NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
649391 | 6pv2 | 30643 | cing | 4-filtered-FRED | STAR | entry | full | 440 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6pv2 # This FRED archive file contains, for PDB entry <6pv2>: # # - 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_6pv2 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6pv2 _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 3756.65 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 $Transcription_factor_Sp1 A . 1 1 2 . 2 $ZINC_ION B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 ZN 1 ZN 1 1 stop_ save_ save_Transcription_factor_Sp1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Transcription factor Sp1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code RPFXCTWXCGKRFTRSDELQRHKRTHTGEKX _Entity.Number_of_monomers 31 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 ARG . 1 1 2 PRO . 1 1 3 PHE . 1 1 4 NLE $NLE 1 1 5 CYS . 1 1 6 THR . 1 1 7 TRP . 1 1 8 ORN $ORN 1 1 9 CYS . 1 1 10 GLY . 1 1 11 LYS . 1 1 12 ARG . 1 1 13 PHE . 1 1 14 THR . 1 1 15 ARG . 1 1 16 SER . 1 1 17 ASP . 1 1 18 GLU . 1 1 19 LEU . 1 1 20 GLN . 1 1 21 ARG . 1 1 22 HIS . 1 1 23 LYS . 1 1 24 ARG . 1 1 25 THR . 1 1 26 HIS . 1 1 27 THR . 1 1 28 GLY . 1 1 29 GLU . 1 1 30 LYS . 1 1 31 NH2 $NH2 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 ARG 1 1 1 1 PRO 2 2 1 1 PHE 3 3 1 1 NLE 4 4 1 1 CYS 5 5 1 1 THR 6 6 1 1 TRP 7 7 1 1 ORN 8 8 1 1 CYS 9 9 1 1 GLY 10 10 1 1 LYS 11 11 1 1 ARG 12 12 1 1 PHE 13 13 1 1 THR 14 14 1 1 ARG 15 15 1 1 SER 16 16 1 1 ASP 17 17 1 1 GLU 18 18 1 1 LEU 19 19 1 1 GLN 20 20 1 1 ARG 21 21 1 1 HIS 22 22 1 1 LYS 23 23 1 1 ARG 24 24 1 1 THR 25 25 1 1 HIS 26 26 1 1 THR 27 27 1 1 GLY 28 28 1 1 GLU 29 29 1 1 LYS 30 30 1 1 NH2 31 31 1 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ZINC ION" _Entity.Type non-polymer loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ZN $ZN 1 2 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_NLE _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NLE _Chem_comp.Type non-polymer save_ save_ORN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ORN _Chem_comp.Type non-polymer save_ save_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ZN _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 2 . OR 1 1 6 2 . 3 . 1 1 6 3 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 2 . OR 1 1 9 2 . 3 . 1 1 9 3 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 2 . OR 1 1 14 2 . 3 . 1 1 14 3 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 2 . OR 1 1 17 2 . 3 . 1 1 17 3 . . . 1 1 18 1 . . . 1 1 19 1 2 . OR 1 1 19 2 . 3 . 1 1 19 3 . . . 1 1 20 1 2 . OR 1 1 20 2 . 3 . 1 1 20 3 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 2 . OR 1 1 24 2 . 3 . 1 1 24 3 . . . 1 1 25 1 2 . OR 1 1 25 2 . 3 . 1 1 25 3 . 4 . 1 1 25 4 . . . 1 1 26 1 2 . OR 1 1 26 2 . 3 . 1 1 26 3 . . . 1 1 27 1 2 . OR 1 1 27 2 . 3 . 1 1 27 3 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 2 . OR 1 1 30 2 . 3 . 1 1 30 3 . . . 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 15 ARG QB . 15 . HB1 1 1 1 1 2 1 1 15 ARG QG . 15 . HG1 1 1 2 1 1 1 1 21 ARG H . 21 . HN 1 1 2 1 1 1 1 22 HIS H . 22 . HN 1 1 2 1 2 1 1 21 ARG HB2 . 21 . HB1 1 1 3 1 1 1 1 5 CYS HB2 . 5 . HB1 1 1 3 1 1 1 1 22 HIS HB2 . 22 . HB1 1 1 3 1 2 1 1 13 PHE QE . 13 . HE1 1 1 4 1 1 1 1 24 ARG HA . 24 . HA 1 1 4 1 2 1 1 24 ARG QB . 24 . HB1 1 1 5 1 1 1 1 29 GLU HA . 29 . HA 1 1 5 1 1 1 1 30 LYS HA . 30 . HA 1 1 5 1 2 1 1 30 LYS H . 30 . HN 1 1 6 2 1 1 1 18 GLU HA . 18 . HA 1 1 6 2 1 1 1 20 GLN HA . 20 . HA 1 1 6 2 2 1 1 21 ARG H . 21 . HN 1 1 6 3 1 1 1 18 GLU HA . 18 . HA 1 1 6 3 2 1 1 22 HIS H . 22 . HN 1 1 7 1 1 1 1 10 GLY QA . 10 . HA1 1 1 7 1 1 1 1 11 LYS HA . 11 . HA 1 1 7 1 2 1 1 11 LYS H . 11 . HN 1 1 8 1 1 1 1 11 LYS QG . 11 . HG1 1 1 8 1 1 1 1 19 LEU QB . 19 . HB1 1 1 8 1 2 1 1 13 PHE QE . 13 . HE1 1 1 9 2 1 1 1 2 PRO HB2 . 2 . HB1 1 1 9 2 2 1 1 13 PHE H . 13 . HN 1 1 9 3 1 1 1 23 LYS H . 23 . HN 1 1 9 3 2 1 1 23 LYS QD . 23 . HD1 1 1 10 1 1 1 1 11 LYS HA . 11 . HA 1 1 10 1 2 1 1 11 LYS QD . 11 . HD1 1 1 10 1 2 1 1 12 ARG HG2 . 12 . HG1 1 1 11 1 1 1 1 3 PHE QD . 3 . HD1 1 1 11 1 1 1 1 13 PHE QD . 13 . HD1 1 1 11 1 2 1 1 19 LEU QB . 19 . HB2 1 1 12 1 1 1 1 20 GLN H . 20 . HN 1 1 12 1 2 1 1 20 GLN QG . 20 . HG1 1 1 13 1 1 1 1 20 GLN HA . 20 . HA 1 1 13 1 2 1 1 20 GLN QG . 20 . HG1 1 1 14 2 1 1 1 21 ARG H . 21 . HN 1 1 14 2 2 1 1 21 ARG HB3 . 21 . HB2 1 1 14 3 1 1 1 24 ARG HB2 . 24 . HB1 1 1 14 3 2 1 1 25 THR H . 25 . HN 1 1 15 1 1 1 1 19 LEU HA . 19 . HA 1 1 15 1 2 1 1 21 ARG H . 21 . HN 1 1 15 1 2 1 1 22 HIS H . 22 . HN 1 1 16 1 1 1 1 4 NLE H . 4 . HN 1 1 16 1 2 1 1 4 NLE HG2 . 4 . HG1 1 1 16 1 2 1 1 4 NLE HG3 . 4 . HG2 1 1 16 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 17 2 1 1 1 7 TRP HH2 . 7 . HH2 1 1 17 2 2 1 1 26 HIS HB3 . 26 . HB1 1 1 17 3 1 1 1 12 ARG QB . 12 . HB1 1 1 17 3 2 1 1 12 ARG HE . 12 . HE 1 1 18 1 1 1 1 21 ARG H . 21 . HN 1 1 18 1 1 1 1 22 HIS H . 22 . HN 1 1 18 1 2 1 1 21 ARG QG . 21 . HG1 1 1 19 2 1 1 1 5 CYS HB2 . 5 . HB1 1 1 19 2 2 1 1 7 TRP H . 7 . HN 1 1 19 3 1 1 1 5 CYS HB2 . 5 . HB1 1 1 19 3 1 1 1 22 HIS HB2 . 22 . HB1 1 1 19 3 2 1 1 23 LYS H . 23 . HN 1 1 20 2 1 1 1 20 GLN HA . 20 . HA 1 1 20 2 1 1 1 21 ARG HA . 21 . HA 1 1 20 2 2 1 1 21 ARG H . 21 . HN 1 1 20 3 1 1 1 21 ARG HA . 21 . HA 1 1 20 3 2 1 1 22 HIS H . 22 . HN 1 1 21 1 1 1 1 21 ARG H . 21 . HN 1 1 21 1 1 1 1 22 HIS H . 22 . HN 1 1 21 1 1 1 1 25 THR H . 25 . HN 1 1 21 1 2 1 1 23 LYS QB . 23 . HB1 1 1 22 1 1 1 1 13 PHE H . 13 . HN 1 1 22 1 1 1 1 23 LYS H . 23 . HN 1 1 22 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 23 1 1 1 1 18 GLU HG3 . 18 . HG1 1 1 23 1 1 1 1 20 GLN QB . 20 . HB1 1 1 23 1 2 1 1 19 LEU H . 19 . HN 1 1 24 2 1 1 1 3 PHE HB2 . 3 . HB1 1 1 24 2 2 1 1 3 PHE QE . 3 . HE1 1 1 24 3 1 1 1 7 TRP HE3 . 7 . HE3 1 1 24 3 2 1 1 23 LYS HE3 . 23 . HE2 1 1 25 2 1 1 1 2 PRO HB2 . 2 . HB1 1 1 25 2 2 1 1 3 PHE QD . 3 . HD1 1 1 25 2 2 1 1 12 ARG HE . 12 . HE 1 1 25 3 1 1 1 3 PHE QD . 3 . HD1 1 1 25 3 2 1 1 15 ARG QG . 15 . HG2 1 1 25 4 1 1 1 4 NLE HB3 . 4 . HB2 1 1 25 4 2 1 1 12 ARG HE . 12 . HE 1 1 25 4 2 1 1 13 PHE QD . 13 . HD1 1 1 26 2 1 1 1 7 TRP HZ3 . 7 . HZ3 1 1 26 2 2 1 1 27 THR MG . 27 . HG21 1 1 26 3 1 1 1 24 ARG H . 24 . HN 1 1 26 3 2 1 1 25 THR MG . 25 . HG21 1 1 27 2 1 1 1 3 PHE QE . 3 . HE1 1 1 27 2 2 1 1 17 ASP H . 17 . HN 1 1 27 3 1 1 1 7 TRP H . 7 . HN 1 1 27 3 2 1 1 7 TRP HE3 . 7 . HE3 1 1 28 1 1 1 1 25 THR MG . 25 . HG21 1 1 28 1 1 1 1 27 THR MG . 27 . HG21 1 1 28 1 2 1 1 26 HIS H . 26 . HN 1 1 29 1 1 1 1 19 LEU MD1 . 19 . HD11 1 1 29 1 2 1 1 21 ARG H . 21 . HN 1 1 29 1 2 1 1 22 HIS H . 22 . HN 1 1 30 2 1 1 1 7 TRP H . 7 . HN 1 1 30 2 2 1 1 9 CYS QB . 9 . HB1 1 1 30 3 1 1 1 19 LEU HA . 19 . HA 1 1 30 3 2 1 1 23 LYS H . 23 . HN 1 1 31 1 1 1 1 9 CYS HA . 9 . HA 1 1 31 1 2 1 1 11 LYS H . 11 . HN 1 1 31 1 2 1 1 26 HIS HE1 . 26 . HE1 1 1 32 1 1 1 1 7 TRP H . 7 . HN 1 1 32 1 1 1 1 23 LYS H . 23 . HN 1 1 32 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 33 1 1 1 1 4 NLE HB3 . 4 . HB2 1 1 33 1 1 1 1 12 ARG HG3 . 12 . HG2 1 1 33 1 2 1 1 12 ARG HA . 12 . HA 1 1 34 1 1 1 1 11 LYS H . 11 . HN 1 1 34 1 1 1 1 26 HIS HE1 . 26 . HE1 1 1 34 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 35 1 1 1 1 21 ARG H . 21 . HN 1 1 35 1 1 1 1 22 HIS H . 22 . HN 1 1 35 1 2 1 1 21 ARG HA . 21 . HA 1 1 36 1 1 1 1 22 HIS H . 22 . HN 1 1 36 1 1 1 1 25 THR H . 25 . HN 1 1 36 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 37 1 1 1 1 18 GLU QB . 18 . HB1 1 1 37 1 2 1 1 18 GLU HG3 . 18 . HG1 1 1 38 1 1 1 1 8 ORN HD2 . 8 . HD1 1 1 38 1 2 1 1 8 ORN HD3 . 8 . HD2 1 1 39 1 1 1 1 11 LYS HA . 11 . HA 1 1 39 1 2 1 1 12 ARG H . 12 . HN 1 1 40 1 1 1 1 20 GLN HA . 20 . HA 1 1 40 1 2 1 1 20 GLN QB . 20 . HB1 1 1 41 1 1 1 1 6 THR HB . 6 . HB 1 1 41 1 2 1 1 6 THR MG . 6 . HG21 1 1 42 1 1 1 1 29 GLU HB3 . 29 . HB2 1 1 42 1 2 1 1 29 GLU QG . 29 . HG1 1 1 43 1 1 1 1 19 LEU MD1 . 19 . HD11 1 1 43 1 2 1 1 19 LEU HG . 19 . HG 1 1 44 1 1 1 1 12 ARG HA . 12 . HA 1 1 44 1 2 1 1 13 PHE H . 13 . HN 1 1 45 1 1 1 1 3 PHE HA . 3 . HA 1 1 45 1 2 1 1 4 NLE H . 4 . HN 1 1 46 1 1 1 1 19 LEU MD2 . 19 . HD21 1 1 46 1 2 1 1 19 LEU HG . 19 . HG 1 1 47 1 1 1 1 4 NLE HA . 4 . HA 1 1 47 1 2 1 1 5 CYS H . 5 . HN 1 1 48 1 1 1 1 13 PHE HB2 . 13 . HB1 1 1 48 1 2 1 1 13 PHE QD . 13 . HD1 1 1 49 1 1 1 1 25 THR HB . 25 . HB 1 1 49 1 2 1 1 25 THR MG . 25 . HG21 1 1 50 1 1 1 1 3 PHE HB2 . 3 . HB1 1 1 50 1 2 1 1 3 PHE QD . 3 . HD1 1 1 51 1 1 1 1 23 LYS HA . 23 . HA 1 1 51 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 52 1 1 1 1 5 CYS HB2 . 5 . HB1 1 1 52 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 53 1 1 1 1 22 HIS H . 22 . HN 1 1 53 1 2 1 1 22 HIS HB3 . 22 . HB2 1 1 54 1 1 1 1 11 LYS HA . 11 . HA 1 1 54 1 2 1 1 11 LYS QG . 11 . HG1 1 1 55 1 1 1 1 21 ARG HA . 21 . HA 1 1 55 1 2 1 1 21 ARG HB2 . 21 . HB1 1 1 56 1 1 1 1 24 ARG H . 24 . HN 1 1 56 1 2 1 1 24 ARG HB2 . 24 . HB1 1 1 57 1 1 1 1 24 ARG HB2 . 24 . HB1 1 1 57 1 2 1 1 24 ARG QD . 24 . HD1 1 1 58 1 1 1 1 13 PHE HB3 . 13 . HB2 1 1 58 1 2 1 1 13 PHE QD . 13 . HD1 1 1 59 1 1 1 1 3 PHE HB3 . 3 . HB2 1 1 59 1 2 1 1 3 PHE QD . 3 . HD1 1 1 60 1 1 1 1 23 LYS HA . 23 . HA 1 1 60 1 2 1 1 23 LYS QB . 23 . HB1 1 1 61 1 1 1 1 8 ORN HA . 8 . HA 1 1 61 1 2 1 1 8 ORN HB2 . 8 . HB1 1 1 61 1 2 1 1 8 ORN HB3 . 8 . HB2 1 1 62 1 1 1 1 2 PRO HA . 2 . HA 1 1 62 1 2 1 1 3 PHE H . 3 . HN 1 1 63 1 1 1 1 8 ORN HA . 8 . HA 1 1 63 1 2 1 1 8 ORN HD3 . 8 . HD2 1 1 64 1 1 1 1 6 THR HA . 6 . HA 1 1 64 1 2 1 1 6 THR MG . 6 . HG21 1 1 65 1 1 1 1 19 LEU H . 19 . HN 1 1 65 1 2 1 1 19 LEU QB . 19 . HB2 1 1 66 1 1 1 1 8 ORN HB2 . 8 . HB1 1 1 66 1 1 1 1 8 ORN HB3 . 8 . HB2 1 1 66 1 2 1 1 8 ORN HD2 . 8 . HD1 1 1 67 1 1 1 1 18 GLU H . 18 . HN 1 1 67 1 2 1 1 18 GLU QB . 18 . HB1 1 1 68 1 1 1 1 19 LEU HA . 19 . HA 1 1 68 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 69 1 1 1 1 25 THR HA . 25 . HA 1 1 69 1 2 1 1 25 THR MG . 25 . HG21 1 1 70 1 1 1 1 19 LEU HA . 19 . HA 1 1 70 1 2 1 1 19 LEU QB . 19 . HB1 1 1 71 1 1 1 1 19 LEU HA . 19 . HA 1 1 71 1 2 1 1 22 HIS HB3 . 22 . HB2 1 1 72 1 1 1 1 21 ARG HA . 21 . HA 1 1 72 1 2 1 1 21 ARG HB3 . 21 . HB2 1 1 73 1 1 1 1 10 GLY H . 10 . HN 1 1 73 1 2 1 1 10 GLY QA . 10 . HA2 1 1 74 1 1 1 1 20 GLN QB . 20 . HB1 1 1 74 1 2 1 1 20 GLN QG . 20 . HG1 1 1 75 1 1 1 1 12 ARG QD . 12 . HD1 1 1 75 1 2 1 1 12 ARG HG3 . 12 . HG2 1 1 76 1 1 1 1 3 PHE HB2 . 3 . HB1 1 1 76 1 2 1 1 13 PHE HB2 . 13 . HB1 1 1 77 1 1 1 1 7 TRP H . 7 . HN 1 1 77 1 2 1 1 7 TRP HB3 . 7 . HB1 1 1 78 1 1 1 1 20 GLN H . 20 . HN 1 1 78 1 2 1 1 20 GLN QB . 20 . HB1 1 1 79 1 1 1 1 23 LYS H . 23 . HN 1 1 79 1 2 1 1 23 LYS QB . 23 . HB1 1 1 80 1 1 1 1 18 GLU H . 18 . HN 1 1 80 1 2 1 1 19 LEU H . 19 . HN 1 1 81 1 1 1 1 17 ASP HA . 17 . HA 1 1 81 1 2 1 1 17 ASP HB3 . 17 . HB2 1 1 82 1 1 1 1 13 PHE HA . 13 . HA 1 1 82 1 2 1 1 13 PHE QD . 13 . HD1 1 1 83 1 1 1 1 21 ARG HB2 . 21 . HB1 1 1 83 1 2 1 1 21 ARG HD2 . 21 . HD1 1 1 84 1 1 1 1 7 TRP H . 7 . HN 1 1 84 1 2 1 1 7 TRP HB2 . 7 . HB2 1 1 85 1 1 1 1 17 ASP HA . 17 . HA 1 1 85 1 2 1 1 17 ASP HB2 . 17 . HB1 1 1 86 1 1 1 1 18 GLU HA . 18 . HA 1 1 86 1 2 1 1 18 GLU QB . 18 . HB1 1 1 87 1 1 1 1 14 THR HB . 14 . HB 1 1 87 1 2 1 1 14 THR MG . 14 . HG21 1 1 88 1 1 1 1 21 ARG HD3 . 21 . HD2 1 1 88 1 2 1 1 21 ARG QG . 21 . HG1 1 1 89 1 1 1 1 13 PHE QD . 13 . HD1 1 1 89 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 90 1 1 1 1 13 PHE HA . 13 . HA 1 1 90 1 2 1 1 13 PHE HB3 . 13 . HB2 1 1 91 1 1 1 1 24 ARG HA . 24 . HA 1 1 91 1 2 1 1 24 ARG HG3 . 24 . HG2 1 1 92 1 1 1 1 22 HIS H . 22 . HN 1 1 92 1 2 1 1 22 HIS HB2 . 22 . HB1 1 1 93 1 1 1 1 26 HIS H . 26 . HN 1 1 93 1 2 1 1 26 HIS HB2 . 26 . HB2 1 1 94 1 1 1 1 25 THR H . 25 . HN 1 1 94 1 2 1 1 25 THR MG . 25 . HG21 1 1 95 1 1 1 1 2 PRO HA . 2 . HA 1 1 95 1 2 1 1 2 PRO HB3 . 2 . HB2 1 1 96 1 1 1 1 5 CYS HA . 5 . HA 1 1 96 1 2 1 1 5 CYS HB2 . 5 . HB1 1 1 97 1 1 1 1 8 ORN HB2 . 8 . HB1 1 1 97 1 1 1 1 8 ORN HB3 . 8 . HB2 1 1 97 1 2 1 1 8 ORN HD3 . 8 . HD2 1 1 98 1 1 1 1 11 LYS H . 11 . HN 1 1 98 1 2 1 1 11 LYS QB . 11 . HB1 1 1 99 1 1 1 1 19 LEU QB . 19 . HB2 1 1 99 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 100 1 1 1 1 5 CYS HB2 . 5 . HB1 1 1 100 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 101 1 1 1 1 23 LYS QB . 23 . HB1 1 1 101 1 2 1 1 24 ARG H . 24 . HN 1 1 102 1 1 1 1 17 ASP HA . 17 . HA 1 1 102 1 2 1 1 20 GLN QB . 20 . HB1 1 1 103 1 1 1 1 27 THR HB . 27 . HB 1 1 103 1 2 1 1 27 THR MG . 27 . HG21 1 1 104 1 1 1 1 19 LEU MD1 . 19 . HD11 1 1 104 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 105 1 1 1 1 12 ARG HA . 12 . HA 1 1 105 1 2 1 1 12 ARG HG3 . 12 . HG2 1 1 106 1 1 1 1 3 PHE HA . 3 . HA 1 1 106 1 2 1 1 3 PHE QD . 3 . HD1 1 1 107 1 1 1 1 1 ARG HA . 1 . HA 1 1 107 1 2 1 1 2 PRO HD3 . 2 . HD2 1 1 108 1 1 1 1 5 CYS H . 5 . HN 1 1 108 1 2 1 1 5 CYS HB3 . 5 . HB2 1 1 109 1 1 1 1 15 ARG HA . 15 . HA 1 1 109 1 2 1 1 16 SER H . 16 . HN 1 1 110 1 1 1 1 9 CYS HA . 9 . HA 1 1 110 1 2 1 1 9 CYS QB . 9 . HB1 1 1 111 1 1 1 1 5 CYS HA . 5 . HA 1 1 111 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 112 1 1 1 1 25 THR H . 25 . HN 1 1 112 1 2 1 1 26 HIS H . 26 . HN 1 1 113 1 1 1 1 9 CYS QB . 9 . HB1 1 1 113 1 2 1 1 26 HIS HE1 . 26 . HE1 1 1 114 1 1 1 1 12 ARG QB . 12 . HB1 1 1 114 1 2 1 1 12 ARG QD . 12 . HD1 1 1 115 1 1 1 1 22 HIS HB3 . 22 . HB2 1 1 115 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 116 1 1 1 1 15 ARG HD3 . 15 . HD2 1 1 116 1 2 1 1 15 ARG QG . 15 . HG2 1 1 117 1 1 1 1 13 PHE H . 13 . HN 1 1 117 1 2 1 1 13 PHE QD . 13 . HD1 1 1 118 1 1 1 1 13 PHE HA . 13 . HA 1 1 118 1 2 1 1 14 THR H . 14 . HN 1 1 119 1 1 1 1 22 HIS H . 22 . HN 1 1 119 1 2 1 1 22 HIS HA . 22 . HA 1 1 120 1 1 1 1 21 ARG HB2 . 21 . HB1 1 1 120 1 2 1 1 21 ARG HD3 . 21 . HD2 1 1 121 1 1 1 1 26 HIS HB2 . 26 . HB2 1 1 121 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 122 1 1 1 1 12 ARG QD . 12 . HD1 1 1 122 1 2 1 1 12 ARG HG2 . 12 . HG1 1 1 123 1 1 1 1 3 PHE HB3 . 3 . HB2 1 1 123 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 124 1 1 1 1 12 ARG H . 12 . HN 1 1 124 1 2 1 1 12 ARG QB . 12 . HB1 1 1 125 1 1 1 1 3 PHE HA . 3 . HA 1 1 125 1 2 1 1 3 PHE HB3 . 3 . HB2 1 1 126 1 1 1 1 22 HIS HA . 22 . HA 1 1 126 1 2 1 1 22 HIS HB2 . 22 . HB1 1 1 127 1 1 1 1 24 ARG QD . 24 . HD1 1 1 127 1 2 1 1 24 ARG HG2 . 24 . HG1 1 1 128 1 1 1 1 15 ARG HA . 15 . HA 1 1 128 1 2 1 1 15 ARG QG . 15 . HG2 1 1 129 1 1 1 1 13 PHE QE . 13 . HE1 1 1 129 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 130 1 1 1 1 4 NLE HA . 4 . HA 1 1 130 1 2 1 1 4 NLE HB2 . 4 . HB1 1 1 131 1 1 1 1 16 SER HA . 16 . HA 1 1 131 1 2 1 1 16 SER HB3 . 16 . HB2 1 1 132 1 1 1 1 28 GLY H . 28 . HN 1 1 132 1 2 1 1 28 GLY HA2 . 28 . HA1 1 1 133 1 1 1 1 24 ARG H . 24 . HN 1 1 133 1 2 1 1 24 ARG HA . 24 . HA 1 1 134 1 1 1 1 3 PHE QD . 3 . HD1 1 1 134 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 135 1 1 1 1 11 LYS HA . 11 . HA 1 1 135 1 2 1 1 11 LYS QB . 11 . HB1 1 1 136 1 1 1 1 5 CYS H . 5 . HN 1 1 136 1 2 1 1 5 CYS HB2 . 5 . HB1 1 1 137 1 1 1 1 14 THR HA . 14 . HA 1 1 137 1 2 1 1 14 THR MG . 14 . HG21 1 1 138 1 1 1 1 13 PHE QD . 13 . HD1 1 1 138 1 2 1 1 18 GLU QB . 18 . HB1 1 1 139 1 1 1 1 20 GLN QB . 20 . HB1 1 1 139 1 2 1 1 21 ARG H . 21 . HN 1 1 140 1 1 1 1 13 PHE QE . 13 . HE1 1 1 140 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 141 1 1 1 1 8 ORN HD2 . 8 . HD1 1 1 141 1 2 1 1 8 ORN HG2 . 8 . HG1 1 1 141 1 2 1 1 8 ORN HG3 . 8 . HG2 1 1 142 1 1 1 1 27 THR HA . 27 . HA 1 1 142 1 2 1 1 27 THR MG . 27 . HG21 1 1 143 1 1 1 1 3 PHE H . 3 . HN 1 1 143 1 2 1 1 13 PHE H . 13 . HN 1 1 144 1 1 1 1 13 PHE HB3 . 13 . HB2 1 1 144 1 2 1 1 15 ARG H . 15 . HN 1 1 145 1 1 1 1 21 ARG HA . 21 . HA 1 1 145 1 2 1 1 21 ARG QG . 21 . HG1 1 1 146 1 1 1 1 20 GLN HA . 20 . HA 1 1 146 1 2 1 1 23 LYS QB . 23 . HB1 1 1 147 1 1 1 1 20 GLN H . 20 . HN 1 1 147 1 2 1 1 20 GLN HA . 20 . HA 1 1 148 1 1 1 1 5 CYS HA . 5 . HA 1 1 148 1 2 1 1 6 THR H . 6 . HN 1 1 149 1 1 1 1 22 HIS H . 22 . HN 1 1 149 1 2 1 1 23 LYS H . 23 . HN 1 1 150 1 1 1 1 19 LEU H . 19 . HN 1 1 150 1 2 1 1 20 GLN H . 20 . HN 1 1 151 1 1 1 1 13 PHE HB3 . 13 . HB2 1 1 151 1 2 1 1 18 GLU QB . 18 . HB1 1 1 152 1 1 1 1 7 TRP HA . 7 . HA 1 1 152 1 2 1 1 7 TRP HB3 . 7 . HB1 1 1 153 1 1 1 1 7 TRP HA . 7 . HA 1 1 153 1 2 1 1 7 TRP HB2 . 7 . HB2 1 1 154 1 1 1 1 25 THR H . 25 . HN 1 1 154 1 2 1 1 25 THR HA . 25 . HA 1 1 155 1 1 1 1 7 TRP HB2 . 7 . HB2 1 1 155 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 156 1 1 1 1 9 CYS HA . 9 . HA 1 1 156 1 2 1 1 10 GLY H . 10 . HN 1 1 157 1 1 1 1 19 LEU QB . 19 . HB2 1 1 157 1 2 1 1 20 GLN H . 20 . HN 1 1 158 1 1 1 1 22 HIS HB3 . 22 . HB2 1 1 158 1 2 1 1 23 LYS H . 23 . HN 1 1 159 1 1 1 1 19 LEU H . 19 . HN 1 1 159 1 2 1 1 19 LEU HA . 19 . HA 1 1 160 1 1 1 1 18 GLU H . 18 . HN 1 1 160 1 2 1 1 18 GLU HA . 18 . HA 1 1 161 1 1 1 1 23 LYS H . 23 . HN 1 1 161 1 2 1 1 23 LYS HA . 23 . HA 1 1 162 1 1 1 1 19 LEU QB . 19 . HB2 1 1 162 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 163 1 1 1 1 3 PHE HB3 . 3 . HB2 1 1 163 1 2 1 1 19 LEU QB . 19 . HB1 1 1 164 1 1 1 1 11 LYS H . 11 . HN 1 1 164 1 2 1 1 11 LYS QG . 11 . HG1 1 1 165 1 1 1 1 13 PHE H . 13 . HN 1 1 165 1 2 1 1 13 PHE HB2 . 13 . HB1 1 1 166 1 1 1 1 13 PHE HA . 13 . HA 1 1 166 1 2 1 1 13 PHE HB2 . 13 . HB1 1 1 167 1 1 1 1 5 CYS HA . 5 . HA 1 1 167 1 2 1 1 5 CYS HB3 . 5 . HB2 1 1 168 1 1 1 1 8 ORN HD3 . 8 . HD2 1 1 168 1 2 1 1 8 ORN HG2 . 8 . HG1 1 1 168 1 2 1 1 8 ORN HG3 . 8 . HG2 1 1 169 1 1 1 1 13 PHE QD . 13 . HD1 1 1 169 1 2 1 1 19 LEU QB . 19 . HB1 1 1 170 1 1 1 1 26 HIS HA . 26 . HA 1 1 170 1 2 1 1 26 HIS HB3 . 26 . HB1 1 1 171 1 1 1 1 3 PHE H . 3 . HN 1 1 171 1 2 1 1 3 PHE HB2 . 3 . HB1 1 1 172 1 1 1 1 12 ARG HA . 12 . HA 1 1 172 1 2 1 1 12 ARG QB . 12 . HB1 1 1 173 1 1 1 1 19 LEU MD1 . 19 . HD11 1 1 173 1 2 1 1 22 HIS HB3 . 22 . HB2 1 1 174 1 1 1 1 13 PHE HZ . 13 . HZ 1 1 174 1 2 1 1 22 HIS HB2 . 22 . HB1 1 1 175 1 1 1 1 18 GLU QB . 18 . HB1 1 1 175 1 2 1 1 19 LEU H . 19 . HN 1 1 176 1 1 1 1 24 ARG H . 24 . HN 1 1 176 1 2 1 1 25 THR H . 25 . HN 1 1 177 1 1 1 1 3 PHE QE . 3 . HE1 1 1 177 1 2 1 1 15 ARG HA . 15 . HA 1 1 178 1 1 1 1 21 ARG H . 21 . HN 1 1 178 1 2 1 1 21 ARG HA . 21 . HA 1 1 179 1 1 1 1 15 ARG HA . 15 . HA 1 1 179 1 2 1 1 15 ARG QB . 15 . HB1 1 1 180 1 1 1 1 2 PRO HD2 . 2 . HD1 1 1 180 1 2 1 1 2 PRO HG2 . 2 . HG1 1 1 181 1 1 1 1 20 GLN H . 20 . HN 1 1 181 1 2 1 1 21 ARG H . 21 . HN 1 1 182 1 1 1 1 2 PRO HB2 . 2 . HB1 1 1 182 1 2 1 1 3 PHE H . 3 . HN 1 1 183 1 1 1 1 6 THR HA . 6 . HA 1 1 183 1 2 1 1 7 TRP H . 7 . HN 1 1 184 1 1 1 1 24 ARG QD . 24 . HD1 1 1 184 1 2 1 1 24 ARG HG3 . 24 . HG2 1 1 185 1 1 1 1 23 LYS H . 23 . HN 1 1 185 1 2 1 1 24 ARG H . 24 . HN 1 1 186 1 1 1 1 18 GLU H . 18 . HN 1 1 186 1 2 1 1 18 GLU HG2 . 18 . HG2 1 1 187 1 1 1 1 27 THR HA . 27 . HA 1 1 187 1 2 1 1 28 GLY H . 28 . HN 1 1 188 1 1 1 1 12 ARG H . 12 . HN 1 1 188 1 2 1 1 12 ARG HG3 . 12 . HG2 1 1 189 1 1 1 1 8 ORN HA . 8 . HA 1 1 189 1 2 1 1 8 ORN HG2 . 8 . HG1 1 1 189 1 2 1 1 8 ORN HG3 . 8 . HG2 1 1 190 1 1 1 1 26 HIS H . 26 . HN 1 1 190 1 2 1 1 27 THR H . 27 . HN 1 1 191 1 1 1 1 28 GLY H . 28 . HN 1 1 191 1 2 1 1 28 GLY HA3 . 28 . HA2 1 1 192 1 1 1 1 13 PHE QD . 13 . HD1 1 1 192 1 2 1 1 19 LEU HA . 19 . HA 1 1 193 1 1 1 1 23 LYS H . 23 . HN 1 1 193 1 2 1 1 23 LYS QG . 23 . HG1 1 1 194 1 1 1 1 2 PRO HD2 . 2 . HD1 1 1 194 1 2 1 1 2 PRO HG3 . 2 . HG2 1 1 195 1 1 1 1 18 GLU HA . 18 . HA 1 1 195 1 2 1 1 18 GLU HG2 . 18 . HG2 1 1 196 1 1 1 1 5 CYS HB3 . 5 . HB2 1 1 196 1 2 1 1 11 LYS H . 11 . HN 1 1 197 1 1 1 1 29 GLU H . 29 . HN 1 1 197 1 2 1 1 29 GLU HA . 29 . HA 1 1 198 1 1 1 1 20 GLN QG . 20 . HG1 1 1 198 1 2 1 1 23 LYS QB . 23 . HB1 1 1 199 1 1 1 1 17 ASP H . 17 . HN 1 1 199 1 2 1 1 17 ASP HB3 . 17 . HB2 1 1 200 1 1 1 1 11 LYS QB . 11 . HB1 1 1 200 1 2 1 1 13 PHE QE . 13 . HE1 1 1 201 1 1 1 1 12 ARG HA . 12 . HA 1 1 201 1 2 1 1 13 PHE QD . 13 . HD1 1 1 202 1 1 1 1 11 LYS QG . 11 . HG1 1 1 202 1 2 1 1 12 ARG H . 12 . HN 1 1 203 1 1 1 1 4 NLE H . 4 . HN 1 1 203 1 2 1 1 4 NLE HB3 . 4 . HB2 1 1 204 1 1 1 1 1 ARG HA . 1 . HA 1 1 204 1 2 1 1 2 PRO HD2 . 2 . HD1 1 1 205 1 1 1 1 26 HIS H . 26 . HN 1 1 205 1 2 1 1 26 HIS HA . 26 . HA 1 1 206 1 1 1 1 10 GLY H . 10 . HN 1 1 206 1 2 1 1 11 LYS H . 11 . HN 1 1 207 1 1 1 1 9 CYS QB . 9 . HB1 1 1 207 1 2 1 1 10 GLY H . 10 . HN 1 1 208 1 1 1 1 3 PHE H . 3 . HN 1 1 208 1 2 1 1 3 PHE QD . 3 . HD1 1 1 209 1 1 1 1 11 LYS QB . 11 . HB1 1 1 209 1 2 1 1 22 HIS HE1 . 22 . HE1 1 1 210 1 1 1 1 29 GLU H . 29 . HN 1 1 210 1 2 1 1 29 GLU HB2 . 29 . HB1 1 1 211 1 1 1 1 4 NLE H . 4 . HN 1 1 211 1 2 1 1 4 NLE HB2 . 4 . HB1 1 1 212 1 1 1 1 7 TRP HB3 . 7 . HB1 1 1 212 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 213 1 1 1 1 26 HIS HA . 26 . HA 1 1 213 1 2 1 1 27 THR H . 27 . HN 1 1 214 1 1 1 1 2 PRO HD3 . 2 . HD2 1 1 214 1 2 1 1 2 PRO HG3 . 2 . HG2 1 1 215 1 1 1 1 11 LYS QD . 11 . HD1 1 1 215 1 2 1 1 22 HIS HE1 . 22 . HE1 1 1 216 1 1 1 1 5 CYS HB3 . 5 . HB2 1 1 216 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 217 1 1 1 1 1 ARG QB . 1 . HB1 1 1 217 1 2 1 1 1 ARG QD . 1 . HD1 1 1 218 1 1 1 1 3 PHE HB2 . 3 . HB1 1 1 218 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 219 1 1 1 1 17 ASP H . 17 . HN 1 1 219 1 2 1 1 17 ASP HA . 17 . HA 1 1 220 1 1 1 1 22 HIS HD2 . 22 . HD2 1 1 220 1 2 1 1 23 LYS HA . 23 . HA 1 1 221 1 1 1 1 24 ARG HA . 24 . HA 1 1 221 1 2 1 1 24 ARG HG2 . 24 . HG1 1 1 222 1 1 1 1 13 PHE H . 13 . HN 1 1 222 1 2 1 1 13 PHE HA . 13 . HA 1 1 223 1 1 1 1 23 LYS HA . 23 . HA 1 1 223 1 2 1 1 23 LYS QG . 23 . HG1 1 1 224 1 1 1 1 3 PHE HB3 . 3 . HB2 1 1 224 1 2 1 1 13 PHE HB2 . 13 . HB1 1 1 225 1 1 1 1 3 PHE QE . 3 . HE1 1 1 225 1 2 1 1 16 SER HB3 . 16 . HB2 1 1 226 1 1 1 1 8 ORN HA . 8 . HA 1 1 226 1 2 1 1 8 ORN HD2 . 8 . HD1 1 1 227 1 1 1 1 14 THR H . 14 . HN 1 1 227 1 2 1 1 15 ARG H . 15 . HN 1 1 228 1 1 1 1 4 NLE HA . 4 . HA 1 1 228 1 2 1 1 4 NLE HG2 . 4 . HG1 1 1 228 1 2 1 1 4 NLE HG3 . 4 . HG2 1 1 229 1 1 1 1 2 PRO HG3 . 2 . HG2 1 1 229 1 2 1 1 12 ARG QD . 12 . HD1 1 1 230 1 1 1 1 11 LYS H . 11 . HN 1 1 230 1 2 1 1 11 LYS QD . 11 . HD1 1 1 231 1 1 1 1 15 ARG H . 15 . HN 1 1 231 1 2 1 1 18 GLU QB . 18 . HB1 1 1 232 1 1 1 1 3 PHE HA . 3 . HA 1 1 232 1 2 1 1 3 PHE HB2 . 3 . HB1 1 1 233 1 1 1 1 3 PHE HB2 . 3 . HB1 1 1 233 1 2 1 1 19 LEU QB . 19 . HB2 1 1 234 1 1 1 1 12 ARG HA . 12 . HA 1 1 234 1 2 1 1 12 ARG HG2 . 12 . HG1 1 1 235 1 1 1 1 3 PHE QD . 3 . HD1 1 1 235 1 2 1 1 14 THR HA . 14 . HA 1 1 236 1 1 1 1 24 ARG H . 24 . HN 1 1 236 1 2 1 1 24 ARG HG2 . 24 . HG1 1 1 237 1 1 1 1 17 ASP H . 17 . HN 1 1 237 1 2 1 1 18 GLU H . 18 . HN 1 1 238 1 1 1 1 22 HIS HA . 22 . HA 1 1 238 1 2 1 1 22 HIS HB3 . 22 . HB2 1 1 239 1 1 1 1 3 PHE QE . 3 . HE1 1 1 239 1 2 1 1 16 SER HB2 . 16 . HB1 1 1 240 1 1 1 1 12 ARG H . 12 . HN 1 1 240 1 2 1 1 12 ARG HA . 12 . HA 1 1 241 1 1 1 1 5 CYS HB3 . 5 . HB2 1 1 241 1 2 1 1 13 PHE QE . 13 . HE1 1 1 242 1 1 1 1 26 HIS H . 26 . HN 1 1 242 1 2 1 1 26 HIS HB3 . 26 . HB1 1 1 243 1 1 1 1 18 GLU H . 18 . HN 1 1 243 1 2 1 1 18 GLU HG3 . 18 . HG1 1 1 244 1 1 1 1 7 TRP HA . 7 . HA 1 1 244 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 245 1 1 1 1 4 NLE HA . 4 . HA 1 1 245 1 2 1 1 4 NLE HB3 . 4 . HB2 1 1 246 1 1 1 1 7 TRP HB3 . 7 . HB1 1 1 246 1 2 1 1 7 TRP HE3 . 7 . HE3 1 1 247 1 1 1 1 15 ARG H . 15 . HN 1 1 247 1 2 1 1 15 ARG HA . 15 . HA 1 1 248 1 1 1 1 11 LYS QB . 11 . HB1 1 1 248 1 2 1 1 13 PHE HZ . 13 . HZ 1 1 249 1 1 1 1 27 THR H . 27 . HN 1 1 249 1 2 1 1 27 THR MG . 27 . HG21 1 1 250 1 1 1 1 13 PHE HB3 . 13 . HB2 1 1 250 1 2 1 1 14 THR H . 14 . HN 1 1 251 1 1 1 1 15 ARG QB . 15 . HB1 1 1 251 1 2 1 1 15 ARG HD2 . 15 . HD1 1 1 252 1 1 1 1 13 PHE HB3 . 13 . HB2 1 1 252 1 2 1 1 18 GLU HG3 . 18 . HG1 1 1 253 1 1 1 1 1 ARG QB . 1 . HB1 1 1 253 1 2 1 1 2 PRO HD2 . 2 . HD1 1 1 254 1 1 1 1 26 HIS HA . 26 . HA 1 1 254 1 2 1 1 26 HIS HB2 . 26 . HB2 1 1 255 1 1 1 1 3 PHE QD . 3 . HD1 1 1 255 1 2 1 1 16 SER HA . 16 . HA 1 1 256 1 1 1 1 30 LYS HA . 30 . HA 1 1 256 1 2 1 1 30 LYS HB2 . 30 . HB1 1 1 257 1 1 1 1 4 NLE H . 4 . HN 1 1 257 1 2 1 1 4 NLE HA . 4 . HA 1 1 258 1 1 1 1 17 ASP H . 17 . HN 1 1 258 1 2 1 1 17 ASP HB2 . 17 . HB1 1 1 259 1 1 1 1 18 GLU HA . 18 . HA 1 1 259 1 2 1 1 21 ARG HB2 . 21 . HB1 1 1 260 1 1 1 1 13 PHE QE . 13 . HE1 1 1 260 1 2 1 1 22 HIS HB3 . 22 . HB2 1 1 261 1 1 1 1 7 TRP HB2 . 7 . HB2 1 1 261 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 262 1 1 1 1 26 HIS HB3 . 26 . HB1 1 1 262 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 263 1 1 1 1 3 PHE QD . 3 . HD1 1 1 263 1 2 1 1 15 ARG HA . 15 . HA 1 1 264 1 1 1 1 5 CYS H . 5 . HN 1 1 264 1 2 1 1 5 CYS HA . 5 . HA 1 1 265 1 1 1 1 2 PRO HA . 2 . HA 1 1 265 1 2 1 1 3 PHE QD . 3 . HD1 1 1 266 1 1 1 1 3 PHE H . 3 . HN 1 1 266 1 2 1 1 3 PHE HA . 3 . HA 1 1 267 1 1 1 1 13 PHE HB2 . 13 . HB1 1 1 267 1 2 1 1 15 ARG H . 15 . HN 1 1 268 1 1 1 1 7 TRP HA . 