2 615 1 1 17 LYS HB2 H -2.445 0.702 6.149 1.00 . A A . 17 LYS HB2 1 1 2 616 1 1 17 LYS HB3 H -1.427 -0.390 5.221 1.00 . A A . 17 LYS HB3 1 1 2 617 1 1 17 LYS HD2 H -0.535 1.549 7.486 1.00 . A A . 17 LYS HD2 1 1 2 618 1 1 17 LYS HD3 H 0.503 0.391 6.652 1.00 . A A . 17 LYS HD3 1 1 2 619 1 1 17 LYS HE2 H 1.831 2.173 7.624 1.00 . A A . 17 LYS HE2 1 1 2 620 1 1 17 LYS HE3 H 1.914 2.237 5.865 1.00 . A A . 17 LYS HE3 1 1 2 621 1 1 17 LYS HG2 H -0.035 1.456 4.512 1.00 . A A . 17 LYS HG2 1 1 2 622 1 1 17 LYS HG3 H -1.089 2.598 5.347 1.00 . A A . 17 LYS HG3 1 1 2 623 1 1 17 LYS HZ1 H 0.274 4.023 5.893 1.00 . A A . 17 LYS HZ1 1 1 2 624 1 1 17 LYS HZ2 H 1.637 4.434 6.812 1.00 . A A . 17 LYS HZ2 1 1 2 625 1 1 17 LYS HZ3 H 0.212 3.959 7.589 1.00 . A A . 17 LYS HZ3 1 1 2 626 1 1 17 LYS N N -1.993 0.597 2.791 1.00 . A A . 17 LYS N 1 1 2 627 1 1 17 LYS NZ N 0.818 3.794 6.756 1.00 . A A . 17 LYS NZ 1 1 2 628 1 1 17 LYS O O -4.043 2.564 5.016 1.00 . A A . 17 LYS O 1 1 2 629 1 1 18 ASP C C -4.137 4.686 1.634 1.00 . A A . 18 ASP C 1 1 2 630 1 1 18 ASP CA C -3.571 4.345 2.998 1.00 . A A . 18 ASP CA 1 1 2 631 1 1 18 ASP CB C -2.456 5.332 3.315 1.00 . A A . 18 ASP CB 1 1 2 632 1 1 18 ASP CG C -1.799 5.114 4.664 1.00 . A A . 18 ASP CG 1 1 2 633 1 1 18 ASP H H -2.565 2.622 2.299 1.00 . A A . 18 ASP H 1 1 2 634 1 1 18 ASP HA H -4.351 4.446 3.735 1.00 . A A . 18 ASP HA 1 1 2 635 1 1 18 ASP HB2 H -1.704 5.263 2.551 1.00 . A A . 18 ASP HB2 1 1 2 636 1 1 18 ASP HB3 H -2.876 6.314 3.304 1.00 . A A . 18 ASP HB3 1 1 2 637 1 1 18 ASP N N -3.086 2.978 3.042 1.00 . A A . 18 ASP N 1 1 2 638 1 1 18 ASP O O -4.337 5.861 1.320 1.00 . A A . 18 ASP O 1 1 2 639 1 1 18 ASP OD1 O -2.437 5.396 5.699 1.00 . A A . 18 ASP OD1 1 1 2 640 1 1 18 ASP OD2 O -0.651 4.621 4.700 1.00 . A A . 18 ASP OD2 1 1 2 641 1 1 19 VAL C C -6.336 4.464 -0.426 1.00 . A A . 19 VAL C 1 1 2 642 1 1 19 VAL CA C -4.926 3.903 -0.512 1.00 . A A . 19 VAL CA 1 1 2 643 1 1 19 VAL CB C -4.927 2.633 -1.387 1.00 . A A . 19 VAL CB 1 1 2 644 1 1 19 VAL CG1 C -3.517 2.294 -1.826 1.00 . A A . 19 VAL CG1 1 1 2 645 1 1 19 VAL CG2 C -5.556 1.464 -0.656 1.00 . A A . 19 VAL CG2 1 1 2 646 1 1 19 VAL H H -4.231 2.757 1.125 1.00 . A A . 19 VAL H 1 1 2 647 1 1 19 VAL HA H -4.296 4.638 -0.993 1.00 . A A . 19 VAL HA 1 1 2 648 1 1 19 VAL HB H -5.514 2.833 -2.272 1.00 . A A . 19 VAL HB 1 1 2 649 1 1 19 VAL HG11 H -3.534 1.392 -2.423 1.00 . A A . 19 VAL HG11 1 1 2 650 1 1 19 VAL HG12 H -2.897 2.142 -0.958 1.00 . A A . 19 VAL HG12 1 1 2 651 1 1 19 VAL HG13 H -3.122 3.108 -2.417 1.00 . A A . 19 VAL HG13 1 1 2 652 1 1 19 VAL HG21 H -4.986 1.249 0.233 1.00 . A A . 19 VAL HG21 1 1 2 653 1 1 19 VAL HG22 H -5.562 0.599 -1.301 1.00 . A A . 19 VAL HG22 1 1 2 654 1 1 19 VAL HG23 H -6.569 1.719 -0.382 1.00 . A A . 19 VAL HG23 1 1 2 655 1 1 19 VAL N N -4.389 3.673 0.818 1.00 . A A . 19 VAL N 1 1 2 656 1 1 19 VAL O O -7.234 3.856 0.158 1.00 . A A . 19 VAL O 1 1 2 657 1 1 20 ILE C C -8.645 5.797 -2.154 1.00 . A A . 20 ILE C 1 1 2 658 1 1 20 ILE CA C -7.804 6.293 -0.983 1.00 . A A . 20 ILE CA 1 1 2 659 1 1 20 ILE CB C -7.637 7.825 -1.044 1.00 . A A . 20 ILE CB 1 1 2 660 1 1 20 ILE CD1 C -8.698 8.075 1.235 1.00 . A A . 20 ILE CD1 1 1 2 661 1 1 20 ILE CG1 C -8.727 8.498 -0.217 1.00 . A A . 20 ILE CG1 1 1 2 662 1 1 20 ILE CG2 C -7.655 8.329 -2.481 1.00 . A A . 20 ILE CG2 1 1 2 663 1 1 20 ILE H H -5.746 6.092 -1.413 1.00 . A A . 20 ILE H 1 1 2 664 1 1 20 ILE HA H -8.302 6.038 -0.061 1.00 . A A . 20 ILE HA 1 1 2 665 1 1 20 ILE HB H -6.675 8.072 -0.620 1.00 . A A . 20 ILE HB 1 1 2 666 1 1 20 ILE HD11 H -7.709 8.252 1.642 1.00 . A A . 20 ILE HD11 1 1 2 667 1 1 20 ILE HD12 H -8.931 7.023 1.309 1.00 . A A . 20 ILE HD12 1 1 2 668 1 1 20 ILE HD13 H -9.425 8.647 1.792 1.00 . A A . 20 ILE HD13 1 1 2 669 1 1 20 ILE HG12 H -8.596 9.571 -0.257 1.00 . A A . 20 ILE HG12 1 1 2 670 1 1 20 ILE HG13 H -9.693 8.239 -0.622 1.00 . A A . 20 ILE HG13 1 1 2 671 1 1 20 ILE HG21 H -7.520 9.400 -2.490 1.00 . A A . 20 ILE HG21 1 1 2 672 1 1 20 ILE HG22 H -8.604 8.080 -2.935 1.00 . A A . 20 ILE HG22 1 1 2 673 1 1 20 ILE HG23 H -6.858 7.857 -3.038 1.00 . A A . 20 ILE HG23 1 1 2 674 1 1 20 ILE N N -6.514 5.639 -0.992 1.00 . A A . 20 ILE N 1 1 2 675 1 1 20 ILE O O -9.845 6.060 -2.244 1.00 . A A . 20 ILE O 1 1 2 676 1 1 21 TRP C C -8.933 3.056 -4.045 1.00 . A A . 21 TRP C 1 1 2 677 1 1 21 TRP CA C -8.625 4.521 -4.226 1.00 . A A . 21 TRP CA 1 1 2 678 1 1 21 TRP CB C -7.724 4.718 -5.436 1.00 . A A . 21 TRP CB 1 1 2 679 1 1 21 TRP CD1 C -5.353 5.286 -4.619 1.00 . A A . 21 TRP CD1 1 1 2 680 1 1 21 TRP CD2 C -5.566 3.242 -5.485 1.00 . A A . 21 TRP CD2 1 1 2 681 1 1 21 TRP CE2 C -4.229 3.425 -5.097 1.00 . A A . 21 TRP CE2 1 1 2 682 1 1 21 TRP CE3 C -5.946 2.035 -6.052 1.00 . A A . 21 TRP CE3 1 1 2 683 1 1 21 TRP CG C -6.268 4.442 -5.178 1.00 . A A . 21 TRP CG 1 1 2 684 1 1 21 TRP CH2 C -3.665 1.256 -5.827 1.00 . A A . 21 TRP CH2 1 1 2 685 1 1 21 TRP CZ2 C -3.265 2.438 -5.267 1.00 . A A . 21 TRP CZ2 1 1 2 686 1 1 21 TRP CZ3 C -4.992 1.049 -6.219 1.00 . A A . 21 TRP CZ3 1 1 2 687 1 1 21 TRP H H -7.047 4.856 -2.880 1.00 . A A . 21 TRP H 1 1 2 688 1 1 21 TRP HA H -9.549 5.055 -4.380 1.00 . A A . 21 TRP HA 1 1 2 689 1 1 21 TRP HB2 H -8.051 4.043 -6.219 1.00 . A A . 21 TRP HB2 1 1 2 690 1 1 21 TRP HB3 H -7.815 5.732 -5.775 1.00 . A A . 21 TRP HB3 1 1 2 691 1 1 21 TRP HD1 H -5.578 6.279 -4.270 1.00 . A A . 21 TRP HD1 1 1 2 692 1 1 21 TRP HE1 H -3.300 5.086 -4.221 1.00 . A A . 21 TRP HE1 1 1 2 693 1 1 21 TRP HE3 H -6.968 1.867 -6.352 1.00 . A A . 21 TRP HE3 1 1 2 694 1 1 21 TRP HH2 H -2.952 0.460 -5.975 1.00 . A A . 21 TRP HH2 1 1 2 695 1 1 21 TRP HZ2 H -2.238 2.583 -4.968 1.00 . A A . 21 TRP HZ2 1 1 2 696 1 1 21 TRP HZ3 H -5.268 0.103 -6.658 1.00 . A A . 21 TRP HZ3 1 1 2 697 1 1 21 TRP N N -7.993 5.057 -3.038 1.00 . A A . 21 TRP N 1 1 2 698 1 1 21 TRP NE1 N -4.122 4.682 -4.571 1.00 . A A . 21 TRP NE1 1 1 2 699 1 1 21 TRP O O -9.020 2.296 -5.005 1.00 . A A . 21 TRP O 1 1 2 700 1 1 22 VAL C C -10.759 0.887 -3.037 1.00 . A A . 22 VAL C 1 1 2 701 1 1 22 VAL CA C -9.397 1.301 -2.467 1.00 . A A . 22 VAL CA 1 1 2 702 1 1 22 VAL CB C -9.329 1.086 -0.938 1.00 . A A . 22 VAL CB 1 1 2 703 1 1 22 VAL CG1 C -10.200 2.094 -0.207 1.00 . A A . 22 VAL CG1 1 1 2 704 1 1 22 VAL CG2 C -9.709 -0.337 -0.571 1.00 . A A . 22 VAL CG2 1 1 2 705 1 1 22 VAL H H -9.060 3.345 -2.092 1.00 . A A . 22 VAL H 1 1 2 706 1 1 22 VAL HA H -8.633 0.688 -2.923 1.00 . A A . 22 VAL HA 1 1 2 707 1 1 22 VAL HB H -8.308 1.248 -0.626 1.00 . A A . 22 VAL HB 1 1 2 708 1 1 22 VAL HG11 H -10.105 1.948 0.858 1.00 . A A . 22 VAL HG11 1 1 2 709 1 1 22 VAL HG12 H -11.230 1.959 -0.503 1.00 . A A . 22 VAL HG12 1 1 2 710 1 1 22 VAL HG13 H -9.877 3.094 -0.465 1.00 . A A . 22 VAL HG13 1 1 2 711 1 1 22 VAL HG21 H -10.708 -0.545 -0.927 1.00 . A A . 22 VAL HG21 1 1 2 712 1 1 22 VAL HG22 H -9.678 -0.453 0.501 1.00 . A A . 22 VAL HG22 1 1 2 713 1 1 22 VAL HG23 H -9.013 -1.022 -1.031 1.00 . A A . 22 VAL HG23 1 1 2 714 1 1 22 VAL N N -9.109 2.675 -2.803 1.00 . A A . 22 VAL N 1 1 2 715 1 1 22 VAL O O -11.801 1.382 -2.603 1.00 . A A . 22 VAL O 1 1 2 716 1 1 23 ASN C C -12.257 0.173 -5.983 1.00 . A A . 23 ASN C 1 1 2 717 1 1 23 ASN CA C -11.858 -0.582 -4.726 1.00 . A A . 23 ASN CA 1 1 2 718 1 1 23 ASN CB C -13.094 -0.709 -3.823 1.00 . A A . 23 ASN CB 1 1 2 719 1 1 23 ASN CG C -12.930 -1.684 -2.673 1.00 . A A . 23 ASN CG 1 1 2 720 1 1 23 ASN H H -9.815 -0.151 -4.442 1.00 . A A . 23 ASN H 1 1 2 721 1 1 23 ASN HA H -11.556 -1.576 -5.023 1.00 . A A . 23 ASN HA 1 1 2 722 1 1 23 ASN HB2 H -13.325 0.261 -3.408 1.00 . A A . 23 ASN HB2 1 1 2 723 1 1 23 ASN HB3 H -13.917 -1.035 -4.429 1.00 . A A . 23 ASN HB3 1 1 2 724 1 1 23 ASN HD21 H -12.564 -0.186 -1.426 1.00 . A A . 23 ASN HD21 1 1 2 725 1 1 23 ASN HD22 H -12.550 -1.770 -0.722 1.00 . A A . 23 ASN HD22 1 1 2 726 1 1 23 ASN N N -10.696 0.037 -4.069 1.00 . A A . 23 ASN N 1 1 2 727 1 1 23 ASN ND2 N -12.652 -1.162 -1.490 1.00 . A A . 23 ASN ND2 1 1 2 728 1 1 23 ASN O O -11.913 1.346 -6.156 1.00 . A A . 23 ASN O 1 1 2 729 1 1 23 ASN OD1 O -13.094 -2.892 -2.839 1.00 . A A . 23 ASN OD1 1 1 2 730 1 1 24 ARG C C -12.501 0.294 -9.139 1.00 . A A . 24 ARG C 1 1 2 731 1 1 24 ARG CA C -13.555 0.012 -8.082 1.00 . A A . 24 ARG CA 1 1 2 732 1 1 24 ARG CB C -14.342 1.295 -7.817 1.00 . A A . 24 ARG CB 1 1 2 733 1 1 24 ARG CD C -15.472 3.257 -8.911 1.00 . A A . 24 ARG CD 1 1 2 734 1 1 24 ARG CG C -15.115 1.787 -9.035 1.00 . A A . 24 ARG CG 1 1 2 735 1 1 24 ARG CZ C -14.197 5.334 -8.519 1.00 . A A . 24 ARG CZ 1 1 2 736 1 1 24 ARG H H -13.132 -1.489 -6.655 1.00 . A A . 24 ARG H 1 1 2 737 1 1 24 ARG HA H -14.231 -0.728 -8.472 1.00 . A A . 24 ARG HA 1 1 2 738 1 1 24 ARG HB2 H -15.044 1.117 -7.016 1.00 . A A . 24 ARG HB2 1 1 2 739 1 1 24 ARG HB3 H -13.652 2.067 -7.519 1.00 . A A . 24 ARG HB3 1 1 2 740 1 1 24 ARG HD2 H -16.179 3.509 -9.688 1.00 . A A . 24 ARG HD2 1 1 2 741 1 1 24 ARG HD3 H -15.923 3.426 -7.944 1.00 . A A . 24 ARG HD3 1 1 2 742 1 1 24 ARG HE H -13.535 3.767 -9.577 1.00 . A A . 24 ARG HE 1 1 2 743 1 1 24 ARG HG2 H -14.507 1.650 -9.917 1.00 . A A . 24 ARG HG2 1 1 2 744 1 1 24 ARG HG3 H -16.026 1.212 -9.132 1.00 . A A . 24 ARG HG3 1 1 2 745 1 1 24 ARG HH11 H -15.987 5.255 -7.562 1.00 . A A . 24 ARG HH11 1 1 2 746 1 1 24 ARG HH12 H -15.095 6.733 -7.363 1.00 . A A . 24 ARG HH12 1 1 2 747 1 1 24 ARG HH21 H -12.366 5.713 -9.304 1.00 . A A . 24 ARG HH21 1 1 2 748 1 1 24 ARG HH22 H -13.049 6.991 -8.349 1.00 . A A . 24 ARG HH22 1 1 2 749 1 1 24 ARG N N -12.979 -0.535 -6.851 1.00 . A A . 24 ARG N 1 1 2 750 1 1 24 ARG NE N -14.293 4.116 -9.045 1.00 . A A . 24 ARG NE 1 1 2 751 1 1 24 ARG NH1 N -15.172 5.812 -7.758 1.00 . A A . 24 ARG NH1 1 1 2 752 1 1 24 ARG NH2 N -13.119 6.070 -8.743 1.00 . A A . 24 ARG NH2 1 1 2 753 1 1 24 ARG O O -12.426 -0.407 -10.145 1.00 . A A . 24 ARG O 1 1 2 754 1 1 25 ASN C C -11.582 2.509 -11.008 1.00 . A A . 25 ASN C 1 1 2 755 1 1 25 ASN CA C -10.777 1.869 -9.879 1.00 . A A . 25 ASN CA 1 1 2 756 1 1 25 ASN CB C -9.825 0.802 -10.438 1.00 . A A . 25 ASN CB 1 1 2 757 1 1 25 ASN CG C -8.803 1.378 -11.409 1.00 . A A . 25 ASN CG 1 1 2 758 1 1 25 ASN H H -11.711 1.706 -7.981 1.00 . A A . 25 ASN H 1 1 2 759 1 1 25 ASN HA H -10.195 2.642 -9.394 1.00 . A A . 25 ASN HA 1 1 2 760 1 1 25 ASN HB2 H -9.297 0.336 -9.621 1.00 . A A . 25 ASN HB2 1 1 2 761 1 1 25 ASN HB3 H -10.405 0.054 -10.958 1.00 . A A . 25 ASN HB3 1 1 2 762 1 1 25 ASN HD21 H -8.721 3.081 -10.376 1.00 . A A . 25 ASN HD21 1 1 2 763 1 1 25 ASN HD22 H -7.706 2.994 -11.780 1.00 . A A . 25 ASN HD22 1 1 2 764 1 1 25 ASN N N -11.691 1.312 -8.882 1.00 . A A . 25 ASN N 1 1 2 765 1 1 25 ASN ND2 N -8.367 2.606 -11.165 1.00 . A A . 25 ASN ND2 1 1 2 766 1 1 25 ASN O O -11.667 1.919 -12.105 1.00 . A A . 25 ASN O 1 1 2 767 1 1 25 ASN OXT O -12.168 3.589 -10.772 1.00 . A A . 25 ASN OXT 1 1 2 768 1 1 25 ASN OD1 O -8.400 0.715 -12.365 1.00 . A A . 25 ASN OD1 1 1 3 769 1 1 1 CYS C C 5.917 5.459 -5.635 1.00 . A A . 1 CYS C 1 1 3 770 1 1 1 CYS CA C 4.563 6.036 -5.250 1.00 . A A . 1 CYS CA 1 1 3 771 1 1 1 CYS CB C 3.657 4.934 -4.686 1.00 . A A . 1 CYS CB 1 1 3 772 1 1 1 CYS H1 H 3.024 7.124 -6.147 1.00 . A A . 1 CYS H1 1 1 3 773 1 1 1 CYS H2 H 3.745 5.976 -7.167 1.00 . A A . 1 CYS H2 1 1 3 774 1 1 1 CYS H3 H 4.559 7.417 -6.807 1.00 . A A . 1 CYS H3 1 1 3 775 1 1 1 CYS HA H 4.714 6.789 -4.489 1.00 . A A . 1 CYS HA 1 1 3 776 1 1 1 CYS HB2 H 3.435 4.227 -5.469 1.00 . A A . 1 CYS HB2 1 1 3 777 1 1 1 CYS HB3 H 4.176 4.425 -3.884 1.00 . A A . 1 CYS HB3 1 1 3 778 1 1 1 CYS N N 3.927 6.682 -6.421 1.00 . A A . 1 CYS N 1 1 3 779 1 1 1 CYS O O 6.001 4.406 -6.266 1.00 . A A . 1 CYS O 1 1 3 780 1 1 1 CYS SG S 2.070 5.544 -4.022 1.00 . A A . 1 CYS SG 1 1 3 781 1 1 2 SER C C 8.867 4.935 -4.374 1.00 . A A . 2 SER C 1 1 3 782 1 1 2 SER CA C 8.327 5.739 -5.546 1.00 . A A . 2 SER CA 1 1 3 783 1 1 2 SER CB C 9.220 6.947 -5.822 1.00 . A A . 2 SER CB 1 1 3 784 1 1 2 SER H H 6.832 7.030 -4.805 1.00 . A A . 2 SER H 1 1 3 785 1 1 2 SER HA H 8.305 5.109 -6.424 1.00 . A A . 2 SER HA 1 1 3 786 1 1 2 SER HB2 H 9.215 7.600 -4.962 1.00 . A A . 2 SER HB2 1 1 3 787 1 1 2 SER HB3 H 10.229 6.609 -6.013 1.00 . A A . 2 SER HB3 1 1 3 788 1 1 2 SER HG H 8.996 7.187 -7.758 1.00 . A A . 2 SER HG 1 1 3 789 1 1 2 SER N N 6.972 6.174 -5.274 1.00 . A A . 2 SER N 1 1 3 790 1 1 2 SER O O 9.148 5.478 -3.307 1.00 . A A . 2 SER O 1 1 3 791 1 1 2 SER OG O 8.757 7.672 -6.953 1.00 . A A . 2 SER OG 1 1 3 792 1 1 3 CYS C C 10.905 2.369 -3.774 1.00 . A A . 3 CYS C 1 1 3 793 1 1 3 CYS CA C 9.446 2.747 -3.536 1.00 . A A . 3 CYS CA 1 1 3 794 1 1 3 CYS CB C 8.541 1.516 -3.491 1.00 . A A . 3 CYS CB 1 1 3 795 1 1 3 CYS H H 8.761 3.265 -5.457 1.00 . A A . 3 CYS H 1 1 3 796 1 1 3 CYS HA H 9.371 3.272 -2.595 1.00 . A A . 3 CYS HA 1 1 3 797 1 1 3 CYS HB2 H 8.716 0.908 -4.368 1.00 . A A . 3 CYS HB2 1 1 3 798 1 1 3 CYS HB3 H 8.767 0.943 -2.609 1.00 . A A . 3 CYS HB3 1 1 3 799 1 1 3 CYS N N 8.987 3.638 -4.577 1.00 . A A . 3 CYS N 1 1 3 800 1 1 3 CYS O O 11.209 1.357 -4.406 1.00 . A A . 3 CYS O 1 1 3 801 1 1 3 CYS SG S 6.765 1.935 -3.442 1.00 . A A . 3 CYS SG 1 1 3 802 1 1 4 THR C C 13.891 2.335 -2.342 1.00 . A A . 4 THR C 1 1 3 803 1 1 4 THR CA C 13.227 3.052 -3.513 1.00 . A A . 4 THR CA 1 1 3 804 1 1 4 THR CB C 13.888 4.422 -3.732 1.00 . A A . 4 THR CB 1 1 3 805 1 1 4 THR CG2 C 15.326 4.266 -4.202 1.00 . A A . 4 THR CG2 1 1 3 806 1 1 4 THR H H 11.499 3.939 -2.705 1.00 . A A . 4 THR H 1 1 3 807 1 1 4 THR HA H 13.358 2.469 -4.403 1.00 . A A . 4 THR HA 1 1 3 808 1 1 4 THR HB H 13.886 4.949 -2.798 1.00 . A A . 4 THR HB 1 1 3 809 1 1 4 THR HG1 H 12.703 4.576 -5.317 1.00 . A A . 4 THR HG1 1 1 3 810 1 1 4 THR HG21 H 15.341 3.730 -5.141 1.00 . A A . 4 THR HG21 1 1 3 811 1 1 4 THR HG22 H 15.890 3.715 -3.462 1.00 . A A . 4 THR HG22 1 1 3 812 1 1 4 THR HG23 H 15.768 5.242 -4.340 1.00 . A A . 4 THR HG23 1 1 3 813 1 1 4 THR N N 11.802 3.205 -3.273 1.00 . A A . 4 THR N 1 1 3 814 1 1 4 THR O O 13.923 2.854 -1.223 1.00 . A A . 4 THR O 1 1 3 815 1 1 4 THR OG1 O 13.146 5.181 -4.701 1.00 . A A . 4 THR OG1 1 1 3 816 1 1 5 ASP C C 14.029 -0.068 -0.482 1.00 . A A . 5 ASP C 1 1 3 817 1 1 5 ASP CA C 15.024 0.288 -1.578 1.00 . A A . 5 ASP CA 1 1 3 818 1 1 5 ASP CB C 16.243 0.993 -0.971 1.00 . A A . 5 ASP CB 1 1 3 819 1 1 5 ASP CG C 17.416 1.049 -1.926 1.00 . A A . 5 ASP CG 1 1 3 820 1 1 5 ASP H H 14.294 0.770 -3.518 1.00 . A A . 5 ASP H 1 1 3 821 1 1 5 ASP HA H 15.351 -0.625 -2.057 1.00 . A A . 5 ASP HA 1 1 3 822 1 1 5 ASP HB2 H 15.971 2.005 -0.706 1.00 . A A . 5 ASP HB2 1 1 3 823 1 1 5 ASP HB3 H 16.550 0.463 -0.082 1.00 . A A . 5 ASP HB3 1 1 3 824 1 1 5 ASP N N 14.378 1.121 -2.603 1.00 . A A . 5 ASP N 1 1 3 825 1 1 5 ASP O O 14.405 -0.430 0.635 1.00 . A A . 5 ASP O 1 1 3 826 1 1 5 ASP OD1 O 17.475 1.976 -2.757 1.00 . A A . 5 ASP OD1 1 1 3 827 1 1 5 ASP OD2 O 18.293 0.163 -1.846 1.00 . A A . 5 ASP OD2 1 1 3 828 1 1 6 MET C C 11.266 -1.700 0.015 1.00 . A A . 6 MET C 1 1 3 829 1 1 6 MET CA C 11.672 -0.232 0.099 1.00 . A A . 6 MET CA 1 1 3 830 1 1 6 MET CB C 10.497 0.682 -0.251 1.00 . A A . 6 MET CB 1 1 3 831 1 1 6 MET CE C 9.015 3.441 0.078 1.00 . A A . 6 MET CE 1 1 3 832 1 1 6 MET CG C 9.475 0.828 0.851 1.00 . A A . 6 MET CG 1 1 3 833 1 1 6 MET H H 12.539 0.261 -1.752 1.00 . A A . 6 MET H 1 1 3 834 1 1 6 MET HA H 12.017 -0.012 1.099 1.00 . A A . 6 MET HA 1 1 3 835 1 1 6 MET HB2 H 10.878 1.662 -0.480 1.00 . A A . 6 MET HB2 1 1 3 836 1 1 6 MET HB3 H 9.999 0.290 -1.125 1.00 . A A . 6 MET HB3 1 1 3 837 1 1 6 MET HE1 H 9.723 3.278 -0.721 1.00 . A A . 6 MET HE1 1 1 3 838 1 1 6 MET HE2 H 9.543 3.733 0.972 1.00 . A A . 6 MET HE2 1 1 3 839 1 1 6 MET HE3 H 8.321 4.219 -0.204 1.00 . A A . 6 MET HE3 1 1 3 840 1 1 6 MET HG2 H 9.074 -0.140 1.074 1.00 . A A . 6 MET HG2 1 1 3 841 1 1 6 MET HG3 H 9.964 1.229 1.724 1.00 . A A . 6 MET HG3 1 1 3 842 1 1 6 MET N N 12.756 0.022 -0.829 1.00 . A A . 6 MET N 1 1 3 843 1 1 6 MET O O 11.114 -2.233 -1.081 1.00 . A A . 6 MET O 1 1 3 844 1 1 6 MET SD S 8.123 1.924 0.391 1.00 . A A . 6 MET SD 1 1 3 845 1 1 7 SER C C 9.487 -4.182 0.708 1.00 . A A . 7 SER C 1 1 3 846 1 1 7 SER CA C 10.880 -3.789 1.211 1.00 . A A . 7 SER CA 1 1 3 847 1 1 7 SER CB C 11.074 -4.296 2.643 1.00 . A A . 7 SER CB 1 1 3 848 1 1 7 SER H H 11.135 -1.844 2.005 1.00 . A A . 7 SER H 1 1 3 849 1 1 7 SER HA H 11.620 -4.255 0.578 1.00 . A A . 7 SER HA 1 1 3 850 1 1 7 SER HB2 H 10.242 -3.979 3.250 1.00 . A A . 7 SER HB2 1 1 3 851 1 1 7 SER HB3 H 11.124 -5.374 2.634 1.00 . A A . 7 SER HB3 1 1 3 852 1 1 7 SER HG H 13.027 -4.319 2.900 1.00 . A A . 7 SER HG 1 1 3 853 1 1 7 SER N N 11.101 -2.345 1.164 1.00 . A A . 7 SER N 1 1 3 854 1 1 7 SER O O 8.580 -4.354 1.510 1.00 . A A . 7 SER O 1 1 3 855 1 1 7 SER OG O 12.273 -3.785 3.207 1.00 . A A . 7 SER OG 1 1 3 856 1 1 8 ASP C C 6.826 -4.422 -0.673 1.00 . A A . 8 ASP C 1 1 3 857 1 1 8 ASP CA C 8.156 -4.748 -1.356 1.00 . A A . 8 ASP CA 1 1 3 858 1 1 8 ASP CB C 8.240 -6.249 -1.628 1.00 . A A . 8 ASP CB 1 1 3 859 1 1 8 ASP CG C 7.144 -6.719 -2.564 1.00 . A A . 8 ASP CG 1 1 3 860 1 1 8 ASP H H 10.146 -4.059 -1.160 1.00 . A A . 8 ASP H 1 1 3 861 1 1 8 ASP HA H 8.161 -4.239 -2.310 1.00 . A A . 8 ASP HA 1 1 3 862 1 1 8 ASP HB2 H 9.195 -6.476 -2.078 1.00 . A A . 8 ASP HB2 1 1 3 863 1 1 8 ASP HB3 H 8.148 -6.786 -0.693 1.00 . A A . 8 ASP HB3 1 1 3 864 1 1 8 ASP N N 9.363 -4.293 -0.624 1.00 . A A . 8 ASP N 1 1 3 865 1 1 8 ASP O O 6.116 -3.505 -1.081 1.00 . A A . 8 ASP O 1 1 3 866 1 1 8 ASP OD1 O 7.262 -6.500 -3.787 1.00 . A A . 8 ASP OD1 1 1 3 867 1 1 8 ASP OD2 O 6.164 -7.322 -2.074 1.00 . A A . 8 ASP OD2 1 1 3 868 1 1 9 LEU C C 5.137 -3.565 1.605 1.00 . A A . 9 LEU C 1 1 3 869 1 1 9 LEU CA C 5.243 -5.002 1.099 1.00 . A A . 9 LEU CA 1 1 3 870 1 1 9 LEU CB C 5.179 -5.985 2.277 1.00 . A A . 9 LEU CB 1 1 3 871 1 1 9 LEU CD1 C 2.682 -6.270 2.378 1.00 . A A . 9 LEU CD1 1 1 3 872 1 1 9 LEU CD2 C 4.077 -6.755 4.392 1.00 . A A . 9 LEU CD2 1 1 3 873 1 1 9 LEU CG C 3.929 -5.881 3.155 1.00 . A A . 9 LEU CG 1 1 3 874 1 1 9 LEU H H 7.119 -5.883 0.636 1.00 . A A . 9 LEU H 1 1 3 875 1 1 9 LEU HA H 4.420 -5.196 0.429 1.00 . A A . 9 LEU HA 1 1 3 876 1 1 9 LEU HB2 H 5.231 -6.989 1.882 1.00 . A A . 9 LEU HB2 1 1 3 877 1 1 9 LEU HB3 H 6.043 -5.819 2.902 1.00 . A A . 9 LEU HB3 1 1 3 878 1 1 9 LEU HD11 H 2.561 -5.611 1.531 1.00 . A A . 9 LEU HD11 1 1 3 879 1 1 9 LEU HD12 H 1.819 -6.188 3.022 1.00 . A A . 9 LEU HD12 1 1 3 880 1 1 9 LEU HD13 H 2.777 -7.289 2.032 1.00 . A A . 9 LEU HD13 1 1 3 881 1 1 9 LEU HD21 H 4.958 -6.460 4.940 1.00 . A A . 9 LEU HD21 1 1 3 882 1 1 9 LEU HD22 H 4.166 -7.788 4.091 1.00 . A A . 9 LEU HD22 1 1 3 883 1 1 9 LEU HD23 H 3.206 -6.637 5.019 1.00 . A A . 9 LEU HD23 1 1 3 884 1 1 9 LEU HG H 3.813 -4.857 3.479 1.00 . A A . 9 LEU HG 1 1 3 885 1 1 9 LEU N N 6.491 -5.188 0.354 1.00 . A A . 9 LEU N 1 1 3 886 1 1 9 LEU O O 4.064 -2.964 1.585 1.00 . A A . 9 LEU O 1 1 3 887 1 1 10 GLU C C 5.924 -0.671 1.431 1.00 . A A . 10 GLU C 1 1 3 888 1 1 10 GLU CA C 6.377 -1.666 2.494 1.00 . A A . 10 GLU CA 1 1 3 889 1 1 10 GLU CB C 7.825 -1.419 2.878 1.00 . A A . 10 GLU CB 1 1 3 890 1 1 10 GLU CD C 7.470 -1.672 5.357 1.00 . A A . 10 GLU CD 1 1 3 891 1 1 10 GLU CG C 8.246 -2.142 4.144 1.00 . A A . 10 GLU CG 1 1 3 892 1 1 10 GLU H H 7.098 -3.556 1.996 1.00 . A A . 10 GLU H 1 1 3 893 1 1 10 GLU HA H 5.756 -1.564 3.371 1.00 . A A . 10 GLU HA 1 1 3 894 1 1 10 GLU HB2 H 8.458 -1.757 2.072 1.00 . A A . 10 GLU HB2 1 1 3 895 1 1 10 GLU HB3 H 7.969 -0.378 3.016 1.00 . A A . 10 GLU HB3 1 1 3 896 1 1 10 GLU HG2 H 8.077 -3.201 4.014 1.00 . A A . 10 GLU HG2 1 1 3 897 1 1 10 GLU HG3 H 9.297 -1.963 4.312 1.00 . A A . 10 GLU HG3 1 1 3 898 1 1 10 GLU N N 6.276 -3.020 2.018 1.00 . A A . 10 GLU N 1 1 3 899 1 1 10 GLU O O 5.333 0.361 1.747 1.00 . A A . 10 GLU O 1 1 3 900 1 1 10 GLU OE1 O 6.349 -2.178 5.578 1.00 . A A . 10 GLU OE1 1 1 3 901 1 1 10 GLU OE2 O 7.985 -0.815 6.104 1.00 . A A . 10 GLU OE2 1 1 3 902 1 1 11 CYS C C 4.262 -0.015 -0.965 1.00 . A A . 11 CYS C 1 1 3 903 1 1 11 CYS CA C 5.776 -0.173 -0.952 1.00 . A A . 11 CYS CA 1 1 3 904 1 1 11 CYS CB C 6.247 -0.800 -2.272 1.00 . A A . 11 CYS CB 1 1 3 905 1 1 11 CYS H H 6.648 -1.851 -0.010 1.00 . A A . 11 CYS H 1 1 3 906 1 1 11 CYS HA H 6.233 0.800 -0.835 1.00 . A A . 11 CYS HA 1 1 3 907 1 1 11 CYS HB2 H 7.321 -0.915 -2.245 1.00 . A A . 11 CYS HB2 1 1 3 908 1 1 11 CYS HB3 H 5.791 -1.775 -2.378 1.00 . A A . 11 CYS HB3 1 1 3 909 1 1 11 CYS N N 6.182 -1.007 0.171 1.00 . A A . 11 CYS N 1 1 3 910 1 1 11 CYS O O 3.733 1.091 -1.096 1.00 . A A . 11 CYS O 1 1 3 911 1 1 11 CYS SG S 5.833 0.166 -3.757 1.00 . A A . 11 CYS SG 1 1 3 912 1 1 12 MET C C 1.579 -0.548 0.485 1.00 . A A . 12 MET C 1 1 3 913 1 1 12 MET CA C 2.119 -1.142 -0.809 1.00 . A A . 12 MET CA 1 1 3 914 1 1 12 MET CB C 1.600 -2.566 -1.008 1.00 . A A . 12 MET CB 1 1 3 915 1 1 12 MET CE C 2.441 -5.721 -1.344 1.00 . A A . 12 MET CE 1 1 3 916 1 1 12 MET CG C 2.014 -3.173 -2.340 1.00 . A A . 12 MET CG 1 1 3 917 1 1 12 MET H H 4.054 -1.975 -0.659 1.00 . A A . 12 MET H 1 1 3 918 1 1 12 MET HA H 1.790 -0.530 -1.635 1.00 . A A . 12 MET HA 1 1 3 919 1 1 12 MET HB2 H 1.978 -3.191 -0.213 1.00 . A A . 12 MET HB2 1 1 3 920 1 1 12 MET HB3 H 0.521 -2.553 -0.964 1.00 . A A . 12 MET HB3 1 1 3 921 1 1 12 MET HE1 H 2.264 -5.298 -0.370 1.00 . A A . 12 MET HE1 1 1 3 922 1 1 12 MET HE2 H 3.482 -5.613 -1.602 1.00 . A A . 12 MET HE2 1 1 3 923 1 1 12 MET HE3 H 2.178 -6.768 -1.335 1.00 . A A . 12 MET HE3 1 1 3 924 1 1 12 MET HG2 H 1.609 -2.568 -3.135 1.00 . A A . 12 MET HG2 1 1 3 925 1 1 12 MET HG3 H 3.093 -3.167 -2.403 1.00 . A A . 12 MET HG3 1 1 3 926 1 1 12 MET N N 3.570 -1.133 -0.800 1.00 . A A . 12 MET N 1 1 3 927 1 1 12 MET O O 0.541 0.120 0.491 1.00 . A A . 12 MET O 1 1 3 928 1 1 12 MET SD S 1.433 -4.866 -2.554 1.00 . A A . 12 MET SD 1 1 3 929 1 1 13 ASN C C 1.894 1.277 2.853 1.00 . A A . 13 ASN C 1 1 3 930 1 1 13 ASN CA C 1.929 -0.245 2.878 1.00 . A A . 13 ASN CA 1 1 3 931 1 1 13 ASN CB C 2.895 -0.716 3.974 1.00 . A A . 13 ASN CB 1 1 3 932 1 1 13 ASN CG C 2.686 -2.168 4.372 1.00 . A A . 13 ASN CG 1 1 3 933 1 1 13 ASN H H 3.112 -1.336 1.502 1.00 . A A . 13 ASN H 1 1 3 934 1 1 13 ASN HA H 0.936 -0.609 3.106 1.00 . A A . 13 ASN HA 1 1 3 935 1 1 13 ASN HB2 H 3.909 -0.605 3.618 1.00 . A A . 13 ASN HB2 1 1 3 936 1 1 13 ASN HB3 H 2.759 -0.101 4.851 1.00 . A A . 13 ASN HB3 1 1 3 937 1 1 13 ASN HD21 H 4.598 -2.328 4.922 1.00 . A A . 13 ASN HD21 1 1 3 938 1 1 13 ASN HD22 H 3.629 -3.751 5.108 1.00 . A A . 13 ASN HD22 1 1 3 939 1 1 13 ASN N N 2.302 -0.780 1.575 1.00 . A A . 13 ASN N 1 1 3 940 1 1 13 ASN ND2 N 3.741 -2.814 4.847 1.00 . A A . 13 ASN ND2 1 1 3 941 1 1 13 ASN O O 0.869 1.878 3.153 1.00 . A A . 13 ASN O 1 1 3 942 1 1 13 ASN OD1 O 1.583 -2.701 4.273 1.00 . A A . 13 ASN OD1 1 1 3 943 1 1 14 PHE C C 2.214 3.986 1.438 1.00 . A A . 14 PHE C 1 1 3 944 1 1 14 PHE CA C 3.111 3.350 2.503 1.00 . A A . 14 PHE CA 1 1 3 945 1 1 14 PHE CB C 4.582 3.790 2.341 1.00 . A A . 14 PHE CB 1 1 3 946 1 1 14 PHE CD1 C 5.258 3.688 -0.083 1.00 . A A . 14 PHE CD1 1 1 3 947 1 1 14 PHE CD2 C 4.893 5.830 0.902 1.00 . A A . 14 PHE CD2 1 1 3 948 1 1 14 PHE CE1 C 5.567 4.293 -1.287 1.00 . A A . 14 PHE CE1 1 1 3 949 1 1 14 PHE CE2 C 5.201 6.438 -0.300 1.00 . A A . 14 PHE CE2 1 1 3 950 1 1 14 PHE CG C 4.917 4.448 1.024 1.00 . A A . 14 PHE CG 1 1 3 951 1 1 14 PHE CZ C 5.538 5.668 -1.396 1.00 . A A . 14 PHE CZ 1 1 3 952 1 1 14 PHE H H 3.776 1.362 2.163 1.00 . A A . 14 PHE H 1 1 3 953 1 1 14 PHE HA H 2.763 3.675 3.473 1.00 . A A . 14 PHE HA 1 1 3 954 1 1 14 PHE HB2 H 4.823 4.491 3.124 1.00 . A A . 14 PHE HB2 1 1 3 955 1 1 14 PHE HB3 H 5.216 2.922 2.444 1.00 . A A . 14 PHE HB3 1 1 3 956 1 1 14 PHE HD1 H 5.282 2.613 -0.001 1.00 . A A . 14 PHE HD1 1 1 3 957 1 1 14 PHE HD2 H 4.631 6.433 1.758 1.00 . A A . 14 PHE HD2 1 1 3 958 1 1 14 PHE HE1 H 5.832 3.689 -2.143 1.00 . A A . 14 PHE HE1 1 1 3 959 1 1 14 PHE HE2 H 5.178 7.515 -0.383 1.00 . A A . 14 PHE HE2 1 1 3 960 1 1 14 PHE HZ H 5.777 6.143 -2.335 1.00 . A A . 14 PHE HZ 1 1 3 961 1 1 14 PHE N N 3.006 1.896 2.471 1.00 . A A . 14 PHE N 1 1 3 962 1 1 14 PHE O O 1.567 5.002 1.685 1.00 . A A . 14 PHE O 1 1 3 963 1 1 15 CYS C C -0.083 3.887 -0.618 1.00 . A A . 15 CYS C 1 1 3 964 1 1 15 CYS CA C 1.423 3.929 -0.858 1.00 . A A . 15 CYS CA 1 1 3 965 1 1 15 CYS CB C 1.770 3.174 -2.143 1.00 . A A . 15 CYS CB 1 1 3 966 1 1 15 CYS H H 2.628 2.510 0.153 1.00 . A A . 15 CYS H 1 1 3 967 1 1 15 CYS HA H 1.727 4.960 -0.966 1.00 . A A . 15 CYS HA 1 1 3 968 1 1 15 CYS HB2 H 2.840 3.189 -2.283 1.00 . A A . 15 CYS HB2 1 1 3 969 1 1 15 CYS HB3 H 1.444 2.149 -2.044 1.00 . A A . 15 CYS HB3 1 1 3 970 1 1 15 CYS N N 2.156 3.366 0.267 1.00 . A A . 15 CYS N 1 1 3 971 1 1 15 CYS O O -0.778 4.891 -0.776 1.00 . A A . 15 CYS O 1 1 3 972 1 1 15 CYS SG S 1.007 3.854 -3.651 1.00 . A A . 15 CYS SG 1 1 3 973 1 1 16 HIS C C -2.477 2.731 1.366 1.00 . A A . 16 HIS C 1 1 3 974 1 1 16 HIS CA C -2.021 2.544 -0.069 1.00 . A A . 16 HIS CA 1 1 3 975 1 1 16 HIS CB C -2.438 1.157 -0.556 1.00 . A A . 16 HIS CB 1 1 3 976 1 1 16 HIS CD2 C -1.935 0.963 -3.092 1.00 . A A . 16 HIS CD2 1 1 3 977 1 1 16 HIS CE1 C -3.989 1.139 -3.835 1.00 . A A . 16 HIS CE1 1 1 3 978 1 1 16 HIS CG C -2.744 1.108 -2.018 1.00 . A A . 16 HIS CG 1 1 3 979 1 1 16 HIS H H 0.020 1.989 0.000 1.00 . A A . 16 HIS H 1 1 3 980 1 1 16 HIS HA H -2.509 3.284 -0.682 1.00 . A A . 16 HIS HA 1 1 3 981 1 1 16 HIS HB2 H -1.639 0.457 -0.356 1.00 . A A . 16 HIS HB2 1 1 3 982 1 1 16 HIS HB3 H -3.321 0.845 -0.019 1.00 . A A . 16 HIS HB3 1 1 3 983 1 1 16 HIS HD1 H -4.843 1.318 -1.979 1.00 . A A . 16 HIS HD1 1 1 3 984 1 1 16 HIS HD2 H -0.860 0.853 -3.073 1.00 . A A . 16 HIS HD2 1 1 3 985 1 1 16 HIS HE1 H -4.842 1.190 -4.496 1.00 . A A . 16 HIS HE1 1 1 3 986 1 1 16 HIS HE2 H -2.411 1.016 -5.139 1.00 . A A . 16 HIS HE2 1 1 3 987 1 1 16 HIS N N -0.586 2.730 -0.215 1.00 . A A . 16 HIS N 1 1 3 988 1 1 16 HIS ND1 N -4.024 1.214 -2.517 1.00 . A A . 16 HIS ND1 1 1 3 989 1 1 16 HIS NE2 N -2.733 0.985 -4.208 1.00 . A A . 16 HIS NE2 1 1 3 990 1 1 16 HIS O O -3.386 3.515 1.631 1.00 . A A . 16 HIS O 1 1 3 991 1 1 17 LYS C C -3.641 1.265 3.766 1.00 . A A . 17 LYS C 1 1 3 992 1 1 17 LYS CA C -2.282 1.943 3.679 1.00 . A A . 17 LYS CA 1 1 3 993 1 1 17 LYS CB C -2.319 3.332 4.328 1.00 . A A . 17 LYS CB 1 1 3 994 1 1 17 LYS CD C -1.032 5.360 5.083 1.00 . A A . 17 LYS CD 1 1 3 995 1 1 17 LYS CE C -1.464 6.316 3.982 1.00 . A A . 17 LYS CE 1 1 3 996 1 1 17 LYS CG C -0.940 3.931 4.575 1.00 . A A . 17 LYS CG 1 1 3 997 1 1 17 LYS H H -1.020 1.531 2.026 1.00 . A A . 17 LYS H 1 1 3 998 1 1 17 LYS HA H -1.580 1.326 4.206 1.00 . A A . 17 LYS HA 1 1 3 999 1 1 17 LYS HB2 H -2.867 4.000 3.682 1.00 . A A . 17 LYS HB2 1 1 3 1000 1 1 17 LYS HB3 H -2.832 3.260 5.275 1.00 . A A . 17 LYS HB3 1 1 3 1001 1 1 17 LYS HD2 H -1.757 5.399 5.883 1.00 . A A . 17 LYS HD2 1 1 3 1002 1 1 17 LYS HD3 H -0.064 5.664 5.457 1.00 . A A . 17 LYS HD3 1 1 3 1003 1 1 17 LYS HE2 H -2.332 5.905 3.491 1.00 . A A . 17 LYS HE2 1 1 3 1004 1 1 17 LYS HE3 H -1.721 7.265 4.428 1.00 . A A . 17 LYS HE3 1 1 3 1005 1 1 17 LYS HG2 H -0.424 3.334 5.310 1.00 . A A . 17 LYS HG2 1 1 3 1006 1 1 17 LYS HG3 H -0.385 3.925 3.648 1.00 . A A . 17 LYS HG3 1 1 3 1007 1 1 17 LYS HZ1 H -0.780 7.019 2.132 1.00 . A A . 17 LYS HZ1 1 1 3 1008 1 1 17 LYS HZ2 H 0.008 5.618 2.666 1.00 . A A . 17 LYS HZ2 1 1 3 1009 1 1 17 LYS HZ3 H 0.373 7.114 3.374 1.00 . A A . 17 LYS HZ3 1 1 3 1010 1 1 17 LYS N N -1.834 2.014 2.285 1.00 . A A . 17 LYS N 1 1 3 1011 1 1 17 LYS NZ N -0.392 6.528 2.970 1.00 . A A . 17 LYS NZ 1 1 3 1012 1 1 17 LYS O O -4.398 1.459 4.719 1.00 . A A . 17 LYS O 1 1 3 1013 1 1 18 ASP C C -4.825 -1.780 3.068 1.00 . A A . 18 ASP C 1 1 3 1014 1 1 18 ASP CA C -5.144 -0.351 2.753 1.00 . A A . 18 ASP CA 1 1 3 1015 1 1 18 ASP CB C -5.811 -0.316 1.389 1.00 . A A . 18 ASP CB 1 1 3 1016 1 1 18 ASP CG C -6.186 1.072 0.919 1.00 . A A . 18 ASP CG 1 1 3 1017 1 1 18 ASP H H -3.300 0.369 2.025 1.00 . A A . 18 ASP H 1 1 3 1018 1 1 18 ASP HA H -5.809 0.024 3.501 1.00 . A A . 18 ASP HA 1 1 3 1019 1 1 18 ASP HB2 H -5.140 -0.747 0.666 1.00 . A A . 18 ASP HB2 1 1 3 1020 1 1 18 ASP HB3 H -6.695 -0.913 1.439 1.00 . A A . 18 ASP HB3 1 1 3 1021 1 1 18 ASP N N -3.926 0.441 2.771 1.00 . A A . 18 ASP N 1 1 3 1022 1 1 18 ASP O O -5.683 -2.662 2.997 1.00 . A A . 18 ASP O 1 1 3 1023 1 1 18 ASP OD1 O -7.034 1.723 1.564 1.00 . A A . 