7 . HA 1 1 268 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 269 1 1 1 1 28 GLY HA3 . 28 . HA2 1 1 269 1 2 1 1 29 GLU H . 29 . HN 1 1 270 1 1 1 1 23 LYS HA . 23 . HA 1 1 270 1 2 1 1 23 LYS QD . 23 . HD1 1 1 271 1 1 1 1 14 THR HB . 14 . HB 1 1 271 1 2 1 1 15 ARG H . 15 . HN 1 1 272 1 1 1 1 4 NLE HG2 . 4 . HG1 1 1 272 1 1 1 1 4 NLE HG3 . 4 . HG2 1 1 272 1 2 1 1 5 CYS H . 5 . HN 1 1 273 1 1 1 1 4 NLE HA . 4 . HA 1 1 273 1 2 1 1 13 PHE QD . 13 . HD1 1 1 274 1 1 1 1 11 LYS QD . 11 . HD1 1 1 274 1 2 1 1 13 PHE QE . 13 . HE1 1 1 275 1 1 1 1 25 THR H . 25 . HN 1 1 275 1 2 1 1 25 THR HB . 25 . HB 1 1 276 1 1 1 1 2 PRO HD3 . 2 . HD2 1 1 276 1 2 1 1 2 PRO HG2 . 2 . HG1 1 1 277 1 1 1 1 7 TRP HB2 . 7 . HB2 1 1 277 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 278 1 1 1 1 12 ARG QB . 12 . HB1 1 1 278 1 2 1 1 13 PHE H . 13 . HN 1 1 279 1 1 1 1 17 ASP HA . 17 . HA 1 1 279 1 2 1 1 20 GLN H . 20 . HN 1 1 280 1 1 1 1 28 GLY HA2 . 28 . HA1 1 1 280 1 2 1 1 29 GLU H . 29 . HN 1 1 281 1 1 1 1 16 SER H . 16 . HN 1 1 281 1 2 1 1 16 SER HA . 16 . HA 1 1 282 1 1 1 1 15 ARG QB . 15 . HB1 1 1 282 1 2 1 1 15 ARG HD3 . 15 . HD2 1 1 283 1 1 1 1 13 PHE QE . 13 . HE1 1 1 283 1 2 1 1 19 LEU HA . 19 . HA 1 1 284 1 1 1 1 29 GLU HA . 29 . HA 1 1 284 1 2 1 1 29 GLU HB2 . 29 . HB1 1 1 285 1 1 1 1 3 PHE HB3 . 3 . HB2 1 1 285 1 2 1 1 4 NLE H . 4 . HN 1 1 286 1 1 1 1 7 TRP HB3 . 7 . HB1 1 1 286 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 287 1 1 1 1 14 THR H . 14 . HN 1 1 287 1 2 1 1 14 THR HB . 14 . HB 1 1 288 1 1 1 1 13 PHE HB2 . 13 . HB1 1 1 288 1 2 1 1 19 LEU QB . 19 . HB1 1 1 289 1 1 1 1 26 HIS HB2 . 26 . HB2 1 1 289 1 2 1 1 27 THR H . 27 . HN 1 1 290 1 1 1 1 16 SER H . 16 . HN 1 1 290 1 2 1 1 16 SER HB2 . 16 . HB1 1 1 291 1 1 1 1 10 GLY QA . 10 . HA2 1 1 291 1 2 1 1 11 LYS H . 11 . HN 1 1 292 1 1 1 1 20 GLN HA . 20 . HA 1 1 292 1 2 1 1 23 LYS H . 23 . HN 1 1 293 1 1 1 1 19 LEU HG . 19 . HG 1 1 293 1 2 1 1 20 GLN HA . 20 . HA 1 1 294 1 1 1 1 15 ARG QB . 15 . HB1 1 1 294 1 2 1 1 18 GLU H . 18 . HN 1 1 295 1 1 1 1 5 CYS HB3 . 5 . HB2 1 1 295 1 2 1 1 11 LYS QB . 11 . HB1 1 1 296 1 1 1 1 12 ARG H . 12 . HN 1 1 296 1 2 1 1 12 ARG HG2 . 12 . HG1 1 1 297 1 1 1 1 22 HIS HD2 . 22 . HD2 1 1 297 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 298 1 1 1 1 15 ARG H . 15 . HN 1 1 298 1 2 1 1 15 ARG QG . 15 . HG1 1 1 299 1 1 1 1 27 THR H . 27 . HN 1 1 299 1 2 1 1 28 GLY H . 28 . HN 1 1 300 1 1 1 1 3 PHE HA . 3 . HA 1 1 300 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 301 1 1 1 1 5 CYS HB3 . 5 . HB2 1 1 301 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 302 1 1 1 1 12 ARG HE . 12 . HE 1 1 302 1 2 1 1 12 ARG HG3 . 12 . HG2 1 1 303 1 1 1 1 16 SER H . 16 . HN 1 1 303 1 2 1 1 16 SER HB3 . 16 . HB2 1 1 304 1 1 1 1 7 TRP HE3 . 7 . HE3 1 1 304 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 305 1 1 1 1 7 TRP H . 7 . HN 1 1 305 1 2 1 1 9 CYS QB . 9 . HB2 1 1 306 1 1 1 1 11 LYS QD . 11 . HD1 1 1 306 1 2 1 1 13 PHE HZ . 13 . HZ 1 1 307 1 1 1 1 29 GLU H . 29 . HN 1 1 307 1 2 1 1 29 GLU HB3 . 29 . HB2 1 1 308 1 1 1 1 13 PHE H . 13 . HN 1 1 308 1 2 1 1 13 PHE HB3 . 13 . HB2 1 1 309 1 1 1 1 15 ARG QB . 15 . HB1 1 1 309 1 2 1 1 17 ASP H . 17 . HN 1 1 310 1 1 1 1 6 THR H . 6 . HN 1 1 310 1 2 1 1 7 TRP H . 7 . HN 1 1 311 1 1 1 1 26 HIS H . 26 . HN 1 1 311 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 312 1 1 1 1 14 THR H . 14 . HN 1 1 312 1 2 1 1 14 THR MG . 14 . HG21 1 1 313 1 1 1 1 17 ASP HB2 . 17 . HB1 1 1 313 1 2 1 1 18 GLU H . 18 . HN 1 1 314 1 1 1 1 21 ARG HA . 21 . HA 1 1 314 1 2 1 1 24 ARG H . 24 . HN 1 1 315 1 1 1 1 3 PHE H . 3 . HN 1 1 315 1 2 1 1 3 PHE HB3 . 3 . HB2 1 1 316 1 1 1 1 5 CYS H . 5 . HN 1 1 316 1 2 1 1 12 ARG HA . 12 . HA 1 1 317 1 1 1 1 16 SER HA . 16 . HA 1 1 317 1 2 1 1 19 LEU H . 19 . HN 1 1 318 1 1 1 1 22 HIS HD2 . 22 . HD2 1 1 318 1 2 1 1 23 LYS QG . 23 . HG1 1 1 319 1 1 1 1 13 PHE HZ . 13 . HZ 1 1 319 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 320 1 1 1 1 23 LYS HA . 23 . HA 1 1 320 1 2 1 1 24 ARG H . 24 . HN 1 1 321 1 1 1 1 1 ARG QD . 1 . HD1 1 1 321 1 2 1 1 1 ARG HG2 . 1 . HG1 1 1 322 1 1 1 1 5 CYS HB2 . 5 . HB1 1 1 322 1 2 1 1 11 LYS H . 11 . HN 1 1 323 1 1 1 1 27 THR H . 27 . HN 1 1 323 1 2 1 1 27 THR HB . 27 . HB 1 1 324 1 1 1 1 18 GLU HA . 18 . HA 1 1 324 1 2 1 1 19 LEU H . 19 . HN 1 1 325 1 1 1 1 15 ARG H . 15 . HN 1 1 325 1 2 1 1 15 ARG QB . 15 . HB1 1 1 326 1 1 1 1 21 ARG HA . 21 . HA 1 1 326 1 2 1 1 24 ARG QD . 24 . HD1 1 1 327 1 1 1 1 13 PHE HZ . 13 . HZ 1 1 327 1 2 1 1 22 HIS HB3 . 22 . HB2 1 1 328 1 1 1 1 16 SER H . 16 . HN 1 1 328 1 2 1 1 17 ASP H . 17 . HN 1 1 329 1 1 1 1 14 THR HA . 14 . HA 1 1 329 1 2 1 1 15 ARG H . 15 . HN 1 1 330 1 1 1 1 11 LYS QB . 11 . HB1 1 1 330 1 2 1 1 12 ARG H . 12 . HN 1 1 331 1 1 1 1 19 LEU QB . 19 . HB2 1 1 331 1 2 1 1 19 LEU HG . 19 . HG 1 1 332 1 1 1 1 16 SER HA . 16 . HA 1 1 332 1 2 1 1 19 LEU QB . 19 . HB2 1 1 333 1 1 1 1 6 THR H . 6 . HN 1 1 333 1 2 1 1 6 THR MG . 6 . HG21 1 1 334 1 1 1 1 29 GLU H . 29 . HN 1 1 334 1 2 1 1 29 GLU QG . 29 . HG1 1 1 335 1 1 1 1 17 ASP HA . 17 . HA 1 1 335 1 2 1 1 18 GLU H . 18 . HN 1 1 336 1 1 1 1 16 SER HB2 . 16 . HB1 1 1 336 1 2 1 1 17 ASP H . 17 . HN 1 1 337 1 1 1 1 25 THR HA . 25 . HA 1 1 337 1 2 1 1 26 HIS H . 26 . HN 1 1 338 1 1 1 1 4 NLE HE1 . 4 . HE1 1 1 338 1 2 1 1 10 GLY QA . 10 . HA2 1 1 339 1 1 1 1 6 THR H . 6 . HN 1 1 339 1 2 1 1 10 GLY QA . 10 . HA1 1 1 340 1 1 1 1 30 LYS H . 30 . HN 1 1 340 1 2 1 1 30 LYS HB2 . 30 . HB1 1 1 341 1 1 1 1 4 NLE HA . 4 . HA 1 1 341 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 342 1 1 1 1 23 LYS HA . 23 . HA 1 1 342 1 2 1 1 26 HIS H . 26 . HN 1 1 343 1 1 1 1 3 PHE QE . 3 . HE1 1 1 343 1 2 1 1 16 SER HA . 16 . HA 1 1 344 1 1 1 1 15 ARG QB . 15 . HB1 1 1 344 1 2 1 1 16 SER H . 16 . HN 1 1 345 1 1 1 1 3 PHE QD . 3 . HD1 1 1 345 1 2 1 1 16 SER HB3 . 16 . HB2 1 1 346 1 1 1 1 13 PHE HB2 . 13 . HB1 1 1 346 1 2 1 1 13 PHE QE . 13 . HE1 1 1 347 1 1 1 1 23 LYS HA . 23 . HA 1 1 347 1 2 1 1 25 THR H . 25 . HN 1 1 348 1 1 1 1 19 LEU HG . 19 . HG 1 1 348 1 2 1 1 20 GLN H . 20 . HN 1 1 349 1 1 1 1 27 THR HB . 27 . HB 1 1 349 1 2 1 1 28 GLY H . 28 . HN 1 1 350 1 1 1 1 24 ARG HA . 24 . HA 1 1 350 1 2 1 1 27 THR H . 27 . HN 1 1 351 1 1 1 1 19 LEU HA . 19 . HA 1 1 351 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 352 1 1 1 1 13 PHE HB3 . 13 . HB2 1 1 352 1 2 1 1 19 LEU H . 19 . HN 1 1 353 1 1 1 1 22 HIS HA . 22 . HA 1 1 353 1 2 1 1 23 LYS H . 23 . HN 1 1 354 1 1 1 1 13 PHE HA . 13 . HA 1 1 354 1 2 1 1 15 ARG H . 15 . HN 1 1 355 1 1 1 1 5 CYS HA . 5 . HA 1 1 355 1 2 1 1 6 THR MG . 6 . HG21 1 1 356 1 1 1 1 5 CYS HB3 . 5 . HB2 1 1 356 1 2 1 1 6 THR H . 6 . HN 1 1 357 1 1 1 1 5 CYS HA . 5 . HA 1 1 357 1 2 1 1 22 HIS HD2 . 22 . HD2 1 1 358 1 1 1 1 15 ARG QG . 15 . HG1 1 1 358 1 2 1 1 18 GLU H . 18 . HN 1 1 359 1 1 1 1 4 NLE HA . 4 . HA 1 1 359 1 2 1 1 13 PHE H . 13 . HN 1 1 360 1 1 1 1 11 LYS QG . 11 . HG1 1 1 360 1 2 1 1 22 HIS HE1 . 22 . HE1 1 1 361 1 1 1 1 7 TRP HD1 . 7 . HD1 1 1 361 1 2 1 1 26 HIS HB3 . 26 . HB1 1 1 362 1 1 1 1 23 LYS QB . 23 . HB1 1 1 362 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 363 1 1 1 1 22 HIS HD2 . 22 . HD2 1 1 363 1 2 1 1 23 LYS H . 23 . HN 1 1 364 1 1 1 1 19 LEU HA . 19 . HA 1 1 364 1 2 1 1 20 GLN H . 20 . HN 1 1 365 1 1 1 1 22 HIS HD2 . 22 . HD2 1 1 365 1 2 1 1 23 LYS QB . 23 . HB1 1 1 366 1 1 1 1 22 HIS HD2 . 22 . HD2 1 1 366 1 2 1 1 23 LYS QD . 23 . HD1 1 1 367 1 1 1 1 5 CYS H . 5 . HN 1 1 367 1 2 1 1 13 PHE QE . 13 . HE1 1 1 368 1 1 1 1 3 PHE HB3 . 3 . HB2 1 1 368 1 2 1 1 3 PHE QE . 3 . HE1 1 1 369 1 1 1 1 7 TRP HD1 . 7 . HD1 1 1 369 1 2 1 1 26 HIS HE1 . 26 . HE1 1 1 370 1 1 1 1 23 LYS QG . 23 . HG1 1 1 370 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 371 1 1 1 1 5 CYS H . 5 . HN 1 1 371 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 372 1 1 1 1 19 LEU MD2 . 19 . HD21 1 1 372 1 2 1 1 20 GLN H . 20 . HN 1 1 373 1 1 1 1 7 TRP H . 7 . HN 1 1 373 1 2 1 1 7 TRP HD1 . 7 . HD1 1 1 374 1 1 1 1 17 ASP HB3 . 17 . HB2 1 1 374 1 2 1 1 18 GLU H . 18 . HN 1 1 375 1 1 1 1 24 ARG HA . 24 . HA 1 1 375 1 2 1 1 25 THR H . 25 . HN 1 1 376 1 1 1 1 12 ARG HA . 12 . HA 1 1 376 1 2 1 1 13 PHE QE . 13 . HE1 1 1 377 1 1 1 1 13 PHE HA . 13 . HA 1 1 377 1 2 1 1 13 PHE QE . 13 . HE1 1 1 378 1 1 1 1 22 HIS HE1 . 22 . HE1 1 1 378 1 2 1 1 25 THR MG . 25 . HG21 1 1 379 1 1 1 1 24 ARG HA . 24 . HA 1 1 379 1 2 1 1 26 HIS H . 26 . HN 1 1 380 1 1 1 1 13 PHE HZ . 13 . HZ 1 1 380 1 2 1 1 22 HIS HE1 . 22 . HE1 1 1 381 1 1 1 1 23 LYS QD . 23 . HD1 1 1 381 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 382 1 1 1 1 19 LEU H . 19 . HN 1 1 382 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 383 1 1 1 1 13 PHE HB2 . 13 . HB1 1 1 383 1 2 1 1 19 LEU H . 19 . HN 1 1 384 1 1 1 1 3 PHE QE . 3 . HE1 1 1 384 1 2 1 1 16 SER H . 16 . HN 1 1 385 1 1 1 1 2 PRO HB3 . 2 . HB2 1 1 385 1 2 1 1 3 PHE H . 3 . HN 1 1 386 1 1 1 1 1 ARG QB . 1 . HB1 1 1 386 1 2 1 1 2 PRO HD3 . 2 . HD2 1 1 387 1 1 1 1 17 ASP HA . 17 . HA 1 1 387 1 2 1 1 21 ARG H . 21 . HN 1 1 388 1 1 1 1 7 TRP HB2 . 7 . HB2 1 1 388 1 2 1 1 26 HIS HE1 . 26 . HE1 1 1 389 1 1 1 1 14 THR HB . 14 . HB 1 1 389 1 2 1 1 15 ARG QG . 15 . HG2 1 1 390 1 1 1 1 13 PHE HB2 . 13 . HB1 1 1 390 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 391 1 1 1 1 5 CYS HB3 . 5 . HB2 1 1 391 1 2 1 1 10 GLY H . 10 . HN 1 1 392 1 1 1 1 16 SER HB3 . 16 . HB2 1 1 392 1 2 1 1 17 ASP H . 17 . HN 1 1 393 1 1 1 1 27 THR MG . 27 . HG21 1 1 393 1 2 1 1 28 GLY H . 28 . HN 1 1 394 1 1 1 1 13 PHE QD . 13 . HD1 1 1 394 1 2 1 1 18 GLU HA . 18 . HA 1 1 395 1 1 1 1 7 TRP HD1 . 7 . HD1 1 1 395 1 2 1 1 8 ORN HD3 . 8 . HD2 1 1 396 1 1 1 1 7 TRP HD1 . 7 . HD1 1 1 396 1 2 1 1 9 CYS QB . 9 . HB1 1 1 397 1 1 1 1 6 THR HA . 6 . HA 1 1 397 1 2 1 1 9 CYS QB . 9 . HB2 1 1 398 1 1 1 1 19 LEU H . 19 . HN 1 1 398 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 399 1 1 1 1 25 THR HB . 25 . HB 1 1 399 1 2 1 1 26 HIS H . 26 . HN 1 1 400 1 1 1 1 16 SER HA . 16 . HA 1 1 400 1 2 1 1 20 GLN H . 20 . HN 1 1 401 1 1 1 1 16 SER HA . 16 . HA 1 1 401 1 2 1 1 17 ASP H . 17 . HN 1 1 402 1 1 1 1 18 GLU H . 18 . HN 1 1 402 1 2 1 1 20 GLN H . 20 . HN 1 1 403 1 1 1 1 2 PRO HA . 2 . HA 1 1 403 1 2 1 1 2 PRO HG2 . 2 . HG1 1 1 404 1 1 1 1 17 ASP HA . 17 . HA 1 1 404 1 2 1 1 19 LEU H . 19 . HN 1 1 405 1 1 1 1 22 HIS HE1 . 22 . HE1 1 1 405 1 2 1 1 26 HIS HD2 . 26 . HD2 1 1 406 1 1 1 1 2 PRO HG3 . 2 . HG2 1 1 406 1 2 1 1 12 ARG QB . 12 . HB1 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 . . . . . 1.954 1.477 2.431 1 1 2 1 . . . . . 2.31 1.643 2.977 1 1 3 1 . . . . . 2.397 1.679 3.115 1 1 4 1 . . . . . 2.476 1.71 3.242 1 1 5 1 . . . . . 2.491 1.715 3.267 1 1 6 2 . . . . . 2.523 1.727 3.319 1 1 6 3 . . . . . 2.523 1.727 3.319 1 1 7 1 . . . . . 2.551 1.737 3.365 1 1 8 1 . . . . . 2.554 1.739 3.369 1 1 9 2 . . . . . 2.564 1.742 3.386 1 1 9 3 . . . . . 2.564 1.742 3.386 1 1 10 1 . . . . . 2.628 1.765 3.491 1 1 11 1 . . . . . 2.695 1.787 3.603 1 1 12 1 . . . . . 2.723 1.796 3.65 1 1 13 1 . . . . . 2.819 1.825 3.813 1 1 14 2 . . . . . 2.858 1.837 3.879 1 1 14 3 . . . . . 2.858 1.837 3.879 1 1 15 1 . . . . . 2.866 1.839 3.893 1 1 16 1 . . . . . 2.899 1.848 3.95 1 1 17 2 . . . . . 2.946 1.861 4.031 1 1 17 3 . . . . . 2.946 1.861 4.031 1 1 18 1 . . . . . 2.978 1.869 4.087 1 1 19 2 . . . . . 3.023 1.88 4.166 1 1 19 3 . . . . . 3.023 1.88 4.166 1 1 20 2 . . . . . 3.031 1.883 4.179 1 1 20 3 . . . . . 3.031 1.883 4.179 1 1 21 1 . . . . . 3.072 1.892 4.252 1 1 22 1 . . . . . 3.124 1.904 4.344 1 1 23 1 . . . . . 3.137 1.907 4.367 1 1 24 2 . . . . . 3.139 1.907 4.371 1 1 24 3 . . . . . 3.139 1.907 4.371 1 1 25 2 . . . . . 3.281 1.935 4.627 1 1 25 3 . . . . . 3.281 1.935 4.627 1 1 25 4 . . . . . 3.281 1.935 4.627 1 1 26 2 . . . . . 3.334 1.945 4.723 1 1 26 3 . . . . . 3.334 1.945 4.723 1 1 27 2 . . . . . 3.358 1.948 4.768 1 1 27 3 . . . . . 3.358 1.948 4.768 1 1 28 1 . . . . . 3.377 1.951 4.803 1 1 29 1 . . . . . 3.397 1.954 4.84 1 1 30 2 . . . . . 3.418 1.958 4.878 1 1 30 3 . . . . . 3.418 1.958 4.878 1 1 31 1 . . . . . 3.462 1.964 4.96 1 1 32 1 . . . . . 3.485 1.966 5.004 1 1 33 1 . . . . . 3.64 1.984 5.296 1 1 34 1 . . . . . 3.698 1.989 5.407 1 1 35 1 . . . . . 3.708 1.99 5.426 1 1 36 1 . . . . . 3.709 1.99 5.428 1 1 37 1 . . . . . 1.732 1.357 2.107 1 1 38 1 . . . . . 1.839 1.416 2.262 1 1 39 1 . . . . . 2.044 1.522 2.566 1 1 40 1 . . . . . 2.048 1.524 2.572 1 1 41 1 . . . . . 2.088 1.543 2.633 1 1 42 1 . . . . . 2.104 1.551 2.657 1 1 43 1 . . . . . 2.116 1.557 2.675 1 1 44 1 . . . . . 2.137 1.566 2.708 1 1 45 1 . . . . . 2.146 1.57 2.722 1 1 46 1 . . . . . 2.151 1.573 2.729 1 1 47 1 . . . . . 2.153 1.573 2.733 1 1 48 1 . . . . . 2.169 1.581 2.757 1 1 49 1 . . . . . 2.178 1.585 2.771 1 1 50 1 . . . . . 2.221 1.604 2.838 1 1 51 1 . . . . . 2.223 1.605 2.841 1 1 52 1 . . . . . 2.226 1.606 2.846 1 1 53 1 . . . . . 2.235 1.61 2.86 1 1 54 1 . . . . . 2.241 1.613 2.869 1 1 55 1 . . . . . 2.25 1.617 2.883 1 1 56 1 . . . . . 2.254 1.619 2.889 1 1 57 1 . . . . . 2.263 1.623 2.903 1 1 58 1 . . . . . 2.265 1.623 2.907 1 1 59 1 . . . . . 2.28 1.63 2.93 1 1 60 1 . . . . . 2.282 1.631 2.933 1 1 61 1 . . . . . 2.282 1.631 2.933 1 1 62 1 . . . . . 2.282 1.631 2.933 1 1 63 1 . . . . . 2.292 1.635 2.949 1 1 64 1 . . . . . 2.294 1.636 2.952 1 1 65 1 . . . . . 2.303 1.703 2.966 1 1 66 1 . . . . . 2.305 1.641 2.969 1 1 67 1 . . . . . 2.308 1.642 2.974 1 1 68 1 . . . . . 2.31 1.643 2.977 1 1 69 1 . . . . . 2.31 1.643 2.977 1 1 70 1 . . . . . 2.312 1.761 2.98 1 1 71 1 . . . . . 2.314 1.644 2.984 1 1 72 1 . . . . . 2.319 1.647 2.991 1 1 73 1 . . . . . 2.324 1.721 2.999 1 1 74 1 . . . . . 2.326 1.65 3.002 1 1 75 1 . . . . . 2.331 1.652 3.01 1 1 76 1 . . . . . 2.333 1.652 3.014 1 1 77 1 . . . . . 2.338 1.655 3.021 1 1 78 1 . . . . . 2.341 1.656 3.026 1 1 79 1 . . . . . 2.343 1.657 3.029 1 1 80 1 . . . . . 2.359 1.664 3.054 1 1 81 1 . . . . . 2.369 1.667 3.071 1 1 82 1 . . . . . 2.369 1.667 3.071 1 1 83 1 . . . . . 2.369 1.667 3.071 1 1 84 1 . . . . . 2.375 1.67 3.08 1 1 85 1 . . . . . 2.377 1.67 3.084 1 1 86 1 . . . . . 2.38 1.672 3.088 1 1 87 1 . . . . . 2.38 1.672 3.088 1 1 88 1 . . . . . 2.389 1.676 3.102 1 1 89 1 . . . . . 2.403 1.681 3.125 1 1 90 1 . . . . . 2.409 1.683 3.135 1 1 91 1 . . . . . 2.415 1.686 3.144 1 1 92 1 . . . . . 2.419 1.688 3.15 1 1 93 1 . . . . . 2.419 1.688 3.15 1 1 94 1 . . . . . 2.425 1.69 3.16 1 1 95 1 . . . . . 2.428 1.691 3.165 1 1 96 1 . . . . . 2.441 1.696 3.186 1 1 97 1 . . . . . 2.445 1.698 3.192 1 1 98 1 . . . . . 2.445 1.698 3.192 1 1 99 1 . . . . . 2.451 1.7 3.202 1 1 100 1 . . . . . 2.451 1.7 3.202 1 1 101 1 . . . . . 2.455 1.702 3.208 1 1 102 1 . . . . . 2.455 1.702 3.208 1 1 103 1 . . . . . 2.455 1.702 3.208 1 1 104 1 . . . . . 2.462 1.704 3.22 1 1 105 1 . . . . . 2.465 1.705 3.225 1 1 106 1 . . . . . 2.473 1.709 3.237 1 1 107 1 . . . . . 2.473 1.709 3.237 1 1 108 1 . . . . . 2.476 1.71 3.242 1 1 109 1 . . . . . 2.48 1.711 3.249 1 1 110 1 . . . . . 2.487 1.74 3.26 1 1 111 1 . . . . . 2.487 1.714 3.26 1 1 112 1 . . . . . 2.495 1.717 3.273 1 1 113 1 . . . . . 2.495 1.815 3.273 1 1 114 1 . . . . . 2.499 1.718 3.28 1 1 115 1 . . . . . 2.503 1.72 3.286 1 1 116 1 . . . . . 2.507 1.721 3.293 1 1 117 1 . . . . . 2.511 1.723 3.299 1 1 118 1 . . . . . 2.511 1.723 3.299 1 1 119 1 . . . . . 2.519 1.726 3.312 1 1 120 1 . . . . . 2.519 1.726 3.312 1 1 121 1 . . . . . 2.519 1.726 3.312 1 1 122 1 . . . . . 2.525 1.728 3.322 1 1 123 1 . . . . . 2.527 1.729 3.325 1 1 124 1 . . . . . 2.532 1.731 3.333 1 1 125 1 . . . . . 2.541 1.734 3.348 1 1 126 1 . . . . . 2.545 1.736 3.354 1 1 127 1 . . . . . 2.545 1.736 3.354 1 1 128 1 . . . . . 2.547 1.958 3.358 1 1 129 1 . . . . . 2.547 1.736 3.358 1 1 130 1 . . . . . 2.547 1.736 3.358 1 1 131 1 . . . . . 2.55 1.737 3.363 1 1 132 1 . . . . . 2.553 1.738 3.368 1 1 133 1 . . . . . 2.556 1.74 3.372 1 1 134 1 . . . . . 2.556 1.739 3.373 1 1 135 1 . . . . . 2.56 1.741 3.379 1 1 136 1 . . . . . 2.562 1.742 3.382 1 1 137 1 . . . . . 2.562 1.741 3.383 1 1 138 1 . . . . . 2.564 1.742 3.386 1 1 139 1 . . . . . 2.566 1.743 3.389 1 1 140 1 . . . . . 2.568 1.744 3.392 1 1 141 1 . . . . . 2.569 1.744 3.394 1 1 142 1 . . . . . 2.574 1.746 3.402 1 1 143 1 . . . . . 2.576 1.747 3.405 1 1 144 1 . . . . . 2.577 1.747 3.407 1 1 145 1 . . . . . 2.579 1.748 3.41 1 1 146 1 . . . . . 2.579 1.747 3.411 1 1 147 1 . . . . . 2.582 1.749 3.415 1 1 148 1 . . . . . 2.586 1.75 3.422 1 1 149 1 . . . . . 2.591 1.752 3.43 1 1 150 1 . . . . . 2.591 1.752 3.43 1 1 151 1 . . . . . 2.592 1.752 3.432 1 1 152 1 . . . . . 2.594 1.753 3.435 1 1 153 1 . . . . . 2.594 1.753 3.435 1 1 154 1 . . . . . 2.595 1.753 3.437 1 1 155 1 . . . . . 2.598 1.754 3.442 1 1 156 1 . . . . . 2.602 1.756 3.448 1 1 157 1 . . . . . 2.61 1.894 3.462 1 1 158 1 . . . . . 2.611 1.759 3.463 1 1 159 1 . . . . . 2.621 1.762 3.48 1 1 160 1 . . . . . 2.621 1.762 3.48 1 1 161 1 . . . . . 2.622 1.762 3.482 1 1 162 1 . . . . . 2.625 1.764 3.486 1 1 163 1 . . . . . 2.629 1.765 3.493 1 1 164 1 . . . . . 2.63 1.766 3.494 1 1 165 1 . . . . . 2.631 1.766 3.496 1 1 166 1 . . . . . 2.636 1.767 3.505 1 1 167 1 . . . . . 2.638 1.768 3.508 1 1 168 1 . . . . . 2.639 1.768 3.51 1 1 169 1 . . . . . 2.642 1.77 3.514 1 1 170 1 . . . . . 2.643 1.77 3.516 1 1 171 1 . . . . . 2.644 1.77 3.518 1 1 172 1 . . . . . 2.647 1.771 3.523 1 1 173 1 . . . . . 2.651 1.773 3.529 1 1 174 1 . . . . . 2.652 1.773 3.531 1 1 175 1 . . . . . 2.652 1.773 3.531 1 1 176 1 . . . . . 2.653 1.773 3.533 1 1 177 1 . . . . . 2.653 1.773 3.533 1 1 178 1 . . . . . 2.653 1.773 3.533 1 1 179 1 . . . . . 2.654 1.774 3.534 1 1 180 1 . . . . . 2.658 1.775 3.541 1 1 181 1 . . . . . 2.659 1.775 3.543 1 1 182 1 . . . . . 2.663 1.777 3.549 1 1 183 1 . . . . . 2.664 1.777 3.551 1 1 184 1 . . . . . 2.672 1.78 3.564 1 1 185 1 . . . . . 2.672 1.779 3.565 1 1 186 1 . . . . . 2.674 1.781 3.567 1 1 187 1 . . . . . 2.674 1.78 3.568 1 1 188 1 . . . . . 2.677 1.781 3.573 1 1 189 1 . . . . . 2.677 1.781 3.573 1 1 190 1 . . . . . 2.682 1.783 3.581 1 1 191 1 . . . . . 2.683 1.783 3.583 1 1 192 1 . . . . . 2.69 1.786 3.594 1 1 193 1 . . . . . 2.696 1.787 3.605 1 1 194 1 . . . . . 2.702 1.789 3.615 1 1 195 1 . . . . . 2.703 1.79 3.616 1 1 196 1 . . . . . 2.706 1.79 3.622 1 1 197 1 . . . . . 2.709 1.792 3.626 1 1 198 1 . . . . . 2.713 1.793 3.633 1 1 199 1 . . . . . 2.715 1.794 3.636 1 1 200 1 . . . . . 2.721 1.795 3.647 1 1 201 1 . . . . . 2.722 1.796 3.648 1 1 202 1 . . . . . 2.722 1.796 3.648 1 1 203 1 . . . . . 2.724 1.796 3.652 1 1 204 1 . . . . . 2.725 1.797 3.653 1 1 205 1 . . . . . 2.731 1.799 3.663 1 1 206 1 . . . . . 2.732 1.799 3.665 1 1 207 1 . . . . . 2.733 1.8 3.666 1 1 208 1 . . . . . 2.733 1.799 3.667 1 1 209 1 . . . . . 2.735 1.8 3.67 1 1 210 1 . . . . . 2.737 1.801 3.673 1 1 211 1 . . . . . 2.737 1.801 3.673 1 1 212 1 . . . . . 2.745 1.803 3.687 1 1 213 1 . . . . . 2.748 1.804 3.692 1 1 214 1 . . . . . 2.751 1.805 3.697 1 1 215 1 . . . . . 2.753 1.806 3.7 1 1 216 1 . . . . . 2.761 1.808 3.714 1 1 217 1 . . . . . 2.764 1.809 3.719 1 1 218 1 . . . . . 2.764 1.809 3.719 1 1 219 1 . . . . . 2.769 1.811 3.727 1 1 220 1 . . . . . 2.769 1.811 3.727 1 1 221 1 . . . . . 2.77 1.811 3.729 1 1 222 1 . . . . . 2.771 1.811 3.731 1 1 223 1 . . . . . 2.778 1.813 3.743 1 1 224 1 . . . . . 2.781 1.814 3.748 1 1 225 1 . . . . . 2.783 1.815 3.751 1 1 226 1 . . . . . 2.786 1.816 3.756 1 1 227 1 . . . . . 2.786 1.816 3.756 1 1 228 1 . . . . . 2.79 1.817 3.763 1 1 229 1 . . . . . 2.793 1.818 3.768 1 1 230 1 . . . . . 2.796 1.819 3.773 1 1 231 1 . . . . . 2.802 1.821 3.783 1 1 232 1 . . . . . 2.805 1.821 3.789 1 1 233 1 . . . . . 2.805 1.821 3.789 1 1 234 1 . . . . . 2.806 1.822 3.79 1 1 235 1 . . . . . 2.816 1.825 3.807 1 1 236 1 . . . . . 2.825 1.827 3.823 1 1 237 1 . . . . . 2.829 1.829 3.829 1 1 238 1 . . . . . 2.83 1.829 3.831 1 1 239 1 . . . . . 2.834 1.83 3.838 1 1 240 1 . . . . . 2.836 1.83 3.842 1 1 241 1 . . . . . 2.837 1.831 3.843 1 1 242 1 . . . . . 2.838 1.831 3.845 1 1 243 1 . . . . . 2.839 1.831 3.847 1 1 244 1 . . . . . 2.849 1.835 3.863 1 1 245 1 . . . . . 2.852 1.835 3.869 1 1 246 1 . . . . . 2.855 1.836 3.874 1 1 247 1 . . . . . 2.858 1.837 3.879 1 1 248 1 . . . . . 2.861 1.838 3.884 1 1 249 1 . . . . . 2.863 1.839 3.887 1 1 250 1 . . . . . 2.865 1.839 3.891 1 1 251 1 . . . . . 2.869 1.84 3.898 1 1 252 1 . . . . . 2.873 1.841 3.905 1 1 253 1 . . . . . 2.873 1.841 3.905 1 1 254 1 . . . . . 2.873 1.841 3.905 1 1 255 1 . . . . . 2.876 1.842 3.91 1 1 256 1 . . . . . 2.884 1.845 3.923 1 1 257 1 . . . . . 2.89 1.846 3.934 1 1 258 1 . . . . . 2.891 1.846 3.936 1 1 259 1 . . . . . 2.895 1.848 3.942 1 1 260 1 . . . . . 2.899 1.848 3.95 1 1 261 1 . . . . . 2.908 1.851 3.965 1 1 262 1 . . . . . 2.915 1.853 3.977 1 1 263 1 . . . . . 2.917 1.853 3.981 1 1 264 1 . . . . . 2.917 1.853 3.981 1 1 265 1 . . . . . 2.918 1.853 3.983 1 1 266 1 . . . . . 2.919 1.854 3.984 1 1 267 1 . . . . . 2.921 1.855 3.987 1 1 268 1 . . . . . 2.922 1.855 3.989 1 1 269 1 . . . . . 2.922 1.855 3.989 1 1 270 1 . . . . . 2.923 1.855 3.991 1 1 271 1 . . . . . 2.929 1.857 4.001 1 1 272 1 . . . . . 2.931 1.857 4.005 1 1 273 1 . . . . . 2.937 1.859 4.015 1 1 274 1 . . . . . 2.939 1.86 4.018 1 1 275 1 . . . . . 2.939 1.86 4.018 1 1 276 1 . . . . . 2.94 1.86 4.02 1 1 277 1 . . . . . 2.941 1.86 4.022 1 1 278 1 . . . . . 2.946 1.861 4.031 1 1 279 1 . . . . . 2.95 1.862 4.038 1 1 280 1 . . . . . 2.956 1.864 4.048 1 1 281 1 . . . . . 2.961 1.865 4.057 1 1 282 1 . . . . . 2.962 1.865 4.059 1 1 283 1 . . . . . 2.966 1.866 4.066 1 1 284 1 . . . . . 2.969 1.867 4.071 1 1 285 1 . . . . . 2.974 1.868 4.08 1 1 286 1 . . . . . 2.977 1.869 4.085 1 1 287 1 . . . . . 2.98 1.87 4.09 1 1 288 1 . . . . . 2.981 1.87 4.092 1 1 289 1 . . . . . 2.982 1.87 4.094 1 1 290 1 . . . . . 2.984 1.871 4.097 1 1 291 1 . . . . . 2.985 1.871 4.099 1 1 292 1 . . . . . 2.986 1.871 4.101 1 1 293 1 . . . . . 2.989 1.872 4.106 1 1 294 1 . . . . . 3.0 1.875 4.125 1 1 295 1 . . . . . 3.003 1.876 4.13 1 1 296 1 . . . . . 3.007 1.876 4.138 1 1 297 1 . . . . . 3.007 1.876 4.138 1 1 298 1 . . . . . 3.009 1.877 4.141 1 1 299 1 . . . . . 3.009 1.877 4.141 1 1 300 1 . . . . . 3.012 1.878 4.146 1 1 301 1 . . . . . 3.019 1.88 4.158 1 1 302 1 . . . . . 3.033 1.883 4.183 1 1 303 1 . . . . . 3.034 1.883 4.185 1 1 304 1 . . . . . 3.05 1.888 4.212 1 1 305 1 . . . . . 3.05 1.888 4.212 1 1 306 1 . . . . . 3.054 1.888 4.22 1 1 307 1 . . . . . 3.056 1.889 4.223 1 1 308 1 . . . . . 3.058 1.889 4.227 1 1 309 1 . . . . . 3.058 1.889 4.227 1 1 310 1 . . . . . 3.059 1.889 4.229 1 1 311 1 . . . . . 3.067 1.891 4.243 1 1 312 1 . . . . . 3.071 1.892 4.25 1 1 313 1 . . . . . 3.071 1.892 4.25 1 1 314 1 . . . . . 3.071 1.892 4.25 1 1 315 1 . . . . . 3.071 1.892 4.25 1 1 316 1 . . . . . 3.072 1.892 4.252 1 1 317 1 . . . . . 3.074 1.893 4.255 1 1 318 1 . . . . . 3.081 1.895 4.267 1 1 319 1 . . . . . 3.096 1.898 4.294 1 1 320 1 . . . . . 3.102 1.899 4.305 1 1 321 1 . . . . . 3.103 1.899 4.307 1 1 322 1 . . . . . 3.103 1.899 4.307 1 1 323 1 . . . . . 3.105 1.9 4.31 1 1 324 1 . . . . . 3.107 1.9 4.314 1 1 325 1 . . . . . 3.111 1.901 4.321 1 1 326 1 . . . . . 3.112 1.901 4.323 1 1 327 1 . . . . . 3.118 1.903 4.333 1 1 328 1 . . . . . 3.12 1.903 4.337 1 1 329 1 . . . . . 3.122 1.904 4.34 1 1 330 1 . . . . . 3.129 1.905 4.353 1 1 331 1 . . . . . 3.139 1.907 4.371 1 1 332 1 . . . . . 3.145 1.927 4.381 1 1 333 1 . . . . . 3.147 1.909 4.385 1 1 334 1 . . . . . 3.159 1.912 4.406 1 1 335 1 . . . . . 3.165 1.913 4.417 1 1 336 1 . . . . . 3.165 1.913 4.417 1 1 337 1 . . . . . 3.171 1.914 4.428 1 1 338 1 . . . . . 3.175 1.915 4.435 1 1 339 1 . . . . . 3.177 1.915 4.439 1 1 340 1 . . . . . 3.184 1.917 4.451 1 1 341 1 . . . . . 3.186 1.917 4.455 1 1 342 1 . . . . . 3.188 1.918 4.458 1 1 343 1 . . . . . 3.188 1.918 4.458 1 1 344 1 . . . . . 3.19 1.918 4.462 1 1 345 1 . . . . . 3.201 1.92 4.482 1 1 346 1 . . . . . 3.201 1.92 4.482 1 1 347 1 . . . . . 3.215 1.923 4.507 1 1 348 1 . . . . . 3.229 1.926 4.532 1 1 349 1 . . . . . 3.231 1.926 4.536 1 1 350 1 . . . . . 3.233 1.926 4.54 1 1 351 1 . . . . . 3.236 1.927 4.545 1 1 352 1 . . . . . 3.24 1.927 4.553 1 1 353 1 . . . . . 3.25 1.929 4.571 1 1 354 1 . . . . . 3.263 1.932 4.594 1 1 355 1 . . . . . 3.278 1.935 4.621 1 1 356 1 . . . . . 3.281 1.935 4.627 1 1 357 1 . . . . . 3.281 1.935 4.627 1 1 358 1 . . . . . 3.289 1.937 4.641 1 1 359 1 . . . . . 3.289 1.937 4.641 1 1 360 1 . . . . . 3.294 1.937 4.651 1 1 361 1 . . . . . 3.3 1.939 4.661 1 1 362 1 . . . . . 3.308 1.94 4.676 1 1 363 1 . . . . . 3.317 1.942 4.692 1 1 364 1 . . . . . 3.317 1.942 4.692 1 1 365 1 . . . . . 3.319 1.942 4.696 1 1 366 1 . . . . . 3.331 1.944 4.718 1 1 367 1 . . . . . 3.337 1.945 4.729 1 1 368 1 . . . . . 3.343 1.946 4.74 1 1 369 1 . . . . . 3.343 1.946 4.74 1 1 370 1 . . . . . 3.346 1.947 4.745 1 1 371 1 . . . . . 3.358 1.948 4.768 1 1 372 1 . . . . . 3.358 1.948 4.768 1 1 373 1 . . . . . 