18 ASP OD1 1 1 3 1024 1 1 18 ASP OD2 O -5.639 1.519 -0.113 1.00 . A A . 18 ASP OD2 1 1 3 1025 1 1 19 VAL C C -3.581 -3.846 4.984 1.00 . A A . 19 VAL C 1 1 3 1026 1 1 19 VAL CA C -3.117 -3.339 3.632 1.00 . A A . 19 VAL CA 1 1 3 1027 1 1 19 VAL CB C -1.597 -3.432 3.541 1.00 . A A . 19 VAL CB 1 1 3 1028 1 1 19 VAL CG1 C -1.190 -4.868 3.690 1.00 . A A . 19 VAL CG1 1 1 3 1029 1 1 19 VAL CG2 C -1.092 -2.867 2.223 1.00 . A A . 19 VAL CG2 1 1 3 1030 1 1 19 VAL H H -2.970 -1.253 3.522 1.00 . A A . 19 VAL H 1 1 3 1031 1 1 19 VAL HA H -3.540 -3.969 2.862 1.00 . A A . 19 VAL HA 1 1 3 1032 1 1 19 VAL HB H -1.169 -2.865 4.354 1.00 . A A . 19 VAL HB 1 1 3 1033 1 1 19 VAL HG11 H -1.675 -5.447 2.920 1.00 . A A . 19 VAL HG11 1 1 3 1034 1 1 19 VAL HG12 H -1.505 -5.222 4.660 1.00 . A A . 19 VAL HG12 1 1 3 1035 1 1 19 VAL HG13 H -0.122 -4.953 3.596 1.00 . A A . 19 VAL HG13 1 1 3 1036 1 1 19 VAL HG21 H -0.019 -2.964 2.176 1.00 . A A . 19 VAL HG21 1 1 3 1037 1 1 19 VAL HG22 H -1.367 -1.827 2.148 1.00 . A A . 19 VAL HG22 1 1 3 1038 1 1 19 VAL HG23 H -1.537 -3.418 1.406 1.00 . A A . 19 VAL HG23 1 1 3 1039 1 1 19 VAL N N -3.583 -2.007 3.406 1.00 . A A . 19 VAL N 1 1 3 1040 1 1 19 VAL O O -2.975 -3.567 6.016 1.00 . A A . 19 VAL O 1 1 3 1041 1 1 20 ILE C C -4.648 -6.617 6.218 1.00 . A A . 20 ILE C 1 1 3 1042 1 1 20 ILE CA C -5.207 -5.203 6.153 1.00 . A A . 20 ILE CA 1 1 3 1043 1 1 20 ILE CB C -6.756 -5.222 6.139 1.00 . A A . 20 ILE CB 1 1 3 1044 1 1 20 ILE CD1 C -6.903 -3.197 7.657 1.00 . A A . 20 ILE CD1 1 1 3 1045 1 1 20 ILE CG1 C -7.291 -4.647 7.447 1.00 . A A . 20 ILE CG1 1 1 3 1046 1 1 20 ILE CG2 C -7.305 -6.626 5.899 1.00 . A A . 20 ILE CG2 1 1 3 1047 1 1 20 ILE H H -5.192 -4.616 4.127 1.00 . A A . 20 ILE H 1 1 3 1048 1 1 20 ILE HA H -4.872 -4.647 7.018 1.00 . A A . 20 ILE HA 1 1 3 1049 1 1 20 ILE HB H -7.090 -4.595 5.324 1.00 . A A . 20 ILE HB 1 1 3 1050 1 1 20 ILE HD11 H -7.348 -2.831 8.569 1.00 . A A . 20 ILE HD11 1 1 3 1051 1 1 20 ILE HD12 H -7.254 -2.606 6.820 1.00 . A A . 20 ILE HD12 1 1 3 1052 1 1 20 ILE HD13 H -5.828 -3.118 7.722 1.00 . A A . 20 ILE HD13 1 1 3 1053 1 1 20 ILE HG12 H -8.369 -4.710 7.451 1.00 . A A . 20 ILE HG12 1 1 3 1054 1 1 20 ILE HG13 H -6.895 -5.221 8.272 1.00 . A A . 20 ILE HG13 1 1 3 1055 1 1 20 ILE HG21 H -8.384 -6.591 5.867 1.00 . A A . 20 ILE HG21 1 1 3 1056 1 1 20 ILE HG22 H -6.989 -7.279 6.699 1.00 . A A . 20 ILE HG22 1 1 3 1057 1 1 20 ILE HG23 H -6.928 -7.001 4.958 1.00 . A A . 20 ILE HG23 1 1 3 1058 1 1 20 ILE N N -4.692 -4.549 4.966 1.00 . A A . 20 ILE N 1 1 3 1059 1 1 20 ILE O O -4.540 -7.224 7.283 1.00 . A A . 20 ILE O 1 1 3 1060 1 1 21 TRP C C -2.239 -8.499 5.238 1.00 . A A . 21 TRP C 1 1 3 1061 1 1 21 TRP CA C -3.716 -8.444 4.889 1.00 . A A . 21 TRP CA 1 1 3 1062 1 1 21 TRP CB C -3.966 -8.906 3.459 1.00 . A A . 21 TRP CB 1 1 3 1063 1 1 21 TRP CD1 C -4.782 -6.958 2.008 1.00 . A A . 21 TRP CD1 1 1 3 1064 1 1 21 TRP CD2 C -2.631 -7.483 1.707 1.00 . A A . 21 TRP CD2 1 1 3 1065 1 1 21 TRP CE2 C -2.953 -6.405 0.864 1.00 . A A . 21 TRP CE2 1 1 3 1066 1 1 21 TRP CE3 C -1.334 -7.988 1.691 1.00 . A A . 21 TRP CE3 1 1 3 1067 1 1 21 TRP CG C -3.813 -7.818 2.438 1.00 . A A . 21 TRP CG 1 1 3 1068 1 1 21 TRP CH2 C -0.756 -6.343 0.010 1.00 . A A . 21 TRP CH2 1 1 3 1069 1 1 21 TRP CZ2 C -2.022 -5.825 0.010 1.00 . A A . 21 TRP CZ2 1 1 3 1070 1 1 21 TRP CZ3 C -0.407 -7.416 0.840 1.00 . A A . 21 TRP CZ3 1 1 3 1071 1 1 21 TRP H H -4.301 -6.521 4.266 1.00 . A A . 21 TRP H 1 1 3 1072 1 1 21 TRP HA H -4.253 -9.089 5.564 1.00 . A A . 21 TRP HA 1 1 3 1073 1 1 21 TRP HB2 H -3.272 -9.696 3.213 1.00 . A A . 21 TRP HB2 1 1 3 1074 1 1 21 TRP HB3 H -4.970 -9.281 3.395 1.00 . A A . 21 TRP HB3 1 1 3 1075 1 1 21 TRP HD1 H -5.798 -6.958 2.373 1.00 . A A . 21 TRP HD1 1 1 3 1076 1 1 21 TRP HE1 H -4.771 -5.376 0.616 1.00 . A A . 21 TRP HE1 1 1 3 1077 1 1 21 TRP HE3 H -1.052 -8.809 2.328 1.00 . A A . 21 TRP HE3 1 1 3 1078 1 1 21 TRP HH2 H -0.002 -5.925 -0.642 1.00 . A A . 21 TRP HH2 1 1 3 1079 1 1 21 TRP HZ2 H -2.274 -4.995 -0.633 1.00 . A A . 21 TRP HZ2 1 1 3 1080 1 1 21 TRP HZ3 H 0.602 -7.797 0.808 1.00 . A A . 21 TRP HZ3 1 1 3 1081 1 1 21 TRP N N -4.243 -7.099 5.053 1.00 . A A . 21 TRP N 1 1 3 1082 1 1 21 TRP NE1 N -4.269 -6.098 1.072 1.00 . A A . 21 TRP NE1 1 1 3 1083 1 1 21 TRP O O -1.481 -9.324 4.731 1.00 . A A . 21 TRP O 1 1 3 1084 1 1 22 VAL C C -0.573 -8.147 8.098 1.00 . A A . 22 VAL C 1 1 3 1085 1 1 22 VAL CA C -0.518 -7.590 6.680 1.00 . A A . 22 VAL CA 1 1 3 1086 1 1 22 VAL CB C 0.038 -6.148 6.668 1.00 . A A . 22 VAL CB 1 1 3 1087 1 1 22 VAL CG1 C -0.810 -5.247 7.548 1.00 . A A . 22 VAL CG1 1 1 3 1088 1 1 22 VAL CG2 C 1.498 -6.101 7.086 1.00 . A A . 22 VAL CG2 1 1 3 1089 1 1 22 VAL H H -2.515 -6.969 6.454 1.00 . A A . 22 VAL H 1 1 3 1090 1 1 22 VAL HA H 0.107 -8.220 6.073 1.00 . A A . 22 VAL HA 1 1 3 1091 1 1 22 VAL HB H -0.031 -5.777 5.653 1.00 . A A . 22 VAL HB 1 1 3 1092 1 1 22 VAL HG11 H -1.833 -5.261 7.192 1.00 . A A . 22 VAL HG11 1 1 3 1093 1 1 22 VAL HG12 H -0.426 -4.238 7.505 1.00 . A A . 22 VAL HG12 1 1 3 1094 1 1 22 VAL HG13 H -0.777 -5.605 8.565 1.00 . A A . 22 VAL HG13 1 1 3 1095 1 1 22 VAL HG21 H 2.082 -6.723 6.425 1.00 . A A . 22 VAL HG21 1 1 3 1096 1 1 22 VAL HG22 H 1.592 -6.464 8.099 1.00 . A A . 22 VAL HG22 1 1 3 1097 1 1 22 VAL HG23 H 1.854 -5.083 7.034 1.00 . A A . 22 VAL HG23 1 1 3 1098 1 1 22 VAL N N -1.858 -7.620 6.133 1.00 . A A . 22 VAL N 1 1 3 1099 1 1 22 VAL O O 0.395 -8.117 8.860 1.00 . A A . 22 VAL O 1 1 3 1100 1 1 23 ASN C C -1.395 -10.615 9.882 1.00 . A A . 23 ASN C 1 1 3 1101 1 1 23 ASN CA C -2.020 -9.234 9.729 1.00 . A A . 23 ASN CA 1 1 3 1102 1 1 23 ASN CB C -3.534 -9.317 9.946 1.00 . A A . 23 ASN CB 1 1 3 1103 1 1 23 ASN CG C -3.910 -9.878 11.304 1.00 . A A . 23 ASN CG 1 1 3 1104 1 1 23 ASN H H -2.423 -8.733 7.722 1.00 . A A . 23 ASN H 1 1 3 1105 1 1 23 ASN HA H -1.592 -8.574 10.470 1.00 . A A . 23 ASN HA 1 1 3 1106 1 1 23 ASN HB2 H -3.957 -8.328 9.860 1.00 . A A . 23 ASN HB2 1 1 3 1107 1 1 23 ASN HB3 H -3.962 -9.952 9.184 1.00 . A A . 23 ASN HB3 1 1 3 1108 1 1 23 ASN HD21 H -2.381 -8.940 12.161 1.00 . A A . 23 ASN HD21 1 1 3 1109 1 1 23 ASN HD22 H -3.361 -9.896 13.214 1.00 . A A . 23 ASN HD22 1 1 3 1110 1 1 23 ASN N N -1.734 -8.687 8.414 1.00 . A A . 23 ASN N 1 1 3 1111 1 1 23 ASN ND2 N -3.142 -9.537 12.327 1.00 . A A . 23 ASN ND2 1 1 3 1112 1 1 23 ASN O O -1.913 -11.611 9.372 1.00 . A A . 23 ASN O 1 1 3 1113 1 1 23 ASN OD1 O -4.904 -10.590 11.435 1.00 . A A . 23 ASN OD1 1 1 3 1114 1 1 24 ARG C C 0.376 -12.240 12.311 1.00 . A A . 24 ARG C 1 1 3 1115 1 1 24 ARG CA C 0.419 -11.914 10.825 1.00 . A A . 24 ARG CA 1 1 3 1116 1 1 24 ARG CB C 1.864 -11.848 10.332 1.00 . A A . 24 ARG CB 1 1 3 1117 1 1 24 ARG CD C 3.430 -11.751 8.374 1.00 . A A . 24 ARG CD 1 1 3 1118 1 1 24 ARG CG C 1.980 -11.732 8.822 1.00 . A A . 24 ARG CG 1 1 3 1119 1 1 24 ARG CZ C 5.463 -10.606 9.176 1.00 . A A . 24 ARG CZ 1 1 3 1120 1 1 24 ARG H H 0.124 -9.820 10.909 1.00 . A A . 24 ARG H 1 1 3 1121 1 1 24 ARG HA H -0.102 -12.692 10.285 1.00 . A A . 24 ARG HA 1 1 3 1122 1 1 24 ARG HB2 H 2.346 -10.991 10.777 1.00 . A A . 24 ARG HB2 1 1 3 1123 1 1 24 ARG HB3 H 2.380 -12.744 10.643 1.00 . A A . 24 ARG HB3 1 1 3 1124 1 1 24 ARG HD2 H 3.897 -12.644 8.759 1.00 . A A . 24 ARG HD2 1 1 3 1125 1 1 24 ARG HD3 H 3.460 -11.767 7.294 1.00 . A A . 24 ARG HD3 1 1 3 1126 1 1 24 ARG HE H 3.681 -9.725 8.907 1.00 . A A . 24 ARG HE 1 1 3 1127 1 1 24 ARG HG2 H 1.461 -12.562 8.365 1.00 . A A . 24 ARG HG2 1 1 3 1128 1 1 24 ARG HG3 H 1.527 -10.804 8.508 1.00 . A A . 24 ARG HG3 1 1 3 1129 1 1 24 ARG HH11 H 5.658 -12.618 8.987 1.00 . A A . 24 ARG HH11 1 1 3 1130 1 1 24 ARG HH12 H 7.110 -11.773 9.436 1.00 . A A . 24 ARG HH12 1 1 3 1131 1 1 24 ARG HH21 H 5.565 -8.614 9.525 1.00 . A A . 24 ARG HH21 1 1 3 1132 1 1 24 ARG HH22 H 7.055 -9.482 9.749 1.00 . A A . 24 ARG HH22 1 1 3 1133 1 1 24 ARG N N -0.266 -10.660 10.566 1.00 . A A . 24 ARG N 1 1 3 1134 1 1 24 ARG NE N 4.172 -10.586 8.853 1.00 . A A . 24 ARG NE 1 1 3 1135 1 1 24 ARG NH1 N 6.130 -11.756 9.204 1.00 . A A . 24 ARG NH1 1 1 3 1136 1 1 24 ARG NH2 N 6.073 -9.478 9.513 1.00 . A A . 24 ARG NH2 1 1 3 1137 1 1 24 ARG O O 0.753 -13.334 12.728 1.00 . A A . 24 ARG O 1 1 3 1138 1 1 25 ASN C C -1.470 -10.721 15.027 1.00 . A A . 25 ASN C 1 1 3 1139 1 1 25 ASN CA C -0.241 -11.476 14.534 1.00 . A A . 25 ASN CA 1 1 3 1140 1 1 25 ASN CB C 1.019 -11.042 15.305 1.00 . A A . 25 ASN CB 1 1 3 1141 1 1 25 ASN CG C 1.364 -9.571 15.141 1.00 . A A . 25 ASN CG 1 1 3 1142 1 1 25 ASN H H -0.334 -10.418 12.712 1.00 . A A . 25 ASN H 1 1 3 1143 1 1 25 ASN HA H -0.404 -12.531 14.700 1.00 . A A . 25 ASN HA 1 1 3 1144 1 1 25 ASN HB2 H 0.869 -11.235 16.356 1.00 . A A . 25 ASN HB2 1 1 3 1145 1 1 25 ASN HB3 H 1.858 -11.628 14.959 1.00 . A A . 25 ASN HB3 1 1 3 1146 1 1 25 ASN HD21 H 0.357 -9.113 16.792 1.00 . A A . 25 ASN HD21 1 1 3 1147 1 1 25 ASN HD22 H 1.112 -7.784 15.982 1.00 . A A . 25 ASN HD22 1 1 3 1148 1 1 25 ASN N N -0.085 -11.282 13.102 1.00 . A A . 25 ASN N 1 1 3 1149 1 1 25 ASN ND2 N 0.898 -8.741 16.063 1.00 . A A . 25 ASN ND2 1 1 3 1150 1 1 25 ASN O O -2.367 -11.365 15.606 1.00 . A A . 25 ASN O 1 1 3 1151 1 1 25 ASN OXT O -1.564 -9.499 14.778 1.00 . A A . 25 ASN OXT 1 1 3 1152 1 1 25 ASN OD1 O 2.064 -9.183 14.203 1.00 . A A . 25 ASN OD1 1 1 4 1153 1 1 1 CYS C C 4.570 3.267 -5.534 1.00 . A A . 1 CYS C 1 1 4 1154 1 1 1 CYS CA C 3.128 3.039 -5.100 1.00 . A A . 1 CYS CA 1 1 4 1155 1 1 1 CYS CB C 2.997 1.662 -4.451 1.00 . A A . 1 CYS CB 1 1 4 1156 1 1 1 CYS H1 H 2.375 4.043 -6.757 1.00 . A A . 1 CYS H1 1 1 4 1157 1 1 1 CYS H2 H 1.226 3.112 -5.936 1.00 . A A . 1 CYS H2 1 1 4 1158 1 1 1 CYS H3 H 2.384 2.352 -6.917 1.00 . A A . 1 CYS H3 1 1 4 1159 1 1 1 CYS HA H 2.851 3.799 -4.381 1.00 . A A . 1 CYS HA 1 1 4 1160 1 1 1 CYS HB2 H 3.298 0.907 -5.164 1.00 . A A . 1 CYS HB2 1 1 4 1161 1 1 1 CYS HB3 H 3.648 1.615 -3.591 1.00 . A A . 1 CYS HB3 1 1 4 1162 1 1 1 CYS N N 2.217 3.143 -6.256 1.00 . A A . 1 CYS N 1 1 4 1163 1 1 1 CYS O O 5.140 2.469 -6.279 1.00 . A A . 1 CYS O 1 1 4 1164 1 1 1 CYS SG S 1.309 1.259 -3.895 1.00 . A A . 1 CYS SG 1 1 4 1165 1 1 2 SER C C 7.440 4.285 -4.242 1.00 . A A . 2 SER C 1 1 4 1166 1 1 2 SER CA C 6.528 4.703 -5.389 1.00 . A A . 2 SER CA 1 1 4 1167 1 1 2 SER CB C 6.647 6.210 -5.654 1.00 . A A . 2 SER CB 1 1 4 1168 1 1 2 SER H H 4.649 4.940 -4.447 1.00 . A A . 2 SER H 1 1 4 1169 1 1 2 SER HA H 6.808 4.159 -6.280 1.00 . A A . 2 SER HA 1 1 4 1170 1 1 2 SER HB2 H 5.928 6.495 -6.409 1.00 . A A . 2 SER HB2 1 1 4 1171 1 1 2 SER HB3 H 6.443 6.752 -4.741 1.00 . A A . 2 SER HB3 1 1 4 1172 1 1 2 SER HG H 8.370 5.781 -6.505 1.00 . A A . 2 SER HG 1 1 4 1173 1 1 2 SER N N 5.153 4.359 -5.060 1.00 . A A . 2 SER N 1 1 4 1174 1 1 2 SER O O 7.403 4.872 -3.159 1.00 . A A . 2 SER O 1 1 4 1175 1 1 2 SER OG O 7.945 6.560 -6.108 1.00 . A A . 2 SER OG 1 1 4 1176 1 1 3 CYS C C 10.416 3.471 -3.380 1.00 . A A . 3 CYS C 1 1 4 1177 1 1 3 CYS CA C 9.095 2.714 -3.439 1.00 . A A . 3 CYS CA 1 1 4 1178 1 1 3 CYS CB C 9.354 1.230 -3.703 1.00 . A A . 3 CYS CB 1 1 4 1179 1 1 3 CYS H H 8.244 2.845 -5.370 1.00 . A A . 3 CYS H 1 1 4 1180 1 1 3 CYS HA H 8.586 2.821 -2.494 1.00 . A A . 3 CYS HA 1 1 4 1181 1 1 3 CYS HB2 H 10.131 1.132 -4.443 1.00 . A A . 3 CYS HB2 1 1 4 1182 1 1 3 CYS HB3 H 9.680 0.763 -2.785 1.00 . A A . 3 CYS HB3 1 1 4 1183 1 1 3 CYS N N 8.236 3.257 -4.474 1.00 . A A . 3 CYS N 1 1 4 1184 1 1 3 CYS O O 11.321 3.224 -4.175 1.00 . A A . 3 CYS O 1 1 4 1185 1 1 3 CYS SG S 7.891 0.320 -4.298 1.00 . A A . 3 CYS SG 1 1 4 1186 1 1 4 THR C C 12.683 4.407 -1.312 1.00 . A A . 4 THR C 1 1 4 1187 1 1 4 THR CA C 11.748 5.156 -2.259 1.00 . A A . 4 THR CA 1 1 4 1188 1 1 4 THR CB C 11.464 6.563 -1.717 1.00 . A A . 4 THR CB 1 1 4 1189 1 1 4 THR CG2 C 12.731 7.410 -1.690 1.00 . A A . 4 THR CG2 1 1 4 1190 1 1 4 THR H H 9.740 4.617 -1.891 1.00 . A A . 4 THR H 1 1 4 1191 1 1 4 THR HA H 12.226 5.257 -3.213 1.00 . A A . 4 THR HA 1 1 4 1192 1 1 4 THR HB H 11.091 6.468 -0.718 1.00 . A A . 4 THR HB 1 1 4 1193 1 1 4 THR HG1 H 10.607 8.165 -2.517 1.00 . A A . 4 THR HG1 1 1 4 1194 1 1 4 THR HG21 H 13.465 6.939 -1.051 1.00 . A A . 4 THR HG21 1 1 4 1195 1 1 4 THR HG22 H 12.498 8.394 -1.309 1.00 . A A . 4 THR HG22 1 1 4 1196 1 1 4 THR HG23 H 13.128 7.497 -2.692 1.00 . A A . 4 THR HG23 1 1 4 1197 1 1 4 THR N N 10.516 4.411 -2.453 1.00 . A A . 4 THR N 1 1 4 1198 1 1 4 THR O O 12.504 4.445 -0.092 1.00 . A A . 4 THR O 1 1 4 1199 1 1 4 THR OG1 O 10.473 7.202 -2.536 1.00 . A A . 4 THR OG1 1 1 4 1200 1 1 5 ASP C C 13.885 1.866 -0.270 1.00 . A A . 5 ASP C 1 1 4 1201 1 1 5 ASP CA C 14.619 2.887 -1.143 1.00 . A A . 5 ASP CA 1 1 4 1202 1 1 5 ASP CB C 15.523 3.794 -0.295 1.00 . A A . 5 ASP CB 1 1 4 1203 1 1 5 ASP CG C 16.803 3.109 0.152 1.00 . A A . 5 ASP CG 1 1 4 1204 1 1 5 ASP H H 13.723 3.722 -2.880 1.00 . A A . 5 ASP H 1 1 4 1205 1 1 5 ASP HA H 15.228 2.353 -1.859 1.00 . A A . 5 ASP HA 1 1 4 1206 1 1 5 ASP HB2 H 15.793 4.664 -0.876 1.00 . A A . 5 ASP HB2 1 1 4 1207 1 1 5 ASP HB3 H 14.981 4.111 0.584 1.00 . A A . 5 ASP HB3 1 1 4 1208 1 1 5 ASP N N 13.651 3.696 -1.898 1.00 . A A . 5 ASP N 1 1 4 1209 1 1 5 ASP O O 14.347 1.476 0.802 1.00 . A A . 5 ASP O 1 1 4 1210 1 1 5 ASP OD1 O 17.594 2.686 -0.717 1.00 . A A . 5 ASP OD1 1 1 4 1211 1 1 5 ASP OD2 O 17.012 2.969 1.378 1.00 . A A . 5 ASP OD2 1 1 4 1212 1 1 6 MET C C 11.944 -0.872 -0.610 1.00 . A A . 6 MET C 1 1 4 1213 1 1 6 MET CA C 11.864 0.537 -0.031 1.00 . A A . 6 MET CA 1 1 4 1214 1 1 6 MET CB C 10.443 1.065 -0.156 1.00 . A A . 6 MET CB 1 1 4 1215 1 1 6 MET CE C 9.491 3.270 1.924 1.00 . A A . 6 MET CE 1 1 4 1216 1 1 6 MET CG C 9.535 0.685 0.981 1.00 . A A . 6 MET CG 1 1 4 1217 1 1 6 MET H H 12.457 1.719 -1.649 1.00 . A A . 6 MET H 1 1 4 1218 1 1 6 MET HA H 12.161 0.527 1.006 1.00 . A A . 6 MET HA 1 1 4 1219 1 1 6 MET HB2 H 10.477 2.140 -0.206 1.00 . A A . 6 MET HB2 1 1 4 1220 1 1 6 MET HB3 H 10.014 0.688 -1.072 1.00 . A A . 6 MET HB3 1 1 4 1221 1 1 6 MET HE1 H 8.442 3.323 1.668 1.00 . A A . 6 MET HE1 1 1 4 1222 1 1 6 MET HE2 H 10.087 3.501 1.053 1.00 . A A . 6 MET HE2 1 1 4 1223 1 1 6 MET HE3 H 9.708 3.977 2.711 1.00 . A A . 6 MET HE3 1 1 4 1224 1 1 6 MET HG2 H 8.526 0.879 0.676 1.00 . A A . 6 MET HG2 1 1 4 1225 1 1 6 MET HG3 H 9.658 -0.363 1.185 1.00 . A A . 6 MET HG3 1 1 4 1226 1 1 6 MET N N 12.735 1.428 -0.760 1.00 . A A . 6 MET N 1 1 4 1227 1 1 6 MET O O 12.345 -1.054 -1.759 1.00 . A A . 6 MET O 1 1 4 1228 1 1 6 MET SD S 9.878 1.615 2.483 1.00 . A A . 6 MET SD 1 1 4 1229 1 1 7 SER C C 10.255 -3.467 -1.097 1.00 . A A . 7 SER C 1 1 4 1230 1 1 7 SER CA C 11.529 -3.230 -0.292 1.00 . A A . 7 SER CA 1 1 4 1231 1 1 7 SER CB C 11.602 -4.177 0.907 1.00 . A A . 7 SER CB 1 1 4 1232 1 1 7 SER H H 11.265 -1.685 1.089 1.00 . A A . 7 SER H 1 1 4 1233 1 1 7 SER HA H 12.387 -3.387 -0.927 1.00 . A A . 7 SER HA 1 1 4 1234 1 1 7 SER HB2 H 10.652 -4.179 1.422 1.00 . A A . 7 SER HB2 1 1 4 1235 1 1 7 SER HB3 H 11.825 -5.175 0.559 1.00 . A A . 7 SER HB3 1 1 4 1236 1 1 7 SER HG H 12.385 -2.905 2.188 1.00 . A A . 7 SER HG 1 1 4 1237 1 1 7 SER N N 11.551 -1.868 0.174 1.00 . A A . 7 SER N 1 1 4 1238 1 1 7 SER O O 9.558 -2.521 -1.469 1.00 . A A . 7 SER O 1 1 4 1239 1 1 7 SER OG O 12.613 -3.773 1.819 1.00 . A A . 7 SER OG 1 1 4 1240 1 1 8 ASP C C 7.512 -5.071 -1.313 1.00 . A A . 8 ASP C 1 1 4 1241 1 1 8 ASP CA C 8.779 -5.066 -2.160 1.00 . A A . 8 ASP CA 1 1 4 1242 1 1 8 ASP CB C 8.968 -6.426 -2.830 1.00 . A A . 8 ASP CB 1 1 4 1243 1 1 8 ASP CG C 7.788 -6.803 -3.704 1.00 . A A . 8 ASP CG 1 1 4 1244 1 1 8 ASP H H 10.522 -5.423 -0.986 1.00 . A A . 8 ASP H 1 1 4 1245 1 1 8 ASP HA H 8.675 -4.311 -2.926 1.00 . A A . 8 ASP HA 1 1 4 1246 1 1 8 ASP HB2 H 9.855 -6.396 -3.446 1.00 . A A . 8 ASP HB2 1 1 4 1247 1 1 8 ASP HB3 H 9.088 -7.183 -2.070 1.00 . A A . 8 ASP HB3 1 1 4 1248 1 1 8 ASP N N 9.948 -4.716 -1.353 1.00 . A A . 8 ASP N 1 1 4 1249 1 1 8 ASP O O 6.649 -4.202 -1.463 1.00 . A A . 8 ASP O 1 1 4 1250 1 1 8 ASP OD1 O 7.768 -6.401 -4.887 1.00 . A A . 8 ASP OD1 1 1 4 1251 1 1 8 ASP OD2 O 6.881 -7.507 -3.216 1.00 . A A . 8 ASP OD2 1 1 4 1252 1 1 9 LEU C C 6.192 -4.894 1.358 1.00 . A A . 9 LEU C 1 1 4 1253 1 1 9 LEU CA C 6.269 -6.141 0.487 1.00 . A A . 9 LEU CA 1 1 4 1254 1 1 9 LEU CB C 6.381 -7.390 1.368 1.00 . A A . 9 LEU CB 1 1 4 1255 1 1 9 LEU CD1 C 3.940 -7.951 1.502 1.00 . A A . 9 LEU CD1 1 1 4 1256 1 1 9 LEU CD2 C 5.508 -8.789 3.254 1.00 . A A . 9 LEU CD2 1 1 4 1257 1 1 9 LEU CG C 5.196 -7.647 2.303 1.00 . A A . 9 LEU CG 1 1 4 1258 1 1 9 LEU H H 8.131 -6.708 -0.342 1.00 . A A . 9 LEU H 1 1 4 1259 1 1 9 LEU HA H 5.376 -6.207 -0.115 1.00 . A A . 9 LEU HA 1 1 4 1260 1 1 9 LEU HB2 H 6.495 -8.249 0.723 1.00 . A A . 9 LEU HB2 1 1 4 1261 1 1 9 LEU HB3 H 7.270 -7.294 1.972 1.00 . A A . 9 LEU HB3 1 1 4 1262 1 1 9 LEU HD11 H 4.125 -8.795 0.854 1.00 . A A . 9 LEU HD11 1 1 4 1263 1 1 9 LEU HD12 H 3.675 -7.090 0.908 1.00 . A A . 9 LEU HD12 1 1 4 1264 1 1 9 LEU HD13 H 3.130 -8.186 2.177 1.00 . A A . 9 LEU HD13 1 1 4 1265 1 1 9 LEU HD21 H 4.676 -8.936 3.927 1.00 . A A . 9 LEU HD21 1 1 4 1266 1 1 9 LEU HD22 H 6.395 -8.553 3.823 1.00 . A A . 9 LEU HD22 1 1 4 1267 1 1 9 LEU HD23 H 5.674 -9.692 2.686 1.00 . A A . 9 LEU HD23 1 1 4 1268 1 1 9 LEU HG H 5.009 -6.759 2.891 1.00 . A A . 9 LEU HG 1 1 4 1269 1 1 9 LEU N N 7.413 -6.042 -0.409 1.00 . A A . 9 LEU N 1 1 4 1270 1 1 9 LEU O O 5.112 -4.364 1.610 1.00 . A A . 9 LEU O 1 1 4 1271 1 1 10 GLU C C 6.864 -2.020 1.857 1.00 . A A . 10 GLU C 1 1 4 1272 1 1 10 GLU CA C 7.495 -3.212 2.578 1.00 . A A . 10 GLU CA 1 1 4 1273 1 1 10 GLU CB C 8.980 -2.957 2.837 1.00 . A A . 10 GLU CB 1 1 4 1274 1 1 10 GLU CD C 10.757 -1.553 3.913 1.00 . A A . 10 GLU CD 1 1 4 1275 1 1 10 GLU CG C 9.276 -1.717 3.654 1.00 . A A . 10 GLU CG 1 1 4 1276 1 1 10 GLU H H 8.174 -4.949 1.578 1.00 . A A . 10 GLU H 1 1 4 1277 1 1 10 GLU HA H 6.992 -3.360 3.520 1.00 . A A . 10 GLU HA 1 1 4 1278 1 1 10 GLU HB2 H 9.391 -3.806 3.360 1.00 . A A . 10 GLU HB2 1 1 4 1279 1 1 10 GLU HB3 H 9.483 -2.860 1.886 1.00 . A A . 10 GLU HB3 1 1 4 1280 1 1 10 GLU HG2 H 8.919 -0.851 3.117 1.00 . A A . 10 GLU HG2 1 1 4 1281 1 1 10 GLU HG3 H 8.765 -1.791 4.601 1.00 . A A . 10 GLU HG3 1 1 4 1282 1 1 10 GLU N N 7.360 -4.433 1.789 1.00 . A A . 10 GLU N 1 1 4 1283 1 1 10 GLU O O 6.196 -1.187 2.471 1.00 . A A . 10 GLU O 1 1 4 1284 1 1 10 GLU OE1 O 11.524 -1.421 2.934 1.00 . A A . 10 GLU OE1 1 1 4 1285 1 1 10 GLU OE2 O 11.158 -1.541 5.098 1.00 . A A . 10 GLU OE2 1 1 4 1286 1 1 11 CYS C C 4.985 -0.982 -0.296 1.00 . A A . 11 CYS C 1 1 4 1287 1 1 11 CYS CA C 6.499 -0.888 -0.268 1.00 . A A . 11 CYS CA 1 1 4 1288 1 1 11 CYS CB C 7.053 -0.955 -1.693 1.00 . A A . 11 CYS CB 1 1 4 1289 1 1 11 CYS H H 7.584 -2.666 0.110 1.00 . A A . 11 CYS H 1 1 4 1290 1 1 11 CYS HA H 6.779 0.052 0.181 1.00 . A A . 11 CYS HA 1 1 4 1291 1 1 11 CYS HB2 H 8.131 -0.975 -1.650 1.00 . A A . 11 CYS HB2 1 1 4 1292 1 1 11 CYS HB3 H 6.700 -1.862 -2.163 1.00 . A A . 11 CYS HB3 1 1 4 1293 1 1 11 CYS N N 7.057 -1.962 0.545 1.00 . A A . 11 CYS N 1 1 4 1294 1 1 11 CYS O O 4.282 0.025 -0.210 1.00 . A A . 11 CYS O 1 1 4 1295 1 1 11 CYS SG S 6.574 0.440 -2.760 1.00 . A A . 11 CYS SG 1 1 4 1296 1 1 12 MET C C 2.462 -2.154 0.982 1.00 . A A . 12 MET C 1 1 4 1297 1 1 12 MET CA C 3.045 -2.407 -0.405 1.00 . A A . 12 MET CA 1 1 4 1298 1 1 12 MET CB C 2.708 -3.816 -0.900 1.00 . A A . 12 MET CB 1 1 4 1299 1 1 12 MET CE C 3.514 -6.779 -1.970 1.00 . A A . 12 MET CE 1 1 4 1300 1 1 12 MET CG C 3.118 -4.056 -2.347 1.00 . A A . 12 MET CG 1 1 4 1301 1 1 12 MET H H 5.081 -2.970 -0.467 1.00 . A A . 12 MET H 1 1 4 1302 1 1 12 MET HA H 2.618 -1.688 -1.090 1.00 . A A . 12 MET HA 1 1 4 1303 1 1 12 MET HB2 H 3.216 -4.537 -0.276 1.00 . A A . 12 MET HB2 1 1 4 1304 1 1 12 MET HB3 H 1.643 -3.970 -0.821 1.00 . A A . 12 MET HB3 1 1 4 1305 1 1 12 MET HE1 H 3.297 -7.796 -2.263 1.00 . A A . 12 MET HE1 1 1 4 1306 1 1 12 MET HE2 H 3.248 -6.638 -0.934 1.00 . A A . 12 MET HE2 1 1 4 1307 1 1 12 MET HE3 H 4.568 -6.584 -2.102 1.00 . A A . 12 MET HE3 1 1 4 1308 1 1 12 MET HG2 H 2.696 -3.276 -2.961 1.00 . A A . 12 MET HG2 1 1 4 1309 1 1 12 MET HG3 H 4.196 -4.013 -2.411 1.00 . A A . 12 MET HG3 1 1 4 1310 1 1 12 MET N N 4.479 -2.197 -0.395 1.00 . A A . 12 MET N 1 1 4 1311 1 1 12 MET O O 1.294 -1.810 1.111 1.00 . A A . 12 MET O 1 1 4 1312 1 1 12 MET SD S 2.567 -5.651 -2.988 1.00 . A A . 12 MET SD 1 1 4 1313 1 1 13 ASN C C 2.517 -0.577 3.600 1.00 . A A . 13 ASN C 1 1 4 1314 1 1 13 ASN CA C 2.856 -2.044 3.385 1.00 . A A . 13 ASN CA 1 1 4 1315 1 1 13 ASN CB C 3.922 -2.464 4.403 1.00 . A A . 13 ASN CB 1 1 4 1316 1 1 13 ASN CG C 4.047 -3.966 4.552 1.00 . A A . 13 ASN CG 1 1 4 1317 1 1 13 ASN H H 4.218 -2.572 1.846 1.00 . A A . 13 ASN H 1 1 4 1318 1 1 13 ASN HA H 1.965 -2.631 3.557 1.00 . A A . 13 ASN HA 1 1 4 1319 1 1 13 ASN HB2 H 4.880 -2.076 4.088 1.00 . A A . 13 ASN HB2 1 1 4 1320 1 1 13 ASN HB3 H 3.671 -2.044 5.366 1.00 . A A . 13 ASN HB3 1 1 4 1321 1 1 13 ASN HD21 H 5.935 -3.767 5.144 1.00 . A A . 13 ASN HD21 1 1 4 1322 1 1 13 ASN HD22 H 5.330 -5.389 5.066 1.00 . A A . 13 ASN HD22 1 1 4 1323 1 1 13 ASN N N 3.291 -2.291 2.013 1.00 . A A . 13 ASN N 1 1 4 1324 1 1 13 ASN ND2 N 5.220 -4.421 4.959 1.00 . A A . 13 ASN ND2 1 1 4 1325 1 1 13 ASN O O 1.403 -0.245 4.002 1.00 . A A . 13 ASN O 1 1 4 1326 1 1 13 ASN OD1 O 3.091 -4.709 4.327 1.00 . A A . 13 ASN OD1 1 1 4 1327 1 1 14 PHE C C 2.325 2.361 2.595 1.00 . A A . 14 PHE C 1 1 4 1328 1 1 14 PHE CA C 3.282 1.727 3.602 1.00 . A A . 14 PHE CA 1 1 4 1329 1 1 14 PHE CB C 4.628 2.483 3.633 1.00 . A A . 14 PHE CB 1 1 4 1330 1 1 14 PHE CD1 C 5.875 2.038 1.499 1.00 . A A . 14 PHE CD1 1 1 4 1331 1 1 14 PHE CD2 C 4.914 4.195 1.815 1.00 . A A . 14 PHE CD2 1 1 4 1332 1 1 14 PHE CE1 C 6.350 2.425 0.262 1.00 . A A . 14 PHE CE1 1 1 4 1333 1 1 14 PHE CE2 C 5.387 4.588 0.578 1.00 . A A . 14 PHE CE2 1 1 4 1334 1 1 14 PHE CG C 5.152 2.919 2.292 1.00 . A A . 14 PHE CG 1 1 4 1335 1 1 14 PHE CZ C 6.136 3.747 -0.171 1.00 . A A . 14 PHE CZ 1 1 4 1336 1 1 14 PHE H H 4.318 0.000 2.922 1.00 . A A . 14 PHE H 1 1 4 1337 1 1 14 PHE HA H 2.831 1.796 4.581 1.00 . A A . 14 PHE HA 1 1 4 1338 1 1 14 PHE HB2 H 4.517 3.367 4.240 1.00 . A A . 14 PHE HB2 1 1 4 1339 1 1 14 PHE HB3 H 5.374 1.843 4.084 1.00 . A A . 14 PHE HB3 1 1 4 1340 1 1 14 PHE HD1 H 6.065 1.039 1.859 1.00 . A A . 14 PHE HD1 1 1 4 1341 1 1 14 PHE HD2 H 4.356 4.893 2.423 1.00 . A A . 14 PHE HD2 1 1 4 1342 1 1 14 PHE HE1 H 6.911 1.730 -0.344 1.00 . A A . 14 PHE HE1 1 1 4 1343 1 1 14 PHE HE2 H 5.193 5.587 0.217 1.00 . A A . 14 PHE HE2 1 1 4 1344 1 1 14 PHE HZ H 6.519 4.068 -1.127 1.00 . A A . 14 PHE HZ 1 1 4 1345 1 1 14 PHE N N 3.472 0.308 3.319 1.00 . A A . 14 PHE N 1 1 4 1346 1 1 14 PHE O O 1.643 3.329 2.907 1.00 . A A . 14 PHE O 1 1 4 1347 1 1 15 CYS C C -0.039 1.869 0.470 1.00 . A A . 15 CYS C 1 1 4 1348 1 1 15 CYS CA C 1.409 2.356 0.350 1.00 . A A . 15 CYS CA 1 1 4 1349 1 1 15 CYS CB C 1.966 2.010 -1.033 1.00 . A A . 15 CYS CB 1 1 4 1350 1 1 15 CYS H H 2.836 1.024 1.191 1.00 . A A . 15 CYS H 1 1 4 1351 1 1 15 CYS HA H 1.416 3.429 0.463 1.00 . A A . 15 CYS HA 1 1 4 1352 1 1 15 CYS HB2 H 2.949 2.443 -1.135 1.00 . A A . 15 CYS HB2 1 1 4 1353 1 1 15 CYS HB3 H 2.042 0.936 -1.122 1.00 . A A . 15 CYS HB3 1 1 4 1354 1 1 15 CYS N N 2.267 1.803 1.392 1.00 . A A . 15 CYS N 1 1 4 1355 1 1 15 CYS O O -0.975 2.662 0.380 1.00 . A A . 15 CYS O 1 1 4 1356 1 1 15 CYS SG S 0.952 2.611 -2.424 1.00 . A A . 15 CYS SG 1 1 4 1357 1 1 16 HIS C C -2.304 0.172 1.981 1.00 . A A . 16 HIS C 1 1 4 1358 1 1 16 HIS CA C -1.572 -0.012 0.658 1.00 . A A . 16 HIS CA 1 1 4 1359 1 1 16 HIS CB C -1.517 -1.499 0.291 1.00 . A A . 16 HIS CB 1 1 4 1360 1 1 16 HIS CD2 C -0.614 -1.000 -2.093 1.00 . A A . 16 HIS CD2 1 1 4 1361 1 1 16 HIS CE1 C -1.184 -2.879 -3.051 1.00 . A A . 16 HIS CE1 1 1 4 1362 1 1 16 HIS CG C -1.224 -1.763 -1.156 1.00 . A A . 16 HIS CG 1 1 4 1363 1 1 16 HIS H H 0.541 -0.005 0.894 1.00 . A A . 16 HIS H 1 1 4 1364 1 1 16 HIS HA H -2.127 0.508 -0.107 1.00 . A A . 16 HIS HA 1 1 4 1365 1 1 16 HIS HB2 H -0.741 -1.974 0.872 1.00 . A A . 16 HIS HB2 1 1 4 1366 1 1 16 HIS HB3 H -2.466 -1.956 0.525 1.00 . A A . 16 HIS HB3 1 1 4 1367 1 1 16 HIS HD1 H -2.022 -3.710 -1.372 1.00 . A A . 16 HIS HD1 1 1 4 1368 1 1 16 HIS HD2 H -0.214 -0.007 -1.945 1.00 . A A . 16 HIS HD2 1 1 4 1369 1 1 16 HIS HE1 H -1.330 -3.654 -3.788 1.00 . A A . 16 HIS HE1 1 1 4 1370 1 1 16 HIS HE2 H -0.461 -1.321 -4.165 1.00 . A A . 16 HIS HE2 1 1 4 1371 1 1 16 HIS N N -0.229 0.571 0.691 1.00 . A A . 16 HIS N 1 1 4 1372 1 1 16 HIS ND1 N -1.567 -2.935 -1.791 1.00 . A A . 16 HIS ND1 1 1 4 1373 1 1 16 HIS NE2 N -0.602 -1.716 -3.265 1.00 . A A . 16 HIS NE2 1 1 4 1374 1 1 16 HIS O O -3.436 -0.286 2.138 1.00 . A A . 16 HIS O 1 1 4 1375 1 1 17 LYS C C -3.086 2.456 4.092 1.00 . A A . 17 LYS C 1 1 4 1376 1 1 17 LYS CA C -2.334 1.152 4.193 1.00 . A A . 17 LYS CA 1 1 4 1377 1 1 17 LYS CB C -1.339 1.208 5.355 1.00 . A A . 17 LYS CB 1 1 4 1378 1 1 17 LYS CD C 0.447 2.528 6.540 1.00 . A A . 17 LYS CD 1 1 4 1379 1 1 17 LYS CE C 1.373 3.733 6.466 1.00 . A A . 17 LYS CE 1 1 4 1380 1 1 17 LYS CG C -0.358 2.365 5.261 1.00 . A A . 17 LYS CG 1 1 4 1381 1 1 17 LYS H H -0.752 1.153 2.779 1.00 . A A . 17 LYS H 1 1 4 1382 1 1 17 LYS HA H -3.049 0.388 4.371 1.00 . A A . 17 LYS HA 1 1 4 1383 1 1 17 LYS HB2 H -1.887 1.305 6.281 1.00 . A A . 17 LYS HB2 1 1 4 1384 1 1 17 LYS HB3 H -0.776 0.288 5.375 1.00 . A A . 17 LYS HB3 1 1 4 1385 1 1 17 LYS HD2 H -0.233 2.659 7.368 1.00 . A A . 17 LYS HD2 1 1 4 1386 1 1 17 LYS HD3 H 1.039 1.639 6.695 1.00 . A A . 17 LYS HD3 1 1 4 1387 1 1 17 LYS HE2 H 1.909 3.816 7.400 1.00 . A A . 17 LYS HE2 1 1 4 1388 1 1 17 LYS HE3 H 2.076 3.579 5.659 1.00 . A A . 17 LYS HE3 1 1 4 1389 1 1 17 LYS HG2 H 0.323 2.181 4.443 1.00 . A A . 17 LYS HG2 1 1 4 1390 1 1 17 LYS HG3 H -0.909 3.275 5.074 1.00 . A A . 17 LYS HG3 1 1 4 1391 1 1 17 LYS HZ1 H 0.208 4.994 5.266 1.00 . A A . 17 LYS HZ1 1 1 4 1392 1 1 17 LYS HZ2 H 1.273 5.815 6.300 1.00 . A A . 17 LYS HZ2 1 1 4 1393 1 1 17 LYS HZ3 H -0.136 5.107 6.923 1.00 . A A . 17 LYS HZ3 1 1 4 1394 1 1 17 LYS N N -1.673 0.852 2.930 1.00 . A A . 17 LYS N 1 1 4 1395 1 1 17 LYS NZ N 0.629 4.997 6.224 1.00 . A A . 17 LYS NZ 1 1 4 1396 1 1 17 LYS O O -3.782 2.869 5.020 1.00 . A A . 17 LYS O 1 1 4 1397 1 1 18 ASP C C -4.379 4.353 1.427 1.00 . A A . 18 ASP C 1 1 4 1398 1 1 18 ASP CA C -3.575 4.367 2.713 1.00 . A A . 18 ASP CA 1 1 4 1399 1 1 18 ASP CB C -2.511 5.457 2.637 1.00 . A A . 18 ASP CB 1 1 4 1400 1 1 18 ASP CG C -1.667 5.564 3.891 1.00 . A A . 18 ASP CG 1 1 4 1401 1 1 18 ASP H H -2.449 2.650 2.231 1.00 . A A . 18 ASP H 1 1 4 1402 1 1 18 ASP HA H -4.238 4.577 3.537 1.00 . A A . 18 ASP HA 1 1 4 1403 1 1 18 ASP HB2 H -1.859 5.258 1.802 1.00 . A A . 18 ASP HB2 1 1 4 1404 1 1 18 ASP HB3 H -3.005 6.391 2.482 1.00 . A A . 18 ASP HB3 1 1 4 1405 1 1 18 ASP N N -2.965 3.077 2.946 1.00 . A A . 18 ASP N 1 1 4 1406 1 1 18 ASP O O -4.470 5.369 0.732 1.00 . A A . 18 ASP O 1 1 4 1407 1 1 18 ASP OD1 O -2.190 6.020 4.929 1.00 . A A . 18 ASP OD1 1 1 4 1408 1 1 18 ASP OD2 O -0.479 5.187 3.849 1.00 . A A . 18 ASP OD2 1 1 4 1409 1 1 19 VAL C C -6.969 4.091 0.030 1.00 . A A . 19 VAL C 1 1 4 1410 1 1 19 VAL CA C -5.813 3.102 -0.069 1.00 . A A . 19 VAL CA 1 1 4 1411 1 1 19 VAL CB C -6.347 1.673 -0.290 1.00 . A A . 19 VAL CB 1 1 4 1412 1 1 19 VAL CG1 C -5.204 0.722 -0.605 1.00 . A A . 19 VAL CG1 1 1 4 1413 1 1 19 VAL CG2 C -7.120 1.188 0.917 1.00 . A A . 19 VAL CG2 1 1 4 1414 1 1 19 VAL H H -4.826 2.419 1.673 1.00 . A A . 19 VAL H 1 1 4 1415 1 1 19 VAL HA H -5.215 3.364 -0.922 1.00 . A A . 19 VAL HA 1 1 4 1416 1 1 19 VAL HB H -7.016 1.691 -1.138 1.00 . A A . 19 VAL HB 1 1 4 1417 1 1 19 VAL HG11 H -5.600 -0.261 -0.812 1.00 . A A . 19 VAL HG11 1 1 4 1418 1 1 19 VAL HG12 H -4.537 0.670 0.243 1.00 . A A . 19 VAL HG12 1 1 4 1419 1 1 19 VAL HG13 H -4.663 1.083 -1.468 1.00 . A A . 19 VAL HG13 1 1 4 1420 1 1 19 VAL HG21 H -7.463 0.180 0.744 1.00 . A A . 19 VAL HG21 1 1 4 1421 1 1 19 VAL HG22 H -7.967 1.837 1.079 1.00 . A A . 19 VAL HG22 1 1 4 1422 1 1 19 VAL HG23 H -6.477 1.210 1.781 1.00 . A A . 19 VAL HG23 1 1 4 1423 1 1 19 VAL N N -4.965 3.204 1.108 1.00 . A A . 19 VAL N 1 1 4 1424 1 1 19 VAL O O -7.676 4.150 1.036 1.00 . A A . 19 VAL O 1 1 4 1425 1 1 20 ILE C C -9.511 5.490 -1.328 1.00 . A A . 20 ILE C 1 1 4 1426 1 1 20 ILE CA C -8.099 5.978 -0.978 1.00 . A A . 20 ILE CA 1 1 4 1427 1 1 20 ILE CB C -7.661 7.105 -1.940 1.00 . A A . 20 ILE CB 1 1 4 1428 1 1 20 ILE CD1 C -8.077 8.943 -0.235 1.00 . A A . 20 ILE CD1 1 1 4 1429 1 1 20 ILE CG1 C -8.395 8.407 -1.616 1.00 . A A . 20 ILE CG1 1 1 4 1430 1 1 20 ILE CG2 C -7.891 6.695 -3.384 1.00 . A A . 20 ILE CG2 1 1 4 1431 1 1 20 ILE H H -6.580 4.758 -1.809 1.00 . A A . 20 ILE H 1 1 4 1432 1 1 20 ILE HA H -8.111 6.383 0.019 1.00 . A A . 20 ILE HA 1 1 4 1433 1 1 20 ILE HB H -6.599 7.260 -1.808 1.00 . A A . 20 ILE HB 1 1 4 1434 1 1 20 ILE HD11 H -8.639 9.849 -0.061 1.00 . A A . 20 ILE HD11 1 1 4 1435 1 1 20 ILE HD12 H -7.020 9.155 -0.164 1.00 . A A . 20 ILE HD12 1 1 4 1436 1 1 20 ILE HD13 H -8.344 8.205 0.508 1.00 . A A . 20 ILE HD13 1 1 4 1437 1 1 20 ILE HG12 H -8.114 9.157 -2.338 1.00 . A A . 20 ILE HG12 1 1 4 1438 1 1 20 ILE HG13 H -9.460 8.237 -1.671 1.00 . A A . 20 ILE HG13 1 1 4 1439 1 1 20 ILE HG21 H -8.934 6.445 -3.524 1.00 . A A . 20 ILE HG21 1 1 4 1440 1 1 20 ILE HG22 H -7.280 5.835 -3.615 1.00 . A A . 20 ILE HG22 1 1 4 1441 1 1 20 ILE HG23 H -7.626 7.513 -4.036 1.00 . A A . 20 ILE HG23 1 1 4 1442 1 1 20 ILE N N -7.137 4.889 -1.007 1.00 . A A . 20 ILE N 1 1 4 1443 1 1 20 ILE O O -10.471 6.258 -1.306 1.00 . A A . 20 ILE O 1 1 4 1444 1 1 21 TRP C C -11.521 2.745 -0.946 1.00 . A A . 21 TRP C 1 1 4 1445 1 1 21 TRP CA C -10.924 3.642 -2.022 1.00 . A A . 21 TRP CA 1 1 4 1446 1 1 21 TRP CB C -10.804 2.878 -3.341 1.00 . A A . 21 TRP CB 1 1 4 1447 1 1 21 TRP CD1 C -8.417 2.622 -4.240 1.00 . A A . 21 TRP CD1 1 1 4 1448 1 1 21 TRP CD2 C -9.149 0.846 -3.087 1.00 . A A . 21 TRP CD2 1 1 4 1449 1 1 21 TRP CE2 C -7.840 0.585 -3.538 1.00 . A A . 21 TRP CE2 1 1 4 1450 1 1 21 TRP CE3 C -9.810 -0.132 -2.338 1.00 . A A . 21 TRP CE3 1 1 4 1451 1 1 21 TRP CG C -9.500 2.157 -3.547 1.00 . A A . 21 TRP CG 1 1 4 1452 1 1 21 TRP CH2 C -7.855 -1.551 -2.531 1.00 . A A . 21 TRP CH2 1 1 4 1453 1 1 21 TRP CZ2 C -7.183 -0.612 -3.266 1.00 . A A . 21 TRP CZ2 1 1 4 1454 1 1 21 TRP CZ3 C -9.157 -1.321 -2.069 1.00 . A A . 21 TRP CZ3 1 1 4 1455 1 1 21 TRP H H -8.854 3.622 -1.580 1.00 . A A . 21 TRP H 1 1 4 1456 1 1 21 TRP HA H -11.599 4.471 -2.173 1.00 . A A . 21 TRP HA 1 1 4 1457 1 1 21 TRP HB2 H -11.595 2.145 -3.389 1.00 . A A . 21 TRP HB2 1 1 4 1458 1 1 21 TRP HB3 H -10.924 3.577 -4.150 1.00 . A A . 21 TRP HB3 1 1 4 1459 1 1 21 TRP HD1 H -8.370 3.591 -4.714 1.00 . A A . 21 TRP HD1 1 1 4 1460 1 1 21 TRP HE1 H -6.538 1.783 -4.678 1.00 . A A . 21 TRP HE1 1 1 4 1461 1 1 21 TRP HE3 H -10.812 0.029 -1.973 1.00 . A A . 21 TRP HE3 1 1 4 1462 1 1 21 TRP HH2 H -7.384 -2.494 -2.300 1.00 . A A . 21 TRP HH2 1 1 4 1463 1 1 21 TRP HZ2 H -6.179 -0.803 -3.614 1.00 . A A . 21 TRP HZ2 1 1 4 1464 1 1 21 TRP HZ3 H -9.654 -2.088 -1.495 1.00 . A A . 21 TRP HZ3 1 1 4 1465 1 1 21 TRP N N -9.639 4.204 -1.627 1.00 . A A . 21 TRP N 1 1 4 1466 1 1 21 TRP NE1 N -7.418 1.683 -4.239 1.00 . A A . 21 TRP NE1 1 1 4 1467 1 1 21 TRP O O -12.139 1.724 -1.249 1.00 . A A . 21 TRP O 1 1 4 1468 1 1 22 VAL C C -13.461 2.604 1.477 1.00 . A A . 22 VAL C 1 1 4 1469 1 1 22 VAL CA C -11.948 2.400 1.413 1.00 . A A . 22 VAL CA 1 1 4 1470 1 1 22 VAL CB C -11.322 2.806 2.761 1.00 . A A . 22 VAL CB 1 1 4 1471 1 1 22 VAL CG1 C -11.913 1.983 3.893 1.00 . A A . 22 VAL CG1 1 1 4 1472 1 1 22 VAL CG2 C -9.812 2.649 2.712 1.00 . A A . 22 VAL CG2 1 1 4 1473 1 1 22 VAL H H -10.874 3.971 0.488 1.00 . A A . 22 VAL H 1 1 4 1474 1 1 22 VAL HA H -11.743 1.354 1.247 1.00 . A A . 22 VAL HA 1 1 4 1475 1 1 22 VAL HB H -11.550 3.845 2.945 1.00 . A A . 22 VAL HB 1 1 4 1476 1 1 22 VAL HG11 H -12.979 2.156 3.943 1.00 . A A . 22 VAL HG11 1 1 4 1477 1 1 22 VAL HG12 H -11.456 2.274 4.826 1.00 . A A . 22 VAL HG12 1 1 4 1478 1 1 22 VAL HG13 H -11.727 0.934 3.710 1.00 . A A . 22 VAL HG13 1 1 4 1479 1 1 22 VAL HG21 H -9.565 1.618 2.507 1.00 . A A . 22 VAL HG21 1 1 4 1480 1 1 22 VAL HG22 H -9.382 2.942 3.660 1.00 . A A . 22 VAL HG22 1 1 4 1481 1 1 22 VAL HG23 H -9.413 3.276 1.926 1.00 . A A . 22 VAL HG23 1 1 4 1482 1 1 22 VAL N N -11.374 3.149 0.306 1.00 . A A . 22 VAL N 1 1 4 1483 1 1 22 VAL O O -13.932 3.671 1.879 1.00 . A A . 22 VAL O 1 1 4 1484 1 1 23 ASN C C -16.245 2.515 0.027 1.00 . A A . 23 ASN C 1 1 4 1485 1 1 23 ASN CA C -15.664 1.572 1.076 1.00 . A A . 23 ASN CA 1 1 4 1486 1 1 23 ASN CB C -16.197 1.921 2.475 1.00 . A A . 23 ASN CB 1 1 4 1487 1 1 23 ASN CG C -17.707 1.813 2.563 1.00 . A A . 23 ASN CG 1 1 4 1488 1 1 23 ASN H H -13.737 0.806 0.648 1.00 . A A . 23 ASN H 1 1 4 1489 1 1 23 ASN HA H -15.979 0.567 0.832 1.00 . A A . 23 ASN HA 1 1 4 1490 1 1 23 ASN HB2 H -15.765 1.247 3.197 1.00 . A A . 23 ASN HB2 1 1 4 1491 1 1 23 ASN HB3 H -15.913 2.935 2.719 1.00 . A A . 23 ASN HB3 1 1 4 1492 1 1 23 ASN HD21 H -17.892 3.760 2.211 1.00 . A A . 23 ASN HD21 1 1 4 1493 1 1 23 ASN HD22 H -19.373 2.887 2.423 1.00 . A A . 23 ASN HD22 1 1 4 1494 1 1 23 ASN N N -14.198 1.583 1.039 1.00 . A A . 23 ASN N 1 1 4 1495 1 1 23 ASN ND2 N -18.394 2.931 2.382 1.00 . A A . 23 ASN ND2 1 1 4 1496 1 1 23 ASN O O -16.007 3.725 0.049 1.00 . A A . 23 ASN O 1 1 4 1497 1 1 23 ASN OD1 O -18.250 0.734 2.816 1.00 . A A . 23 ASN OD1 1 1 4 1498 1 1 24 ARG C C -19.047 2.984 -1.784 1.00 . A A . 24 ARG C 1 1 4 1499 1 1 24 ARG CA C -17.560 2.728 -2.002 1.00 . A A . 24 ARG CA 1 1 4 1500 1 1 24 ARG CB C -17.344 1.998 -3.334 1.00 . A A . 24 ARG CB 1 1 4 1501 1 1 24 ARG CD C -14.875 2.522 -3.303 1.00 . A A . 24 ARG CD 1 1 4 1502 1 1 24 ARG CG C -15.934 1.454 -3.527 1.00 . A A . 24 ARG CG 1 1 4 1503 1 1 24 ARG CZ C -14.520 4.858 -4.007 1.00 . A A . 24 ARG CZ 1 1 4 1504 1 1 24 ARG H H -17.212 0.995 -0.834 1.00 . A A . 24 ARG H 1 1 4 1505 1 1 24 ARG HA H -17.044 3.675 -2.031 1.00 . A A . 24 ARG HA 1 1 4 1506 1 1 24 ARG HB2 H -18.035 1.169 -3.393 1.00 . A A . 24 ARG HB2 1 1 4 1507 1 1 24 ARG HB3 H -17.555 2.684 -4.142 1.00 . A A . 24 ARG HB3 1 1 4 1508 1 1 24 ARG HD2 H -14.967 2.896 -2.294 1.00 . A A . 24 ARG HD2 1 1 4 1509 1 1 24 ARG HD3 H -13.901 2.074 -3.432 1.00 . A A . 24 ARG HD3 1 1 4 1510 1 1 24 ARG HE H -15.476 3.466 -5.089 1.00 . A A . 24 ARG HE 1 1 4 1511 1 1 24 ARG HG2 H -15.771 0.651 -2.825 1.00 . A A . 24 ARG HG2 1 1 4 1512 1 1 24 ARG HG3 H -15.842 1.075 -4.535 1.00 . A A . 24 ARG HG3 1 1 4 1513 1 1 24 ARG HH11 H -13.803 4.425 -2.166 1.00 . A A . 24 ARG HH11 1 1 4 1514 1 1 24 ARG HH12 H -13.504 6.047 -2.714 1.00 . A A . 24 ARG HH12 1 1 4 1515 1 1 24 ARG HH21 H -15.139 5.611 -5.785 1.00 . A A . 24 ARG HH21 1 1 4 1516 1 1 24 ARG HH22 H -14.306 6.731 -4.749 1.00 . A A . 24 ARG HH22 1 1 4 1517 1 1 24 ARG N N -17.009 1.953 -0.898 1.00 . A A . 24 ARG N 1 1 4 1518 1 1 24 ARG NE N -15.007 3.639 -4.234 1.00 . A A . 24 ARG NE 1 1 4 1519 1 1 24 ARG NH1 N -13.900 5.130 -2.868 1.00 . A A . 24 ARG NH1 1 1 4 1520 1 1 24 ARG NH2 N -14.664 5.809 -4.919 1.00 . A A . 24 ARG NH2 1 1 4 1521 1 1 24 ARG O O -19.616 3.926 -2.336 1.00 . A A . 24 ARG O 1 1 4 1522 1 1 25 ASN C C -21.283 2.423 0.821 1.00 . A A . 25 ASN C 1 1 4 1523 1 1 25 ASN CA C -21.083 2.254 -0.677 1.00 . A A . 25 ASN CA 1 1 4 1524 1 1 25 ASN CB C -21.838 1.020 -1.171 1.00 . A A . 25 ASN CB 1 1 4 1525 1 1 25 ASN CG C -23.334 1.110 -0.923 1.00 . A A . 25 ASN CG 1 1 4 1526 1 1 25 ASN H H -19.154 1.404 -0.576 1.00 . A A . 25 ASN H 1 1 4 1527 1 1 25 ASN HA H -21.463 3.126 -1.181 1.00 . A A . 25 ASN HA 1 1 4 1528 1 1 25 ASN HB2 H -21.677 0.910 -2.234 1.00 . A A . 25 ASN HB2 1 1 4 1529 1 1 25 ASN HB3 H -21.458 0.146 -0.664 1.00 . A A . 25 ASN HB3 1 1 4 1530 1 1 25 ASN HD21 H -23.309 3.067 -1.255 1.00 . A A . 25 ASN HD21 1 1 4 1531 1 1 25 ASN HD22 H -24.852 2.389 -0.879 1.00 . A A . 25 ASN HD22 1 1 4 1532 1 1 25 ASN N N -19.666 2.135 -0.982 1.00 . A A . 25 ASN N 1 1 4 1533 1 1 25 ASN ND2 N -23.887 2.309 -1.027 1.00 . A A . 25 ASN ND2 1 1 4 1534 1 1 25 ASN O O -21.528 3.562 1.263 1.00 . A A . 25 ASN O 1 1 4 1535 1 1 25 ASN OXT O -21.165 1.421 1.553 1.00 . A A . 25 ASN OXT 1 1 4 1536 1 1 25 ASN OD1 O -23.990 0.103 -0.653 1.00 . A A . 25 ASN OD1 1 1 5 1537 1 1 1 CYS C C 5.421 3.390 -6.010 1.00 . A A . 1 CYS C 1 1 5 1538 1 1 1 CYS CA C 3.915 3.145 -5.977 1.00 . A A . 1 CYS CA 1 1 5 1539 1 1 1 CYS CB C 3.470 2.754 -4.564 1.00 . A A . 1 CYS CB 1 1 5 1540 1 1 1 CYS H1 H 3.850 2.331 -7.896 1.00 . A A . 1 CYS H1 1 1 5 1541 1 1 1 CYS H2 H 2.522 1.924 -6.928 1.00 . A A . 1 CYS H2 1 1 5 1542 1 1 1 CYS H3 H 4.023 1.178 -6.661 1.00 . A A . 1 CYS H3 1 1 5 1543 1 1 1 CYS HA H 3.408 4.052 -6.276 1.00 . A A . 1 CYS HA 1 1 5 1544 1 1 1 CYS HB2 H 4.110 1.965 -4.196 1.00 . A A . 1 CYS HB2 1 1 5 1545 1 1 1 CYS HB3 H 3.557 3.614 -3.915 1.00 . A A . 1 CYS HB3 1 1 5 1546 1 1 1 CYS N N 3.552 2.072 -6.930 1.00 . A A . 1 CYS N 1 1 5 1547 1 1 1 CYS O O 6.197 2.491 -6.330 1.00 . A A . 1 CYS O 1 1 5 1548 1 1 1 CYS SG S 1.744 2.162 -4.478 1.00 . A A . 1 CYS SG 1 1 5 1549 1 1 2 SER C C 7.934 4.435 -4.437 1.00 . A A . 2 SER C 1 1 5 1550 1 1 2 SER CA C 7.252 4.958 -5.705 1.00 . A A . 2 SER CA 1 1 5 1551 1 1 2 SER CB C 7.425 6.477 -5.828 1.00 . A A . 2 SER CB 1 1 5 1552 1 1 2 SER H H 5.177 5.304 -5.481 1.00 . A A . 2 SER H 1 1 5 1553 1 1 2 SER HA H 7.704 4.480 -6.560 1.00 . A A . 2 SER HA 1 1 5 1554 1 1 2 SER HB2 H 6.876 6.827 -6.690 1.00 . A A . 2 SER HB2 1 1 5 1555 1 1 2 SER HB3 H 7.037 6.955 -4.938 1.00 . A A . 2 SER HB3 1 1 5 1556 1 1 2 SER HG H 8.897 7.339 -6.810 1.00 . A A . 2 SER HG 1 1 5 1557 1 1 2 SER N N 5.836 4.614 -5.702 1.00 . A A . 2 SER N 1 1 5 1558 1 1 2 SER O O 7.794 5.010 -3.355 1.00 . A A . 2 SER O 1 1 5 1559 1 1 2 SER OG O 8.790 6.838 -5.982 1.00 . A A . 2 SER OG 1 1 5 1560 1 1 3 CYS C C 10.771 3.236 -3.371 1.00 . A A . 3 CYS C 1 1 5 1561 1 1 3 CYS CA C 9.341 2.716 -3.450 1.00 . A A . 3 CYS CA 1 1 5 1562 1 1 3 CYS CB C 9.344 1.194 -3.604 1.00 . A A . 3 CYS CB 1 1 5 1563 1 1 3 CYS H H 8.707 2.900 -5.454 1.00 . A A . 3 CYS H 1 1 5 1564 1 1 3 CYS HA H 8.814 2.981 -2.544 1.00 . A A . 3 CYS HA 1 1 5 1565 1 1 3 CYS HB2 H 10.207 0.900 -4.183 1.00 . A A . 3 CYS HB2 1 1 5 1566 1 1 3 CYS HB3 H 9.401 0.740 -2.624 1.00 . A A . 3 CYS HB3 1 1 5 1567 1 1 3 CYS N N 8.649 3.326 -4.574 1.00 . A A . 3 CYS N 1 1 5 1568 1 1 3 CYS O O 11.655 2.757 -4.080 1.00 . A A . 3 CYS O 1 1 5 1569 1 1 3 CYS SG S 7.860 0.532 -4.438 1.00 . A A . 3 CYS SG 1 1 5 1570 1 1 4 THR C C 13.059 4.209 -1.220 1.00 . A A . 4 THR C 1 1 5 1571 1 1 4 THR CA C 12.302 4.837 -2.382 1.00 . A A . 4 THR CA 1 1 5 1572 1 1 4 THR CB C 12.190 6.347 -2.145 1.00 . A A . 4 THR CB 1 1 5 1573 1 1 4 THR CG2 C 13.532 7.031 -2.371 1.00 . A A . 4 THR CG2 1 1 5 1574 1 1 4 THR H H 10.253 4.566 -1.981 1.00 . A A . 4 THR H 1 1 5 1575 1 1 4 THR HA H 12.849 4.676 -3.290 1.00 . A A . 4 THR HA 1 1 5 1576 1 1 4 THR HB H 11.891 6.506 -1.128 1.00 . A A . 4 THR HB 1 1 5 1577 1 1 4 THR HG1 H 11.444 6.705 -3.942 1.00 . A A . 4 THR HG1 1 1 5 1578 1 1 4 THR HG21 H 14.260 6.632 -1.678 1.00 . A A . 4 THR HG21 1 1 5 1579 1 1 4 THR HG22 H 13.425 8.094 -2.209 1.00 . A A . 4 THR HG22 1 1 5 1580 1 1 4 THR HG23 H 13.863 6.852 -3.383 1.00 . A A . 4 THR HG23 1 1 5 1581 1 1 4 THR N N 10.990 4.231 -2.524 1.00 . A A . 4 THR N 1 1 5 1582 1 1 4 THR O O 12.665 4.363 -0.060 1.00 . A A . 4 THR O 1 1 5 1583 1 1 4 THR OG1 O 11.207 6.909 -3.023 1.00 . A A . 4 THR OG1 1 1 5 1584 1 1 5 ASP C C 14.132 1.840 0.254 1.00 . A A . 5 ASP C 1 1 5 1585 1 1 5 ASP CA C 14.971 2.826 -0.542 1.00 . A A . 5 ASP CA 1 1 5 1586 1 1 5 ASP CB C 15.622 3.850 0.398 1.00 . A A . 5 ASP CB 1 1 5 1587 1 1 5 ASP CG C 16.479 4.859 -0.336 1.00 . A A . 5 ASP CG 1 1 5 1588 1 1 5 ASP H H 14.365 3.398 -2.494 1.00 . A A . 5 ASP H 1 1 5 1589 1 1 5 ASP HA H 15.745 2.284 -1.063 1.00 . A A . 5 ASP HA 1 1 5 1590 1 1 5 ASP HB2 H 14.850 4.386 0.929 1.00 . A A . 5 ASP HB2 1 1 5 1591 1 1 5 ASP HB3 H 16.245 3.330 1.110 1.00 . A A . 5 ASP HB3 1 1 5 1592 1 1 5 ASP N N 14.133 3.491 -1.546 1.00 . A A . 5 ASP N 1 1 5 1593 1 1 5 ASP O O 14.263 1.723 1.473 1.00 . A A . 5 ASP O 1 1 5 1594 1 1 5 ASP OD1 O 17.511 4.461 -0.916 1.00 . A A . 5 ASP OD1 1 1 5 1595 1 1 5 ASP OD2 O 16.127 6.056 -0.336 1.00 . A A . 5 ASP OD2 1 1 5 1596 1 1 6 MET C C 11.918 -0.885 -0.748 1.00 . A A . 6 MET C 1 1 5 1597 1 1 6 MET CA C 12.261 0.294 0.155 1.00 . A A . 6 MET CA 1 1 5 1598 1 1 6 MET CB C 11.036 1.169 0.424 1.00 . A A . 6 MET CB 1 1 5 1599 1 1 6 MET CE C 8.501 2.796 0.226 1.00 . A A . 6 MET CE 1 1 5 1600 1 1 6 MET CG C 9.780 0.419 0.804 1.00 . A A . 6 MET CG 1 1 5 1601 1 1 6 MET H H 13.351 1.137 -1.440 1.00 . A A . 6 MET H 1 1 5 1602 1 1 6 MET HA H 12.645 -0.080 1.092 1.00 . A A . 6 MET HA 1 1 5 1603 1 1 6 MET HB2 H 11.269 1.852 1.224 1.00 . A A . 6 MET HB2 1 1 5 1604 1 1 6 MET HB3 H 10.825 1.739 -0.466 1.00 . A A . 6 MET HB3 1 1 5 1605 1 1 6 MET HE1 H 8.261 2.363 -0.733 1.00 . A A . 6 MET HE1 1 1 5 1606 1 1 6 MET HE2 H 9.475 3.260 0.180 1.00 . A A . 6 MET HE2 1 1 5 1607 1 1 6 MET HE3 H 7.759 3.538 0.483 1.00 . A A . 6 MET HE3 1 1 5 1608 1 1 6 MET HG2 H 9.387 -0.073 -0.076 1.00 . A A . 6 MET HG2 1 1 5 1609 1 1 6 MET HG3 H 10.026 -0.319 1.546 1.00 . A A . 6 MET HG3 1 1 5 1610 1 1 6 MET N N 13.283 1.119 -0.460 1.00 . A A . 6 MET N 1 1 5 1611 1 1 6 MET O O 11.921 -0.752 -1.969 1.00 . A A . 6 MET O 1 1 5 1612 1 1 6 MET SD S 8.513 1.511 1.470 1.00 . A A . 6 MET SD 1 1 5 1613 1 1 7 SER C C 9.930 -3.383 -1.266 1.00 . A A . 7 SER C 1 1 5 1614 1 1 7 SER CA C 11.400 -3.246 -0.895 1.00 . A A . 7 SER CA 1 1 5 1615 1 1 7 SER CB C 11.869 -4.449 -0.069 1.00 . A A . 7 SER CB 1 1 5 1616 1 1 7 SER H H 11.544 -2.062 0.820 1.00 . A A . 7 SER H 1 1 5 1617 1 1 7 SER HA H 11.985 -3.193 -1.799 1.00 . A A . 7 SER HA 1 1 5 1618 1 1 7 SER HB2 H 11.664 -5.359 -0.607 1.00 . A A . 7 SER HB2 1 1 5 1619 1 1 7 SER HB3 H 12.934 -4.366 0.104 1.00 . A A . 7 SER HB3 1 1 5 1620 1 1 7 SER HG H 11.581 -3.827 1.778 1.00 . A A . 7 SER HG 1 1 5 1621 1 1 7 SER N N 11.627 -2.032 -0.148 1.00 . A A . 7 SER N 1 1 5 1622 1 1 7 SER O O 9.131 -2.467 -1.052 1.00 . A A . 7 SER O 1 1 5 1623 1 1 7 SER OG O 11.206 -4.503 1.183 1.00 . A A . 7 SER OG 1 1 5 1624 1 1 8 ASP C C 7.207 -4.810 -1.209 1.00 . A A . 8 ASP C 1 1 5 1625 1 1 8 ASP CA C 8.245 -4.794 -2.319 1.00 . A A . 8 ASP CA 1 1 5 1626 1 1 8 ASP CB C 8.190 -6.122 -3.078 1.00 . A A . 8 ASP CB 1 1 5 1627 1 1 8 ASP CG C 8.933 -6.081 -4.397 1.00 . A A . 8 ASP CG 1 1 5 1628 1 1 8 ASP H H 10.256 -5.249 -1.821 1.00 . A A . 8 ASP H 1 1 5 1629 1 1 8 ASP HA H 8.005 -3.995 -3.001 1.00 . A A . 8 ASP HA 1 1 5 1630 1 1 8 ASP HB2 H 8.629 -6.898 -2.467 1.00 . A A . 8 ASP HB2 1 1 5 1631 1 1 8 ASP HB3 H 7.158 -6.370 -3.277 1.00 . A A . 8 ASP HB3 1 1 5 1632 1 1 8 ASP N N 9.587 -4.540 -1.794 1.00 . A A . 8 ASP N 1 1 5 1633 1 1 8 ASP O O 6.224 -4.070 -1.261 1.00 . A A . 8 ASP O 1 1 5 1634 1 1 8 ASP OD1 O 8.318 -5.720 -5.424 1.00 . A A . 8 ASP OD1 1 1 5 1635 1 1 8 ASP OD2 O 10.139 -6.402 -4.417 1.00 . A A . 8 ASP OD2 1 1 5 1636 1 1 9 LEU C C 6.288 -4.461 1.600 1.00 . A A . 9 LEU C 1 1 5 1637 1 1 9 LEU CA C 6.486 -5.793 0.899 1.00 . A A . 9 LEU CA 1 1 5 1638 1 1 9 LEU CB C 6.972 -6.846 1.901 1.00 . A A . 9 LEU CB 1 1 5 1639 1 1 9 LEU CD1 C 4.706 -7.684 2.590 1.00 . A A . 9 LEU CD1 1 1 5 1640 1 1 9 LEU CD2 C 6.675 -8.041 4.091 1.00 . A A . 9 LEU CD2 1 1 5 1641 1 1 9 LEU CG C 6.027 -7.107 3.079 1.00 . A A . 9 LEU CG 1 1 5 1642 1 1 9 LEU H H 8.262 -6.175 -0.190 1.00 . A A . 9 LEU H 1 1 5 1643 1 1 9 LEU HA H 5.542 -6.110 0.484 1.00 . A A . 9 LEU HA 1 1 5 1644 1 1 9 LEU HB2 H 7.117 -7.774 1.370 1.00 . A A . 9 LEU HB2 1 1 5 1645 1 1 9 LEU HB3 H 7.922 -6.522 2.296 1.00 . A A . 9 LEU HB3 1 1 5 1646 1 1 9 LEU HD11 H 4.262 -7.010 1.873 1.00 . A A . 9 LEU HD11 1 1 5 1647 1 1 9 LEU HD12 H 4.036 -7.810 3.429 1.00 . A A . 9 LEU HD12 1 1 5 1648 1 1 9 LEU HD13 H 4.881 -8.642 2.121 1.00 . A A . 9 LEU HD13 1 1 5 1649 1 1 9 LEU HD21 H 7.562 -7.577 4.494 1.00 . A A . 9 LEU HD21 1 1 5 1650 1 1 9 LEU HD22 H 6.941 -8.967 3.609 1.00 . A A . 9 LEU HD22 1 1 5 1651 1 1 9 LEU HD23 H 5.978 -8.240 4.893 1.00 . A A . 9 LEU HD23 1 1 5 1652 1 1 9 LEU HG H 5.818 -6.170 3.575 1.00 . A A . 9 LEU HG 1 1 5 1653 1 1 9 LEU N N 7.433 -5.645 -0.198 1.00 . A A . 9 LEU N 1 1 5 1654 1 1 9 LEU O O 5.159 -4.037 1.840 1.00 . A A . 9 LEU O 1 1 5 1655 1 1 10 GLU C C 6.586 -1.495 1.704 1.00 . A A . 10 GLU C 1 1 5 1656 1 1 10 GLU CA C 7.385 -2.501 2.524 1.00 . A A . 10 GLU CA 1 1 5 1657 1 1 10 GLU CB C 8.817 -2.028 2.652 1.00 . A A . 10 GLU CB 1 1 5 1658 1 1 10 GLU CD C 11.065 -2.277 3.727 1.00 . A A . 10 GLU CD 1 1 5 1659 1 1 10 GLU CG C 9.653 -2.812 3.639 1.00 . A A . 10 GLU CG 1 1 5 1660 1 1 10 GLU H H 8.263 -4.180 1.666 1.00 . A A . 10 GLU H 1 1 5 1661 1 1 10 GLU HA H 6.949 -2.600 3.506 1.00 . A A . 10 GLU HA 1 1 5 1662 1 1 10 GLU HB2 H 9.290 -2.100 1.685 1.00 . A A . 10 GLU HB2 1 1 5 1663 1 1 10 GLU HB3 H 8.809 -1.011 2.951 1.00 . A A . 10 GLU HB3 1 1 5 1664 1 1 10 GLU HG2 H 9.197 -2.746 4.613 1.00 . A A . 10 GLU HG2 1 1 5 1665 1 1 10 GLU HG3 H 9.691 -3.843 3.323 1.00 . A A . 10 GLU HG3 1 1 5 1666 1 1 10 GLU N N 7.398 -3.794 1.891 1.00 . A A . 10 GLU N 1 1 5 1667 1 1 10 GLU O O 5.792 -0.726 2.245 1.00 . A A . 10 GLU O 1 1 5 1668 1 1 10 GLU OE1 O 11.879 -2.601 2.838 1.00 . A A . 10 GLU OE1 1 1 5 1669 1 1 10 GLU OE2 O 11.359 -1.517 4.671 1.00 . A A . 10 GLU OE2 1 1 5 1670 1 1 11 CYS C C 4.649 -0.841 -0.562 1.00 . A A . 11 CYS C 1 1 5 1671 1 1 11 CYS CA C 6.152 -0.587 -0.520 1.00 . A A . 11 CYS CA 1 1 5 1672 1 1 11 CYS CB C 6.755 -0.726 -1.920 1.00 . A A . 11 CYS CB 1 1 5 1673 1 1 11 CYS H H 7.438 -2.173 0.029 1.00 . A A . 11 CYS H 1 1 5 1674 1 1 11 CYS HA H 6.324 0.413 -0.159 1.00 . A A . 11 CYS HA 1 1 5 1675 1 1 11 CYS HB2 H 7.829 -0.799 -1.832 1.00 . A A . 11 CYS HB2 1 1 5 1676 1 1 11 CYS HB3 H 6.377 -1.628 -2.380 1.00 . A A . 11 CYS HB3 1 1 5 1677 1 1 11 CYS N N 6.806 -1.515 0.394 1.00 . A A . 11 CYS N 1 1 5 1678 1 1 11 CYS O O 3.845 0.094 -0.560 1.00 . A A . 11 CYS O 1 1 5 1679 1 1 11 CYS SG S 6.393 0.662 -3.043 1.00 . A A . 11 CYS SG 1 1 5 1680 1 1 12 MET C C 2.235 -2.092 0.743 1.00 . A A . 12 MET C 1 1 5 1681 1 1 12 MET CA C 2.866 -2.477 -0.580 1.00 . A A . 12 MET CA 1 1 5 1682 1 1 12 MET CB C 2.684 -3.972 -0.842 1.00 . A A . 12 MET CB 1 1 5 1683 1 1 12 MET CE C 3.738 -6.963 -1.316 1.00 . A A . 12 MET CE 1 1 5 1684 1 1 12 MET CG C 3.154 -4.405 -2.220 1.00 . A A . 12 MET CG 1 1 5 1685 1 1 12 MET H H 4.954 -2.818 -0.610 1.00 . A A . 12 MET H 1 1 5 1686 1 1 12 MET HA H 2.373 -1.920 -1.363 1.00 . A A . 12 MET HA 1 1 5 1687 1 1 12 MET HB2 H 3.243 -4.527 -0.102 1.00 . A A . 12 MET HB2 1 1 5 1688 1 1 12 MET HB3 H 1.637 -4.216 -0.749 1.00 . A A . 12 MET HB3 1 1 5 1689 1 1 12 MET HE1 H 3.408 -6.639 -0.341 1.00 . A A . 12 MET HE1 1 1 5 1690 1 1 12 MET HE2 H 4.782 -6.723 -1.443 1.00 . A A . 12 MET HE2 1 1 5 1691 1 1 12 MET HE3 H 3.601 -8.032 -1.403 1.00 . A A . 12 MET HE3 1 1 5 1692 1 1 12 MET HG2 H 2.671 -3.786 -2.961 1.00 . A A . 12 MET HG2 1 1 5 1693 1 1 12 MET HG3 H 4.224 -4.264 -2.279 1.00 . A A . 12 MET HG3 1 1 5 1694 1 1 12 MET N N 4.271 -2.111 -0.587 1.00 . A A . 12 MET N 1 1 5 1695 1 1 12 MET O O 1.085 -1.671 0.782 1.00 . A A . 12 MET O 1 1 5 1696 1 1 12 MET SD S 2.776 -6.133 -2.579 1.00 . A A . 12 MET SD 1 1 5 1697 1 1 13 ASN C C 2.169 -0.345 3.171 1.00 . A A . 13 ASN C 1 1 5 1698 1 1 13 ASN CA C 2.520 -1.824 3.142 1.00 . A A . 13 ASN CA 1 1 5 1699 1 1 13 ASN CB C 3.554 -2.131 4.233 1.00 . A A . 13 ASN CB 1 1 5 1700 1 1 13 ASN CG C 3.679 -3.612 4.538 1.00 . A A . 13 ASN CG 1 1 5 1701 1 1 13 ASN H H 3.899 -2.601 1.734 1.00 . A A . 13 ASN H 1 1 5 1702 1 1 13 ASN HA H 1.624 -2.389 3.344 1.00 . A A . 13 ASN HA 1 1 5 1703 1 1 13 ASN HB2 H 4.520 -1.770 3.913 1.00 . A A . 13 ASN HB2 1 1 5 1704 1 1 13 ASN HB3 H 3.270 -1.617 5.141 1.00 . A A . 13 ASN HB3 1 1 5 1705 1 1 13 ASN HD21 H 5.545 -3.353 5.171 1.00 . A A . 13 ASN HD21 1 1 5 1706 1 1 13 ASN HD22 H 4.944 -4.970 5.237 1.00 . A A . 13 ASN HD22 1 1 5 1707 1 1 13 ASN N N 2.996 -2.220 1.824 1.00 . A A . 13 ASN N 1 1 5 1708 1 1 13 ASN ND2 N 4.840 -4.021 5.030 1.00 . A A . 13 ASN ND2 1 1 5 1709 1 1 13 ASN O O 1.009 0.015 3.333 1.00 . A A . 13 ASN O 1 1 5 1710 1 1 13 ASN OD1 O 2.738 -4.381 4.352 1.00 . A A . 13 ASN OD1 1 1 5 1711 1 1 14 PHE C C 1.956 2.509 2.150 1.00 . A A . 14 PHE C 1 1 5 1712 1 1 14 PHE CA C 2.973 1.954 3.146 1.00 . A A . 14 PHE CA 1 1 5 1713 1 1 14 PHE CB C 4.314 2.707 3.036 1.00 . A A . 14 PHE CB 1 1 5 1714 1 1 14 PHE CD1 C 5.004 2.579 0.620 1.00 . A A . 14 PHE CD1 1 1 5 1715 1 1 14 PHE CD2 C 4.389 4.704 1.506 1.00 . A A . 14 PHE CD2 1 1 5 1716 1 1 14 PHE CE1 C 5.245 3.159 -0.612 1.00 . A A . 14 PHE CE1 1 1 5 1717 1 1 14 PHE CE2 C 4.631 5.289 0.278 1.00 . A A . 14 PHE CE2 1 1 5 1718 1 1 14 PHE CG C 4.574 3.346 1.695 1.00 . A A . 14 PHE CG 1 1 5 1719 1 1 14 PHE CZ C 5.047 4.532 -0.780 1.00 . A A . 14 PHE CZ 1 1 5 1720 1 1 14 PHE H H 4.047 0.175 2.704 1.00 . A A . 14 PHE H 1 1 5 1721 1 1 14 PHE HA H 2.579 2.104 4.141 1.00 . A A . 14 PHE HA 1 1 5 1722 1 1 14 PHE HB2 H 4.336 3.490 3.777 1.00 . A A . 14 PHE HB2 1 1 5 1723 1 1 14 PHE HB3 H 5.121 2.016 3.234 1.00 . A A . 14 PHE HB3 1 1 5 1724 1 1 14 PHE HD1 H 5.148 1.517 0.753 1.00 . A A . 14 PHE HD1 1 1 5 1725 1 1 14 PHE HD2 H 4.056 5.311 2.335 1.00 . A A . 14 PHE HD2 1 1 5 1726 1 1 14 PHE HE1 H 5.581 2.552 -1.438 1.00 . A A . 14 PHE HE1 1 1 5 1727 1 1 14 PHE HE2 H 4.481 6.350 0.148 1.00 . A A . 14 PHE HE2 1 1 5 1728 1 1 14 PHE HZ H 5.231 4.988 -1.742 1.00 . A A . 14 PHE HZ 1 1 5 1729 1 1 14 PHE N N 3.165 0.515 2.973 1.00 . A A . 14 PHE N 1 1 5 1730 1 1 14 PHE O O 1.255 3.474 2.444 1.00 . A A . 14 PHE O 1 1 5 1731 1 1 15 CYS C C -0.433 1.873 0.071 1.00 . A A . 15 CYS C 1 1 5 1732 1 1 15 CYS CA C 1.000 2.400 -0.070 1.00 . A A . 15 CYS CA 1 1 5 1733 1 1 15 CYS CB C 1.581 2.030 -1.439 1.00 . A A . 15 CYS CB 1 1 5 1734 1 1 15 CYS H H 2.390 1.076 0.825 1.00 . A A . 15 CYS H 1 1 5 1735 1 1 15 CYS HA H 0.981 3.475 0.019 1.00 . A A . 15 CYS HA 1 1 5 1736 1 1 15 CYS HB2 H 2.654 2.142 -1.405 1.00 . A A . 15 CYS HB2 1 1 5 1737 1 1 15 CYS HB3 H 1.343 0.998 -1.652 1.00 . A A . 15 CYS HB3 1 1 5 1738 1 1 15 CYS N N 1.859 1.886 0.985 1.00 . A A . 15 CYS N 1 1 5 1739 1 1 15 CYS O O -1.390 2.540 -0.315 1.00 . A A . 15 CYS O 1 1 5 1740 1 1 15 CYS SG S 0.964 3.047 -2.824 1.00 . A A . 15 CYS SG 1 1 5 1741 1 1 16 HIS C C -2.466 0.194 2.188 1.00 . A A . 16 HIS C 1 1 5 1742 1 1 16 HIS CA C -1.907 0.066 0.773 1.00 . A A . 16 HIS CA 1 1 5 1743 1 1 16 HIS CB C -1.846 -1.418 0.391 1.00 . A A . 16 HIS CB 1 1 5 1744 1 1 16 HIS CD2 C -1.436 -1.027 -2.157 1.00 . A A . 16 HIS CD2 1 1 5 1745 1 1 16 HIS CE1 C -2.529 -2.770 -2.911 1.00 . A A . 16 HIS CE1 1 1 5 1746 1 1 16 HIS CG C -1.936 -1.692 -1.085 1.00 . A A . 16 HIS CG 1 1 5 1747 1 1 16 HIS H H 0.201 0.215 0.998 1.00 . A A . 16 HIS H 1 1 5 1748 1 1 16 HIS HA H -2.575 0.571 0.093 1.00 . A A . 16 HIS HA 1 1 5 1749 1 1 16 HIS HB2 H -0.910 -1.831 0.744 1.00 . A A . 16 HIS HB2 1 1 5 1750 1 1 16 HIS HB3 H -2.663 -1.936 0.876 1.00 . A A . 16 HIS HB3 1 1 5 1751 1 1 16 HIS HD1 H -3.078 -3.464 -1.062 1.00 . A A . 16 HIS HD1 1 1 5 1752 1 1 16 HIS HD2 H -0.848 -0.121 -2.134 1.00 . A A . 16 HIS HD2 1 1 5 1753 1 1 16 HIS HE1 H -2.965 -3.504 -3.574 1.00 . A A . 16 HIS HE1 1 1 5 1754 1 1 16 HIS HE2 H -1.717 -1.411 -4.212 1.00 . A A . 16 HIS HE2 1 1 5 1755 1 1 16 HIS N N -0.587 0.686 0.645 1.00 . A A . 16 HIS N 1 1 5 1756 1 1 16 HIS ND1 N -2.613 -2.776 -1.594 1.00 . A A . 16 HIS ND1 1 1 5 1757 1 1 16 HIS NE2 N -1.824 -1.721 -3.278 1.00 . A A . 16 HIS NE2 1 1 5 1758 1 1 16 HIS O O -3.613 -0.170 2.435 1.00 . A A . 16 HIS O 1 1 5 1759 1 1 17 LYS C C -3.174 1.679 4.861 1.00 . A A . 17 LYS C 1 1 5 1760 1 1 17 LYS CA C -2.037 0.734 4.532 1.00 . A A . 17 LYS CA 1 1 5 1761 1 1 17 LYS CB C -0.826 1.056 5.412 1.00 . A A . 17 LYS CB 1 1 5 1762 1 1 17 LYS CD C 0.931 2.724 6.080 1.00 . A A . 17 LYS CD 1 1 5 1763 1 1 17 LYS CE C 1.448 4.140 5.888 1.00 . A A . 17 LYS CE 1 1 5 1764 1 1 17 LYS CG C -0.290 2.460 5.214 1.00 . A A . 17 LYS CG 1 1 5 1765 1 1 17 LYS H H -0.804 1.108 2.834 1.00 . A A . 17 LYS H 1 1 5 1766 1 1 17 LYS HA H -2.376 -0.241 4.764 1.00 . A A . 17 LYS HA 1 1 5 1767 1 1 17 LYS HB2 H -1.108 0.944 6.449 1.00 . A A . 17 LYS HB2 1 1 5 1768 1 1 17 LYS HB3 H -0.035 0.355 5.184 1.00 . A A . 17 LYS HB3 1 1 5 1769 1 1 17 LYS HD2 H 0.664 2.584 7.117 1.00 . A A . 17 LYS HD2 1 1 5 1770 1 1 17 LYS HD3 H 1.710 2.025 5.807 1.00 . A A . 17 LYS HD3 1 1 5 1771 1 1 17 LYS HE2 H 2.363 4.256 6.450 1.00 . A A . 17 LYS HE2 1 1 5 1772 1 1 17 LYS HE3 H 1.648 4.293 4.840 1.00 . A A . 17 LYS HE3 1 1 5 1773 1 1 17 LYS HG2 H -0.017 2.586 4.176 1.00 . A A . 17 LYS HG2 1 1 5 1774 1 1 17 LYS HG3 H -1.065 3.166 5.474 1.00 . A A . 17 LYS HG3 1 1 5 1775 1 1 17 LYS HZ1 H 0.306 5.071 7.373 1.00 . A A . 17 LYS HZ1 1 1 5 1776 1 1 17 LYS HZ2 H -0.448 5.030 5.855 1.00 . A A . 17 LYS HZ2 1 1 5 1777 1 1 17 LYS HZ3 H 0.822 6.119 6.144 1.00 . A A . 17 LYS HZ3 1 1 5 1778 1 1 17 LYS N N -1.671 0.730 3.108 1.00 . A A . 17 LYS N 1 1 5 1779 1 1 17 LYS NZ N 0.466 5.160 6.347 1.00 . A A . 17 LYS NZ 1 1 5 1780 1 1 17 LYS O O -3.693 1.666 5.979 1.00 . A A . 17 LYS O 1 1 5 1781 1 1 18 ASP C C -5.596 3.459 2.929 1.00 . A A . 18 ASP C 1 1 5 1782 1 1 18 ASP CA C -4.659 3.415 4.114 1.00 . A A . 18 ASP CA 1 1 5 1783 1 1 18 ASP CB C -4.133 4.824 4.364 1.00 . A A . 18 ASP CB 1 1 5 1784 1 1 18 ASP CG C -3.156 4.931 5.516 1.00 . A A . 18 ASP CG 1 1 5 1785 1 1 18 ASP H H -3.134 2.414 3.033 1.00 . A A . 18 ASP H 1 1 5 1786 1 1 18 ASP HA H -5.217 3.087 4.966 1.00 . A A . 18 ASP HA 1 1 5 1787 1 1 18 ASP HB2 H -3.642 5.179 3.473 1.00 . A A . 18 ASP HB2 1 1 5 1788 1 1 18 ASP HB3 H -4.969 5.453 4.578 1.00 . A A . 18 ASP HB3 1 1 5 1789 1 1 18 ASP N N -3.573 2.471 3.899 1.00 . A A . 18 ASP N 1 1 5 1790 1 1 18 ASP O O -6.659 4.075 2.990 1.00 . A A . 18 ASP O 1 1 5 1791 1 1 18 ASP OD1 O -3.596 4.929 6.684 1.00 . A A . 18 ASP OD1 1 1 5 1792 1 1 18 ASP OD2 O -1.938 5.052 5.259 1.00 . A A . 18 ASP OD2 1 1 5 1793 1 1 19 VAL C C -6.057 4.337 0.189 1.00 . A A . 19 VAL C 1 1 5 1794 1 1 19 VAL CA C -5.906 2.869 0.598 1.00 . A A . 19 VAL CA 1 1 5 1795 1 1 19 VAL CB C -7.279 2.159 0.658 1.00 . A A . 19 VAL CB 1 1 5 1796 1 1 19 VAL CG1 C -8.005 2.227 -0.674 1.00 . A A . 19 VAL CG1 1 1 5 1797 1 1 19 VAL CG2 C -7.098 0.712 1.080 1.00 . A A . 19 VAL CG2 1 1 5 1798 1 1 19 VAL H H -4.444 2.180 1.952 1.00 . A A . 19 VAL H 1 1 5 1799 1 1 19 VAL HA H -5.299 2.372 -0.143 1.00 . A A . 19 VAL HA 1 1 5 1800 1 1 19 VAL HB H -7.882 2.654 1.400 1.00 . A A . 19 VAL HB 1 1 5 1801 1 1 19 VAL HG11 H -7.390 1.786 -1.443 1.00 . A A . 19 VAL HG11 1 1 5 1802 1 1 19 VAL HG12 H -8.202 3.261 -0.918 1.00 . A A . 19 VAL HG12 1 1 5 1803 1 1 19 VAL HG13 H -8.938 1.690 -0.603 1.00 . A A . 19 VAL HG13 1 1 5 1804 1 1 19 VAL HG21 H -6.620 0.677 2.046 1.00 . A A . 19 VAL HG21 1 1 5 1805 1 1 19 VAL HG22 H -6.479 0.203 0.351 1.00 . A A . 19 VAL HG22 1 1 5 1806 1 1 19 VAL HG23 H -8.061 0.229 1.134 1.00 . A A . 19 VAL HG23 1 1 5 1807 1 1 19 VAL N N -5.205 2.780 1.868 1.00 . A A . 19 VAL N 1 1 5 1808 1 1 19 VAL O O -7.155 4.869 0.040 1.00 . A A . 19 VAL O 1 1 5 1809 1 1 20 ILE C C -5.251 6.427 -1.895 1.00 . A A . 20 ILE C 1 1 5 1810 1 1 20 ILE CA C -4.884 6.378 -0.414 1.00 . A A . 20 ILE CA 1 1 5 1811 1 1 20 ILE CB C -3.495 7.012 -0.178 1.00 . A A . 20 ILE CB 1 1 5 1812 1 1 20 ILE CD1 C -4.484 9.283 0.416 1.00 . A A . 20 ILE CD1 1 1 5 1813 1 1 20 ILE CG1 C -3.527 8.514 -0.470 1.00 . A A . 20 ILE CG1 1 1 5 1814 1 1 20 ILE CG2 C -2.438 6.327 -1.025 1.00 . A A . 20 ILE CG2 1 1 5 1815 1 1 20 ILE H H -4.081 4.542 0.263 1.00 . A A . 20 ILE H 1 1 5 1816 1 1 20 ILE HA H -5.611 6.938 0.146 1.00 . A A . 20 ILE HA 1 1 5 1817 1 1 20 ILE HB H -3.232 6.864 0.858 1.00 . A A . 20 ILE HB 1 1 5 1818 1 1 20 ILE HD11 H -5.487 8.905 0.277 1.00 . A A . 20 ILE HD11 1 1 5 1819 1 1 20 ILE HD12 H -4.454 10.330 0.156 1.00 . A A . 20 ILE HD12 1 1 5 1820 1 1 20 ILE HD13 H -4.195 9.161 1.449 1.00 . A A . 20 ILE HD13 1 1 5 1821 1 1 20 ILE HG12 H -2.544 8.920 -0.321 1.00 . A A . 20 ILE HG12 1 1 5 1822 1 1 20 ILE HG13 H -3.826 8.670 -1.497 1.00 . A A . 20 ILE HG13 1 1 5 1823 1 1 20 ILE HG21 H -2.695 6.435 -2.067 1.00 . A A . 20 ILE HG21 1 1 5 1824 1 1 20 ILE HG22 H -2.399 5.279 -0.770 1.00 . A A . 20 ILE HG22 1 1 5 1825 1 1 20 ILE HG23 H -1.476 6.782 -0.841 1.00 . A A . 20 ILE HG23 1 1 5 1826 1 1 20 ILE N N -4.919 4.995 0.045 1.00 . A A . 20 ILE N 1 1 5 1827 1 1 20 ILE O O -5.646 7.461 -2.430 1.00 . A A . 20 ILE O 1 1 5 1828 1 1 21 TRP C C -6.943 4.807 -4.148 1.00 . A A . 21 TRP C 1 1 5 1829 1 1 21 TRP CA C -5.470 5.106 -3.937 1.00 . A A . 21 TRP CA 1 1 5 1830 1 1 21 TRP CB C -4.616 3.978 -4.510 1.00 . A A . 21 TRP CB 1 1 5 1831 1 1 21 TRP CD1 C -3.454 2.642 -2.666 1.00 . A A . 