3.361 1.949 4.773 1 1 374 1 . . . . . 3.361 1.949 4.773 1 1 375 1 . . . . . 3.368 1.95 4.786 1 1 376 1 . . . . . 3.371 1.951 4.791 1 1 377 1 . . . . . 3.371 1.951 4.791 1 1 378 1 . . . . . 3.381 1.953 4.809 1 1 379 1 . . . . . 3.394 1.954 4.834 1 1 380 1 . . . . . 3.411 1.957 4.865 1 1 381 1 . . . . . 3.411 1.957 4.865 1 1 382 1 . . . . . 3.414 1.957 4.871 1 1 383 1 . . . . . 3.418 1.958 4.878 1 1 384 1 . . . . . 3.432 1.96 4.904 1 1 385 1 . . . . . 3.447 1.962 4.932 1 1 386 1 . . . . . 3.454 1.963 4.945 1 1 387 1 . . . . . 3.466 1.965 4.967 1 1 388 1 . . . . . 3.477 1.965 4.989 1 1 389 1 . . . . . 3.485 1.966 5.004 1 1 390 1 . . . . . 3.485 1.966 5.004 1 1 391 1 . . . . . 3.494 1.968 5.02 1 1 392 1 . . . . . 3.506 1.969 5.043 1 1 393 1 . . . . . 3.515 1.971 5.059 1 1 394 1 . . . . . 3.528 1.973 5.083 1 1 395 1 . . . . . 3.536 1.973 5.099 1 1 396 1 . . . . . 3.536 1.973 5.099 1 1 397 1 . . . . . 3.569 1.977 5.161 1 1 398 1 . . . . . 3.569 1.977 5.161 1 1 399 1 . . . . . 3.598 1.98 5.216 1 1 400 1 . . . . . 3.662 1.985 5.339 1 1 401 1 . . . . . 3.713 1.989 5.437 1 1 402 1 . . . . . 3.764 1.993 5.535 1 1 403 1 . . . . . 3.81 1.995 5.625 1 1 404 1 . . . . . 3.833 1.996 5.67 1 1 405 1 . . . . . 3.888 1.998 5.778 1 1 406 1 . . . . . 4.023 2.0 6.046 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 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 3 PHE H . 3 . HN 1 2 1 1 2 1 1 13 PHE O . 13 . O 1 2 2 1 1 1 1 3 PHE N . 3 . N 1 2 2 1 2 1 1 13 PHE O . 13 . O 1 2 3 1 1 1 1 3 PHE O . 3 . O 1 2 3 1 2 1 1 13 PHE H . 13 . HN 1 2 4 1 1 1 1 3 PHE O . 3 . O 1 2 4 1 2 1 1 13 PHE N . 13 . N 1 2 5 1 1 1 1 5 CYS H . 5 . HN 1 2 5 1 2 1 1 11 LYS O . 11 . O 1 2 6 1 1 1 1 5 CYS N . 5 . N 1 2 6 1 2 1 1 11 LYS O . 11 . O 1 2 7 1 1 1 1 7 TRP O . 7 . O 1 2 7 1 2 1 1 9 CYS H . 9 . HN 1 2 8 1 1 1 1 7 TRP O . 7 . O 1 2 8 1 2 1 1 9 CYS N . 9 . N 1 2 9 1 1 1 1 15 ARG O . 15 . O 1 2 9 1 2 1 1 19 LEU H . 19 . HN 1 2 10 1 1 1 1 15 ARG O . 15 . O 1 2 10 1 2 1 1 19 LEU N . 19 . N 1 2 11 1 1 1 1 16 SER O . 16 . O 1 2 11 1 2 1 1 20 GLN H . 20 . HN 1 2 12 1 1 1 1 16 SER O . 16 . O 1 2 12 1 2 1 1 20 GLN N . 20 . N 1 2 13 1 1 1 1 17 ASP O . 17 . O 1 2 13 1 2 1 1 21 ARG H . 21 . HN 1 2 14 1 1 1 1 17 ASP O . 17 . O 1 2 14 1 2 1 1 21 ARG N . 21 . N 1 2 15 1 1 1 1 18 GLU O . 18 . O 1 2 15 1 2 1 1 22 HIS H . 22 . HN 1 2 16 1 1 1 1 18 GLU O . 18 . O 1 2 16 1 2 1 1 22 HIS N . 22 . N 1 2 17 1 1 1 1 19 LEU O . 19 . O 1 2 17 1 2 1 1 23 LYS H . 23 . HN 1 2 18 1 1 1 1 19 LEU O . 19 . O 1 2 18 1 2 1 1 23 LYS N . 23 . N 1 2 19 1 1 1 1 20 GLN O . 20 . O 1 2 19 1 2 1 1 24 ARG H . 24 . HN 1 2 20 1 1 1 1 20 GLN O . 20 . O 1 2 20 1 2 1 1 24 ARG N . 24 . N 1 2 21 1 1 1 1 21 ARG O . 21 . O 1 2 21 1 2 1 1 24 ARG H . 24 . HN 1 2 22 1 1 1 1 21 ARG O . 21 . O 1 2 22 1 2 1 1 24 ARG N . 24 . N 1 2 23 1 1 1 1 22 HIS O . 22 . O 1 2 23 1 2 1 1 25 THR H . 25 . HN 1 2 24 1 1 1 1 22 HIS O . 22 . O 1 2 24 1 2 1 1 25 THR N . 25 . N 1 2 25 1 1 1 1 23 LYS O . 23 . O 1 2 25 1 2 1 1 26 HIS H . 26 . HN 1 2 26 1 1 1 1 23 LYS O . 23 . O 1 2 26 1 2 1 1 26 HIS N . 26 . N 1 2 27 1 1 1 1 23 LYS O . 23 . O 1 2 27 1 2 1 1 27 THR H . 27 . HN 1 2 28 1 1 1 1 23 LYS O . 23 . O 1 2 28 1 2 1 1 27 THR N . 27 . 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 1.8 2.0 1 2 2 1 . . . . . 2.9 2.7 3.1 1 2 3 1 . . . . . 1.9 1.8 2.0 1 2 4 1 . . . . . 2.9 2.7 3.1 1 2 5 1 . . . . . 1.9 1.8 2.0 1 2 6 1 . . . . . 2.9 2.7 3.1 1 2 7 1 . . . . . 1.9 1.8 2.0 1 2 8 1 . . . . . 2.9 2.7 3.1 1 2 9 1 . . . . . 1.9 1.8 2.0 1 2 10 1 . . . . . 2.9 2.7 3.1 1 2 11 1 . . . . . 1.9 1.8 2.0 1 2 12 1 . . . . . 2.9 2.7 3.1 1 2 13 1 . . . . . 1.9 1.8 2.0 1 2 14 1 . . . . . 2.9 2.7 3.1 1 2 15 1 . . . . . 1.9 1.8 2.0 1 2 16 1 . . . . . 2.9 2.7 3.1 1 2 17 1 . . . . . 1.9 1.8 2.0 1 2 18 1 . . . . . 2.9 2.7 3.1 1 2 19 1 . . . . . 1.9 1.8 2.0 1 2 20 1 . . . . . 2.9 2.7 3.1 1 2 21 1 . . . . . 1.9 1.8 2.0 1 2 22 1 . . . . . 2.9 2.7 3.1 1 2 23 1 . . . . . 1.9 1.8 2.0 1 2 24 1 . . . . . 2.9 2.7 3.1 1 2 25 1 . . . . . 1.9 1.8 2.0 1 2 26 1 . . . . . 2.9 2.7 3.1 1 2 27 1 . . . . . 1.9 1.8 2.0 1 2 28 1 . . . . . 2.9 2.7 3.1 1 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 2 PRO C 1 1 3 PHE N 1 1 3 PHE CA 1 1 3 PHE C -160.0 -80.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 2 . 1 1 3 PHE C 1 1 4 NLE N 1 1 4 NLE CA 1 1 4 NLE C -160.0 -80.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 3 . 1 1 11 LYS C 1 1 12 ARG N 1 1 12 ARG CA 1 1 12 ARG C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 4 . 1 1 14 THR C 1 1 15 ARG N 1 1 15 ARG CA 1 1 15 ARG C -160.0 -80.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 5 . 1 1 17 ASP C 1 1 18 GLU N 1 1 18 GLU CA 1 1 18 GLU C -89.99999 -40.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 6 . 1 1 18 GLU C 1 1 19 LEU N 1 1 19 LEU CA 1 1 19 LEU C -89.99999 -40.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ARG C C 11.491 -1.611 3.786 1.00 . A A . 1 ARG C 1 1 1 2 1 1 1 ARG CA C 12.409 -2.340 4.762 1.00 . A A . 1 ARG CA 1 1 1 3 1 1 1 ARG CB C 11.605 -2.876 5.955 1.00 . A A . 1 ARG CB 1 1 1 4 1 1 1 ARG CD C 10.124 -2.387 7.935 1.00 . A A . 1 ARG CD 1 1 1 5 1 1 1 ARG CG C 10.887 -1.799 6.757 1.00 . A A . 1 ARG CG 1 1 1 6 1 1 1 ARG CZ C 10.719 -4.024 9.686 1.00 . A A . 1 ARG CZ 1 1 1 7 1 1 1 ARG H1 H 14.074 -1.901 5.929 1.00 . A A . 1 ARG H1 1 1 1 8 1 1 1 ARG H2 H 13.055 -0.577 5.658 1.00 . A A . 1 ARG H2 1 1 1 9 1 1 1 ARG H3 H 14.065 -1.133 4.423 1.00 . A A . 1 ARG H3 1 1 1 10 1 1 1 ARG HA H 12.878 -3.167 4.249 1.00 . A A . 1 ARG HA 1 1 1 11 1 1 1 ARG HB2 H 10.864 -3.570 5.589 1.00 . A A . 1 ARG HB2 1 1 1 12 1 1 1 ARG HB3 H 12.276 -3.399 6.619 1.00 . A A . 1 ARG HB3 1 1 1 13 1 1 1 ARG HD2 H 9.539 -1.604 8.397 1.00 . A A . 1 ARG HD2 1 1 1 14 1 1 1 ARG HD3 H 9.463 -3.160 7.571 1.00 . A A . 1 ARG HD3 1 1 1 15 1 1 1 ARG HE H 11.887 -2.521 9.074 1.00 . A A . 1 ARG HE 1 1 1 16 1 1 1 ARG HG2 H 11.618 -1.094 7.128 1.00 . A A . 1 ARG HG2 1 1 1 17 1 1 1 ARG HG3 H 10.191 -1.288 6.108 1.00 . A A . 1 ARG HG3 1 1 1 18 1 1 1 ARG HH11 H 9.342 -5.457 10.083 1.00 . A A . 1 ARG HH11 1 1 1 19 1 1 1 ARG HH12 H 8.907 -4.337 8.835 1.00 . A A . 1 ARG HH12 1 1 1 20 1 1 1 ARG HH21 H 12.462 -3.981 10.719 1.00 . A A . 1 ARG HH21 1 1 1 21 1 1 1 ARG HH22 H 11.368 -5.254 11.163 1.00 . A A . 1 ARG HH22 1 1 1 22 1 1 1 ARG N N 13.473 -1.425 5.228 1.00 . A A . 1 ARG N 1 1 1 23 1 1 1 ARG NE N 11.017 -2.961 8.940 1.00 . A A . 1 ARG NE 1 1 1 24 1 1 1 ARG NH1 N 9.564 -4.656 9.521 1.00 . A A . 1 ARG NH1 1 1 1 25 1 1 1 ARG NH2 N 11.585 -4.456 10.595 1.00 . A A . 1 ARG NH2 1 1 1 26 1 1 1 ARG O O 11.153 -0.448 3.998 1.00 . A A . 1 ARG O 1 1 1 27 1 1 2 PRO C C 8.747 -1.686 2.176 1.00 . A A . 2 PRO C 1 1 1 28 1 1 2 PRO CA C 10.193 -1.683 1.699 1.00 . A A . 2 PRO CA 1 1 1 29 1 1 2 PRO CB C 10.355 -2.601 0.489 1.00 . A A . 2 PRO CB 1 1 1 30 1 1 2 PRO CD C 11.486 -3.652 2.320 1.00 . A A . 2 PRO CD 1 1 1 31 1 1 2 PRO CG C 10.675 -3.931 1.078 1.00 . A A . 2 PRO CG 1 1 1 32 1 1 2 PRO HA H 10.488 -0.677 1.440 1.00 . A A . 2 PRO HA 1 1 1 33 1 1 2 PRO HB2 H 9.432 -2.626 -0.074 1.00 . A A . 2 PRO HB2 1 1 1 34 1 1 2 PRO HB3 H 11.161 -2.241 -0.136 1.00 . A A . 2 PRO HB3 1 1 1 35 1 1 2 PRO HD2 H 11.228 -4.350 3.103 1.00 . A A . 2 PRO HD2 1 1 1 36 1 1 2 PRO HD3 H 12.542 -3.704 2.099 1.00 . A A . 2 PRO HD3 1 1 1 37 1 1 2 PRO HG2 H 9.760 -4.445 1.334 1.00 . A A . 2 PRO HG2 1 1 1 38 1 1 2 PRO HG3 H 11.250 -4.515 0.375 1.00 . A A . 2 PRO HG3 1 1 1 39 1 1 2 PRO N N 11.093 -2.275 2.688 1.00 . A A . 2 PRO N 1 1 1 40 1 1 2 PRO O O 8.378 -2.451 3.070 1.00 . A A . 2 PRO O 1 1 1 41 1 1 3 PHE C C 5.729 -1.669 1.016 1.00 . A A . 3 PHE C 1 1 1 42 1 1 3 PHE CA C 6.529 -0.759 1.931 1.00 . A A . 3 PHE CA 1 1 1 43 1 1 3 PHE CB C 6.040 0.685 1.844 1.00 . A A . 3 PHE CB 1 1 1 44 1 1 3 PHE CD1 C 7.791 2.398 2.375 1.00 . A A . 3 PHE CD1 1 1 1 45 1 1 3 PHE CD2 C 6.371 1.642 4.132 1.00 . A A . 3 PHE CD2 1 1 1 46 1 1 3 PHE CE1 C 8.446 3.230 3.259 1.00 . A A . 3 PHE CE1 1 1 1 47 1 1 3 PHE CE2 C 7.022 2.473 5.021 1.00 . A A . 3 PHE CE2 1 1 1 48 1 1 3 PHE CG C 6.747 1.596 2.802 1.00 . A A . 3 PHE CG 1 1 1 49 1 1 3 PHE CZ C 8.062 3.269 4.585 1.00 . A A . 3 PHE CZ 1 1 1 50 1 1 3 PHE H H 8.279 -0.254 0.863 1.00 . A A . 3 PHE H 1 1 1 51 1 1 3 PHE HA H 6.424 -1.109 2.949 1.00 . A A . 3 PHE HA 1 1 1 52 1 1 3 PHE HB2 H 6.203 1.057 0.845 1.00 . A A . 3 PHE HB2 1 1 1 53 1 1 3 PHE HB3 H 4.988 0.717 2.069 1.00 . A A . 3 PHE HB3 1 1 1 54 1 1 3 PHE HD1 H 8.092 2.369 1.337 1.00 . A A . 3 PHE HD1 1 1 1 55 1 1 3 PHE HD2 H 5.556 1.021 4.472 1.00 . A A . 3 PHE HD2 1 1 1 56 1 1 3 PHE HE1 H 9.259 3.850 2.913 1.00 . A A . 3 PHE HE1 1 1 1 57 1 1 3 PHE HE2 H 6.718 2.500 6.056 1.00 . A A . 3 PHE HE2 1 1 1 58 1 1 3 PHE HZ H 8.574 3.920 5.278 1.00 . A A . 3 PHE HZ 1 1 1 59 1 1 3 PHE N N 7.933 -0.836 1.578 1.00 . A A . 3 PHE N 1 1 1 60 1 1 3 PHE O O 5.180 -1.238 0.005 1.00 . A A . 3 PHE O 1 1 1 61 1 1 4 NLE C C 3.694 -4.309 0.971 1.00 . A A . 4 NLE C 1 1 1 62 1 1 4 NLE CA C 5.109 -3.961 0.524 1.00 . A A . 4 NLE CA 1 1 1 63 1 1 4 NLE CB C 5.992 -5.217 0.550 1.00 . A A . 4 NLE CB 1 1 1 64 1 1 4 NLE CD C 6.360 -7.591 -0.176 1.00 . A A . 4 NLE CD 1 1 1 65 1 1 4 NLE CE C 5.785 -8.737 -0.978 1.00 . A A . 4 NLE CE 1 1 1 66 1 1 4 NLE CG C 5.453 -6.376 -0.273 1.00 . A A . 4 NLE CG 1 1 1 67 1 1 4 NLE H H 6.072 -3.198 2.238 1.00 . A A . 4 NLE H 1 1 1 68 1 1 4 NLE HA H 5.072 -3.577 -0.482 1.00 . A A . 4 NLE HA 1 1 1 69 1 1 4 NLE HB2 H 6.089 -5.549 1.573 1.00 . A A . 4 NLE HB2 1 1 1 70 1 1 4 NLE HB3 H 6.972 -4.963 0.172 1.00 . A A . 4 NLE HB3 1 1 1 71 1 1 4 NLE HD2 H 6.444 -7.896 0.857 1.00 . A A . 4 NLE HD2 1 1 1 72 1 1 4 NLE HD3 H 7.335 -7.346 -0.572 1.00 . A A . 4 NLE HD3 1 1 1 73 1 1 4 NLE HE1 H 4.809 -8.992 -0.592 1.00 . A A . 4 NLE HE1 1 1 1 74 1 1 4 NLE HE2 H 6.438 -9.595 -0.901 1.00 . A A . 4 NLE HE2 1 1 1 75 1 1 4 NLE HE3 H 5.697 -8.444 -2.013 1.00 . A A . 4 NLE HE3 1 1 1 76 1 1 4 NLE HG2 H 5.381 -6.072 -1.308 1.00 . A A . 4 NLE HG2 1 1 1 77 1 1 4 NLE HG3 H 4.473 -6.641 0.094 1.00 . A A . 4 NLE HG3 1 1 1 78 1 1 4 NLE N N 5.696 -2.939 1.372 1.00 . A A . 4 NLE N 1 1 1 79 1 1 4 NLE O O 3.432 -4.514 2.158 1.00 . A A . 4 NLE O 1 1 1 80 1 1 5 CYS C C 1.456 -6.349 0.365 1.00 . A A . 5 CYS C 1 1 1 81 1 1 5 CYS CA C 1.437 -4.826 0.261 1.00 . A A . 5 CYS CA 1 1 1 82 1 1 5 CYS CB C 0.491 -4.373 -0.860 1.00 . A A . 5 CYS CB 1 1 1 83 1 1 5 CYS H H 3.026 -4.062 -0.896 1.00 . A A . 5 CYS H 1 1 1 84 1 1 5 CYS HA H 1.104 -4.409 1.199 1.00 . A A . 5 CYS HA 1 1 1 85 1 1 5 CYS HB2 H 0.517 -3.295 -0.931 1.00 . A A . 5 CYS HB2 1 1 1 86 1 1 5 CYS HB3 H 0.824 -4.797 -1.794 1.00 . A A . 5 CYS HB3 1 1 1 87 1 1 5 CYS N N 2.783 -4.354 0.010 1.00 . A A . 5 CYS N 1 1 1 88 1 1 5 CYS O O 2.266 -7.007 -0.282 1.00 . A A . 5 CYS O 1 1 1 89 1 1 5 CYS SG S -1.235 -4.863 -0.613 1.00 . A A . 5 CYS SG 1 1 1 90 1 1 6 THR C C -0.973 -8.727 1.553 1.00 . A A . 6 THR C 1 1 1 91 1 1 6 THR CA C 0.488 -8.349 1.318 1.00 . A A . 6 THR CA 1 1 1 92 1 1 6 THR CB C 1.388 -8.904 2.445 1.00 . A A . 6 THR CB 1 1 1 93 1 1 6 THR CG2 C 1.482 -10.422 2.371 1.00 . A A . 6 THR CG2 1 1 1 94 1 1 6 THR H H 0.053 -6.338 1.779 1.00 . A A . 6 THR H 1 1 1 95 1 1 6 THR HA H 0.809 -8.779 0.380 1.00 . A A . 6 THR HA 1 1 1 96 1 1 6 THR HB H 0.966 -8.623 3.399 1.00 . A A . 6 THR HB 1 1 1 97 1 1 6 THR HG1 H 2.805 -7.943 1.453 1.00 . A A . 6 THR HG1 1 1 1 98 1 1 6 THR HG21 H 1.909 -10.711 1.423 1.00 . A A . 6 THR HG21 1 1 1 99 1 1 6 THR HG22 H 0.494 -10.847 2.465 1.00 . A A . 6 THR HG22 1 1 1 100 1 1 6 THR HG23 H 2.107 -10.783 3.173 1.00 . A A . 6 THR HG23 1 1 1 101 1 1 6 THR N N 0.607 -6.906 1.208 1.00 . A A . 6 THR N 1 1 1 102 1 1 6 THR O O -1.321 -9.411 2.518 1.00 . A A . 6 THR O 1 1 1 103 1 1 6 THR OG1 O 2.709 -8.348 2.325 1.00 . A A . 6 THR OG1 1 1 1 104 1 1 7 TRP C C -3.562 -9.839 0.044 1.00 . A A . 7 TRP C 1 1 1 105 1 1 7 TRP CA C -3.254 -8.526 0.749 1.00 . A A . 7 TRP CA 1 1 1 106 1 1 7 TRP CB C -4.050 -7.377 0.122 1.00 . A A . 7 TRP CB 1 1 1 107 1 1 7 TRP CD1 C -6.440 -8.172 -0.339 1.00 . A A . 7 TRP CD1 1 1 1 108 1 1 7 TRP CD2 C -6.254 -6.753 1.378 1.00 . A A . 7 TRP CD2 1 1 1 109 1 1 7 TRP CE2 C -7.609 -7.107 1.234 1.00 . A A . 7 TRP CE2 1 1 1 110 1 1 7 TRP CE3 C -5.892 -5.868 2.393 1.00 . A A . 7 TRP CE3 1 1 1 111 1 1 7 TRP CG C -5.525 -7.448 0.367 1.00 . A A . 7 TRP CG 1 1 1 112 1 1 7 TRP CH2 C -8.217 -5.736 3.057 1.00 . A A . 7 TRP CH2 1 1 1 113 1 1 7 TRP CZ2 C -8.601 -6.603 2.070 1.00 . A A . 7 TRP CZ2 1 1 1 114 1 1 7 TRP CZ3 C -6.877 -5.367 3.222 1.00 . A A . 7 TRP CZ3 1 1 1 115 1 1 7 TRP H H -1.494 -7.711 -0.082 1.00 . A A . 7 TRP H 1 1 1 116 1 1 7 TRP HA H -3.519 -8.615 1.791 1.00 . A A . 7 TRP HA 1 1 1 117 1 1 7 TRP HB2 H -3.694 -6.440 0.524 1.00 . A A . 7 TRP HB2 1 1 1 118 1 1 7 TRP HB3 H -3.891 -7.383 -0.942 1.00 . A A . 7 TRP HB3 1 1 1 119 1 1 7 TRP HD1 H -6.194 -8.807 -1.177 1.00 . A A . 7 TRP HD1 1 1 1 120 1 1 7 TRP HE1 H -8.521 -8.393 -0.155 1.00 . A A . 7 TRP HE1 1 1 1 121 1 1 7 TRP HE3 H -4.861 -5.573 2.533 1.00 . A A . 7 TRP HE3 1 1 1 122 1 1 7 TRP HH2 H -8.954 -5.319 3.728 1.00 . A A . 7 TRP HH2 1 1 1 123 1 1 7 TRP HZ2 H -9.640 -6.879 1.954 1.00 . A A . 7 TRP HZ2 1 1 1 124 1 1 7 TRP HZ3 H -6.615 -4.679 4.013 1.00 . A A . 7 TRP HZ3 1 1 1 125 1 1 7 TRP N N -1.832 -8.252 0.663 1.00 . A A . 7 TRP N 1 1 1 126 1 1 7 TRP NE1 N -7.696 -7.978 0.179 1.00 . A A . 7 TRP NE1 1 1 1 127 1 1 7 TRP O O -3.979 -9.856 -1.117 1.00 . A A . 7 TRP O 1 1 1 128 1 1 8 ORN C C -1.410 -10.831 -3.223 1.00 . A A . 8 ORN C 1 1 1 129 1 1 8 ORN CA C -2.030 -12.019 -2.504 1.00 . A A . 8 ORN CA 1 1 1 130 1 1 8 ORN CB C -1.394 -12.168 -1.120 1.00 . A A . 8 ORN CB 1 1 1 131 1 1 8 ORN CD C -3.523 -12.292 0.217 1.00 . A A . 8 ORN CD 1 1 1 132 1 1 8 ORN CG C -2.218 -12.992 -0.142 1.00 . A A . 8 ORN CG 1 1 1 133 1 1 8 ORN H H -2.310 -14.061 -2.800 1.00 . A A . 8 ORN H 1 1 1 134 1 1 8 ORN HA H -3.088 -11.837 -2.387 1.00 . A A . 8 ORN HA 1 1 1 135 1 1 8 ORN HB2 H -1.255 -11.185 -0.696 1.00 . A A . 8 ORN HB2 1 1 1 136 1 1 8 ORN HB3 H -0.431 -12.641 -1.230 1.00 . A A . 8 ORN HB3 1 1 1 137 1 1 8 ORN HD2 H -4.033 -12.872 0.971 1.00 . A A . 8 ORN HD2 1 1 1 138 1 1 8 ORN HD3 H -4.140 -12.230 -0.664 1.00 . A A . 8 ORN HD3 1 1 1 139 1 1 8 ORN HE1 H -2.931 -10.852 1.637 1.00 . A A . 8 ORN HE1 1 1 1 140 1 1 8 ORN HG2 H -1.641 -13.144 0.759 1.00 . A A . 8 ORN HG2 1 1 1 141 1 1 8 ORN HG3 H -2.445 -13.948 -0.592 1.00 . A A . 8 ORN HG3 1 1 1 142 1 1 8 ORN N N -1.857 -13.263 -3.288 1.00 . A A . 8 ORN N 1 1 1 143 1 1 8 ORN NE N -3.300 -10.942 0.730 1.00 . A A . 8 ORN NE 1 1 1 144 1 1 8 ORN O O -0.330 -10.938 -3.800 1.00 . A A . 8 ORN O 1 1 1 145 1 1 9 CYS C C -0.352 -8.016 -3.040 1.00 . A A . 9 CYS C 1 1 1 146 1 1 9 CYS CA C -1.616 -8.463 -3.767 1.00 . A A . 9 CYS CA 1 1 1 147 1 1 9 CYS CB C -2.700 -7.390 -3.662 1.00 . A A . 9 CYS CB 1 1 1 148 1 1 9 CYS H H -2.989 -9.705 -2.749 1.00 . A A . 9 CYS H 1 1 1 149 1 1 9 CYS HA H -1.389 -8.640 -4.807 1.00 . A A . 9 CYS HA 1 1 1 150 1 1 9 CYS HB2 H -3.538 -7.674 -4.278 1.00 . A A . 9 CYS HB2 1 1 1 151 1 1 9 CYS HB3 H -3.025 -7.324 -2.636 1.00 . A A . 9 CYS HB3 1 1 1 152 1 1 9 CYS N N -2.110 -9.704 -3.189 1.00 . A A . 9 CYS N 1 1 1 153 1 1 9 CYS O O -0.388 -7.761 -1.834 1.00 . A A . 9 CYS O 1 1 1 154 1 1 9 CYS SG S -2.177 -5.742 -4.177 1.00 . A A . 9 CYS SG 1 1 1 155 1 1 10 GLY C C 2.867 -6.607 -3.852 1.00 . A A . 10 GLY C 1 1 1 156 1 1 10 GLY CA C 2.027 -7.638 -3.127 1.00 . A A . 10 GLY CA 1 1 1 157 1 1 10 GLY H H 0.715 -8.034 -4.740 1.00 . A A . 10 GLY H 1 1 1 158 1 1 10 GLY HA2 H 1.837 -7.283 -2.125 1.00 . A A . 10 GLY HA2 1 1 1 159 1 1 10 GLY HA3 H 2.586 -8.557 -3.066 1.00 . A A . 10 GLY HA3 1 1 1 160 1 1 10 GLY N N 0.758 -7.917 -3.767 1.00 . A A . 10 GLY N 1 1 1 161 1 1 10 GLY O O 4.044 -6.843 -4.125 1.00 . A A . 10 GLY O 1 1 1 162 1 1 11 LYS C C 3.951 -3.726 -3.736 1.00 . A A . 11 LYS C 1 1 1 163 1 1 11 LYS CA C 3.028 -4.368 -4.766 1.00 . A A . 11 LYS CA 1 1 1 164 1 1 11 LYS CB C 2.085 -3.312 -5.350 1.00 . A A . 11 LYS CB 1 1 1 165 1 1 11 LYS CD C 0.559 -2.633 -7.225 1.00 . A A . 11 LYS CD 1 1 1 166 1 1 11 LYS CE C -0.232 -3.095 -8.440 1.00 . A A . 11 LYS CE 1 1 1 167 1 1 11 LYS CG C 1.315 -3.782 -6.573 1.00 . A A . 11 LYS CG 1 1 1 168 1 1 11 LYS H H 1.321 -5.353 -3.988 1.00 . A A . 11 LYS H 1 1 1 169 1 1 11 LYS HA H 3.630 -4.780 -5.562 1.00 . A A . 11 LYS HA 1 1 1 170 1 1 11 LYS HB2 H 1.369 -3.029 -4.592 1.00 . A A . 11 LYS HB2 1 1 1 171 1 1 11 LYS HB3 H 2.664 -2.444 -5.626 1.00 . A A . 11 LYS HB3 1 1 1 172 1 1 11 LYS HD2 H -0.124 -2.211 -6.504 1.00 . A A . 11 LYS HD2 1 1 1 173 1 1 11 LYS HD3 H 1.269 -1.880 -7.534 1.00 . A A . 11 LYS HD3 1 1 1 174 1 1 11 LYS HE2 H -0.939 -3.846 -8.127 1.00 . A A . 11 LYS HE2 1 1 1 175 1 1 11 LYS HE3 H -0.765 -2.248 -8.847 1.00 . A A . 11 LYS HE3 1 1 1 176 1 1 11 LYS HG2 H 2.012 -4.193 -7.289 1.00 . A A . 11 LYS HG2 1 1 1 177 1 1 11 LYS HG3 H 0.610 -4.543 -6.275 1.00 . A A . 11 LYS HG3 1 1 1 178 1 1 11 LYS HZ1 H 1.127 -4.517 -9.139 1.00 . A A . 11 LYS HZ1 1 1 1 179 1 1 11 LYS HZ2 H 1.363 -2.973 -9.782 1.00 . A A . 11 LYS HZ2 1 1 1 180 1 1 11 LYS HZ3 H 0.078 -3.928 -10.326 1.00 . A A . 11 LYS HZ3 1 1 1 181 1 1 11 LYS N N 2.277 -5.462 -4.163 1.00 . A A . 11 LYS N 1 1 1 182 1 1 11 LYS NZ N 0.645 -3.669 -9.494 1.00 . A A . 11 LYS NZ 1 1 1 183 1 1 11 LYS O O 3.551 -3.492 -2.593 1.00 . A A . 11 LYS O 1 1 1 184 1 1 12 ARG C C 6.315 -1.368 -3.527 1.00 . A A . 12 ARG C 1 1 1 185 1 1 12 ARG CA C 6.169 -2.856 -3.243 1.00 . A A . 12 ARG CA 1 1 1 186 1 1 12 ARG CB C 7.529 -3.539 -3.392 1.00 . A A . 12 ARG CB 1 1 1 187 1 1 12 ARG CD C 8.896 -5.631 -3.164 1.00 . A A . 12 ARG CD 1 1 1 188 1 1 12 ARG CG C 7.501 -5.030 -3.109 1.00 . A A . 12 ARG CG 1 1 1 189 1 1 12 ARG CZ C 9.803 -7.712 -2.195 1.00 . A A . 12 ARG CZ 1 1 1 190 1 1 12 ARG H H 5.448 -3.677 -5.055 1.00 . A A . 12 ARG H 1 1 1 191 1 1 12 ARG HA H 5.817 -2.985 -2.232 1.00 . A A . 12 ARG HA 1 1 1 192 1 1 12 ARG HB2 H 7.882 -3.393 -4.402 1.00 . A A . 12 ARG HB2 1 1 1 193 1 1 12 ARG HB3 H 8.225 -3.077 -2.707 1.00 . A A . 12 ARG HB3 1 1 1 194 1 1 12 ARG HD2 H 9.314 -5.454 -4.143 1.00 . A A . 12 ARG HD2 1 1 1 195 1 1 12 ARG HD3 H 9.512 -5.151 -2.418 1.00 . A A . 12 ARG HD3 1 1 1 196 1 1 12 ARG HE H 8.136 -7.586 -3.300 1.00 . A A . 12 ARG HE 1 1 1 197 1 1 12 ARG HG2 H 7.088 -5.190 -2.126 1.00 . A A . 12 ARG HG2 1 1 1 198 1 1 12 ARG HG3 H 6.878 -5.514 -3.847 1.00 . A A . 12 ARG HG3 1 1 1 199 1 1 12 ARG HH11 H 10.920 -6.061 -1.812 1.00 . A A . 12 ARG HH11 1 1 1 200 1 1 12 ARG HH12 H 11.520 -7.536 -1.128 1.00 . A A . 12 ARG HH12 1 1 1 201 1 1 12 ARG HH21 H 10.397 -9.506 -1.476 1.00 . A A . 12 ARG HH21 1 1 1 202 1 1 12 ARG HH22 H 8.942 -9.531 -2.420 1.00 . A A . 12 ARG HH22 1 1 1 203 1 1 12 ARG N N 5.188 -3.462 -4.135 1.00 . A A . 12 ARG N 1 1 1 204 1 1 12 ARG NE N 8.880 -7.070 -2.910 1.00 . A A . 12 ARG NE 1 1 1 205 1 1 12 ARG NH1 N 10.829 -7.049 -1.671 1.00 . A A . 12 ARG NH1 1 1 1 206 1 1 12 ARG NH2 N 9.705 -9.021 -2.014 1.00 . A A . 12 ARG NH2 1 1 1 207 1 1 12 ARG O O 6.450 -0.955 -4.681 1.00 . A A . 12 ARG O 1 1 1 208 1 1 13 PHE C C 7.588 1.383 -1.780 1.00 . A A . 13 PHE C 1 1 1 209 1 1 13 PHE CA C 6.401 0.872 -2.585 1.00 . A A . 13 PHE CA 1 1 1 210 1 1 13 PHE CB C 5.115 1.528 -2.080 1.00 . A A . 13 PHE CB 1 1 1 211 1 1 13 PHE CD1 C 3.458 1.570 -3.957 1.00 . A A . 13 PHE CD1 1 1 1 212 1 1 13 PHE CD2 C 3.162 -0.026 -2.215 1.00 . A A . 13 PHE CD2 1 1 1 213 1 1 13 PHE CE1 C 2.329 1.093 -4.588 1.00 . A A . 13 PHE CE1 1 1 1 214 1 1 13 PHE CE2 C 2.033 -0.508 -2.840 1.00 . A A . 13 PHE CE2 1 1 1 215 1 1 13 PHE CG C 3.885 1.016 -2.764 1.00 . A A . 13 PHE CG 1 1 1 216 1 1 13 PHE CZ C 1.616 0.053 -4.029 1.00 . A A . 13 PHE CZ 1 1 1 217 1 1 13 PHE H H 6.201 -0.969 -1.575 1.00 . A A . 13 PHE H 1 1 1 218 1 1 13 PHE HA H 6.540 1.120 -3.625 1.00 . A A . 13 PHE HA 1 1 1 219 1 1 13 PHE HB2 H 5.012 1.338 -1.024 1.00 . A A . 13 PHE HB2 1 1 1 220 1 1 13 PHE HB3 H 5.172 2.593 -2.247 1.00 . A A . 13 PHE HB3 1 1 1 221 1 1 13 PHE HD1 H 4.015 2.385 -4.393 1.00 . A A . 13 PHE HD1 1 1 1 222 1 1 13 PHE HD2 H 3.493 -0.466 -1.286 1.00 . A A . 13 PHE HD2 1 1 1 223 1 1 13 PHE HE1 H 2.004 1.530 -5.518 1.00 . A A . 13 PHE HE1 1 1 1 224 1 1 13 PHE HE2 H 1.477 -1.321 -2.398 1.00 . A A . 13 PHE HE2 1 1 1 225 1 1 13 PHE HZ H 0.731 -0.321 -4.519 1.00 . A A . 13 PHE HZ 1 1 1 226 1 1 13 PHE N N 6.296 -0.573 -2.469 1.00 . A A . 13 PHE N 1 1 1 227 1 1 13 PHE O O 7.987 0.775 -0.782 1.00 . A A . 13 PHE O 1 1 1 228 1 1 14 THR C C 8.743 4.157 -0.532 1.00 . A A . 14 THR C 1 1 1 229 1 1 14 THR CA C 9.265 3.120 -1.524 1.00 . A A . 14 THR CA 1 1 1 230 1 1 14 THR CB C 10.224 3.801 -2.521 1.00 . A A . 14 THR CB 1 1 1 231 1 1 14 THR CG2 C 11.568 4.109 -1.869 1.00 . A A . 14 THR CG2 1 1 1 232 1 1 14 THR H H 7.827 2.897 -3.058 1.00 . A A . 14 THR H 1 1 1 233 1 1 14 THR HA H 9.804 2.354 -0.989 1.00 . A A . 14 THR HA 1 1 1 234 1 1 14 THR HB H 9.779 4.728 -2.854 1.00 . A A . 14 THR HB 1 1 1 235 1 1 14 THR HG1 H 9.990 3.326 -4.424 1.00 . A A . 14 THR HG1 1 1 1 236 1 1 14 THR HG21 H 12.211 4.605 -2.581 1.00 . A A . 14 THR HG21 1 1 1 237 1 1 14 THR HG22 H 12.032 3.188 -1.548 1.00 . A A . 14 THR HG22 1 1 1 238 1 1 14 THR HG23 H 11.415 4.750 -1.014 1.00 . A A . 14 THR HG23 1 1 1 239 1 1 14 THR N N 8.156 2.493 -2.224 1.00 . A A . 14 THR N 1 1 1 240 1 1 14 THR O O 9.462 4.599 0.365 1.00 . A A . 14 THR O 1 1 1 241 1 1 14 THR OG1 O 10.431 2.942 -3.652 1.00 . A A . 14 THR OG1 1 1 1 242 1 1 15 ARG C C 5.678 4.983 0.929 1.00 . A A . 15 ARG C 1 1 1 243 1 1 15 ARG CA C 6.871 5.546 0.160 1.00 . A A . 15 ARG CA 1 1 1 244 1 1 15 ARG CB C 6.436 6.746 -0.680 1.00 . A A . 15 ARG CB 1 1 1 245 1 1 15 ARG CD C 7.120 8.692 -2.124 1.00 . A A . 15 ARG CD 1 1 1 246 1 1 15 ARG CG C 7.589 7.614 -1.159 1.00 . A A . 15 ARG CG 1 1 1 247 1 1 15 ARG CZ C 5.573 10.619 -2.120 1.00 . A A . 15 ARG CZ 1 1 1 248 1 1 15 ARG H H 6.937 4.102 -1.385 1.00 . A A . 15 ARG H 1 1 1 249 1 1 15 ARG HA H 7.618 5.866 0.871 1.00 . A A . 15 ARG HA 1 1 1 250 1 1 15 ARG HB2 H 5.904 6.388 -1.548 1.00 . A A . 15 ARG HB2 1 1 1 251 1 1 15 ARG HB3 H 5.774 7.362 -0.091 1.00 . A A . 15 ARG HB3 1 1 1 252 1 1 15 ARG HD2 H 7.935 9.376 -2.300 1.00 . A A . 15 ARG HD2 1 1 1 253 1 1 15 ARG HD3 H 6.841 8.223 -3.056 1.00 . A A . 15 ARG HD3 1 1 1 254 1 1 15 ARG HE H 5.460 9.054 -0.867 1.00 . A A . 15 ARG HE 1 1 1 255 1 1 15 ARG HG2 H 8.052 8.084 -0.306 1.00 . A A . 15 ARG HG2 1 1 1 256 1 1 15 ARG HG3 H 8.312 6.986 -1.662 1.00 . A A . 15 ARG HG3 1 1 1 257 1 1 15 ARG HH11 H 7.057 10.732 -3.501 1.00 . A A . 15 ARG HH11 1 1 1 258 1 1 15 ARG HH12 H 5.943 12.063 -3.494 1.00 . A A . 15 ARG HH12 1 1 1 259 1 1 15 ARG HH21 H 3.974 10.778 -0.882 1.00 . A A . 15 ARG HH21 1 1 1 260 1 1 15 ARG HH22 H 4.186 12.092 -2.002 1.00 . A A . 15 ARG HH22 1 1 1 261 1 1 15 ARG N N 7.479 4.529 -0.688 1.00 . A A . 15 ARG N 1 1 1 262 1 1 15 ARG NE N 5.974 9.451 -1.617 1.00 . A A . 15 ARG NE 1 1 1 263 1 1 15 ARG NH1 N 6.244 11.183 -3.118 1.00 . A A . 15 ARG NH1 1 1 1 264 1 1 15 ARG NH2 N 4.493 11.212 -1.631 1.00 . A A . 15 ARG NH2 1 1 1 265 1 1 15 ARG O O 4.791 4.334 0.363 1.00 . A A . 15 ARG O 1 1 1 266 1 1 16 SER C C 3.284 5.358 2.805 1.00 . A A . 16 SER C 1 1 1 267 1 1 16 SER CA C 4.644 4.761 3.131 1.00 . A A . 16 SER CA 1 1 1 268 1 1 16 SER CB C 5.039 5.106 4.563 1.00 . A A . 16 SER CB 1 1 1 269 1 1 16 SER H H 6.387 5.815 2.600 1.00 . A A . 16 SER H 1 1 1 270 1 1 16 SER HA H 4.595 3.688 3.028 1.00 . A A . 16 SER HA 1 1 1 271 1 1 16 SER HB2 H 4.166 5.082 5.195 1.00 . A A . 16 SER HB2 1 1 1 272 1 1 16 SER HB3 H 5.764 4.389 4.920 1.00 . A A . 16 SER HB3 1 1 1 273 1 1 16 SER HG H 6.145 6.478 5.422 1.00 . A A . 16 SER HG 1 1 1 274 1 1 16 SER N N 5.673 5.253 2.229 1.00 . A A . 16 SER N 1 1 1 275 1 1 16 SER O O 2.256 4.694 2.940 1.00 . A A . 16 SER O 1 1 1 276 1 1 16 SER OG O 5.611 6.401 4.621 1.00 . A A . 16 SER OG 1 1 1 277 1 1 17 ASP C C 1.486 6.724 0.724 1.00 . A A . 17 ASP C 1 1 1 278 1 1 17 ASP CA C 2.058 7.301 2.010 1.00 . A A . 17 ASP CA 1 1 1 279 1 1 17 ASP CB C 2.299 8.809 1.860 1.00 . A A . 17 ASP CB 1 1 1 280 1 1 17 ASP CG C 3.079 9.177 0.611 1.00 . A A . 17 ASP CG 1 1 1 281 1 1 17 ASP H H 4.142 7.086 2.293 1.00 . A A . 17 ASP H 1 1 1 282 1 1 17 ASP HA H 1.348 7.136 2.806 1.00 . A A . 17 ASP HA 1 1 1 283 1 1 17 ASP HB2 H 1.348 9.310 1.823 1.00 . A A . 17 ASP HB2 1 1 1 284 1 1 17 ASP HB3 H 2.847 9.161 2.720 1.00 . A A . 17 ASP HB3 1 1 1 285 1 1 17 ASP N N 3.289 6.611 2.369 1.00 . A A . 17 ASP N 1 1 1 286 1 1 17 ASP O O 0.272 6.694 0.534 1.00 . A A . 17 ASP O 1 1 1 287 1 1 17 ASP OD1 O 2.510 9.866 -0.266 1.00 . A A . 17 ASP OD1 1 1 1 288 1 1 17 ASP OD2 O 4.264 8.790 0.503 1.00 . A A . 17 ASP OD2 1 1 1 289 1 1 18 GLU C C 1.363 4.233 -1.101 1.00 . A A . 18 GLU C 1 1 1 290 1 1 18 GLU CA C 1.934 5.612 -1.383 1.00 . A A . 18 GLU CA 1 1 1 291 1 1 18 GLU CB C 3.080 5.518 -2.388 1.00 . A A . 18 GLU CB 1 1 1 292 1 1 18 GLU CD C 4.499 6.771 -4.046 1.00 . A A . 18 GLU CD 1 1 1 293 1 1 18 GLU CG C 3.583 6.872 -2.848 1.00 . A A . 18 GLU CG 1 1 1 294 1 1 18 GLU H H 3.318 6.322 0.047 1.00 . A A . 