21 TRP CD1 1 1 5 1832 1 1 21 TRP CD2 C -5.326 1.679 -3.423 1.00 . A A . 21 TRP CD2 1 1 5 1833 1 1 21 TRP CE2 C -4.773 0.864 -2.416 1.00 . A A . 21 TRP CE2 1 1 5 1834 1 1 21 TRP CE3 C -6.510 1.265 -4.042 1.00 . A A . 21 TRP CE3 1 1 5 1835 1 1 21 TRP CG C -4.459 2.817 -3.568 1.00 . A A . 21 TRP CG 1 1 5 1836 1 1 21 TRP CH2 C -6.520 -0.711 -2.642 1.00 . A A . 21 TRP CH2 1 1 5 1837 1 1 21 TRP CZ2 C -5.364 -0.332 -2.017 1.00 . A A . 21 TRP CZ2 1 1 5 1838 1 1 21 TRP CZ3 C -7.093 0.076 -3.646 1.00 . A A . 21 TRP CZ3 1 1 5 1839 1 1 21 TRP H H -4.891 4.477 -2.015 1.00 . A A . 21 TRP H 1 1 5 1840 1 1 21 TRP HA H -5.228 6.026 -4.437 1.00 . A A . 21 TRP HA 1 1 5 1841 1 1 21 TRP HB2 H -5.068 3.614 -5.419 1.00 . A A . 21 TRP HB2 1 1 5 1842 1 1 21 TRP HB3 H -3.635 4.365 -4.725 1.00 . A A . 21 TRP HB3 1 1 5 1843 1 1 21 TRP HD1 H -2.640 3.334 -2.524 1.00 . A A . 21 TRP HD1 1 1 5 1844 1 1 21 TRP HE1 H -3.044 1.144 -1.267 1.00 . A A . 21 TRP HE1 1 1 5 1845 1 1 21 TRP HE3 H -6.968 1.856 -4.814 1.00 . A A . 21 TRP HE3 1 1 5 1846 1 1 21 TRP HH2 H -7.008 -1.633 -2.367 1.00 . A A . 21 TRP HH2 1 1 5 1847 1 1 21 TRP HZ2 H -4.932 -0.951 -1.246 1.00 . A A . 21 TRP HZ2 1 1 5 1848 1 1 21 TRP HZ3 H -8.006 -0.259 -4.119 1.00 . A A . 21 TRP HZ3 1 1 5 1849 1 1 21 TRP N N -5.165 5.266 -2.525 1.00 . A A . 21 TRP N 1 1 5 1850 1 1 21 TRP NE1 N -3.637 1.480 -1.968 1.00 . A A . 21 TRP NE1 1 1 5 1851 1 1 21 TRP O O -7.338 4.255 -5.175 1.00 . A A . 21 TRP O 1 1 5 1852 1 1 22 VAL C C -9.830 5.653 -4.398 1.00 . A A . 22 VAL C 1 1 5 1853 1 1 22 VAL CA C -9.171 4.970 -3.194 1.00 . A A . 22 VAL CA 1 1 5 1854 1 1 22 VAL CB C -9.822 5.439 -1.872 1.00 . A A . 22 VAL CB 1 1 5 1855 1 1 22 VAL CG1 C -9.407 6.866 -1.549 1.00 . A A . 22 VAL CG1 1 1 5 1856 1 1 22 VAL CG2 C -11.340 5.313 -1.933 1.00 . A A . 22 VAL CG2 1 1 5 1857 1 1 22 VAL H H -7.343 5.687 -2.422 1.00 . A A . 22 VAL H 1 1 5 1858 1 1 22 VAL HA H -9.323 3.904 -3.280 1.00 . A A . 22 VAL HA 1 1 5 1859 1 1 22 VAL HB H -9.465 4.800 -1.075 1.00 . A A . 22 VAL HB 1 1 5 1860 1 1 22 VAL HG11 H -9.836 7.165 -0.606 1.00 . A A . 22 VAL HG11 1 1 5 1861 1 1 22 VAL HG12 H -9.755 7.527 -2.332 1.00 . A A . 22 VAL HG12 1 1 5 1862 1 1 22 VAL HG13 H -8.328 6.919 -1.491 1.00 . A A . 22 VAL HG13 1 1 5 1863 1 1 22 VAL HG21 H -11.766 5.615 -0.988 1.00 . A A . 22 VAL HG21 1 1 5 1864 1 1 22 VAL HG22 H -11.605 4.286 -2.137 1.00 . A A . 22 VAL HG22 1 1 5 1865 1 1 22 VAL HG23 H -11.721 5.948 -2.719 1.00 . A A . 22 VAL HG23 1 1 5 1866 1 1 22 VAL N N -7.738 5.206 -3.177 1.00 . A A . 22 VAL N 1 1 5 1867 1 1 22 VAL O O -10.115 6.853 -4.392 1.00 . A A . 22 VAL O 1 1 5 1868 1 1 23 ASN C C -11.743 4.331 -7.058 1.00 . A A . 23 ASN C 1 1 5 1869 1 1 23 ASN CA C -10.705 5.352 -6.639 1.00 . A A . 23 ASN CA 1 1 5 1870 1 1 23 ASN CB C -9.726 5.630 -7.780 1.00 . A A . 23 ASN CB 1 1 5 1871 1 1 23 ASN CG C -8.891 6.873 -7.536 1.00 . A A . 23 ASN CG 1 1 5 1872 1 1 23 ASN H H -9.665 3.967 -5.438 1.00 . A A . 23 ASN H 1 1 5 1873 1 1 23 ASN HA H -11.212 6.270 -6.380 1.00 . A A . 23 ASN HA 1 1 5 1874 1 1 23 ASN HB2 H -9.062 4.785 -7.888 1.00 . A A . 23 ASN HB2 1 1 5 1875 1 1 23 ASN HB3 H -10.282 5.766 -8.693 1.00 . A A . 23 ASN HB3 1 1 5 1876 1 1 23 ASN HD21 H -7.442 5.786 -6.722 1.00 . A A . 23 ASN HD21 1 1 5 1877 1 1 23 ASN HD22 H -7.157 7.492 -6.797 1.00 . A A . 23 ASN HD22 1 1 5 1878 1 1 23 ASN N N -10.015 4.882 -5.453 1.00 . A A . 23 ASN N 1 1 5 1879 1 1 23 ASN ND2 N -7.712 6.699 -6.960 1.00 . A A . 23 ASN ND2 1 1 5 1880 1 1 23 ASN O O -11.419 3.280 -7.616 1.00 . A A . 23 ASN O 1 1 5 1881 1 1 23 ASN OD1 O -9.306 7.983 -7.865 1.00 . A A . 23 ASN OD1 1 1 5 1882 1 1 24 ARG C C -15.413 4.480 -6.799 1.00 . A A . 24 ARG C 1 1 5 1883 1 1 24 ARG CA C -14.102 3.726 -6.946 1.00 . A A . 24 ARG CA 1 1 5 1884 1 1 24 ARG CB C -14.013 2.552 -5.948 1.00 . A A . 24 ARG CB 1 1 5 1885 1 1 24 ARG CD C -14.681 3.468 -3.673 1.00 . A A . 24 ARG CD 1 1 5 1886 1 1 24 ARG CG C -13.548 2.942 -4.543 1.00 . A A . 24 ARG CG 1 1 5 1887 1 1 24 ARG CZ C -16.830 2.620 -2.806 1.00 . A A . 24 ARG CZ 1 1 5 1888 1 1 24 ARG H H -13.176 5.547 -6.421 1.00 . A A . 24 ARG H 1 1 5 1889 1 1 24 ARG HA H -14.040 3.340 -7.951 1.00 . A A . 24 ARG HA 1 1 5 1890 1 1 24 ARG HB2 H -14.990 2.099 -5.863 1.00 . A A . 24 ARG HB2 1 1 5 1891 1 1 24 ARG HB3 H -13.324 1.818 -6.339 1.00 . A A . 24 ARG HB3 1 1 5 1892 1 1 24 ARG HD2 H -14.258 3.915 -2.786 1.00 . A A . 24 ARG HD2 1 1 5 1893 1 1 24 ARG HD3 H -15.225 4.217 -4.229 1.00 . A A . 24 ARG HD3 1 1 5 1894 1 1 24 ARG HE H -15.275 1.481 -3.352 1.00 . A A . 24 ARG HE 1 1 5 1895 1 1 24 ARG HG2 H -13.124 2.074 -4.066 1.00 . A A . 24 ARG HG2 1 1 5 1896 1 1 24 ARG HG3 H -12.791 3.709 -4.631 1.00 . A A . 24 ARG HG3 1 1 5 1897 1 1 24 ARG HH11 H -16.770 4.647 -3.011 1.00 . A A . 24 ARG HH11 1 1 5 1898 1 1 24 ARG HH12 H -18.260 4.003 -2.376 1.00 . A A . 24 ARG HH12 1 1 5 1899 1 1 24 ARG HH21 H -17.202 0.650 -2.492 1.00 . A A . 24 ARG HH21 1 1 5 1900 1 1 24 ARG HH22 H -18.499 1.731 -2.061 1.00 . A A . 24 ARG HH22 1 1 5 1901 1 1 24 ARG N N -12.990 4.646 -6.756 1.00 . A A . 24 ARG N 1 1 5 1902 1 1 24 ARG NE N -15.600 2.409 -3.277 1.00 . A A . 24 ARG NE 1 1 5 1903 1 1 24 ARG NH1 N -17.321 3.854 -2.721 1.00 . A A . 24 ARG NH1 1 1 5 1904 1 1 24 ARG NH2 N -17.568 1.587 -2.425 1.00 . A A . 24 ARG NH2 1 1 5 1905 1 1 24 ARG O O -16.388 4.197 -7.492 1.00 . A A . 24 ARG O 1 1 5 1906 1 1 25 ASN C C -16.236 7.069 -4.319 1.00 . A A . 25 ASN C 1 1 5 1907 1 1 25 ASN CA C -16.502 6.362 -5.635 1.00 . A A . 25 ASN CA 1 1 5 1908 1 1 25 ASN CB C -17.861 5.650 -5.567 1.00 . A A . 25 ASN CB 1 1 5 1909 1 1 25 ASN CG C -19.012 6.637 -5.502 1.00 . A A . 25 ASN CG 1 1 5 1910 1 1 25 ASN H H -14.584 5.555 -5.352 1.00 . A A . 25 ASN H 1 1 5 1911 1 1 25 ASN HA H -16.519 7.094 -6.430 1.00 . A A . 25 ASN HA 1 1 5 1912 1 1 25 ASN HB2 H -17.986 5.034 -6.445 1.00 . A A . 25 ASN HB2 1 1 5 1913 1 1 25 ASN HB3 H -17.893 5.027 -4.685 1.00 . A A . 25 ASN HB3 1 1 5 1914 1 1 25 ASN HD21 H -19.091 6.700 -7.486 1.00 . A A . 25 ASN HD21 1 1 5 1915 1 1 25 ASN HD22 H -20.223 7.718 -6.656 1.00 . A A . 25 ASN HD22 1 1 5 1916 1 1 25 ASN N N -15.392 5.448 -5.889 1.00 . A A . 25 ASN N 1 1 5 1917 1 1 25 ASN ND2 N -19.494 7.053 -6.663 1.00 . A A . 25 ASN ND2 1 1 5 1918 1 1 25 ASN O O -16.460 6.446 -3.262 1.00 . A A . 25 ASN O 1 1 5 1919 1 1 25 ASN OXT O -15.758 8.221 -4.343 1.00 . A A . 25 ASN OXT 1 1 5 1920 1 1 25 ASN OD1 O -19.463 7.021 -4.424 1.00 . A A . 25 ASN OD1 1 1 6 1921 1 1 1 CYS C C 4.787 3.892 -5.284 1.00 . A A . 1 CYS C 1 1 6 1922 1 1 1 CYS CA C 3.355 3.643 -4.830 1.00 . A A . 1 CYS CA 1 1 6 1923 1 1 1 CYS CB C 3.085 2.139 -4.751 1.00 . A A . 1 CYS CB 1 1 6 1924 1 1 1 CYS H1 H 2.534 5.317 -5.742 1.00 . A A . 1 CYS H1 1 1 6 1925 1 1 1 CYS H2 H 1.419 4.071 -5.462 1.00 . A A . 1 CYS H2 1 1 6 1926 1 1 1 CYS H3 H 2.549 3.937 -6.725 1.00 . A A . 1 CYS H3 1 1 6 1927 1 1 1 CYS HA H 3.219 4.075 -3.849 1.00 . A A . 1 CYS HA 1 1 6 1928 1 1 1 CYS HB2 H 3.156 1.714 -5.741 1.00 . A A . 1 CYS HB2 1 1 6 1929 1 1 1 CYS HB3 H 3.826 1.682 -4.113 1.00 . A A . 1 CYS HB3 1 1 6 1930 1 1 1 CYS N N 2.398 4.283 -5.752 1.00 . A A . 1 CYS N 1 1 6 1931 1 1 1 CYS O O 5.307 3.184 -6.147 1.00 . A A . 1 CYS O 1 1 6 1932 1 1 1 CYS SG S 1.445 1.721 -4.079 1.00 . A A . 1 CYS SG 1 1 6 1933 1 1 2 SER C C 7.728 4.503 -4.075 1.00 . A A . 2 SER C 1 1 6 1934 1 1 2 SER CA C 6.797 5.220 -5.045 1.00 . A A . 2 SER CA 1 1 6 1935 1 1 2 SER CB C 7.018 6.732 -4.997 1.00 . A A . 2 SER CB 1 1 6 1936 1 1 2 SER H H 4.937 5.484 -4.075 1.00 . A A . 2 SER H 1 1 6 1937 1 1 2 SER HA H 6.993 4.864 -6.047 1.00 . A A . 2 SER HA 1 1 6 1938 1 1 2 SER HB2 H 6.870 7.085 -3.989 1.00 . A A . 2 SER HB2 1 1 6 1939 1 1 2 SER HB3 H 8.024 6.960 -5.316 1.00 . A A . 2 SER HB3 1 1 6 1940 1 1 2 SER HG H 6.214 8.358 -5.761 1.00 . A A . 2 SER HG 1 1 6 1941 1 1 2 SER N N 5.415 4.914 -4.722 1.00 . A A . 2 SER N 1 1 6 1942 1 1 2 SER O O 7.972 4.976 -2.965 1.00 . A A . 2 SER O 1 1 6 1943 1 1 2 SER OG O 6.102 7.399 -5.852 1.00 . A A . 2 SER OG 1 1 6 1944 1 1 3 CYS C C 10.517 3.036 -3.720 1.00 . A A . 3 CYS C 1 1 6 1945 1 1 3 CYS CA C 9.078 2.543 -3.628 1.00 . A A . 3 CYS CA 1 1 6 1946 1 1 3 CYS CB C 9.008 1.066 -4.027 1.00 . A A . 3 CYS CB 1 1 6 1947 1 1 3 CYS H H 8.003 3.016 -5.385 1.00 . A A . 3 CYS H 1 1 6 1948 1 1 3 CYS HA H 8.737 2.651 -2.611 1.00 . A A . 3 CYS HA 1 1 6 1949 1 1 3 CYS HB2 H 9.674 0.893 -4.855 1.00 . A A . 3 CYS HB2 1 1 6 1950 1 1 3 CYS HB3 H 9.326 0.465 -3.187 1.00 . A A . 3 CYS HB3 1 1 6 1951 1 1 3 CYS N N 8.219 3.343 -4.482 1.00 . A A . 3 CYS N 1 1 6 1952 1 1 3 CYS O O 11.270 2.621 -4.596 1.00 . A A . 3 CYS O 1 1 6 1953 1 1 3 CYS SG S 7.344 0.491 -4.515 1.00 . A A . 3 CYS SG 1 1 6 1954 1 1 4 THR C C 13.062 3.776 -1.737 1.00 . A A . 4 THR C 1 1 6 1955 1 1 4 THR CA C 12.233 4.479 -2.812 1.00 . A A . 4 THR CA 1 1 6 1956 1 1 4 THR CB C 12.218 5.991 -2.563 1.00 . A A . 4 THR CB 1 1 6 1957 1 1 4 THR CG2 C 13.608 6.585 -2.711 1.00 . A A . 4 THR CG2 1 1 6 1958 1 1 4 THR H H 10.222 4.289 -2.194 1.00 . A A . 4 THR H 1 1 6 1959 1 1 4 THR HA H 12.679 4.303 -3.770 1.00 . A A . 4 THR HA 1 1 6 1960 1 1 4 THR HB H 11.871 6.165 -1.563 1.00 . A A . 4 THR HB 1 1 6 1961 1 1 4 THR HG1 H 10.901 5.951 -4.038 1.00 . A A . 4 THR HG1 1 1 6 1962 1 1 4 THR HG21 H 13.569 7.646 -2.516 1.00 . A A . 4 THR HG21 1 1 6 1963 1 1 4 THR HG22 H 13.964 6.417 -3.717 1.00 . A A . 4 THR HG22 1 1 6 1964 1 1 4 THR HG23 H 14.279 6.114 -2.008 1.00 . A A . 4 THR HG23 1 1 6 1965 1 1 4 THR N N 10.882 3.952 -2.839 1.00 . A A . 4 THR N 1 1 6 1966 1 1 4 THR O O 12.886 4.032 -0.547 1.00 . A A . 4 THR O 1 1 6 1967 1 1 4 THR OG1 O 11.324 6.625 -3.491 1.00 . A A . 4 THR OG1 1 1 6 1968 1 1 5 ASP C C 13.889 1.156 -0.417 1.00 . A A . 5 ASP C 1 1 6 1969 1 1 5 ASP CA C 14.774 2.059 -1.277 1.00 . A A . 5 ASP CA 1 1 6 1970 1 1 5 ASP CB C 15.663 2.964 -0.406 1.00 . A A . 5 ASP CB 1 1 6 1971 1 1 5 ASP CG C 16.775 2.200 0.293 1.00 . A A . 5 ASP CG 1 1 6 1972 1 1 5 ASP H H 14.000 2.699 -3.150 1.00 . A A . 5 ASP H 1 1 6 1973 1 1 5 ASP HA H 15.405 1.432 -1.893 1.00 . A A . 5 ASP HA 1 1 6 1974 1 1 5 ASP HB2 H 16.116 3.720 -1.032 1.00 . A A . 5 ASP HB2 1 1 6 1975 1 1 5 ASP HB3 H 15.054 3.446 0.345 1.00 . A A . 5 ASP HB3 1 1 6 1976 1 1 5 ASP N N 13.931 2.857 -2.177 1.00 . A A . 5 ASP N 1 1 6 1977 1 1 5 ASP O O 14.301 0.623 0.612 1.00 . A A . 5 ASP O 1 1 6 1978 1 1 5 ASP OD1 O 17.719 1.746 -0.388 1.00 . A A . 5 ASP OD1 1 1 6 1979 1 1 5 ASP OD2 O 16.711 2.047 1.535 1.00 . A A . 5 ASP OD2 1 1 6 1980 1 1 6 MET C C 11.648 -1.238 -0.662 1.00 . A A . 6 MET C 1 1 6 1981 1 1 6 MET CA C 11.669 0.202 -0.165 1.00 . A A . 6 MET CA 1 1 6 1982 1 1 6 MET CB C 10.299 0.828 -0.363 1.00 . A A . 6 MET CB 1 1 6 1983 1 1 6 MET CE C 9.608 3.317 1.496 1.00 . A A . 6 MET CE 1 1 6 1984 1 1 6 MET CG C 9.401 0.642 0.835 1.00 . A A . 6 MET CG 1 1 6 1985 1 1 6 MET H H 12.426 1.352 -1.751 1.00 . A A . 6 MET H 1 1 6 1986 1 1 6 MET HA H 11.911 0.217 0.884 1.00 . A A . 6 MET HA 1 1 6 1987 1 1 6 MET HB2 H 10.415 1.887 -0.542 1.00 . A A . 6 MET HB2 1 1 6 1988 1 1 6 MET HB3 H 9.823 0.373 -1.219 1.00 . A A . 6 MET HB3 1 1 6 1989 1 1 6 MET HE1 H 8.559 3.450 1.277 1.00 . A A . 6 MET HE1 1 1 6 1990 1 1 6 MET HE2 H 10.177 3.395 0.579 1.00 . A A . 6 MET HE2 1 1 6 1991 1 1 6 MET HE3 H 9.932 4.078 2.188 1.00 . A A . 6 MET HE3 1 1 6 1992 1 1 6 MET HG2 H 8.395 0.868 0.547 1.00 . A A . 6 MET HG2 1 1 6 1993 1 1 6 MET HG3 H 9.463 -0.388 1.149 1.00 . A A . 6 MET HG3 1 1 6 1994 1 1 6 MET N N 12.664 0.965 -0.887 1.00 . A A . 6 MET N 1 1 6 1995 1 1 6 MET O O 11.393 -1.486 -1.842 1.00 . A A . 6 MET O 1 1 6 1996 1 1 6 MET SD S 9.862 1.698 2.219 1.00 . A A . 6 MET SD 1 1 6 1997 1 1 7 SER C C 10.567 -4.143 -0.388 1.00 . A A . 7 SER C 1 1 6 1998 1 1 7 SER CA C 11.965 -3.585 -0.119 1.00 . A A . 7 SER CA 1 1 6 1999 1 1 7 SER CB C 12.652 -4.371 0.999 1.00 . A A . 7 SER CB 1 1 6 2000 1 1 7 SER H H 12.082 -1.913 1.163 1.00 . A A . 7 SER H 1 1 6 2001 1 1 7 SER HA H 12.553 -3.674 -1.020 1.00 . A A . 7 SER HA 1 1 6 2002 1 1 7 SER HB2 H 12.015 -4.390 1.870 1.00 . A A . 7 SER HB2 1 1 6 2003 1 1 7 SER HB3 H 12.837 -5.383 0.666 1.00 . A A . 7 SER HB3 1 1 6 2004 1 1 7 SER HG H 14.292 -3.383 0.550 1.00 . A A . 7 SER HG 1 1 6 2005 1 1 7 SER N N 11.910 -2.175 0.236 1.00 . A A . 7 SER N 1 1 6 2006 1 1 7 SER O O 9.888 -4.568 0.539 1.00 . A A . 7 SER O 1 1 6 2007 1 1 7 SER OG O 13.887 -3.768 1.347 1.00 . A A . 7 SER OG 1 1 6 2008 1 1 8 ASP C C 7.740 -4.647 -1.236 1.00 . A A . 8 ASP C 1 1 6 2009 1 1 8 ASP CA C 8.908 -4.622 -2.217 1.00 . A A . 8 ASP CA 1 1 6 2010 1 1 8 ASP CB C 9.152 -6.034 -2.757 1.00 . A A . 8 ASP CB 1 1 6 2011 1 1 8 ASP CG C 7.941 -6.597 -3.477 1.00 . A A . 8 ASP CG 1 1 6 2012 1 1 8 ASP H H 10.734 -3.569 -2.279 1.00 . A A . 8 ASP H 1 1 6 2013 1 1 8 ASP HA H 8.622 -3.995 -3.048 1.00 . A A . 8 ASP HA 1 1 6 2014 1 1 8 ASP HB2 H 9.979 -6.010 -3.450 1.00 . A A . 8 ASP HB2 1 1 6 2015 1 1 8 ASP HB3 H 9.396 -6.690 -1.934 1.00 . A A . 8 ASP HB3 1 1 6 2016 1 1 8 ASP N N 10.158 -4.054 -1.664 1.00 . A A . 8 ASP N 1 1 6 2017 1 1 8 ASP O O 6.867 -3.780 -1.276 1.00 . A A . 8 ASP O 1 1 6 2018 1 1 8 ASP OD1 O 7.661 -6.156 -4.611 1.00 . A A . 8 ASP OD1 1 1 6 2019 1 1 8 ASP OD2 O 7.275 -7.494 -2.924 1.00 . A A . 8 ASP OD2 1 1 6 2020 1 1 9 LEU C C 6.462 -4.601 1.464 1.00 . A A . 9 LEU C 1 1 6 2021 1 1 9 LEU CA C 6.660 -5.842 0.601 1.00 . A A . 9 LEU CA 1 1 6 2022 1 1 9 LEU CB C 6.955 -7.053 1.489 1.00 . A A . 9 LEU CB 1 1 6 2023 1 1 9 LEU CD1 C 4.574 -7.753 1.871 1.00 . A A . 9 LEU CD1 1 1 6 2024 1 1 9 LEU CD2 C 6.364 -8.469 3.466 1.00 . A A . 9 LEU CD2 1 1 6 2025 1 1 9 LEU CG C 5.886 -7.365 2.537 1.00 . A A . 9 LEU CG 1 1 6 2026 1 1 9 LEU H H 8.507 -6.256 -0.354 1.00 . A A . 9 LEU H 1 1 6 2027 1 1 9 LEU HA H 5.752 -6.027 0.047 1.00 . A A . 9 LEU HA 1 1 6 2028 1 1 9 LEU HB2 H 7.070 -7.919 0.853 1.00 . A A . 9 LEU HB2 1 1 6 2029 1 1 9 LEU HB3 H 7.890 -6.879 2.002 1.00 . A A . 9 LEU HB3 1 1 6 2030 1 1 9 LEU HD11 H 4.728 -8.633 1.265 1.00 . A A . 9 LEU HD11 1 1 6 2031 1 1 9 LEU HD12 H 4.234 -6.939 1.246 1.00 . A A . 9 LEU HD12 1 1 6 2032 1 1 9 LEU HD13 H 3.833 -7.962 2.629 1.00 . A A . 9 LEU HD13 1 1 6 2033 1 1 9 LEU HD21 H 5.586 -8.703 4.176 1.00 . A A . 9 LEU HD21 1 1 6 2034 1 1 9 LEU HD22 H 7.246 -8.138 3.993 1.00 . A A . 9 LEU HD22 1 1 6 2035 1 1 9 LEU HD23 H 6.598 -9.348 2.885 1.00 . A A . 9 LEU HD23 1 1 6 2036 1 1 9 LEU HG H 5.707 -6.481 3.132 1.00 . A A . 9 LEU HG 1 1 6 2037 1 1 9 LEU N N 7.738 -5.643 -0.362 1.00 . A A . 9 LEU N 1 1 6 2038 1 1 9 LEU O O 5.334 -4.239 1.800 1.00 . A A . 9 LEU O 1 1 6 2039 1 1 10 GLU C C 6.823 -1.605 1.842 1.00 . A A . 10 GLU C 1 1 6 2040 1 1 10 GLU CA C 7.507 -2.736 2.611 1.00 . A A . 10 GLU CA 1 1 6 2041 1 1 10 GLU CB C 8.916 -2.317 3.042 1.00 . A A . 10 GLU CB 1 1 6 2042 1 1 10 GLU CD C 8.146 -1.897 5.396 1.00 . A A . 10 GLU CD 1 1 6 2043 1 1 10 GLU CG C 8.926 -1.356 4.218 1.00 . A A . 10 GLU CG 1 1 6 2044 1 1 10 GLU H H 8.434 -4.273 1.483 1.00 . A A . 10 GLU H 1 1 6 2045 1 1 10 GLU HA H 6.922 -2.962 3.492 1.00 . A A . 10 GLU HA 1 1 6 2046 1 1 10 GLU HB2 H 9.479 -3.197 3.317 1.00 . A A . 10 GLU HB2 1 1 6 2047 1 1 10 GLU HB3 H 9.404 -1.836 2.208 1.00 . A A . 10 GLU HB3 1 1 6 2048 1 1 10 GLU HG2 H 9.947 -1.190 4.524 1.00 . A A . 10 GLU HG2 1 1 6 2049 1 1 10 GLU HG3 H 8.484 -0.420 3.909 1.00 . A A . 10 GLU HG3 1 1 6 2050 1 1 10 GLU N N 7.561 -3.939 1.796 1.00 . A A . 10 GLU N 1 1 6 2051 1 1 10 GLU O O 6.171 -0.741 2.428 1.00 . A A . 10 GLU O 1 1 6 2052 1 1 10 GLU OE1 O 8.673 -2.776 6.108 1.00 . A A . 10 GLU OE1 1 1 6 2053 1 1 10 GLU OE2 O 7.014 -1.431 5.631 1.00 . A A . 10 GLU OE2 1 1 6 2054 1 1 11 CYS C C 4.785 -0.910 -0.308 1.00 . A A . 11 CYS C 1 1 6 2055 1 1 11 CYS CA C 6.285 -0.653 -0.329 1.00 . A A . 11 CYS CA 1 1 6 2056 1 1 11 CYS CB C 6.811 -0.716 -1.769 1.00 . A A . 11 CYS CB 1 1 6 2057 1 1 11 CYS H H 7.491 -2.340 0.105 1.00 . A A . 11 CYS H 1 1 6 2058 1 1 11 CYS HA H 6.476 0.329 0.078 1.00 . A A . 11 CYS HA 1 1 6 2059 1 1 11 CYS HB2 H 7.890 -0.687 -1.754 1.00 . A A . 11 CYS HB2 1 1 6 2060 1 1 11 CYS HB3 H 6.487 -1.645 -2.222 1.00 . A A . 11 CYS HB3 1 1 6 2061 1 1 11 CYS N N 6.952 -1.633 0.519 1.00 . A A . 11 CYS N 1 1 6 2062 1 1 11 CYS O O 3.974 0.019 -0.330 1.00 . A A . 11 CYS O 1 1 6 2063 1 1 11 CYS SG S 6.228 0.653 -2.827 1.00 . A A . 11 CYS SG 1 1 6 2064 1 1 12 MET C C 2.455 -2.131 1.184 1.00 . A A . 12 MET C 1 1 6 2065 1 1 12 MET CA C 3.040 -2.593 -0.144 1.00 . A A . 12 MET CA 1 1 6 2066 1 1 12 MET CB C 2.928 -4.114 -0.271 1.00 . A A . 12 MET CB 1 1 6 2067 1 1 12 MET CE C 1.757 -6.785 -1.464 1.00 . A A . 12 MET CE 1 1 6 2068 1 1 12 MET CG C 3.548 -4.663 -1.546 1.00 . A A . 12 MET CG 1 1 6 2069 1 1 12 MET H H 5.128 -2.872 -0.244 1.00 . A A . 12 MET H 1 1 6 2070 1 1 12 MET HA H 2.495 -2.124 -0.949 1.00 . A A . 12 MET HA 1 1 6 2071 1 1 12 MET HB2 H 3.426 -4.571 0.571 1.00 . A A . 12 MET HB2 1 1 6 2072 1 1 12 MET HB3 H 1.885 -4.390 -0.256 1.00 . A A . 12 MET HB3 1 1 6 2073 1 1 12 MET HE1 H 1.235 -6.347 -2.302 1.00 . A A . 12 MET HE1 1 1 6 2074 1 1 12 MET HE2 H 1.391 -6.348 -0.545 1.00 . A A . 12 MET HE2 1 1 6 2075 1 1 12 MET HE3 H 1.583 -7.851 -1.446 1.00 . A A . 12 MET HE3 1 1 6 2076 1 1 12 MET HG2 H 3.007 -4.270 -2.391 1.00 . A A . 12 MET HG2 1 1 6 2077 1 1 12 MET HG3 H 4.578 -4.337 -1.600 1.00 . A A . 12 MET HG3 1 1 6 2078 1 1 12 MET N N 4.429 -2.184 -0.235 1.00 . A A . 12 MET N 1 1 6 2079 1 1 12 MET O O 1.279 -1.802 1.273 1.00 . A A . 12 MET O 1 1 6 2080 1 1 12 MET SD S 3.513 -6.466 -1.617 1.00 . A A . 12 MET SD 1 1 6 2081 1 1 13 ASN C C 2.537 -0.172 3.544 1.00 . A A . 13 ASN C 1 1 6 2082 1 1 13 ASN CA C 2.864 -1.658 3.528 1.00 . A A . 13 ASN CA 1 1 6 2083 1 1 13 ASN CB C 3.931 -1.945 4.587 1.00 . A A . 13 ASN CB 1 1 6 2084 1 1 13 ASN CG C 4.192 -3.423 4.785 1.00 . A A . 13 ASN CG 1 1 6 2085 1 1 13 ASN H H 4.228 -2.368 2.072 1.00 . A A . 13 ASN H 1 1 6 2086 1 1 13 ASN HA H 1.970 -2.210 3.777 1.00 . A A . 13 ASN HA 1 1 6 2087 1 1 13 ASN HB2 H 4.855 -1.476 4.290 1.00 . A A . 13 ASN HB2 1 1 6 2088 1 1 13 ASN HB3 H 3.608 -1.527 5.529 1.00 . A A . 13 ASN HB3 1 1 6 2089 1 1 13 ASN HD21 H 6.058 -3.028 5.342 1.00 . A A . 13 ASN HD21 1 1 6 2090 1 1 13 ASN HD22 H 5.608 -4.702 5.326 1.00 . A A . 13 ASN HD22 1 1 6 2091 1 1 13 ASN N N 3.296 -2.089 2.207 1.00 . A A . 13 ASN N 1 1 6 2092 1 1 13 ASN ND2 N 5.405 -3.755 5.191 1.00 . A A . 13 ASN ND2 1 1 6 2093 1 1 13 ASN O O 1.397 0.211 3.802 1.00 . A A . 13 ASN O 1 1 6 2094 1 1 13 ASN OD1 O 3.309 -4.259 4.587 1.00 . A A . 13 ASN OD1 1 1 6 2095 1 1 14 PHE C C 2.411 2.704 2.392 1.00 . A A . 14 PHE C 1 1 6 2096 1 1 14 PHE CA C 3.380 2.107 3.413 1.00 . A A . 14 PHE CA 1 1 6 2097 1 1 14 PHE CB C 4.747 2.820 3.342 1.00 . A A . 14 PHE CB 1 1 6 2098 1 1 14 PHE CD1 C 5.826 2.346 1.118 1.00 . A A . 14 PHE CD1 1 1 6 2099 1 1 14 PHE CD2 C 4.961 4.532 1.515 1.00 . A A . 14 PHE CD2 1 1 6 2100 1 1 14 PHE CE1 C 6.230 2.735 -0.146 1.00 . A A . 14 PHE CE1 1 1 6 2101 1 1 14 PHE CE2 C 5.363 4.924 0.252 1.00 . A A . 14 PHE CE2 1 1 6 2102 1 1 14 PHE CG C 5.185 3.237 1.961 1.00 . A A . 14 PHE CG 1 1 6 2103 1 1 14 PHE CZ C 5.997 4.025 -0.578 1.00 . A A . 14 PHE CZ 1 1 6 2104 1 1 14 PHE H H 4.382 0.298 2.917 1.00 . A A . 14 PHE H 1 1 6 2105 1 1 14 PHE HA H 2.966 2.267 4.397 1.00 . A A . 14 PHE HA 1 1 6 2106 1 1 14 PHE HB2 H 4.710 3.708 3.953 1.00 . A A . 14 PHE HB2 1 1 6 2107 1 1 14 PHE HB3 H 5.503 2.156 3.740 1.00 . A A . 14 PHE HB3 1 1 6 2108 1 1 14 PHE HD1 H 6.009 1.338 1.455 1.00 . A A . 14 PHE HD1 1 1 6 2109 1 1 14 PHE HD2 H 4.463 5.238 2.164 1.00 . A A . 14 PHE HD2 1 1 6 2110 1 1 14 PHE HE1 H 6.726 2.030 -0.793 1.00 . A A . 14 PHE HE1 1 1 6 2111 1 1 14 PHE HE2 H 5.182 5.935 -0.084 1.00 . A A . 14 PHE HE2 1 1 6 2112 1 1 14 PHE HZ H 6.312 4.328 -1.565 1.00 . A A . 14 PHE HZ 1 1 6 2113 1 1 14 PHE N N 3.529 0.662 3.245 1.00 . A A . 14 PHE N 1 1 6 2114 1 1 14 PHE O O 1.805 3.745 2.638 1.00 . A A . 14 PHE O 1 1 6 2115 1 1 15 CYS C C 0.008 2.039 0.204 1.00 . A A . 15 CYS C 1 1 6 2116 1 1 15 CYS CA C 1.429 2.600 0.187 1.00 . A A . 15 CYS CA 1 1 6 2117 1 1 15 CYS CB C 2.085 2.343 -1.170 1.00 . A A . 15 CYS CB 1 1 6 2118 1 1 15 CYS H H 2.703 1.186 1.124 1.00 . A A . 15 CYS H 1 1 6 2119 1 1 15 CYS HA H 1.372 3.667 0.344 1.00 . A A . 15 CYS HA 1 1 6 2120 1 1 15 CYS HB2 H 3.079 2.764 -1.165 1.00 . A A . 15 CYS HB2 1 1 6 2121 1 1 15 CYS HB3 H 2.153 1.276 -1.331 1.00 . A A . 15 CYS HB3 1 1 6 2122 1 1 15 CYS N N 2.250 2.047 1.254 1.00 . A A . 15 CYS N 1 1 6 2123 1 1 15 CYS O O -0.947 2.749 -0.119 1.00 . A A . 15 CYS O 1 1 6 2124 1 1 15 CYS SG S 1.186 3.066 -2.582 1.00 . A A . 15 CYS SG 1 1 6 2125 1 1 16 HIS C C -2.167 0.196 1.888 1.00 . A A . 16 HIS C 1 1 6 2126 1 1 16 HIS CA C -1.452 0.122 0.543 1.00 . A A . 16 HIS CA 1 1 6 2127 1 1 16 HIS CB C -1.328 -1.339 0.093 1.00 . A A . 16 HIS CB 1 1 6 2128 1 1 16 HIS CD2 C 0.331 -1.230 -1.907 1.00 . A A . 16 HIS CD2 1 1 6 2129 1 1 16 HIS CE1 C -0.960 -2.117 -3.435 1.00 . A A . 16 HIS CE1 1 1 6 2130 1 1 16 HIS CG C -0.857 -1.512 -1.322 1.00 . A A . 16 HIS CG 1 1 6 2131 1 1 16 HIS H H 0.632 0.283 0.944 1.00 . A A . 16 HIS H 1 1 6 2132 1 1 16 HIS HA H -2.046 0.655 -0.182 1.00 . A A . 16 HIS HA 1 1 6 2133 1 1 16 HIS HB2 H -0.626 -1.847 0.737 1.00 . A A . 16 HIS HB2 1 1 6 2134 1 1 16 HIS HB3 H -2.294 -1.814 0.182 1.00 . A A . 16 HIS HB3 1 1 6 2135 1 1 16 HIS HD1 H -2.574 -2.374 -2.196 1.00 . A A . 16 HIS HD1 1 1 6 2136 1 1 16 HIS HD2 H 1.188 -0.778 -1.429 1.00 . A A . 16 HIS HD2 1 1 6 2137 1 1 16 HIS HE1 H -1.323 -2.507 -4.375 1.00 . A A . 16 HIS HE1 1 1 6 2138 1 1 16 HIS HE2 H 1.005 -1.695 -3.844 1.00 . A A . 16 HIS HE2 1 1 6 2139 1 1 16 HIS N N -0.143 0.778 0.598 1.00 . A A . 16 HIS N 1 1 6 2140 1 1 16 HIS ND1 N -1.640 -2.064 -2.309 1.00 . A A . 16 HIS ND1 1 1 6 2141 1 1 16 HIS NE2 N 0.241 -1.616 -3.220 1.00 . A A . 16 HIS NE2 1 1 6 2142 1 1 16 HIS O O -3.176 -0.474 2.102 1.00 . A A . 16 HIS O 1 1 6 2143 1 1 17 LYS C C -3.212 2.471 3.977 1.00 . A A . 17 LYS C 1 1 6 2144 1 1 17 LYS CA C -2.305 1.264 4.070 1.00 . A A . 17 LYS CA 1 1 6 2145 1 1 17 LYS CB C -1.285 1.481 5.187 1.00 . A A . 17 LYS CB 1 1 6 2146 1 1 17 LYS CD C 0.263 3.156 6.238 1.00 . A A . 17 LYS CD 1 1 6 2147 1 1 17 LYS CE C -0.799 3.776 7.135 1.00 . A A . 17 LYS CE 1 1 6 2148 1 1 17 LYS CG C -0.344 2.651 4.941 1.00 . A A . 17 LYS CG 1 1 6 2149 1 1 17 LYS H H -0.807 1.481 2.587 1.00 . A A . 17 LYS H 1 1 6 2150 1 1 17 LYS HA H -2.909 0.407 4.298 1.00 . A A . 17 LYS HA 1 1 6 2151 1 1 17 LYS HB2 H -1.818 1.665 6.106 1.00 . A A . 17 LYS HB2 1 1 6 2152 1 1 17 LYS HB3 H -0.693 0.585 5.299 1.00 . A A . 17 LYS HB3 1 1 6 2153 1 1 17 LYS HD2 H 0.723 2.330 6.757 1.00 . A A . 17 LYS HD2 1 1 6 2154 1 1 17 LYS HD3 H 1.009 3.903 6.011 1.00 . A A . 17 LYS HD3 1 1 6 2155 1 1 17 LYS HE2 H -1.586 3.052 7.292 1.00 . A A . 17 LYS HE2 1 1 6 2156 1 1 17 LYS HE3 H -0.348 4.023 8.084 1.00 . A A . 17 LYS HE3 1 1 6 2157 1 1 17 LYS HG2 H 0.452 2.330 4.285 1.00 . A A . 17 LYS HG2 1 1 6 2158 1 1 17 LYS HG3 H -0.895 3.452 4.476 1.00 . A A . 17 LYS HG3 1 1 6 2159 1 1 17 LYS HZ1 H -1.738 4.820 5.575 1.00 . A A . 17 LYS HZ1 1 1 6 2160 1 1 17 LYS HZ2 H -0.672 5.764 6.498 1.00 . A A . 17 LYS HZ2 1 1 6 2161 1 1 17 LYS HZ3 H -2.185 5.342 7.127 1.00 . A A . 17 LYS HZ3 1 1 6 2162 1 1 17 LYS N N -1.649 1.024 2.787 1.00 . A A . 17 LYS N 1 1 6 2163 1 1 17 LYS NZ N -1.388 5.009 6.541 1.00 . A A . 17 LYS NZ 1 1 6 2164 1 1 17 LYS O O -3.627 3.040 4.987 1.00 . A A . 17 LYS O 1 1 6 2165 1 1 18 ASP C C -5.341 3.657 1.384 1.00 . A A . 18 ASP C 1 1 6 2166 1 1 18 ASP CA C -4.367 3.984 2.497 1.00 . A A . 18 ASP CA 1 1 6 2167 1 1 18 ASP CB C -3.528 5.200 2.115 1.00 . A A . 18 ASP CB 1 1 6 2168 1 1 18 ASP CG C -2.888 5.883 3.310 1.00 . A A . 18 ASP CG 1 1 6 2169 1 1 18 ASP H H -3.151 2.341 2.005 1.00 . A A . 18 ASP H 1 1 6 2170 1 1 18 ASP HA H -4.919 4.204 3.398 1.00 . A A . 18 ASP HA 1 1 6 2171 1 1 18 ASP HB2 H -2.748 4.894 1.438 1.00 . A A . 18 ASP HB2 1 1 6 2172 1 1 18 ASP HB3 H -4.162 5.906 1.622 1.00 . A A . 18 ASP HB3 1 1 6 2173 1 1 18 ASP N N -3.514 2.847 2.758 1.00 . A A . 18 ASP N 1 1 6 2174 1 1 18 ASP O O -5.562 4.465 0.479 1.00 . A A . 18 ASP O 1 1 6 2175 1 1 18 ASP OD1 O -1.882 5.353 3.829 1.00 . A A . 18 ASP OD1 1 1 6 2176 1 1 18 ASP OD2 O -3.386 6.942 3.743 1.00 . A A . 18 ASP OD2 1 1 6 2177 1 1 19 VAL C C -8.109 2.933 0.484 1.00 . A A . 19 VAL C 1 1 6 2178 1 1 19 VAL CA C -6.881 2.034 0.453 1.00 . A A . 19 VAL CA 1 1 6 2179 1 1 19 VAL CB C -7.299 0.561 0.634 1.00 . A A . 19 VAL CB 1 1 6 2180 1 1 19 VAL CG1 C -6.119 -0.367 0.384 1.00 . A A . 19 VAL CG1 1 1 6 2181 1 1 19 VAL CG2 C -7.874 0.329 2.016 1.00 . A A . 19 VAL CG2 1 1 6 2182 1 1 19 VAL H H -5.700 1.864 2.199 1.00 . A A . 19 VAL H 1 1 6 2183 1 1 19 VAL HA H -6.413 2.129 -0.509 1.00 . A A . 19 VAL HA 1 1 6 2184 1 1 19 VAL HB H -8.065 0.337 -0.093 1.00 . A A . 19 VAL HB 1 1 6 2185 1 1 19 VAL HG11 H -5.343 -0.164 1.106 1.00 . A A . 19 VAL HG11 1 1 6 2186 1 1 19 VAL HG12 H -5.735 -0.203 -0.612 1.00 . A A . 19 VAL HG12 1 1 6 2187 1 1 19 VAL HG13 H -6.444 -1.395 0.478 1.00 . A A . 19 VAL HG13 1 1 6 2188 1 1 19 VAL HG21 H -8.758 0.934 2.140 1.00 . A A . 19 VAL HG21 1 1 6 2189 1 1 19 VAL HG22 H -7.142 0.606 2.756 1.00 . A A . 19 VAL HG22 1 1 6 2190 1 1 19 VAL HG23 H -8.127 -0.713 2.133 1.00 . A A . 19 VAL HG23 1 1 6 2191 1 1 19 VAL N N -5.919 2.461 1.451 1.00 . A A . 19 VAL N 1 1 6 2192 1 1 19 VAL O O -8.642 3.251 1.548 1.00 . A A . 19 VAL O 1 1 6 2193 1 1 20 ILE C C -10.989 3.609 -0.792 1.00 . A A . 20 ILE C 1 1 6 2194 1 1 20 ILE CA C -9.634 4.313 -0.771 1.00 . A A . 20 ILE CA 1 1 6 2195 1 1 20 ILE CB C -9.471 5.206 -2.022 1.00 . A A . 20 ILE CB 1 1 6 2196 1 1 20 ILE CD1 C -9.570 7.360 -0.691 1.00 . A A . 20 ILE CD1 1 1 6 2197 1 1 20 ILE CG1 C -10.173 6.545 -1.812 1.00 . A A . 20 ILE CG1 1 1 6 2198 1 1 20 ILE CG2 C -10.005 4.506 -3.262 1.00 . A A . 20 ILE CG2 1 1 6 2199 1 1 20 ILE H H -8.142 3.014 -1.505 1.00 . A A . 20 ILE H 1 1 6 2200 1 1 20 ILE HA H -9.586 4.947 0.101 1.00 . A A . 20 ILE HA 1 1 6 2201 1 1 20 ILE HB H -8.417 5.384 -2.171 1.00 . A A . 20 ILE HB 1 1 6 2202 1 1 20 ILE HD11 H -10.089 8.304 -0.610 1.00 . A A . 20 ILE HD11 1 1 6 2203 1 1 20 ILE HD12 H -8.524 7.540 -0.897 1.00 . A A . 20 ILE HD12 1 1 6 2204 1 1 20 ILE HD13 H -9.662 6.815 0.238 1.00 . A A . 20 ILE HD13 1 1 6 2205 1 1 20 ILE HG12 H -10.107 7.129 -2.719 1.00 . A A . 20 ILE HG12 1 1 6 2206 1 1 20 ILE HG13 H -11.209 6.368 -1.573 1.00 . A A . 20 ILE HG13 1 1 6 2207 1 1 20 ILE HG21 H -9.880 5.149 -4.119 1.00 . A A . 20 ILE HG21 1 1 6 2208 1 1 20 ILE HG22 H -11.052 4.283 -3.126 1.00 . A A . 20 ILE HG22 1 1 6 2209 1 1 20 ILE HG23 H -9.459 3.587 -3.417 1.00 . A A . 20 ILE HG23 1 1 6 2210 1 1 20 ILE N N -8.553 3.352 -0.684 1.00 . A A . 20 ILE N 1 1 6 2211 1 1 20 ILE O O -12.031 4.229 -0.584 1.00 . A A . 20 ILE O 1 1 6 2212 1 1 21 TRP C C -12.690 1.007 0.211 1.00 . A A . 21 TRP C 1 1 6 2213 1 1 21 TRP CA C -12.198 1.530 -1.136 1.00 . A A . 21 TRP CA 1 1 6 2214 1 1 21 TRP CB C -12.020 0.384 -2.141 1.00 . A A . 21 TRP CB 1 1 6 2215 1 1 21 TRP CD1 C -9.625 -0.034 -2.941 1.00 . A A . 21 TRP CD1 1 1 6 2216 1 1 21 TRP CD2 C -10.250 -1.348 -1.239 1.00 . A A . 21 TRP CD2 1 1 6 2217 1 1 21 TRP CE2 C -8.930 -1.677 -1.599 1.00 . A A . 21 TRP CE2 1 1 6 2218 1 1 21 TRP CE3 C -10.851 -2.048 -0.189 1.00 . A A . 21 TRP CE3 1 1 6 2219 1 1 21 TRP CG C -10.678 -0.292 -2.111 1.00 . A A . 21 TRP CG 1 1 6 2220 1 1 21 TRP CH2 C -8.821 -3.344 0.071 1.00 . A A . 21 TRP CH2 1 1 6 2221 1 1 21 TRP CZ2 C -8.206 -2.676 -0.949 1.00 . A A . 21 TRP CZ2 1 1 6 2222 1 1 21 TRP CZ3 C -10.132 -3.038 0.454 1.00 . A A . 21 TRP CZ3 1 1 6 2223 1 1 21 TRP H H -10.105 1.838 -1.073 1.00 . A A . 21 TRP H 1 1 6 2224 1 1 21 TRP HA H -12.947 2.205 -1.522 1.00 . A A . 21 TRP HA 1 1 6 2225 1 1 21 TRP HB2 H -12.767 -0.370 -1.945 1.00 . A A . 21 TRP HB2 1 1 6 2226 1 1 21 TRP HB3 H -12.170 0.772 -3.138 1.00 . A A . 21 TRP HB3 1 1 6 2227 1 1 21 TRP HD1 H -9.633 0.716 -3.719 1.00 . A A . 21 TRP HD1 1 1 6 2228 1 1 21 TRP HE1 H -7.696 -0.862 -3.100 1.00 . A A . 21 TRP HE1 1 1 6 2229 1 1 21 TRP HE3 H -11.856 -1.824 0.123 1.00 . A A . 21 TRP HE3 1 1 6 2230 1 1 21 TRP HH2 H -8.298 -4.126 0.600 1.00 . A A . 21 TRP HH2 1 1 6 2231 1 1 21 TRP HZ2 H -7.193 -2.927 -1.233 1.00 . A A . 21 TRP HZ2 1 1 6 2232 1 1 21 TRP HZ3 H -10.583 -3.590 1.265 1.00 . A A . 21 TRP HZ3 1 1 6 2233 1 1 21 TRP N N -10.967 2.299 -1.005 1.00 . A A . 21 TRP N 1 1 6 2234 1 1 21 TRP NE1 N -8.571 -0.857 -2.637 1.00 . A A . 21 TRP NE1 1 1 6 2235 1 1 21 TRP O O -13.194 -0.111 0.311 1.00 . A A . 21 TRP O 1 1 6 2236 1 1 22 VAL C C -14.510 1.990 2.739 1.00 . A A . 22 VAL C 1 1 6 2237 1 1 22 VAL CA C -13.083 1.493 2.566 1.00 . A A . 22 VAL CA 1 1 6 2238 1 1 22 VAL CB C -12.199 2.080 3.688 1.00 . A A . 22 VAL CB 1 1 6 2239 1 1 22 VAL CG1 C -10.829 1.431 3.680 1.00 . A A . 22 VAL CG1 1 1 6 2240 1 1 22 VAL CG2 C -12.073 3.591 3.545 1.00 . A A . 22 VAL CG2 1 1 6 2241 1 1 22 VAL H H -12.171 2.721 1.099 1.00 . A A . 22 VAL H 1 1 6 2242 1 1 22 VAL HA H -13.077 0.419 2.647 1.00 . A A . 22 VAL HA 1 1 6 2243 1 1 22 VAL HB H -12.666 1.868 4.640 1.00 . A A . 22 VAL HB 1 1 6 2244 1 1 22 VAL HG11 H -10.933 0.366 3.825 1.00 . A A . 22 VAL HG11 1 1 6 2245 1 1 22 VAL HG12 H -10.232 1.848 4.476 1.00 . A A . 22 VAL HG12 1 1 6 2246 1 1 22 VAL HG13 H -10.349 1.620 2.732 1.00 . A A . 22 VAL HG13 1 1 6 2247 1 1 22 VAL HG21 H -11.586 3.824 2.611 1.00 . A A . 22 VAL HG21 1 1 6 2248 1 1 22 VAL HG22 H -11.487 3.983 4.365 1.00 . A A . 22 VAL HG22 1 1 6 2249 1 1 22 VAL HG23 H -13.057 4.038 3.559 1.00 . A A . 22 VAL HG23 1 1 6 2250 1 1 22 VAL N N -12.583 1.841 1.239 1.00 . A A . 22 VAL N 1 1 6 2251 1 1 22 VAL O O -15.047 2.030 3.845 1.00 . A A . 22 VAL O 1 1 6 2252 1 1 23 ASN C C -17.279 2.305 0.487 1.00 . A A . 23 ASN C 1 1 6 2253 1 1 23 ASN CA C -16.459 2.903 1.620 1.00 . A A . 23 ASN CA 1 1 6 2254 1 1 23 ASN CB C -16.394 4.429 1.476 1.00 . A A . 23 ASN CB 1 1 6 2255 1 1 23 ASN CG C -17.751 5.056 1.193 1.00 . A A . 23 ASN CG 1 1 6 2256 1 1 23 ASN H H -14.653 2.210 0.775 1.00 . A A . 23 ASN H 1 1 6 2257 1 1 23 ASN HA H -16.929 2.656 2.562 1.00 . A A . 23 ASN HA 1 1 6 2258 1 1 23 ASN HB2 H -16.005 4.851 2.390 1.00 . A A . 23 ASN HB2 1 1 6 2259 1 1 23 ASN HB3 H -15.726 4.676 0.663 1.00 . A A . 23 ASN HB3 1 1 6 2260 1 1 23 ASN HD21 H -18.133 5.235 3.140 1.00 . A A . 23 ASN HD21 1 1 6 2261 1 1 23 ASN HD22 H -19.371 5.797 2.068 1.00 . A A . 23 ASN HD22 1 1 6 2262 1 1 23 ASN N N -15.117 2.346 1.626 1.00 . A A . 23 ASN N 1 1 6 2263 1 1 23 ASN ND2 N -18.490 5.396 2.237 1.00 . A A . 23 ASN ND2 1 1 6 2264 1 1 23 ASN O O -16.813 2.241 -0.652 1.00 . A A . 23 ASN O 1 1 6 2265 1 1 23 ASN OD1 O -18.128 5.243 0.036 1.00 . A A . 23 ASN OD1 1 1 6 2266 1 1 24 ARG C C -18.886 0.035 -0.787 1.00 . A A . 24 ARG C 1 1 6 2267 1 1 24 ARG CA C -19.434 1.308 -0.141 1.00 . A A . 24 ARG CA 1 1 6 2268 1 1 24 ARG CB C -19.801 2.349 -1.204 1.00 . A A . 24 ARG CB 1 1 6 2269 1 1 24 ARG CD C -21.396 3.066 -2.996 1.00 . A A . 24 ARG CD 1 1 6 2270 1 1 24 ARG CG C -20.946 1.923 -2.107 1.00 . A A . 24 ARG CG 1 1 6 2271 1 1 24 ARG CZ C -23.649 3.447 -3.919 1.00 . A A . 24 ARG CZ 1 1 6 2272 1 1 24 ARG H H -18.757 1.914 1.768 1.00 . A A . 24 ARG H 1 1 6 2273 1 1 24 ARG HA H -20.329 1.048 0.404 1.00 . A A . 24 ARG HA 1 1 6 2274 1 1 24 ARG HB2 H -20.084 3.269 -0.711 1.00 . A A . 24 ARG HB2 1 1 6 2275 1 1 24 ARG HB3 H -18.935 2.534 -1.821 1.00 . A A . 24 ARG HB3 1 1 6 2276 1 1 24 ARG HD2 H -21.665 3.904 -2.372 1.00 . A A . 24 ARG HD2 1 1 6 2277 1 1 24 ARG HD3 H -20.575 3.349 -3.638 1.00 . A A . 24 ARG HD3 1 1 6 2278 1 1 24 ARG HE H -22.480 1.873 -4.348 1.00 . A A . 24 ARG HE 1 1 6 2279 1 1 24 ARG HG2 H -20.614 1.105 -2.728 1.00 . A A . 24 ARG HG2 1 1 6 2280 1 1 24 ARG HG3 H -21.776 1.602 -1.495 1.00 . A A . 24 ARG HG3 1 1 6 2281 1 1 24 ARG HH11 H -23.027 4.843 -2.583 1.00 . A A . 24 ARG HH11 1 1 6 2282 1 1 24 ARG HH12 H -24.621 5.092 -3.242 1.00 . A A . 24 ARG HH12 1 1 6 2283 1 1 24 ARG HH21 H -24.566 2.232 -5.264 1.00 . A A . 24 ARG HH21 1 1 6 2284 1 1 24 ARG HH22 H -25.466 3.642 -4.793 1.00 . A A . 24 ARG HH22 1 1 6 2285 1 1 24 ARG N N -18.488 1.865 0.824 1.00 . A A . 24 ARG N 1 1 6 2286 1 1 24 ARG NE N -22.544 2.709 -3.826 1.00 . A A . 24 ARG NE 1 1 6 2287 1 1 24 ARG NH1 N -23.771 4.551 -3.197 1.00 . A A . 24 ARG NH1 1 1 6 2288 1 1 24 ARG NH2 N -24.638 3.075 -4.719 1.00 . A A . 24 ARG NH2 1 1 6 2289 1 1 24 ARG O O -18.361 0.051 -1.906 1.00 . A A . 24 ARG O 1 1 6 2290 1 1 25 ASN C C -19.479 -3.452 -0.040 1.00 . A A . 25 ASN C 1 1 6 2291 1 1 25 ASN CA C -18.543 -2.362 -0.534 1.00 . A A . 25 ASN CA 1 1 6 2292 1 1 25 ASN CB C -17.112 -2.648 -0.065 1.00 . A A . 25 ASN CB 1 1 6 2293 1 1 25 ASN CG C -16.632 -4.031 -0.469 1.00 . A A . 25 ASN CG 1 1 6 2294 1 1 25 ASN H H -19.401 -1.004 0.837 1.00 . A A . 25 ASN H 1 1 6 2295 1 1 25 ASN HA H -18.564 -2.346 -1.614 1.00 . A A . 25 ASN HA 1 1 6 2296 1 1 25 ASN HB2 H -16.445 -1.917 -0.497 1.00 . A A . 25 ASN HB2 1 1 6 2297 1 1 25 ASN HB3 H -17.072 -2.573 1.012 1.00 . A A . 25 ASN HB3 1 1 6 2298 1 1 25 ASN HD21 H -15.992 -3.322 -2.212 1.00 . A A . 25 ASN HD21 1 1 6 2299 1 1 25 ASN HD22 H -15.750 -5.017 -1.951 1.00 . A A . 25 ASN HD22 1 1 6 2300 1 1 25 ASN N N -18.997 -1.064 -0.058 1.00 . A A . 25 ASN N 1 1 6 2301 1 1 25 ASN ND2 N -16.070 -4.135 -1.661 1.00 . A A . 25 ASN ND2 1 1 6 2302 1 1 25 ASN O O -19.493 -3.710 1.178 1.00 . A A . 25 ASN O 1 1 6 2303 1 1 25 ASN OXT O -20.208 -4.033 -0.866 1.00 . A A . 25 ASN OXT 1 1 6 2304 1 1 25 ASN OD1 O -16.766 -4.998 0.284 1.00 . A A . 25 ASN OD1 1 1 7 2305 1 1 1 CYS C C 5.428 4.153 -5.723 1.00 . A A . 1 CYS C 1 1 7 2306 1 1 1 CYS CA C 3.928 4.217 -5.471 1.00 . A A . 1 CYS CA 1 1 7 2307 1 1 1 CYS CB C 3.619 3.879 -4.012 1.00 . A A . 1 CYS CB 1 1 7 2308 1 1 1 CYS H1 H 3.526 2.296 -6.157 1.00 . A A . 1 CYS H1 1 1 7 2309 1 1 1 CYS H2 H 3.460 3.486 -7.359 1.00 . A A . 1 CYS H2 1 1 7 2310 1 1 1 CYS H3 H 2.195 3.346 -6.239 1.00 . A A . 1 CYS H3 1 1 7 2311 1 1 1 CYS HA H 3.580 5.216 -5.689 1.00 . A A . 1 CYS HA 1 1 7 2312 1 1 1 CYS HB2 H 3.995 2.892 -3.787 1.00 . A A . 1 CYS HB2 1 1 7 2313 1 1 1 CYS HB3 H 4.107 4.600 -3.371 1.00 . A A . 1 CYS HB3 1 1 7 2314 1 1 1 CYS N N 3.228 3.273 -6.367 1.00 . A A . 1 CYS N 1 1 7 2315 1 1 1 CYS O O 5.920 3.200 -6.328 1.00 . A A . 1 CYS O 1 1 7 2316 1 1 1 CYS SG S 1.842 3.898 -3.613 1.00 . A A . 1 CYS SG 1 1 7 2317 1 1 2 SER C C 8.335 4.684 -4.282 1.00 . A A . 2 SER C 1 1 7 2318 1 1 2 SER CA C 7.582 5.245 -5.485 1.00 . A A . 2 SER CA 1 1 7 2319 1 1 2 SER CB C 7.997 6.695 -5.745 1.00 . A A . 2 SER CB 1 1 7 2320 1 1 2 SER H H 5.699 5.892 -4.771 1.00 . A A . 2 SER H 1 1 7 2321 1 1 2 SER HA H 7.821 4.650 -6.353 1.00 . A A . 2 SER HA 1 1 7 2322 1 1 2 SER HB2 H 7.871 7.273 -4.842 1.00 . A A . 2 SER HB2 1 1 7 2323 1 1 2 SER HB3 H 9.032 6.722 -6.048 1.00 . A A . 2 SER HB3 1 1 7 2324 1 1 2 SER HG H 6.590 7.915 -6.385 1.00 . A A . 2 SER HG 1 1 7 2325 1 1 2 SER N N 6.147 5.169 -5.271 1.00 . A A . 2 SER N 1 1 7 2326 1 1 2 SER O O 8.499 5.360 -3.266 1.00 . A A . 2 SER O 1 1 7 2327 1 1 2 SER OG O 7.206 7.273 -6.776 1.00 . A A . 2 SER OG 1 1 7 2328 1 1 3 CYS C C 11.001 2.954 -3.534 1.00 . A A . 3 CYS C 1 1 7 2329 1 1 3 CYS CA C 9.504 2.793 -3.313 1.00 . A A . 3 CYS CA 1 1 7 2330 1 1 3 CYS CB C 9.155 1.306 -3.216 1.00 . A A . 3 CYS CB 1 1 7 2331 1 1 3 CYS H H 8.582 2.932 -5.212 1.00 . A A . 3 CYS H 1 1 7 2332 1 1 3 CYS HA H 9.234 3.281 -2.388 1.00 . A A . 3 CYS HA 1 1 7 2333 1 1 3 CYS HB2 H 10.012 0.726 -3.517 1.00 . A A . 3 CYS HB2 1 1 7 2334 1 1 3 CYS HB3 H 8.913 1.071 -2.189 1.00 . A A . 3 CYS HB3 1 1 7 2335 1 1 3 CYS N N 8.764 3.436 -4.389 1.00 . A A . 3 CYS N 1 1 7 2336 1 1 3 CYS O O 11.597 2.245 -4.344 1.00 . A A . 3 CYS O 1 1 7 2337 1 1 3 CYS SG S 7.744 0.793 -4.251 1.00 . A A . 3 CYS SG 1 1 7 2338 1 1 4 THR C C 13.738 3.449 -1.779 1.00 . A A . 4 THR C 1 1 7 2339 1 1 4 THR CA C 13.025 4.137 -2.934 1.00 . A A . 4 THR CA 1 1 7 2340 1 1 4 THR CB C 13.343 5.636 -2.919 1.00 . A A . 4 THR CB 1 1 7 2341 1 1 4 THR CG2 C 14.779 5.893 -3.351 1.00 . A A . 4 THR CG2 1 1 7 2342 1 1 4 THR H H 11.069 4.435 -2.201 1.00 . A A . 4 THR H 1 1 7 2343 1 1 4 THR HA H 13.372 3.724 -3.861 1.00 . A A . 4 THR HA 1 1 7 2344 1 1 4 THR HB H 13.216 5.995 -1.917 1.00 . A A . 4 THR HB 1 1 7 2345 1 1 4 THR HG1 H 12.144 5.741 -4.497 1.00 . A A . 4 THR HG1 1 1 7 2346 1 1 4 THR HG21 H 14.923 5.528 -4.357 1.00 . A A . 4 THR HG21 1 1 7 2347 1 1 4 THR HG22 H 15.453 5.380 -2.681 1.00 . A A . 4 THR HG22 1 1 7 2348 1 1 4 THR HG23 H 14.978 6.954 -3.321 1.00 . A A . 4 THR HG23 1 1 7 2349 1 1 4 THR N N 11.600 3.896 -2.829 1.00 . A A . 4 THR N 1 1 7 2350 1 1 4 THR O O 13.567 3.836 -0.622 1.00 . A A . 4 THR O 1 1 7 2351 1 1 4 THR OG1 O 12.443 6.339 -3.792 1.00 . A A . 4 THR OG1 1 1 7 2352 1 1 5 ASP C C 14.171 0.636 -0.407 1.00 . A A . 5 ASP C 1 1 7 2353 1 1 5 ASP CA C 15.171 1.547 -1.125 1.00 . A A . 5 ASP CA 1 1 7 2354 1 1 5 ASP CB C 15.973 2.383 -0.117 1.00 . A A . 5 ASP CB 1 1 7 2355 1 1 5 ASP CG C 16.745 1.529 0.866 1.00 . A A . 5 ASP CG 1 1 7 2356 1 1 5 ASP H H 14.591 2.186 -3.067 1.00 . A A . 5 ASP H 1 1 7 2357 1 1 5 ASP HA H 15.857 0.919 -1.673 1.00 . A A . 5 ASP HA 1 1 7 2358 1 1 5 ASP HB2 H 16.676 3.004 -0.653 1.00 . A A . 5 ASP HB2 1 1 7 2359 1 1 5 ASP HB3 H 15.292 3.013 0.436 1.00 . A A . 5 ASP HB3 1 1 7 2360 1 1 5 ASP N N 14.488 2.399 -2.109 1.00 . A A . 5 ASP N 1 1 7 2361 1 1 5 ASP O O 14.513 -0.470 0.021 1.00 . A A . 5 ASP O 1 1 7 2362 1 1 5 ASP OD1 O 17.881 1.120 0.543 1.00 . A A . 5 ASP OD1 1 1 7 2363 1 1 5 ASP OD2 O 16.218 1.260 1.968 1.00 . A A . 5 ASP OD2 1 1 7 2364 1 1 6 MET C C 11.650 -0.952 -0.471 1.00 . A A . 6 MET C 1 1 7 2365 1 1 6 MET CA C 11.834 0.361 0.279 1.00 . A A . 6 MET CA 1 1 7 2366 1 1 6 MET CB C 10.562 1.193 0.183 1.00 . A A . 6 MET CB 1 1 7 2367 1 1 6 MET CE C 9.747 3.124 2.631 1.00 . A A . 6 MET CE 1 1 7 2368 1 1 6 MET CG C 9.495 0.802 1.175 1.00 . A A . 6 MET CG 1 1 7 2369 1 1 6 MET H H 12.758 2.021 -0.617 1.00 . A A . 6 MET H 1 1 7 2370 1 1 6 MET HA H 12.057 0.158 1.317 1.00 . A A . 6 MET HA 1 1 7 2371 1 1 6 MET HB2 H 10.809 2.228 0.352 1.00 . A A . 6 MET HB2 1 1 7 2372 1 1 6 MET HB3 H 10.153 1.087 -0.811 1.00 . A A . 6 MET HB3 1 1 7 2373 1 1 6 MET HE1 H 9.994 3.619 3.557 1.00 . A A . 6 MET HE1 1 1 7 2374 1 1 6 MET HE2 H 8.738 3.378 2.343 1.00 . A A . 6 MET HE2 1 1 7 2375 1 1 6 MET HE3 H 10.432 3.437 1.857 1.00 . A A . 6 MET HE3 1 1 7 2376 1 1 6 MET HG2 H 8.565 1.246 0.867 1.00 . A A . 6 MET HG2 1 1 7 2377 1 1 6 MET HG3 H 9.402 -0.266 1.174 1.00 . A A . 6 MET HG3 1 1 7 2378 1 1 6 MET N N 12.934 1.114 -0.298 1.00 . A A . 6 MET N 1 1 7 2379 1 1 6 MET O O 11.435 -0.952 -1.683 1.00 . A A . 6 MET O 1 1 7 2380 1 1 6 MET SD S 9.871 1.352 2.846 1.00 . A A . 6 MET SD 1 1 7 2381 1 1 7 SER C C 10.371 -3.990 -0.499 1.00 . A A . 7 SER C 1 1 7 2382 1 1 7 SER CA C 11.760 -3.370 -0.368 1.00 . A A . 7 SER CA 1 1 7 2383 1 1 7 SER CB C 12.682 -4.287 0.436 1.00 . A A . 7 SER CB 1 1 7 2384 1 1 7 SER H H 11.735 -1.990 1.227 1.00 . A A . 7 SER H 1 1 7 2385 1 1 7 SER HA H 12.175 -3.247 -1.355 1.00 . A A . 7 SER HA 1 1 7 2386 1 1 7 SER HB2 H 12.258 -4.462 1.413 1.00 . A A . 7 SER HB2 1 1 7 2387 1 1 7 SER HB3 H 12.794 -5.229 -0.084 1.00 . A A . 7 SER HB3 1 1 7 2388 1 1 7 SER HG H 13.912 -2.765 0.323 1.00 . A A . 7 SER HG 1 1 7 2389 1 1 7 SER N N 11.717 -2.058 0.251 1.00 . A A . 7 SER N 1 1 7 2390 1 1 7 SER O O 9.786 -4.427 0.489 1.00 . A A . 7 SER O 1 1 7 2391 1 1 7 SER OG O 13.962 -3.693 0.587 1.00 . A A . 7 SER OG 1 1 7 2392 1 1 8 ASP C C 7.504 -4.618 -1.169 1.00 . A A . 8 ASP C 1 1 7 2393 1 1 8 ASP CA C 8.639 -4.651 -2.184 1.00 . A A . 8 ASP CA 1 1 7 2394 1 1 8 ASP CB C 8.936 -6.109 -2.560 1.00 . A A . 8 ASP CB 1 1 7 2395 1 1 8 ASP CG C 9.675 -6.244 -3.876 1.00 . A A . 8 ASP CG 1 1 7 2396 1 1 8 ASP H H 10.366 -3.448 -2.402 1.00 . A A . 8 ASP H 1 1 7 2397 1 1 8 ASP HA H 8.302 -4.142 -3.075 1.00 . A A . 8 ASP HA 1 1 7 2398 1 1 8 ASP HB2 H 9.538 -6.557 -1.786 1.00 . A A . 8 ASP HB2 1 1 7 2399 1 1 8 ASP HB3 H 8.001 -6.647 -2.636 1.00 . A A . 8 ASP HB3 1 1 7 2400 1 1 8 ASP N N 9.869 -3.963 -1.737 1.00 . A A . 8 ASP N 1 1 7 2401 1 1 8 ASP O O 6.608 -3.778 -1.246 1.00 . A A . 8 ASP O 1 1 7 2402 1 1 8 ASP OD1 O 9.012 -6.325 -4.931 1.00 . A A . 8 ASP OD1 1 1 7 2403 1 1 8 ASP OD2 O 10.924 -6.255 -3.868 1.00 . A A . 8 ASP OD2 1 1 7 2404 1 1 9 LEU C C 6.274 -4.441 1.549 1.00 . A A . 9 LEU C 1 1 7 2405 1 1 9 LEU CA C 6.519 -5.728 0.772 1.00 . A A . 9 LEU CA 1 1 7 2406 1 1 9 LEU CB C 6.907 -6.851 1.735 1.00 . A A . 9 LEU CB 1 1 7 2407 1 1 9 LEU CD1 C 4.585 -7.657 2.243 1.00 . A A . 9 LEU CD1 1 1 7 2408 1 1 9 LEU CD2 C 6.458 -8.161 3.818 1.00 . A A . 9 LEU CD2 1 1 7 2409 1 1 9 LEU CG C 5.889 -7.150 2.837 1.00 . A A . 9 LEU CG 1 1 7 2410 1 1 9 LEU H H 8.364 -6.110 -0.190 1.00 . A A . 9 LEU H 1 1 7 2411 1 1 9 LEU HA H 5.612 -6.002 0.259 1.00 . A A . 9 LEU HA 1 1 7 2412 1 1 9 LEU HB2 H 7.056 -7.754 1.160 1.00 . A A . 9 LEU HB2 1 1 7 2413 1 1 9 LEU HB3 H 7.842 -6.585 2.203 1.00 . A A . 9 LEU HB3 1 1 7 2414 1 1 9 LEU HD11 H 3.874 -7.836 3.036 1.00 . A A . 9 LEU HD11 1 1 7 2415 1 1 9 LEU HD12 H 4.766 -8.577 1.708 1.00 . A A . 9 LEU HD12 1 1 7 2416 1 1 9 LEU HD13 H 4.186 -6.918 1.562 1.00 . A A . 9 LEU HD13 1 1 7 2417 1 1 9 LEU HD21 H 5.735 -8.349 4.600 1.00 . A A . 9 LEU HD21 1 1 7 2418 1 1 9 LEU HD22 H 7.365 -7.770 4.254 1.00 . A A . 9 LEU HD22 1 1 7 2419 1 1 9 LEU HD23 H 6.675 -9.082 3.301 1.00 . A A . 9 LEU HD23 1 1 7 2420 1 1 9 LEU HG H 5.678 -6.239 3.377 1.00 . A A . 9 LEU HG 1 1 7 2421 1 1 9 LEU N N 7.564 -5.543 -0.227 1.00 . A A . 9 LEU N 1 1 7 2422 1 1 9 LEU O O 5.129 -4.020 1.727 1.00 . A A . 9 LEU O 1 1 7 2423 1 1 10 GLU C C 6.658 -1.464 1.914 1.00 . A A . 10 GLU C 1 1 7 2424 1 1 10 GLU CA C 7.251 -2.586 2.765 1.00 . A A . 10 GLU CA 1 1 7 2425 1 1 10 GLU CB C 8.622 -2.177 3.303 1.00 . A A . 10 GLU CB 1 1 7 2426 1 1 10 GLU CD C 7.734 -1.771 5.638 1.00 . A A . 10 GLU CD 1 1 7 2427 1 1 10 GLU CG C 8.547 -1.220 4.482 1.00 . A A . 10 GLU CG 1 1 7 2428 1 1 10 GLU H H 8.243 -4.183 1.789 1.00 . A A . 10 GLU H 1 1 7 2429 1 1 10 GLU HA H 6.590 -2.778 3.597 1.00 . A A . 10 GLU HA 1 1 7 2430 1 1 10 GLU HB2 H 9.160 -3.062 3.610 1.00 . A A . 10 GLU HB2 1 1 7 2431 1 1 10 GLU HB3 H 9.173 -1.692 2.511 1.00 . A A . 10 GLU HB3 1 1 7 2432 1 1 10 GLU HG2 H 9.548 -1.020 4.832 1.00 . A A . 10 GLU HG2 1 1 7 2433 1 1 10 GLU HG3 H 8.092 -0.297 4.150 1.00 . A A . 10 GLU HG3 1 1 7 2434 1 1 10 GLU N N 7.353 -3.811 1.988 1.00 . A A . 10 GLU N 1 1 7 2435 1 1 10 GLU O O 5.973 -0.572 2.424 1.00 . A A . 10 GLU O 1 1 7 2436 1 1 10 GLU OE1 O 6.496 -1.614 5.629 1.00 . A A . 10 GLU OE1 1 1 7 2437 1 1 10 GLU OE2 O 8.330 -2.352 6.570 1.00 . A A . 10 GLU OE2 1 1 7 2438 1 1 11 CYS C C 4.840 -0.651 -0.340 1.00 . A A . 11 CYS C 1 1 7 2439 1 1 11 CYS CA C 6.351 -0.541 -0.311 1.00 . A A . 11 CYS CA 1 1 7 2440 1 1 11 CYS CB C 6.905 -0.705 -1.728 1.00 . A A . 11 CYS CB 1 1 7 2441 1 1 11 CYS H H 7.449 -2.259 0.255 1.00 . A A . 11 CYS H 1 1 7 2442 1 1 11 CYS HA H 6.614 0.439 0.058 1.00 . A A . 11 CYS HA 1 1 7 2443 1 1 11 CYS HB2 H 7.980 -0.591 -1.706 1.00 . A A . 11 CYS HB2 1 1 7 2444 1 1 11 CYS HB3 H 6.658 -1.692 -2.089 1.00 . A A . 11 CYS HB3 1 1 7 2445 1 1 11 CYS N N 6.903 -1.526 0.607 1.00 . A A . 11 CYS N 1 1 7 2446 1 1 11 CYS O O 4.144 0.347 -0.201 1.00 . A A . 11 CYS O 1 1 7 2447 1 1 11 CYS SG S 6.239 0.506 -2.921 1.00 . A A . 11 CYS SG 1 1 7 2448 1 1 12 MET C C 2.231 -1.606 0.740 1.00 . A A . 12 MET C 1 1 7 2449 1 1 12 MET CA C 2.895 -2.096 -0.536 1.00 . A A . 12 MET CA 1 1 7 2450 1 1 12 MET CB C 2.582 -3.576 -0.769 1.00 . A A . 12 MET CB 1 1 7 2451 1 1 12 MET CE C 3.204 -6.695 -1.117 1.00 . A A . 12 MET CE 1 1 7 2452 1 1 12 MET CG C 3.097 -4.099 -2.101 1.00 . A A . 12 MET CG 1 1 7 2453 1 1 12 MET H H 4.946 -2.637 -0.565 1.00 . A A . 12 MET H 1 1 7 2454 1 1 12 MET HA H 2.495 -1.522 -1.358 1.00 . A A . 12 MET HA 1 1 7 2455 1 1 12 MET HB2 H 3.033 -4.158 0.022 1.00 . A A . 12 MET HB2 1 1 7 2456 1 1 12 MET HB3 H 1.511 -3.715 -0.741 1.00 . A A . 12 MET HB3 1 1 7 2457 1 1 12 MET HE1 H 2.851 -6.287 -0.183 1.00 . A A . 12 MET HE1 1 1 7 2458 1 1 12 MET HE2 H 4.281 -6.634 -1.154 1.00 . A A . 12 MET HE2 1 1 7 2459 1 1 12 MET HE3 H 2.898 -7.729 -1.196 1.00 . A A . 12 MET HE3 1 1 7 2460 1 1 12 MET HG2 H 2.775 -3.430 -2.884 1.00 . A A . 12 MET HG2 1 1 7 2461 1 1 12 MET HG3 H 4.177 -4.114 -2.068 1.00 . A A . 12 MET HG3 1 1 7 2462 1 1 12 MET N N 4.336 -1.870 -0.490 1.00 . A A . 12 MET N 1 1 7 2463 1 1 12 MET O O 1.118 -1.095 0.703 1.00 . A A . 12 MET O 1 1 7 2464 1 1 12 MET SD S 2.507 -5.763 -2.478 1.00 . A A . 12 MET SD 1 1 7 2465 1 1 13 ASN C C 2.143 0.249 3.103 1.00 . A A . 13 ASN C 1 1 7 2466 1 1 13 ASN CA C 2.416 -1.257 3.141 1.00 . A A . 13 ASN CA 1 1 7 2467 1 1 13 ASN CB C 3.385 -1.582 4.282 1.00 . A A . 13 ASN CB 1 1 7 2468 1 1 13 ASN CG C 3.425 -3.061 4.629 1.00 . A A . 13 ASN CG 1 1 7 2469 1 1 13 ASN H H 3.809 -2.176 1.830 1.00 . A A . 13 ASN H 1 1 7 2470 1 1 13 ASN HA H 1.479 -1.767 3.320 1.00 . A A . 13 ASN HA 1 1 7 2471 1 1 13 ASN HB2 H 4.381 -1.276 3.996 1.00 . A A . 13 ASN HB2 1 1 7 2472 1 1 13 ASN HB3 H 3.086 -1.034 5.163 1.00 . A A . 13 ASN HB3 1 1 7 2473 1 1 13 ASN HD21 H 5.327 -2.893 5.195 1.00 . A A . 13 ASN HD21 1 1 7 2474 1 1 13 ASN HD22 H 4.628 -4.479 5.333 1.00 . A A . 13 ASN HD22 1 1 7 2475 1 1 13 ASN N N 2.930 -1.735 1.861 1.00 . A A . 13 ASN N 1 1 7 2476 1 1 13 ASN ND2 N 4.573 -3.525 5.098 1.00 . A A . 13 ASN ND2 1 1 7 2477 1 1 13 ASN O O 1.002 0.680 3.290 1.00 . A A . 13 ASN O 1 1 7 2478 1 1 13 ASN OD1 O 2.432 -3.778 4.491 1.00 . A A . 13 ASN OD1 1 1 7 2479 1 1 14 PHE C C 2.259 2.964 1.571 1.00 . A A . 14 PHE C 1 1 7 2480 1 1 14 PHE CA C 2.997 2.506 2.832 1.00 . A A . 14 PHE CA 1 1 7 2481 1 1 14 PHE CB C 4.349 3.235 2.975 1.00 . A A . 14 PHE CB 1 1 7 2482 1 1 14 PHE CD1 C 5.992 2.533 1.201 1.00 . A A . 14 PHE CD1 1 1 7 2483 1 1 14 PHE CD2 C 4.917 4.649 0.977 1.00 . A A . 14 PHE CD2 1 1 7 2484 1 1 14 PHE CE1 C 6.681 2.760 0.026 1.00 . A A . 14 PHE CE1 1 1 7 2485 1 1 14 PHE CE2 C 5.606 4.881 -0.198 1.00 . A A . 14 PHE CE2 1 1 7 2486 1 1 14 PHE CG C 5.097 3.470 1.688 1.00 . A A . 14 PHE CG 1 1 7 2487 1 1 14 PHE CZ C 6.491 3.935 -0.673 1.00 . A A . 14 PHE CZ 1 1 7 2488 1 1 14 PHE H H 4.053 0.665 2.631 1.00 . A A . 14 PHE H 1 1 7 2489 1 1 14 PHE HA H 2.384 2.752 3.687 1.00 . A A . 14 PHE HA 1 1 7 2490 1 1 14 PHE HB2 H 4.177 4.199 3.427 1.00 . A A . 14 PHE HB2 1 1 7 2491 1 1 14 PHE HB3 H 4.989 2.654 3.625 1.00 . A A . 14 PHE HB3 1 1 7 2492 1 1 14 PHE HD1 H 6.144 1.613 1.745 1.00 . A A . 14 PHE HD1 1 1 7 2493 1 1 14 PHE HD2 H 4.223 5.389 1.349 1.00 . A A . 14 PHE HD2 1 1 7 2494 1 1 14 PHE HE1 H 7.375 2.019 -0.344 1.00 . A A . 14 PHE HE1 1 1 7 2495 1 1 14 PHE HE2 H 5.455 5.802 -0.744 1.00 . A A . 14 PHE HE2 1 1 7 2496 1 1 14 PHE HZ H 7.032 4.112 -1.591 1.00 . A A . 14 PHE HZ 1 1 7 2497 1 1 14 PHE N N 3.169 1.053 2.830 1.00 . A A . 14 PHE N 1 1 7 2498 1 1 14 PHE O O 1.799 4.100 1.482 1.00 . A A . 14 PHE O 1 1 7 2499 1 1 15 CYS C C -0.051 2.166 -0.508 1.00 . A A . 15 CYS C 1 1 7 2500 1 1 15 CYS CA C 1.454 2.375 -0.647 1.00 . A A . 15 CYS CA 1 1 7 2501 1 1 15 CYS CB C 1.996 1.503 -1.782 1.00 . A A . 15 CYS CB 1 1 7 2502 1 1 15 CYS H H 2.573 1.191 0.704 1.00 . A A . 15 CYS H 1 1 7 2503 1 1 15 CYS HA H 1.641 3.412 -0.885 1.00 . A A . 15 CYS HA 1 1 7 2504 1 1 15 CYS HB2 H 3.069 1.592 -1.809 1.00 . A A . 15 CYS HB2 1 1 7 2505 1 1 15 CYS HB3 H 1.731 0.473 -1.591 1.00 . A A . 15 CYS HB3 1 1 7 2506 1 1 15 CYS N N 2.150 2.070 0.596 1.00 . A A . 15 CYS N 1 1 7 2507 1 1 15 CYS O O -0.843 3.034 -0.880 1.00 . A A . 15 CYS O 1 1 7 2508 1 1 15 CYS SG S 1.363 1.937 -3.434 1.00 . A A . 15 CYS SG 1 1 7 2509 1 1 16 HIS C C -2.583 1.509 1.147 1.00 . A A . 16 HIS C 1 1 7 2510 1 1 16 HIS CA C -1.864 0.667 0.094 1.00 . A A . 16 HIS CA 1 1 7 2511 1 1 16 HIS CB C -2.052 -0.851 0.330 1.00 . A A . 16 HIS CB 1 1 7 2512 1 1 16 HIS CD2 C -1.023 -1.428 2.645 1.00 . A A . 16 HIS CD2 1 1 7 2513 1 1 16 HIS CE1 C -2.833 -2.150 3.637 1.00 . A A . 16 HIS CE1 1 1 7 2514 1 1 16 HIS CG C -2.038 -1.312 1.762 1.00 . A A . 16 HIS CG 1 1 7 2515 1 1 16 HIS H H 0.219 0.389 0.387 1.00 . A A . 16 HIS H 1 1 7 2516 1 1 16 HIS HA H -2.290 0.913 -0.869 1.00 . A A . 16 HIS HA 1 1 7 2517 1 1 16 HIS HB2 H -2.993 -1.156 -0.097 1.00 . A A . 16 HIS HB2 1 1 7 2518 1 1 16 HIS HB3 H -1.252 -1.373 -0.183 1.00 . A A . 16 HIS HB3 1 1 7 2519 1 1 16 HIS HD1 H -4.066 -1.853 2.028 1.00 . A A . 16 HIS HD1 1 1 7 2520 1 1 16 HIS HD2 H 0.011 -1.168 2.465 1.00 . A A . 16 HIS HD2 1 1 7 2521 1 1 16 HIS HE1 H -3.508 -2.558 4.373 1.00 . A A . 16 HIS HE1 1 1 7 2522 1 1 16 HIS HE2 H -1.001 -2.362 4.528 1.00 . A A . 16 HIS HE2 1 1 7 2523 1 1 16 HIS N N -0.451 1.015 0.033 1.00 . A A . 16 HIS N 1 1 7 2524 1 1 16 HIS ND1 N -3.159 -1.775 2.416 1.00 . A A . 16 HIS ND1 1 1 7 2525 1 1 16 HIS NE2 N -1.541 -1.950 3.804 1.00 . A A . 16 HIS NE2 1 1 7 2526 1 1 16 HIS O O -3.784 1.747 1.042 1.00 . A A . 16 HIS O 1 1 7 2527 1 1 17 LYS C C -3.663 2.448 3.786 1.00 . A A . 17 LYS C 1 1 7 2528 1 1 17 LYS CA C -2.340 2.902 3.171 1.00 . A A . 17 LYS CA 1 1 7 2529 1 1 17 LYS CB C -2.509 4.300 2.567 1.00 . A A . 17 LYS CB 1 1 7 2530 1 1 17 LYS CD C -0.395 5.277 3.547 1.00 . A A . 17 LYS CD 1 1 7 2531 1 1 17 LYS CE C -0.919 6.481 4.328 1.00 . A A . 17 LYS CE 1 1 7 2532 1 1 17 LYS CG C -1.196 5.003 2.278 1.00 . A A . 17 LYS CG 1 1 7 2533 1 1 17 LYS H H -0.891 1.675 2.210 1.00 . A A . 17 LYS H 1 1 7 2534 1 1 17 LYS HA H -1.604 2.958 3.957 1.00 . A A . 17 LYS HA 1 1 7 2535 1 1 17 LYS HB2 H -3.056 4.213 1.640 1.00 . A A . 17 LYS HB2 1 1 7 2536 1 1 17 LYS HB3 H -3.076 4.912 3.252 1.00 . A A . 17 LYS HB3 1 1 7 2537 1 1 17 LYS HD2 H -0.446 4.407 4.184 1.00 . A A . 17 LYS HD2 1 1 7 2538 1 1 17 LYS HD3 H 0.634 5.459 3.274 1.00 . A A . 17 LYS HD3 1 1 7 2539 1 1 17 LYS HE2 H -0.207 6.722 5.103 1.00 . A A . 17 LYS HE2 1 1 7 2540 1 1 17 LYS HE3 H -1.004 7.318 3.650 1.00 . A A . 17 LYS HE3 1 1 7 2541 1 1 17 LYS HG2 H -0.605 4.378 1.626 1.00 . A A . 17 LYS HG2 1 1 7 2542 1 1 17 LYS HG3 H -1.404 5.941 1.784 1.00 . A A . 17 LYS HG3 1 1 7 2543 1 1 17 LYS HZ1 H -2.207 5.367 5.545 1.00 . A A . 17 LYS HZ1 1 1 7 2544 1 1 17 LYS HZ2 H -2.972 6.109 4.227 1.00 . A A . 17 LYS HZ2 1 1 7 2545 1 1 17 LYS HZ3 H -2.512 7.037 5.565 1.00 . A A . 17 LYS HZ3 1 1 7 2546 1 1 17 LYS N N -1.829 1.965 2.155 1.00 . A A . 17 LYS N 1 1 7 2547 1 1 17 LYS NZ N -2.245 6.231 4.956 1.00 . A A . 17 LYS NZ 1 1 7 2548 1 1 17 LYS O O -4.497 3.281 4.149 1.00 . A A . 17 LYS O 1 1 7 2549 1 1 18 ASP C C -6.301 0.909 3.767 1.00 . A A . 18 ASP C 1 1 7 2550 1 1 18 ASP CA C -5.033 0.541 4.515 1.00 . A A . 18 ASP CA 1 1 7 2551 1 1 18 ASP CB C -5.157 0.987 5.969 1.00 . A A . 18 ASP CB 1 1 7 2552 1 1 18 ASP CG C -3.946 0.629 6.801 1.00 . A A . 18 ASP CG 1 1 7 2553 1 1 18 ASP H H -3.161 0.536 3.547 1.00 . A A . 18 ASP H 1 1 7 2554 1 1 18 ASP HA H -4.918 -0.531 4.487 1.00 . A A . 18 ASP HA 1 1 7 2555 1 1 18 ASP HB2 H -5.291 2.057 6.000 1.00 . A A . 18 ASP HB2 1 1 7 2556 1 1 18 ASP HB3 H -6.018 0.510 6.401 1.00 . A A . 18 ASP HB3 1 1 7 2557 1 1 18 ASP N N -3.846 1.132 3.892 1.00 . A A . 18 ASP N 1 1 7 2558 1 1 18 ASP O O -7.404 0.650 4.243 1.00 . A A . 18 ASP O 1 1 7 2559 1 1 18 ASP OD1 O -3.897 -0.497 7.333 1.00 . A A . 18 ASP OD1 1 1 7 2560 1 1 18 ASP OD2 O -3.036 1.476 6.932 1.00 . A A . 18 ASP OD2 1 1 7 2561 1 1 19 VAL C C -8.110 2.926 2.661 1.00 . A A . 19 VAL C 1 1 7 2562 1 1 19 VAL CA C -7.244 2.003 1.802 1.00 . A A . 19 VAL CA 1 1 7 2563 1 1 19 VAL CB C -8.066 0.851 1.178 1.00 . A A . 19 VAL CB 1 1 7 2564 1 1 19 VAL CG1 C -9.191 1.383 0.309 1.00 . A A . 19 VAL CG1 1 1 7 2565 1 1 19 VAL CG2 C -7.159 -0.038 0.345 1.00 . A A . 19 VAL CG2 1 1 7 2566 1 1 19 VAL H H -5.221 1.580 2.227 1.00 . A A . 19 VAL H 1 1 7 2567 1 1 19 VAL HA H -6.825 2.593 1.003 1.00 . A A . 19 VAL HA 1 1 7 2568 1 1 19 VAL HB H -8.491 0.258 1.973 1.00 . A A . 19 VAL HB 1 1 7 2569 1 1 19 VAL HG11 H -9.778 0.557 -0.065 1.00 . A A . 19 VAL HG11 1 1 7 2570 1 1 19 VAL HG12 H -8.772 1.933 -0.519 1.00 . A A . 19 VAL HG12 1 1 7 2571 1 1 19 VAL HG13 H -9.815 2.036 0.898 1.00 . A A . 19 VAL HG13 1 1 7 2572 1 1 19 VAL HG21 H -7.728 -0.867 -0.049 1.00 . A A . 19 VAL HG21 1 1 7 2573 1 1 19 VAL HG22 H -6.353 -0.410 0.959 1.00 . A A . 19 VAL HG22 1 1 7 2574 1 1 19 VAL HG23 H -6.753 0.542 -0.474 1.00 . A A . 19 VAL HG23 1 1 7 2575 1 1 19 VAL N N -6.132 1.493 2.587 1.00 . A A . 19 VAL N 1 1 7 2576 1 1 19 VAL O O -9.334 2.819 2.729 1.00 . A A . 19 VAL O 1 1 7 2577 1 1 20 ILE C C -8.579 5.967 3.174 1.00 . A A . 20 ILE C 1 1 7 2578 1 1 20 ILE CA C -8.099 4.867 4.116 1.00 . A A . 20 ILE CA 1 1 7 2579 1 1 20 ILE CB C -7.158 5.450 5.193 1.00 . A A . 20 ILE CB 1 1 7 2580 1 1 20 ILE CD1 C -9.025 5.622 6.922 1.00 . A A . 20 ILE CD1 1 1 7 2581 1 1 20 ILE CG1 C -7.935 6.347 6.159 1.00 . A A . 20 ILE CG1 1 1 7 2582 1 1 20 ILE CG2 C -6.018 6.222 4.550 1.00 . A A . 20 ILE CG2 1 1 7 2583 1 1 20 ILE H H -6.452 3.801 3.316 1.00 . A A . 20 ILE H 1 1 7 2584 1 1 20 ILE HA H -8.950 4.428 4.608 1.00 . A A . 20 ILE HA 1 1 7 2585 1 1 20 ILE HB H -6.731 4.628 5.746 1.00 . A A . 20 ILE HB 1 1 7 2586 1 1 20 ILE HD11 H -8.590 4.820 7.498 1.00 . A A . 20 ILE HD11 1 1 7 2587 1 1 20 ILE HD12 H -9.744 5.217 6.225 1.00 . A A . 20 ILE HD12 1 1 7 2588 1 1 20 ILE HD13 H -9.518 6.316 7.587 1.00 . A A . 20 ILE HD13 1 1 7 2589 1 1 20 ILE HG12 H -7.250 6.760 6.880 1.00 . A A . 20 ILE HG12 1 1 7 2590 1 1 20 ILE HG13 H -8.395 7.150 5.603 1.00 . A A . 20 ILE HG13 1 1 7 2591 1 1 20 ILE HG21 H -6.422 7.031 3.962 1.00 . A A . 20 ILE HG21 1 1 7 2592 1 1 20 ILE HG22 H -5.452 5.561 3.912 1.00 . A A . 20 ILE HG22 1 1 7 2593 1 1 20 ILE HG23 H -5.372 6.621 5.320 1.00 . A A . 20 ILE HG23 1 1 7 2594 1 1 20 ILE N N -7.433 3.834 3.337 1.00 . A A . 20 ILE N 1 1 7 2595 1 1 20 ILE O O -9.405 6.808 3.524 1.00 . A A . 20 ILE O 1 1 7 2596 1 1 21 TRP C C -9.686 6.561 0.200 1.00 . A A . 21 TRP C 1 1 7 2597 1 1 21 TRP CA C -8.388 6.889 0.920 1.00 . A A . 21 TRP CA 1 1 7 2598 1 1 21 TRP CB C -7.233 6.981 -0.076 1.00 . A A . 21 TRP CB 1 1 7 2599 1 1 21 TRP CD1 C -5.374 5.236 0.237 1.00 . A A . 21 TRP CD1 1 1 7 2600 1 1 21 TRP CD2 C -6.925 4.640 -1.262 1.00 . A A . 21 TRP CD2 1 1 7 2601 1 1 21 TRP CE2 C -5.959 3.618 -1.182 1.00 . A A . 21 TRP CE2 1 1 7 2602 1 1 21 TRP CE3 C -7.996 4.478 -2.143 1.00 . A A . 21 TRP CE3 1 1 7 2603 1 1 21 TRP CG C -6.532 5.672 -0.344 1.00 . A A . 21 TRP CG 1 1 7 2604 1 1 21 TRP CH2 C -7.091 2.329 -2.800 1.00 . A A . 21 TRP CH2 1 1 7 2605 1 1 21 TRP CZ2 C -6.033 2.458 -1.946 1.00 . A A . 21 TRP CZ2 1 1 7 2606 1 1 21 TRP CZ3 C -8.069 3.325 -2.901 1.00 . A A . 21 TRP CZ3 1 1 7 2607 1 1 21 TRP H H -7.482 5.163 1.720 1.00 . A A . 21 TRP H 1 1 7 2608 1 1 21 TRP HA H -8.502 7.840 1.410 1.00 . A A . 21 TRP HA 1 1 7 2609 1 1 21 TRP HB2 H -7.611 7.353 -1.016 1.00 . A A . 21 TRP HB2 1 1 7 2610 1 1 21 TRP HB3 H -6.509 7.674 0.310 1.00 . A A . 21 TRP HB3 1 1 7 2611 1 1 21 TRP HD1 H -4.823 5.789 0.980 1.00 . A A . 21 TRP HD1 1 1 7 2612 1 1 21 TRP HE1 H -4.233 3.483 0.003 1.00 . A A . 21 TRP HE1 1 1 7 2613 1 1 21 TRP HE3 H -8.760 5.229 -2.232 1.00 . A A . 21 TRP HE3 1 1 7 2614 1 1 21 TRP HH2 H -7.189 1.445 -3.412 1.00 . A A . 21 TRP HH2 1 1 7 2615 1 1 21 TRP HZ2 H -5.286 1.681 -1.877 1.00 . A A . 21 TRP HZ2 1 1 7 2616 1 1 21 TRP HZ3 H -8.890 3.185 -3.589 1.00 . A A . 21 TRP HZ3 1 1 7 2617 1 1 21 TRP N N -8.079 5.905 1.947 1.00 . A A . 21 TRP N 1 1 7 2618 1 1 21 TRP NE1 N -5.027 4.004 -0.259 1.00 . A A . 21 TRP NE1 1 1 7 2619 1 1 21 TRP O O -9.887 6.937 -0.952 1.00 . A A . 21 TRP O 1 1 7 2620 1 1 22 VAL C C -12.920 6.496 0.912 1.00 . A A . 22 VAL C 1 1 7 2621 1 1 22 VAL CA C -11.871 5.529 0.370 1.00 . A A . 22 VAL CA 1 1 7 2622 1 1 22 VAL CB C -12.211 4.069 0.737 1.00 . A A . 22 VAL CB 1 1 7 2623 1 1 22 VAL CG1 C -12.324 3.918 2.244 1.00 . A A . 22 VAL CG1 1 1 7 2624 1 1 22 VAL CG2 C -13.472 3.594 0.032 1.00 . A A . 22 VAL CG2 1 1 7 2625 1 1 22 VAL H H -10.342 5.634 1.820 1.00 . A A . 22 VAL H 1 1 7 2626 1 1 22 VAL HA H -11.830 5.624 -0.699 1.00 . A A . 22 VAL HA 1 1 7 2627 1 1 22 VAL HB H -11.391 3.446 0.407 1.00 . A A . 22 VAL HB 1 1 7 2628 1 1 22 VAL HG11 H -12.533 2.888 2.490 1.00 . A A . 22 VAL HG11 1 1 7 2629 1 1 22 VAL HG12 H -13.121 4.548 2.611 1.00 . A A . 22 VAL HG12 1 1 7 2630 1 1 22 VAL HG13 H -11.389 4.216 2.698 1.00 . A A . 22 VAL HG13 1 1 7 2631 1 1 22 VAL HG21 H -13.672 2.568 0.302 1.00 . A A . 22 VAL HG21 1 1 7 2632 1 1 22 VAL HG22 H -13.332 3.665 -1.037 1.00 . A A . 22 VAL HG22 1 1 7 2633 1 1 22 VAL HG23 H -14.305 4.215 0.327 1.00 . A A . 22 VAL HG23 1 1 7 2634 1 1 22 VAL N N -10.569 5.888 0.903 1.00 . A A . 22 VAL N 1 1 7 2635 1 1 22 VAL O O -14.122 6.371 0.677 1.00 . A A . 22 VAL O 1 1 7 2636 1 1 23 ASN C C -12.861 9.871 1.667 1.00 . A A . 23 ASN C 1 1 7 2637 1 1 23 ASN CA C -13.263 8.513 2.215 1.00 . A A . 23 ASN CA 1 1 7 2638 1 1 23 ASN CB C -13.145 8.484 3.745 1.00 . A A . 