18 GLU H 1 1 1 295 1 1 18 GLU HA H 1.152 6.224 -1.803 1.00 . A A . 18 GLU HA 1 1 1 296 1 1 18 GLU HB2 H 3.903 4.988 -1.931 1.00 . A A . 18 GLU HB2 1 1 1 297 1 1 18 GLU HB3 H 2.742 4.968 -3.253 1.00 . A A . 18 GLU HB3 1 1 1 298 1 1 18 GLU HG2 H 2.736 7.487 -3.112 1.00 . A A . 18 GLU HG2 1 1 1 299 1 1 18 GLU HG3 H 4.128 7.333 -2.037 1.00 . A A . 18 GLU HG3 1 1 1 300 1 1 18 GLU N N 2.363 6.244 -0.146 1.00 . A A . 18 GLU N 1 1 1 301 1 1 18 GLU O O 0.397 3.816 -1.741 1.00 . A A . 18 GLU O 1 1 1 302 1 1 18 GLU OE1 O 5.672 6.391 -3.873 1.00 . A A . 18 GLU OE1 1 1 1 303 1 1 18 GLU OE2 O 4.048 7.069 -5.172 1.00 . A A . 18 GLU OE2 1 1 1 304 1 1 19 LEU C C 0.032 2.507 0.949 1.00 . A A . 19 LEU C 1 1 1 305 1 1 19 LEU CA C 1.395 2.264 0.317 1.00 . A A . 19 LEU CA 1 1 1 306 1 1 19 LEU CB C 2.318 1.574 1.323 1.00 . A A . 19 LEU CB 1 1 1 307 1 1 19 LEU CD1 C 1.510 -0.776 0.930 1.00 . A A . 19 LEU CD1 1 1 1 308 1 1 19 LEU CD2 C 2.640 -0.198 3.081 1.00 . A A . 19 LEU CD2 1 1 1 309 1 1 19 LEU CG C 1.735 0.311 1.971 1.00 . A A . 19 LEU CG 1 1 1 310 1 1 19 LEU H H 2.799 3.856 0.252 1.00 . A A . 19 LEU H 1 1 1 311 1 1 19 LEU HA H 1.269 1.625 -0.546 1.00 . A A . 19 LEU HA 1 1 1 312 1 1 19 LEU HB2 H 3.231 1.306 0.811 1.00 . A A . 19 LEU HB2 1 1 1 313 1 1 19 LEU HB3 H 2.556 2.278 2.105 1.00 . A A . 19 LEU HB3 1 1 1 314 1 1 19 LEU HD11 H 0.820 -0.419 0.179 1.00 . A A . 19 LEU HD11 1 1 1 315 1 1 19 LEU HD12 H 1.102 -1.653 1.408 1.00 . A A . 19 LEU HD12 1 1 1 316 1 1 19 LEU HD13 H 2.452 -1.025 0.464 1.00 . A A . 19 LEU HD13 1 1 1 317 1 1 19 LEU HD21 H 2.143 -0.998 3.609 1.00 . A A . 19 LEU HD21 1 1 1 318 1 1 19 LEU HD22 H 2.859 0.606 3.766 1.00 . A A . 19 LEU HD22 1 1 1 319 1 1 19 LEU HD23 H 3.559 -0.569 2.653 1.00 . A A . 19 LEU HD23 1 1 1 320 1 1 19 LEU HG H 0.774 0.553 2.407 1.00 . A A . 19 LEU HG 1 1 1 321 1 1 19 LEU N N 1.957 3.527 -0.143 1.00 . A A . 19 LEU N 1 1 1 322 1 1 19 LEU O O -0.909 1.762 0.708 1.00 . A A . 19 LEU O 1 1 1 323 1 1 20 GLN C C -2.389 4.210 1.305 1.00 . A A . 20 GLN C 1 1 1 324 1 1 20 GLN CA C -1.321 3.958 2.368 1.00 . A A . 20 GLN CA 1 1 1 325 1 1 20 GLN CB C -1.112 5.213 3.218 1.00 . A A . 20 GLN CB 1 1 1 326 1 1 20 GLN CD C -2.157 7.080 4.549 1.00 . A A . 20 GLN CD 1 1 1 327 1 1 20 GLN CG C -2.399 5.825 3.740 1.00 . A A . 20 GLN CG 1 1 1 328 1 1 20 GLN H H 0.752 4.077 1.950 1.00 . A A . 20 GLN H 1 1 1 329 1 1 20 GLN HA H -1.646 3.149 3.006 1.00 . A A . 20 GLN HA 1 1 1 330 1 1 20 GLN HB2 H -0.492 4.959 4.065 1.00 . A A . 20 GLN HB2 1 1 1 331 1 1 20 GLN HB3 H -0.602 5.955 2.621 1.00 . A A . 20 GLN HB3 1 1 1 332 1 1 20 GLN HE21 H -2.052 6.010 6.214 1.00 . A A . 20 GLN HE21 1 1 1 333 1 1 20 GLN HE22 H -1.852 7.717 6.403 1.00 . A A . 20 GLN HE22 1 1 1 334 1 1 20 GLN HG2 H -3.030 6.073 2.901 1.00 . A A . 20 GLN HG2 1 1 1 335 1 1 20 GLN HG3 H -2.901 5.101 4.365 1.00 . A A . 20 GLN HG3 1 1 1 336 1 1 20 GLN N N -0.060 3.559 1.752 1.00 . A A . 20 GLN N 1 1 1 337 1 1 20 GLN NE2 N -2.002 6.919 5.851 1.00 . A A . 20 GLN NE2 1 1 1 338 1 1 20 GLN O O -3.495 3.660 1.372 1.00 . A A . 20 GLN O 1 1 1 339 1 1 20 GLN OE1 O -2.113 8.188 4.007 1.00 . A A . 20 GLN OE1 1 1 1 340 1 1 21 ARG C C -3.360 4.041 -1.485 1.00 . A A . 21 ARG C 1 1 1 341 1 1 21 ARG CA C -2.959 5.326 -0.782 1.00 . A A . 21 ARG CA 1 1 1 342 1 1 21 ARG CB C -2.319 6.292 -1.784 1.00 . A A . 21 ARG CB 1 1 1 343 1 1 21 ARG CD C -1.448 8.599 -2.270 1.00 . A A . 21 ARG CD 1 1 1 344 1 1 21 ARG CG C -2.083 7.688 -1.230 1.00 . A A . 21 ARG CG 1 1 1 345 1 1 21 ARG CZ C -2.255 9.807 -4.265 1.00 . A A . 21 ARG CZ 1 1 1 346 1 1 21 ARG H H -1.153 5.445 0.327 1.00 . A A . 21 ARG H 1 1 1 347 1 1 21 ARG HA H -3.844 5.785 -0.366 1.00 . A A . 21 ARG HA 1 1 1 348 1 1 21 ARG HB2 H -1.369 5.889 -2.097 1.00 . A A . 21 ARG HB2 1 1 1 349 1 1 21 ARG HB3 H -2.966 6.375 -2.644 1.00 . A A . 21 ARG HB3 1 1 1 350 1 1 21 ARG HD2 H -1.288 9.571 -1.830 1.00 . A A . 21 ARG HD2 1 1 1 351 1 1 21 ARG HD3 H -0.497 8.180 -2.566 1.00 . A A . 21 ARG HD3 1 1 1 352 1 1 21 ARG HE H -2.913 8.018 -3.663 1.00 . A A . 21 ARG HE 1 1 1 353 1 1 21 ARG HG2 H -3.029 8.111 -0.928 1.00 . A A . 21 ARG HG2 1 1 1 354 1 1 21 ARG HG3 H -1.427 7.622 -0.375 1.00 . A A . 21 ARG HG3 1 1 1 355 1 1 21 ARG HH11 H -0.829 10.800 -3.214 1.00 . A A . 21 ARG HH11 1 1 1 356 1 1 21 ARG HH12 H -1.413 11.613 -4.632 1.00 . A A . 21 ARG HH12 1 1 1 357 1 1 21 ARG HH21 H -3.671 9.085 -5.515 1.00 . A A . 21 ARG HH21 1 1 1 358 1 1 21 ARG HH22 H -3.028 10.639 -5.943 1.00 . A A . 21 ARG HH22 1 1 1 359 1 1 21 ARG N N -2.046 5.031 0.316 1.00 . A A . 21 ARG N 1 1 1 360 1 1 21 ARG NE N -2.289 8.751 -3.455 1.00 . A A . 21 ARG NE 1 1 1 361 1 1 21 ARG NH1 N -1.433 10.821 -4.018 1.00 . A A . 21 ARG NH1 1 1 1 362 1 1 21 ARG NH2 N -3.049 9.848 -5.326 1.00 . A A . 21 ARG NH2 1 1 1 363 1 1 21 ARG O O -4.538 3.812 -1.751 1.00 . A A . 21 ARG O 1 1 1 364 1 1 22 HIS C C -3.631 1.096 -1.530 1.00 . A A . 22 HIS C 1 1 1 365 1 1 22 HIS CA C -2.638 1.902 -2.370 1.00 . A A . 22 HIS CA 1 1 1 366 1 1 22 HIS CB C -1.326 1.126 -2.546 1.00 . A A . 22 HIS CB 1 1 1 367 1 1 22 HIS CD2 C -1.805 -1.375 -2.193 1.00 . A A . 22 HIS CD2 1 1 1 368 1 1 22 HIS CE1 C -1.861 -2.039 -4.263 1.00 . A A . 22 HIS CE1 1 1 1 369 1 1 22 HIS CG C -1.534 -0.292 -2.959 1.00 . A A . 22 HIS CG 1 1 1 370 1 1 22 HIS H H -1.454 3.433 -1.526 1.00 . A A . 22 HIS H 1 1 1 371 1 1 22 HIS HA H -3.073 2.083 -3.342 1.00 . A A . 22 HIS HA 1 1 1 372 1 1 22 HIS HB2 H -0.726 1.610 -3.301 1.00 . A A . 22 HIS HB2 1 1 1 373 1 1 22 HIS HB3 H -0.786 1.125 -1.610 1.00 . A A . 22 HIS HB3 1 1 1 374 1 1 22 HIS HD1 H -1.384 -0.182 -5.076 1.00 . A A . 22 HIS HD1 1 1 1 375 1 1 22 HIS HD2 H -1.827 -1.409 -1.115 1.00 . A A . 22 HIS HD2 1 1 1 376 1 1 22 HIS HE1 H -1.964 -2.665 -5.135 1.00 . A A . 22 HIS HE1 1 1 1 377 1 1 22 HIS N N -2.380 3.189 -1.754 1.00 . A A . 22 HIS N 1 1 1 378 1 1 22 HIS ND1 N -1.560 -0.731 -4.277 1.00 . A A . 22 HIS ND1 1 1 1 379 1 1 22 HIS NE2 N -2.014 -2.441 -3.028 1.00 . A A . 22 HIS NE2 1 1 1 380 1 1 22 HIS O O -4.598 0.537 -2.054 1.00 . A A . 22 HIS O 1 1 1 381 1 1 23 LYS C C -5.657 0.872 0.707 1.00 . A A . 23 LYS C 1 1 1 382 1 1 23 LYS CA C -4.240 0.322 0.703 1.00 . A A . 23 LYS CA 1 1 1 383 1 1 23 LYS CB C -3.666 0.377 2.117 1.00 . A A . 23 LYS CB 1 1 1 384 1 1 23 LYS CD C -2.683 -1.937 2.232 1.00 . A A . 23 LYS CD 1 1 1 385 1 1 23 LYS CE C -1.477 -2.752 2.665 1.00 . A A . 23 LYS CE 1 1 1 386 1 1 23 LYS CG C -2.404 -0.447 2.316 1.00 . A A . 23 LYS CG 1 1 1 387 1 1 23 LYS H H -2.611 1.539 0.127 1.00 . A A . 23 LYS H 1 1 1 388 1 1 23 LYS HA H -4.270 -0.704 0.375 1.00 . A A . 23 LYS HA 1 1 1 389 1 1 23 LYS HB2 H -3.438 1.404 2.357 1.00 . A A . 23 LYS HB2 1 1 1 390 1 1 23 LYS HB3 H -4.415 0.015 2.806 1.00 . A A . 23 LYS HB3 1 1 1 391 1 1 23 LYS HD2 H -3.516 -2.177 2.875 1.00 . A A . 23 LYS HD2 1 1 1 392 1 1 23 LYS HD3 H -2.929 -2.192 1.214 1.00 . A A . 23 LYS HD3 1 1 1 393 1 1 23 LYS HE2 H -0.649 -2.518 2.016 1.00 . A A . 23 LYS HE2 1 1 1 394 1 1 23 LYS HE3 H -1.226 -2.489 3.681 1.00 . A A . 23 LYS HE3 1 1 1 395 1 1 23 LYS HG2 H -1.690 -0.183 1.552 1.00 . A A . 23 LYS HG2 1 1 1 396 1 1 23 LYS HG3 H -1.989 -0.222 3.288 1.00 . A A . 23 LYS HG3 1 1 1 397 1 1 23 LYS HZ1 H -0.941 -4.740 2.986 1.00 . A A . 23 LYS HZ1 1 1 1 398 1 1 23 LYS HZ2 H -1.894 -4.503 1.611 1.00 . A A . 23 LYS HZ2 1 1 1 399 1 1 23 LYS HZ3 H -2.598 -4.446 3.148 1.00 . A A . 23 LYS HZ3 1 1 1 400 1 1 23 LYS N N -3.390 1.057 -0.225 1.00 . A A . 23 LYS N 1 1 1 401 1 1 23 LYS NZ N -1.745 -4.211 2.596 1.00 . A A . 23 LYS NZ 1 1 1 402 1 1 23 LYS O O -6.602 0.149 1.018 1.00 . A A . 23 LYS O 1 1 1 403 1 1 24 ARG C C -7.997 2.067 -0.758 1.00 . A A . 24 ARG C 1 1 1 404 1 1 24 ARG CA C -7.112 2.777 0.269 1.00 . A A . 24 ARG CA 1 1 1 405 1 1 24 ARG CB C -6.947 4.259 -0.080 1.00 . A A . 24 ARG CB 1 1 1 406 1 1 24 ARG CD C -7.984 6.487 -0.528 1.00 . A A . 24 ARG CD 1 1 1 407 1 1 24 ARG CG C -8.251 5.020 -0.242 1.00 . A A . 24 ARG CG 1 1 1 408 1 1 24 ARG CZ C -9.316 8.555 -0.666 1.00 . A A . 24 ARG CZ 1 1 1 409 1 1 24 ARG H H -4.994 2.682 0.139 1.00 . A A . 24 ARG H 1 1 1 410 1 1 24 ARG HA H -7.578 2.696 1.239 1.00 . A A . 24 ARG HA 1 1 1 411 1 1 24 ARG HB2 H -6.378 4.737 0.703 1.00 . A A . 24 ARG HB2 1 1 1 412 1 1 24 ARG HB3 H -6.397 4.335 -1.006 1.00 . A A . 24 ARG HB3 1 1 1 413 1 1 24 ARG HD2 H -7.503 6.926 0.333 1.00 . A A . 24 ARG HD2 1 1 1 414 1 1 24 ARG HD3 H -7.322 6.557 -1.379 1.00 . A A . 24 ARG HD3 1 1 1 415 1 1 24 ARG HE H -9.979 6.729 -1.144 1.00 . A A . 24 ARG HE 1 1 1 416 1 1 24 ARG HG2 H -8.808 4.594 -1.064 1.00 . A A . 24 ARG HG2 1 1 1 417 1 1 24 ARG HG3 H -8.826 4.935 0.670 1.00 . A A . 24 ARG HG3 1 1 1 418 1 1 24 ARG HH11 H -8.377 10.261 -0.101 1.00 . A A . 24 ARG HH11 1 1 1 419 1 1 24 ARG HH12 H -7.426 8.815 0.016 1.00 . A A . 24 ARG HH12 1 1 1 420 1 1 24 ARG HH21 H -10.548 10.150 -0.861 1.00 . A A . 24 ARG HH21 1 1 1 421 1 1 24 ARG HH22 H -11.235 8.616 -1.322 1.00 . A A . 24 ARG HH22 1 1 1 422 1 1 24 ARG N N -5.800 2.145 0.349 1.00 . A A . 24 ARG N 1 1 1 423 1 1 24 ARG NE N -9.205 7.236 -0.816 1.00 . A A . 24 ARG NE 1 1 1 424 1 1 24 ARG NH1 N -8.291 9.267 -0.213 1.00 . A A . 24 ARG NH1 1 1 1 425 1 1 24 ARG NH2 N -10.455 9.157 -0.972 1.00 . A A . 24 ARG NH2 1 1 1 426 1 1 24 ARG O O -9.224 2.133 -0.686 1.00 . A A . 24 ARG O 1 1 1 427 1 1 25 THR C C -8.617 -0.701 -2.153 1.00 . A A . 25 THR C 1 1 1 428 1 1 25 THR CA C -8.103 0.628 -2.712 1.00 . A A . 25 THR CA 1 1 1 429 1 1 25 THR CB C -7.224 0.349 -3.944 1.00 . A A . 25 THR CB 1 1 1 430 1 1 25 THR CG2 C -8.063 0.322 -5.211 1.00 . A A . 25 THR CG2 1 1 1 431 1 1 25 THR H H -6.386 1.345 -1.704 1.00 . A A . 25 THR H 1 1 1 432 1 1 25 THR HA H -8.945 1.230 -3.021 1.00 . A A . 25 THR HA 1 1 1 433 1 1 25 THR HB H -6.751 -0.614 -3.820 1.00 . A A . 25 THR HB 1 1 1 434 1 1 25 THR HG1 H -5.423 1.070 -3.588 1.00 . A A . 25 THR HG1 1 1 1 435 1 1 25 THR HG21 H -8.517 1.290 -5.363 1.00 . A A . 25 THR HG21 1 1 1 436 1 1 25 THR HG22 H -8.834 -0.427 -5.116 1.00 . A A . 25 THR HG22 1 1 1 437 1 1 25 THR HG23 H -7.432 0.084 -6.055 1.00 . A A . 25 THR HG23 1 1 1 438 1 1 25 THR N N -7.368 1.366 -1.696 1.00 . A A . 25 THR N 1 1 1 439 1 1 25 THR O O -9.539 -1.305 -2.705 1.00 . A A . 25 THR O 1 1 1 440 1 1 25 THR OG1 O -6.214 1.359 -4.062 1.00 . A A . 25 THR OG1 1 1 1 441 1 1 26 HIS C C -9.453 -2.065 0.691 1.00 . A A . 26 HIS C 1 1 1 442 1 1 26 HIS CA C -8.444 -2.385 -0.405 1.00 . A A . 26 HIS CA 1 1 1 443 1 1 26 HIS CB C -7.262 -3.144 0.213 1.00 . A A . 26 HIS CB 1 1 1 444 1 1 26 HIS CD2 C -4.936 -3.438 -0.874 1.00 . A A . 26 HIS CD2 1 1 1 445 1 1 26 HIS CE1 C -5.400 -4.963 -2.363 1.00 . A A . 26 HIS CE1 1 1 1 446 1 1 26 HIS CG C -6.264 -3.696 -0.762 1.00 . A A . 26 HIS CG 1 1 1 447 1 1 26 HIS H H -7.268 -0.645 -0.673 1.00 . A A . 26 HIS H 1 1 1 448 1 1 26 HIS HA H -8.918 -3.010 -1.147 1.00 . A A . 26 HIS HA 1 1 1 449 1 1 26 HIS HB2 H -6.729 -2.477 0.872 1.00 . A A . 26 HIS HB2 1 1 1 450 1 1 26 HIS HB3 H -7.647 -3.970 0.794 1.00 . A A . 26 HIS HB3 1 1 1 451 1 1 26 HIS HD1 H -7.429 -5.074 -1.892 1.00 . A A . 26 HIS HD1 1 1 1 452 1 1 26 HIS HD2 H -4.369 -2.736 -0.283 1.00 . A A . 26 HIS HD2 1 1 1 453 1 1 26 HIS HE1 H -5.298 -5.690 -3.154 1.00 . A A . 26 HIS HE1 1 1 1 454 1 1 26 HIS N N -8.012 -1.156 -1.060 1.00 . A A . 26 HIS N 1 1 1 455 1 1 26 HIS ND1 N -6.548 -4.666 -1.721 1.00 . A A . 26 HIS ND1 1 1 1 456 1 1 26 HIS NE2 N -4.424 -4.240 -1.874 1.00 . A A . 26 HIS NE2 1 1 1 457 1 1 26 HIS O O -10.481 -2.728 0.821 1.00 . A A . 26 HIS O 1 1 1 458 1 1 27 THR C C -9.832 0.835 2.889 1.00 . A A . 27 THR C 1 1 1 459 1 1 27 THR CA C -9.994 -0.655 2.590 1.00 . A A . 27 THR CA 1 1 1 460 1 1 27 THR CB C -9.669 -1.486 3.853 1.00 . A A . 27 THR CB 1 1 1 461 1 1 27 THR CG2 C -8.250 -1.221 4.337 1.00 . A A . 27 THR CG2 1 1 1 462 1 1 27 THR H H -8.338 -0.517 1.293 1.00 . A A . 27 THR H 1 1 1 463 1 1 27 THR HA H -11.019 -0.847 2.311 1.00 . A A . 27 THR HA 1 1 1 464 1 1 27 THR HB H -9.754 -2.535 3.603 1.00 . A A . 27 THR HB 1 1 1 465 1 1 27 THR HG1 H -11.076 -1.987 5.144 1.00 . A A . 27 THR HG1 1 1 1 466 1 1 27 THR HG21 H -7.547 -1.503 3.567 1.00 . A A . 27 THR HG21 1 1 1 467 1 1 27 THR HG22 H -8.060 -1.799 5.229 1.00 . A A . 27 THR HG22 1 1 1 468 1 1 27 THR HG23 H -8.138 -0.170 4.558 1.00 . A A . 27 THR HG23 1 1 1 469 1 1 27 THR N N -9.151 -1.039 1.475 1.00 . A A . 27 THR N 1 1 1 470 1 1 27 THR O O -8.827 1.445 2.519 1.00 . A A . 27 THR O 1 1 1 471 1 1 27 THR OG1 O -10.596 -1.186 4.902 1.00 . A A . 27 THR OG1 1 1 1 472 1 1 28 GLY C C -11.719 3.604 2.928 1.00 . A A . 28 GLY C 1 1 1 473 1 1 28 GLY CA C -10.794 2.832 3.836 1.00 . A A . 28 GLY CA 1 1 1 474 1 1 28 GLY H H -11.586 0.870 3.844 1.00 . A A . 28 GLY H 1 1 1 475 1 1 28 GLY HA2 H -11.094 2.990 4.861 1.00 . A A . 28 GLY HA2 1 1 1 476 1 1 28 GLY HA3 H -9.788 3.197 3.702 1.00 . A A . 28 GLY HA3 1 1 1 477 1 1 28 GLY N N -10.824 1.414 3.546 1.00 . A A . 28 GLY N 1 1 1 478 1 1 28 GLY O O -12.186 4.690 3.271 1.00 . A A . 28 GLY O 1 1 1 479 1 1 29 GLU C C -13.661 2.529 0.083 1.00 . A A . 29 GLU C 1 1 1 480 1 1 29 GLU CA C -12.901 3.625 0.813 1.00 . A A . 29 GLU CA 1 1 1 481 1 1 29 GLU CB C -12.149 4.502 -0.187 1.00 . A A . 29 GLU CB 1 1 1 482 1 1 29 GLU CD C -12.348 6.234 -2.012 1.00 . A A . 29 GLU CD 1 1 1 483 1 1 29 GLU CG C -13.063 5.190 -1.187 1.00 . A A . 29 GLU CG 1 1 1 484 1 1 29 GLU H H -11.538 2.195 1.535 1.00 . A A . 29 GLU H 1 1 1 485 1 1 29 GLU HA H -13.605 4.233 1.363 1.00 . A A . 29 GLU HA 1 1 1 486 1 1 29 GLU HB2 H -11.601 5.259 0.354 1.00 . A A . 29 GLU HB2 1 1 1 487 1 1 29 GLU HB3 H -11.452 3.887 -0.735 1.00 . A A . 29 GLU HB3 1 1 1 488 1 1 29 GLU HG2 H -13.467 4.444 -1.855 1.00 . A A . 29 GLU HG2 1 1 1 489 1 1 29 GLU HG3 H -13.871 5.666 -0.651 1.00 . A A . 29 GLU HG3 1 1 1 490 1 1 29 GLU N N -11.981 3.037 1.764 1.00 . A A . 29 GLU N 1 1 1 491 1 1 29 GLU O O -13.068 1.551 -0.374 1.00 . A A . 29 GLU O 1 1 1 492 1 1 29 GLU OE1 O -12.295 7.402 -1.575 1.00 . A A . 29 GLU OE1 1 1 1 493 1 1 29 GLU OE2 O -11.842 5.902 -3.100 1.00 . A A . 29 GLU OE2 1 1 1 494 1 1 30 LYS C C -16.507 2.423 -1.864 1.00 . A A . 30 LYS C 1 1 1 495 1 1 30 LYS CA C -15.805 1.732 -0.704 1.00 . A A . 30 LYS CA 1 1 1 496 1 1 30 LYS CB C -16.828 1.107 0.252 1.00 . A A . 30 LYS CB 1 1 1 497 1 1 30 LYS CD C -17.257 -0.313 2.281 1.00 . A A . 30 LYS CD 1 1 1 498 1 1 30 LYS CE C -16.633 -1.107 3.419 1.00 . A A . 30 LYS CE 1 1 1 499 1 1 30 LYS CG C -16.199 0.316 1.391 1.00 . A A . 30 LYS CG 1 1 1 500 1 1 30 LYS H H -15.386 3.473 0.407 1.00 . A A . 30 LYS H 1 1 1 501 1 1 30 LYS HA H -15.164 0.954 -1.095 1.00 . A A . 30 LYS HA 1 1 1 502 1 1 30 LYS HB2 H -17.428 1.896 0.681 1.00 . A A . 30 LYS HB2 1 1 1 503 1 1 30 LYS HB3 H -17.469 0.444 -0.307 1.00 . A A . 30 LYS HB3 1 1 1 504 1 1 30 LYS HD2 H -17.872 0.469 2.699 1.00 . A A . 30 LYS HD2 1 1 1 505 1 1 30 LYS HD3 H -17.868 -0.974 1.686 1.00 . A A . 30 LYS HD3 1 1 1 506 1 1 30 LYS HE2 H -17.420 -1.606 3.965 1.00 . A A . 30 LYS HE2 1 1 1 507 1 1 30 LYS HE3 H -15.966 -1.846 3.000 1.00 . A A . 30 LYS HE3 1 1 1 508 1 1 30 LYS HG2 H -15.582 -0.466 0.974 1.00 . A A . 30 LYS HG2 1 1 1 509 1 1 30 LYS HG3 H -15.588 0.982 1.985 1.00 . A A . 30 LYS HG3 1 1 1 510 1 1 30 LYS HZ1 H -16.495 0.471 4.780 1.00 . A A . 30 LYS HZ1 1 1 1 511 1 1 30 LYS HZ2 H -15.100 0.248 3.856 1.00 . A A . 30 LYS HZ2 1 1 1 512 1 1 30 LYS HZ3 H -15.455 -0.817 5.120 1.00 . A A . 30 LYS HZ3 1 1 1 513 1 1 30 LYS N N -14.970 2.684 -0.003 1.00 . A A . 30 LYS N 1 1 1 514 1 1 30 LYS NZ N -15.870 -0.241 4.359 1.00 . A A . 30 LYS NZ 1 1 1 515 1 1 30 LYS O O -16.086 2.311 -3.014 1.00 . A A . 30 LYS O 1 1 1 516 1 1 31 NH2 HN1 H -17.841 3.204 -0.622 1.00 . A A . 31 NH2 HN1 1 1 1 517 1 1 31 NH2 HN2 H -18.023 3.625 -2.287 1.00 . A A . 31 NH2 HN2 1 1 1 518 1 1 31 NH2 N N -17.561 3.157 -1.561 1.00 . A A . 31 NH2 N 1 1 1 519 2 2 1 ZN ZN ZN -2.504 -4.275 -2.442 1.00 . B A . 101 ZN ZN 1 1 2 520 1 1 1 ARG C C 11.521 -0.845 3.036 1.00 . A A . 1 ARG C 1 1 2 521 1 1 1 ARG CA C 12.569 -1.136 4.107 1.00 . A A . 1 ARG CA 1 1 2 522 1 1 1 ARG CB C 11.902 -1.194 5.490 1.00 . A A . 1 ARG CB 1 1 2 523 1 1 1 ARG CD C 10.412 -0.049 7.170 1.00 . A A . 1 ARG CD 1 1 2 524 1 1 1 ARG CG C 11.292 0.127 5.941 1.00 . A A . 1 ARG CG 1 1 2 525 1 1 1 ARG CZ C 8.087 -0.844 7.448 1.00 . A A . 1 ARG CZ 1 1 2 526 1 1 1 ARG H1 H 13.224 0.834 4.228 1.00 . A A . 1 ARG H1 1 1 2 527 1 1 1 ARG H2 H 14.114 -0.123 3.160 1.00 . A A . 1 ARG H2 1 1 2 528 1 1 1 ARG H3 H 14.330 -0.297 4.826 1.00 . A A . 1 ARG H3 1 1 2 529 1 1 1 ARG HA H 13.025 -2.092 3.895 1.00 . A A . 1 ARG HA 1 1 2 530 1 1 1 ARG HB2 H 11.119 -1.936 5.466 1.00 . A A . 1 ARG HB2 1 1 2 531 1 1 1 ARG HB3 H 12.642 -1.490 6.220 1.00 . A A . 1 ARG HB3 1 1 2 532 1 1 1 ARG HD2 H 11.013 -0.447 7.975 1.00 . A A . 1 ARG HD2 1 1 2 533 1 1 1 ARG HD3 H 10.019 0.913 7.458 1.00 . A A . 1 ARG HD3 1 1 2 534 1 1 1 ARG HE H 9.469 -1.714 6.300 1.00 . A A . 1 ARG HE 1 1 2 535 1 1 1 ARG HG2 H 12.088 0.816 6.178 1.00 . A A . 1 ARG HG2 1 1 2 536 1 1 1 ARG HG3 H 10.695 0.529 5.134 1.00 . A A . 1 ARG HG3 1 1 2 537 1 1 1 ARG HH11 H 6.896 0.238 8.683 1.00 . A A . 1 ARG HH11 1 1 2 538 1 1 1 ARG HH12 H 8.522 0.824 8.518 1.00 . A A . 1 ARG HH12 1 1 2 539 1 1 1 ARG HH21 H 7.346 -2.483 6.513 1.00 . A A . 1 ARG HH21 1 1 2 540 1 1 1 ARG HH22 H 6.230 -1.648 7.545 1.00 . A A . 1 ARG HH22 1 1 2 541 1 1 1 ARG N N 13.631 -0.110 4.080 1.00 . A A . 1 ARG N 1 1 2 542 1 1 1 ARG NE N 9.299 -0.961 6.911 1.00 . A A . 1 ARG NE 1 1 2 543 1 1 1 ARG NH1 N 7.813 0.153 8.282 1.00 . A A . 1 ARG NH1 1 1 2 544 1 1 1 ARG NH2 N 7.145 -1.726 7.143 1.00 . A A . 1 ARG NH2 1 1 2 545 1 1 1 ARG O O 11.004 0.269 2.951 1.00 . A A . 1 ARG O 1 1 2 546 1 1 2 PRO C C 8.777 -1.762 1.730 1.00 . A A . 2 PRO C 1 1 2 547 1 1 2 PRO CA C 10.185 -1.676 1.160 1.00 . A A . 2 PRO CA 1 1 2 548 1 1 2 PRO CB C 10.455 -2.841 0.212 1.00 . A A . 2 PRO CB 1 1 2 549 1 1 2 PRO CD C 11.805 -3.186 2.170 1.00 . A A . 2 PRO CD 1 1 2 550 1 1 2 PRO CG C 11.049 -3.901 1.073 1.00 . A A . 2 PRO CG 1 1 2 551 1 1 2 PRO HA H 10.303 -0.740 0.633 1.00 . A A . 2 PRO HA 1 1 2 552 1 1 2 PRO HB2 H 9.525 -3.165 -0.235 1.00 . A A . 2 PRO HB2 1 1 2 553 1 1 2 PRO HB3 H 11.144 -2.528 -0.561 1.00 . A A . 2 PRO HB3 1 1 2 554 1 1 2 PRO HD2 H 11.657 -3.688 3.115 1.00 . A A . 2 PRO HD2 1 1 2 555 1 1 2 PRO HD3 H 12.857 -3.133 1.932 1.00 . A A . 2 PRO HD3 1 1 2 556 1 1 2 PRO HG2 H 10.264 -4.510 1.495 1.00 . A A . 2 PRO HG2 1 1 2 557 1 1 2 PRO HG3 H 11.724 -4.511 0.489 1.00 . A A . 2 PRO HG3 1 1 2 558 1 1 2 PRO N N 11.201 -1.838 2.192 1.00 . A A . 2 PRO N 1 1 2 559 1 1 2 PRO O O 8.461 -2.662 2.513 1.00 . A A . 2 PRO O 1 1 2 560 1 1 3 PHE C C 5.700 -1.687 0.947 1.00 . A A . 3 PHE C 1 1 2 561 1 1 3 PHE CA C 6.565 -0.777 1.805 1.00 . A A . 3 PHE CA 1 1 2 562 1 1 3 PHE CB C 6.049 0.663 1.766 1.00 . A A . 3 PHE CB 1 1 2 563 1 1 3 PHE CD1 C 7.800 2.406 2.163 1.00 . A A . 3 PHE CD1 1 1 2 564 1 1 3 PHE CD2 C 6.523 1.644 4.025 1.00 . A A . 3 PHE CD2 1 1 2 565 1 1 3 PHE CE1 C 8.500 3.262 2.989 1.00 . A A . 3 PHE CE1 1 1 2 566 1 1 3 PHE CE2 C 7.220 2.497 4.857 1.00 . A A . 3 PHE CE2 1 1 2 567 1 1 3 PHE CG C 6.806 1.589 2.670 1.00 . A A . 3 PHE CG 1 1 2 568 1 1 3 PHE CZ C 8.207 3.299 4.348 1.00 . A A . 3 PHE CZ 1 1 2 569 1 1 3 PHE H H 8.242 -0.153 0.684 1.00 . A A . 3 PHE H 1 1 2 570 1 1 3 PHE HA H 6.550 -1.134 2.823 1.00 . A A . 3 PHE HA 1 1 2 571 1 1 3 PHE HB2 H 6.130 1.042 0.759 1.00 . A A . 3 PHE HB2 1 1 2 572 1 1 3 PHE HB3 H 5.015 0.678 2.067 1.00 . A A . 3 PHE HB3 1 1 2 573 1 1 3 PHE HD1 H 8.028 2.368 1.109 1.00 . A A . 3 PHE HD1 1 1 2 574 1 1 3 PHE HD2 H 5.749 1.011 4.432 1.00 . A A . 3 PHE HD2 1 1 2 575 1 1 3 PHE HE1 H 9.275 3.891 2.580 1.00 . A A . 3 PHE HE1 1 1 2 576 1 1 3 PHE HE2 H 6.991 2.530 5.911 1.00 . A A . 3 PHE HE2 1 1 2 577 1 1 3 PHE HZ H 8.752 3.964 5.002 1.00 . A A . 3 PHE HZ 1 1 2 578 1 1 3 PHE N N 7.937 -0.826 1.332 1.00 . A A . 3 PHE N 1 1 2 579 1 1 3 PHE O O 5.200 -1.281 -0.100 1.00 . A A . 3 PHE O 1 1 2 580 1 1 4 NLE C C 3.440 -4.153 1.047 1.00 . A A . 4 NLE C 1 1 2 581 1 1 4 NLE CA C 4.876 -3.937 0.589 1.00 . A A . 4 NLE CA 1 1 2 582 1 1 4 NLE CB C 5.649 -5.256 0.665 1.00 . A A . 4 NLE CB 1 1 2 583 1 1 4 NLE CD C 5.847 -7.652 -0.070 1.00 . A A . 4 NLE CD 1 1 2 584 1 1 4 NLE CE C 5.220 -8.725 -0.929 1.00 . A A . 4 NLE CE 1 1 2 585 1 1 4 NLE CG C 5.062 -6.360 -0.202 1.00 . A A . 4 NLE CG 1 1 2 586 1 1 4 NLE H H 5.880 -3.157 2.277 1.00 . A A . 4 NLE H 1 1 2 587 1 1 4 NLE HA H 4.865 -3.595 -0.435 1.00 . A A . 4 NLE HA 1 1 2 588 1 1 4 NLE HB2 H 5.652 -5.598 1.688 1.00 . A A . 4 NLE HB2 1 1 2 589 1 1 4 NLE HB3 H 6.669 -5.085 0.350 1.00 . A A . 4 NLE HB3 1 1 2 590 1 1 4 NLE HD2 H 5.838 -7.978 0.959 1.00 . A A . 4 NLE HD2 1 1 2 591 1 1 4 NLE HD3 H 6.863 -7.491 -0.402 1.00 . A A . 4 NLE HD3 1 1 2 592 1 1 4 NLE HE1 H 5.226 -8.410 -1.961 1.00 . A A . 4 NLE HE1 1 1 2 593 1 1 4 NLE HE2 H 4.202 -8.893 -0.610 1.00 . A A . 4 NLE HE2 1 1 2 594 1 1 4 NLE HE3 H 5.783 -9.640 -0.829 1.00 . A A . 4 NLE HE3 1 1 2 595 1 1 4 NLE HG2 H 5.083 -6.042 -1.234 1.00 . A A . 4 NLE HG2 1 1 2 596 1 1 4 NLE HG3 H 4.041 -6.538 0.101 1.00 . A A . 4 NLE HG3 1 1 2 597 1 1 4 NLE N N 5.546 -2.923 1.387 1.00 . A A . 4 NLE N 1 1 2 598 1 1 4 NLE O O 3.156 -4.217 2.244 1.00 . A A . 4 NLE O 1 1 2 599 1 1 5 CYS C C 1.023 -6.058 0.709 1.00 . A A . 5 CYS C 1 1 2 600 1 1 5 CYS CA C 1.155 -4.585 0.345 1.00 . A A . 5 CYS CA 1 1 2 601 1 1 5 CYS CB C 0.295 -4.266 -0.879 1.00 . A A . 5 CYS CB 1 1 2 602 1 1 5 CYS H H 2.825 -4.096 -0.849 1.00 . A A . 5 CYS H 1 1 2 603 1 1 5 CYS HA H 0.821 -3.985 1.178 1.00 . A A . 5 CYS HA 1 1 2 604 1 1 5 CYS HB2 H 0.228 -3.193 -0.994 1.00 . A A . 5 CYS HB2 1 1 2 605 1 1 5 CYS HB3 H 0.761 -4.687 -1.753 1.00 . A A . 5 CYS HB3 1 1 2 606 1 1 5 CYS N N 2.542 -4.255 0.079 1.00 . A A . 5 CYS N 1 1 2 607 1 1 5 CYS O O 1.646 -6.921 0.087 1.00 . A A . 5 CYS O 1 1 2 608 1 1 5 CYS SG S -1.392 -4.910 -0.790 1.00 . A A . 5 CYS SG 1 1 2 609 1 1 6 THR C C -1.480 -8.078 2.019 1.00 . A A . 6 THR C 1 1 2 610 1 1 6 THR CA C -0.011 -7.701 2.158 1.00 . A A . 6 THR CA 1 1 2 611 1 1 6 THR CB C 0.440 -7.891 3.617 1.00 . A A . 6 THR CB 1 1 2 612 1 1 6 THR CG2 C 1.954 -8.000 3.706 1.00 . A A . 6 THR CG2 1 1 2 613 1 1 6 THR H H -0.237 -5.606 2.184 1.00 . A A . 6 THR H 1 1 2 614 1 1 6 THR HA H 0.578 -8.356 1.534 1.00 . A A . 6 THR HA 1 1 2 615 1 1 6 THR HB H 0.004 -8.804 3.995 1.00 . A A . 6 THR HB 1 1 2 616 1 1 6 THR HG1 H 0.075 -7.014 5.348 1.00 . A A . 6 THR HG1 1 1 2 617 1 1 6 THR HG21 H 2.288 -8.859 3.141 1.00 . A A . 6 THR HG21 1 1 2 618 1 1 6 THR HG22 H 2.247 -8.115 4.740 1.00 . A A . 6 THR HG22 1 1 2 619 1 1 6 THR HG23 H 2.404 -7.106 3.301 1.00 . A A . 6 THR HG23 1 1 2 620 1 1 6 THR N N 0.219 -6.339 1.718 1.00 . A A . 6 THR N 1 1 2 621 1 1 6 THR O O -1.973 -8.974 2.705 1.00 . A A . 6 THR O 1 1 2 622 1 1 6 THR OG1 O -0.017 -6.789 4.414 1.00 . A A . 6 THR OG1 1 1 2 623 1 1 7 TRP C C -3.732 -8.790 -0.114 1.00 . A A . 7 TRP C 1 1 2 624 1 1 7 TRP CA C -3.585 -7.666 0.903 1.00 . A A . 7 TRP CA 1 1 2 625 1 1 7 TRP CB C -4.296 -6.406 0.417 1.00 . A A . 7 TRP CB 1 1 2 626 1 1 7 TRP CD1 C -6.772 -7.050 0.262 1.00 . A A . 7 TRP CD1 1 1 2 627 1 1 7 TRP CD2 C -6.312 -5.504 1.810 1.00 . A A . 7 TRP CD2 1 1 2 628 1 1 7 TRP CE2 C -7.694 -5.761 1.834 1.00 . A A . 7 TRP CE2 1 1 2 629 1 1 7 TRP CE3 C -5.785 -4.563 2.696 1.00 . A A . 7 TRP CE3 1 1 2 630 1 1 7 TRP CG C -5.741 -6.342 0.803 1.00 . A A . 7 TRP CG 1 1 2 631 1 1 7 TRP CH2 C -8.014 -4.192 3.568 1.00 . A A . 7 TRP CH2 1 1 2 632 1 1 7 TRP CZ2 C -8.558 -5.109 2.710 1.00 . A A . 7 TRP CZ2 1 1 2 633 1 1 7 TRP CZ3 C -6.640 -3.916 3.565 1.00 . A A . 7 TRP CZ3 1 1 2 634 1 1 7 TRP H H -1.733 -6.706 0.587 1.00 . A A . 7 TRP H 1 1 2 635 1 1 7 TRP HA H -4.017 -7.978 1.841 1.00 . A A . 7 TRP HA 1 1 2 636 1 1 7 TRP HB2 H -3.805 -5.541 0.833 1.00 . A A . 7 TRP HB2 1 1 2 637 1 1 7 TRP HB3 H -4.235 -6.360 -0.659 1.00 . A A . 7 TRP HB3 1 1 2 638 1 1 7 TRP HD1 H -6.661 -7.773 -0.532 1.00 . A A . 7 TRP HD1 1 1 2 639 1 1 7 TRP HE1 H -8.835 -7.083 0.671 1.00 . A A . 7 TRP HE1 1 1 2 640 1 1 7 TRP HE3 H -4.727 -4.340 2.706 1.00 . A A . 7 TRP HE3 1 1 2 641 1 1 7 TRP HH2 H -8.646 -3.661 4.264 1.00 . A A . 7 TRP HH2 1 1 2 642 1 1 7 TRP HZ2 H -9.619 -5.312 2.725 1.00 . A A . 7 TRP HZ2 1 1 2 643 1 1 7 TRP HZ3 H -6.250 -3.185 4.258 1.00 . A A . 7 TRP HZ3 1 1 2 644 1 1 7 TRP N N -2.178 -7.397 1.123 1.00 . A A . 7 TRP N 1 1 2 645 1 1 7 TRP NE1 N -7.951 -6.709 0.880 1.00 . A A . 7 TRP NE1 1 1 2 646 1 1 7 TRP O O -4.009 -8.558 -1.295 1.00 . A A . 7 TRP O 1 1 2 647 1 1 8 ORN C C -2.123 -10.897 -3.912 1.00 . A A . 8 ORN C 1 1 2 648 1 1 8 ORN CA C -2.944 -12.070 -3.394 1.00 . A A . 8 ORN CA 1 1 2 649 1 1 8 ORN CB C -2.311 -12.636 -2.119 1.00 . A A . 8 ORN CB 1 1 2 650 1 1 8 ORN CD C -3.579 -11.199 -0.492 1.00 . A A . 8 ORN CD 1 1 2 651 1 1 8 ORN CG C -2.206 -11.626 -0.990 1.00 . A A . 8 ORN CG 1 1 2 652 1 1 8 ORN H H -2.086 -13.465 -4.668 1.00 . A A . 8 ORN H 1 1 2 653 1 1 8 ORN HA H -3.942 -11.724 -3.174 1.00 . A A . 8 ORN HA 1 1 2 654 1 1 8 ORN HB2 H -1.318 -12.991 -2.349 1.00 . A A . 