23 ASN CB 1 1 7 2639 1 1 23 ASN CG C -13.764 9.699 4.415 1.00 . A A . 23 ASN CG 1 1 7 2640 1 1 23 ASN H H -11.453 7.542 1.720 1.00 . A A . 23 ASN H 1 1 7 2641 1 1 23 ASN HA H -14.286 8.310 1.934 1.00 . A A . 23 ASN HA 1 1 7 2642 1 1 23 ASN HB2 H -13.643 7.602 4.119 1.00 . A A . 23 ASN HB2 1 1 7 2643 1 1 23 ASN HB3 H -12.100 8.442 4.017 1.00 . A A . 23 ASN HB3 1 1 7 2644 1 1 23 ASN HD21 H -15.560 8.834 4.429 1.00 . A A . 23 ASN HD21 1 1 7 2645 1 1 23 ASN HD22 H -15.477 10.430 5.109 1.00 . A A . 23 ASN HD22 1 1 7 2646 1 1 23 ASN N N -12.424 7.485 1.619 1.00 . A A . 23 ASN N 1 1 7 2647 1 1 23 ASN ND2 N -15.060 9.647 4.676 1.00 . A A . 23 ASN ND2 1 1 7 2648 1 1 23 ASN O O -11.726 10.311 1.850 1.00 . A A . 23 ASN O 1 1 7 2649 1 1 23 ASN OD1 O -13.078 10.685 4.692 1.00 . A A . 23 ASN OD1 1 1 7 2650 1 1 24 ARG C C -14.795 12.518 0.022 1.00 . A A . 24 ARG C 1 1 7 2651 1 1 24 ARG CA C -13.499 11.790 0.333 1.00 . A A . 24 ARG CA 1 1 7 2652 1 1 24 ARG CB C -12.712 11.570 -0.961 1.00 . A A . 24 ARG CB 1 1 7 2653 1 1 24 ARG CD C -12.654 10.547 -3.260 1.00 . A A . 24 ARG CD 1 1 7 2654 1 1 24 ARG CG C -13.490 10.798 -2.019 1.00 . A A . 24 ARG CG 1 1 7 2655 1 1 24 ARG CZ C -11.105 8.720 -3.851 1.00 . A A . 24 ARG CZ 1 1 7 2656 1 1 24 ARG H H -14.684 10.142 0.905 1.00 . A A . 24 ARG H 1 1 7 2657 1 1 24 ARG HA H -12.910 12.388 1.012 1.00 . A A . 24 ARG HA 1 1 7 2658 1 1 24 ARG HB2 H -12.442 12.530 -1.373 1.00 . A A . 24 ARG HB2 1 1 7 2659 1 1 24 ARG HB3 H -11.811 11.019 -0.733 1.00 . A A . 24 ARG HB3 1 1 7 2660 1 1 24 ARG HD2 H -13.285 10.109 -4.020 1.00 . A A . 24 ARG HD2 1 1 7 2661 1 1 24 ARG HD3 H -12.268 11.490 -3.615 1.00 . A A . 24 ARG HD3 1 1 7 2662 1 1 24 ARG HE H -11.072 9.739 -2.123 1.00 . A A . 24 ARG HE 1 1 7 2663 1 1 24 ARG HG2 H -13.791 9.846 -1.607 1.00 . A A . 24 ARG HG2 1 1 7 2664 1 1 24 ARG HG3 H -14.365 11.367 -2.293 1.00 . A A . 24 ARG HG3 1 1 7 2665 1 1 24 ARG HH11 H -12.507 9.131 -5.264 1.00 . A A . 24 ARG HH11 1 1 7 2666 1 1 24 ARG HH12 H -11.391 7.858 -5.667 1.00 . A A . 24 ARG HH12 1 1 7 2667 1 1 24 ARG HH21 H -9.630 8.040 -2.642 1.00 . A A . 24 ARG HH21 1 1 7 2668 1 1 24 ARG HH22 H -9.750 7.245 -4.186 1.00 . A A . 24 ARG HH22 1 1 7 2669 1 1 24 ARG N N -13.783 10.520 0.977 1.00 . A A . 24 ARG N 1 1 7 2670 1 1 24 ARG NE N -11.534 9.644 -2.993 1.00 . A A . 24 ARG NE 1 1 7 2671 1 1 24 ARG NH1 N -11.716 8.557 -5.018 1.00 . A A . 24 ARG NH1 1 1 7 2672 1 1 24 ARG NH2 N -10.083 7.940 -3.532 1.00 . A A . 24 ARG NH2 1 1 7 2673 1 1 24 ARG O O -15.882 11.966 0.200 1.00 . A A . 24 ARG O 1 1 7 2674 1 1 25 ASN C C -15.384 15.571 -1.875 1.00 . A A . 25 ASN C 1 1 7 2675 1 1 25 ASN CA C -15.817 14.551 -0.840 1.00 . A A . 25 ASN CA 1 1 7 2676 1 1 25 ASN CB C -16.422 15.257 0.382 1.00 . A A . 25 ASN CB 1 1 7 2677 1 1 25 ASN CG C -15.504 16.315 0.967 1.00 . A A . 25 ASN CG 1 1 7 2678 1 1 25 ASN H H -13.770 14.121 -0.568 1.00 . A A . 25 ASN H 1 1 7 2679 1 1 25 ASN HA H -16.556 13.896 -1.277 1.00 . A A . 25 ASN HA 1 1 7 2680 1 1 25 ASN HB2 H -17.347 15.732 0.094 1.00 . A A . 25 ASN HB2 1 1 7 2681 1 1 25 ASN HB3 H -16.626 14.521 1.146 1.00 . A A . 25 ASN HB3 1 1 7 2682 1 1 25 ASN HD21 H -16.386 17.726 -0.116 1.00 . A A . 25 ASN HD21 1 1 7 2683 1 1 25 ASN HD22 H -15.106 18.261 0.918 1.00 . A A . 25 ASN HD22 1 1 7 2684 1 1 25 ASN N N -14.668 13.744 -0.457 1.00 . A A . 25 ASN N 1 1 7 2685 1 1 25 ASN ND2 N -15.682 17.557 0.546 1.00 . A A . 25 ASN ND2 1 1 7 2686 1 1 25 ASN O O -16.212 16.415 -2.274 1.00 . A A . 25 ASN O 1 1 7 2687 1 1 25 ASN OXT O -14.202 15.526 -2.284 1.00 . A A . 25 ASN OXT 1 1 7 2688 1 1 25 ASN OD1 O -14.650 16.020 1.803 1.00 . A A . 25 ASN OD1 1 1 8 2689 1 1 1 CYS C C 5.503 3.851 -6.037 1.00 . A A . 1 CYS C 1 1 8 2690 1 1 1 CYS CA C 4.024 3.803 -5.690 1.00 . A A . 1 CYS CA 1 1 8 2691 1 1 1 CYS CB C 3.604 2.363 -5.384 1.00 . A A . 1 CYS CB 1 1 8 2692 1 1 1 CYS H1 H 3.397 3.812 -7.674 1.00 . A A . 1 CYS H1 1 1 8 2693 1 1 1 CYS H2 H 3.465 5.348 -6.961 1.00 . A A . 1 CYS H2 1 1 8 2694 1 1 1 CYS H3 H 2.205 4.290 -6.571 1.00 . A A . 1 CYS H3 1 1 8 2695 1 1 1 CYS HA H 3.854 4.413 -4.817 1.00 . A A . 1 CYS HA 1 1 8 2696 1 1 1 CYS HB2 H 3.722 1.763 -6.273 1.00 . A A . 1 CYS HB2 1 1 8 2697 1 1 1 CYS HB3 H 4.239 1.970 -4.603 1.00 . A A . 1 CYS HB3 1 1 8 2698 1 1 1 CYS N N 3.217 4.349 -6.798 1.00 . A A . 1 CYS N 1 1 8 2699 1 1 1 CYS O O 5.989 3.064 -6.846 1.00 . A A . 1 CYS O 1 1 8 2700 1 1 1 CYS SG S 1.876 2.197 -4.829 1.00 . A A . 1 CYS SG 1 1 8 2701 1 1 2 SER C C 8.401 4.398 -4.451 1.00 . A A . 2 SER C 1 1 8 2702 1 1 2 SER CA C 7.638 4.929 -5.656 1.00 . A A . 2 SER CA 1 1 8 2703 1 1 2 SER CB C 7.993 6.392 -5.911 1.00 . A A . 2 SER CB 1 1 8 2704 1 1 2 SER H H 5.758 5.413 -4.813 1.00 . A A . 2 SER H 1 1 8 2705 1 1 2 SER HA H 7.898 4.344 -6.523 1.00 . A A . 2 SER HA 1 1 8 2706 1 1 2 SER HB2 H 7.795 6.972 -5.020 1.00 . A A . 2 SER HB2 1 1 8 2707 1 1 2 SER HB3 H 9.040 6.469 -6.165 1.00 . A A . 2 SER HB3 1 1 8 2708 1 1 2 SER HG H 6.285 6.753 -6.806 1.00 . A A . 2 SER HG 1 1 8 2709 1 1 2 SER N N 6.211 4.793 -5.437 1.00 . A A . 2 SER N 1 1 8 2710 1 1 2 SER O O 8.453 5.043 -3.405 1.00 . A A . 2 SER O 1 1 8 2711 1 1 2 SER OG O 7.221 6.917 -6.978 1.00 . A A . 2 SER OG 1 1 8 2712 1 1 3 CYS C C 11.138 2.900 -3.501 1.00 . A A . 3 CYS C 1 1 8 2713 1 1 3 CYS CA C 9.653 2.551 -3.498 1.00 . A A . 3 CYS CA 1 1 8 2714 1 1 3 CYS CB C 9.471 1.038 -3.612 1.00 . A A . 3 CYS CB 1 1 8 2715 1 1 3 CYS H H 8.922 2.758 -5.468 1.00 . A A . 3 CYS H 1 1 8 2716 1 1 3 CYS HA H 9.211 2.892 -2.573 1.00 . A A . 3 CYS HA 1 1 8 2717 1 1 3 CYS HB2 H 10.251 0.633 -4.236 1.00 . A A . 3 CYS HB2 1 1 8 2718 1 1 3 CYS HB3 H 9.540 0.601 -2.627 1.00 . A A . 3 CYS HB3 1 1 8 2719 1 1 3 CYS N N 8.969 3.209 -4.598 1.00 . A A . 3 CYS N 1 1 8 2720 1 1 3 CYS O O 11.915 2.348 -4.276 1.00 . A A . 3 CYS O 1 1 8 2721 1 1 3 CYS SG S 7.867 0.547 -4.328 1.00 . A A . 3 CYS SG 1 1 8 2722 1 1 4 THR C C 13.648 3.459 -1.489 1.00 . A A . 4 THR C 1 1 8 2723 1 1 4 THR CA C 12.915 4.243 -2.572 1.00 . A A . 4 THR CA 1 1 8 2724 1 1 4 THR CB C 13.029 5.749 -2.302 1.00 . A A . 4 THR CB 1 1 8 2725 1 1 4 THR CG2 C 14.483 6.190 -2.292 1.00 . A A . 4 THR CG2 1 1 8 2726 1 1 4 THR H H 10.868 4.237 -2.038 1.00 . A A . 4 THR H 1 1 8 2727 1 1 4 THR HA H 13.372 4.038 -3.521 1.00 . A A . 4 THR HA 1 1 8 2728 1 1 4 THR HB H 12.600 5.951 -1.340 1.00 . A A . 4 THR HB 1 1 8 2729 1 1 4 THR HG1 H 12.185 5.921 -4.089 1.00 . A A . 4 THR HG1 1 1 8 2730 1 1 4 THR HG21 H 14.938 5.951 -3.244 1.00 . A A . 4 THR HG21 1 1 8 2731 1 1 4 THR HG22 H 15.010 5.675 -1.502 1.00 . A A . 4 THR HG22 1 1 8 2732 1 1 4 THR HG23 H 14.535 7.255 -2.126 1.00 . A A . 4 THR HG23 1 1 8 2733 1 1 4 THR N N 11.529 3.827 -2.647 1.00 . A A . 4 THR N 1 1 8 2734 1 1 4 THR O O 13.497 3.739 -0.296 1.00 . A A . 4 THR O 1 1 8 2735 1 1 4 THR OG1 O 12.308 6.482 -3.307 1.00 . A A . 4 THR OG1 1 1 8 2736 1 1 5 ASP C C 14.255 0.859 -0.058 1.00 . A A . 5 ASP C 1 1 8 2737 1 1 5 ASP CA C 15.177 1.597 -1.017 1.00 . A A . 5 ASP CA 1 1 8 2738 1 1 5 ASP CB C 16.209 2.417 -0.233 1.00 . A A . 5 ASP CB 1 1 8 2739 1 1 5 ASP CG C 17.298 2.993 -1.116 1.00 . A A . 5 ASP CG 1 1 8 2740 1 1 5 ASP H H 14.435 2.260 -2.889 1.00 . A A . 5 ASP H 1 1 8 2741 1 1 5 ASP HA H 15.697 0.868 -1.621 1.00 . A A . 5 ASP HA 1 1 8 2742 1 1 5 ASP HB2 H 15.706 3.236 0.259 1.00 . A A . 5 ASP HB2 1 1 8 2743 1 1 5 ASP HB3 H 16.671 1.786 0.512 1.00 . A A . 5 ASP HB3 1 1 8 2744 1 1 5 ASP N N 14.402 2.449 -1.921 1.00 . A A . 5 ASP N 1 1 8 2745 1 1 5 ASP O O 14.654 0.484 1.043 1.00 . A A . 5 ASP O 1 1 8 2746 1 1 5 ASP OD1 O 17.566 2.415 -2.189 1.00 . A A . 5 ASP OD1 1 1 8 2747 1 1 5 ASP OD2 O 17.892 4.031 -0.746 1.00 . A A . 5 ASP OD2 1 1 8 2748 1 1 6 MET C C 11.751 -1.410 -0.239 1.00 . A A . 6 MET C 1 1 8 2749 1 1 6 MET CA C 12.027 -0.018 0.320 1.00 . A A . 6 MET CA 1 1 8 2750 1 1 6 MET CB C 10.748 0.816 0.343 1.00 . A A . 6 MET CB 1 1 8 2751 1 1 6 MET CE C 9.051 3.055 1.789 1.00 . A A . 6 MET CE 1 1 8 2752 1 1 6 MET CG C 9.797 0.420 1.442 1.00 . A A . 6 MET CG 1 1 8 2753 1 1 6 MET H H 12.774 0.948 -1.385 1.00 . A A . 6 MET H 1 1 8 2754 1 1 6 MET HA H 12.413 -0.107 1.324 1.00 . A A . 6 MET HA 1 1 8 2755 1 1 6 MET HB2 H 11.008 1.852 0.482 1.00 . A A . 6 MET HB2 1 1 8 2756 1 1 6 MET HB3 H 10.240 0.704 -0.605 1.00 . A A . 6 MET HB3 1 1 8 2757 1 1 6 MET HE1 H 9.699 3.303 0.962 1.00 . A A . 6 MET HE1 1 1 8 2758 1 1 6 MET HE2 H 9.625 3.031 2.705 1.00 . A A . 6 MET HE2 1 1 8 2759 1 1 6 MET HE3 H 8.269 3.793 1.869 1.00 . A A . 6 MET HE3 1 1 8 2760 1 1 6 MET HG2 H 9.501 -0.598 1.284 1.00 . A A . 6 MET HG2 1 1 8 2761 1 1 6 MET HG3 H 10.319 0.498 2.382 1.00 . A A . 6 MET HG3 1 1 8 2762 1 1 6 MET N N 13.021 0.648 -0.491 1.00 . A A . 6 MET N 1 1 8 2763 1 1 6 MET O O 11.820 -1.621 -1.450 1.00 . A A . 6 MET O 1 1 8 2764 1 1 6 MET SD S 8.322 1.449 1.506 1.00 . A A . 6 MET SD 1 1 8 2765 1 1 7 SER C C 9.774 -3.981 -0.136 1.00 . A A . 7 SER C 1 1 8 2766 1 1 7 SER CA C 11.234 -3.731 0.223 1.00 . A A . 7 SER CA 1 1 8 2767 1 1 7 SER CB C 11.691 -4.686 1.329 1.00 . A A . 7 SER CB 1 1 8 2768 1 1 7 SER H H 11.311 -2.118 1.582 1.00 . A A . 7 SER H 1 1 8 2769 1 1 7 SER HA H 11.839 -3.902 -0.654 1.00 . A A . 7 SER HA 1 1 8 2770 1 1 7 SER HB2 H 11.125 -4.494 2.228 1.00 . A A . 7 SER HB2 1 1 8 2771 1 1 7 SER HB3 H 11.525 -5.706 1.012 1.00 . A A . 7 SER HB3 1 1 8 2772 1 1 7 SER HG H 13.353 -3.633 1.318 1.00 . A A . 7 SER HG 1 1 8 2773 1 1 7 SER N N 11.435 -2.355 0.635 1.00 . A A . 7 SER N 1 1 8 2774 1 1 7 SER O O 8.919 -4.010 0.741 1.00 . A A . 7 SER O 1 1 8 2775 1 1 7 SER OG O 13.072 -4.514 1.612 1.00 . A A . 7 SER OG 1 1 8 2776 1 1 8 ASP C C 7.023 -4.345 -1.193 1.00 . A A . 8 ASP C 1 1 8 2777 1 1 8 ASP CA C 8.260 -4.474 -2.080 1.00 . A A . 8 ASP CA 1 1 8 2778 1 1 8 ASP CB C 8.361 -5.919 -2.575 1.00 . A A . 8 ASP CB 1 1 8 2779 1 1 8 ASP CG C 9.428 -6.105 -3.634 1.00 . A A . 8 ASP CG 1 1 8 2780 1 1 8 ASP H H 10.271 -3.824 -2.039 1.00 . A A . 8 ASP H 1 1 8 2781 1 1 8 ASP HA H 8.118 -3.840 -2.941 1.00 . A A . 8 ASP HA 1 1 8 2782 1 1 8 ASP HB2 H 8.595 -6.562 -1.740 1.00 . A A . 8 ASP HB2 1 1 8 2783 1 1 8 ASP HB3 H 7.412 -6.214 -2.994 1.00 . A A . 8 ASP HB3 1 1 8 2784 1 1 8 ASP N N 9.536 -4.061 -1.447 1.00 . A A . 8 ASP N 1 1 8 2785 1 1 8 ASP O O 6.239 -3.406 -1.332 1.00 . A A . 8 ASP O 1 1 8 2786 1 1 8 ASP OD1 O 9.190 -5.718 -4.797 1.00 . A A . 8 ASP OD1 1 1 8 2787 1 1 8 ASP OD2 O 10.508 -6.633 -3.304 1.00 . A A . 8 ASP OD2 1 1 8 2788 1 1 9 LEU C C 5.461 -4.115 1.355 1.00 . A A . 9 LEU C 1 1 8 2789 1 1 9 LEU CA C 5.667 -5.395 0.553 1.00 . A A . 9 LEU CA 1 1 8 2790 1 1 9 LEU CB C 5.783 -6.593 1.500 1.00 . A A . 9 LEU CB 1 1 8 2791 1 1 9 LEU CD1 C 3.339 -7.173 1.566 1.00 . A A . 9 LEU CD1 1 1 8 2792 1 1 9 LEU CD2 C 4.864 -7.964 3.381 1.00 . A A . 9 LEU CD2 1 1 8 2793 1 1 9 LEU CG C 4.569 -6.843 2.398 1.00 . A A . 9 LEU CG 1 1 8 2794 1 1 9 LEU H H 7.578 -5.965 -0.171 1.00 . A A . 9 LEU H 1 1 8 2795 1 1 9 LEU HA H 4.813 -5.541 -0.089 1.00 . A A . 9 LEU HA 1 1 8 2796 1 1 9 LEU HB2 H 5.951 -7.478 0.904 1.00 . A A . 9 LEU HB2 1 1 8 2797 1 1 9 LEU HB3 H 6.644 -6.439 2.133 1.00 . A A . 9 LEU HB3 1 1 8 2798 1 1 9 LEU HD11 H 2.500 -7.360 2.222 1.00 . A A . 9 LEU HD11 1 1 8 2799 1 1 9 LEU HD12 H 3.532 -8.052 0.969 1.00 . A A . 9 LEU HD12 1 1 8 2800 1 1 9 LEU HD13 H 3.111 -6.340 0.918 1.00 . A A . 9 LEU HD13 1 1 8 2801 1 1 9 LEU HD21 H 5.099 -8.870 2.839 1.00 . A A . 9 LEU HD21 1 1 8 2802 1 1 9 LEU HD22 H 3.999 -8.133 4.004 1.00 . A A . 9 LEU HD22 1 1 8 2803 1 1 9 LEU HD23 H 5.704 -7.688 4.002 1.00 . A A . 9 LEU HD23 1 1 8 2804 1 1 9 LEU HG H 4.358 -5.947 2.965 1.00 . A A . 9 LEU HG 1 1 8 2805 1 1 9 LEU N N 6.857 -5.305 -0.290 1.00 . A A . 9 LEU N 1 1 8 2806 1 1 9 LEU O O 4.345 -3.604 1.447 1.00 . A A . 9 LEU O 1 1 8 2807 1 1 10 GLU C C 6.013 -1.205 1.861 1.00 . A A . 10 GLU C 1 1 8 2808 1 1 10 GLU CA C 6.489 -2.380 2.708 1.00 . A A . 10 GLU CA 1 1 8 2809 1 1 10 GLU CB C 7.865 -2.064 3.291 1.00 . A A . 10 GLU CB 1 1 8 2810 1 1 10 GLU CD C 7.182 -1.852 5.704 1.00 . A A . 10 GLU CD 1 1 8 2811 1 1 10 GLU CG C 7.808 -1.163 4.511 1.00 . A A . 10 GLU CG 1 1 8 2812 1 1 10 GLU H H 7.419 -4.016 1.742 1.00 . A A . 10 GLU H 1 1 8 2813 1 1 10 GLU HA H 5.789 -2.542 3.512 1.00 . A A . 10 GLU HA 1 1 8 2814 1 1 10 GLU HB2 H 8.355 -2.987 3.568 1.00 . A A . 10 GLU HB2 1 1 8 2815 1 1 10 GLU HB3 H 8.457 -1.569 2.535 1.00 . A A . 10 GLU HB3 1 1 8 2816 1 1 10 GLU HG2 H 8.814 -0.867 4.772 1.00 . A A . 10 GLU HG2 1 1 8 2817 1 1 10 GLU HG3 H 7.227 -0.285 4.272 1.00 . A A . 10 GLU HG3 1 1 8 2818 1 1 10 GLU N N 6.547 -3.587 1.901 1.00 . A A . 10 GLU N 1 1 8 2819 1 1 10 GLU O O 5.293 -0.324 2.333 1.00 . A A . 10 GLU O 1 1 8 2820 1 1 10 GLU OE1 O 5.938 -1.950 5.760 1.00 . A A . 10 GLU OE1 1 1 8 2821 1 1 10 GLU OE2 O 7.934 -2.296 6.597 1.00 . A A . 10 GLU OE2 1 1 8 2822 1 1 11 CYS C C 4.533 -0.190 -0.568 1.00 . A A . 11 CYS C 1 1 8 2823 1 1 11 CYS CA C 6.036 -0.169 -0.336 1.00 . A A . 11 CYS CA 1 1 8 2824 1 1 11 CYS CB C 6.778 -0.356 -1.658 1.00 . A A . 11 CYS CB 1 1 8 2825 1 1 11 CYS H H 6.974 -1.957 0.282 1.00 . A A . 11 CYS H 1 1 8 2826 1 1 11 CYS HA H 6.311 0.778 0.098 1.00 . A A . 11 CYS HA 1 1 8 2827 1 1 11 CYS HB2 H 7.837 -0.421 -1.460 1.00 . A A . 11 CYS HB2 1 1 8 2828 1 1 11 CYS HB3 H 6.446 -1.278 -2.116 1.00 . A A . 11 CYS HB3 1 1 8 2829 1 1 11 CYS N N 6.413 -1.216 0.597 1.00 . A A . 11 CYS N 1 1 8 2830 1 1 11 CYS O O 3.884 0.852 -0.631 1.00 . A A . 11 CYS O 1 1 8 2831 1 1 11 CYS SG S 6.525 0.981 -2.868 1.00 . A A . 11 CYS SG 1 1 8 2832 1 1 12 MET C C 1.803 -1.160 0.410 1.00 . A A . 12 MET C 1 1 8 2833 1 1 12 MET CA C 2.547 -1.538 -0.861 1.00 . A A . 12 MET CA 1 1 8 2834 1 1 12 MET CB C 2.203 -2.967 -1.290 1.00 . A A . 12 MET CB 1 1 8 2835 1 1 12 MET CE C 2.861 -6.047 -1.969 1.00 . A A . 12 MET CE 1 1 8 2836 1 1 12 MET CG C 2.799 -3.356 -2.637 1.00 . A A . 12 MET CG 1 1 8 2837 1 1 12 MET H H 4.545 -2.187 -0.607 1.00 . A A . 12 MET H 1 1 8 2838 1 1 12 MET HA H 2.245 -0.856 -1.643 1.00 . A A . 12 MET HA 1 1 8 2839 1 1 12 MET HB2 H 2.575 -3.654 -0.542 1.00 . A A . 12 MET HB2 1 1 8 2840 1 1 12 MET HB3 H 1.130 -3.063 -1.353 1.00 . A A . 12 MET HB3 1 1 8 2841 1 1 12 MET HE1 H 2.596 -7.067 -2.202 1.00 . A A . 12 MET HE1 1 1 8 2842 1 1 12 MET HE2 H 2.435 -5.774 -1.014 1.00 . A A . 12 MET HE2 1 1 8 2843 1 1 12 MET HE3 H 3.935 -5.954 -1.924 1.00 . A A . 12 MET HE3 1 1 8 2844 1 1 12 MET HG2 H 2.532 -2.604 -3.362 1.00 . A A . 12 MET HG2 1 1 8 2845 1 1 12 MET HG3 H 3.876 -3.391 -2.540 1.00 . A A . 12 MET HG3 1 1 8 2846 1 1 12 MET N N 3.978 -1.387 -0.669 1.00 . A A . 12 MET N 1 1 8 2847 1 1 12 MET O O 0.689 -0.645 0.352 1.00 . A A . 12 MET O 1 1 8 2848 1 1 12 MET SD S 2.223 -4.958 -3.237 1.00 . A A . 12 MET SD 1 1 8 2849 1 1 13 ASN C C 1.627 0.495 2.915 1.00 . A A . 13 ASN C 1 1 8 2850 1 1 13 ASN CA C 1.851 -1.013 2.835 1.00 . A A . 13 ASN CA 1 1 8 2851 1 1 13 ASN CB C 2.743 -1.461 3.996 1.00 . A A . 13 ASN CB 1 1 8 2852 1 1 13 ASN CG C 2.786 -2.967 4.171 1.00 . A A . 13 ASN CG 1 1 8 2853 1 1 13 ASN H H 3.314 -1.828 1.534 1.00 . A A . 13 ASN H 1 1 8 2854 1 1 13 ASN HA H 0.895 -1.510 2.917 1.00 . A A . 13 ASN HA 1 1 8 2855 1 1 13 ASN HB2 H 3.751 -1.114 3.818 1.00 . A A . 13 ASN HB2 1 1 8 2856 1 1 13 ASN HB3 H 2.376 -1.023 4.911 1.00 . A A . 13 ASN HB3 1 1 8 2857 1 1 13 ASN HD21 H 4.608 -2.840 4.963 1.00 . A A . 13 ASN HD21 1 1 8 2858 1 1 13 ASN HD22 H 3.939 -4.438 4.851 1.00 . A A . 13 ASN HD22 1 1 8 2859 1 1 13 ASN N N 2.434 -1.386 1.552 1.00 . A A . 13 ASN N 1 1 8 2860 1 1 13 ASN ND2 N 3.887 -3.467 4.711 1.00 . A A . 13 ASN ND2 1 1 8 2861 1 1 13 ASN O O 0.498 0.951 3.105 1.00 . A A . 13 ASN O 1 1 8 2862 1 1 13 ASN OD1 O 1.832 -3.675 3.841 1.00 . A A . 13 ASN OD1 1 1 8 2863 1 1 14 PHE C C 1.898 3.375 1.744 1.00 . A A . 14 PHE C 1 1 8 2864 1 1 14 PHE CA C 2.623 2.716 2.917 1.00 . A A . 14 PHE CA 1 1 8 2865 1 1 14 PHE CB C 4.027 3.329 3.115 1.00 . A A . 14 PHE CB 1 1 8 2866 1 1 14 PHE CD1 C 5.331 3.042 0.986 1.00 . A A . 14 PHE CD1 1 1 8 2867 1 1 14 PHE CD2 C 4.622 5.237 1.586 1.00 . A A . 14 PHE CD2 1 1 8 2868 1 1 14 PHE CE1 C 5.926 3.541 -0.156 1.00 . A A . 14 PHE CE1 1 1 8 2869 1 1 14 PHE CE2 C 5.216 5.743 0.446 1.00 . A A . 14 PHE CE2 1 1 8 2870 1 1 14 PHE CG C 4.674 3.885 1.871 1.00 . A A . 14 PHE CG 1 1 8 2871 1 1 14 PHE CZ C 5.862 4.922 -0.417 1.00 . A A . 14 PHE CZ 1 1 8 2872 1 1 14 PHE H H 3.561 0.853 2.502 1.00 . A A . 14 PHE H 1 1 8 2873 1 1 14 PHE HA H 2.043 2.895 3.811 1.00 . A A . 14 PHE HA 1 1 8 2874 1 1 14 PHE HB2 H 3.957 4.135 3.828 1.00 . A A . 14 PHE HB2 1 1 8 2875 1 1 14 PHE HB3 H 4.685 2.569 3.513 1.00 . A A . 14 PHE HB3 1 1 8 2876 1 1 14 PHE HD1 H 5.374 1.984 1.197 1.00 . A A . 14 PHE HD1 1 1 8 2877 1 1 14 PHE HD2 H 4.113 5.904 2.268 1.00 . A A . 14 PHE HD2 1 1 8 2878 1 1 14 PHE HE1 H 6.434 2.875 -0.837 1.00 . A A . 14 PHE HE1 1 1 8 2879 1 1 14 PHE HE2 H 5.167 6.801 0.236 1.00 . A A . 14 PHE HE2 1 1 8 2880 1 1 14 PHE HZ H 6.323 5.324 -1.307 1.00 . A A . 14 PHE HZ 1 1 8 2881 1 1 14 PHE N N 2.701 1.267 2.742 1.00 . A A . 14 PHE N 1 1 8 2882 1 1 14 PHE O O 1.106 4.296 1.933 1.00 . A A . 14 PHE O 1 1 8 2883 1 1 15 CYS C C 0.085 3.252 -0.760 1.00 . A A . 15 CYS C 1 1 8 2884 1 1 15 CYS CA C 1.586 3.499 -0.664 1.00 . A A . 15 CYS CA 1 1 8 2885 1 1 15 CYS CB C 2.284 2.979 -1.924 1.00 . A A . 15 CYS CB 1 1 8 2886 1 1 15 CYS H H 2.729 2.095 0.443 1.00 . A A . 15 CYS H 1 1 8 2887 1 1 15 CYS HA H 1.754 4.564 -0.588 1.00 . A A . 15 CYS HA 1 1 8 2888 1 1 15 CYS HB2 H 3.338 3.206 -1.865 1.00 . A A . 15 CYS HB2 1 1 8 2889 1 1 15 CYS HB3 H 2.154 1.910 -1.979 1.00 . A A . 15 CYS HB3 1 1 8 2890 1 1 15 CYS N N 2.146 2.883 0.532 1.00 . A A . 15 CYS N 1 1 8 2891 1 1 15 CYS O O -0.654 4.087 -1.278 1.00 . A A . 15 CYS O 1 1 8 2892 1 1 15 CYS SG S 1.654 3.696 -3.478 1.00 . A A . 15 CYS SG 1 1 8 2893 1 1 16 HIS C C -2.479 2.124 1.014 1.00 . A A . 16 HIS C 1 1 8 2894 1 1 16 HIS CA C -1.783 1.777 -0.299 1.00 . A A . 16 HIS CA 1 1 8 2895 1 1 16 HIS CB C -1.971 0.293 -0.637 1.00 . A A . 16 HIS CB 1 1 8 2896 1 1 16 HIS CD2 C -0.663 -0.799 -2.594 1.00 . A A . 16 HIS CD2 1 1 8 2897 1 1 16 HIS CE1 C -1.874 -0.046 -4.254 1.00 . A A . 16 HIS CE1 1 1 8 2898 1 1 16 HIS CG C -1.655 -0.048 -2.063 1.00 . A A . 16 HIS CG 1 1 8 2899 1 1 16 HIS H H 0.260 1.496 0.186 1.00 . A A . 16 HIS H 1 1 8 2900 1 1 16 HIS HA H -2.229 2.368 -1.085 1.00 . A A . 16 HIS HA 1 1 8 2901 1 1 16 HIS HB2 H -1.312 -0.294 -0.011 1.00 . A A . 16 HIS HB2 1 1 8 2902 1 1 16 HIS HB3 H -2.995 0.011 -0.442 1.00 . A A . 16 HIS HB3 1 1 8 2903 1 1 16 HIS HD1 H -3.177 1.013 -3.077 1.00 . A A . 16 HIS HD1 1 1 8 2904 1 1 16 HIS HD2 H 0.113 -1.316 -2.046 1.00 . A A . 16 HIS HD2 1 1 8 2905 1 1 16 HIS HE1 H -2.248 0.148 -5.249 1.00 . A A . 16 HIS HE1 1 1 8 2906 1 1 16 HIS HE2 H -0.159 -1.111 -4.616 1.00 . A A . 16 HIS HE2 1 1 8 2907 1 1 16 HIS N N -0.367 2.116 -0.245 1.00 . A A . 16 HIS N 1 1 8 2908 1 1 16 HIS ND1 N -2.394 0.412 -3.131 1.00 . A A . 16 HIS ND1 1 1 8 2909 1 1 16 HIS NE2 N -0.821 -0.781 -3.957 1.00 . A A . 16 HIS NE2 1 1 8 2910 1 1 16 HIS O O -3.678 1.894 1.161 1.00 . A A . 16 HIS O 1 1 8 2911 1 1 17 LYS C C -3.029 2.039 3.965 1.00 . A A . 17 LYS C 1 1 8 2912 1 1 17 LYS CA C -2.236 3.131 3.254 1.00 . A A . 17 LYS CA 1 1 8 2913 1 1 17 LYS CB C -3.106 4.380 3.090 1.00 . A A . 17 LYS CB 1 1 8 2914 1 1 17 LYS CD C -3.228 6.862 2.736 1.00 . A A . 17 LYS CD 1 1 8 2915 1 1 17 LYS CE C -2.443 8.143 2.504 1.00 . A A . 17 LYS CE 1 1 8 2916 1 1 17 LYS CG C -2.325 5.638 2.748 1.00 . A A . 17 LYS CG 1 1 8 2917 1 1 17 LYS H H -0.755 2.794 1.779 1.00 . A A . 17 LYS H 1 1 8 2918 1 1 17 LYS HA H -1.389 3.385 3.873 1.00 . A A . 17 LYS HA 1 1 8 2919 1 1 17 LYS HB2 H -3.823 4.204 2.302 1.00 . A A . 17 LYS HB2 1 1 8 2920 1 1 17 LYS HB3 H -3.637 4.553 4.013 1.00 . A A . 17 LYS HB3 1 1 8 2921 1 1 17 LYS HD2 H -3.956 6.751 1.946 1.00 . A A . 17 LYS HD2 1 1 8 2922 1 1 17 LYS HD3 H -3.736 6.929 3.687 1.00 . A A . 17 LYS HD3 1 1 8 2923 1 1 17 LYS HE2 H -3.110 8.983 2.615 1.00 . A A . 17 LYS HE2 1 1 8 2924 1 1 17 LYS HE3 H -1.660 8.208 3.246 1.00 . A A . 17 LYS HE3 1 1 8 2925 1 1 17 LYS HG2 H -1.547 5.782 3.485 1.00 . A A . 17 LYS HG2 1 1 8 2926 1 1 17 LYS HG3 H -1.880 5.519 1.771 1.00 . A A . 17 LYS HG3 1 1 8 2927 1 1 17 LYS HZ1 H -2.573 8.200 0.416 1.00 . A A . 17 LYS HZ1 1 1 8 2928 1 1 17 LYS HZ2 H -1.222 7.360 0.997 1.00 . A A . 17 LYS HZ2 1 1 8 2929 1 1 17 LYS HZ3 H -1.251 9.054 1.049 1.00 . A A . 17 LYS HZ3 1 1 8 2930 1 1 17 LYS N N -1.711 2.681 1.958 1.00 . A A . 17 LYS N 1 1 8 2931 1 1 17 LYS NZ N -1.832 8.193 1.149 1.00 . A A . 17 LYS NZ 1 1 8 2932 1 1 17 LYS O O -4.187 2.246 4.338 1.00 . A A . 17 LYS O 1 1 8 2933 1 1 18 ASP C C -4.262 -0.741 4.145 1.00 . A A . 18 ASP C 1 1 8 2934 1 1 18 ASP CA C -3.000 -0.257 4.834 1.00 . A A . 18 ASP CA 1 1 8 2935 1 1 18 ASP CB C -3.334 0.108 6.281 1.00 . A A . 18 ASP CB 1 1 8 2936 1 1 18 ASP CG C -2.120 0.237 7.174 1.00 . A A . 18 ASP CG 1 1 8 2937 1 1 18 ASP H H -1.502 0.775 3.773 1.00 . A A . 18 ASP H 1 1 8 2938 1 1 18 ASP HA H -2.283 -1.062 4.836 1.00 . A A . 18 ASP HA 1 1 8 2939 1 1 18 ASP HB2 H -3.861 1.049 6.292 1.00 . A A . 18 ASP HB2 1 1 8 2940 1 1 18 ASP HB3 H -3.970 -0.655 6.686 1.00 . A A . 18 ASP HB3 1 1 8 2941 1 1 18 ASP N N -2.400 0.875 4.131 1.00 . A A . 18 ASP N 1 1 8 2942 1 1 18 ASP O O -4.997 -1.562 4.695 1.00 . A A . 18 ASP O 1 1 8 2943 1 1 18 ASP OD1 O -1.523 1.330 7.231 1.00 . A A . 18 ASP OD1 1 1 8 2944 1 1 18 ASP OD2 O -1.773 -0.755 7.849 1.00 . A A . 18 ASP OD2 1 1 8 2945 1 1 19 VAL C C -6.916 -0.005 3.002 1.00 . A A . 19 VAL C 1 1 8 2946 1 1 19 VAL CA C -5.720 -0.525 2.212 1.00 . A A . 19 VAL CA 1 1 8 2947 1 1 19 VAL CB C -5.883 -2.025 1.907 1.00 . A A . 19 VAL CB 1 1 8 2948 1 1 19 VAL CG1 C -7.184 -2.291 1.173 1.00 . A A . 19 VAL CG1 1 1 8 2949 1 1 19 VAL CG2 C -4.705 -2.532 1.089 1.00 . A A . 19 VAL CG2 1 1 8 2950 1 1 19 VAL H H -3.829 0.343 2.528 1.00 . A A . 19 VAL H 1 1 8 2951 1 1 19 VAL HA H -5.670 0.008 1.273 1.00 . A A . 19 VAL HA 1 1 8 2952 1 1 19 VAL HB H -5.904 -2.553 2.845 1.00 . A A . 19 VAL HB 1 1 8 2953 1 1 19 VAL HG11 H -7.184 -1.746 0.240 1.00 . A A . 19 VAL HG11 1 1 8 2954 1 1 19 VAL HG12 H -8.012 -1.964 1.780 1.00 . A A . 19 VAL HG12 1 1 8 2955 1 1 19 VAL HG13 H -7.274 -3.347 0.975 1.00 . A A . 19 VAL HG13 1 1 8 2956 1 1 19 VAL HG21 H -4.813 -3.593 0.915 1.00 . A A . 19 VAL HG21 1 1 8 2957 1 1 19 VAL HG22 H -3.786 -2.345 1.623 1.00 . A A . 19 VAL HG22 1 1 8 2958 1 1 19 VAL HG23 H -4.684 -2.014 0.140 1.00 . A A . 19 VAL HG23 1 1 8 2959 1 1 19 VAL N N -4.496 -0.245 2.935 1.00 . A A . 19 VAL N 1 1 8 2960 1 1 19 VAL O O -7.656 -0.758 3.636 1.00 . A A . 19 VAL O 1 1 8 2961 1 1 20 ILE C C -9.332 2.075 2.676 1.00 . A A . 20 ILE C 1 1 8 2962 1 1 20 ILE CA C -8.163 1.975 3.655 1.00 . A A . 20 ILE CA 1 1 8 2963 1 1 20 ILE CB C -7.756 3.380 4.154 1.00 . A A . 20 ILE CB 1 1 8 2964 1 1 20 ILE CD1 C -9.193 3.211 6.254 1.00 . A A . 20 ILE CD1 1 1 8 2965 1 1 20 ILE CG1 C -8.866 4.000 5.004 1.00 . A A . 20 ILE CG1 1 1 8 2966 1 1 20 ILE CG2 C -7.414 4.283 2.978 1.00 . A A . 20 ILE CG2 1 1 8 2967 1 1 20 ILE H H -6.348 1.845 2.581 1.00 . A A . 20 ILE H 1 1 8 2968 1 1 20 ILE HA H -8.463 1.387 4.506 1.00 . A A . 20 ILE HA 1 1 8 2969 1 1 20 ILE HB H -6.868 3.272 4.761 1.00 . A A . 20 ILE HB 1 1 8 2970 1 1 20 ILE HD11 H -9.979 3.710 6.800 1.00 . A A . 20 ILE HD11 1 1 8 2971 1 1 20 ILE HD12 H -8.312 3.141 6.875 1.00 . A A . 20 ILE HD12 1 1 8 2972 1 1 20 ILE HD13 H -9.521 2.220 5.979 1.00 . A A . 20 ILE HD13 1 1 8 2973 1 1 20 ILE HG12 H -8.563 4.985 5.309 1.00 . A A . 20 ILE HG12 1 1 8 2974 1 1 20 ILE HG13 H -9.768 4.072 4.413 1.00 . A A . 20 ILE HG13 1 1 8 2975 1 1 20 ILE HG21 H -8.278 4.381 2.338 1.00 . A A . 20 ILE HG21 1 1 8 2976 1 1 20 ILE HG22 H -6.601 3.847 2.417 1.00 . A A . 20 ILE HG22 1 1 8 2977 1 1 20 ILE HG23 H -7.120 5.255 3.344 1.00 . A A . 20 ILE HG23 1 1 8 2978 1 1 20 ILE N N -7.043 1.308 3.008 1.00 . A A . 20 ILE N 1 1 8 2979 1 1 20 ILE O O -10.482 2.299 3.060 1.00 . A A . 20 ILE O 1 1 8 2980 1 1 21 TRP C C -10.803 0.645 0.220 1.00 . A A . 21 TRP C 1 1 8 2981 1 1 21 TRP CA C -10.001 1.940 0.331 1.00 . A A . 21 TRP CA 1 1 8 2982 1 1 21 TRP CB C -9.301 2.259 -0.994 1.00 . A A . 21 TRP CB 1 1 8 2983 1 1 21 TRP CD1 C -6.751 2.293 -0.734 1.00 . A A . 21 TRP CD1 1 1 8 2984 1 1 21 TRP CD2 C -7.547 0.393 -1.609 1.00 . A A . 21 TRP CD2 1 1 8 2985 1 1 21 TRP CE2 C -6.147 0.295 -1.516 1.00 . A A . 21 TRP CE2 1 1 8 2986 1 1 21 TRP CE3 C -8.259 -0.685 -2.133 1.00 . A A . 21 TRP CE3 1 1 8 2987 1 1 21 TRP CG C -7.917 1.683 -1.101 1.00 . A A . 21 TRP CG 1 1 8 2988 1 1 21 TRP CH2 C -6.175 -1.878 -2.434 1.00 . A A . 21 TRP CH2 1 1 8 2989 1 1 21 TRP CZ2 C -5.451 -0.838 -1.925 1.00 . A A . 21 TRP CZ2 1 1 8 2990 1 1 21 TRP CZ3 C -7.568 -1.811 -2.539 1.00 . A A . 21 TRP CZ3 1 1 8 2991 1 1 21 TRP H H -8.094 1.639 1.181 1.00 . A A . 21 TRP H 1 1 8 2992 1 1 21 TRP HA H -10.680 2.746 0.567 1.00 . A A . 21 TRP HA 1 1 8 2993 1 1 21 TRP HB2 H -9.889 1.863 -1.806 1.00 . A A . 21 TRP HB2 1 1 8 2994 1 1 21 TRP HB3 H -9.227 3.332 -1.102 1.00 . A A . 21 TRP HB3 1 1 8 2995 1 1 21 TRP HD1 H -6.690 3.283 -0.309 1.00 . A A . 21 TRP HD1 1 1 8 2996 1 1 21 TRP HE1 H -4.747 1.679 -0.792 1.00 . A A . 21 TRP HE1 1 1 8 2997 1 1 21 TRP HE3 H -9.332 -0.650 -2.218 1.00 . A A . 21 TRP HE3 1 1 8 2998 1 1 21 TRP HH2 H -5.675 -2.776 -2.766 1.00 . A A . 21 TRP HH2 1 1 8 2999 1 1 21 TRP HZ2 H -4.375 -0.906 -1.850 1.00 . A A . 21 TRP HZ2 1 1 8 3000 1 1 21 TRP HZ3 H -8.105 -2.653 -2.949 1.00 . A A . 21 TRP HZ3 1 1 8 3001 1 1 21 TRP N N -9.020 1.863 1.405 1.00 . A A . 21 TRP N 1 1 8 3002 1 1 21 TRP NE1 N -5.687 1.463 -0.973 1.00 . A A . 21 TRP NE1 1 1 8 3003 1 1 21 TRP O O -10.913 0.046 -0.852 1.00 . A A . 21 TRP O 1 1 8 3004 1 1 22 VAL C C -13.619 -0.686 0.980 1.00 . A A . 22 VAL C 1 1 8 3005 1 1 22 VAL CA C -12.190 -0.984 1.400 1.00 . A A . 22 VAL CA 1 1 8 3006 1 1 22 VAL CB C -12.196 -1.571 2.825 1.00 . A A . 22 VAL CB 1 1 8 3007 1 1 22 VAL CG1 C -12.426 -3.075 2.800 1.00 . A A . 22 VAL CG1 1 1 8 3008 1 1 22 VAL CG2 C -10.905 -1.225 3.537 1.00 . A A . 22 VAL CG2 1 1 8 3009 1 1 22 VAL H H -11.280 0.776 2.152 1.00 . A A . 22 VAL H 1 1 8 3010 1 1 22 VAL HA H -11.763 -1.705 0.724 1.00 . A A . 22 VAL HA 1 1 8 3011 1 1 22 VAL HB H -13.009 -1.118 3.372 1.00 . A A . 22 VAL HB 1 1 8 3012 1 1 22 VAL HG11 H -11.650 -3.549 2.217 1.00 . A A . 22 VAL HG11 1 1 8 3013 1 1 22 VAL HG12 H -13.388 -3.283 2.357 1.00 . A A . 22 VAL HG12 1 1 8 3014 1 1 22 VAL HG13 H -12.404 -3.460 3.810 1.00 . A A . 22 VAL HG13 1 1 8 3015 1 1 22 VAL HG21 H -10.759 -0.154 3.495 1.00 . A A . 22 VAL HG21 1 1 8 3016 1 1 22 VAL HG22 H -10.081 -1.720 3.049 1.00 . A A . 22 VAL HG22 1 1 8 3017 1 1 22 VAL HG23 H -10.962 -1.542 4.566 1.00 . A A . 22 VAL HG23 1 1 8 3018 1 1 22 VAL N N -11.390 0.237 1.337 1.00 . A A . 22 VAL N 1 1 8 3019 1 1 22 VAL O O -14.539 -1.469 1.214 1.00 . A A . 22 VAL O 1 1 8 3020 1 1 23 ASN C C -15.949 1.343 1.070 1.00 . A A . 23 ASN C 1 1 8 3021 1 1 23 ASN CA C -15.052 0.986 -0.108 1.00 . A A . 23 ASN CA 1 1 8 3022 1 1 23 ASN CB C -15.729 -0.015 -1.048 1.00 . A A . 23 ASN CB 1 1 8 3023 1 1 23 ASN CG C -14.936 -0.236 -2.328 1.00 . A A . 23 ASN CG 1 1 8 3024 1 1 23 ASN H H -12.971 1.026 0.242 1.00 . A A . 23 ASN H 1 1 8 3025 1 1 23 ASN HA H -14.846 1.893 -0.662 1.00 . A A . 23 ASN HA 1 1 8 3026 1 1 23 ASN HB2 H -15.837 -0.963 -0.545 1.00 . A A . 23 ASN HB2 1 1 8 3027 1 1 23 ASN HB3 H -16.703 0.362 -1.311 1.00 . A A . 23 ASN HB3 1 1 8 3028 1 1 23 ASN HD21 H -14.261 1.634 -2.285 1.00 . A A . 23 ASN HD21 1 1 8 3029 1 1 23 ASN HD22 H -13.716 0.667 -3.610 1.00 . A A . 23 ASN HD22 1 1 8 3030 1 1 23 ASN N N -13.769 0.478 0.371 1.00 . A A . 23 ASN N 1 1 8 3031 1 1 23 ASN ND2 N -14.234 0.792 -2.786 1.00 . A A . 23 ASN ND2 1 1 8 3032 1 1 23 ASN O O -17.156 1.540 0.928 1.00 . A A . 23 ASN O 1 1 8 3033 1 1 23 ASN OD1 O -14.955 -1.324 -2.904 1.00 . A A . 23 ASN OD1 1 1 8 3034 1 1 24 ARG C C -14.903 2.330 4.427 1.00 . A A . 24 ARG C 1 1 8 3035 1 1 24 ARG CA C -15.975 1.873 3.450 1.00 . A A . 24 ARG CA 1 1 8 3036 1 1 24 ARG CB C -16.834 0.739 4.045 1.00 . A A . 24 ARG CB 1 1 8 3037 1 1 24 ARG CD C -15.451 -0.391 5.840 1.00 . A A . 24 ARG CD 1 1 8 3038 1 1 24 ARG CG C -16.063 -0.517 4.449 1.00 . A A . 24 ARG CG 1 1 8 3039 1 1 24 ARG CZ C -13.959 -1.675 7.330 1.00 . A A . 24 ARG CZ 1 1 8 3040 1 1 24 ARG H H -14.366 1.230 2.266 1.00 . A A . 24 ARG H 1 1 8 3041 1 1 24 ARG HA H -16.610 2.714 3.209 1.00 . A A . 24 ARG HA 1 1 8 3042 1 1 24 ARG HB2 H -17.338 1.115 4.922 1.00 . A A . 24 ARG HB2 1 1 8 3043 1 1 24 ARG HB3 H -17.579 0.454 3.314 1.00 . A A . 24 ARG HB3 1 1 8 3044 1 1 24 ARG HD2 H -14.781 0.456 5.847 1.00 . A A . 24 ARG HD2 1 1 8 3045 1 1 24 ARG HD3 H -16.245 -0.226 6.552 1.00 . A A . 24 ARG HD3 1 1 8 3046 1 1 24 ARG HE H -14.777 -2.372 5.634 1.00 . A A . 24 ARG HE 1 1 8 3047 1 1 24 ARG HG2 H -16.740 -1.358 4.444 1.00 . A A . 24 ARG HG2 1 1 8 3048 1 1 24 ARG HG3 H -15.272 -0.687 3.732 1.00 . A A . 24 ARG HG3 1 1 8 3049 1 1 24 ARG HH11 H -14.279 0.245 7.927 1.00 . A A . 24 ARG HH11 1 1 8 3050 1 1 24 ARG HH12 H -13.272 -0.707 8.979 1.00 . A A . 24 ARG HH12 1 1 8 3051 1 1 24 ARG HH21 H -13.414 -3.605 7.010 1.00 . A A . 24 ARG HH21 1 1 8 3052 1 1 24 ARG HH22 H -12.761 -2.872 8.443 1.00 . A A . 24 ARG HH22 1 1 8 3053 1 1 24 ARG N N -15.321 1.446 2.230 1.00 . A A . 24 ARG N 1 1 8 3054 1 1 24 ARG NE N -14.706 -1.587 6.227 1.00 . A A . 24 ARG NE 1 1 8 3055 1 1 24 ARG NH1 N -13.823 -0.630 8.139 1.00 . A A . 24 ARG NH1 1 1 8 3056 1 1 24 ARG NH2 N -13.330 -2.807 7.617 1.00 . A A . 24 ARG NH2 1 1 8 3057 1 1 24 ARG O O -13.750 1.909 4.318 1.00 . A A . 24 ARG O 1 1 8 3058 1 1 25 ASN C C -14.633 3.075 7.694 1.00 . A A . 25 ASN C 1 1 8 3059 1 1 25 ASN CA C -14.313 3.672 6.336 1.00 . A A . 25 ASN CA 1 1 8 3060 1 1 25 ASN CB C -14.333 5.196 6.418 1.00 . A A . 25 ASN CB 1 1 8 3061 1 1 25 ASN CG C -13.139 5.738 7.178 1.00 . A A . 25 ASN CG 1 1 8 3062 1 1 25 ASN H H -16.198 3.508 5.389 1.00 . A A . 25 ASN H 1 1 8 3063 1 1 25 ASN HA H -13.328 3.347 6.037 1.00 . A A . 25 ASN HA 1 1 8 3064 1 1 25 ASN HB2 H -14.319 5.609 5.420 1.00 . A A . 25 ASN HB2 1 1 8 3065 1 1 25 ASN HB3 H -15.233 5.511 6.923 1.00 . A A . 25 ASN HB3 1 1 8 3066 1 1 25 ASN HD21 H -14.136 5.628 8.892 1.00 . A A . 25 ASN HD21 1 1 8 3067 1 1 25 ASN HD22 H -12.508 6.222 8.999 1.00 . A A . 25 ASN HD22 1 1 8 3068 1 1 25 ASN N N -15.266 3.191 5.355 1.00 . A A . 25 ASN N 1 1 8 3069 1 1 25 ASN ND2 N -13.276 5.877 8.487 1.00 . A A . 25 ASN ND2 1 1 8 3070 1 1 25 ASN O O -14.042 2.034 8.039 1.00 . A A . 25 ASN O 1 1 8 3071 1 1 25 ASN OXT O -15.495 3.635 8.397 1.00 . A A . 25 ASN OXT 1 1 8 3072 1 1 25 ASN OD1 O -12.098 6.028 6.590 1.00 . A A . 25 ASN OD1 1 1 9 3073 1 1 1 CYS C C 4.654 5.340 -4.700 1.00 . A A . 1 CYS C 1 1 9 3074 1 1 1 CYS CA C 3.257 5.714 -4.209 1.00 . A A . 1 CYS CA 1 1 9 3075 1 1 1 CYS CB C 2.724 4.665 -3.223 1.00 . A A . 1 CYS CB 1 1 9 3076 1 1 1 CYS H1 H 2.269 4.955 -5.881 1.00 . A A . 1 CYS H1 1 1 9 3077 1 1 1 CYS H2 H 2.680 6.598 -5.998 1.00 . A A . 1 CYS H2 1 1 9 3078 1 1 1 CYS H3 H 1.383 6.119 -5.016 1.00 . A A . 1 CYS H3 1 1 9 3079 1 1 1 CYS HA H 3.313 6.670 -3.707 1.00 . A A . 1 CYS HA 1 1 9 3080 1 1 1 CYS HB2 H 3.453 4.519 -2.439 1.00 . A A . 1 CYS HB2 1 1 9 3081 1 1 1 CYS HB3 H 1.806 5.030 -2.786 1.00 . A A . 1 CYS HB3 1 1 9 3082 1 1 1 CYS N N 2.334 5.855 -5.353 1.00 . A A . 1 CYS N 1 1 9 3083 1 1 1 CYS O O 4.842 4.316 -5.358 1.00 . A A . 1 CYS O 1 1 9 3084 1 1 1 CYS SG S 2.376 3.028 -3.954 1.00 . A A . 1 CYS SG 1 1 9 3085 1 1 2 SER C C 7.762 5.099 -3.837 1.00 . A A . 2 SER C 1 1 9 3086 1 1 2 SER CA C 7.000 5.968 -4.828 1.00 . A A . 2 SER CA 1 1 9 3087 1 1 2 SER CB C 7.717 7.310 -5.006 1.00 . A A . 2 SER CB 1 1 9 3088 1 1 2 SER H H 5.425 6.971 -3.830 1.00 . A A . 2 SER H 1 1 9 3089 1 1 2 SER HA H 6.965 5.461 -5.781 1.00 . A A . 2 SER HA 1 1 9 3090 1 1 2 SER HB2 H 7.680 7.860 -4.076 1.00 . A A . 2 SER HB2 1 1 9 3091 1 1 2 SER HB3 H 8.749 7.130 -5.275 1.00 . A A . 2 SER HB3 1 1 9 3092 1 1 2 SER HG H 7.797 8.520 -6.550 1.00 . A A . 2 SER HG 1 1 9 3093 1 1 2 SER N N 5.630 6.182 -4.387 1.00 . A A . 2 SER N 1 1 9 3094 1 1 2 SER O O 8.141 5.551 -2.756 1.00 . A A . 2 SER O 1 1 9 3095 1 1 2 SER OG O 7.107 8.089 -6.023 1.00 . A A . 2 SER OG 1 1 9 3096 1 1 3 CYS C C 10.185 2.923 -3.877 1.00 . A A . 3 CYS C 1 1 9 3097 1 1 3 CYS CA C 8.744 2.941 -3.386 1.00 . A A . 3 CYS CA 1 1 9 3098 1 1 3 CYS CB C 8.122 1.542 -3.422 1.00 . A A . 3 CYS CB 1 1 9 3099 1 1 3 CYS H H 7.589 3.521 -5.048 1.00 . A A . 3 CYS H 1 1 9 3100 1 1 3 CYS HA H 8.726 3.309 -2.371 1.00 . A A . 3 CYS HA 1 1 9 3101 1 1 3 CYS HB2 H 8.116 1.180 -4.440 1.00 . A A . 3 CYS HB2 1 1 9 3102 1 1 3 CYS HB3 H 8.712 0.879 -2.810 1.00 . A A . 3 CYS HB3 1 1 9 3103 1 1 3 CYS N N 7.968 3.847 -4.200 1.00 . A A . 3 CYS N 1 1 9 3104 1 1 3 CYS O O 10.518 2.243 -4.841 1.00 . A A . 3 CYS O 1 1 9 3105 1 1 3 CYS SG S 6.405 1.505 -2.799 1.00 . A A . 3 CYS SG 1 1 9 3106 1 1 4 THR C C 13.335 3.324 -2.565 1.00 . A A . 4 THR C 1 1 9 3107 1 1 4 THR CA C 12.410 3.852 -3.641 1.00 . A A . 4 THR CA 1 1 9 3108 1 1 4 THR CB C 12.747 5.320 -3.927 1.00 . A A . 4 THR CB 1 1 9 3109 1 1 4 THR CG2 C 14.112 5.453 -4.590 1.00 . A A . 4 THR CG2 1 1 9 3110 1 1 4 THR H H 10.728 4.164 -2.416 1.00 . A A . 4 THR H 1 1 9 3111 1 1 4 THR HA H 12.555 3.291 -4.543 1.00 . A A . 4 THR HA 1 1 9 3112 1 1 4 THR HB H 12.763 5.847 -2.994 1.00 . A A . 4 THR HB 1 1 9 3113 1 1 4 THR HG1 H 11.484 5.242 -5.450 1.00 . A A . 4 THR HG1 1 1 9 3114 1 1 4 THR HG21 H 14.320 6.495 -4.786 1.00 . A A . 4 THR HG21 1 1 9 3115 1 1 4 THR HG22 H 14.113 4.906 -5.521 1.00 . A A . 4 THR HG22 1 1 9 3116 1 1 4 THR HG23 H 14.871 5.050 -3.936 1.00 . A A . 4 THR HG23 1 1 9 3117 1 1 4 THR N N 11.032 3.698 -3.221 1.00 . A A . 4 THR N 1 1 9 3118 1 1 4 THR O O 13.242 3.741 -1.408 1.00 . A A . 4 THR O 1 1 9 3119 1 1 4 THR OG1 O 11.746 5.893 -4.777 1.00 . A A . 4 THR OG1 1 1 9 3120 1 1 5 ASP C C 14.365 0.955 -0.969 1.00 . A A . 5 ASP C 1 1 9 3121 1 1 5 ASP CA C 15.132 1.743 -2.027 1.00 . A A . 5 ASP CA 1 1 9 3122 1 1 5 ASP CB C 16.046 2.799 -1.388 1.00 . A A . 5 ASP CB 1 1 9 3123 1 1 5 ASP CG C 17.184 2.193 -0.598 1.00 . A A . 5 ASP CG 1 1 9 3124 1 1 5 ASP H H 14.192 2.098 -3.888 1.00 . A A . 5 ASP H 1 1 9 3125 1 1 5 ASP HA H 15.734 1.053 -2.598 1.00 . A A . 5 ASP HA 1 1 9 3126 1 1 5 ASP HB2 H 16.467 3.416 -2.168 1.00 . A A . 5 ASP HB2 1 1 9 3127 1 1 5 ASP HB3 H 15.460 3.418 -0.724 1.00 . A A . 5 ASP HB3 1 1 9 3128 1 1 5 ASP N N 14.191 2.379 -2.947 1.00 . A A . 5 ASP N 1 1 9 3129 1 1 5 ASP O O 14.892 0.573 0.075 1.00 . A A . 5 ASP O 1 1 9 3130 1 1 5 ASP OD1 O 17.963 1.413 -1.182 1.00 . A A . 5 ASP OD1 1 1 9 3131 1 1 5 ASP OD2 O 17.321 2.511 0.603 1.00 . A A . 5 ASP OD2 1 1 9 3132 1 1 6 MET C C 11.831 -1.352 -0.902 1.00 . A A . 6 MET C 1 1 9 3133 1 1 6 MET CA C 12.216 0.020 -0.363 1.00 . A A . 6 MET CA 1 1 9 3134 1 1 6 MET CB C 10.986 0.895 -0.147 1.00 . A A . 6 MET CB 1 1 9 3135 1 1 6 MET CE C 8.403 2.472 0.167 1.00 . A A . 6 MET CE 1 1 9 3136 1 1 6 MET CG C 10.074 0.403 0.948 1.00 . A A . 6 MET CG 1 1 9 3137 1 1 6 MET H H 12.777 0.935 -2.164 1.00 . A A . 6 MET H 1 1 9 3138 1 1 6 MET HA H 12.732 -0.104 0.576 1.00 . A A . 6 MET HA 1 1 9 3139 1 1 6 MET HB2 H 11.307 1.891 0.106 1.00 . A A . 6 MET HB2 1 1 9 3140 1 1 6 MET HB3 H 10.422 0.931 -1.067 1.00 . A A . 6 MET HB3 1 1 9 3141 1 1 6 MET HE1 H 7.808 1.753 -0.377 1.00 . A A . 6 MET HE1 1 1 9 3142 1 1 6 MET HE2 H 9.221 2.803 -0.454 1.00 . A A . 6 MET HE2 1 1 9 3143 1 1 6 MET HE3 H 7.789 3.318 0.436 1.00 . A A . 6 MET HE3 1 1 9 3144 1 1 6 MET HG2 H 9.431 -0.363 0.547 1.00 . A A . 6 MET HG2 1 1 9 3145 1 1 6 MET HG3 H 10.687 -0.012 1.726 1.00 . A A . 6 MET HG3 1 1 9 3146 1 1 6 MET N N 13.110 0.683 -1.281 1.00 . A A . 6 MET N 1 1 9 3147 1 1 6 MET O O 11.427 -1.487 -2.057 1.00 . A A . 6 MET O 1 1 9 3148 1 1 6 MET SD S 9.051 1.711 1.651 1.00 . A A . 6 MET SD 1 1 9 3149 1 1 7 SER C C 10.350 -4.189 -0.426 1.00 . A A . 7 SER C 1 1 9 3150 1 1 7 SER CA C 11.804 -3.738 -0.478 1.00 . A A . 7 SER CA 1 1 9 3151 1 1 7 SER CB C 12.666 -4.641 0.399 1.00 . A A . 7 SER CB 1 1 9 3152 1 1 7 SER H H 12.131 -2.174 0.883 1.00 . A A . 7 SER H 1 1 9 3153 1 1 7 SER HA H 12.154 -3.808 -1.496 1.00 . A A . 7 SER HA 1 1 9 3154 1 1 7 SER HB2 H 12.305 -4.605 1.415 1.00 . A A . 7 SER HB2 1 1 9 3155 1 1 7 SER HB3 H 12.610 -5.655 0.031 1.00 . A A . 7 SER HB3 1 1 9 3156 1 1 7 SER HG H 14.086 -3.316 0.719 1.00 . A A . 7 SER HG 1 1 9 3157 1 1 7 SER N N 11.951 -2.361 -0.056 1.00 . A A . 7 SER N 1 1 9 3158 1 1 7 SER O O 9.786 -4.331 0.652 1.00 . A A . 7 SER O 1 1 9 3159 1 1 7 SER OG O 14.021 -4.222 0.379 1.00 . A A . 7 SER OG 1 1 9 3160 1 1 8 ASP C C 7.465 -4.904 -0.738 1.00 . A A . 8 ASP C 1 1 9 3161 1 1 8 ASP CA C 8.456 -4.946 -1.896 1.00 . A A . 8 ASP CA 1 1 9 3162 1 1 8 ASP CB C 8.644 -6.397 -2.349 1.00 . A A . 8 ASP CB 1 1 9 3163 1 1 8 ASP CG C 9.275 -6.505 -3.723 1.00 . A A . 8 ASP CG 1 1 9 3164 1 1 8 ASP H H 10.268 -3.967 -2.388 1.00 . A A . 8 ASP H 1 1 9 3165 1 1 8 ASP HA H 8.020 -4.401 -2.718 1.00 . A A . 8 ASP HA 1 1 9 3166 1 1 8 ASP HB2 H 9.281 -6.907 -1.642 1.00 . A A . 8 ASP HB2 1 1 9 3167 1 1 8 ASP HB3 H 7.682 -6.886 -2.374 1.00 . A A . 8 ASP HB3 1 1 9 3168 1 1 8 ASP N N 9.771 -4.317 -1.622 1.00 . A A . 8 ASP N 1 1 9 3169 1 1 8 ASP O O 6.528 -4.108 -0.744 1.00 . A A . 8 ASP O 1 1 9 3170 1 1 8 ASP OD1 O 8.539 -6.416 -4.727 1.00 . A A . 8 ASP OD1 1 1 9 3171 1 1 8 ASP OD2 O 10.510 -6.676 -3.801 1.00 . A A . 8 ASP OD2 1 1 9 3172 1 1 9 LEU C C 6.590 -4.548 2.074 1.00 . A A . 9 LEU C 1 1 9 3173 1 1 9 LEU CA C 6.766 -5.894 1.379 1.00 . A A . 9 LEU CA 1 1 9 3174 1 1 9 LEU CB C 7.300 -6.933 2.368 1.00 . A A . 9 LEU CB 1 1 9 3175 1 1 9 LEU CD1 C 5.079 -7.718 3.232 1.00 . A A . 9 LEU CD1 1 1 9 3176 1 1 9 LEU CD2 C 7.145 -8.085 4.583 1.00 . A A . 9 LEU CD2 1 1 9 3177 1 1 9 LEU CG C 6.439 -7.154 3.612 1.00 . A A . 9 LEU CG 1 1 9 3178 1 1 9 LEU H H 8.477 -6.337 0.204 1.00 . A A . 9 LEU H 1 1 9 3179 1 1 9 LEU HA H 5.807 -6.224 1.009 1.00 . A A . 9 LEU HA 1 1 9 3180 1 1 9 LEU HB2 H 7.396 -7.878 1.852 1.00 . A A . 9 LEU HB2 1 1 9 3181 1 1 9 LEU HB3 H 8.280 -6.619 2.690 1.00 . A A . 9 LEU HB3 1 1 9 3182 1 1 9 LEU HD11 H 4.577 -7.030 2.568 1.00 . A A . 9 LEU HD11 1 1 9 3183 1 1 9 LEU HD12 H 4.487 -7.856 4.125 1.00 . A A . 9 LEU HD12 1 1 9 3184 1 1 9 LEU HD13 H 5.210 -8.669 2.736 1.00 . A A . 9 LEU HD13 1 1 9 3185 1 1 9 LEU HD21 H 6.531 -8.223 5.460 1.00 . A A . 9 LEU HD21 1 1 9 3186 1 1 9 LEU HD22 H 8.093 -7.651 4.870 1.00 . A A . 9 LEU HD22 1 1 9 3187 1 1 9 LEU HD23 H 7.316 -9.039 4.106 1.00 . A A . 9 LEU HD23 1 1 9 3188 1 1 9 LEU HG H 6.281 -6.207 4.105 1.00 . A A . 9 LEU HG 1 1 9 3189 1 1 9 LEU N N 7.670 -5.774 0.240 1.00 . A A . 9 LEU N 1 1 9 3190 1 1 9 LEU O O 5.470 -4.139 2.373 1.00 . A A . 9 LEU O 1 1 9 3191 1 1 10 GLU C C 6.945 -1.525 2.075 1.00 . A A . 10 GLU C 1 1 9 3192 1 1 10 GLU CA C 7.670 -2.547 2.953 1.00 . A A . 10 GLU CA 1 1 9 3193 1 1 10 GLU CB C 9.095 -2.077 3.262 1.00 . A A . 10 GLU CB 1 1 9 3194 1 1 10 GLU CD C 8.586 -1.663 5.692 1.00 . A A . 10 GLU CD 1 1 9 3195 1 1 10 GLU CG C 9.166 -1.089 4.415 1.00 . A A . 10 GLU CG 1 1 9 3196 1 1 10 GLU H H 8.566 -4.220 1.997 1.00 . A A . 10 GLU H 1 1 9 3197 1 1 10 GLU HA H 7.127 -2.659 3.880 1.00 . A A . 10 GLU HA 1 1 9 3198 1 1 10 GLU HB2 H 9.704 -2.934 3.509 1.00 . A A . 10 GLU HB2 1 1 9 3199 1 1 10 GLU HB3 H 9.504 -1.599 2.383 1.00 . A A . 10 GLU HB3 1 1 9 3200 1 1 10 GLU HG2 H 10.200 -0.831 4.589 1.00 . A A . 10 GLU HG2 1 1 9 3201 1 1 10 GLU HG3 H 8.611 -0.200 4.152 1.00 . A A . 10 GLU HG3 1 1 9 3202 1 1 10 GLU N N 7.700 -3.848 2.291 1.00 . A A . 10 GLU N 1 1 9 3203 1 1 10 GLU O O 6.288 -0.610 2.573 1.00 . A A . 10 GLU O 1 1 9 3204 1 1 10 GLU OE1 O 9.304 -2.397 6.400 1.00 . A A . 10 GLU OE1 1 1 9 3205 1 1 10 GLU OE2 O 7.400 -1.399 5.983 1.00 . A A . 10 GLU OE2 1 1 9 3206 1 1 11 CYS C C 4.845 -1.081 -0.013 1.00 . A A . 11 CYS C 1 1 9 3207 1 1 11 CYS CA C 6.338 -0.890 -0.205 1.00 . A A . 11 CYS CA 1 1 9 3208 1 1 11 CYS CB C 6.743 -1.287 -1.630 1.00 . A A . 11 CYS CB 1 1 9 3209 1 1 11 CYS H H 7.649 -2.422 0.436 1.00 . A A . 11 CYS H 1 1 9 3210 1 1 11 CYS HA H 6.582 0.149 -0.036 1.00 . A A . 11 CYS HA 1 1 9 3211 1 1 11 CYS HB2 H 7.789 -1.078 -1.768 1.00 . A A . 11 CYS HB2 1 1 9 3212 1 1 11 CYS HB3 H 6.573 -2.348 -1.749 1.00 . A A . 11 CYS HB3 1 1 9 3213 1 1 11 CYS N N 7.064 -1.706 0.763 1.00 . A A . 11 CYS N 1 1 9 3214 1 1 11 CYS O O 4.083 -0.118 0.011 1.00 . A A . 11 CYS O 1 1 9 3215 1 1 11 CYS SG S 5.833 -0.433 -2.959 1.00 . A A . 11 CYS SG 1 1 9 3216 1 1 12 MET C C 2.563 -2.106 1.714 1.00 . A A . 12 MET C 1 1 9 3217 1 1 12 MET CA C 3.032 -2.634 0.366 1.00 . A A . 12 MET CA 1 1 9 3218 1 1 12 MET CB C 2.771 -4.139 0.255 1.00 . A A . 12 MET CB 1 1 9 3219 1 1 12 MET CE C 3.418 -7.265 -0.067 1.00 . A A . 12 MET CE 1 1 9 3220 1 1 12 MET CG C 3.080 -4.711 -1.119 1.00 . A A . 12 MET CG 1 1 9 3221 1 1 12 MET H H 5.092 -3.063 0.150 1.00 . A A . 12 MET H 1 1 9 3222 1 1 12 MET HA H 2.479 -2.127 -0.410 1.00 . A A . 12 MET HA 1 1 9 3223 1 1 12 MET HB2 H 3.384 -4.656 0.981 1.00 . A A . 12 MET HB2 1 1 9 3224 1 1 12 MET HB3 H 1.732 -4.331 0.475 1.00 . A A . 12 MET HB3 1 1 9 3225 1 1 12 MET HE1 H 3.188 -6.850 0.904 1.00 . A A . 12 MET HE1 1 1 9 3226 1 1 12 MET HE2 H 4.473 -7.154 -0.266 1.00 . A A . 12 MET HE2 1 1 9 3227 1 1 12 MET HE3 H 3.158 -8.313 -0.080 1.00 . A A . 12 MET HE3 1 1 9 3228 1 1 12 MET HG2 H 2.617 -4.085 -1.868 1.00 . A A . 12 MET HG2 1 1 9 3229 1 1 12 MET HG3 H 4.150 -4.706 -1.263 1.00 . A A . 12 MET HG3 1 1 9 3230 1 1 12 MET N N 4.434 -2.330 0.162 1.00 . A A . 12 MET N 1 1 9 3231 1 1 12 MET O O 1.461 -1.586 1.826 1.00 . A A . 12 MET O 1 1 9 3232 1 1 12 MET SD S 2.477 -6.399 -1.323 1.00 . A A . 12 MET SD 1 1 9 3233 1 1 13 ASN C C 2.749 -0.219 4.022 1.00 . A A . 13 ASN C 1 1 9 3234 1 1 13 ASN CA C 3.082 -1.708 4.061 1.00 . A A . 13 ASN CA 1 1 9 3235 1 1 13 ASN CB C 4.240 -1.928 5.044 1.00 . A A . 13 ASN CB 1 1 9 3236 1 1 13 ASN CG C 4.526 -3.388 5.341 1.00 . A A . 13 ASN CG 1 1 9 3237 1 1 13 ASN H H 4.282 -2.648 2.581 1.00 . A A . 13 ASN H 1 1 9 3238 1 1 13 ASN HA H 2.216 -2.250 4.413 1.00 . A A . 13 ASN HA 1 1 9 3239 1 1 13 ASN HB2 H 5.136 -1.489 4.631 1.00 . A A . 13 ASN HB2 1 1 9 3240 1 1 13 ASN HB3 H 4.003 -1.431 5.973 1.00 . A A . 13 ASN HB3 1 1 9 3241 1 1 13 ASN HD21 H 6.415 -2.934 5.785 1.00 . A A . 13 ASN HD21 1 1 9 3242 1 1 13 ASN HD22 H 5.985 -4.609 5.921 1.00 . A A . 13 ASN HD22 1 1 9 3243 1 1 13 ASN N N 3.414 -2.211 2.727 1.00 . A A . 13 ASN N 1 1 9 3244 1 1 13 ASN ND2 N 5.765 -3.676 5.719 1.00 . A A . 13 ASN ND2 1 1 9 3245 1 1 13 ASN O O 1.847 0.244 4.715 1.00 . A A . 13 ASN O 1 1 9 3246 1 1 13 ASN OD1 O 3.643 -4.240 5.259 1.00 . A A . 13 ASN OD1 1 1 9 3247 1 1 14 PHE C C 2.309 2.422 2.110 1.00 . A A . 14 PHE C 1 1 9 3248 1 1 14 PHE CA C 3.334 1.977 3.159 1.00 . A A . 14 PHE CA 1 1 9 3249 1 1 14 PHE CB C 4.713 2.628 2.926 1.00 . A A . 14 PHE CB 1 1 9 3250 1 1 14 PHE CD1 C 5.002 2.871 0.439 1.00 . A A . 14 PHE CD1 1 1 9 3251 1 1 14 PHE CD2 C 4.775 4.848 1.751 1.00 . A A . 14 PHE CD2 1 1 9 3252 1 1 14 PHE CE1 C 5.100 3.639 -0.705 1.00 . A A . 14 PHE CE1 1 1 9 3253 1 1 14 PHE CE2 C 4.872 5.619 0.612 1.00 . A A . 14 PHE CE2 1 1 9 3254 1 1 14 PHE CG C 4.841 3.467 1.682 1.00 . A A . 14 PHE CG 1 1 9 3255 1 1 14 PHE CZ C 5.123 5.017 -0.609 1.00 . A A . 14 PHE CZ 1 1 9 3256 1 1 14 PHE H H 4.140 0.091 2.621 1.00 . A A . 14 PHE H 1 1 9 3257 1 1 14 PHE HA H 2.974 2.288 4.129 1.00 . A A . 14 PHE HA 1 1 9 3258 1 1 14 PHE HB2 H 4.940 3.267 3.766 1.00 . A A . 14 PHE HB2 1 1 9 3259 1 1 14 PHE HB3 H 5.458 1.847 2.875 1.00 . A A . 14 PHE HB3 1 1 9 3260 1 1 14 PHE HD1 H 5.054 1.793 0.371 1.00 . A A . 14 PHE HD1 1 1 9 3261 1 1 14 PHE HD2 H 4.650 5.323 2.712 1.00 . A A . 14 PHE HD2 1 1 9 3262 1 1 14 PHE HE1 H 5.226 3.163 -1.666 1.00 . A A . 14 PHE HE1 1 1 9 3263 1 1 14 PHE HE2 H 4.818 6.695 0.683 1.00 . A A . 14 PHE HE2 1 1 9 3264 1 1 14 PHE HZ H 5.232 5.615 -1.500 1.00 . A A . 14 PHE HZ 1 1 9 3265 1 1 14 PHE N N 3.479 0.527 3.202 1.00 . A A . 14 PHE N 1 1 9 3266 1 1 14 PHE O O 1.697 3.481 2.247 1.00 . A A . 14 PHE O 1 1 9 3267 1 1 15 CYS C C -0.203 1.429 0.226 1.00 . A A . 15 CYS C 1 1 9 3268 1 1 15 CYS CA C 1.198 2.004 0.000 1.00 . A A . 15 CYS CA 1 1 9 3269 1 1 15 CYS CB C 1.753 1.557 -1.357 1.00 . A A . 15 CYS CB 1 1 9 3270 1 1 15 CYS H H 2.604 0.774 1.010 1.00 . A A . 15 CYS H 1 1 9 3271 1 1 15 CYS HA H 1.126 3.082 0.005 1.00 . A A . 15 CYS HA 1 1 9 3272 1 1 15 CYS HB2 H 2.792 1.848 -1.424 1.00 . A A . 15 CYS HB2 1 1 9 3273 1 1 15 CYS HB3 H 1.682 0.482 -1.430 1.00 . A A . 15 CYS HB3 1 1 9 3274 1 1 15 CYS N N 2.111 1.621 1.072 1.00 . A A . 15 CYS N 1 1 9 3275 1 1 15 CYS O O -1.194 2.003 -0.219 1.00 . A A . 15 CYS O 1 1 9 3276 1 1 15 CYS SG S 0.885 2.268 -2.797 1.00 . A A . 15 CYS SG 1 1 9 3277 1 1 16 HIS C C -2.338 0.276 2.343 1.00 . A A . 16 HIS C 1 1 9 3278 1 1 16 HIS CA C -1.588 -0.340 1.168 1.00 . A A . 16 HIS CA 1 1 9 3279 1 1 16 HIS CB C -1.420 -1.846 1.398 1.00 . A A . 16 HIS CB 1 1 9 3280 1 1 16 HIS CD2 C -0.577 -2.337 -1.011 1.00 . A A . 16 HIS CD2 1 1 9 3281 1 1 16 HIS CE1 C -1.339 -4.380 -1.203 1.00 . A A . 16 HIS CE1 1 1 9 3282 1 1 16 HIS CG C -1.216 -2.642 0.144 1.00 . A A . 16 HIS CG 1 1 9 3283 1 1 16 HIS H H 0.516 -0.075 1.344 1.00 . A A . 16 HIS H 1 1 9 3284 1 1 16 HIS HA H -2.177 -0.193 0.275 1.00 . A A . 16 HIS HA 1 1 9 3285 1 1 16 HIS HB2 H -0.561 -2.008 2.031 1.00 . A A . 16 HIS HB2 1 1 9 3286 1 1 16 HIS HB3 H -2.301 -2.226 1.894 1.00 . A A . 16 HIS HB3 1 1 9 3287 1 1 16 HIS HD1 H -2.195 -4.444 0.663 1.00 . A A . 16 HIS HD1 1 1 9 3288 1 1 16 HIS HD2 H -0.090 -1.400 -1.244 1.00 . A A . 16 HIS HD2 1 1 9 3289 1 1 16 HIS HE1 H -1.571 -5.357 -1.600 1.00 . A A . 16 HIS HE1 1 1 9 3290 1 1 16 HIS HE2 H -0.468 -3.437 -2.799 1.00 . A A . 16 HIS HE2 1 1 9 3291 1 1 16 HIS N N -0.296 0.314 0.947 1.00 . A A . 16 HIS N 1 1 9 3292 1 1 16 HIS ND1 N -1.680 -3.929 -0.012 1.00 . A A . 16 HIS ND1 1 1 9 3293 1 1 16 HIS NE2 N -0.669 -3.434 -1.830 1.00 . A A . 16 HIS NE2 1 1 9 3294 1 1 16 HIS O O -3.310 -0.296 2.836 1.00 . A A . 16 HIS O 1 1 9 3295 1 1 17 LYS C C -3.547 3.182 3.222 1.00 . A A . 17 LYS C 1 1 9 3296 1 1 17 LYS CA C -2.604 2.173 3.837 1.00 . A A . 17 LYS CA 1 1 9 3297 1 1 17 LYS CB C -1.631 2.879 4.782 1.00 . A A . 17 LYS CB 1 1 9 3298 1 1 17 LYS CD C -0.117 4.864 5.063 1.00 . A A . 17 LYS CD 1 1 9 3299 1 1 17 LYS CE C 0.716 5.906 4.336 1.00 . A A . 17 LYS CE 1 1 9 3300 1 1 17 LYS CG C -0.779 3.918 4.081 1.00 . A A . 17 LYS CG 1 1 9 3301 1 1 17 LYS H H -1.081 1.828 2.404 1.00 . A A . 17 LYS H 1 1 9 3302 1 1 17 LYS HA H -3.192 1.471 4.381 1.00 . A A . 17 LYS HA 1 1 9 3303 1 1 17 LYS HB2 H -2.194 3.368 5.563 1.00 . A A . 17 LYS HB2 1 1 9 3304 1 1 17 LYS HB3 H -0.976 2.144 5.224 1.00 . A A . 17 LYS HB3 1 1 9 3305 1 1 17 LYS HD2 H -0.880 5.365 5.640 1.00 . A A . 17 LYS HD2 1 1 9 3306 1 1 17 LYS HD3 H 0.526 4.297 5.722 1.00 . A A . 17 LYS HD3 1 1 9 3307 1 1 17 LYS HE2 H 1.111 6.601 5.061 1.00 . A A . 17 LYS HE2 1 1 9 3308 1 1 17 LYS HE3 H 1.532 5.409 3.833 1.00 . A A . 17 LYS HE3 1 1 9 3309 1 1 17 LYS HG2 H -0.012 3.415 3.510 1.00 . A A . 17 LYS HG2 1 1 9 3310 1 1 17 LYS HG3 H -1.408 4.489 3.413 1.00 . A A . 17 LYS HG3 1 1 9 3311 1 1 17 LYS HZ1 H 0.537 7.284 2.779 1.00 . A A . 17 LYS HZ1 1 1 9 3312 1 1 17 LYS HZ2 H -0.804 7.247 3.813 1.00 . A A . 17 LYS HZ2 1 1 9 3313 1 1 17 LYS HZ3 H -0.568 6.003 2.682 1.00 . A A . 17 LYS HZ3 1 1 9 3314 1 1 17 LYS N N -1.897 1.445 2.788 1.00 . A A . 17 LYS N 1 1 9 3315 1 1 17 LYS NZ N -0.084 6.660 3.333 1.00 . A A . 17 LYS NZ 1 1 9 3316 1 1 17 LYS O O -4.196 3.966 3.914 1.00 . A A . 17 LYS O 1 1 9 3317 1 1 18 ASP C C -5.504 3.225 0.391 1.00 . A A . 18 ASP C 1 1 9 3318 1 1 18 ASP CA C -4.482 4.031 1.175 1.00 . A A . 18 ASP CA 1 1 9 3319 1 1 18 ASP CB C -3.664 4.900 0.225 1.00 . A A . 18 ASP CB 1 1 9 3320 1 1 18 ASP CG C -2.731 5.870 0.933 1.00 . A A . 18 ASP CG 1 1 9 3321 1 1 18 ASP H H -3.066 2.492 1.434 1.00 . A A . 18 ASP H 1 1 9 3322 1 1 18 ASP HA H -4.999 4.662 1.881 1.00 . A A . 18 ASP HA 1 1 9 3323 1 1 18 ASP HB2 H -3.077 4.265 -0.417 1.00 . A A . 18 ASP HB2 1 1 9 3324 1 1 18 ASP HB3 H -4.345 5.463 -0.372 1.00 . A A . 18 ASP HB3 1 1 9 3325 1 1 18 ASP N N -3.619 3.141 1.917 1.00 . A A . 18 ASP N 1 1 9 3326 1 1 18 ASP O O -6.077 3.703 -0.588 1.00 . A A . 18 ASP O 1 1 9 3327 1 1 18 ASP OD1 O -1.669 5.427 1.427 1.00 . A A . 18 ASP OD1 1 1 9 3328 1 1 18 ASP OD2 O -3.056 7.076 1.017 1.00 . A A . 18 ASP OD2 1 1 9 3329 1 1 19 VAL C C -8.107 1.662 0.349 1.00 . A A . 19 VAL C 1 1 9 3330 1 1 19 VAL CA C -6.691 1.125 0.173 1.00 . A A . 19 VAL CA 1 1 9 3331 1 1 19 VAL CB C -6.603 -0.331 0.674 1.00 . A A . 19 VAL CB 1 1 9 3332 1 1 19 VAL CG1 C -5.242 -0.920 0.348 1.00 . A A . 19 VAL CG1 1 1 9 3333 1 1 19 VAL CG2 C -6.872 -0.419 2.163 1.00 . A A . 19 VAL CG2 1 1 9 3334 1 1 19 VAL H H -5.249 1.665 1.616 1.00 . A A . 19 VAL H 1 1 9 3335 1 1 19 VAL HA H -6.459 1.125 -0.876 1.00 . A A . 19 VAL HA 1 1 9 3336 1 1 19 VAL HB H -7.351 -0.912 0.159 1.00 . A A . 19 VAL HB 1 1 9 3337 1 1 19 VAL HG11 H -4.474 -0.348 0.847 1.00 . A A . 19 VAL HG11 1 1 9 3338 1 1 19 VAL HG12 H -5.083 -0.884 -0.718 1.00 . A A . 19 VAL HG12 1 1 9 3339 1 1 19 VAL HG13 H -5.203 -1.946 0.684 1.00 . A A . 19 VAL HG13 1 1 9 3340 1 1 19 VAL HG21 H -6.144 0.176 2.692 1.00 . A A . 19 VAL HG21 1 1 9 3341 1 1 19 VAL HG22 H -6.802 -1.447 2.481 1.00 . A A . 19 VAL HG22 1 1 9 3342 1 1 19 VAL HG23 H -7.863 -0.044 2.366 1.00 . A A . 19 VAL HG23 1 1 9 3343 1 1 19 VAL N N -5.731 1.992 0.830 1.00 . A A . 19 VAL N 1 1 9 3344 1 1 19 VAL O O -8.581 1.864 1.467 1.00 . A A . 19 VAL O 1 1 9 3345 1 1 20 ILE C C -11.131 1.410 -0.371 1.00 . A A . 20 ILE C 1 1 9 3346 1 1 20 ILE CA C -10.108 2.486 -0.737 1.00 . A A . 20 ILE CA 1 1 9 3347 1 1 20 ILE CB C -10.463 3.140 -2.093 1.00 . A A . 20 ILE CB 1 1 9 3348 1 1 20 ILE CD1 C -10.575 5.458 -1.068 1.00 . A A . 20 ILE CD1 1 1 9 3349 1 1 20 ILE CG1 C -11.305 4.391 -1.859 1.00 . A A . 20 ILE CG1 1 1 9 3350 1 1 20 ILE CG2 C -11.187 2.162 -3.011 1.00 . A A . 20 ILE CG2 1 1 9 3351 1 1 20 ILE H H -8.339 1.740 -1.631 1.00 . A A . 20 ILE H 1 1 9 3352 1 1 20 ILE HA H -10.125 3.251 0.023 1.00 . A A . 20 ILE HA 1 1 9 3353 1 1 20 ILE HB H -9.542 3.427 -2.578 1.00 . A A . 20 ILE HB 1 1 9 3354 1 1 20 ILE HD11 H -10.310 5.070 -0.094 1.00 . A A . 20 ILE HD11 1 1 9 3355 1 1 20 ILE HD12 H -11.214 6.320 -0.951 1.00 . A A . 20 ILE HD12 1 1 9 3356 1 1 20 ILE HD13 H -9.675 5.744 -1.597 1.00 . A A . 20 ILE HD13 1 1 9 3357 1 1 20 ILE HG12 H -11.582 4.815 -2.811 1.00 . A A . 20 ILE HG12 1 1 9 3358 1 1 20 ILE HG13 H -12.197 4.121 -1.312 1.00 . A A . 20 ILE HG13 1 1 9 3359 1 1 20 ILE HG21 H -11.394 2.638 -3.960 1.00 . A A . 20 ILE HG21 1 1 9 3360 1 1 20 ILE HG22 H -12.117 1.858 -2.551 1.00 . A A . 20 ILE HG22 1 1 9 3361 1 1 20 ILE HG23 H -10.566 1.293 -3.171 1.00 . A A . 20 ILE HG23 1 1 9 3362 1 1 20 ILE N N -8.769 1.920 -0.765 1.00 . A A . 20 ILE N 1 1 9 3363 1 1 20 ILE O O -12.238 1.701 0.079 1.00 . A A . 20 ILE O 1 1 9 3364 1 1 21 TRP C C -11.309 -1.461 1.191 1.00 . A A . 21 TRP C 1 1 9 3365 1 1 21 TRP CA C -11.563 -0.985 -0.228 1.00 . A A . 21 TRP CA 1 1 9 3366 1 1 21 TRP CB C -11.300 -2.107 -1.231 1.00 . A A . 21 TRP CB 1 1 9 3367 1 1 21 TRP CD1 C -9.173 -1.624 -2.585 1.00 . A A . 21 TRP CD1 1 1 9 3368 1 1 21 TRP CD2 C -8.907 -3.169 -0.989 1.00 . A A . 21 TRP CD2 1 1 9 3369 1 1 21 TRP CE2 C -7.679 -2.994 -1.653 1.00 . A A . 21 TRP CE2 1 1 9 3370 1 1 21 TRP CE3 C -8.980 -4.095 0.054 1.00 . A A . 21 TRP CE3 1 1 9 3371 1 1 21 TRP CG C -9.849 -2.278 -1.595 1.00 . A A . 21 TRP CG 1 1 9 3372 1 1 21 TRP CH2 C -6.639 -4.612 -0.285 1.00 . A A . 21 TRP CH2 1 1 9 3373 1 1 21 TRP CZ2 C -6.535 -3.710 -1.308 1.00 . A A . 21 TRP CZ2 1 1 9 3374 1 1 21 TRP CZ3 C -7.847 -4.808 0.393 1.00 . A A . 21 TRP CZ3 1 1 9 3375 1 1 21 TRP H H -9.820 0.002 -0.878 1.00 . A A . 21 TRP H 1 1 9 3376 1 1 21 TRP HA H -12.594 -0.673 -0.308 1.00 . A A . 21 TRP HA 1 1 9 3377 1 1 21 TRP HB2 H -11.651 -3.041 -0.815 1.00 . A A . 21 TRP HB2 1 1 9 3378 1 1 21 TRP HB3 H -11.847 -1.893 -2.131 1.00 . A A . 21 TRP HB3 1 1 9 3379 1 1 21 TRP HD1 H -9.615 -0.880 -3.232 1.00 . A A . 21 TRP HD1 1 1 9 3380 1 1 21 TRP HE1 H -7.175 -1.709 -3.240 1.00 . A A . 21 TRP HE1 1 1 9 3381 1 1 21 TRP HE3 H -9.902 -4.255 0.590 1.00 . A A . 21 TRP HE3 1 1 9 3382 1 1 21 TRP HH2 H -5.779 -5.192 0.013 1.00 . A A . 21 TRP HH2 1 1 9 3383 1 1 21 TRP HZ2 H -5.594 -3.569 -1.822 1.00 . A A . 21 TRP HZ2 1 1 9 3384 1 1 21 TRP HZ3 H -7.888 -5.531 1.196 1.00 . A A . 21 TRP HZ3 1 1 9 3385 1 1 21 TRP N N -10.722 0.160 -0.538 1.00 . A A . 21 TRP N 1 1 9 3386 1 1 21 TRP NE1 N -7.867 -2.041 -2.617 1.00 . A A . 21 TRP NE1 1 1 9 3387 1 1 21 TRP O O -11.379 -2.654 1.490 1.00 . A A . 21 TRP O 1 1 9 3388 1 1 22 VAL C C -11.994 -1.352 4.159 1.00 . A A . 22 VAL C 1 1 9 3389 1 1 22 VAL CA C -10.754 -0.789 3.455 1.00 . A A . 22 VAL CA 1 1 9 3390 1 1 22 VAL CB C -10.233 0.474 4.181 1.00 . A A . 22 VAL CB 1 1 9 3391 1 1 22 VAL CG1 C -11.135 1.669 3.903 1.00 . A A . 22 VAL CG1 1 1 9 3392 1 1 22 VAL CG2 C -10.098 0.231 5.678 1.00 . A A . 22 VAL CG2 1 1 9 3393 1 1 22 VAL H H -11.016 0.423 1.753 1.00 . A A . 22 VAL H 1 1 9 3394 1 1 22 VAL HA H -9.974 -1.536 3.487 1.00 . A A . 22 VAL HA 1 1 9 3395 1 1 22 VAL HB H -9.252 0.702 3.791 1.00 . A A . 22 VAL HB 1 1 9 3396 1 1 22 VAL HG11 H -12.122 1.473 4.296 1.00 . A A . 22 VAL HG11 1 1 9 3397 1 1 22 VAL HG12 H -11.197 1.827 2.835 1.00 . A A . 22 VAL HG12 1 1 9 3398 1 1 22 VAL HG13 H -10.725 2.550 4.375 1.00 . A A . 22 VAL HG13 1 1 9 3399 1 1 22 VAL HG21 H -9.717 1.123 6.154 1.00 . A A . 22 VAL HG21 1 1 9 3400 1 1 22 VAL HG22 H -9.418 -0.590 5.850 1.00 . A A . 22 VAL HG22 1 1 9 3401 1 1 22 VAL HG23 H -11.066 -0.010 6.091 1.00 . A A . 22 VAL HG23 1 1 9 3402 1 1 22 VAL N N -11.028 -0.508 2.061 1.00 . A A . 22 VAL N 1 1 9 3403 1 1 22 VAL O O -12.927 -0.622 4.517 1.00 . A A . 22 VAL O 1 1 9 3404 1 1 23 ASN C C -12.476 -4.617 5.649 1.00 . A A . 23 ASN C 1 1 9 3405 1 1 23 ASN CA C -13.059 -3.362 5.025 1.00 . A A . 23 ASN CA 1 1 9 3406 1 1 23 ASN CB C -14.224 -3.721 4.097 1.00 . A A . 23 ASN CB 1 1 9 3407 1 1 23 ASN CG C -15.351 -4.437 4.825 1.00 . A A . 23 ASN CG 1 1 9 3408 1 1 23 ASN H H -11.293 -3.192 3.887 1.00 . A A . 23 ASN H 1 1 9 3409 1 1 23 ASN HA H -13.411 -2.715 5.808 1.00 . A A . 23 ASN HA 1 1 9 3410 1 1 23 ASN HB2 H -14.618 -2.818 3.660 1.00 . A A . 23 ASN HB2 1 1 9 3411 1 1 23 ASN HB3 H -13.859 -4.366 3.311 1.00 . A A . 23 ASN HB3 1 1 9 3412 1 1 23 ASN HD21 H -16.287 -2.708 5.141 1.00 . A A . 23 ASN HD21 1 1 9 3413 1 1 23 ASN HD22 H -17.064 -4.124 5.782 1.00 . A A . 23 ASN HD22 1 1 9 3414 1 1 23 ASN N N -12.011 -2.666 4.298 1.00 . A A . 23 ASN N 1 1 9 3415 1 1 23 ASN ND2 N -16.333 -3.682 5.294 1.00 . A A . 23 ASN ND2 1 1 9 3416 1 1 23 ASN O O -12.179 -4.646 6.842 1.00 . A A . 23 ASN O 1 1 9 3417 1 1 23 ASN OD1 O -15.353 -5.661 4.940 1.00 . A A . 23 ASN OD1 1 1 9 3418 1 1 24 ARG C C -11.504 -7.789 4.015 1.00 . A A . 24 ARG C 1 1 9 3419 1 1 24 ARG CA C -11.655 -6.881 5.229 1.00 . A A . 24 ARG CA 1 1 9 3420 1 1 24 ARG CB C -12.481 -7.586 6.314 1.00 . A A . 24 ARG CB 1 1 9 3421 1 1 24 ARG CD C -12.528 -9.181 8.252 1.00 . A A . 24 ARG CD 1 1 9 3422 1 1 24 ARG CG C -11.676 -8.558 7.159 1.00 . A A . 24 ARG CG 1 1 9 3423 1 1 24 ARG CZ C -12.156 -10.854 10.026 1.00 . A A . 24 ARG CZ 1 1 9 3424 1 1 24 ARG H H -12.600 -5.545 3.896 1.00 . A A . 24 ARG H 1 1 9 3425 1 1 24 ARG HA H -10.674 -6.648 5.618 1.00 . A A . 24 ARG HA 1 1 9 3426 1 1 24 ARG HB2 H -12.905 -6.841 6.969 1.00 . A A . 24 ARG HB2 1 1 9 3427 1 1 24 ARG HB3 H -13.283 -8.134 5.841 1.00 . A A . 24 ARG HB3 1 1 9 3428 1 1 24 ARG HD2 H -13.106 -8.403 8.728 1.00 . A A . 24 ARG HD2 1 1 9 3429 1 1 24 ARG HD3 H -13.196 -9.900 7.802 1.00 . A A . 24 ARG HD3 1 1 9 3430 1 1 24 ARG HE H -10.799 -9.526 9.398 1.00 . A A . 24 ARG HE 1 1 9 3431 1 1 24 ARG HG2 H -11.292 -9.344 6.526 1.00 . A A . 24 ARG HG2 1 1 9 3432 1 1 24 ARG HG3 H -10.852 -8.028 7.615 1.00 . A A . 24 ARG HG3 1 1 9 3433 1 1 24 ARG HH11 H -13.969 -10.980 9.112 1.00 . A A . 24 ARG HH11 1 1 9 3434 1 1 24 ARG HH12 H -13.703 -12.111 10.409 1.00 . A A . 24 ARG HH12 1 1 9 3435 1 1 24 ARG HH21 H -10.448 -10.994 11.110 1.00 . A A . 24 ARG HH21 1 1 9 3436 1 1 24 ARG HH22 H -11.706 -12.117 11.551 1.00 . A A . 24 ARG HH22 1 1 9 3437 1 1 24 ARG N N -12.288 -5.632 4.818 1.00 . A A . 24 ARG N 1 1 9 3438 1 1 24 ARG NE N -11.717 -9.856 9.264 1.00 . A A . 24 ARG NE 1 1 9 3439 1 1 24 ARG NH1 N -13.370 -11.354 9.836 1.00 . A A . 24 ARG NH1 1 1 9 3440 1 1 24 ARG NH2 N -11.373 -11.364 10.968 1.00 . A A . 24 ARG NH2 1 1 9 3441 1 1 24 ARG O O -12.469 -8.411 3.572 1.00 . A A . 24 ARG O 1 1 9 3442 1 1 25 ASN C C -9.367 -9.921 2.607 1.00 . A A . 25 ASN C 1 1 9 3443 1 1 25 ASN CA C -10.059 -8.614 2.253 1.00 . A A . 25 ASN CA 1 1 9 3444 1 1 25 ASN CB C -9.211 -7.822 1.255 1.00 . A A . 