8 ORN HB2 1 1 2 655 1 1 8 ORN HB3 H -2.909 -13.465 -1.772 1.00 . A A . 8 ORN HB3 1 1 2 656 1 1 8 ORN HD2 H -4.008 -12.004 0.086 1.00 . A A . 8 ORN HD2 1 1 2 657 1 1 8 ORN HD3 H -4.210 -10.991 -1.341 1.00 . A A . 8 ORN HD3 1 1 2 658 1 1 8 ORN HE1 H -3.243 -10.123 1.281 1.00 . A A . 8 ORN HE1 1 1 2 659 1 1 8 ORN HG2 H -1.676 -10.756 -1.349 1.00 . A A . 8 ORN HG2 1 1 2 660 1 1 8 ORN HG3 H -1.658 -12.071 -0.172 1.00 . A A . 8 ORN HG3 1 1 2 661 1 1 8 ORN N N -3.034 -13.119 -4.430 1.00 . A A . 8 ORN N 1 1 2 662 1 1 8 ORN NE N -3.497 -10.009 0.339 1.00 . A A . 8 ORN NE 1 1 2 663 1 1 8 ORN O O -1.150 -11.086 -4.640 1.00 . A A . 8 ORN O 1 1 2 664 1 1 9 CYS C C -0.640 -8.183 -3.099 1.00 . A A . 9 CYS C 1 1 2 665 1 1 9 CYS CA C -1.844 -8.485 -3.988 1.00 . A A . 9 CYS CA 1 1 2 666 1 1 9 CYS CB C -2.830 -7.320 -3.979 1.00 . A A . 9 CYS CB 1 1 2 667 1 1 9 CYS H H -3.278 -9.601 -2.914 1.00 . A A . 9 CYS H 1 1 2 668 1 1 9 CYS HA H -1.504 -8.653 -4.998 1.00 . A A . 9 CYS HA 1 1 2 669 1 1 9 CYS HB2 H -3.616 -7.517 -4.693 1.00 . A A . 9 CYS HB2 1 1 2 670 1 1 9 CYS HB3 H -3.263 -7.237 -2.992 1.00 . A A . 9 CYS HB3 1 1 2 671 1 1 9 CYS N N -2.517 -9.688 -3.534 1.00 . A A . 9 CYS N 1 1 2 672 1 1 9 CYS O O -0.737 -8.245 -1.872 1.00 . A A . 9 CYS O 1 1 2 673 1 1 9 CYS SG S -2.110 -5.723 -4.393 1.00 . A A . 9 CYS SG 1 1 2 674 1 1 10 GLY C C 2.660 -6.689 -3.697 1.00 . A A . 10 GLY C 1 1 2 675 1 1 10 GLY CA C 1.701 -7.606 -2.966 1.00 . A A . 10 GLY CA 1 1 2 676 1 1 10 GLY H H 0.506 -7.813 -4.696 1.00 . A A . 10 GLY H 1 1 2 677 1 1 10 GLY HA2 H 1.434 -7.153 -2.024 1.00 . A A . 10 GLY HA2 1 1 2 678 1 1 10 GLY HA3 H 2.195 -8.546 -2.775 1.00 . A A . 10 GLY HA3 1 1 2 679 1 1 10 GLY N N 0.491 -7.866 -3.718 1.00 . A A . 10 GLY N 1 1 2 680 1 1 10 GLY O O 3.791 -7.071 -3.991 1.00 . A A . 10 GLY O 1 1 2 681 1 1 11 LYS C C 3.931 -3.780 -3.639 1.00 . A A . 11 LYS C 1 1 2 682 1 1 11 LYS CA C 3.051 -4.491 -4.661 1.00 . A A . 11 LYS CA 1 1 2 683 1 1 11 LYS CB C 2.181 -3.482 -5.411 1.00 . A A . 11 LYS CB 1 1 2 684 1 1 11 LYS CD C 0.494 -3.073 -7.221 1.00 . A A . 11 LYS CD 1 1 2 685 1 1 11 LYS CE C -0.334 -3.691 -8.338 1.00 . A A . 11 LYS CE 1 1 2 686 1 1 11 LYS CG C 1.361 -4.107 -6.527 1.00 . A A . 11 LYS CG 1 1 2 687 1 1 11 LYS H H 1.283 -5.251 -3.781 1.00 . A A . 11 LYS H 1 1 2 688 1 1 11 LYS HA H 3.684 -5.007 -5.367 1.00 . A A . 11 LYS HA 1 1 2 689 1 1 11 LYS HB2 H 1.501 -3.018 -4.710 1.00 . A A . 11 LYS HB2 1 1 2 690 1 1 11 LYS HB3 H 2.816 -2.721 -5.841 1.00 . A A . 11 LYS HB3 1 1 2 691 1 1 11 LYS HD2 H -0.169 -2.631 -6.496 1.00 . A A . 11 LYS HD2 1 1 2 692 1 1 11 LYS HD3 H 1.132 -2.308 -7.639 1.00 . A A . 11 LYS HD3 1 1 2 693 1 1 11 LYS HE2 H -0.924 -4.497 -7.928 1.00 . A A . 11 LYS HE2 1 1 2 694 1 1 11 LYS HE3 H -0.991 -2.935 -8.743 1.00 . A A . 11 LYS HE3 1 1 2 695 1 1 11 LYS HG2 H 2.031 -4.545 -7.251 1.00 . A A . 11 LYS HG2 1 1 2 696 1 1 11 LYS HG3 H 0.726 -4.874 -6.109 1.00 . A A . 11 LYS HG3 1 1 2 697 1 1 11 LYS HZ1 H -0.073 -4.559 -10.220 1.00 . A A . 11 LYS HZ1 1 1 2 698 1 1 11 LYS HZ2 H 1.097 -5.018 -9.086 1.00 . A A . 11 LYS HZ2 1 1 2 699 1 1 11 LYS HZ3 H 1.156 -3.478 -9.784 1.00 . A A . 11 LYS HZ3 1 1 2 700 1 1 11 LYS N N 2.207 -5.483 -4.002 1.00 . A A . 11 LYS N 1 1 2 701 1 1 11 LYS NZ N 0.520 -4.224 -9.432 1.00 . A A . 11 LYS NZ 1 1 2 702 1 1 11 LYS O O 3.538 -3.616 -2.485 1.00 . A A . 11 LYS O 1 1 2 703 1 1 12 ARG C C 6.214 -1.245 -3.514 1.00 . A A . 12 ARG C 1 1 2 704 1 1 12 ARG CA C 6.056 -2.714 -3.155 1.00 . A A . 12 ARG CA 1 1 2 705 1 1 12 ARG CB C 7.418 -3.412 -3.188 1.00 . A A . 12 ARG CB 1 1 2 706 1 1 12 ARG CD C 8.725 -5.527 -2.803 1.00 . A A . 12 ARG CD 1 1 2 707 1 1 12 ARG CG C 7.363 -4.857 -2.730 1.00 . A A . 12 ARG CG 1 1 2 708 1 1 12 ARG CZ C 9.557 -7.499 -1.568 1.00 . A A . 12 ARG CZ 1 1 2 709 1 1 12 ARG H H 5.377 -3.512 -4.994 1.00 . A A . 12 ARG H 1 1 2 710 1 1 12 ARG HA H 5.651 -2.783 -2.157 1.00 . A A . 12 ARG HA 1 1 2 711 1 1 12 ARG HB2 H 7.797 -3.389 -4.198 1.00 . A A . 12 ARG HB2 1 1 2 712 1 1 12 ARG HB3 H 8.101 -2.878 -2.544 1.00 . A A . 12 ARG HB3 1 1 2 713 1 1 12 ARG HD2 H 9.080 -5.489 -3.822 1.00 . A A . 12 ARG HD2 1 1 2 714 1 1 12 ARG HD3 H 9.410 -4.992 -2.162 1.00 . A A . 12 ARG HD3 1 1 2 715 1 1 12 ARG HE H 7.899 -7.456 -2.692 1.00 . A A . 12 ARG HE 1 1 2 716 1 1 12 ARG HG2 H 7.016 -4.886 -1.708 1.00 . A A . 12 ARG HG2 1 1 2 717 1 1 12 ARG HG3 H 6.671 -5.396 -3.360 1.00 . A A . 12 ARG HG3 1 1 2 718 1 1 12 ARG HH11 H 10.763 -5.873 -1.451 1.00 . A A . 12 ARG HH11 1 1 2 719 1 1 12 ARG HH12 H 11.299 -7.255 -0.552 1.00 . A A . 12 ARG HH12 1 1 2 720 1 1 12 ARG HH21 H 10.063 -9.197 -0.587 1.00 . A A . 12 ARG HH21 1 1 2 721 1 1 12 ARG HH22 H 8.602 -9.288 -1.516 1.00 . A A . 12 ARG HH22 1 1 2 722 1 1 12 ARG N N 5.122 -3.374 -4.057 1.00 . A A . 12 ARG N 1 1 2 723 1 1 12 ARG NE N 8.662 -6.923 -2.372 1.00 . A A . 12 ARG NE 1 1 2 724 1 1 12 ARG NH1 N 10.623 -6.820 -1.159 1.00 . A A . 12 ARG NH1 1 1 2 725 1 1 12 ARG NH2 N 9.395 -8.761 -1.193 1.00 . A A . 12 ARG NH2 1 1 2 726 1 1 12 ARG O O 6.240 -0.882 -4.689 1.00 . A A . 12 ARG O 1 1 2 727 1 1 13 PHE C C 7.626 1.538 -1.854 1.00 . A A . 13 PHE C 1 1 2 728 1 1 13 PHE CA C 6.445 1.026 -2.668 1.00 . A A . 13 PHE CA 1 1 2 729 1 1 13 PHE CB C 5.161 1.728 -2.218 1.00 . A A . 13 PHE CB 1 1 2 730 1 1 13 PHE CD1 C 3.502 1.837 -4.094 1.00 . A A . 13 PHE CD1 1 1 2 731 1 1 13 PHE CD2 C 3.220 0.157 -2.426 1.00 . A A . 13 PHE CD2 1 1 2 732 1 1 13 PHE CE1 C 2.379 1.375 -4.750 1.00 . A A . 13 PHE CE1 1 1 2 733 1 1 13 PHE CE2 C 2.098 -0.308 -3.076 1.00 . A A . 13 PHE CE2 1 1 2 734 1 1 13 PHE CG C 3.934 1.234 -2.926 1.00 . A A . 13 PHE CG 1 1 2 735 1 1 13 PHE CZ C 1.677 0.302 -4.241 1.00 . A A . 13 PHE CZ 1 1 2 736 1 1 13 PHE H H 6.267 -0.769 -1.577 1.00 . A A . 13 PHE H 1 1 2 737 1 1 13 PHE HA H 6.613 1.225 -3.714 1.00 . A A . 13 PHE HA 1 1 2 738 1 1 13 PHE HB2 H 5.021 1.564 -1.159 1.00 . A A . 13 PHE HB2 1 1 2 739 1 1 13 PHE HB3 H 5.252 2.787 -2.407 1.00 . A A . 13 PHE HB3 1 1 2 740 1 1 13 PHE HD1 H 4.052 2.676 -4.492 1.00 . A A . 13 PHE HD1 1 1 2 741 1 1 13 PHE HD2 H 3.551 -0.321 -1.515 1.00 . A A . 13 PHE HD2 1 1 2 742 1 1 13 PHE HE1 H 2.052 1.852 -5.661 1.00 . A A . 13 PHE HE1 1 1 2 743 1 1 13 PHE HE2 H 1.550 -1.148 -2.674 1.00 . A A . 13 PHE HE2 1 1 2 744 1 1 13 PHE HZ H 0.799 -0.061 -4.753 1.00 . A A . 13 PHE HZ 1 1 2 745 1 1 13 PHE N N 6.307 -0.410 -2.492 1.00 . A A . 13 PHE N 1 1 2 746 1 1 13 PHE O O 7.998 0.938 -0.846 1.00 . A A . 13 PHE O 1 1 2 747 1 1 14 THR C C 8.828 4.337 -0.624 1.00 . A A . 14 THR C 1 1 2 748 1 1 14 THR CA C 9.323 3.240 -1.559 1.00 . A A . 14 THR CA 1 1 2 749 1 1 14 THR CB C 10.367 3.824 -2.523 1.00 . A A . 14 THR CB 1 1 2 750 1 1 14 THR CG2 C 11.406 2.777 -2.904 1.00 . A A . 14 THR CG2 1 1 2 751 1 1 14 THR H H 7.920 3.045 -3.134 1.00 . A A . 14 THR H 1 1 2 752 1 1 14 THR HA H 9.796 2.469 -0.970 1.00 . A A . 14 THR HA 1 1 2 753 1 1 14 THR HB H 10.867 4.644 -2.029 1.00 . A A . 14 THR HB 1 1 2 754 1 1 14 THR HG1 H 9.656 3.614 -4.355 1.00 . A A . 14 THR HG1 1 1 2 755 1 1 14 THR HG21 H 10.914 1.933 -3.365 1.00 . A A . 14 THR HG21 1 1 2 756 1 1 14 THR HG22 H 11.930 2.449 -2.019 1.00 . A A . 14 THR HG22 1 1 2 757 1 1 14 THR HG23 H 12.111 3.205 -3.600 1.00 . A A . 14 THR HG23 1 1 2 758 1 1 14 THR N N 8.219 2.635 -2.291 1.00 . A A . 14 THR N 1 1 2 759 1 1 14 THR O O 9.610 4.950 0.105 1.00 . A A . 14 THR O 1 1 2 760 1 1 14 THR OG1 O 9.716 4.322 -3.700 1.00 . A A . 14 THR OG1 1 1 2 761 1 1 15 ARG C C 5.709 5.091 0.920 1.00 . A A . 15 ARG C 1 1 2 762 1 1 15 ARG CA C 6.920 5.628 0.157 1.00 . A A . 15 ARG CA 1 1 2 763 1 1 15 ARG CB C 6.502 6.792 -0.750 1.00 . A A . 15 ARG CB 1 1 2 764 1 1 15 ARG CD C 7.153 8.428 -2.555 1.00 . A A . 15 ARG CD 1 1 2 765 1 1 15 ARG CG C 7.632 7.332 -1.617 1.00 . A A . 15 ARG CG 1 1 2 766 1 1 15 ARG CZ C 5.810 10.492 -2.354 1.00 . A A . 15 ARG CZ 1 1 2 767 1 1 15 ARG H H 6.947 4.002 -1.194 1.00 . A A . 15 ARG H 1 1 2 768 1 1 15 ARG HA H 7.659 5.974 0.864 1.00 . A A . 15 ARG HA 1 1 2 769 1 1 15 ARG HB2 H 5.708 6.459 -1.400 1.00 . A A . 15 ARG HB2 1 1 2 770 1 1 15 ARG HB3 H 6.135 7.600 -0.135 1.00 . A A . 15 ARG HB3 1 1 2 771 1 1 15 ARG HD2 H 7.982 8.745 -3.169 1.00 . A A . 15 ARG HD2 1 1 2 772 1 1 15 ARG HD3 H 6.371 8.030 -3.185 1.00 . A A . 15 ARG HD3 1 1 2 773 1 1 15 ARG HE H 6.928 9.696 -0.894 1.00 . A A . 15 ARG HE 1 1 2 774 1 1 15 ARG HG2 H 8.402 7.733 -0.977 1.00 . A A . 15 ARG HG2 1 1 2 775 1 1 15 ARG HG3 H 8.039 6.522 -2.205 1.00 . A A . 15 ARG HG3 1 1 2 776 1 1 15 ARG HH11 H 5.684 9.605 -4.177 1.00 . A A . 15 ARG HH11 1 1 2 777 1 1 15 ARG HH12 H 4.761 11.062 -3.997 1.00 . A A . 15 ARG HH12 1 1 2 778 1 1 15 ARG HH21 H 5.723 11.612 -0.669 1.00 . A A . 15 ARG HH21 1 1 2 779 1 1 15 ARG HH22 H 4.788 12.204 -2.004 1.00 . A A . 15 ARG HH22 1 1 2 780 1 1 15 ARG N N 7.522 4.569 -0.639 1.00 . A A . 15 ARG N 1 1 2 781 1 1 15 ARG NE N 6.635 9.586 -1.829 1.00 . A A . 15 ARG NE 1 1 2 782 1 1 15 ARG NH1 N 5.387 10.377 -3.610 1.00 . A A . 15 ARG NH1 1 1 2 783 1 1 15 ARG NH2 N 5.410 11.518 -1.618 1.00 . A A . 15 ARG NH2 1 1 2 784 1 1 15 ARG O O 4.850 4.404 0.353 1.00 . A A . 15 ARG O 1 1 2 785 1 1 16 SER C C 3.240 5.464 2.719 1.00 . A A . 16 SER C 1 1 2 786 1 1 16 SER CA C 4.609 4.901 3.089 1.00 . A A . 16 SER CA 1 1 2 787 1 1 16 SER CB C 4.953 5.231 4.542 1.00 . A A . 16 SER CB 1 1 2 788 1 1 16 SER H H 6.333 6.014 2.581 1.00 . A A . 16 SER H 1 1 2 789 1 1 16 SER HA H 4.583 3.826 2.974 1.00 . A A . 16 SER HA 1 1 2 790 1 1 16 SER HB2 H 4.081 5.081 5.160 1.00 . A A . 16 SER HB2 1 1 2 791 1 1 16 SER HB3 H 5.750 4.585 4.879 1.00 . A A . 16 SER HB3 1 1 2 792 1 1 16 SER HG H 6.336 6.621 4.605 1.00 . A A . 16 SER HG 1 1 2 793 1 1 16 SER N N 5.652 5.410 2.208 1.00 . A A . 16 SER N 1 1 2 794 1 1 16 SER O O 2.231 4.767 2.817 1.00 . A A . 16 SER O 1 1 2 795 1 1 16 SER OG O 5.373 6.579 4.668 1.00 . A A . 16 SER OG 1 1 2 796 1 1 17 ASP C C 1.456 6.643 0.587 1.00 . A A . 17 ASP C 1 1 2 797 1 1 17 ASP CA C 1.960 7.341 1.839 1.00 . A A . 17 ASP CA 1 1 2 798 1 1 17 ASP CB C 2.153 8.834 1.560 1.00 . A A . 17 ASP CB 1 1 2 799 1 1 17 ASP CG C 0.872 9.514 1.115 1.00 . A A . 17 ASP CG 1 1 2 800 1 1 17 ASP H H 4.037 7.250 2.284 1.00 . A A . 17 ASP H 1 1 2 801 1 1 17 ASP HA H 1.228 7.218 2.622 1.00 . A A . 17 ASP HA 1 1 2 802 1 1 17 ASP HB2 H 2.500 9.318 2.458 1.00 . A A . 17 ASP HB2 1 1 2 803 1 1 17 ASP HB3 H 2.891 8.955 0.784 1.00 . A A . 17 ASP HB3 1 1 2 804 1 1 17 ASP N N 3.207 6.723 2.288 1.00 . A A . 17 ASP N 1 1 2 805 1 1 17 ASP O O 0.251 6.501 0.380 1.00 . A A . 17 ASP O 1 1 2 806 1 1 17 ASP OD1 O 0.760 9.854 -0.084 1.00 . A A . 17 ASP OD1 1 1 2 807 1 1 17 ASP OD2 O -0.038 9.696 1.953 1.00 . A A . 17 ASP OD2 1 1 2 808 1 1 18 GLU C C 1.435 4.131 -1.115 1.00 . A A . 18 GLU C 1 1 2 809 1 1 18 GLU CA C 2.072 5.466 -1.447 1.00 . A A . 18 GLU CA 1 1 2 810 1 1 18 GLU CB C 3.327 5.255 -2.289 1.00 . A A . 18 GLU CB 1 1 2 811 1 1 18 GLU CD C 2.958 6.975 -4.081 1.00 . A A . 18 GLU CD 1 1 2 812 1 1 18 GLU CG C 3.836 6.526 -2.936 1.00 . A A . 18 GLU CG 1 1 2 813 1 1 18 GLU H H 3.333 6.338 -0.002 1.00 . A A . 18 GLU H 1 1 2 814 1 1 18 GLU HA H 1.368 6.059 -2.008 1.00 . A A . 18 GLU HA 1 1 2 815 1 1 18 GLU HB2 H 4.109 4.860 -1.659 1.00 . A A . 18 GLU HB2 1 1 2 816 1 1 18 GLU HB3 H 3.108 4.543 -3.069 1.00 . A A . 18 GLU HB3 1 1 2 817 1 1 18 GLU HG2 H 3.863 7.311 -2.193 1.00 . A A . 18 GLU HG2 1 1 2 818 1 1 18 GLU HG3 H 4.832 6.345 -3.312 1.00 . A A . 18 GLU HG3 1 1 2 819 1 1 18 GLU N N 2.395 6.190 -0.231 1.00 . A A . 18 GLU N 1 1 2 820 1 1 18 GLU O O 0.411 3.767 -1.692 1.00 . A A . 18 GLU O 1 1 2 821 1 1 18 GLU OE1 O 3.390 6.844 -5.241 1.00 . A A . 18 GLU OE1 1 1 2 822 1 1 18 GLU OE2 O 1.830 7.446 -3.832 1.00 . A A . 18 GLU OE2 1 1 2 823 1 1 19 LEU C C 0.137 2.306 0.923 1.00 . A A . 19 LEU C 1 1 2 824 1 1 19 LEU CA C 1.497 2.131 0.258 1.00 . A A . 19 LEU CA 1 1 2 825 1 1 19 LEU CB C 2.452 1.433 1.223 1.00 . A A . 19 LEU CB 1 1 2 826 1 1 19 LEU CD1 C 1.586 -0.896 0.851 1.00 . A A . 19 LEU CD1 1 1 2 827 1 1 19 LEU CD2 C 2.823 -0.344 2.954 1.00 . A A . 19 LEU CD2 1 1 2 828 1 1 19 LEU CG C 1.878 0.179 1.888 1.00 . A A . 19 LEU CG 1 1 2 829 1 1 19 LEU H H 2.871 3.748 0.230 1.00 . A A . 19 LEU H 1 1 2 830 1 1 19 LEU HA H 1.372 1.513 -0.619 1.00 . A A . 19 LEU HA 1 1 2 831 1 1 19 LEU HB2 H 3.347 1.156 0.681 1.00 . A A . 19 LEU HB2 1 1 2 832 1 1 19 LEU HB3 H 2.723 2.131 1.998 1.00 . A A . 19 LEU HB3 1 1 2 833 1 1 19 LEU HD11 H 1.165 -1.760 1.341 1.00 . A A . 19 LEU HD11 1 1 2 834 1 1 19 LEU HD12 H 2.503 -1.175 0.354 1.00 . A A . 19 LEU HD12 1 1 2 835 1 1 19 LEU HD13 H 0.883 -0.515 0.125 1.00 . A A . 19 LEU HD13 1 1 2 836 1 1 19 LEU HD21 H 2.322 -1.103 3.536 1.00 . A A . 19 LEU HD21 1 1 2 837 1 1 19 LEU HD22 H 3.124 0.467 3.600 1.00 . A A . 19 LEU HD22 1 1 2 838 1 1 19 LEU HD23 H 3.693 -0.773 2.482 1.00 . A A . 19 LEU HD23 1 1 2 839 1 1 19 LEU HG H 0.944 0.437 2.368 1.00 . A A . 19 LEU HG 1 1 2 840 1 1 19 LEU N N 2.038 3.411 -0.175 1.00 . A A . 19 LEU N 1 1 2 841 1 1 19 LEU O O -0.802 1.568 0.637 1.00 . A A . 19 LEU O 1 1 2 842 1 1 20 GLN C C -2.321 3.921 1.553 1.00 . A A . 20 GLN C 1 1 2 843 1 1 20 GLN CA C -1.210 3.529 2.527 1.00 . A A . 20 GLN CA 1 1 2 844 1 1 20 GLN CB C -1.004 4.618 3.585 1.00 . A A . 20 GLN CB 1 1 2 845 1 1 20 GLN CD C -2.522 3.656 5.382 1.00 . A A . 20 GLN CD 1 1 2 846 1 1 20 GLN CG C -2.209 4.843 4.484 1.00 . A A . 20 GLN CG 1 1 2 847 1 1 20 GLN H H 0.816 3.854 1.996 1.00 . A A . 20 GLN H 1 1 2 848 1 1 20 GLN HA H -1.490 2.611 3.020 1.00 . A A . 20 GLN HA 1 1 2 849 1 1 20 GLN HB2 H -0.167 4.338 4.207 1.00 . A A . 20 GLN HB2 1 1 2 850 1 1 20 GLN HB3 H -0.773 5.548 3.087 1.00 . A A . 20 GLN HB3 1 1 2 851 1 1 20 GLN HE21 H -3.337 4.868 6.725 1.00 . A A . 20 GLN HE21 1 1 2 852 1 1 20 GLN HE22 H -3.342 3.187 7.129 1.00 . A A . 20 GLN HE22 1 1 2 853 1 1 20 GLN HG2 H -2.015 5.701 5.108 1.00 . A A . 20 GLN HG2 1 1 2 854 1 1 20 GLN HG3 H -3.067 5.041 3.862 1.00 . A A . 20 GLN HG3 1 1 2 855 1 1 20 GLN N N 0.034 3.285 1.811 1.00 . A A . 20 GLN N 1 1 2 856 1 1 20 GLN NE2 N -3.127 3.931 6.526 1.00 . A A . 20 GLN NE2 1 1 2 857 1 1 20 GLN O O -3.465 3.465 1.673 1.00 . A A . 20 GLN O 1 1 2 858 1 1 20 GLN OE1 O -2.237 2.504 5.052 1.00 . A A . 20 GLN OE1 1 1 2 859 1 1 21 ARG C C -3.333 3.919 -1.260 1.00 . A A . 21 ARG C 1 1 2 860 1 1 21 ARG CA C -2.915 5.141 -0.462 1.00 . A A . 21 ARG CA 1 1 2 861 1 1 21 ARG CB C -2.287 6.170 -1.394 1.00 . A A . 21 ARG CB 1 1 2 862 1 1 21 ARG CD C -2.557 7.716 -3.342 1.00 . A A . 21 ARG CD 1 1 2 863 1 1 21 ARG CG C -3.270 6.804 -2.361 1.00 . A A . 21 ARG CG 1 1 2 864 1 1 21 ARG CZ C -1.092 9.691 -3.226 1.00 . A A . 21 ARG CZ 1 1 2 865 1 1 21 ARG H H -1.055 5.109 0.557 1.00 . A A . 21 ARG H 1 1 2 866 1 1 21 ARG HA H -3.785 5.571 0.011 1.00 . A A . 21 ARG HA 1 1 2 867 1 1 21 ARG HB2 H -1.846 6.954 -0.799 1.00 . A A . 21 ARG HB2 1 1 2 868 1 1 21 ARG HB3 H -1.511 5.689 -1.968 1.00 . A A . 21 ARG HB3 1 1 2 869 1 1 21 ARG HD2 H -2.006 7.110 -4.045 1.00 . A A . 21 ARG HD2 1 1 2 870 1 1 21 ARG HD3 H -3.291 8.304 -3.870 1.00 . A A . 21 ARG HD3 1 1 2 871 1 1 21 ARG HE H -1.380 8.394 -1.737 1.00 . A A . 21 ARG HE 1 1 2 872 1 1 21 ARG HG2 H -3.777 6.023 -2.909 1.00 . A A . 21 ARG HG2 1 1 2 873 1 1 21 ARG HG3 H -3.991 7.382 -1.801 1.00 . A A . 21 ARG HG3 1 1 2 874 1 1 21 ARG HH11 H -2.105 9.502 -4.971 1.00 . A A . 21 ARG HH11 1 1 2 875 1 1 21 ARG HH12 H -1.031 10.861 -4.881 1.00 . A A . 21 ARG HH12 1 1 2 876 1 1 21 ARG HH21 H 0.038 10.152 -1.606 1.00 . A A . 21 ARG HH21 1 1 2 877 1 1 21 ARG HH22 H 0.191 11.229 -2.965 1.00 . A A . 21 ARG HH22 1 1 2 878 1 1 21 ARG N N -1.973 4.749 0.577 1.00 . A A . 21 ARG N 1 1 2 879 1 1 21 ARG NE N -1.629 8.617 -2.663 1.00 . A A . 21 ARG NE 1 1 2 880 1 1 21 ARG NH1 N -1.437 10.046 -4.456 1.00 . A A . 21 ARG NH1 1 1 2 881 1 1 21 ARG NH2 N -0.220 10.417 -2.548 1.00 . A A . 21 ARG NH2 1 1 2 882 1 1 21 ARG O O -4.515 3.718 -1.539 1.00 . A A . 21 ARG O 1 1 2 883 1 1 22 HIS C C -3.603 0.994 -1.515 1.00 . A A . 22 HIS C 1 1 2 884 1 1 22 HIS CA C -2.608 1.849 -2.302 1.00 . A A . 22 HIS CA 1 1 2 885 1 1 22 HIS CB C -1.290 1.092 -2.533 1.00 . A A . 22 HIS CB 1 1 2 886 1 1 22 HIS CD2 C -1.807 -1.413 -2.297 1.00 . A A . 22 HIS CD2 1 1 2 887 1 1 22 HIS CE1 C -1.793 -2.001 -4.389 1.00 . A A . 22 HIS CE1 1 1 2 888 1 1 22 HIS CG C -1.491 -0.308 -3.009 1.00 . A A . 22 HIS CG 1 1 2 889 1 1 22 HIS H H -1.424 3.332 -1.380 1.00 . A A . 22 HIS H 1 1 2 890 1 1 22 HIS HA H -3.043 2.095 -3.258 1.00 . A A . 22 HIS HA 1 1 2 891 1 1 22 HIS HB2 H -0.704 1.616 -3.274 1.00 . A A . 22 HIS HB2 1 1 2 892 1 1 22 HIS HB3 H -0.737 1.054 -1.606 1.00 . A A . 22 HIS HB3 1 1 2 893 1 1 22 HIS HD1 H -1.258 -0.123 -5.113 1.00 . A A . 22 HIS HD1 1 1 2 894 1 1 22 HIS HD2 H -1.875 -1.486 -1.220 1.00 . A A . 22 HIS HD2 1 1 2 895 1 1 22 HIS HE1 H -1.877 -2.591 -5.287 1.00 . A A . 22 HIS HE1 1 1 2 896 1 1 22 HIS N N -2.352 3.093 -1.603 1.00 . A A . 22 HIS N 1 1 2 897 1 1 22 HIS ND1 N -1.470 -0.698 -4.343 1.00 . A A . 22 HIS ND1 1 1 2 898 1 1 22 HIS NE2 N -1.998 -2.442 -3.178 1.00 . A A . 22 HIS NE2 1 1 2 899 1 1 22 HIS O O -4.540 0.431 -2.084 1.00 . A A . 22 HIS O 1 1 2 900 1 1 23 LYS C C -5.707 0.768 0.625 1.00 . A A . 23 LYS C 1 1 2 901 1 1 23 LYS CA C -4.306 0.168 0.663 1.00 . A A . 23 LYS CA 1 1 2 902 1 1 23 LYS CB C -3.785 0.147 2.100 1.00 . A A . 23 LYS CB 1 1 2 903 1 1 23 LYS CD C -2.070 -0.684 3.731 1.00 . A A . 23 LYS CD 1 1 2 904 1 1 23 LYS CE C -0.827 -1.537 3.924 1.00 . A A . 23 LYS CE 1 1 2 905 1 1 23 LYS CG C -2.507 -0.657 2.278 1.00 . A A . 23 LYS CG 1 1 2 906 1 1 23 LYS H H -2.617 1.358 0.187 1.00 . A A . 23 LYS H 1 1 2 907 1 1 23 LYS HA H -4.355 -0.843 0.296 1.00 . A A . 23 LYS HA 1 1 2 908 1 1 23 LYS HB2 H -3.593 1.163 2.413 1.00 . A A . 23 LYS HB2 1 1 2 909 1 1 23 LYS HB3 H -4.543 -0.280 2.738 1.00 . A A . 23 LYS HB3 1 1 2 910 1 1 23 LYS HD2 H -1.857 0.325 4.050 1.00 . A A . 23 LYS HD2 1 1 2 911 1 1 23 LYS HD3 H -2.873 -1.091 4.327 1.00 . A A . 23 LYS HD3 1 1 2 912 1 1 23 LYS HE2 H -1.027 -2.530 3.551 1.00 . A A . 23 LYS HE2 1 1 2 913 1 1 23 LYS HE3 H -0.015 -1.099 3.363 1.00 . A A . 23 LYS HE3 1 1 2 914 1 1 23 LYS HG2 H -2.680 -1.670 1.947 1.00 . A A . 23 LYS HG2 1 1 2 915 1 1 23 LYS HG3 H -1.723 -0.210 1.684 1.00 . A A . 23 LYS HG3 1 1 2 916 1 1 23 LYS HZ1 H 0.391 -2.257 5.459 1.00 . A A . 23 LYS HZ1 1 1 2 917 1 1 23 LYS HZ2 H -1.216 -2.011 5.918 1.00 . A A . 23 LYS HZ2 1 1 2 918 1 1 23 LYS HZ3 H -0.185 -0.688 5.721 1.00 . A A . 23 LYS HZ3 1 1 2 919 1 1 23 LYS N N -3.402 0.912 -0.205 1.00 . A A . 23 LYS N 1 1 2 920 1 1 23 LYS NZ N -0.433 -1.630 5.354 1.00 . A A . 23 LYS NZ 1 1 2 921 1 1 23 LYS O O -6.706 0.049 0.730 1.00 . A A . 23 LYS O 1 1 2 922 1 1 24 ARG C C -7.797 2.330 -0.938 1.00 . A A . 24 ARG C 1 1 2 923 1 1 24 ARG CA C -7.064 2.768 0.329 1.00 . A A . 24 ARG CA 1 1 2 924 1 1 24 ARG CB C -6.869 4.287 0.326 1.00 . A A . 24 ARG CB 1 1 2 925 1 1 24 ARG CD C -7.934 6.562 0.282 1.00 . A A . 24 ARG CD 1 1 2 926 1 1 24 ARG CG C -8.174 5.066 0.352 1.00 . A A . 24 ARG CG 1 1 2 927 1 1 24 ARG CZ C -9.266 8.630 0.102 1.00 . A A . 24 ARG CZ 1 1 2 928 1 1 24 ARG H H -4.946 2.609 0.354 1.00 . A A . 24 ARG H 1 1 2 929 1 1 24 ARG HA H -7.656 2.491 1.188 1.00 . A A . 24 ARG HA 1 1 2 930 1 1 24 ARG HB2 H -6.290 4.566 1.191 1.00 . A A . 24 ARG HB2 1 1 2 931 1 1 24 ARG HB3 H -6.326 4.567 -0.565 1.00 . A A . 24 ARG HB3 1 1 2 932 1 1 24 ARG HD2 H -7.339 6.860 1.133 1.00 . A A . 24 ARG HD2 1 1 2 933 1 1 24 ARG HD3 H -7.395 6.786 -0.628 1.00 . A A . 24 ARG HD3 1 1 2 934 1 1 24 ARG HE H -10.015 6.809 0.455 1.00 . A A . 24 ARG HE 1 1 2 935 1 1 24 ARG HG2 H -8.775 4.768 -0.493 1.00 . A A . 24 ARG HG2 1 1 2 936 1 1 24 ARG HG3 H -8.700 4.837 1.268 1.00 . A A . 24 ARG HG3 1 1 2 937 1 1 24 ARG HH11 H -8.229 10.331 -0.275 1.00 . A A . 24 ARG HH11 1 1 2 938 1 1 24 ARG HH12 H -7.272 8.889 -0.166 1.00 . A A . 24 ARG HH12 1 1 2 939 1 1 24 ARG HH21 H -10.515 10.222 0.000 1.00 . A A . 24 ARG HH21 1 1 2 940 1 1 24 ARG HH22 H -11.278 8.696 0.310 1.00 . A A . 24 ARG HH22 1 1 2 941 1 1 24 ARG N N -5.780 2.083 0.433 1.00 . A A . 24 ARG N 1 1 2 942 1 1 24 ARG NE N -9.185 7.316 0.292 1.00 . A A . 24 ARG NE 1 1 2 943 1 1 24 ARG NH1 N -8.168 9.341 -0.133 1.00 . A A . 24 ARG NH1 1 1 2 944 1 1 24 ARG NH2 N -10.446 9.231 0.142 1.00 . A A . 24 ARG NH2 1 1 2 945 1 1 24 ARG O O -8.988 2.583 -1.101 1.00 . A A . 24 ARG O 1 1 2 946 1 1 25 THR C C -8.316 -0.216 -2.777 1.00 . A A . 25 THR C 1 1 2 947 1 1 25 THR CA C -7.681 1.150 -3.047 1.00 . A A . 25 THR CA 1 1 2 948 1 1 25 THR CB C -6.641 1.057 -4.180 1.00 . A A . 25 THR CB 1 1 2 949 1 1 25 THR CG2 C -7.306 0.730 -5.509 1.00 . A A . 25 THR CG2 1 1 2 950 1 1 25 THR H H -6.121 1.522 -1.670 1.00 . A A . 25 THR H 1 1 2 951 1 1 25 THR HA H -8.457 1.838 -3.352 1.00 . A A . 25 THR HA 1 1 2 952 1 1 25 THR HB H -5.935 0.275 -3.940 1.00 . A A . 25 THR HB 1 1 2 953 1 1 25 THR HG1 H -5.799 2.670 -3.406 1.00 . A A . 25 THR HG1 1 1 2 954 1 1 25 THR HG21 H -8.014 1.505 -5.758 1.00 . A A . 25 THR HG21 1 1 2 955 1 1 25 THR HG22 H -7.820 -0.216 -5.432 1.00 . A A . 25 THR HG22 1 1 2 956 1 1 25 THR HG23 H -6.553 0.669 -6.281 1.00 . A A . 25 THR HG23 1 1 2 957 1 1 25 THR N N -7.080 1.671 -1.834 1.00 . A A . 25 THR N 1 1 2 958 1 1 25 THR O O -9.197 -0.659 -3.510 1.00 . A A . 25 THR O 1 1 2 959 1 1 25 THR OG1 O -5.943 2.308 -4.289 1.00 . A A . 25 THR OG1 1 1 2 960 1 1 26 HIS C C -9.696 -1.824 -0.388 1.00 . A A . 26 HIS C 1 1 2 961 1 1 26 HIS CA C -8.497 -2.120 -1.276 1.00 . A A . 26 HIS CA 1 1 2 962 1 1 26 HIS CB C -7.511 -3.010 -0.512 1.00 . A A . 26 HIS CB 1 1 2 963 1 1 26 HIS CD2 C -5.094 -3.375 -1.344 1.00 . A A . 26 HIS CD2 1 1 2 964 1 1 26 HIS CE1 C -5.442 -4.940 -2.823 1.00 . A A . 26 HIS CE1 1 1 2 965 1 1 26 HIS CG C -6.428 -3.614 -1.350 1.00 . A A . 26 HIS CG 1 1 2 966 1 1 26 HIS H H -7.141 -0.498 -1.175 1.00 . A A . 26 HIS H 1 1 2 967 1 1 26 HIS HA H -8.834 -2.642 -2.158 1.00 . A A . 26 HIS HA 1 1 2 968 1 1 26 HIS HB2 H -7.033 -2.422 0.257 1.00 . A A . 26 HIS HB2 1 1 2 969 1 1 26 HIS HB3 H -8.058 -3.817 -0.046 1.00 . A A . 26 HIS HB3 1 1 2 970 1 1 26 HIS HD1 H -7.507 -5.007 -2.541 1.00 . A A . 26 HIS HD1 1 1 2 971 1 1 26 HIS HD2 H -4.571 -2.669 -0.718 1.00 . A A . 26 HIS HD2 1 1 2 972 1 1 26 HIS HE1 H -5.280 -5.692 -3.579 1.00 . A A . 26 HIS HE1 1 1 2 973 1 1 26 HIS N N -7.881 -0.870 -1.702 1.00 . A A . 26 HIS N 1 1 2 974 1 1 26 HIS ND1 N -6.638 -4.611 -2.300 1.00 . A A . 26 HIS ND1 1 1 2 975 1 1 26 HIS NE2 N -4.505 -4.213 -2.268 1.00 . A A . 26 HIS NE2 1 1 2 976 1 1 26 HIS O O -10.729 -2.484 -0.480 1.00 . A A . 26 HIS O 1 1 2 977 1 1 27 THR C C -11.557 0.595 0.631 1.00 . A A . 27 THR C 1 1 2 978 1 1 27 THR CA C -10.632 -0.387 1.341 1.00 . A A . 27 THR CA 1 1 2 979 1 1 27 THR CB C -10.079 0.266 2.620 1.00 . A A . 27 THR CB 1 1 2 980 1 1 27 THR CG2 C -9.505 -0.784 3.556 1.00 . A A . 27 THR CG2 1 1 2 981 1 1 27 THR H H -8.679 -0.356 0.525 1.00 . A A . 27 THR H 1 1 2 982 1 1 27 THR HA H -11.200 -1.261 1.624 1.00 . A A . 27 THR HA 1 1 2 983 1 1 27 THR HB H -10.886 0.777 3.123 1.00 . A A . 27 THR HB 1 1 2 984 1 1 27 THR HG1 H -9.265 2.066 2.699 1.00 . A A . 27 THR HG1 1 1 2 985 1 1 27 THR HG21 H -8.717 -1.323 3.052 1.00 . A A . 27 THR HG21 1 1 2 986 1 1 27 THR HG22 H -10.284 -1.473 3.847 1.00 . A A . 27 THR HG22 1 1 2 987 1 1 27 THR HG23 H -9.104 -0.301 4.434 1.00 . A A . 27 THR HG23 1 1 2 988 1 1 27 THR N N -9.548 -0.816 0.467 1.00 . A A . 27 THR N 1 1 2 989 1 1 27 THR O O -12.518 1.106 1.214 1.00 . A A . 27 THR O 1 1 2 990 1 1 27 THR OG1 O -9.061 1.221 2.283 1.00 . A A . 27 THR OG1 1 1 2 991 1 1 28 GLY C C -13.190 1.019 -2.109 1.00 . A A . 28 GLY C 1 1 2 992 1 1 28 GLY CA C -12.068 1.755 -1.416 1.00 . A A . 28 GLY CA 1 1 2 993 1 1 28 GLY H H -10.475 0.432 -1.029 1.00 . A A . 28 GLY H 1 1 2 994 1 1 28 GLY HA2 H -12.484 2.511 -0.768 1.00 . A A . 28 GLY HA2 1 1 2 995 1 1 28 GLY HA3 H -11.448 2.230 -2.161 1.00 . A A . 28 GLY HA3 1 1 2 996 1 1 28 GLY N N -11.257 0.858 -0.628 1.00 . A A . 28 GLY N 1 1 2 997 1 1 28 GLY O O -12.977 -0.067 -2.652 1.00 . A A . 28 GLY O 1 1 2 998 1 1 29 GLU C C -15.522 1.129 -4.205 1.00 . A A . 29 GLU C 1 1 2 999 1 1 29 GLU CA C -15.534 0.945 -2.692 1.00 . A A . 29 GLU CA 1 1 2 1000 1 1 29 GLU CB C -16.835 1.495 -2.101 1.00 . A A . 29 GLU CB 1 1 2 1001 1 1 29 GLU CD C -18.331 3.490 -1.742 1.00 . A A . 29 GLU CD 1 1 2 1002 1 1 29 GLU CG C -17.004 2.998 -2.269 1.00 . A A . 29 GLU CG 1 1 2 1003 1 1 29 GLU H H -14.489 2.465 -1.664 1.00 . A A . 29 GLU H 1 1 2 1004 1 1 29 GLU HA H -15.467 -0.111 -2.473 1.00 . A A . 29 GLU HA 1 1 2 1005 1 1 29 GLU HB2 H -17.669 1.010 -2.583 1.00 . A A . 29 GLU HB2 1 1 2 1006 1 1 29 GLU HB3 H -16.861 1.269 -1.045 1.00 . A A . 29 GLU HB3 1 1 2 1007 1 1 29 GLU HG2 H -16.213 3.501 -1.734 1.00 . A A . 29 GLU HG2 1 1 2 1008 1 1 29 GLU HG3 H -16.936 3.240 -3.318 1.00 . A A . 29 GLU HG3 1 1 2 1009 1 1 29 GLU N N -14.382 1.589 -2.088 1.00 . A A . 29 GLU N 1 1 2 1010 1 1 29 GLU O O -15.137 2.184 -4.711 1.00 . A A . 29 GLU O 1 1 2 1011 1 1 29 GLU OE1 O -18.430 3.754 -0.526 1.00 . A A . 29 GLU OE1 1 1 2 1012 1 1 29 GLU OE2 O -19.284 3.605 -2.537 1.00 . A A . 