25 ASN CB 1 1 9 3445 1 1 25 ASN CG C -9.111 -8.515 -0.091 1.00 . A A . 25 ASN CG 1 1 9 3446 1 1 25 ASN H H -9.560 -7.327 3.862 1.00 . A A . 25 ASN H 1 1 9 3447 1 1 25 ASN HA H -11.013 -8.837 1.802 1.00 . A A . 25 ASN HA 1 1 9 3448 1 1 25 ASN HB2 H -9.653 -6.847 1.108 1.00 . A A . 25 ASN HB2 1 1 9 3449 1 1 25 ASN HB3 H -8.215 -7.705 1.656 1.00 . A A . 25 ASN HB3 1 1 9 3450 1 1 25 ASN HD21 H -10.712 -7.537 -0.750 1.00 . A A . 25 ASN HD21 1 1 9 3451 1 1 25 ASN HD22 H -9.988 -8.641 -1.873 1.00 . A A . 25 ASN HD22 1 1 9 3452 1 1 25 ASN N N -10.305 -7.829 3.453 1.00 . A A . 25 ASN N 1 1 9 3453 1 1 25 ASN ND2 N -10.028 -8.196 -0.993 1.00 . A A . 25 ASN ND2 1 1 9 3454 1 1 25 ASN O O -8.160 -9.890 2.922 1.00 . A A . 25 ASN O 1 1 9 3455 1 1 25 ASN OXT O -10.029 -10.979 2.561 1.00 . A A . 25 ASN OXT 1 1 9 3456 1 1 25 ASN OD1 O -8.215 -9.327 -0.323 1.00 . A A . 25 ASN OD1 1 1 10 3457 1 1 1 CYS C C 4.437 4.451 -6.059 1.00 . A A . 1 CYS C 1 1 10 3458 1 1 1 CYS CA C 3.071 4.978 -5.633 1.00 . A A . 1 CYS CA 1 1 10 3459 1 1 1 CYS CB C 2.162 3.825 -5.192 1.00 . A A . 1 CYS CB 1 1 10 3460 1 1 1 CYS H1 H 1.599 6.218 -6.427 1.00 . A A . 1 CYS H1 1 1 10 3461 1 1 1 CYS H2 H 2.175 5.049 -7.505 1.00 . A A . 1 CYS H2 1 1 10 3462 1 1 1 CYS H3 H 3.125 6.403 -7.143 1.00 . A A . 1 CYS H3 1 1 10 3463 1 1 1 CYS HA H 3.203 5.662 -4.808 1.00 . A A . 1 CYS HA 1 1 10 3464 1 1 1 CYS HB2 H 1.214 4.227 -4.867 1.00 . A A . 1 CYS HB2 1 1 10 3465 1 1 1 CYS HB3 H 1.999 3.163 -6.031 1.00 . A A . 1 CYS HB3 1 1 10 3466 1 1 1 CYS N N 2.450 5.715 -6.749 1.00 . A A . 1 CYS N 1 1 10 3467 1 1 1 CYS O O 4.535 3.461 -6.784 1.00 . A A . 1 CYS O 1 1 10 3468 1 1 1 CYS SG S 2.836 2.829 -3.824 1.00 . A A . 1 CYS SG 1 1 10 3469 1 1 2 SER C C 7.580 4.208 -4.776 1.00 . A A . 2 SER C 1 1 10 3470 1 1 2 SER CA C 6.847 4.777 -5.984 1.00 . A A . 2 SER CA 1 1 10 3471 1 1 2 SER CB C 7.584 6.003 -6.525 1.00 . A A . 2 SER CB 1 1 10 3472 1 1 2 SER H H 5.336 5.925 -5.049 1.00 . A A . 2 SER H 1 1 10 3473 1 1 2 SER HA H 6.806 4.023 -6.753 1.00 . A A . 2 SER HA 1 1 10 3474 1 1 2 SER HB2 H 7.673 6.744 -5.746 1.00 . A A . 2 SER HB2 1 1 10 3475 1 1 2 SER HB3 H 8.569 5.714 -6.860 1.00 . A A . 2 SER HB3 1 1 10 3476 1 1 2 SER HG H 6.358 5.881 -8.054 1.00 . A A . 2 SER HG 1 1 10 3477 1 1 2 SER N N 5.485 5.141 -5.631 1.00 . A A . 2 SER N 1 1 10 3478 1 1 2 SER O O 7.448 4.721 -3.665 1.00 . A A . 2 SER O 1 1 10 3479 1 1 2 SER OG O 6.878 6.571 -7.616 1.00 . A A . 2 SER OG 1 1 10 3480 1 1 3 CYS C C 10.533 2.970 -3.946 1.00 . A A . 3 CYS C 1 1 10 3481 1 1 3 CYS CA C 9.081 2.508 -3.924 1.00 . A A . 3 CYS CA 1 1 10 3482 1 1 3 CYS CB C 9.022 0.987 -4.061 1.00 . A A . 3 CYS CB 1 1 10 3483 1 1 3 CYS H H 8.396 2.772 -5.899 1.00 . A A . 3 CYS H 1 1 10 3484 1 1 3 CYS HA H 8.633 2.799 -2.987 1.00 . A A . 3 CYS HA 1 1 10 3485 1 1 3 CYS HB2 H 9.702 0.679 -4.837 1.00 . A A . 3 CYS HB2 1 1 10 3486 1 1 3 CYS HB3 H 9.326 0.544 -3.127 1.00 . A A . 3 CYS HB3 1 1 10 3487 1 1 3 CYS N N 8.337 3.144 -4.997 1.00 . A A . 3 CYS N 1 1 10 3488 1 1 3 CYS O O 11.288 2.634 -4.854 1.00 . A A . 3 CYS O 1 1 10 3489 1 1 3 CYS SG S 7.369 0.331 -4.478 1.00 . A A . 3 CYS SG 1 1 10 3490 1 1 4 THR C C 12.820 3.847 -1.459 1.00 . A A . 4 THR C 1 1 10 3491 1 1 4 THR CA C 12.278 4.218 -2.831 1.00 . A A . 4 THR CA 1 1 10 3492 1 1 4 THR CB C 12.380 5.734 -3.033 1.00 . A A . 4 THR CB 1 1 10 3493 1 1 4 THR CG2 C 13.836 6.178 -3.115 1.00 . A A . 4 THR CG2 1 1 10 3494 1 1 4 THR H H 10.247 4.052 -2.295 1.00 . A A . 4 THR H 1 1 10 3495 1 1 4 THR HA H 12.869 3.736 -3.588 1.00 . A A . 4 THR HA 1 1 10 3496 1 1 4 THR HB H 11.919 6.214 -2.191 1.00 . A A . 4 THR HB 1 1 10 3497 1 1 4 THR HG1 H 11.583 5.335 -4.798 1.00 . A A . 4 THR HG1 1 1 10 3498 1 1 4 THR HG21 H 14.340 5.940 -2.186 1.00 . A A . 4 THR HG21 1 1 10 3499 1 1 4 THR HG22 H 13.880 7.243 -3.284 1.00 . A A . 4 THR HG22 1 1 10 3500 1 1 4 THR HG23 H 14.325 5.665 -3.929 1.00 . A A . 4 THR HG23 1 1 10 3501 1 1 4 THR N N 10.911 3.760 -2.959 1.00 . A A . 4 THR N 1 1 10 3502 1 1 4 THR O O 12.218 4.187 -0.439 1.00 . A A . 4 THR O 1 1 10 3503 1 1 4 THR OG1 O 11.687 6.113 -4.233 1.00 . A A . 4 THR OG1 1 1 10 3504 1 1 5 ASP C C 13.627 1.607 0.450 1.00 . A A . 5 ASP C 1 1 10 3505 1 1 5 ASP CA C 14.550 2.617 -0.214 1.00 . A A . 5 ASP CA 1 1 10 3506 1 1 5 ASP CB C 14.869 3.745 0.775 1.00 . A A . 5 ASP CB 1 1 10 3507 1 1 5 ASP CG C 15.968 4.667 0.297 1.00 . A A . 5 ASP CG 1 1 10 3508 1 1 5 ASP H H 14.392 2.950 -2.310 1.00 . A A . 5 ASP H 1 1 10 3509 1 1 5 ASP HA H 15.468 2.119 -0.485 1.00 . A A . 5 ASP HA 1 1 10 3510 1 1 5 ASP HB2 H 13.979 4.334 0.933 1.00 . A A . 5 ASP HB2 1 1 10 3511 1 1 5 ASP HB3 H 15.174 3.309 1.714 1.00 . A A . 5 ASP HB3 1 1 10 3512 1 1 5 ASP N N 13.944 3.133 -1.448 1.00 . A A . 5 ASP N 1 1 10 3513 1 1 5 ASP O O 13.773 1.289 1.633 1.00 . A A . 5 ASP O 1 1 10 3514 1 1 5 ASP OD1 O 17.138 4.229 0.245 1.00 . A A . 5 ASP OD1 1 1 10 3515 1 1 5 ASP OD2 O 15.666 5.826 -0.057 1.00 . A A . 5 ASP OD2 1 1 10 3516 1 1 6 MET C C 11.771 -1.153 -0.578 1.00 . A A . 6 MET C 1 1 10 3517 1 1 6 MET CA C 11.695 0.168 0.170 1.00 . A A . 6 MET CA 1 1 10 3518 1 1 6 MET CB C 10.302 0.766 -0.003 1.00 . A A . 6 MET CB 1 1 10 3519 1 1 6 MET CE C 9.459 3.649 1.331 1.00 . A A . 6 MET CE 1 1 10 3520 1 1 6 MET CG C 9.554 0.890 1.304 1.00 . A A . 6 MET CG 1 1 10 3521 1 1 6 MET H H 12.666 1.341 -1.270 1.00 . A A . 6 MET H 1 1 10 3522 1 1 6 MET HA H 11.874 -0.001 1.219 1.00 . A A . 6 MET HA 1 1 10 3523 1 1 6 MET HB2 H 10.396 1.751 -0.439 1.00 . A A . 6 MET HB2 1 1 10 3524 1 1 6 MET HB3 H 9.728 0.137 -0.668 1.00 . A A . 6 MET HB3 1 1 10 3525 1 1 6 MET HE1 H 8.377 3.620 1.342 1.00 . A A . 6 MET HE1 1 1 10 3526 1 1 6 MET HE2 H 9.810 3.562 0.312 1.00 . A A . 6 MET HE2 1 1 10 3527 1 1 6 MET HE3 H 9.800 4.582 1.753 1.00 . A A . 6 MET HE3 1 1 10 3528 1 1 6 MET HG2 H 8.507 1.001 1.091 1.00 . A A . 6 MET HG2 1 1 10 3529 1 1 6 MET HG3 H 9.713 -0.015 1.864 1.00 . A A . 6 MET HG3 1 1 10 3530 1 1 6 MET N N 12.688 1.092 -0.326 1.00 . A A . 6 MET N 1 1 10 3531 1 1 6 MET O O 12.081 -1.180 -1.768 1.00 . A A . 6 MET O 1 1 10 3532 1 1 6 MET SD S 10.099 2.288 2.300 1.00 . A A . 6 MET SD 1 1 10 3533 1 1 7 SER C C 9.965 -3.667 -1.048 1.00 . A A . 7 SER C 1 1 10 3534 1 1 7 SER CA C 11.379 -3.527 -0.511 1.00 . A A . 7 SER CA 1 1 10 3535 1 1 7 SER CB C 11.700 -4.636 0.495 1.00 . A A . 7 SER CB 1 1 10 3536 1 1 7 SER H H 11.339 -2.185 1.070 1.00 . A A . 7 SER H 1 1 10 3537 1 1 7 SER HA H 12.080 -3.567 -1.333 1.00 . A A . 7 SER HA 1 1 10 3538 1 1 7 SER HB2 H 12.657 -4.437 0.951 1.00 . A A . 7 SER HB2 1 1 10 3539 1 1 7 SER HB3 H 10.937 -4.658 1.258 1.00 . A A . 7 SER HB3 1 1 10 3540 1 1 7 SER HG H 12.217 -6.534 0.453 1.00 . A A . 7 SER HG 1 1 10 3541 1 1 7 SER N N 11.489 -2.243 0.117 1.00 . A A . 7 SER N 1 1 10 3542 1 1 7 SER O O 9.136 -2.768 -0.885 1.00 . A A . 7 SER O 1 1 10 3543 1 1 7 SER OG O 11.754 -5.907 -0.132 1.00 . A A . 7 SER OG 1 1 10 3544 1 1 8 ASP C C 7.272 -5.085 -1.333 1.00 . A A . 8 ASP C 1 1 10 3545 1 1 8 ASP CA C 8.416 -4.998 -2.336 1.00 . A A . 8 ASP CA 1 1 10 3546 1 1 8 ASP CB C 8.456 -6.247 -3.230 1.00 . A A . 8 ASP CB 1 1 10 3547 1 1 8 ASP CG C 8.313 -7.549 -2.466 1.00 . A A . 8 ASP CG 1 1 10 3548 1 1 8 ASP H H 10.345 -5.515 -1.607 1.00 . A A . 8 ASP H 1 1 10 3549 1 1 8 ASP HA H 8.251 -4.134 -2.960 1.00 . A A . 8 ASP HA 1 1 10 3550 1 1 8 ASP HB2 H 7.648 -6.187 -3.942 1.00 . A A . 8 ASP HB2 1 1 10 3551 1 1 8 ASP HB3 H 9.395 -6.267 -3.762 1.00 . A A . 8 ASP HB3 1 1 10 3552 1 1 8 ASP N N 9.686 -4.795 -1.648 1.00 . A A . 8 ASP N 1 1 10 3553 1 1 8 ASP O O 6.209 -4.495 -1.540 1.00 . A A . 8 ASP O 1 1 10 3554 1 1 8 ASP OD1 O 9.224 -7.883 -1.680 1.00 . A A . 8 ASP OD1 1 1 10 3555 1 1 8 ASP OD2 O 7.292 -8.244 -2.644 1.00 . A A . 8 ASP OD2 1 1 10 3556 1 1 9 LEU C C 6.409 -4.599 1.592 1.00 . A A . 9 LEU C 1 1 10 3557 1 1 9 LEU CA C 6.509 -5.910 0.823 1.00 . A A . 9 LEU CA 1 1 10 3558 1 1 9 LEU CB C 6.856 -7.052 1.784 1.00 . A A . 9 LEU CB 1 1 10 3559 1 1 9 LEU CD1 C 4.505 -7.721 2.358 1.00 . A A . 9 LEU CD1 1 1 10 3560 1 1 9 LEU CD2 C 6.372 -8.265 3.930 1.00 . A A . 9 LEU CD2 1 1 10 3561 1 1 9 LEU CG C 5.844 -7.266 2.915 1.00 . A A . 9 LEU CG 1 1 10 3562 1 1 9 LEU H H 8.359 -6.269 -0.141 1.00 . A A . 9 LEU H 1 1 10 3563 1 1 9 LEU HA H 5.555 -6.117 0.360 1.00 . A A . 9 LEU HA 1 1 10 3564 1 1 9 LEU HB2 H 6.930 -7.968 1.214 1.00 . A A . 9 LEU HB2 1 1 10 3565 1 1 9 LEU HB3 H 7.817 -6.845 2.229 1.00 . A A . 9 LEU HB3 1 1 10 3566 1 1 9 LEU HD11 H 3.823 -7.910 3.173 1.00 . A A . 9 LEU HD11 1 1 10 3567 1 1 9 LEU HD12 H 4.641 -8.626 1.784 1.00 . A A . 9 LEU HD12 1 1 10 3568 1 1 9 LEU HD13 H 4.099 -6.948 1.721 1.00 . A A . 9 LEU HD13 1 1 10 3569 1 1 9 LEU HD21 H 6.557 -9.211 3.441 1.00 . A A . 9 LEU HD21 1 1 10 3570 1 1 9 LEU HD22 H 5.641 -8.401 4.713 1.00 . A A . 9 LEU HD22 1 1 10 3571 1 1 9 LEU HD23 H 7.292 -7.895 4.355 1.00 . A A . 9 LEU HD23 1 1 10 3572 1 1 9 LEU HG H 5.688 -6.324 3.426 1.00 . A A . 9 LEU HG 1 1 10 3573 1 1 9 LEU N N 7.502 -5.797 -0.234 1.00 . A A . 9 LEU N 1 1 10 3574 1 1 9 LEU O O 5.315 -4.115 1.870 1.00 . A A . 9 LEU O 1 1 10 3575 1 1 10 GLU C C 6.925 -1.648 1.915 1.00 . A A . 10 GLU C 1 1 10 3576 1 1 10 GLU CA C 7.613 -2.782 2.675 1.00 . A A . 10 GLU CA 1 1 10 3577 1 1 10 GLU CB C 9.063 -2.411 2.991 1.00 . A A . 10 GLU CB 1 1 10 3578 1 1 10 GLU CD C 8.585 -1.693 5.360 1.00 . A A . 10 GLU CD 1 1 10 3579 1 1 10 GLU CG C 9.192 -1.307 4.027 1.00 . A A . 10 GLU CG 1 1 10 3580 1 1 10 GLU H H 8.399 -4.436 1.617 1.00 . A A . 10 GLU H 1 1 10 3581 1 1 10 GLU HA H 7.086 -2.946 3.601 1.00 . A A . 10 GLU HA 1 1 10 3582 1 1 10 GLU HB2 H 9.572 -3.287 3.366 1.00 . A A . 10 GLU HB2 1 1 10 3583 1 1 10 GLU HB3 H 9.547 -2.084 2.084 1.00 . A A . 10 GLU HB3 1 1 10 3584 1 1 10 GLU HG2 H 10.240 -1.090 4.177 1.00 . A A . 10 GLU HG2 1 1 10 3585 1 1 10 GLU HG3 H 8.692 -0.423 3.659 1.00 . A A . 10 GLU HG3 1 1 10 3586 1 1 10 GLU N N 7.561 -4.018 1.906 1.00 . A A . 10 GLU N 1 1 10 3587 1 1 10 GLU O O 6.249 -0.804 2.505 1.00 . A A . 10 GLU O 1 1 10 3588 1 1 10 GLU OE1 O 7.363 -1.515 5.538 1.00 . A A . 10 GLU OE1 1 1 10 3589 1 1 10 GLU OE2 O 9.325 -2.179 6.233 1.00 . A A . 10 GLU OE2 1 1 10 3590 1 1 11 CYS C C 4.922 -0.828 -0.160 1.00 . A A . 11 CYS C 1 1 10 3591 1 1 11 CYS CA C 6.430 -0.661 -0.244 1.00 . A A . 11 CYS CA 1 1 10 3592 1 1 11 CYS CB C 6.888 -0.785 -1.697 1.00 . A A . 11 CYS CB 1 1 10 3593 1 1 11 CYS H H 7.667 -2.323 0.183 1.00 . A A . 11 CYS H 1 1 10 3594 1 1 11 CYS HA H 6.689 0.318 0.128 1.00 . A A . 11 CYS HA 1 1 10 3595 1 1 11 CYS HB2 H 7.967 -0.778 -1.731 1.00 . A A . 11 CYS HB2 1 1 10 3596 1 1 11 CYS HB3 H 6.523 -1.718 -2.103 1.00 . A A . 11 CYS HB3 1 1 10 3597 1 1 11 CYS N N 7.086 -1.648 0.598 1.00 . A A . 11 CYS N 1 1 10 3598 1 1 11 CYS O O 4.185 0.149 -0.064 1.00 . A A . 11 CYS O 1 1 10 3599 1 1 11 CYS SG S 6.290 0.557 -2.774 1.00 . A A . 11 CYS SG 1 1 10 3600 1 1 12 MET C C 2.516 -2.000 1.311 1.00 . A A . 12 MET C 1 1 10 3601 1 1 12 MET CA C 3.046 -2.351 -0.071 1.00 . A A . 12 MET CA 1 1 10 3602 1 1 12 MET CB C 2.751 -3.811 -0.406 1.00 . A A . 12 MET CB 1 1 10 3603 1 1 12 MET CE C 3.508 -6.821 -1.252 1.00 . A A . 12 MET CE 1 1 10 3604 1 1 12 MET CG C 3.042 -4.165 -1.855 1.00 . A A . 12 MET CG 1 1 10 3605 1 1 12 MET H H 5.103 -2.818 -0.210 1.00 . A A . 12 MET H 1 1 10 3606 1 1 12 MET HA H 2.547 -1.722 -0.796 1.00 . A A . 12 MET HA 1 1 10 3607 1 1 12 MET HB2 H 3.355 -4.445 0.227 1.00 . A A . 12 MET HB2 1 1 10 3608 1 1 12 MET HB3 H 1.707 -4.009 -0.213 1.00 . A A . 12 MET HB3 1 1 10 3609 1 1 12 MET HE1 H 3.323 -6.573 -0.218 1.00 . A A . 12 MET HE1 1 1 10 3610 1 1 12 MET HE2 H 4.545 -6.635 -1.487 1.00 . A A . 12 MET HE2 1 1 10 3611 1 1 12 MET HE3 H 3.284 -7.866 -1.418 1.00 . A A . 12 MET HE3 1 1 10 3612 1 1 12 MET HG2 H 2.554 -3.443 -2.492 1.00 . A A . 12 MET HG2 1 1 10 3613 1 1 12 MET HG3 H 4.109 -4.118 -2.012 1.00 . A A . 12 MET HG3 1 1 10 3614 1 1 12 MET N N 4.468 -2.073 -0.158 1.00 . A A . 12 MET N 1 1 10 3615 1 1 12 MET O O 1.341 -1.688 1.463 1.00 . A A . 12 MET O 1 1 10 3616 1 1 12 MET SD S 2.467 -5.811 -2.302 1.00 . A A . 12 MET SD 1 1 10 3617 1 1 13 ASN C C 2.579 -0.176 3.695 1.00 . A A . 13 ASN C 1 1 10 3618 1 1 13 ASN CA C 3.004 -1.640 3.661 1.00 . A A . 13 ASN CA 1 1 10 3619 1 1 13 ASN CB C 4.149 -1.858 4.657 1.00 . A A . 13 ASN CB 1 1 10 3620 1 1 13 ASN CG C 4.422 -3.320 4.948 1.00 . A A . 13 ASN CG 1 1 10 3621 1 1 13 ASN H H 4.300 -2.341 2.139 1.00 . A A . 13 ASN H 1 1 10 3622 1 1 13 ASN HA H 2.164 -2.248 3.955 1.00 . A A . 13 ASN HA 1 1 10 3623 1 1 13 ASN HB2 H 5.051 -1.423 4.255 1.00 . A A . 13 ASN HB2 1 1 10 3624 1 1 13 ASN HB3 H 3.904 -1.366 5.587 1.00 . A A . 13 ASN HB3 1 1 10 3625 1 1 13 ASN HD21 H 6.325 -2.886 5.327 1.00 . A A . 13 ASN HD21 1 1 10 3626 1 1 13 ASN HD22 H 5.878 -4.557 5.485 1.00 . A A . 13 ASN HD22 1 1 10 3627 1 1 13 ASN N N 3.384 -2.034 2.309 1.00 . A A . 13 ASN N 1 1 10 3628 1 1 13 ASN ND2 N 5.664 -3.622 5.285 1.00 . A A . 13 ASN ND2 1 1 10 3629 1 1 13 ASN O O 1.422 0.136 3.974 1.00 . A A . 13 ASN O 1 1 10 3630 1 1 13 ASN OD1 O 3.529 -4.164 4.889 1.00 . A A . 13 ASN OD1 1 1 10 3631 1 1 14 PHE C C 2.230 2.595 2.412 1.00 . A A . 14 PHE C 1 1 10 3632 1 1 14 PHE CA C 3.233 2.150 3.480 1.00 . A A . 14 PHE CA 1 1 10 3633 1 1 14 PHE CB C 4.536 2.976 3.382 1.00 . A A . 14 PHE CB 1 1 10 3634 1 1 14 PHE CD1 C 5.850 2.368 1.325 1.00 . A A . 14 PHE CD1 1 1 10 3635 1 1 14 PHE CD2 C 4.629 4.415 1.316 1.00 . A A . 14 PHE CD2 1 1 10 3636 1 1 14 PHE CE1 C 6.286 2.617 0.039 1.00 . A A . 14 PHE CE1 1 1 10 3637 1 1 14 PHE CE2 C 5.062 4.665 0.026 1.00 . A A . 14 PHE CE2 1 1 10 3638 1 1 14 PHE CG C 5.018 3.265 1.981 1.00 . A A . 14 PHE CG 1 1 10 3639 1 1 14 PHE CZ C 5.916 3.828 -0.590 1.00 . A A . 14 PHE CZ 1 1 10 3640 1 1 14 PHE H H 4.397 0.416 3.085 1.00 . A A . 14 PHE H 1 1 10 3641 1 1 14 PHE HA H 2.791 2.325 4.451 1.00 . A A . 14 PHE HA 1 1 10 3642 1 1 14 PHE HB2 H 4.384 3.925 3.872 1.00 . A A . 14 PHE HB2 1 1 10 3643 1 1 14 PHE HB3 H 5.326 2.444 3.895 1.00 . A A . 14 PHE HB3 1 1 10 3644 1 1 14 PHE HD1 H 6.160 1.467 1.831 1.00 . A A . 14 PHE HD1 1 1 10 3645 1 1 14 PHE HD2 H 3.986 5.125 1.814 1.00 . A A . 14 PHE HD2 1 1 10 3646 1 1 14 PHE HE1 H 6.939 1.912 -0.457 1.00 . A A . 14 PHE HE1 1 1 10 3647 1 1 14 PHE HE2 H 4.752 5.564 -0.485 1.00 . A A . 14 PHE HE2 1 1 10 3648 1 1 14 PHE HZ H 6.268 4.048 -1.588 1.00 . A A . 14 PHE HZ 1 1 10 3649 1 1 14 PHE N N 3.507 0.721 3.381 1.00 . A A . 14 PHE N 1 1 10 3650 1 1 14 PHE O O 1.497 3.567 2.601 1.00 . A A . 14 PHE O 1 1 10 3651 1 1 15 CYS C C -0.075 1.716 0.310 1.00 . A A . 15 CYS C 1 1 10 3652 1 1 15 CYS CA C 1.350 2.260 0.169 1.00 . A A . 15 CYS CA 1 1 10 3653 1 1 15 CYS CB C 1.978 1.762 -1.137 1.00 . A A . 15 CYS CB 1 1 10 3654 1 1 15 CYS H H 2.766 1.080 1.219 1.00 . A A . 15 CYS H 1 1 10 3655 1 1 15 CYS HA H 1.306 3.336 0.142 1.00 . A A . 15 CYS HA 1 1 10 3656 1 1 15 CYS HB2 H 3.022 2.037 -1.147 1.00 . A A . 15 CYS HB2 1 1 10 3657 1 1 15 CYS HB3 H 1.896 0.685 -1.181 1.00 . A A . 15 CYS HB3 1 1 10 3658 1 1 15 CYS N N 2.194 1.877 1.296 1.00 . A A . 15 CYS N 1 1 10 3659 1 1 15 CYS O O -1.038 2.373 -0.088 1.00 . A A . 15 CYS O 1 1 10 3660 1 1 15 CYS SG S 1.226 2.435 -2.652 1.00 . A A . 15 CYS SG 1 1 10 3661 1 1 16 HIS C C -2.167 0.020 2.334 1.00 . A A . 16 HIS C 1 1 10 3662 1 1 16 HIS CA C -1.529 -0.125 0.957 1.00 . A A . 16 HIS CA 1 1 10 3663 1 1 16 HIS CB C -1.436 -1.608 0.586 1.00 . A A . 16 HIS CB 1 1 10 3664 1 1 16 HIS CD2 C -1.167 -1.049 -1.933 1.00 . A A . 16 HIS CD2 1 1 10 3665 1 1 16 HIS CE1 C -0.460 -3.003 -2.620 1.00 . A A . 16 HIS CE1 1 1 10 3666 1 1 16 HIS CG C -1.098 -1.859 -0.852 1.00 . A A . 16 HIS CG 1 1 10 3667 1 1 16 HIS H H 0.563 0.077 1.281 1.00 . A A . 16 HIS H 1 1 10 3668 1 1 16 HIS HA H -2.165 0.367 0.239 1.00 . A A . 16 HIS HA 1 1 10 3669 1 1 16 HIS HB2 H -0.671 -2.075 1.188 1.00 . A A . 16 HIS HB2 1 1 10 3670 1 1 16 HIS HB3 H -2.385 -2.083 0.791 1.00 . A A . 16 HIS HB3 1 1 10 3671 1 1 16 HIS HD1 H -0.511 -3.889 -0.768 1.00 . A A . 16 HIS HD1 1 1 10 3672 1 1 16 HIS HD2 H -1.475 -0.012 -1.937 1.00 . A A . 16 HIS HD2 1 1 10 3673 1 1 16 HIS HE1 H -0.112 -3.807 -3.252 1.00 . A A . 16 HIS HE1 1 1 10 3674 1 1 16 HIS HE2 H -0.928 -1.529 -3.961 1.00 . A A . 16 HIS HE2 1 1 10 3675 1 1 16 HIS N N -0.219 0.526 0.888 1.00 . A A . 16 HIS N 1 1 10 3676 1 1 16 HIS ND1 N -0.652 -3.076 -1.316 1.00 . A A . 16 HIS ND1 1 1 10 3677 1 1 16 HIS NE2 N -0.767 -1.784 -3.020 1.00 . A A . 16 HIS NE2 1 1 10 3678 1 1 16 HIS O O -3.219 -0.560 2.593 1.00 . A A . 16 HIS O 1 1 10 3679 1 1 17 LYS C C -3.134 2.224 4.367 1.00 . A A . 17 LYS C 1 1 10 3680 1 1 17 LYS CA C -2.152 1.091 4.514 1.00 . A A . 17 LYS CA 1 1 10 3681 1 1 17 LYS CB C -1.099 1.448 5.554 1.00 . A A . 17 LYS CB 1 1 10 3682 1 1 17 LYS CD C 0.673 3.063 6.300 1.00 . A A . 17 LYS CD 1 1 10 3683 1 1 17 LYS CE C 1.220 4.467 6.121 1.00 . A A . 17 LYS CE 1 1 10 3684 1 1 17 LYS CG C -0.354 2.731 5.235 1.00 . A A . 17 LYS CG 1 1 10 3685 1 1 17 LYS H H -0.654 1.151 3.006 1.00 . A A . 17 LYS H 1 1 10 3686 1 1 17 LYS HA H -2.691 0.231 4.826 1.00 . A A . 17 LYS HA 1 1 10 3687 1 1 17 LYS HB2 H -1.592 1.569 6.508 1.00 . A A . 17 LYS HB2 1 1 10 3688 1 1 17 LYS HB3 H -0.383 0.643 5.623 1.00 . A A . 17 LYS HB3 1 1 10 3689 1 1 17 LYS HD2 H 0.207 2.992 7.272 1.00 . A A . 17 LYS HD2 1 1 10 3690 1 1 17 LYS HD3 H 1.487 2.356 6.236 1.00 . A A . 17 LYS HD3 1 1 10 3691 1 1 17 LYS HE2 H 1.965 4.651 6.881 1.00 . A A . 17 LYS HE2 1 1 10 3692 1 1 17 LYS HE3 H 1.674 4.543 5.144 1.00 . A A . 17 LYS HE3 1 1 10 3693 1 1 17 LYS HG2 H 0.148 2.617 4.287 1.00 . A A . 17 LYS HG2 1 1 10 3694 1 1 17 LYS HG3 H -1.068 3.541 5.171 1.00 . A A . 17 LYS HG3 1 1 10 3695 1 1 17 LYS HZ1 H 0.551 6.445 6.148 1.00 . A A . 17 LYS HZ1 1 1 10 3696 1 1 17 LYS HZ2 H -0.322 5.409 7.168 1.00 . A A . 17 LYS HZ2 1 1 10 3697 1 1 17 LYS HZ3 H -0.569 5.351 5.489 1.00 . A A . 17 LYS HZ3 1 1 10 3698 1 1 17 LYS N N -1.543 0.791 3.217 1.00 . A A . 17 LYS N 1 1 10 3699 1 1 17 LYS NZ N 0.146 5.488 6.239 1.00 . A A . 17 LYS NZ 1 1 10 3700 1 1 17 LYS O O -3.834 2.605 5.303 1.00 . A A . 17 LYS O 1 1 10 3701 1 1 18 ASP C C -4.639 3.405 1.431 1.00 . A A . 18 ASP C 1 1 10 3702 1 1 18 ASP CA C -4.095 3.767 2.791 1.00 . A A . 18 ASP CA 1 1 10 3703 1 1 18 ASP CB C -3.428 5.128 2.721 1.00 . A A . 18 ASP CB 1 1 10 3704 1 1 18 ASP CG C -2.819 5.588 4.036 1.00 . A A . 18 ASP CG 1 1 10 3705 1 1 18 ASP H H -2.529 2.408 2.514 1.00 . A A . 18 ASP H 1 1 10 3706 1 1 18 ASP HA H -4.901 3.786 3.509 1.00 . A A . 18 ASP HA 1 1 10 3707 1 1 18 ASP HB2 H -2.653 5.088 1.977 1.00 . A A . 18 ASP HB2 1 1 10 3708 1 1 18 ASP HB3 H -4.165 5.843 2.424 1.00 . A A . 18 ASP HB3 1 1 10 3709 1 1 18 ASP N N -3.162 2.744 3.176 1.00 . A A . 18 ASP N 1 1 10 3710 1 1 18 ASP O O -4.164 3.900 0.405 1.00 . A A . 18 ASP O 1 1 10 3711 1 1 18 ASP OD1 O -3.580 5.993 4.943 1.00 . A A . 18 ASP OD1 1 1 10 3712 1 1 18 ASP OD2 O -1.571 5.574 4.159 1.00 . A A . 18 ASP OD2 1 1 10 3713 1 1 19 VAL C C -6.765 2.999 -0.677 1.00 . A A . 19 VAL C 1 1 10 3714 1 1 19 VAL CA C -6.074 1.941 0.174 1.00 . A A . 19 VAL CA 1 1 10 3715 1 1 19 VAL CB C -6.975 0.712 0.397 1.00 . A A . 19 VAL CB 1 1 10 3716 1 1 19 VAL CG1 C -6.225 -0.323 1.208 1.00 . A A . 19 VAL CG1 1 1 10 3717 1 1 19 VAL CG2 C -8.279 1.080 1.072 1.00 . A A . 19 VAL CG2 1 1 10 3718 1 1 19 VAL H H -5.973 2.189 2.277 1.00 . A A . 19 VAL H 1 1 10 3719 1 1 19 VAL HA H -5.210 1.603 -0.370 1.00 . A A . 19 VAL HA 1 1 10 3720 1 1 19 VAL HB H -7.203 0.280 -0.565 1.00 . A A . 19 VAL HB 1 1 10 3721 1 1 19 VAL HG11 H -5.922 0.111 2.151 1.00 . A A . 19 VAL HG11 1 1 10 3722 1 1 19 VAL HG12 H -5.350 -0.636 0.659 1.00 . A A . 19 VAL HG12 1 1 10 3723 1 1 19 VAL HG13 H -6.863 -1.174 1.387 1.00 . A A . 19 VAL HG13 1 1 10 3724 1 1 19 VAL HG21 H -8.877 0.193 1.209 1.00 . A A . 19 VAL HG21 1 1 10 3725 1 1 19 VAL HG22 H -8.808 1.784 0.448 1.00 . A A . 19 VAL HG22 1 1 10 3726 1 1 19 VAL HG23 H -8.071 1.529 2.029 1.00 . A A . 19 VAL HG23 1 1 10 3727 1 1 19 VAL N N -5.590 2.496 1.420 1.00 . A A . 19 VAL N 1 1 10 3728 1 1 19 VAL O O -7.861 3.473 -0.375 1.00 . A A . 19 VAL O 1 1 10 3729 1 1 20 ILE C C -7.649 3.669 -3.560 1.00 . A A . 20 ILE C 1 1 10 3730 1 1 20 ILE CA C -6.619 4.356 -2.673 1.00 . A A . 20 ILE CA 1 1 10 3731 1 1 20 ILE CB C -5.500 4.976 -3.537 1.00 . A A . 20 ILE CB 1 1 10 3732 1 1 20 ILE CD1 C -6.328 7.355 -3.222 1.00 . A A . 20 ILE CD1 1 1 10 3733 1 1 20 ILE CG1 C -5.987 6.259 -4.206 1.00 . A A . 20 ILE CG1 1 1 10 3734 1 1 20 ILE CG2 C -5.012 3.981 -4.575 1.00 . A A . 20 ILE CG2 1 1 10 3735 1 1 20 ILE H H -5.175 3.045 -1.878 1.00 . A A . 20 ILE H 1 1 10 3736 1 1 20 ILE HA H -7.098 5.144 -2.117 1.00 . A A . 20 ILE HA 1 1 10 3737 1 1 20 ILE HB H -4.669 5.214 -2.889 1.00 . A A . 20 ILE HB 1 1 10 3738 1 1 20 ILE HD11 H -5.455 7.595 -2.636 1.00 . A A . 20 ILE HD11 1 1 10 3739 1 1 20 ILE HD12 H -7.118 7.018 -2.570 1.00 . A A . 20 ILE HD12 1 1 10 3740 1 1 20 ILE HD13 H -6.653 8.235 -3.759 1.00 . A A . 20 ILE HD13 1 1 10 3741 1 1 20 ILE HG12 H -5.216 6.629 -4.860 1.00 . A A . 20 ILE HG12 1 1 10 3742 1 1 20 ILE HG13 H -6.873 6.044 -4.786 1.00 . A A . 20 ILE HG13 1 1 10 3743 1 1 20 ILE HG21 H -4.256 4.443 -5.190 1.00 . A A . 20 ILE HG21 1 1 10 3744 1 1 20 ILE HG22 H -5.846 3.671 -5.190 1.00 . A A . 20 ILE HG22 1 1 10 3745 1 1 20 ILE HG23 H -4.595 3.120 -4.076 1.00 . A A . 20 ILE HG23 1 1 10 3746 1 1 20 ILE N N -6.080 3.396 -1.735 1.00 . A A . 20 ILE N 1 1 10 3747 1 1 20 ILE O O -8.490 4.311 -4.187 1.00 . A A . 20 ILE O 1 1 10 3748 1 1 21 TRP C C -9.811 1.285 -3.712 1.00 . A A . 21 TRP C 1 1 10 3749 1 1 21 TRP CA C -8.483 1.540 -4.395 1.00 . A A . 21 TRP CA 1 1 10 3750 1 1 21 TRP CB C -7.810 0.230 -4.791 1.00 . A A . 21 TRP CB 1 1 10 3751 1 1 21 TRP CD1 C -5.873 -0.579 -3.317 1.00 . A A . 21 TRP CD1 1 1 10 3752 1 1 21 TRP CD2 C -7.861 -1.440 -2.747 1.00 . A A . 21 TRP CD2 1 1 10 3753 1 1 21 TRP CE2 C -6.882 -1.968 -1.887 1.00 . A A . 21 TRP CE2 1 1 10 3754 1 1 21 TRP CE3 C -9.183 -1.839 -2.578 1.00 . A A . 21 TRP CE3 1 1 10 3755 1 1 21 TRP CG C -7.194 -0.553 -3.659 1.00 . A A . 21 TRP CG 1 1 10 3756 1 1 21 TRP CH2 C -8.497 -3.243 -0.731 1.00 . A A . 21 TRP CH2 1 1 10 3757 1 1 21 TRP CZ2 C -7.190 -2.870 -0.872 1.00 . A A . 21 TRP CZ2 1 1 10 3758 1 1 21 TRP CZ3 C -9.492 -2.733 -1.572 1.00 . A A . 21 TRP CZ3 1 1 10 3759 1 1 21 TRP H H -6.947 1.890 -2.994 1.00 . A A . 21 TRP H 1 1 10 3760 1 1 21 TRP HA H -8.675 2.110 -5.284 1.00 . A A . 21 TRP HA 1 1 10 3761 1 1 21 TRP HB2 H -8.533 -0.408 -5.271 1.00 . A A . 21 TRP HB2 1 1 10 3762 1 1 21 TRP HB3 H -7.028 0.459 -5.490 1.00 . A A . 21 TRP HB3 1 1 10 3763 1 1 21 TRP HD1 H -5.101 -0.011 -3.818 1.00 . A A . 21 TRP HD1 1 1 10 3764 1 1 21 TRP HE1 H -4.814 -1.618 -1.824 1.00 . A A . 21 TRP HE1 1 1 10 3765 1 1 21 TRP HE3 H -9.959 -1.451 -3.213 1.00 . A A . 21 TRP HE3 1 1 10 3766 1 1 21 TRP HH2 H -8.782 -3.939 0.043 1.00 . A A . 21 TRP HH2 1 1 10 3767 1 1 21 TRP HZ2 H -6.432 -3.273 -0.217 1.00 . A A . 21 TRP HZ2 1 1 10 3768 1 1 21 TRP HZ3 H -10.514 -3.048 -1.428 1.00 . A A . 21 TRP HZ3 1 1 10 3769 1 1 21 TRP N N -7.600 2.341 -3.565 1.00 . A A . 21 TRP N 1 1 10 3770 1 1 21 TRP NE1 N -5.679 -1.427 -2.252 1.00 . A A . 21 TRP NE1 1 1 10 3771 1 1 21 TRP O O -10.552 0.371 -4.071 1.00 . A A . 21 TRP O 1 1 10 3772 1 1 22 VAL C C -12.524 2.492 -2.969 1.00 . A A . 22 VAL C 1 1 10 3773 1 1 22 VAL CA C -11.384 2.083 -2.048 1.00 . A A . 22 VAL CA 1 1 10 3774 1 1 22 VAL CB C -11.337 2.983 -0.792 1.00 . A A . 22 VAL CB 1 1 10 3775 1 1 22 VAL CG1 C -11.033 4.423 -1.183 1.00 . A A . 22 VAL CG1 1 1 10 3776 1 1 22 VAL CG2 C -12.633 2.888 0.006 1.00 . A A . 22 VAL CG2 1 1 10 3777 1 1 22 VAL H H -9.488 2.863 -2.560 1.00 . A A . 22 VAL H 1 1 10 3778 1 1 22 VAL HA H -11.534 1.072 -1.749 1.00 . A A . 22 VAL HA 1 1 10 3779 1 1 22 VAL HB H -10.529 2.634 -0.163 1.00 . A A . 22 VAL HB 1 1 10 3780 1 1 22 VAL HG11 H -10.107 4.452 -1.744 1.00 . A A . 22 VAL HG11 1 1 10 3781 1 1 22 VAL HG12 H -10.935 5.026 -0.293 1.00 . A A . 22 VAL HG12 1 1 10 3782 1 1 22 VAL HG13 H -11.836 4.807 -1.796 1.00 . A A . 22 VAL HG13 1 1 10 3783 1 1 22 VAL HG21 H -13.462 3.198 -0.614 1.00 . A A . 22 VAL HG21 1 1 10 3784 1 1 22 VAL HG22 H -12.572 3.527 0.874 1.00 . A A . 22 VAL HG22 1 1 10 3785 1 1 22 VAL HG23 H -12.786 1.866 0.321 1.00 . A A . 22 VAL HG23 1 1 10 3786 1 1 22 VAL N N -10.124 2.146 -2.769 1.00 . A A . 22 VAL N 1 1 10 3787 1 1 22 VAL O O -13.696 2.205 -2.733 1.00 . A A . 22 VAL O 1 1 10 3788 1 1 23 ASN C C -13.093 2.490 -6.203 1.00 . A A . 23 ASN C 1 1 10 3789 1 1 23 ASN CA C -13.051 3.539 -5.096 1.00 . A A . 23 ASN CA 1 1 10 3790 1 1 23 ASN CB C -12.651 4.921 -5.650 1.00 . A A . 23 ASN CB 1 1 10 3791 1 1 23 ASN CG C -11.204 5.025 -6.127 1.00 . A A . 23 ASN CG 1 1 10 3792 1 1 23 ASN H H -11.177 3.294 -4.147 1.00 . A A . 23 ASN H 1 1 10 3793 1 1 23 ASN HA H -14.034 3.611 -4.655 1.00 . A A . 23 ASN HA 1 1 10 3794 1 1 23 ASN HB2 H -13.291 5.156 -6.486 1.00 . A A . 23 ASN HB2 1 1 10 3795 1 1 23 ASN HB3 H -12.807 5.659 -4.875 1.00 . A A . 23 ASN HB3 1 1 10 3796 1 1 23 ASN HD21 H -11.294 3.258 -7.024 1.00 . A A . 23 ASN HD21 1 1 10 3797 1 1 23 ASN HD22 H -9.778 4.083 -7.154 1.00 . A A . 23 ASN HD22 1 1 10 3798 1 1 23 ASN N N -12.130 3.120 -4.049 1.00 . A A . 23 ASN N 1 1 10 3799 1 1 23 ASN ND2 N -10.713 4.020 -6.835 1.00 . A A . 23 ASN ND2 1 1 10 3800 1 1 23 ASN O O -13.644 2.720 -7.279 1.00 . A A . 23 ASN O 1 1 10 3801 1 1 23 ASN OD1 O -10.545 6.038 -5.896 1.00 . A A . 23 ASN OD1 1 1 10 3802 1 1 24 ARG C C -11.744 0.597 -8.140 1.00 . A A . 24 ARG C 1 1 10 3803 1 1 24 ARG CA C -12.421 0.207 -6.831 1.00 . A A . 24 ARG CA 1 1 10 3804 1 1 24 ARG CB C -13.813 -0.368 -7.088 1.00 . A A . 24 ARG CB 1 1 10 3805 1 1 24 ARG CD C -15.747 -1.675 -6.156 1.00 . A A . 24 ARG CD 1 1 10 3806 1 1 24 ARG CG C -14.465 -0.930 -5.835 1.00 . A A . 24 ARG CG 1 1 10 3807 1 1 24 ARG CZ C -16.388 -3.363 -7.828 1.00 . A A . 24 ARG CZ 1 1 10 3808 1 1 24 ARG H H -12.069 1.244 -5.024 1.00 . A A . 24 ARG H 1 1 10 3809 1 1 24 ARG HA H -11.820 -0.553 -6.356 1.00 . A A . 24 ARG HA 1 1 10 3810 1 1 24 ARG HB2 H -14.448 0.415 -7.481 1.00 . A A . 24 ARG HB2 1 1 10 3811 1 1 24 ARG HB3 H -13.735 -1.159 -7.816 1.00 . A A . 24 ARG HB3 1 1 10 3812 1 1 24 ARG HD2 H -16.211 -1.982 -5.232 1.00 . A A . 24 ARG HD2 1 1 10 3813 1 1 24 ARG HD3 H -16.410 -1.009 -6.689 1.00 . A A . 24 ARG HD3 1 1 10 3814 1 1 24 ARG HE H -14.627 -3.308 -6.874 1.00 . A A . 24 ARG HE 1 1 10 3815 1 1 24 ARG HG2 H -13.776 -1.612 -5.356 1.00 . A A . 24 ARG HG2 1 1 10 3816 1 1 24 ARG HG3 H -14.692 -0.116 -5.163 1.00 . A A . 24 ARG HG3 1 1 10 3817 1 1 24 ARG HH11 H -17.758 -1.897 -7.524 1.00 . A A . 24 ARG HH11 1 1 10 3818 1 1 24 ARG HH12 H -18.226 -3.123 -8.666 1.00 . A A . 24 ARG HH12 1 1 10 3819 1 1 24 ARG HH21 H -15.220 -4.928 -8.378 1.00 . A A . 24 ARG HH21 1 1 10 3820 1 1 24 ARG HH22 H -16.778 -4.868 -9.138 1.00 . A A . 24 ARG HH22 1 1 10 3821 1 1 24 ARG N N -12.486 1.339 -5.908 1.00 . A A . 24 ARG N 1 1 10 3822 1 1 24 ARG NE N -15.500 -2.855 -6.981 1.00 . A A . 24 ARG NE 1 1 10 3823 1 1 24 ARG NH1 N -17.550 -2.746 -8.021 1.00 . A A . 24 ARG NH1 1 1 10 3824 1 1 24 ARG NH2 N -16.104 -4.471 -8.506 1.00 . A A . 24 ARG NH2 1 1 10 3825 1 1 24 ARG O O -12.244 0.304 -9.227 1.00 . A A . 24 ARG O 1 1 10 3826 1 1 25 ASN C C -8.446 2.142 -8.704 1.00 . A A . 25 ASN C 1 1 10 3827 1 1 25 ASN CA C -9.815 1.671 -9.169 1.00 . A A . 25 ASN CA 1 1 10 3828 1 1 25 ASN CB C -10.517 2.795 -9.936 1.00 . A A . 25 ASN CB 1 1 10 3829 1 1 25 ASN CG C -9.818 3.114 -11.241 1.00 . A A . 25 ASN CG 1 1 10 3830 1 1 25 ASN H H -10.256 1.448 -7.121 1.00 . A A . 25 ASN H 1 1 10 3831 1 1 25 ASN HA H -9.692 0.818 -9.821 1.00 . A A . 25 ASN HA 1 1 10 3832 1 1 25 ASN HB2 H -11.531 2.496 -10.154 1.00 . A A . 25 ASN HB2 1 1 10 3833 1 1 25 ASN HB3 H -10.530 3.686 -9.324 1.00 . A A . 25 ASN HB3 1 1 10 3834 1 1 25 ASN HD21 H -10.396 5.008 -11.119 1.00 . A A . 25 ASN HD21 1 1 10 3835 1 1 25 ASN HD22 H -9.477 4.587 -12.524 1.00 . A A . 25 ASN HD22 1 1 10 3836 1 1 25 ASN N N -10.598 1.250 -8.017 1.00 . A A . 25 ASN N 1 1 10 3837 1 1 25 ASN ND2 N -9.900 4.361 -11.667 1.00 . A A . 25 ASN ND2 1 1 10 3838 1 1 25 ASN O O -8.354 3.268 -8.179 1.00 . A A . 25 ASN O 1 1 10 3839 1 1 25 ASN OXT O -7.477 1.368 -8.833 1.00 . A A . 25 ASN OXT 1 1 10 3840 1 1 25 ASN OD1 O -9.202 2.246 -11.858 1.00 . A A . 25 ASN OD1 1 1 stop_ save_
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