29 GLU OE2 1 1 2 1013 1 1 30 LYS C C -17.400 -0.104 -6.858 1.00 . A A . 30 LYS C 1 1 2 1014 1 1 30 LYS CA C -15.983 0.154 -6.372 1.00 . A A . 30 LYS CA 1 1 2 1015 1 1 30 LYS CB C -15.015 -0.860 -6.994 1.00 . A A . 30 LYS CB 1 1 2 1016 1 1 30 LYS CD C -12.618 -1.567 -7.340 1.00 . A A . 30 LYS CD 1 1 2 1017 1 1 30 LYS CE C -12.934 -3.045 -7.168 1.00 . A A . 30 LYS CE 1 1 2 1018 1 1 30 LYS CG C -13.571 -0.680 -6.548 1.00 . A A . 30 LYS CG 1 1 2 1019 1 1 30 LYS H H -16.225 -0.722 -4.464 1.00 . A A . 30 LYS H 1 1 2 1020 1 1 30 LYS HA H -15.690 1.150 -6.671 1.00 . A A . 30 LYS HA 1 1 2 1021 1 1 30 LYS HB2 H -15.332 -1.856 -6.721 1.00 . A A . 30 LYS HB2 1 1 2 1022 1 1 30 LYS HB3 H -15.052 -0.762 -8.069 1.00 . A A . 30 LYS HB3 1 1 2 1023 1 1 30 LYS HD2 H -12.696 -1.315 -8.386 1.00 . A A . 30 LYS HD2 1 1 2 1024 1 1 30 LYS HD3 H -11.608 -1.382 -7.001 1.00 . A A . 30 LYS HD3 1 1 2 1025 1 1 30 LYS HE2 H -13.951 -3.222 -7.485 1.00 . A A . 30 LYS HE2 1 1 2 1026 1 1 30 LYS HE3 H -12.261 -3.619 -7.788 1.00 . A A . 30 LYS HE3 1 1 2 1027 1 1 30 LYS HG2 H -13.286 0.351 -6.689 1.00 . A A . 30 LYS HG2 1 1 2 1028 1 1 30 LYS HG3 H -13.495 -0.935 -5.500 1.00 . A A . 30 LYS HG3 1 1 2 1029 1 1 30 LYS HZ1 H -11.817 -3.316 -5.425 1.00 . A A . 30 LYS HZ1 1 1 2 1030 1 1 30 LYS HZ2 H -12.998 -4.502 -5.674 1.00 . A A . 30 LYS HZ2 1 1 2 1031 1 1 30 LYS HZ3 H -13.445 -2.963 -5.145 1.00 . A A . 30 LYS HZ3 1 1 2 1032 1 1 30 LYS N N -15.936 0.097 -4.922 1.00 . A A . 30 LYS N 1 1 2 1033 1 1 30 LYS NZ N -12.788 -3.488 -5.756 1.00 . A A . 30 LYS NZ 1 1 2 1034 1 1 30 LYS O O -17.788 -1.243 -7.107 1.00 . A A . 30 LYS O 1 1 2 1035 1 1 31 NH2 HN1 H -17.797 1.836 -6.757 1.00 . A A . 31 NH2 HN1 1 1 2 1036 1 1 31 NH2 HN2 H -19.103 0.824 -7.273 1.00 . A A . 31 NH2 HN2 1 1 2 1037 1 1 31 NH2 N N -18.177 0.956 -6.976 1.00 . A A . 31 NH2 N 1 1 2 1038 2 2 1 ZN ZN ZN -2.546 -4.277 -2.670 1.00 . B A . 101 ZN ZN 1 1 3 1039 1 1 1 ARG C C 11.862 -1.195 2.903 1.00 . A A . 1 ARG C 1 1 3 1040 1 1 1 ARG CA C 13.060 -1.748 3.668 1.00 . A A . 1 ARG CA 1 1 3 1041 1 1 1 ARG CB C 13.001 -1.274 5.122 1.00 . A A . 1 ARG CB 1 1 3 1042 1 1 1 ARG CD C 14.183 -1.000 7.325 1.00 . A A . 1 ARG CD 1 1 3 1043 1 1 1 ARG CG C 14.244 -1.608 5.931 1.00 . A A . 1 ARG CG 1 1 3 1044 1 1 1 ARG CZ C 12.408 -0.932 9.042 1.00 . A A . 1 ARG CZ 1 1 3 1045 1 1 1 ARG H1 H 14.371 -0.248 3.060 1.00 . A A . 1 ARG H1 1 1 3 1046 1 1 1 ARG H2 H 14.338 -1.588 2.034 1.00 . A A . 1 ARG H2 1 1 3 1047 1 1 1 ARG H3 H 15.139 -1.685 3.517 1.00 . A A . 1 ARG H3 1 1 3 1048 1 1 1 ARG HA H 13.034 -2.827 3.639 1.00 . A A . 1 ARG HA 1 1 3 1049 1 1 1 ARG HB2 H 12.869 -0.202 5.131 1.00 . A A . 1 ARG HB2 1 1 3 1050 1 1 1 ARG HB3 H 12.150 -1.734 5.601 1.00 . A A . 1 ARG HB3 1 1 3 1051 1 1 1 ARG HD2 H 15.137 -1.148 7.811 1.00 . A A . 1 ARG HD2 1 1 3 1052 1 1 1 ARG HD3 H 13.992 0.059 7.231 1.00 . A A . 1 ARG HD3 1 1 3 1053 1 1 1 ARG HE H 12.973 -2.566 8.032 1.00 . A A . 1 ARG HE 1 1 3 1054 1 1 1 ARG HG2 H 14.326 -2.682 6.020 1.00 . A A . 1 ARG HG2 1 1 3 1055 1 1 1 ARG HG3 H 15.112 -1.221 5.416 1.00 . A A . 1 ARG HG3 1 1 3 1056 1 1 1 ARG HH11 H 12.032 0.876 9.886 1.00 . A A . 1 ARG HH11 1 1 3 1057 1 1 1 ARG HH12 H 13.263 0.869 8.665 1.00 . A A . 1 ARG HH12 1 1 3 1058 1 1 1 ARG HH21 H 11.366 -2.561 9.643 1.00 . A A . 1 ARG HH21 1 1 3 1059 1 1 1 ARG HH22 H 10.957 -1.080 10.448 1.00 . A A . 1 ARG HH22 1 1 3 1060 1 1 1 ARG N N 14.313 -1.288 3.027 1.00 . A A . 1 ARG N 1 1 3 1061 1 1 1 ARG NE N 13.134 -1.600 8.145 1.00 . A A . 1 ARG NE 1 1 3 1062 1 1 1 ARG NH1 N 12.581 0.376 9.210 1.00 . A A . 1 ARG NH1 1 1 3 1063 1 1 1 ARG NH2 N 11.504 -1.574 9.767 1.00 . A A . 1 ARG NH2 1 1 3 1064 1 1 1 ARG O O 11.512 -0.025 3.055 1.00 . A A . 1 ARG O 1 1 3 1065 1 1 2 PRO C C 8.777 -1.578 1.946 1.00 . A A . 2 PRO C 1 1 3 1066 1 1 2 PRO CA C 10.119 -1.568 1.224 1.00 . A A . 2 PRO CA 1 1 3 1067 1 1 2 PRO CB C 10.122 -2.587 0.090 1.00 . A A . 2 PRO CB 1 1 3 1068 1 1 2 PRO CD C 11.502 -3.454 1.872 1.00 . A A . 2 PRO CD 1 1 3 1069 1 1 2 PRO CG C 10.602 -3.852 0.720 1.00 . A A . 2 PRO CG 1 1 3 1070 1 1 2 PRO HA H 10.303 -0.581 0.826 1.00 . A A . 2 PRO HA 1 1 3 1071 1 1 2 PRO HB2 H 9.120 -2.691 -0.304 1.00 . A A . 2 PRO HB2 1 1 3 1072 1 1 2 PRO HB3 H 10.791 -2.256 -0.692 1.00 . A A . 2 PRO HB3 1 1 3 1073 1 1 2 PRO HD2 H 11.249 -4.017 2.759 1.00 . A A . 2 PRO HD2 1 1 3 1074 1 1 2 PRO HD3 H 12.539 -3.609 1.611 1.00 . A A . 2 PRO HD3 1 1 3 1075 1 1 2 PRO HG2 H 9.759 -4.418 1.084 1.00 . A A . 2 PRO HG2 1 1 3 1076 1 1 2 PRO HG3 H 11.155 -4.432 -0.005 1.00 . A A . 2 PRO HG3 1 1 3 1077 1 1 2 PRO N N 11.219 -2.018 2.064 1.00 . A A . 2 PRO N 1 1 3 1078 1 1 2 PRO O O 8.590 -2.276 2.947 1.00 . A A . 2 PRO O 1 1 3 1079 1 1 3 PHE C C 5.610 -1.605 1.061 1.00 . A A . 3 PHE C 1 1 3 1080 1 1 3 PHE CA C 6.500 -0.746 1.945 1.00 . A A . 3 PHE CA 1 1 3 1081 1 1 3 PHE CB C 5.999 0.697 1.972 1.00 . A A . 3 PHE CB 1 1 3 1082 1 1 3 PHE CD1 C 7.833 2.363 2.330 1.00 . A A . 3 PHE CD1 1 1 3 1083 1 1 3 PHE CD2 C 6.545 1.681 4.215 1.00 . A A . 3 PHE CD2 1 1 3 1084 1 1 3 PHE CE1 C 8.584 3.193 3.141 1.00 . A A . 3 PHE CE1 1 1 3 1085 1 1 3 PHE CE2 C 7.290 2.508 5.030 1.00 . A A . 3 PHE CE2 1 1 3 1086 1 1 3 PHE CG C 6.808 1.600 2.858 1.00 . A A . 3 PHE CG 1 1 3 1087 1 1 3 PHE CZ C 8.295 3.274 4.499 1.00 . A A . 3 PHE CZ 1 1 3 1088 1 1 3 PHE H H 8.087 -0.221 0.667 1.00 . A A . 3 PHE H 1 1 3 1089 1 1 3 PHE HA H 6.503 -1.148 2.947 1.00 . A A . 3 PHE HA 1 1 3 1090 1 1 3 PHE HB2 H 6.032 1.099 0.971 1.00 . A A . 3 PHE HB2 1 1 3 1091 1 1 3 PHE HB3 H 4.982 0.711 2.325 1.00 . A A . 3 PHE HB3 1 1 3 1092 1 1 3 PHE HD1 H 8.046 2.305 1.274 1.00 . A A . 3 PHE HD1 1 1 3 1093 1 1 3 PHE HD2 H 5.744 1.089 4.638 1.00 . A A . 3 PHE HD2 1 1 3 1094 1 1 3 PHE HE1 H 9.382 3.783 2.717 1.00 . A A . 3 PHE HE1 1 1 3 1095 1 1 3 PHE HE2 H 7.077 2.562 6.088 1.00 . A A . 3 PHE HE2 1 1 3 1096 1 1 3 PHE HZ H 8.873 3.924 5.138 1.00 . A A . 3 PHE HZ 1 1 3 1097 1 1 3 PHE N N 7.852 -0.792 1.431 1.00 . A A . 3 PHE N 1 1 3 1098 1 1 3 PHE O O 5.077 -1.135 0.058 1.00 . A A . 3 PHE O 1 1 3 1099 1 1 4 NLE C C 3.347 -4.022 0.992 1.00 . A A . 4 NLE C 1 1 3 1100 1 1 4 NLE CA C 4.797 -3.831 0.567 1.00 . A A . 4 NLE CA 1 1 3 1101 1 1 4 NLE CB C 5.540 -5.170 0.598 1.00 . A A . 4 NLE CB 1 1 3 1102 1 1 4 NLE CD C 5.840 -7.468 -0.372 1.00 . A A . 4 NLE CD 1 1 3 1103 1 1 4 NLE CE C 5.314 -8.451 -1.394 1.00 . A A . 4 NLE CE 1 1 3 1104 1 1 4 NLE CG C 5.021 -6.188 -0.405 1.00 . A A . 4 NLE CG 1 1 3 1105 1 1 4 NLE H H 5.844 -3.161 2.278 1.00 . A A . 4 NLE H 1 1 3 1106 1 1 4 NLE HA H 4.811 -3.447 -0.439 1.00 . A A . 4 NLE HA 1 1 3 1107 1 1 4 NLE HB2 H 5.446 -5.593 1.586 1.00 . A A . 4 NLE HB2 1 1 3 1108 1 1 4 NLE HB3 H 6.585 -4.995 0.390 1.00 . A A . 4 NLE HB3 1 1 3 1109 1 1 4 NLE HD2 H 5.768 -7.914 0.610 1.00 . A A . 4 NLE HD2 1 1 3 1110 1 1 4 NLE HD3 H 6.869 -7.242 -0.604 1.00 . A A . 4 NLE HD3 1 1 3 1111 1 1 4 NLE HE1 H 5.359 -8.006 -2.377 1.00 . A A . 4 NLE HE1 1 1 3 1112 1 1 4 NLE HE2 H 4.291 -8.704 -1.158 1.00 . A A . 4 NLE HE2 1 1 3 1113 1 1 4 NLE HE3 H 5.919 -9.346 -1.376 1.00 . A A . 4 NLE HE3 1 1 3 1114 1 1 4 NLE HG2 H 5.073 -5.764 -1.398 1.00 . A A . 4 NLE HG2 1 1 3 1115 1 1 4 NLE HG3 H 3.994 -6.425 -0.167 1.00 . A A . 4 NLE HG3 1 1 3 1116 1 1 4 NLE N N 5.480 -2.868 1.418 1.00 . A A . 4 NLE N 1 1 3 1117 1 1 4 NLE O O 3.034 -4.073 2.183 1.00 . A A . 4 NLE O 1 1 3 1118 1 1 5 CYS C C 0.882 -5.790 0.799 1.00 . A A . 5 CYS C 1 1 3 1119 1 1 5 CYS CA C 1.064 -4.382 0.231 1.00 . A A . 5 CYS CA 1 1 3 1120 1 1 5 CYS CB C 0.280 -4.230 -1.074 1.00 . A A . 5 CYS CB 1 1 3 1121 1 1 5 CYS H H 2.778 -3.946 -0.920 1.00 . A A . 5 CYS H 1 1 3 1122 1 1 5 CYS HA H 0.694 -3.667 0.947 1.00 . A A . 5 CYS HA 1 1 3 1123 1 1 5 CYS HB2 H 0.212 -3.180 -1.326 1.00 . A A . 5 CYS HB2 1 1 3 1124 1 1 5 CYS HB3 H 0.799 -4.751 -1.862 1.00 . A A . 5 CYS HB3 1 1 3 1125 1 1 5 CYS N N 2.469 -4.098 0.001 1.00 . A A . 5 CYS N 1 1 3 1126 1 1 5 CYS O O 1.495 -6.747 0.319 1.00 . A A . 5 CYS O 1 1 3 1127 1 1 5 CYS SG S -1.398 -4.883 -0.988 1.00 . A A . 5 CYS SG 1 1 3 1128 1 1 6 THR C C -1.548 -7.762 2.249 1.00 . A A . 6 THR C 1 1 3 1129 1 1 6 THR CA C -0.158 -7.179 2.506 1.00 . A A . 6 THR CA 1 1 3 1130 1 1 6 THR CB C 0.044 -7.007 4.023 1.00 . A A . 6 THR CB 1 1 3 1131 1 1 6 THR CG2 C 1.516 -6.808 4.357 1.00 . A A . 6 THR CG2 1 1 3 1132 1 1 6 THR H H -0.448 -5.119 2.131 1.00 . A A . 6 THR H 1 1 3 1133 1 1 6 THR HA H 0.585 -7.874 2.144 1.00 . A A . 6 THR HA 1 1 3 1134 1 1 6 THR HB H -0.305 -7.900 4.520 1.00 . A A . 6 THR HB 1 1 3 1135 1 1 6 THR HG1 H -1.653 -6.117 4.528 1.00 . A A . 6 THR HG1 1 1 3 1136 1 1 6 THR HG21 H 1.882 -5.925 3.854 1.00 . A A . 6 THR HG21 1 1 3 1137 1 1 6 THR HG22 H 2.079 -7.669 4.031 1.00 . A A . 6 THR HG22 1 1 3 1138 1 1 6 THR HG23 H 1.630 -6.688 5.426 1.00 . A A . 6 THR HG23 1 1 3 1139 1 1 6 THR N N 0.043 -5.910 1.821 1.00 . A A . 6 THR N 1 1 3 1140 1 1 6 THR O O -2.056 -8.553 3.049 1.00 . A A . 6 THR O 1 1 3 1141 1 1 6 THR OG1 O -0.717 -5.881 4.491 1.00 . A A . 6 THR OG1 1 1 3 1142 1 1 7 TRP C C -3.426 -8.923 -0.285 1.00 . A A . 7 TRP C 1 1 3 1143 1 1 7 TRP CA C -3.494 -7.872 0.818 1.00 . A A . 7 TRP CA 1 1 3 1144 1 1 7 TRP CB C -4.401 -6.723 0.394 1.00 . A A . 7 TRP CB 1 1 3 1145 1 1 7 TRP CD1 C -6.472 -7.723 -0.727 1.00 . A A . 7 TRP CD1 1 1 3 1146 1 1 7 TRP CD2 C -6.842 -6.904 1.319 1.00 . A A . 7 TRP CD2 1 1 3 1147 1 1 7 TRP CE2 C -8.051 -7.418 0.818 1.00 . A A . 7 TRP CE2 1 1 3 1148 1 1 7 TRP CE3 C -6.829 -6.335 2.593 1.00 . A A . 7 TRP CE3 1 1 3 1149 1 1 7 TRP CG C -5.845 -7.111 0.315 1.00 . A A . 7 TRP CG 1 1 3 1150 1 1 7 TRP CH2 C -9.193 -6.816 2.791 1.00 . A A . 7 TRP CH2 1 1 3 1151 1 1 7 TRP CZ2 C -9.234 -7.380 1.546 1.00 . A A . 7 TRP CZ2 1 1 3 1152 1 1 7 TRP CZ3 C -8.004 -6.296 3.316 1.00 . A A . 7 TRP CZ3 1 1 3 1153 1 1 7 TRP H H -1.721 -6.758 0.524 1.00 . A A . 7 TRP H 1 1 3 1154 1 1 7 TRP HA H -3.902 -8.328 1.707 1.00 . A A . 7 TRP HA 1 1 3 1155 1 1 7 TRP HB2 H -4.310 -5.917 1.104 1.00 . A A . 7 TRP HB2 1 1 3 1156 1 1 7 TRP HB3 H -4.095 -6.373 -0.580 1.00 . A A . 7 TRP HB3 1 1 3 1157 1 1 7 TRP HD1 H -5.981 -8.011 -1.643 1.00 . A A . 7 TRP HD1 1 1 3 1158 1 1 7 TRP HE1 H -8.457 -8.338 -1.025 1.00 . A A . 7 TRP HE1 1 1 3 1159 1 1 7 TRP HE3 H -5.920 -5.931 3.013 1.00 . A A . 7 TRP HE3 1 1 3 1160 1 1 7 TRP HH2 H -10.088 -6.763 3.390 1.00 . A A . 7 TRP HH2 1 1 3 1161 1 1 7 TRP HZ2 H -10.159 -7.777 1.156 1.00 . A A . 7 TRP HZ2 1 1 3 1162 1 1 7 TRP HZ3 H -8.013 -5.859 4.303 1.00 . A A . 7 TRP HZ3 1 1 3 1163 1 1 7 TRP N N -2.165 -7.380 1.139 1.00 . A A . 7 TRP N 1 1 3 1164 1 1 7 TRP NE1 N -7.798 -7.915 -0.433 1.00 . A A . 7 TRP NE1 1 1 3 1165 1 1 7 TRP O O -3.456 -8.600 -1.473 1.00 . A A . 7 TRP O 1 1 3 1166 1 1 8 ORN C C -1.750 -10.796 -4.188 1.00 . A A . 8 ORN C 1 1 3 1167 1 1 8 ORN CA C -2.460 -12.053 -3.707 1.00 . A A . 8 ORN CA 1 1 3 1168 1 1 8 ORN CB C -1.794 -12.575 -2.429 1.00 . A A . 8 ORN CB 1 1 3 1169 1 1 8 ORN CD C -3.241 -11.310 -0.807 1.00 . A A . 8 ORN CD 1 1 3 1170 1 1 8 ORN CG C -1.820 -11.580 -1.279 1.00 . A A . 8 ORN CG 1 1 3 1171 1 1 8 ORN H H -2.924 -13.944 -4.438 1.00 . A A . 8 ORN H 1 1 3 1172 1 1 8 ORN HA H -3.490 -11.813 -3.498 1.00 . A A . 8 ORN HA 1 1 3 1173 1 1 8 ORN HB2 H -0.764 -12.816 -2.645 1.00 . A A . 8 ORN HB2 1 1 3 1174 1 1 8 ORN HB3 H -2.305 -13.470 -2.110 1.00 . A A . 8 ORN HB3 1 1 3 1175 1 1 8 ORN HD2 H -3.613 -12.190 -0.308 1.00 . A A . 8 ORN HD2 1 1 3 1176 1 1 8 ORN HD3 H -3.859 -11.096 -1.665 1.00 . A A . 8 ORN HD3 1 1 3 1177 1 1 8 ORN HE1 H -3.267 -10.368 1.072 1.00 . A A . 8 ORN HE1 1 1 3 1178 1 1 8 ORN HG2 H -1.376 -10.652 -1.608 1.00 . A A . 8 ORN HG2 1 1 3 1179 1 1 8 ORN HG3 H -1.249 -11.983 -0.455 1.00 . A A . 8 ORN HG3 1 1 3 1180 1 1 8 ORN N N -2.430 -13.089 -4.760 1.00 . A A . 8 ORN N 1 1 3 1181 1 1 8 ORN NE N -3.311 -10.180 0.112 1.00 . A A . 8 ORN NE 1 1 3 1182 1 1 8 ORN O O -0.685 -10.870 -4.806 1.00 . A A . 8 ORN O 1 1 3 1183 1 1 9 CYS C C -0.542 -8.104 -3.375 1.00 . A A . 9 CYS C 1 1 3 1184 1 1 9 CYS CA C -1.743 -8.382 -4.277 1.00 . A A . 9 CYS CA 1 1 3 1185 1 1 9 CYS CB C -2.782 -7.270 -4.160 1.00 . A A . 9 CYS CB 1 1 3 1186 1 1 9 CYS H H -3.196 -9.648 -3.423 1.00 . A A . 9 CYS H 1 1 3 1187 1 1 9 CYS HA H -1.410 -8.454 -5.300 1.00 . A A . 9 CYS HA 1 1 3 1188 1 1 9 CYS HB2 H -3.612 -7.489 -4.816 1.00 . A A . 9 CYS HB2 1 1 3 1189 1 1 9 CYS HB3 H -3.137 -7.232 -3.142 1.00 . A A . 9 CYS HB3 1 1 3 1190 1 1 9 CYS N N -2.340 -9.648 -3.910 1.00 . A A . 9 CYS N 1 1 3 1191 1 1 9 CYS O O -0.609 -8.310 -2.163 1.00 . A A . 9 CYS O 1 1 3 1192 1 1 9 CYS SG S -2.166 -5.634 -4.586 1.00 . A A . 9 CYS SG 1 1 3 1193 1 1 10 GLY C C 2.656 -6.397 -3.817 1.00 . A A . 10 GLY C 1 1 3 1194 1 1 10 GLY CA C 1.762 -7.444 -3.199 1.00 . A A . 10 GLY CA 1 1 3 1195 1 1 10 GLY H H 0.546 -7.468 -4.926 1.00 . A A . 10 GLY H 1 1 3 1196 1 1 10 GLY HA2 H 1.493 -7.130 -2.202 1.00 . A A . 10 GLY HA2 1 1 3 1197 1 1 10 GLY HA3 H 2.304 -8.375 -3.139 1.00 . A A . 10 GLY HA3 1 1 3 1198 1 1 10 GLY N N 0.556 -7.659 -3.964 1.00 . A A . 10 GLY N 1 1 3 1199 1 1 10 GLY O O 3.864 -6.596 -3.941 1.00 . A A . 10 GLY O 1 1 3 1200 1 1 11 LYS C C 3.686 -3.540 -3.706 1.00 . A A . 11 LYS C 1 1 3 1201 1 1 11 LYS CA C 2.829 -4.185 -4.786 1.00 . A A . 11 LYS CA 1 1 3 1202 1 1 11 LYS CB C 1.902 -3.146 -5.423 1.00 . A A . 11 LYS CB 1 1 3 1203 1 1 11 LYS CD C 0.429 -2.568 -7.372 1.00 . A A . 11 LYS CD 1 1 3 1204 1 1 11 LYS CE C -0.380 -3.112 -8.537 1.00 . A A . 11 LYS CE 1 1 3 1205 1 1 11 LYS CG C 1.095 -3.686 -6.590 1.00 . A A . 11 LYS CG 1 1 3 1206 1 1 11 LYS H H 1.094 -5.197 -4.124 1.00 . A A . 11 LYS H 1 1 3 1207 1 1 11 LYS HA H 3.477 -4.593 -5.547 1.00 . A A . 11 LYS HA 1 1 3 1208 1 1 11 LYS HB2 H 1.212 -2.788 -4.673 1.00 . A A . 11 LYS HB2 1 1 3 1209 1 1 11 LYS HB3 H 2.497 -2.317 -5.777 1.00 . A A . 11 LYS HB3 1 1 3 1210 1 1 11 LYS HD2 H -0.228 -2.023 -6.712 1.00 . A A . 11 LYS HD2 1 1 3 1211 1 1 11 LYS HD3 H 1.191 -1.904 -7.752 1.00 . A A . 11 LYS HD3 1 1 3 1212 1 1 11 LYS HE2 H 0.266 -3.719 -9.154 1.00 . A A . 11 LYS HE2 1 1 3 1213 1 1 11 LYS HE3 H -1.179 -3.723 -8.147 1.00 . A A . 11 LYS HE3 1 1 3 1214 1 1 11 LYS HG2 H 1.753 -4.229 -7.248 1.00 . A A . 11 LYS HG2 1 1 3 1215 1 1 11 LYS HG3 H 0.331 -4.350 -6.210 1.00 . A A . 11 LYS HG3 1 1 3 1216 1 1 11 LYS HZ1 H -1.532 -1.389 -8.771 1.00 . A A . 11 LYS HZ1 1 1 3 1217 1 1 11 LYS HZ2 H -1.564 -2.420 -10.109 1.00 . A A . 11 LYS HZ2 1 1 3 1218 1 1 11 LYS HZ3 H -0.201 -1.469 -9.809 1.00 . A A . 11 LYS HZ3 1 1 3 1219 1 1 11 LYS N N 2.064 -5.283 -4.218 1.00 . A A . 11 LYS N 1 1 3 1220 1 1 11 LYS NZ N -0.959 -2.023 -9.364 1.00 . A A . 11 LYS NZ 1 1 3 1221 1 1 11 LYS O O 3.205 -3.265 -2.606 1.00 . A A . 11 LYS O 1 1 3 1222 1 1 12 ARG C C 6.133 -1.276 -3.398 1.00 . A A . 12 ARG C 1 1 3 1223 1 1 12 ARG CA C 5.874 -2.734 -3.051 1.00 . A A . 12 ARG CA 1 1 3 1224 1 1 12 ARG CB C 7.197 -3.512 -3.001 1.00 . A A . 12 ARG CB 1 1 3 1225 1 1 12 ARG CD C 9.365 -4.090 -4.140 1.00 . A A . 12 ARG CD 1 1 3 1226 1 1 12 ARG CG C 7.994 -3.453 -4.293 1.00 . A A . 12 ARG CG 1 1 3 1227 1 1 12 ARG CZ C 11.507 -4.098 -5.369 1.00 . A A . 12 ARG CZ 1 1 3 1228 1 1 12 ARG H H 5.280 -3.565 -4.904 1.00 . A A . 12 ARG H 1 1 3 1229 1 1 12 ARG HA H 5.405 -2.775 -2.082 1.00 . A A . 12 ARG HA 1 1 3 1230 1 1 12 ARG HB2 H 7.809 -3.108 -2.209 1.00 . A A . 12 ARG HB2 1 1 3 1231 1 1 12 ARG HB3 H 6.982 -4.549 -2.785 1.00 . A A . 12 ARG HB3 1 1 3 1232 1 1 12 ARG HD2 H 9.856 -3.660 -3.278 1.00 . A A . 12 ARG HD2 1 1 3 1233 1 1 12 ARG HD3 H 9.242 -5.153 -3.992 1.00 . A A . 12 ARG HD3 1 1 3 1234 1 1 12 ARG HE H 9.748 -3.507 -6.123 1.00 . A A . 12 ARG HE 1 1 3 1235 1 1 12 ARG HG2 H 7.451 -3.980 -5.062 1.00 . A A . 12 ARG HG2 1 1 3 1236 1 1 12 ARG HG3 H 8.116 -2.418 -4.581 1.00 . A A . 12 ARG HG3 1 1 3 1237 1 1 12 ARG HH11 H 11.627 -4.841 -3.487 1.00 . A A . 12 ARG HH11 1 1 3 1238 1 1 12 ARG HH12 H 13.122 -4.790 -4.361 1.00 . A A . 12 ARG HH12 1 1 3 1239 1 1 12 ARG HH21 H 13.178 -3.989 -6.508 1.00 . A A . 12 ARG HH21 1 1 3 1240 1 1 12 ARG HH22 H 11.727 -3.412 -7.263 1.00 . A A . 12 ARG HH22 1 1 3 1241 1 1 12 ARG N N 4.956 -3.327 -4.011 1.00 . A A . 12 ARG N 1 1 3 1242 1 1 12 ARG NE N 10.195 -3.867 -5.321 1.00 . A A . 12 ARG NE 1 1 3 1243 1 1 12 ARG NH1 N 12.135 -4.619 -4.321 1.00 . A A . 12 ARG NH1 1 1 3 1244 1 1 12 ARG NH2 N 12.190 -3.814 -6.469 1.00 . A A . 12 ARG NH2 1 1 3 1245 1 1 12 ARG O O 6.247 -0.914 -4.570 1.00 . A A . 12 ARG O 1 1 3 1246 1 1 13 PHE C C 7.604 1.455 -1.756 1.00 . A A . 13 PHE C 1 1 3 1247 1 1 13 PHE CA C 6.398 0.983 -2.555 1.00 . A A . 13 PHE CA 1 1 3 1248 1 1 13 PHE CB C 5.140 1.727 -2.106 1.00 . A A . 13 PHE CB 1 1 3 1249 1 1 13 PHE CD1 C 3.517 1.912 -4.007 1.00 . A A . 13 PHE CD1 1 1 3 1250 1 1 13 PHE CD2 C 3.145 0.232 -2.360 1.00 . A A . 13 PHE CD2 1 1 3 1251 1 1 13 PHE CE1 C 2.389 1.500 -4.686 1.00 . A A . 13 PHE CE1 1 1 3 1252 1 1 13 PHE CE2 C 2.017 -0.186 -3.032 1.00 . A A . 13 PHE CE2 1 1 3 1253 1 1 13 PHE CG C 3.906 1.284 -2.838 1.00 . A A . 13 PHE CG 1 1 3 1254 1 1 13 PHE CZ C 1.637 0.449 -4.197 1.00 . A A . 13 PHE CZ 1 1 3 1255 1 1 13 PHE H H 6.126 -0.798 -1.461 1.00 . A A . 13 PHE H 1 1 3 1256 1 1 13 PHE HA H 6.566 1.173 -3.604 1.00 . A A . 13 PHE HA 1 1 3 1257 1 1 13 PHE HB2 H 4.981 1.554 -1.052 1.00 . A A . 13 PHE HB2 1 1 3 1258 1 1 13 PHE HB3 H 5.269 2.785 -2.280 1.00 . A A . 13 PHE HB3 1 1 3 1259 1 1 13 PHE HD1 H 4.105 2.732 -4.389 1.00 . A A . 13 PHE HD1 1 1 3 1260 1 1 13 PHE HD2 H 3.445 -0.266 -1.449 1.00 . A A . 13 PHE HD2 1 1 3 1261 1 1 13 PHE HE1 H 2.095 1.997 -5.598 1.00 . A A . 13 PHE HE1 1 1 3 1262 1 1 13 PHE HE2 H 1.430 -1.008 -2.647 1.00 . A A . 13 PHE HE2 1 1 3 1263 1 1 13 PHE HZ H 0.754 0.124 -4.725 1.00 . A A . 13 PHE HZ 1 1 3 1264 1 1 13 PHE N N 6.210 -0.444 -2.375 1.00 . A A . 13 PHE N 1 1 3 1265 1 1 13 PHE O O 7.976 0.840 -0.760 1.00 . A A . 13 PHE O 1 1 3 1266 1 1 14 THR C C 8.937 4.185 -0.539 1.00 . A A . 14 THR C 1 1 3 1267 1 1 14 THR CA C 9.371 3.095 -1.515 1.00 . A A . 14 THR CA 1 1 3 1268 1 1 14 THR CB C 10.392 3.672 -2.515 1.00 . A A . 14 THR CB 1 1 3 1269 1 1 14 THR CG2 C 11.185 2.564 -3.191 1.00 . A A . 14 THR CG2 1 1 3 1270 1 1 14 THR H H 7.912 2.958 -3.035 1.00 . A A . 14 THR H 1 1 3 1271 1 1 14 THR HA H 9.850 2.301 -0.960 1.00 . A A . 14 THR HA 1 1 3 1272 1 1 14 THR HB H 11.077 4.311 -1.978 1.00 . A A . 14 THR HB 1 1 3 1273 1 1 14 THR HG1 H 10.360 4.846 -4.106 1.00 . A A . 14 THR HG1 1 1 3 1274 1 1 14 THR HG21 H 11.892 2.998 -3.882 1.00 . A A . 14 THR HG21 1 1 3 1275 1 1 14 THR HG22 H 10.510 1.915 -3.728 1.00 . A A . 14 THR HG22 1 1 3 1276 1 1 14 THR HG23 H 11.716 1.991 -2.444 1.00 . A A . 14 THR HG23 1 1 3 1277 1 1 14 THR N N 8.225 2.531 -2.207 1.00 . A A . 14 THR N 1 1 3 1278 1 1 14 THR O O 9.762 4.778 0.155 1.00 . A A . 14 THR O 1 1 3 1279 1 1 14 THR OG1 O 9.711 4.451 -3.509 1.00 . A A . 14 THR OG1 1 1 3 1280 1 1 15 ARG C C 5.817 4.951 1.060 1.00 . A A . 15 ARG C 1 1 3 1281 1 1 15 ARG CA C 7.083 5.467 0.385 1.00 . A A . 15 ARG CA 1 1 3 1282 1 1 15 ARG CB C 6.770 6.735 -0.416 1.00 . A A . 15 ARG CB 1 1 3 1283 1 1 15 ARG CD C 8.982 7.874 -0.029 1.00 . A A . 15 ARG CD 1 1 3 1284 1 1 15 ARG CG C 7.988 7.373 -1.062 1.00 . A A . 15 ARG CG 1 1 3 1285 1 1 15 ARG CZ C 10.693 9.608 -0.422 1.00 . A A . 15 ARG CZ 1 1 3 1286 1 1 15 ARG H H 7.024 3.909 -1.041 1.00 . A A . 15 ARG H 1 1 3 1287 1 1 15 ARG HA H 7.820 5.694 1.141 1.00 . A A . 15 ARG HA 1 1 3 1288 1 1 15 ARG HB2 H 6.068 6.486 -1.197 1.00 . A A . 15 ARG HB2 1 1 3 1289 1 1 15 ARG HB3 H 6.317 7.460 0.243 1.00 . A A . 15 ARG HB3 1 1 3 1290 1 1 15 ARG HD2 H 8.520 8.655 0.548 1.00 . A A . 15 ARG HD2 1 1 3 1291 1 1 15 ARG HD3 H 9.248 7.056 0.624 1.00 . A A . 15 ARG HD3 1 1 3 1292 1 1 15 ARG HE H 10.673 7.798 -1.268 1.00 . A A . 15 ARG HE 1 1 3 1293 1 1 15 ARG HG2 H 8.474 6.639 -1.685 1.00 . A A . 15 ARG HG2 1 1 3 1294 1 1 15 ARG HG3 H 7.663 8.204 -1.670 1.00 . A A . 15 ARG HG3 1 1 3 1295 1 1 15 ARG HH11 H 9.219 10.172 0.853 1.00 . A A . 15 ARG HH11 1 1 3 1296 1 1 15 ARG HH12 H 10.450 11.358 0.570 1.00 . A A . 15 ARG HH12 1 1 3 1297 1 1 15 ARG HH21 H 12.290 9.356 -1.641 1.00 . A A . 15 ARG HH21 1 1 3 1298 1 1 15 ARG HH22 H 12.194 10.895 -0.851 1.00 . A A . 15 ARG HH22 1 1 3 1299 1 1 15 ARG N N 7.635 4.438 -0.487 1.00 . A A . 15 ARG N 1 1 3 1300 1 1 15 ARG NE N 10.196 8.395 -0.650 1.00 . A A . 15 ARG NE 1 1 3 1301 1 1 15 ARG NH1 N 10.071 10.446 0.398 1.00 . A A . 15 ARG NH1 1 1 3 1302 1 1 15 ARG NH2 N 11.815 9.983 -1.018 1.00 . A A . 15 ARG NH2 1 1 3 1303 1 1 15 ARG O O 4.954 4.347 0.414 1.00 . A A . 15 ARG O 1 1 3 1304 1 1 16 SER C C 3.298 5.343 2.699 1.00 . A A . 16 SER C 1 1 3 1305 1 1 16 SER CA C 4.603 4.709 3.160 1.00 . A A . 16 SER CA 1 1 3 1306 1 1 16 SER CB C 4.829 5.000 4.649 1.00 . A A . 16 SER CB 1 1 3 1307 1 1 16 SER H H 6.432 5.711 2.804 1.00 . A A . 16 SER H 1 1 3 1308 1 1 16 SER HA H 4.537 3.640 3.021 1.00 . A A . 16 SER HA 1 1 3 1309 1 1 16 SER HB2 H 5.766 4.564 4.961 1.00 . A A . 16 SER HB2 1 1 3 1310 1 1 16 SER HB3 H 4.863 6.068 4.805 1.00 . A A . 16 SER HB3 1 1 3 1311 1 1 16 SER HG H 4.133 4.256 6.326 1.00 . A A . 16 SER HG 1 1 3 1312 1 1 16 SER N N 5.723 5.192 2.364 1.00 . A A . 16 SER N 1 1 3 1313 1 1 16 SER O O 2.264 4.689 2.681 1.00 . A A . 16 SER O 1 1 3 1314 1 1 16 SER OG O 3.789 4.455 5.447 1.00 . A A . 16 SER OG 1 1 3 1315 1 1 17 ASP C C 1.668 6.745 0.538 1.00 . A A . 17 ASP C 1 1 3 1316 1 1 17 ASP CA C 2.185 7.333 1.847 1.00 . A A . 17 ASP CA 1 1 3 1317 1 1 17 ASP CB C 2.500 8.826 1.693 1.00 . A A . 17 ASP CB 1 1 3 1318 1 1 17 ASP CG C 3.769 9.097 0.907 1.00 . A A . 17 ASP CG 1 1 3 1319 1 1 17 ASP H H 4.224 7.078 2.344 1.00 . A A . 17 ASP H 1 1 3 1320 1 1 17 ASP HA H 1.416 7.218 2.595 1.00 . A A . 17 ASP HA 1 1 3 1321 1 1 17 ASP HB2 H 1.681 9.303 1.181 1.00 . A A . 17 ASP HB2 1 1 3 1322 1 1 17 ASP HB3 H 2.606 9.265 2.673 1.00 . A A . 17 ASP HB3 1 1 3 1323 1 1 17 ASP N N 3.361 6.610 2.315 1.00 . A A . 17 ASP N 1 1 3 1324 1 1 17 ASP O O 0.459 6.699 0.304 1.00 . A A . 17 ASP O 1 1 3 1325 1 1 17 ASP OD1 O 3.676 9.668 -0.203 1.00 . A A . 17 ASP OD1 1 1 3 1326 1 1 17 ASP OD2 O 4.860 8.718 1.378 1.00 . A A . 17 ASP OD2 1 1 3 1327 1 1 18 GLU C C 1.473 4.284 -1.174 1.00 . A A . 18 GLU C 1 1 3 1328 1 1 18 GLU CA C 2.212 5.569 -1.519 1.00 . A A . 18 GLU CA 1 1 3 1329 1 1 18 GLU CB C 3.450 5.239 -2.355 1.00 . A A . 18 GLU CB 1 1 3 1330 1 1 18 GLU CD C 3.315 7.199 -3.940 1.00 . A A . 18 GLU CD 1 1 3 1331 1 1 18 GLU CG C 4.157 6.452 -2.928 1.00 . A A . 18 GLU CG 1 1 3 1332 1 1 18 GLU H H 3.531 6.389 -0.084 1.00 . A A . 18 GLU H 1 1 3 1333 1 1 18 GLU HA H 1.557 6.210 -2.088 1.00 . A A . 18 GLU HA 1 1 3 1334 1 1 18 GLU HB2 H 4.154 4.706 -1.735 1.00 . A A . 18 GLU HB2 1 1 3 1335 1 1 18 GLU HB3 H 3.153 4.603 -3.174 1.00 . A A . 18 GLU HB3 1 1 3 1336 1 1 18 GLU HG2 H 4.397 7.128 -2.119 1.00 . A A . 18 GLU HG2 1 1 3 1337 1 1 18 GLU HG3 H 5.068 6.125 -3.407 1.00 . A A . 18 GLU HG3 1 1 3 1338 1 1 18 GLU N N 2.584 6.269 -0.297 1.00 . A A . 18 GLU N 1 1 3 1339 1 1 18 GLU O O 0.406 3.998 -1.724 1.00 . A A . 18 GLU O 1 1 3 1340 1 1 18 GLU OE1 O 2.928 8.350 -3.667 1.00 . A A . 18 GLU OE1 1 1 3 1341 1 1 18 GLU OE2 O 3.031 6.633 -5.015 1.00 . A A . 18 GLU OE2 1 1 3 1342 1 1 19 LEU C C 0.087 2.508 0.851 1.00 . A A . 19 LEU C 1 1 3 1343 1 1 19 LEU CA C 1.436 2.270 0.188 1.00 . A A . 19 LEU CA 1 1 3 1344 1 1 19 LEU CB C 2.358 1.520 1.151 1.00 . A A . 19 LEU CB 1 1 3 1345 1 1 19 LEU CD1 C 1.337 -0.741 0.734 1.00 . A A . 19 LEU CD1 1 1 3 1346 1 1 19 LEU CD2 C 2.692 -0.350 2.797 1.00 . A A . 19 LEU CD2 1 1 3 1347 1 1 19 LEU CG C 1.735 0.275 1.795 1.00 . A A . 19 LEU CG 1 1 3 1348 1 1 19 LEU H H 2.884 3.816 0.168 1.00 . A A . 19 LEU H 1 1 3 1349 1 1 19 LEU HA H 1.283 1.664 -0.692 1.00 . A A . 19 LEU HA 1 1 3 1350 1 1 19 LEU HB2 H 3.245 1.221 0.611 1.00 . A A . 19 LEU HB2 1 1 3 1351 1 1 19 LEU HB3 H 2.647 2.197 1.938 1.00 . A A . 19 LEU HB3 1 1 3 1352 1 1 19 LEU HD11 H 2.218 -1.069 0.200 1.00 . A A . 19 LEU HD11 1 1 3 1353 1 1 19 LEU HD12 H 0.645 -0.288 0.041 1.00 . A A . 19 LEU HD12 1 1 3 1354 1 1 19 LEU HD13 H 0.866 -1.589 1.207 1.00 . A A . 19 LEU HD13 1 1 3 1355 1 1 19 LEU HD21 H 3.034 0.407 3.489 1.00 . A A . 19 LEU HD21 1 1 3 1356 1 1 19 LEU HD22 H 3.539 -0.770 2.273 1.00 . A A . 19 LEU HD22 1 1 3 1357 1 1 19 LEU HD23 H 2.183 -1.131 3.340 1.00 . A A . 19 LEU HD23 1 1 3 1358 1 1 19 LEU HG H 0.838 0.567 2.327 1.00 . A A . 19 LEU HG 1 1 3 1359 1 1 19 LEU N N 2.038 3.524 -0.241 1.00 . A A . 19 LEU N 1 1 3 1360 1 1 19 LEU O O -0.844 1.742 0.650 1.00 . A A . 19 LEU O 1 1 3 1361 1 1 20 GLN C C -2.352 4.209 1.307 1.00 . A A . 20 GLN C 1 1 3 1362 1 1 20 GLN CA C -1.260 3.897 2.320 1.00 . A A . 20 GLN CA 1 1 3 1363 1 1 20 GLN CB C -1.063 5.080 3.267 1.00 . A A . 20 GLN CB 1 1 3 1364 1 1 20 GLN CD C 0.119 5.981 5.313 1.00 . A A . 20 GLN CD 1 1 3 1365 1 1 20 GLN CG C -0.143 4.773 4.440 1.00 . A A . 20 GLN CG 1 1 3 1366 1 1 20 GLN H H 0.775 4.137 1.779 1.00 . A A . 20 GLN H 1 1 3 1367 1 1 20 GLN HA H -1.559 3.034 2.895 1.00 . A A . 20 GLN HA 1 1 3 1368 1 1 20 GLN HB2 H -0.640 5.904 2.713 1.00 . A A . 20 GLN HB2 1 1 3 1369 1 1 20 GLN HB3 H -2.023 5.376 3.659 1.00 . A A . 20 GLN HB3 1 1 3 1370 1 1 20 GLN HE21 H 1.948 5.321 5.713 1.00 . A A . 20 GLN HE21 1 1 3 1371 1 1 20 GLN HE22 H 1.505 6.815 6.462 1.00 . A A . 20 GLN HE22 1 1 3 1372 1 1 20 GLN HG2 H -0.598 4.006 5.045 1.00 . A A . 20 GLN HG2 1 1 3 1373 1 1 20 GLN HG3 H 0.801 4.414 4.056 1.00 . A A . 20 GLN HG3 1 1 3 1374 1 1 20 GLN N N -0.013 3.566 1.642 1.00 . A A . 20 GLN N 1 1 3 1375 1 1 20 GLN NE2 N 1.308 6.047 5.886 1.00 . A A . 20 GLN NE2 1 1 3 1376 1 1 20 GLN O O -3.485 3.733 1.429 1.00 . A A . 20 GLN O 1 1 3 1377 1 1 20 GLN OE1 O -0.736 6.857 5.459 1.00 . A A . 20 GLN OE1 1 1 3 1378 1 1 21 ARG C C -3.380 4.031 -1.470 1.00 . A A . 21 ARG C 1 1 3 1379 1 1 21 ARG CA C -2.940 5.312 -0.773 1.00 . A A . 21 ARG CA 1 1 3 1380 1 1 21 ARG CB C -2.304 6.263 -1.786 1.00 . A A . 21 ARG CB 1 1 3 1381 1 1 21 ARG CD C -2.588 7.684 -3.836 1.00 . A A . 21 ARG CD 1 1 3 1382 1 1 21 ARG CG C -3.290 6.816 -2.803 1.00 . A A . 21 ARG CG 1 1 3 1383 1 1 21 ARG CZ C -0.342 7.056 -4.654 1.00 . A A . 21 ARG CZ 1 1 3 1384 1 1 21 ARG H H -1.093 5.378 0.271 1.00 . A A . 21 ARG H 1 1 3 1385 1 1 21 ARG HA H -3.802 5.788 -0.334 1.00 . A A . 21 ARG HA 1 1 3 1386 1 1 21 ARG HB2 H -1.858 7.090 -1.258 1.00 . A A . 21 ARG HB2 1 1 3 1387 1 1 21 ARG HB3 H -1.531 5.733 -2.321 1.00 . A A . 21 ARG HB3 1 1 3 1388 1 1 21 ARG HD2 H -3.332 8.139 -4.472 1.00 . A A . 21 ARG HD2 1 1 3 1389 1 1 21 ARG HD3 H -2.034 8.456 -3.325 1.00 . A A . 21 ARG HD3 1 1 3 1390 1 1 21 ARG HE H -2.065 6.236 -5.269 1.00 . A A . 21 ARG HE 1 1 3 1391 1 1 21 ARG HG2 H -3.774 5.992 -3.306 1.00 . A A . 21 ARG HG2 1 1 3 1392 1 1 21 ARG HG3 H -4.028 7.411 -2.287 1.00 . A A . 21 ARG HG3 1 1 3 1393 1 1 21 ARG HH11 H -0.338 8.495 -3.227 1.00 . A A . 21 ARG HH11 1 1 3 1394 1 1 21 ARG HH12 H 1.228 8.050 -3.835 1.00 . A A . 21 ARG HH12 1 1 3 1395 1 1 21 ARG HH21 H -0.002 5.640 -6.063 1.00 . A A . 21 ARG HH21 1 1 3 1396 1 1 21 ARG HH22 H 1.422 6.426 -5.438 1.00 . A A . 21 ARG HH22 1 1 3 1397 1 1 21 ARG N N -2.003 4.996 0.295 1.00 . A A . 21 ARG N 1 1 3 1398 1 1 21 ARG NE N -1.667 6.905 -4.664 1.00 . A A . 21 ARG NE 1 1 3 1399 1 1 21 ARG NH1 N 0.225 7.937 -3.841 1.00 . A A . 21 ARG NH1 1 1 3 1400 1 1 21 ARG NH2 N 0.416 6.317 -5.449 1.00 . A A . 21 ARG NH2 1 1 3 1401 1 1 21 ARG O O -4.574 3.796 -1.672 1.00 . A A . 21 ARG O 1 1 3 1402 1 1 22 HIS C C -3.554 1.046 -1.549 1.00 . A A . 22 HIS C 1 1 3 1403 1 1 22 HIS CA C -2.674 1.915 -2.445 1.00 . A A . 22 HIS CA 1 1 3 1404 1 1 22 HIS CB C -1.366 1.176 -2.756 1.00 . A A . 22 HIS CB 1 1 3 1405 1 1 22 HIS CD2 C -1.818 -1.350 -2.475 1.00 . A A . 22 HIS CD2 1 1 3 1406 1 1 22 HIS CE1 C -2.076 -1.900 -4.563 1.00 . A A . 22 HIS CE1 1 1 3 1407 1 1 22 HIS CG C -1.599 -0.229 -3.210 1.00 . A A . 22 HIS CG 1 1 3 1408 1 1 22 HIS H H -1.469 3.447 -1.633 1.00 . A A . 22 HIS H 1 1 3 1409 1 1 22 HIS HA H -3.198 2.108 -3.369 1.00 . A A . 22 HIS HA 1 1 3 1410 1 1 22 HIS HB2 H -0.836 1.700 -3.537 1.00 . A A . 22 HIS HB2 1 1 3 1411 1 1 22 HIS HB3 H -0.754 1.144 -1.866 1.00 . A A . 22 HIS HB3 1 1 3 1412 1 1 22 HIS HD1 H -1.651 -0.008 -5.319 1.00 . A A . 22 HIS HD1 1 1 3 1413 1 1 22 HIS HD2 H -1.744 -1.443 -1.400 1.00 . A A . 22 HIS HD2 1 1 3 1414 1 1 22 HIS HE1 H -2.266 -2.475 -5.456 1.00 . A A . 22 HIS HE1 1 1 3 1415 1 1 22 HIS N N -2.403 3.194 -1.812 1.00 . A A . 22 HIS N 1 1 3 1416 1 1 22 HIS ND1 N -1.751 -0.599 -4.539 1.00 . A A . 22 HIS ND1 1 1 3 1417 1 1 22 HIS NE2 N -2.124 -2.368 -3.344 1.00 . A A . 22 HIS NE2 1 1 3 1418 1 1 22 HIS O O -4.511 0.433 -2.008 1.00 . A A . 22 HIS O 1 1 3 1419 1 1 23 LYS C C -5.396 0.537 0.717 1.00 . A A . 23 LYS C 1 1 3 1420 1 1 23 LYS CA C -3.913 0.194 0.709 1.00 . A A . 23 LYS CA 1 1 3 1421 1 1 23 LYS CB C -3.297 0.439 2.089 1.00 . A A . 23 LYS CB 1 1 3 1422 1 1 23 LYS CD C -3.668 -1.867 3.030 1.00 . A A . 23 LYS CD 1 1 3 1423 1 1 23 LYS CE C -3.767 -2.613 4.350 1.00 . A A . 23 LYS CE 1 1 3 1424 1 1 23 LYS CG C -3.896 -0.378 3.220 1.00 . A A . 23 LYS CG 1 1 3 1425 1 1 23 LYS H H -2.426 1.520 0.016 1.00 . A A . 23 LYS H 1 1 3 1426 1 1 23 LYS HA H -3.794 -0.845 0.444 1.00 . A A . 23 LYS HA 1 1 3 1427 1 1 23 LYS HB2 H -2.243 0.212 2.038 1.00 . A A . 23 LYS HB2 1 1 3 1428 1 1 23 LYS HB3 H -3.414 1.486 2.334 1.00 . A A . 23 LYS HB3 1 1 3 1429 1 1 23 LYS HD2 H -4.415 -2.253 2.353 1.00 . A A . 23 LYS HD2 1 1 3 1430 1 1 23 LYS HD3 H -2.684 -2.022 2.611 1.00 . A A . 23 LYS HD3 1 1 3 1431 1 1 23 LYS HE2 H -3.746 -3.672 4.150 1.00 . A A . 23 LYS HE2 1 1 3 1432 1 1 23 LYS HE3 H -2.915 -2.347 4.962 1.00 . A A . 23 LYS HE3 1 1 3 1433 1 1 23 LYS HG2 H -3.443 -0.074 4.150 1.00 . A A . 23 LYS HG2 1 1 3 1434 1 1 23 LYS HG3 H -4.959 -0.191 3.256 1.00 . A A . 23 LYS HG3 1 1 3 1435 1 1 23 LYS HZ1 H -5.852 -2.501 4.510 1.00 . A A . 23 LYS HZ1 1 1 3 1436 1 1 23 LYS HZ2 H -5.033 -1.280 5.346 1.00 . A A . 23 LYS HZ2 1 1 3 1437 1 1 23 LYS HZ3 H -5.065 -2.853 5.968 1.00 . A A . 23 LYS HZ3 1 1 3 1438 1 1 23 LYS N N -3.205 0.997 -0.276 1.00 . A A . 23 LYS N 1 1 3 1439 1 1 23 LYS NZ N -5.015 -2.288 5.094 1.00 . A A . 23 LYS NZ 1 1 3 1440 1 1 23 LYS O O -6.247 -0.331 0.921 1.00 . A A . 23 LYS O 1 1 3 1441 1 1 24 ARG C C -7.868 1.782 -0.756 1.00 . A A . 24 ARG C 1 1 3 1442 1 1 24 ARG CA C -7.074 2.276 0.459 1.00 . A A . 24 ARG CA 1 1 3 1443 1 1 24 ARG CB C -7.101 3.802 0.549 1.00 . A A . 24 ARG CB 1 1 3 1444 1 1 24 ARG CD C -6.578 5.840 1.935 1.00 . A A . 24 ARG CD 1 1 3 1445 1 1 24 ARG CG C -6.624 4.322 1.896 1.00 . A A . 24 ARG CG 1 1 3 1446 1 1 24 ARG CZ C -5.756 7.566 3.501 1.00 . A A . 24 ARG CZ 1 1 3 1447 1 1 24 ARG H H -4.975 2.433 0.218 1.00 . A A . 24 ARG H 1 1 3 1448 1 1 24 ARG HA H -7.537 1.874 1.347 1.00 . A A . 24 ARG HA 1 1 3 1449 1 1 24 ARG HB2 H -6.462 4.211 -0.220 1.00 . A A . 24 ARG HB2 1 1 3 1450 1 1 24 ARG HB3 H -8.111 4.147 0.390 1.00 . A A . 24 ARG HB3 1 1 3 1451 1 1 24 ARG HD2 H -5.856 6.187 1.211 1.00 . A A . 24 ARG HD2 1 1 3 1452 1 1 24 ARG HD3 H -7.554 6.224 1.682 1.00 . A A . 24 ARG HD3 1 1 3 1453 1 1 24 ARG HE H -6.299 5.710 4.015 1.00 . A A . 24 ARG HE 1 1 3 1454 1 1 24 ARG HG2 H -7.299 3.973 2.664 1.00 . A A . 24 ARG HG2 1 1 3 1455 1 1 24 ARG HG3 H -5.633 3.937 2.087 1.00 . A A . 24 ARG HG3 1 1 3 1456 1 1 24 ARG HH11 H -5.263 9.355 2.690 1.00 . A A . 24 ARG HH11 1 1 3 1457 1 1 24 ARG HH12 H -5.819 8.158 1.565 1.00 . A A . 24 ARG HH12 1 1 3 1458 1 1 24 ARG HH21 H -5.132 8.865 4.924 1.00 . A A . 24 ARG HH21 1 1 3 1459 1 1 24 ARG HH22 H -5.592 7.295 5.506 1.00 . A A . 24 ARG HH22 1 1 3 1460 1 1 24 ARG N N -5.700 1.800 0.441 1.00 . A A . 24 ARG N 1 1 3 1461 1 1 24 ARG NE N -6.200 6.335 3.260 1.00 . A A . 24 ARG NE 1 1 3 1462 1 1 24 ARG NH1 N -5.599 8.428 2.505 1.00 . A A . 24 ARG NH1 1 1 3 1463 1 1 24 ARG NH2 N -5.468 7.938 4.743 1.00 . A A . 24 ARG NH2 1 1 3 1464 1 1 24 ARG O O -9.049 2.104 -0.899 1.00 . A A . 24 ARG O 1 1 3 1465 1 1 25 THR C C -8.629 -0.905 -2.181 1.00 . A A . 25 THR C 1 1 3 1466 1 1 25 THR CA C -7.948 0.347 -2.714 1.00 . A A . 25 THR CA 1 1 3 1467 1 1 25 THR CB C -7.034 -0.053 -3.895 1.00 . A A . 25 THR CB 1 1 3 1468 1 1 25 THR CG2 C -6.298 1.151 -4.459 1.00 . A A . 25 THR CG2 1 1 3 1469 1 1 25 THR H H -6.258 0.874 -1.545 1.00 . A A . 25 THR H 1 1 3 1470 1 1 25 THR HA H -8.701 1.030 -3.077 1.00 . A A . 25 THR HA 1 1 3 1471 1 1 25 THR HB H -7.652 -0.472 -4.676 1.00 . A A . 25 THR HB 1 1 3 1472 1 1 25 THR HG1 H -5.307 -0.604 -3.099 1.00 . A A . 25 THR HG1 1 1 3 1473 1 1 25 THR HG21 H -7.014 1.862 -4.841 1.00 . A A . 25 THR HG21 1 1 3 1474 1 1 25 THR HG22 H -5.645 0.831 -5.258 1.00 . A A . 25 THR HG22 1 1 3 1475 1 1 25 THR HG23 H -5.712 1.611 -3.678 1.00 . A A . 25 THR HG23 1 1 3 1476 1 1 25 THR N N -7.229 1.003 -1.630 1.00 . A A . 25 THR N 1 1 3 1477 1 1 25 THR O O -9.693 -1.305 -2.658 1.00 . A A . 25 THR O 1 1 3 1478 1 1 25 THR OG1 O -6.083 -1.042 -3.481 1.00 . A A . 25 THR OG1 1 1 3 1479 1 1 26 HIS C C -9.333 -2.334 0.679 1.00 . A A . 26 HIS C 1 1 3 1480 1 1 26 HIS CA C -8.545 -2.717 -0.562 1.00 . A A . 26 HIS CA 1 1 3 1481 1 1 26 HIS CB C -7.434 -3.688 -0.146 1.00 . A A . 26 HIS CB 1 1 3 1482 1 1 26 HIS CD2 C -5.082 -3.714 -1.210 1.00 . A A . 26 HIS CD2 1 1 3 1483 1 1 26 HIS CE1 C -5.484 -4.908 -2.987 1.00 . A A . 26 HIS CE1 1 1 3 1484 1 1 26 HIS CG C -6.410 -3.997 -1.195 1.00 . A A . 26 HIS CG 1 1 3 1485 1 1 26 HIS H H -7.149 -1.159 -0.860 1.00 . A A . 26 HIS H 1 1 3 1486 1 1 26 HIS HA H -9.200 -3.199 -1.268 1.00 . A A . 26 HIS HA 1 1 3 1487 1 1 26 HIS HB2 H -6.908 -3.270 0.699 1.00 . A A . 26 HIS HB2 1 1 3 1488 1 1 26 HIS HB3 H -7.886 -4.622 0.155 1.00 . A A . 26 HIS HB3 1 1 3 1489 1 1 26 HIS HD1 H -7.529 -5.108 -2.622 1.00 . A A . 26 HIS HD1 1 1 3 1490 1 1 26 HIS HD2 H -4.541 -3.132 -0.477 1.00 . A A . 26 HIS HD2 1 1 3 1491 1 1 26 HIS HE1 H -5.350 -5.459 -3.906 1.00 . A A . 26 HIS HE1 1 1 3 1492 1 1 26 HIS N N -8.001 -1.521 -1.184 1.00 . A A . 26 HIS N 1 1 3 1493 1 1 26 HIS ND1 N -6.657 -4.751 -2.339 1.00 . A A . 26 HIS ND1 1 1 3 1494 1 1 26 HIS NE2 N -4.534 -4.298 -2.331 1.00 . A A . 26 HIS NE2 1 1 3 1495 1 1 26 HIS O O -10.478 -2.741 0.861 1.00 . A A . 26 HIS O 1 1 3 1496 1 1 27 THR C C -9.944 0.210 2.708 1.00 . A A . 27 THR C 1 1 3 1497 1 1 27 THR CA C -9.280 -1.161 2.800 1.00 . A A . 27 THR CA 1 1 3 1498 1 1 27 THR CB C -8.201 -1.150 3.898 1.00 . A A . 27 THR CB 1 1 3 1499 1 1 27 THR CG2 C -8.827 -1.007 5.278 1.00 . A A . 27 THR CG2 1 1 3 1500 1 1 27 THR H H -7.819 -1.188 1.288 1.00 . A A . 27 THR H 1 1 3 1501 1 1 27 THR HA H -10.025 -1.899 3.062 1.00 . A A . 27 THR HA 1 1 3 1502 1 1 27 THR HB H -7.541 -0.313 3.728 1.00 . A A . 27 THR HB 1 1 3 1503 1 1 27 THR HG1 H -8.028 -3.094 3.588 1.00 . A A . 27 THR HG1 1 1 3 1504 1 1 27 THR HG21 H -8.047 -0.952 6.023 1.00 . A A . 27 THR HG21 1 1 3 1505 1 1 27 THR HG22 H -9.453 -1.863 5.478 1.00 . A A . 27 THR HG22 1 1 3 1506 1 1 27 THR HG23 H -9.424 -0.108 5.313 1.00 . A A . 27 THR HG23 1 1 3 1507 1 1 27 THR N N -8.703 -1.540 1.530 1.00 . A A . 27 THR N 1 1 3 1508 1 1 27 THR O O -9.332 1.240 3.006 1.00 . A A . 27 THR O 1 1 3 1509 1 1 27 THR OG1 O -7.444 -2.370 3.842 1.00 . A A . 27 THR OG1 1 1 3 1510 1 1 28 GLY C C -13.388 1.198 2.628 1.00 . A A . 28 GLY C 1 1 3 1511 1 1 28 GLY CA C -11.958 1.433 2.205 1.00 . A A . 28 GLY CA 1 1 3 1512 1 1 28 GLY H H -11.598 -0.636 1.996 1.00 . A A . 28 GLY H 1 1 3 1513 1 1 28 GLY HA2 H -11.511 2.167 2.859 1.00 . A A . 28 GLY HA2 1 1 3 1514 1 1 28 GLY HA3 H -11.945 1.806 1.192 1.00 . A A . 28 GLY HA3 1 1 3 1515 1 1 28 GLY N N -11.189 0.211 2.272 1.00 . A A . 28 GLY N 1 1 3 1516 1 1 28 GLY O O -13.757 1.461 3.774 1.00 . A A . 28 GLY O 1 1 3 1517 1 1 29 GLU C C -15.769 -1.164 1.744 1.00 . A A . 29 GLU C 1 1 3 1518 1 1 29 GLU CA C -15.562 0.321 2.010 1.00 . A A . 29 GLU CA 1 1 3 1519 1 1 29 GLU CB C -16.535 1.144 1.161 1.00 . A A . 29 GLU CB 1 1 3 1520 1 1 29 GLU CD C -18.946 1.696 0.643 1.00 . A A . 29 GLU CD 1 1 3 1521 1 1 29 GLU CG C -17.993 0.921 1.527 1.00 . A A . 29 GLU CG 1 1 3 1522 1 1 29 GLU H H -13.845 0.540 0.805 1.00 . A A . 29 GLU H 1 1 3 1523 1 1 29 GLU HA H -15.741 0.521 3.056 1.00 . A A . 29 GLU HA 1 1 3 1524 1 1 29 GLU HB2 H -16.307 2.193 1.283 1.00 . A A . 29 GLU HB2 1 1 3 1525 1 1 29 GLU HB3 H -16.404 0.875 0.123 1.00 . A A . 29 GLU HB3 1 1 3 1526 1 1 29 GLU HG2 H -18.216 -0.131 1.432 1.00 . A A . 29 GLU HG2 1 1 3 1527 1 1 29 GLU HG3 H -18.144 1.228 2.552 1.00 . A A . 29 GLU HG3 1 1 3 1528 1 1 29 GLU N N -14.188 0.683 1.711 1.00 . A A . 29 GLU N 1 1 3 1529 1 1 29 GLU O O -16.364 -1.878 2.553 1.00 . A A . 29 GLU O 1 1 3 1530 1 1 29 GLU OE1 O -19.077 2.922 0.835 1.00 . A A . 29 GLU OE1 1 1 3 1531 1 1 29 GLU OE2 O -19.581 1.078 -0.235 1.00 . A A . 29 GLU OE2 1 1 3 1532 1 1 30 LYS C C -14.214 -3.815 0.746 1.00 . A A . 30 LYS C 1 1 3 1533 1 1 30 LYS CA C -15.397 -3.016 0.219 1.00 . A A . 30 LYS CA 1 1 3 1534 1 1 30 LYS CB C -15.480 -3.140 -1.307 1.00 . A A . 30 LYS CB 1 1 3 1535 1 1 30 LYS CD C -17.912 -2.497 -1.401 1.00 . A A . 30 LYS CD 1 1 3 1536 1 1 30 LYS CE C -18.938 -1.561 -2.020 1.00 . A A . 30 LYS CE 1 1 3 1537 1 1 30 LYS CG C -16.519 -2.227 -1.943 1.00 . A A . 30 LYS CG 1 1 3 1538 1 1 30 LYS H H -14.787 -1.007 0.013 1.00 . A A . 30 LYS H 1 1 3 1539 1 1 30 LYS HA H -16.306 -3.400 0.660 1.00 . A A . 30 LYS HA 1 1 3 1540 1 1 30 LYS HB2 H -14.516 -2.898 -1.727 1.00 . A A . 30 LYS HB2 1 1 3 1541 1 1 30 LYS HB3 H -15.726 -4.161 -1.560 1.00 . A A . 30 LYS HB3 1 1 3 1542 1 1 30 LYS HD2 H -18.186 -3.517 -1.626 1.00 . A A . 30 LYS HD2 1 1 3 1543 1 1 30 LYS HD3 H -17.906 -2.351 -0.331 1.00 . A A . 30 LYS HD3 1 1 3 1544 1 1 30 LYS HE2 H -19.908 -1.789 -1.607 1.00 . A A . 30 LYS HE2 1 1 3 1545 1 1 30 LYS HE3 H -18.672 -0.544 -1.774 1.00 . A A . 30 LYS HE3 1 1 3 1546 1 1 30 LYS HG2 H -16.257 -1.201 -1.737 1.00 . A A . 30 LYS HG2 1 1 3 1547 1 1 30 LYS HG3 H -16.520 -2.392 -3.011 1.00 . A A . 30 LYS HG3 1 1 3 1548 1 1 30 LYS HZ1 H -18.089 -1.425 -3.923 1.00 . A A . 30 LYS HZ1 1 1 3 1549 1 1 30 LYS HZ2 H -19.747 -1.096 -3.885 1.00 . A A . 30 LYS HZ2 1 1 3 1550 1 1 30 LYS HZ3 H -19.200 -2.689 -3.758 1.00 . A A . 30 LYS HZ3 1 1 3 1551 1 1 30 LYS N N -15.265 -1.623 0.608 1.00 . A A . 30 LYS N 1 1 3 1552 1 1 30 LYS NZ N -18.997 -1.702 -3.498 1.00 . A A . 30 LYS NZ 1 1 3 1553 1 1 30 LYS O O -14.329 -4.557 1.720 1.00 . A A . 30 LYS O 1 1 3 1554 1 1 31 NH2 HN1 H -13.042 -3.033 -0.652 1.00 . A A . 31 NH2 HN1 1 1 3 1555 1 1 31 NH2 HN2 H -12.275 -4.112 0.456 1.00 . A A . 31 NH2 HN2 1 1 3 1556 1 1 31 NH2 N N -13.063 -3.639 0.120 1.00 . A A . 31 NH2 N 1 1 3 1557 2 2 1 ZN ZN ZN -2.602 -4.229 -2.827 1.00 . B A . 101 ZN ZN 1 1 4 1558 1 1 1 ARG C C 11.797 -1.022 2.556 1.00 . A A . 1 ARG C 1 1 4 1559 1 1 1 ARG CA C 13.041 -1.503 3.295 1.00 . A A . 1 ARG CA 1 1 4 1560 1 1 1 ARG CB C 12.644 -2.360 4.507 1.00 . A A . 1 ARG CB 1 1 4 1561 1 1 1 ARG CD C 11.381 -2.562 6.669 1.00 . A A . 1 ARG CD 1 1 4 1562 1 1 1 ARG CG C 11.724 -1.660 5.494 1.00 . A A . 1 ARG CG 1 1 4 1563 1 1 1 ARG CZ C 9.902 -2.544 8.643 1.00 . A A . 1 ARG CZ 1 1 4 1564 1 1 1 ARG H1 H 14.187 0.183 2.884 1.00 . A A . 1 ARG H1 1 1 4 1565 1 1 1 ARG H2 H 14.677 -0.658 4.267 1.00 . A A . 1 ARG H2 1 1 4 1566 1 1 1 ARG H3 H 13.284 0.298 4.309 1.00 . A A . 1 ARG H3 1 1 4 1567 1 1 1 ARG HA H 13.636 -2.099 2.619 1.00 . A A . 1 ARG HA 1 1 4 1568 1 1 1 ARG HB2 H 12.143 -3.248 4.155 1.00 . A A . 1 ARG HB2 1 1 4 1569 1 1 1 ARG HB3 H 13.542 -2.653 5.032 1.00 . A A . 1 ARG HB3 1 1 4 1570 1 1 1 ARG HD2 H 10.959 -3.483 6.293 1.00 . A A . 1 ARG HD2 1 1 4 1571 1 1 1 ARG HD3 H 12.289 -2.779 7.214 1.00 . A A . 1 ARG HD3 1 1 4 1572 1 1 1 ARG HE H 10.151 -1.012 7.380 1.00 . A A . 1 ARG HE 1 1 4 1573 1 1 1 ARG HG2 H 12.219 -0.775 5.865 1.00 . A A . 1 ARG HG2 1 1 4 1574 1 1 1 ARG HG3 H 10.813 -1.379 4.986 1.00 . A A . 1 ARG HG3 1 1 4 1575 1 1 1 ARG HH11 H 9.865 -4.249 9.741 1.00 . A A . 1 ARG HH11 1 1 4 1576 1 1 1 ARG HH12 H 10.923 -4.274 8.368 1.00 . A A . 1 ARG HH12 1 1 4 1577 1 1 1 ARG HH21 H 8.768 -0.958 9.199 1.00 . A A . 1 ARG HH21 1 1 4 1578 1 1 1 ARG HH22 H 8.635 -2.356 10.216 1.00 . A A . 1 ARG HH22 1 1 4 1579 1 1 1 ARG N N 13.853 -0.342 3.721 1.00 . A A . 1 ARG N 1 1 4 1580 1 1 1 ARG NE N 10.423 -1.937 7.579 1.00 . A A . 1 ARG NE 1 1 4 1581 1 1 1 ARG NH1 N 10.256 -3.789 8.940 1.00 . A A . 1 ARG NH1 1 1 4 1582 1 1 1 ARG NH2 N 9.034 -1.901 9.415 1.00 . A A . 1 ARG NH2 1 1 4 1583 1 1 1 ARG O O 11.243 0.030 2.884 1.00 . A A . 1 ARG O 1 1 4 1584 1 1 2 PRO C C 8.877 -1.601 1.477 1.00 . A A . 2 PRO C 1 1 4 1585 1 1 2 PRO CA C 10.190 -1.387 0.734 1.00 . A A . 2 PRO CA 1 1 4 1586 1 1 2 PRO CB C 10.271 -2.309 -0.481 1.00 . A A . 2 PRO CB 1 1 4 1587 1 1 2 PRO CD C 11.959 -3.030 1.056 1.00 . A A . 2 PRO CD 1 1 4 1588 1 1 2 PRO CG C 10.995 -3.515 0.005 1.00 . A A . 2 PRO CG 1 1 4 1589 1 1 2 PRO HA H 10.253 -0.357 0.412 1.00 . A A . 2 PRO HA 1 1 4 1590 1 1 2 PRO HB2 H 9.272 -2.555 -0.816 1.00 . A A . 2 PRO HB2 1 1 4 1591 1 1 2 PRO HB3 H 10.813 -1.816 -1.275 1.00 . A A . 2 PRO HB3 1 1 4 1592 1 1 2 PRO HD2 H 12.033 -3.749 1.859 1.00 . A A . 2 PRO HD2 1 1 4 1593 1 1 2 PRO HD3 H 12.932 -2.851 0.621 1.00 . A A . 2 PRO HD3 1 1 4 1594 1 1 2 PRO HG2 H 10.292 -4.215 0.435 1.00 . A A . 2 PRO HG2 1 1 4 1595 1 1 2 PRO HG3 H 11.531 -3.976 -0.812 1.00 . A A . 2 PRO HG3 1 1 4 1596 1 1 2 PRO N N 11.354 -1.768 1.530 1.00 . A A . 2 PRO N 1 1 4 1597 1 1 2 PRO O O 8.726 -2.553 2.244 1.00 . A A . 2 PRO O 1 1 4 1598 1 1 3 PHE C C 5.728 -1.676 0.965 1.00 . A A . 3 PHE C 1 1 4 1599 1 1 3 PHE CA C 6.615 -0.797 1.832 1.00 . A A . 3 PHE CA 1 1 4 1600 1 1 3 PHE CB C 6.006 0.600 1.975 1.00 . A A . 3 PHE CB 1 1 4 1601 1 1 3 PHE CD1 C 7.814 2.278 2.452 1.00 . A A . 3 PHE CD1 1 1 4 1602 1 1 3 PHE CD2 C 6.423 1.559 4.249 1.00 . A A . 3 PHE CD2 1 1 4 1603 1 1 3 PHE CE1 C 8.507 3.105 3.314 1.00 . A A . 3 PHE CE1 1 1 4 1604 1 1 3 PHE CE2 C 7.112 2.383 5.116 1.00 . A A . 3 PHE CE2 1 1 4 1605 1 1 3 PHE CG C 6.765 1.497 2.910 1.00 . A A . 3 PHE CG 1 1 4 1606 1 1 3 PHE CZ C 8.157 3.157 4.649 1.00 . A A . 3 PHE CZ 1 1 4 1607 1 1 3 PHE H H 8.125 0.023 0.610 1.00 . A A . 3 PHE H 1 1 4 1608 1 1 3 PHE HA H 6.716 -1.246 2.808 1.00 . A A . 3 PHE HA 1 1 4 1609 1 1 3 PHE HB2 H 5.979 1.076 1.009 1.00 . A A . 3 PHE HB2 1 1 4 1610 1 1 3 PHE HB3 H 5.001 0.508 2.351 1.00 . A A . 3 PHE HB3 1 1 4 1611 1 1 3 PHE HD1 H 8.088 2.238 1.407 1.00 . A A . 3 PHE HD1 1 1 4 1612 1 1 3 PHE HD2 H 5.607 0.954 4.615 1.00 . A A . 3 PHE HD2 1 1 4 1613 1 1 3 PHE HE1 H 9.322 3.710 2.946 1.00 . A A . 3 PHE HE1 1 1 4 1614 1 1 3 PHE HE2 H 6.833 2.422 6.158 1.00 . A A . 3 PHE HE2 1 1 4 1615 1 1 3 PHE HZ H 8.697 3.802 5.325 1.00 . A A . 3 PHE HZ 1 1 4 1616 1 1 3 PHE N N 7.934 -0.711 1.233 1.00 . A A . 3 PHE N 1 1 4 1617 1 1 3 PHE O O 5.173 -1.220 -0.030 1.00 . A A . 3 PHE O 1 1 4 1618 1 1 4 NLE C C 3.489 -4.116 1.021 1.00 . A A . 4 NLE C 1 1 4 1619 1 1 4 NLE CA C 4.904 -3.900 0.508 1.00 . A A . 4 NLE CA 1 1 4 1620 1 1 4 NLE CB C 5.653 -5.235 0.481 1.00 . A A . 4 NLE CB 1 1 4 1621 1 1 4 NLE CD C 5.767 -7.585 -0.426 1.00 . A A . 4 NLE CD 1 1 4 1622 1 1 4 NLE CE C 5.416 -8.275 0.874 1.00 . A A . 4 NLE CE 1 1 4 1623 1 1 4 NLE CG C 5.073 -6.235 -0.510 1.00 . A A . 4 NLE CG 1 1 4 1624 1 1 4 NLE H H 6.023 -3.231 2.175 1.00 . A A . 4 NLE H 1 1 4 1625 1 1 4 NLE HA H 4.853 -3.505 -0.494 1.00 . A A . 4 NLE HA 1 1 4 1626 1 1 4 NLE HB2 H 5.614 -5.673 1.466 1.00 . A A . 4 NLE HB2 1 1 4 1627 1 1 4 NLE HB3 H 6.685 -5.053 0.218 1.00 . A A . 4 NLE HB3 1 1 4 1628 1 1 4 NLE HD2 H 6.836 -7.444 -0.469 1.00 . A A . 4 NLE HD2 1 1 4 1629 1 1 4 NLE HD3 H 5.441 -8.207 -1.246 1.00 . A A . 4 NLE HD3 1 1 4 1630 1 1 4 NLE HE1 H 5.909 -9.234 0.915 1.00 . A A . 4 NLE HE1 1 1 4 1631 1 1 4 NLE HE2 H 4.347 -8.418 0.927 1.00 . A A . 4 NLE HE2 1 1 4 1632 1 1 4 NLE HE3 H 5.740 -7.667 1.705 1.00 . A A . 4 NLE HE3 1 1 4 1633 1 1 4 NLE HG2 H 5.189 -5.844 -1.510 1.00 . A A . 4 NLE HG2 1 1 4 1634 1 1 4 NLE HG3 H 4.025 -6.371 -0.293 1.00 . A A . 4 NLE HG3 1 1 4 1635 1 1 4 NLE N N 5.620 -2.939 1.329 1.00 . A A . 4 NLE N 1 1 4 1636 1 1 4 NLE O O 3.257 -4.208 2.228 1.00 . A A . 4 NLE O 1 1 4 1637 1 1 5 CYS C C 1.078 -5.985 0.818 1.00 . A A . 5 CYS C 1 1 4 1638 1 1 5 CYS CA C 1.171 -4.516 0.414 1.00 . A A . 5 CYS CA 1 1 4 1639 1 1 5 CYS CB C 0.269 -4.236 -0.790 1.00 . A A . 5 CYS CB 1 1 4 1640 1 1 5 CYS H H 2.785 -3.985 -0.842 1.00 . A A . 5 CYS H 1 1 4 1641 1 1 5 CYS HA H 0.858 -3.901 1.244 1.00 . A A . 5 CYS HA 1 1 4 1642 1 1 5 CYS HB2 H 0.235 -3.171 -0.964 1.00 . A A . 5 CYS HB2 1 1 4 1643 1 1 5 CYS HB3 H 0.683 -4.723 -1.658 1.00 . A A . 5 CYS HB3 1 1 4 1644 1 1 5 CYS N N 2.546 -4.177 0.093 1.00 . A A . 5 CYS N 1 1 4 1645 1 1 5 CYS O O 1.784 -6.833 0.269 1.00 . A A . 5 CYS O 1 1 4 1646 1 1 5 CYS SG S -1.429 -4.812 -0.590 1.00 . A A . 5 CYS SG 1 1 4 1647 1 1 6 THR C C -1.423 -8.026 2.333 1.00 . A A . 6 THR C 1 1 4 1648 1 1 6 THR CA C 0.052 -7.643 2.261 1.00 . A A . 6 THR CA 1 1 4 1649 1 1 6 THR CB C 0.711 -7.817 3.643 1.00 . A A . 6 THR CB 1 1 4 1650 1 1 6 THR CG2 C 2.221 -7.931 3.512 1.00 . A A . 6 THR CG2 1 1 4 1651 1 1 6 THR H H -0.323 -5.568 2.176 1.00 . A A . 6 THR H 1 1 4 1652 1 1 6 THR HA H 0.548 -8.303 1.565 1.00 . A A . 6 THR HA 1 1 4 1653 1 1 6 THR HB H 0.334 -8.723 4.094 1.00 . A A . 6 THR HB 1 1 4 1654 1 1 6 THR HG1 H 0.933 -6.730 5.278 1.00 . A A . 6 THR HG1 1 1 4 1655 1 1 6 THR HG21 H 2.661 -8.042 4.491 1.00 . A A . 6 THR HG21 1 1 4 1656 1 1 6 THR HG22 H 2.609 -7.040 3.042 1.00 . A A . 6 THR HG22 1 1 4 1657 1 1 6 THR HG23 H 2.467 -8.792 2.906 1.00 . A A . 6 THR HG23 1 1 4 1658 1 1 6 THR N N 0.216 -6.282 1.778 1.00 . A A . 6 THR N 1 1 4 1659 1 1 6 THR O O -1.913 -8.493 3.364 1.00 . A A . 6 THR O 1 1 4 1660 1 1 6 THR OG1 O 0.382 -6.702 4.486 1.00 . A A . 6 THR OG1 1 1 4 1661 1 1 7 TRP C C -3.729 -9.510 0.497 1.00 . A A . 7 TRP C 1 1 4 1662 1 1 7 TRP CA C -3.541 -8.149 1.161 1.00 . A A . 7 TRP CA 1 1 4 1663 1 1 7 TRP CB C -4.295 -7.066 0.388 1.00 . A A . 7 TRP CB 1 1 4 1664 1 1 7 TRP CD1 C -6.657 -7.837 -0.222 1.00 . A A . 7 TRP CD1 1 1 4 1665 1 1 7 TRP CD2 C -6.566 -6.460 1.536 1.00 . A A . 7 TRP CD2 1 1 4 1666 1 1 7 TRP CE2 C -7.911 -6.804 1.308 1.00 . A A . 7 TRP CE2 1 1 4 1667 1 1 7 TRP CE3 C -6.259 -5.600 2.592 1.00 . A A . 7 TRP CE3 1 1 4 1668 1 1 7 TRP CG C -5.782 -7.135 0.548 1.00 . A A . 7 TRP CG 1 1 4 1669 1 1 7 TRP CH2 C -8.618 -5.475 3.128 1.00 . A A . 7 TRP CH2 1 1 4 1670 1 1 7 TRP CZ2 C -8.948 -6.316 2.099 1.00 . A A . 7 TRP CZ2 1 1 4 1671 1 1 7 TRP CZ3 C -7.288 -5.116 3.377 1.00 . A A . 7 TRP CZ3 1 1 4 1672 1 1 7 TRP H H -1.683 -7.452 0.436 1.00 . A A . 7 TRP H 1 1 4 1673 1 1 7 TRP HA H -3.923 -8.195 2.169 1.00 . A A . 7 TRP HA 1 1 4 1674 1 1 7 TRP HB2 H -3.969 -6.096 0.729 1.00 . A A . 7 TRP HB2 1 1 4 1675 1 1 7 TRP HB3 H -4.068 -7.165 -0.661 1.00 . A A . 7 TRP HB3 1 1 4 1676 1 1 7 TRP HD1 H -6.367 -8.452 -1.060 1.00 . A A . 7 TRP HD1 1 1 4 1677 1 1 7 TRP HE1 H -8.747 -8.051 -0.162 1.00 . A A . 7 TRP HE1 1 1 4 1678 1 1 7 TRP HE3 H -5.238 -5.312 2.799 1.00 . A A . 7 TRP HE3 1 1 4 1679 1 1 7 TRP HH2 H -9.390 -5.071 3.766 1.00 . A A . 7 TRP HH2 1 1 4 1680 1 1 7 TRP HZ2 H -9.978 -6.585 1.921 1.00 . A A . 7 TRP HZ2 1 1 4 1681 1 1 7 TRP HZ3 H -7.070 -4.449 4.198 1.00 . A A . 7 TRP HZ3 1 1 4 1682 1 1 7 TRP N N -2.128 -7.824 1.230 1.00 . A A . 7 TRP N 1 1 4 1683 1 1 7 TRP NE1 N -7.941 -7.647 0.228 1.00 . A A . 7 TRP NE1 1 1 4 1684 1 1 7 TRP O O -4.021 -9.601 -0.697 1.00 . A A . 7 TRP O 1 1 4 1685 1 1 8 ORN C C -1.480 -10.819 -2.721 1.00 . A A . 8 ORN C 1 1 4 1686 1 1 8 ORN CA C -2.104 -11.910 -1.863 1.00 . A A . 8 ORN CA 1 1 4 1687 1 1 8 ORN CB C -1.471 -11.884 -0.469 1.00 . A A . 8 ORN CB 1 1 4 1688 1 1 8 ORN CD C -3.637 -11.948 0.812 1.00 . A A . 8 ORN CD 1 1 4 1689 1 1 8 ORN CG C -2.282 -12.610 0.591 1.00 . A A . 8 ORN CG 1 1 4 1690 1 1 8 ORN H H -0.933 -13.448 -2.618 1.00 . A A . 8 ORN H 1 1 4 1691 1 1 8 ORN HA H -3.159 -11.710 -1.770 1.00 . A A . 8 ORN HA 1 1 4 1692 1 1 8 ORN HB2 H -1.358 -10.856 -0.161 1.00 . A A . 8 ORN HB2 1 1 4 1693 1 1 8 ORN HB3 H -0.495 -12.343 -0.521 1.00 . A A . 8 ORN HB3 1 1 4 1694 1 1 8 ORN HD2 H -4.182 -12.512 1.554 1.00 . A A . 8 ORN HD2 1 1 4 1695 1 1 8 ORN HD3 H -4.187 -11.959 -0.117 1.00 . A A . 8 ORN HD3 1 1 4 1696 1 1 8 ORN HE1 H -3.241 -10.416 2.198 1.00 . A A . 8 ORN HE1 1 1 4 1697 1 1 8 ORN HG2 H -1.731 -12.601 1.520 1.00 . A A . 8 ORN HG2 1 1 4 1698 1 1 8 ORN HG3 H -2.439 -13.629 0.273 1.00 . A A . 8 ORN HG3 1 1 4 1699 1 1 8 ORN N N -1.941 -13.242 -2.481 1.00 . A A . 8 ORN N 1 1 4 1700 1 1 8 ORN NE N -3.509 -10.566 1.266 1.00 . A A . 8 ORN NE 1 1 4 1701 1 1 8 ORN O O -0.406 -10.999 -3.300 1.00 . A A . 8 ORN O 1 1 4 1702 1 1 9 CYS C C -0.473 -7.971 -2.671 1.00 . A A . 9 CYS C 1 1 4 1703 1 1 9 CYS CA C -1.656 -8.513 -3.465 1.00 . A A . 9 CYS CA 1 1 4 1704 1 1 9 CYS CB C -2.760 -7.460 -3.571 1.00 . A A . 9 CYS CB 1 1 4 1705 1 1 9 CYS H H -3.077 -9.663 -2.413 1.00 . A A . 9 CYS H 1 1 4 1706 1 1 9 CYS HA H -1.327 -8.789 -4.454 1.00 . A A . 9 CYS HA 1 1 4 1707 1 1 9 CYS HB2 H -3.512 -7.807 -4.263 1.00 . A A . 9 CYS HB2 1 1 4 1708 1 1 9 CYS HB3 H -3.210 -7.330 -2.599 1.00 . A A . 9 CYS HB3 1 1 4 1709 1 1 9 CYS N N -2.175 -9.696 -2.809 1.00 . A A . 9 CYS N 1 1 4 1710 1 1 9 CYS O O -0.587 -7.743 -1.464 1.00 . A A . 9 CYS O 1 1 4 1711 1 1 9 CYS SG S -2.202 -5.842 -4.138 1.00 . A A . 9 CYS SG 1 1 4 1712 1 1 10 GLY C C 2.740 -6.456 -3.465 1.00 . A A . 10 GLY C 1 1 4 1713 1 1 10 GLY CA C 1.852 -7.359 -2.642 1.00 . A A . 10 GLY CA 1 1 4 1714 1 1 10 GLY H H 0.681 -7.918 -4.310 1.00 . A A . 10 GLY H 1 1 4 1715 1 1 10 GLY HA2 H 1.562 -6.834 -1.744 1.00 . A A . 10 GLY HA2 1 1 4 1716 1 1 10 GLY HA3 H 2.415 -8.236 -2.363 1.00 . A A . 10 GLY HA3 1 1 4 1717 1 1 10 GLY N N 0.658 -7.777 -3.338 1.00 . A A . 10 GLY N 1 1 4 1718 1 1 10 GLY O O 3.910 -6.762 -3.685 1.00 . A A . 10 GLY O 1 1 4 1719 1 1 11 LYS C C 3.907 -3.644 -3.645 1.00 . A A . 11 LYS C 1 1 4 1720 1 1 11 LYS CA C 2.978 -4.344 -4.627 1.00 . A A . 11 LYS CA 1 1 4 1721 1 1 11 LYS CB C 2.070 -3.327 -5.323 1.00 . A A . 11 LYS CB 1 1 4 1722 1 1 11 LYS CD C 0.428 -2.867 -7.168 1.00 . A A . 11 LYS CD 1 1 4 1723 1 1 11 LYS CE C -0.376 -3.471 -8.307 1.00 . A A . 11 LYS CE 1 1 4 1724 1 1 11 LYS CG C 1.246 -3.925 -6.450 1.00 . A A . 11 LYS CG 1 1 4 1725 1 1 11 LYS H H 1.230 -5.195 -3.793 1.00 . A A . 11 LYS H 1 1 4 1726 1 1 11 LYS HA H 3.574 -4.852 -5.370 1.00 . A A . 11 LYS HA 1 1 4 1727 1 1 11 LYS HB2 H 1.390 -2.909 -4.593 1.00 . A A . 11 LYS HB2 1 1 4 1728 1 1 11 LYS HB3 H 2.678 -2.533 -5.732 1.00 . A A . 11 LYS HB3 1 1 4 1729 1 1 11 LYS HD2 H -0.250 -2.414 -6.462 1.00 . A A . 11 LYS HD2 1 1 4 1730 1 1 11 LYS HD3 H 1.094 -2.115 -7.565 1.00 . A A . 11 LYS HD3 1 1 4 1731 1 1 11 LYS HE2 H 0.301 -3.980 -8.978 1.00 . A A . 11 LYS HE2 1 1 4 1732 1 1 11 LYS HE3 H -1.077 -4.182 -7.897 1.00 . A A . 11 LYS HE3 1 1 4 1733 1 1 11 LYS HG2 H 1.913 -4.393 -7.158 1.00 . A A . 11 LYS HG2 1 1 4 1734 1 1 11 LYS HG3 H 0.577 -4.667 -6.038 1.00 . A A . 11 LYS HG3 1 1 4 1735 1 1 11 LYS HZ1 H -0.464 -1.740 -9.467 1.00 . A A . 11 LYS HZ1 1 1 4 1736 1 1 11 LYS HZ2 H -1.795 -1.947 -8.445 1.00 . A A . 11 LYS HZ2 1 1 4 1737 1 1 11 LYS HZ3 H -1.652 -2.880 -9.846 1.00 . A A . 11 LYS HZ3 1 1 4 1738 1 1 11 LYS N N 2.187 -5.346 -3.927 1.00 . A A . 11 LYS N 1 1 4 1739 1 1 11 LYS NZ N -1.123 -2.437 -9.069 1.00 . A A . 11 LYS NZ 1 1 4 1740 1 1 11 LYS O O 3.530 -3.393 -2.498 1.00 . A A . 11 LYS O 1 1 4 1741 1 1 12 ARG C C 6.233 -1.246 -3.522 1.00 . A A . 12 ARG C 1 1 4 1742 1 1 12 ARG CA C 6.111 -2.731 -3.216 1.00 . A A . 12 ARG CA 1 1 4 1743 1 1 12 ARG CB C 7.469 -3.424 -3.366 1.00 . A A . 12 ARG CB 1 1 4 1744 1 1 12 ARG CD C 8.815 -5.540 -3.125 1.00 . A A . 12 ARG CD 1 1 4 1745 1 1 12 ARG CG C 7.447 -4.893 -2.971 1.00 . A A . 12 ARG CG 1 1 4 1746 1 1 12 ARG CZ C 9.891 -7.686 -2.539 1.00 . A A . 12 ARG CZ 1 1 4 1747 1 1 12 ARG H H 5.359 -3.557 -5.014 1.00 . A A . 12 ARG H 1 1 4 1748 1 1 12 ARG HA H 5.769 -2.845 -2.197 1.00 . A A . 12 ARG HA 1 1 4 1749 1 1 12 ARG HB2 H 7.784 -3.355 -4.397 1.00 . A A . 12 ARG HB2 1 1 4 1750 1 1 12 ARG HB3 H 8.193 -2.916 -2.744 1.00 . A A . 12 ARG HB3 1 1 4 1751 1 1 12 ARG HD2 H 9.138 -5.431 -4.148 1.00 . A A . 12 ARG HD2 1 1 4 1752 1 1 12 ARG HD3 H 9.512 -5.033 -2.473 1.00 . A A . 12 ARG HD3 1 1 4 1753 1 1 12 ARG HE H 7.918 -7.405 -2.736 1.00 . A A . 12 ARG HE 1 1 4 1754 1 1 12 ARG HG2 H 7.136 -4.973 -1.940 1.00 . A A . 12 ARG HG2 1 1 4 1755 1 1 12 ARG HG3 H 6.740 -5.413 -3.601 1.00 . A A . 12 ARG HG3 1 1 4 1756 1 1 12 ARG HH11 H 11.183 -6.151 -2.833 1.00 . A A . 12 ARG HH11 1 1 4 1757 1 1 12 ARG HH12 H 11.917 -7.669 -2.426 1.00 . A A . 12 ARG HH12 1 1 4 1758 1 1 12 ARG HH21 H 10.599 -9.519 -2.049 1.00 . A A . 12 ARG HH21 1 1 4 1759 1 1 12 ARG HH22 H 8.875 -9.407 -2.196 1.00 . A A . 12 ARG HH22 1 1 4 1760 1 1 12 ARG N N 5.122 -3.354 -4.083 1.00 . A A . 12 ARG N 1 1 4 1761 1 1 12 ARG NE N 8.797 -6.963 -2.784 1.00 . A A . 12 ARG NE 1 1 4 1762 1 1 12 ARG NH1 N 11.093 -7.124 -2.603 1.00 . A A . 12 ARG NH1 1 1 4 1763 1 1 12 ARG NH2 N 9.781 -8.971 -2.236 1.00 . A A . 12 ARG NH2 1 1 4 1764 1 1 12 ARG O O 6.271 -0.839 -4.685 1.00 . A A . 12 ARG O 1 1 4 1765 1 1 13 PHE C C 7.549 1.558 -1.894 1.00 . A A . 13 PHE C 1 1 4 1766 1 1 13 PHE CA C 6.333 1.004 -2.611 1.00 . A A . 13 PHE CA 1 1 4 1767 1 1 13 PHE CB C 5.063 1.625 -2.041 1.00 . A A . 13 PHE CB 1 1 4 1768 1 1 13 PHE CD1 C 3.349 1.652 -3.857 1.00 . A A . 13 PHE CD1 1 1 4 1769 1 1 13 PHE CD2 C 3.140 0.029 -2.127 1.00 . A A . 13 PHE CD2 1 1 4 1770 1 1 13 PHE CE1 C 2.214 1.157 -4.461 1.00 . A A . 13 PHE CE1 1 1 4 1771 1 1 13 PHE CE2 C 2.003 -0.470 -2.724 1.00 . A A . 13 PHE CE2 1 1 4 1772 1 1 13 PHE CG C 3.822 1.096 -2.685 1.00 . A A . 13 PHE CG 1 1 4 1773 1 1 13 PHE CZ C 1.540 0.095 -3.895 1.00 . A A . 13 PHE CZ 1 1 4 1774 1 1 13 PHE H H 6.252 -0.830 -1.571 1.00 . A A . 13 PHE H 1 1 4 1775 1 1 13 PHE HA H 6.401 1.241 -3.662 1.00 . A A . 13 PHE HA 1 1 4 1776 1 1 13 PHE HB2 H 5.007 1.413 -0.984 1.00 . A A . 13 PHE HB2 1 1 4 1777 1 1 13 PHE HB3 H 5.091 2.692 -2.193 1.00 . A A . 13 PHE HB3 1 1 4 1778 1 1 13 PHE HD1 H 3.877 2.483 -4.299 1.00 . A A . 13 PHE HD1 1 1 4 1779 1 1 13 PHE HD2 H 3.506 -0.414 -1.212 1.00 . A A . 13 PHE HD2 1 1 4 1780 1 1 13 PHE HE1 H 1.853 1.599 -5.374 1.00 . A A . 13 PHE HE1 1 1 4 1781 1 1 13 PHE HE2 H 1.478 -1.300 -2.277 1.00 . A A . 13 PHE HE2 1 1 4 1782 1 1 13 PHE HZ H 0.649 -0.292 -4.365 1.00 . A A . 13 PHE HZ 1 1 4 1783 1 1 13 PHE N N 6.275 -0.441 -2.473 1.00 . A A . 13 PHE N 1 1 4 1784 1 1 13 PHE O O 8.021 0.986 -0.911 1.00 . A A . 13 PHE O 1 1 4 1785 1 1 14 THR C C 8.852 4.133 -0.600 1.00 . A A . 14 THR C 1 1 4 1786 1 1 14 THR CA C 9.230 3.299 -1.824 1.00 . A A . 14 THR CA 1 1 4 1787 1 1 14 THR CB C 9.923 4.203 -2.863 1.00 . A A . 14 THR CB 1 1 4 1788 1 1 14 THR CG2 C 11.345 4.532 -2.439 1.00 . A A . 14 THR CG2 1 1 4 1789 1 1 14 THR H H 7.641 3.072 -3.189 1.00 . A A . 14 THR H 1 1 4 1790 1 1 14 THR HA H 9.920 2.525 -1.524 1.00 . A A . 14 THR HA 1 1 4 1791 1 1 14 THR HB H 9.363 5.124 -2.951 1.00 . A A . 14 THR HB 1 1 4 1792 1 1 14 THR HG1 H 10.449 4.084 -4.767 1.00 . A A . 14 THR HG1 1 1 4 1793 1 1 14 THR HG21 H 11.917 3.620 -2.356 1.00 . A A . 14 THR HG21 1 1 4 1794 1 1 14 THR HG22 H 11.328 5.034 -1.485 1.00 . A A . 14 THR HG22 1 1 4 1795 1 1 14 THR HG23 H 11.802 5.176 -3.177 1.00 . A A . 14 THR HG23 1 1 4 1796 1 1 14 THR N N 8.058 2.670 -2.398 1.00 . A A . 14 THR N 1 1 4 1797 1 1 14 THR O O 9.659 4.322 0.312 1.00 . A A . 14 THR O 1 1 4 1798 1 1 14 THR OG1 O 9.950 3.543 -4.139 1.00 . A A . 14 THR OG1 1 1 4 1799 1 1 15 ARG C C 5.855 4.997 1.106 1.00 . A A . 15 ARG C 1 1 4 1800 1 1 15 ARG CA C 7.158 5.500 0.485 1.00 . A A . 15 ARG CA 1 1 4 1801 1 1 15 ARG CB C 6.979 6.913 -0.074 1.00 . A A . 15 ARG CB 1 1 4 1802 1 1 15 ARG CD C 8.037 8.842 -1.301 1.00 . A A . 15 ARG CD 1 1 4 1803 1 1 15 ARG CG C 8.278 7.531 -0.570 1.00 . A A . 15 ARG CG 1 1 4 1804 1 1 15 ARG CZ C 6.852 9.639 -3.314 1.00 . A A . 15 ARG CZ 1 1 4 1805 1 1 15 ARG H H 6.986 4.357 -1.290 1.00 . A A . 15 ARG H 1 1 4 1806 1 1 15 ARG HA H 7.922 5.518 1.249 1.00 . A A . 15 ARG HA 1 1 4 1807 1 1 15 ARG HB2 H 6.284 6.878 -0.898 1.00 . A A . 15 ARG HB2 1 1 4 1808 1 1 15 ARG HB3 H 6.577 7.549 0.701 1.00 . A A . 15 ARG HB3 1 1 4 1809 1 1 15 ARG HD2 H 7.495 9.512 -0.648 1.00 . A A . 15 ARG HD2 1 1 4 1810 1 1 15 ARG HD3 H 8.990 9.279 -1.554 1.00 . A A . 15 ARG HD3 1 1 4 1811 1 1 15 ARG HE H 7.043 7.720 -2.779 1.00 . A A . 15 ARG HE 1 1 4 1812 1 1 15 ARG HG2 H 8.924 7.715 0.274 1.00 . A A . 15 ARG HG2 1 1 4 1813 1 1 15 ARG HG3 H 8.756 6.837 -1.247 1.00 . A A . 15 ARG HG3 1 1 4 1814 1 1 15 ARG HH11 H 7.666 11.109 -2.184 1.00 . A A . 15 ARG HH11 1 1 4 1815 1 1 15 ARG HH12 H 6.827 11.646 -3.601 1.00 . A A . 15 ARG HH12 1 1 4 1816 1 1 15 ARG HH21 H 5.929 8.413 -4.644 1.00 . A A . 15 ARG HH21 1 1 4 1817 1 1 15 ARG HH22 H 5.842 10.114 -5.005 1.00 . A A . 15 ARG HH22 1 1 4 1818 1 1 15 ARG N N 7.612 4.611 -0.575 1.00 . A A . 15 ARG N 1 1 4 1819 1 1 15 ARG NE N 7.263 8.647 -2.526 1.00 . A A . 15 ARG NE 1 1 4 1820 1 1 15 ARG NH1 N 7.137 10.898 -3.007 1.00 . A A . 15 ARG NH1 1 1 4 1821 1 1 15 ARG NH2 N 6.150 9.370 -4.406 1.00 . A A . 15 ARG NH2 1 1 4 1822 1 1 15 ARG O O 4.988 4.440 0.426 1.00 . A A . 15 ARG O 1 1 4 1823 1 1 16 SER C C 3.292 5.323 2.775 1.00 . A A . 16 SER C 1 1 4 1824 1 1 16 SER CA C 4.618 4.704 3.203 1.00 . A A . 16 SER CA 1 1 4 1825 1 1 16 SER CB C 4.875 4.984 4.685 1.00 . A A . 16 SER CB 1 1 4 1826 1 1 16 SER H H 6.436 5.725 2.875 1.00 . A A . 16 SER H 1 1 4 1827 1 1 16 SER HA H 4.566 3.636 3.056 1.00 . A A . 16 SER HA 1 1 4 1828 1 1 16 SER HB2 H 3.959 4.860 5.241 1.00 . A A . 16 SER HB2 1 1 4 1829 1 1 16 SER HB3 H 5.619 4.296 5.056 1.00 . A A . 16 SER HB3 1 1 4 1830 1 1 16 SER HG H 4.827 6.743 5.557 1.00 . A A . 16 SER HG 1 1 4 1831 1 1 16 SER N N 5.737 5.209 2.415 1.00 . A A . 16 SER N 1 1 4 1832 1 1 16 SER O O 2.254 4.663 2.823 1.00 . A A . 16 SER O 1 1 4 1833 1 1 16 SER OG O 5.347 6.308 4.869 1.00 . A A . 16 SER OG 1 1 4 1834 1 1 17 ASP C C 1.605 6.631 0.628 1.00 . A A . 17 ASP C 1 1 4 1835 1 1 17 ASP CA C 2.135 7.278 1.894 1.00 . A A . 17 ASP CA 1 1 4 1836 1 1 17 ASP CB C 2.417 8.761 1.637 1.00 . A A . 17 ASP CB 1 1 4 1837 1 1 17 ASP CG C 2.597 9.555 2.913 1.00 . A A . 17 ASP CG 1 1 4 1838 1 1 17 ASP H H 4.181 7.075 2.400 1.00 . A A . 17 ASP H 1 1 4 1839 1 1 17 ASP HA H 1.384 7.194 2.662 1.00 . A A . 17 ASP HA 1 1 4 1840 1 1 17 ASP HB2 H 3.318 8.852 1.053 1.00 . A A . 17 ASP HB2 1 1 4 1841 1 1 17 ASP HB3 H 1.594 9.185 1.085 1.00 . A A . 17 ASP HB3 1 1 4 1842 1 1 17 ASP N N 3.332 6.588 2.367 1.00 . A A . 17 ASP N 1 1 4 1843 1 1 17 ASP O O 0.396 6.588 0.400 1.00 . A A . 17 ASP O 1 1 4 1844 1 1 17 ASP OD1 O 1.586 10.014 3.481 1.00 . A A . 17 ASP OD1 1 1 4 1845 1 1 17 ASP OD2 O 3.754 9.732 3.351 1.00 . A A . 17 ASP OD2 1 1 4 1846 1 1 18 GLU C C 1.475 4.113 -1.105 1.00 . A A . 18 GLU C 1 1 4 1847 1 1 18 GLU CA C 2.141 5.443 -1.416 1.00 . A A . 18 GLU CA 1 1 4 1848 1 1 18 GLU CB C 3.370 5.227 -2.298 1.00 . A A . 18 GLU CB 1 1 4 1849 1 1 18 GLU CD C 5.262 6.280 -3.575 1.00 . A A . 18 GLU CD 1 1 4 1850 1 1 18 GLU CG C 4.103 6.510 -2.634 1.00 . A A . 18 GLU CG 1 1 4 1851 1 1 18 GLU H H 3.458 6.166 0.061 1.00 . A A . 18 GLU H 1 1 4 1852 1 1 18 GLU HA H 1.438 6.073 -1.937 1.00 . A A . 18 GLU HA 1 1 4 1853 1 1 18 GLU HB2 H 4.057 4.575 -1.781 1.00 . A A . 18 GLU HB2 1 1 4 1854 1 1 18 GLU HB3 H 3.064 4.758 -3.220 1.00 . A A . 18 GLU HB3 1 1 4 1855 1 1 18 GLU HG2 H 3.409 7.196 -3.099 1.00 . A A . 18 GLU HG2 1 1 4 1856 1 1 18 GLU HG3 H 4.480 6.943 -1.720 1.00 . A A . 18 GLU HG3 1 1 4 1857 1 1 18 GLU N N 2.514 6.110 -0.183 1.00 . A A . 18 GLU N 1 1 4 1858 1 1 18 GLU O O 0.486 3.741 -1.739 1.00 . A A . 18 GLU O 1 1 4 1859 1 1 18 GLU OE1 O 6.189 5.532 -3.204 1.00 . A A . 18 GLU OE1 1 1 4 1860 1 1 18 GLU OE2 O 5.250 6.841 -4.689 1.00 . A A . 18 GLU OE2 1 1 4 1861 1 1 19 LEU C C 0.033 2.420 0.930 1.00 . A A . 19 LEU C 1 1 4 1862 1 1 19 LEU CA C 1.410 2.160 0.335 1.00 . A A . 19 LEU CA 1 1 4 1863 1 1 19 LEU CB C 2.300 1.459 1.364 1.00 . A A . 19 LEU CB 1 1 4 1864 1 1 19 LEU CD1 C 1.329 -0.832 1.015 1.00 . A A . 19 LEU CD1 1 1 4 1865 1 1 19 LEU CD2 C 2.577 -0.319 3.121 1.00 . A A . 19 LEU CD2 1 1 4 1866 1 1 19 LEU CG C 1.662 0.241 2.043 1.00 . A A . 19 LEU CG 1 1 4 1867 1 1 19 LEU H H 2.837 3.731 0.314 1.00 . A A . 19 LEU H 1 1 4 1868 1 1 19 LEU HA H 1.298 1.518 -0.528 1.00 . A A . 19 LEU HA 1 1 4 1869 1 1 19 LEU HB2 H 3.202 1.138 0.865 1.00 . A A . 19 LEU HB2 1 1 4 1870 1 1 19 LEU HB3 H 2.565 2.173 2.126 1.00 . A A . 19 LEU HB3 1 1 4 1871 1 1 19 LEU HD11 H 2.236 -1.150 0.522 1.00 . A A . 19 LEU HD11 1 1 4 1872 1 1 19 LEU HD12 H 0.644 -0.430 0.283 1.00 . A A . 19 LEU HD12 1 1 4 1873 1 1 19 LEU HD13 H 0.873 -1.675 1.510 1.00 . A A . 19 LEU HD13 1 1 4 1874 1 1 19 LEU HD21 H 3.458 -0.742 2.660 1.00 . A A . 19 LEU HD21 1 1 4 1875 1 1 19 LEU HD22 H 2.057 -1.087 3.673 1.00 . A A . 19 LEU HD22 1 1 4 1876 1 1 19 LEU HD23 H 2.870 0.474 3.793 1.00 . A A . 19 LEU HD23 1 1 4 1877 1 1 19 LEU HG H 0.735 0.544 2.514 1.00 . A A . 19 LEU HG 1 1 4 1878 1 1 19 LEU N N 2.013 3.407 -0.117 1.00 . A A . 19 LEU N 1 1 4 1879 1 1 19 LEU O O -0.921 1.713 0.624 1.00 . A A . 19 LEU O 1 1 4 1880 1 1 20 GLN C C -2.363 4.149 1.316 1.00 . A A . 20 GLN C 1 1 4 1881 1 1 20 GLN CA C -1.334 3.812 2.390 1.00 . A A . 20 GLN CA 1 1 4 1882 1 1 20 GLN CB C -1.140 4.999 3.336 1.00 . A A . 20 GLN CB 1 1 4 1883 1 1 20 GLN CD C -2.902 4.291 5.012 1.00 . A A . 20 GLN CD 1 1 4 1884 1 1 20 GLN CG C -2.396 5.395 4.102 1.00 . A A . 20 GLN CG 1 1 4 1885 1 1 20 GLN H H 0.745 3.957 1.993 1.00 . A A . 20 GLN H 1 1 4 1886 1 1 20 GLN HA H -1.686 2.963 2.955 1.00 . A A . 20 GLN HA 1 1 4 1887 1 1 20 GLN HB2 H -0.375 4.747 4.053 1.00 . A A . 20 GLN HB2 1 1 4 1888 1 1 20 GLN HB3 H -0.812 5.853 2.760 1.00 . A A . 20 GLN HB3 1 1 4 1889 1 1 20 GLN HE21 H -4.759 4.972 4.845 1.00 . A A . 20 GLN HE21 1 1 4 1890 1 1 20 GLN HE22 H -4.553 3.574 5.843 1.00 . A A . 20 GLN HE22 1 1 4 1891 1 1 20 GLN HG2 H -2.174 6.263 4.703 1.00 . A A . 20 GLN HG2 1 1 4 1892 1 1 20 GLN HG3 H -3.170 5.639 3.390 1.00 . A A . 20 GLN HG3 1 1 4 1893 1 1 20 GLN N N -0.063 3.441 1.773 1.00 . A A . 20 GLN N 1 1 4 1894 1 1 20 GLN NE2 N -4.200 4.276 5.258 1.00 . A A . 20 GLN NE2 1 1 4 1895 1 1 20 GLN O O -3.504 3.679 1.357 1.00 . A A . 20 GLN O 1 1 4 1896 1 1 20 GLN OE1 O -2.129 3.469 5.506 1.00 . A A . 20 GLN OE1 1 1 4 1897 1 1 21 ARG C C -3.278 4.036 -1.480 1.00 . A A . 21 ARG C 1 1 4 1898 1 1 21 ARG CA C -2.781 5.300 -0.793 1.00 . A A . 21 ARG CA 1 1 4 1899 1 1 21 ARG CB C -1.989 6.152 -1.786 1.00 . A A . 21 ARG CB 1 1 4 1900 1 1 21 ARG CD C -1.882 7.287 -4.012 1.00 . A A . 21 ARG CD 1 1 4 1901 1 1 21 ARG CG C -2.752 6.497 -3.052 1.00 . A A . 21 ARG CG 1 1 4 1902 1 1 21 ARG CZ C -1.878 7.522 -6.465 1.00 . A A . 21 ARG CZ 1 1 4 1903 1 1 21 ARG H H -1.030 5.324 0.398 1.00 . A A . 21 ARG H 1 1 4 1904 1 1 21 ARG HA H -3.629 5.864 -0.432 1.00 . A A . 21 ARG HA 1 1 4 1905 1 1 21 ARG HB2 H -1.703 7.073 -1.304 1.00 . A A . 21 ARG HB2 1 1 4 1906 1 1 21 ARG HB3 H -1.098 5.613 -2.067 1.00 . A A . 21 ARG HB3 1 1 4 1907 1 1 21 ARG HD2 H -1.661 8.248 -3.573 1.00 . A A . 21 ARG HD2 1 1 4 1908 1 1 21 ARG HD3 H -0.961 6.746 -4.168 1.00 . A A . 21 ARG HD3 1 1 4 1909 1 1 21 ARG HE H -3.506 7.625 -5.304 1.00 . A A . 21 ARG HE 1 1 4 1910 1 1 21 ARG HG2 H -3.066 5.582 -3.532 1.00 . A A . 21 ARG HG2 1 1 4 1911 1 1 21 ARG HG3 H -3.621 7.087 -2.793 1.00 . A A . 21 ARG HG3 1 1 4 1912 1 1 21 ARG HH11 H -0.050 7.235 -5.640 1.00 . A A . 21 ARG HH11 1 1 4 1913 1 1 21 ARG HH12 H -0.066 7.382 -7.367 1.00 . A A . 21 ARG HH12 1 1 4 1914 1 1 21 ARG HH21 H -3.540 7.835 -7.579 1.00 . A A . 21 ARG HH21 1 1 4 1915 1 1 21 ARG HH22 H -2.057 7.730 -8.472 1.00 . A A . 21 ARG HH22 1 1 4 1916 1 1 21 ARG N N -1.940 4.953 0.346 1.00 . A A . 21 ARG N 1 1 4 1917 1 1 21 ARG NE N -2.531 7.497 -5.304 1.00 . A A . 21 ARG NE 1 1 4 1918 1 1 21 ARG NH1 N -0.558 7.369 -6.493 1.00 . A A . 21 ARG NH1 1 1 4 1919 1 1 21 ARG NH2 N -2.544 7.711 -7.595 1.00 . A A . 21 ARG NH2 1 1 4 1920 1 1 21 ARG O O -4.476 3.871 -1.717 1.00 . A A . 21 ARG O 1 1 4 1921 1 1 22 HIS C C -3.654 1.080 -1.573 1.00 . A A . 22 HIS C 1 1 4 1922 1 1 22 HIS CA C -2.662 1.880 -2.414 1.00 . A A . 22 HIS CA 1 1 4 1923 1 1 22 HIS CB C -1.380 1.072 -2.649 1.00 . A A . 22 HIS CB 1 1 4 1924 1 1 22 HIS CD2 C -1.871 -1.428 -2.274 1.00 . A A . 22 HIS CD2 1 1 4 1925 1 1 22 HIS CE1 C -2.088 -2.082 -4.337 1.00 . A A . 22 HIS CE1 1 1 4 1926 1 1 22 HIS CG C -1.638 -0.344 -3.053 1.00 . A A . 22 HIS CG 1 1 4 1927 1 1 22 HIS H H -1.407 3.333 -1.546 1.00 . A A . 22 HIS H 1 1 4 1928 1 1 22 HIS HA H -3.116 2.101 -3.368 1.00 . A A . 22 HIS HA 1 1 4 1929 1 1 22 HIS HB2 H -0.802 1.543 -3.430 1.00 . A A . 22 HIS HB2 1 1 4 1930 1 1 22 HIS HB3 H -0.800 1.058 -1.738 1.00 . A A . 22 HIS HB3 1 1 4 1931 1 1 22 HIS HD1 H -1.640 -0.227 -5.175 1.00 . A A . 22 HIS HD1 1 1 4 1932 1 1 22 HIS HD2 H -1.815 -1.466 -1.196 1.00 . A A . 22 HIS HD2 1 1 4 1933 1 1 22 HIS HE1 H -2.259 -2.701 -5.202 1.00 . A A . 22 HIS HE1 1 1 4 1934 1 1 22 HIS N N -2.344 3.140 -1.774 1.00 . A A . 22 HIS N 1 1 4 1935 1 1 22 HIS ND1 N -1.765 -0.777 -4.368 1.00 . A A . 22 HIS ND1 1 1 4 1936 1 1 22 HIS NE2 N -2.156 -2.488 -3.097 1.00 . A A . 22 HIS NE2 1 1 4 1937 1 1 22 HIS O O -4.648 0.579 -2.086 1.00 . A A . 22 HIS O 1 1 4 1938 1 1 23 LYS C C -5.665 0.705 0.620 1.00 . A A . 23 LYS C 1 1 4 1939 1 1 23 LYS CA C -4.229 0.200 0.624 1.00 . A A . 23 LYS CA 1 1 4 1940 1 1 23 LYS CB C -3.678 0.237 2.049 1.00 . A A . 23 LYS CB 1 1 4 1941 1 1 23 LYS CD C -2.560 -2.028 1.922 1.00 . A A . 23 LYS CD 1 1 4 1942 1 1 23 LYS CE C -3.671 -2.666 2.747 1.00 . A A . 23 LYS CE 1 1 4 1943 1 1 23 LYS CG C -2.387 -0.548 2.242 1.00 . A A . 23 LYS CG 1 1 4 1944 1 1 23 LYS H H -2.592 1.434 0.081 1.00 . A A . 23 LYS H 1 1 4 1945 1 1 23 LYS HA H -4.225 -0.819 0.276 1.00 . A A . 23 LYS HA 1 1 4 1946 1 1 23 LYS HB2 H -3.489 1.265 2.318 1.00 . A A . 23 LYS HB2 1 1 4 1947 1 1 23 LYS HB3 H -4.422 -0.168 2.718 1.00 . A A . 23 LYS HB3 1 1 4 1948 1 1 23 LYS HD2 H -2.797 -2.135 0.876 1.00 . A A . 23 LYS HD2 1 1 4 1949 1 1 23 LYS HD3 H -1.631 -2.539 2.135 1.00 . A A . 23 LYS HD3 1 1 4 1950 1 1 23 LYS HE2 H -4.612 -2.210 2.475 1.00 . A A . 23 LYS HE2 1 1 4 1951 1 1 23 LYS HE3 H -3.705 -3.721 2.520 1.00 . A A . 23 LYS HE3 1 1 4 1952 1 1 23 LYS HG2 H -1.630 -0.141 1.590 1.00 . A A . 23 LYS HG2 1 1 4 1953 1 1 23 LYS HG3 H -2.068 -0.447 3.270 1.00 . A A . 23 LYS HG3 1 1 4 1954 1 1 23 LYS HZ1 H -3.474 -1.483 4.456 1.00 . A A . 23 LYS HZ1 1 1 4 1955 1 1 23 LYS HZ2 H -2.530 -2.884 4.482 1.00 . A A . 23 LYS HZ2 1 1 4 1956 1 1 23 LYS HZ3 H -4.195 -2.986 4.743 1.00 . A A . 23 LYS HZ3 1 1 4 1957 1 1 23 LYS N N -3.386 0.976 -0.279 1.00 . A A . 23 LYS N 1 1 4 1958 1 1 23 LYS NZ N -3.453 -2.492 4.206 1.00 . A A . 23 LYS NZ 1 1 4 1959 1 1 23 LYS O O -6.604 -0.069 0.831 1.00 . A A . 23 LYS O 1 1 4 1960 1 1 24 ARG C C -8.003 2.094 -0.837 1.00 . A A . 24 ARG C 1 1 4 1961 1 1 24 ARG CA C -7.169 2.586 0.345 1.00 . A A . 24 ARG CA 1 1 4 1962 1 1 24 ARG CB C -7.086 4.114 0.361 1.00 . A A . 24 ARG CB 1 1 4 1963 1 1 24 ARG CD C -6.600 6.179 1.727 1.00 . A A . 24 ARG CD 1 1 4 1964 1 1 24 ARG CG C -6.502 4.663 1.653 1.00 . A A . 24 ARG CG 1 1 4 1965 1 1 24 ARG CZ C -4.963 7.781 0.803 1.00 . A A . 24 ARG CZ 1 1 4 1966 1 1 24 ARG H H -5.055 2.556 0.139 1.00 . A A . 24 ARG H 1 1 4 1967 1 1 24 ARG HA H -7.656 2.264 1.252 1.00 . A A . 24 ARG HA 1 1 4 1968 1 1 24 ARG HB2 H -6.464 4.440 -0.460 1.00 . A A . 24 ARG HB2 1 1 4 1969 1 1 24 ARG HB3 H -8.078 4.520 0.236 1.00 . A A . 24 ARG HB3 1 1 4 1970 1 1 24 ARG HD2 H -7.642 6.461 1.684 1.00 . A A . 24 ARG HD2 1 1 4 1971 1 1 24 ARG HD3 H -6.181 6.507 2.665 1.00 . A A . 24 ARG HD3 1 1 4 1972 1 1 24 ARG HE H -6.140 6.581 -0.283 1.00 . A A . 24 ARG HE 1 1 4 1973 1 1 24 ARG HG2 H -7.041 4.238 2.487 1.00 . A A . 24 ARG HG2 1 1 4 1974 1 1 24 ARG HG3 H -5.462 4.376 1.715 1.00 . A A . 24 ARG HG3 1 1 4 1975 1 1 24 ARG HH11 H -3.867 8.844 2.137 1.00 . A A . 24 ARG HH11 1 1 4 1976 1 1 24 ARG HH12 H -4.955 7.687 2.831 1.00 . A A . 24 ARG HH12 1 1 4 1977 1 1 24 ARG HH21 H -3.720 9.080 -0.142 1.00 . A A . 24 ARG HH21 1 1 4 1978 1 1 24 ARG HH22 H -4.720 8.110 -1.180 1.00 . A A . 24 ARG HH22 1 1 4 1979 1 1 24 ARG N N -5.840 1.993 0.345 1.00 . A A . 24 ARG N 1 1 4 1980 1 1 24 ARG NE N -5.890 6.838 0.634 1.00 . A A . 24 ARG NE 1 1 4 1981 1 1 24 ARG NH1 N -4.564 8.132 2.020 1.00 . A A . 24 ARG NH1 1 1 4 1982 1 1 24 ARG NH2 N -4.423 8.367 -0.257 1.00 . A A . 24 ARG NH2 1 1 4 1983 1 1 24 ARG O O -9.193 2.403 -0.936 1.00 . A A . 24 ARG O 1 1 4 1984 1 1 25 THR C C -8.788 -0.599 -2.267 1.00 . A A . 25 THR C 1 1 4 1985 1 1 25 THR CA C -8.128 0.671 -2.794 1.00 . A A . 25 THR CA 1 1 4 1986 1 1 25 THR CB C -7.239 0.319 -4.007 1.00 . A A . 25 THR CB 1 1 4 1987 1 1 25 THR CG2 C -6.557 1.561 -4.559 1.00 . A A . 25 THR CG2 1 1 4 1988 1 1 25 THR H H -6.415 1.189 -1.664 1.00 . A A . 25 THR H 1 1 4 1989 1 1 25 THR HA H -8.897 1.352 -3.123 1.00 . A A . 25 THR HA 1 1 4 1990 1 1 25 THR HB H -7.867 -0.097 -4.780 1.00 . A A . 25 THR HB 1 1 4 1991 1 1 25 THR HG1 H -5.544 -0.219 -3.138 1.00 . A A . 25 THR HG1 1 1 4 1992 1 1 25 THR HG21 H -5.947 1.290 -5.408 1.00 . A A . 25 THR HG21 1 1 4 1993 1 1 25 THR HG22 H -5.934 2.000 -3.794 1.00 . A A . 25 THR HG22 1 1 4 1994 1 1 25 THR HG23 H -7.305 2.276 -4.866 1.00 . A A . 25 THR HG23 1 1 4 1995 1 1 25 THR N N -7.387 1.320 -1.727 1.00 . A A . 25 THR N 1 1 4 1996 1 1 25 THR O O -9.891 -0.955 -2.677 1.00 . A A . 25 THR O 1 1 4 1997 1 1 25 THR OG1 O -6.248 -0.649 -3.645 1.00 . A A . 25 THR OG1 1 1 4 1998 1 1 26 HIS C C -9.697 -2.145 0.300 1.00 . A A . 26 HIS C 1 1 4 1999 1 1 26 HIS CA C -8.637 -2.487 -0.732 1.00 . A A . 26 HIS CA 1 1 4 2000 1 1 26 HIS CB C -7.529 -3.298 -0.053 1.00 . A A . 26 HIS CB 1 1 4 2001 1 1 26 HIS CD2 C -5.144 -3.540 -1.015 1.00 . A A . 26 HIS CD2 1 1 4 2002 1 1 26 HIS CE1 C -5.506 -5.058 -2.536 1.00 . A A . 26 HIS CE1 1 1 4 2003 1 1 26 HIS CG C -6.471 -3.826 -0.970 1.00 . A A . 26 HIS CG 1 1 4 2004 1 1 26 HIS H H -7.241 -0.925 -1.034 1.00 . A A . 26 HIS H 1 1 4 2005 1 1 26 HIS HA H -9.084 -3.079 -1.513 1.00 . A A . 26 HIS HA 1 1 4 2006 1 1 26 HIS HB2 H -7.038 -2.673 0.677 1.00 . A A . 26 HIS HB2 1 1 4 2007 1 1 26 HIS HB3 H -7.976 -4.141 0.454 1.00 . A A . 26 HIS HB3 1 1 4 2008 1 1 26 HIS HD1 H -7.549 -5.214 -2.167 1.00 . A A . 26 HIS HD1 1 1 4 2009 1 1 26 HIS HD2 H -4.619 -2.833 -0.392 1.00 . A A . 26 HIS HD2 1 1 4 2010 1 1 26 HIS HE1 H -5.351 -5.775 -3.329 1.00 . A A . 26 HIS HE1 1 1 4 2011 1 1 26 HIS N N -8.111 -1.268 -1.332 1.00 . A A . 26 HIS N 1 1 4 2012 1 1 26 HIS ND1 N -6.689 -4.793 -1.948 1.00 . A A . 26 HIS ND1 1 1 4 2013 1 1 26 HIS NE2 N -4.571 -4.322 -1.994 1.00 . A A . 26 HIS NE2 1 1 4 2014 1 1 26 HIS O O -10.729 -2.810 0.391 1.00 . A A . 26 HIS O 1 1 4 2015 1 1 27 THR C C -11.417 0.268 1.537 1.00 . A A . 27 THR C 1 1 4 2016 1 1 27 THR CA C -10.356 -0.664 2.110 1.00 . A A . 27 THR CA 1 1 4 2017 1 1 27 THR CB C -9.612 0.042 3.259 1.00 . A A . 27 THR CB 1 1 4 2018 1 1 27 THR CG2 C -8.759 -0.946 4.044 1.00 . A A . 27 THR CG2 1 1 4 2019 1 1 27 THR H H -8.599 -0.601 0.940 1.00 . A A . 27 THR H 1 1 4 2020 1 1 27 THR HA H -10.843 -1.543 2.509 1.00 . A A . 27 THR HA 1 1 4 2021 1 1 27 THR HB H -10.345 0.471 3.927 1.00 . A A . 27 THR HB 1 1 4 2022 1 1 27 THR HG1 H -9.341 1.843 2.501 1.00 . A A . 27 THR HG1 1 1 4 2023 1 1 27 THR HG21 H -8.045 -1.411 3.381 1.00 . A A . 27 THR HG21 1 1 4 2024 1 1 27 THR HG22 H -9.393 -1.706 4.478 1.00 . A A . 27 THR HG22 1 1 4 2025 1 1 27 THR HG23 H -8.234 -0.424 4.830 1.00 . A A . 27 THR HG23 1 1 4 2026 1 1 27 THR N N -9.436 -1.099 1.073 1.00 . A A . 27 THR N 1 1 4 2027 1 1 27 THR O O -11.646 1.368 2.047 1.00 . A A . 27 THR O 1 1 4 2028 1 1 27 THR OG1 O -8.784 1.092 2.739 1.00 . A A . 27 THR OG1 1 1 4 2029 1 1 28 GLY C C -14.405 0.457 0.613 1.00 . A A . 28 GLY C 1 1 4 2030 1 1 28 GLY CA C -13.105 0.600 -0.147 1.00 . A A . 28 GLY CA 1 1 4 2031 1 1 28 GLY H H -11.803 -1.049 0.090 1.00 . A A . 28 GLY H 1 1 4 2032 1 1 28 GLY HA2 H -12.813 1.639 -0.163 1.00 . A A . 28 GLY HA2 1 1 4 2033 1 1 28 GLY HA3 H -13.252 0.259 -1.160 1.00 . A A . 28 GLY HA3 1 1 4 2034 1 1 28 GLY N N -12.051 -0.176 0.463 1.00 . A A . 28 GLY N 1 1 4 2035 1 1 28 GLY O O -14.779 -0.654 1.000 1.00 . A A . 28 GLY O 1 1 4 2036 1 1 29 GLU C C -17.418 0.848 0.799 1.00 . A A . 29 GLU C 1 1 4 2037 1 1 29 GLU CA C -16.330 1.560 1.594 1.00 . A A . 29 GLU CA 1 1 4 2038 1 1 29 GLU CB C -16.764 2.992 1.920 1.00 . A A . 29 GLU CB 1 1 4 2039 1 1 29 GLU CD C -17.304 2.581 4.344 1.00 . A A . 29 GLU CD 1 1 4 2040 1 1 29 GLU CG C -17.818 3.079 3.010 1.00 . A A . 29 GLU CG 1 1 4 2041 1 1 29 GLU H H -14.742 2.422 0.498 1.00 . A A . 29 GLU H 1 1 4 2042 1 1 29 GLU HA H -16.160 1.021 2.515 1.00 . A A . 29 GLU HA 1 1 4 2043 1 1 29 GLU HB2 H -15.899 3.554 2.241 1.00 . A A . 29 GLU HB2 1 1 4 2044 1 1 29 GLU HB3 H -17.166 3.447 1.027 1.00 . A A . 29 GLU HB3 1 1 4 2045 1 1 29 GLU HG2 H -18.123 4.109 3.118 1.00 . A A . 29 GLU HG2 1 1 4 2046 1 1 29 GLU HG3 H -18.668 2.479 2.721 1.00 . A A . 29 GLU HG3 1 1 4 2047 1 1 29 GLU N N -15.086 1.570 0.843 1.00 . A A . 29 GLU N 1 1 4 2048 1 1 29 GLU O O -18.088 -0.053 1.305 1.00 . A A . 29 GLU O 1 1 4 2049 1 1 29 GLU OE1 O -16.459 3.269 4.953 1.00 . A A . 29 GLU OE1 1 1 4 2050 1 1 29 GLU OE2 O -17.743 1.503 4.796 1.00 . A A . 29 GLU OE2 1 1 4 2051 1 1 30 LYS C C -17.882 0.078 -2.571 1.00 . A A . 30 LYS C 1 1 4 2052 1 1 30 LYS CA C -18.561 0.636 -1.331 1.00 . A A . 30 LYS CA 1 1 4 2053 1 1 30 LYS CB C -19.636 1.651 -1.725 1.00 . A A . 30 LYS CB 1 1 4 2054 1 1 30 LYS CD C -21.544 3.117 -0.994 1.00 . A A . 30 LYS CD 1 1 4 2055 1 1 30 LYS CE C -22.487 3.469 0.145 1.00 . A A . 30 LYS CE 1 1 4 2056 1 1 30 LYS CG C -20.534 2.064 -0.570 1.00 . A A . 30 LYS CG 1 1 4 2057 1 1 30 LYS H H -17.018 1.976 -0.798 1.00 . A A . 30 LYS H 1 1 4 2058 1 1 30 LYS HA H -19.025 -0.177 -0.792 1.00 . A A . 30 LYS HA 1 1 4 2059 1 1 30 LYS HB2 H -19.154 2.538 -2.111 1.00 . A A . 30 LYS HB2 1 1 4 2060 1 1 30 LYS HB3 H -20.255 1.222 -2.500 1.00 . A A . 30 LYS HB3 1 1 4 2061 1 1 30 LYS HD2 H -21.015 4.007 -1.299 1.00 . A A . 30 LYS HD2 1 1 4 2062 1 1 30 LYS HD3 H -22.122 2.736 -1.823 1.00 . A A . 30 LYS HD3 1 1 4 2063 1 1 30 LYS HE2 H -23.071 2.595 0.393 1.00 . A A . 30 LYS HE2 1 1 4 2064 1 1 30 LYS HE3 H -21.901 3.762 1.003 1.00 . A A . 30 LYS HE3 1 1 4 2065 1 1 30 LYS HG2 H -21.064 1.194 -0.210 1.00 . A A . 30 LYS HG2 1 1 4 2066 1 1 30 LYS HG3 H -19.921 2.466 0.223 1.00 . A A . 30 LYS HG3 1 1 4 2067 1 1 30 LYS HZ1 H -23.999 4.308 -1.025 1.00 . A A . 30 LYS HZ1 1 1 4 2068 1 1 30 LYS HZ2 H -22.868 5.429 -0.462 1.00 . A A . 30 LYS HZ2 1 1 4 2069 1 1 30 LYS HZ3 H -24.029 4.800 0.591 1.00 . A A . 30 LYS HZ3 1 1 4 2070 1 1 30 LYS N N -17.580 1.249 -0.453 1.00 . A A . 30 LYS N 1 1 4 2071 1 1 30 LYS NZ N -23.410 4.577 -0.213 1.00 . A A . 30 LYS NZ 1 1 4 2072 1 1 30 LYS O O -17.843 0.720 -3.620 1.00 . A A . 30 LYS O 1 1 4 2073 1 1 31 NH2 HN1 H -17.405 -1.569 -1.577 1.00 . A A . 31 NH2 HN1 1 1 4 2074 1 1 31 NH2 HN2 H -16.879 -1.499 -3.221 1.00 . A A . 31 NH2 HN2 1 1 4 2075 1 1 31 NH2 N N -17.334 -1.114 -2.445 1.00 . A A . 31 NH2 N 1 1 4 2076 2 2 1 ZN ZN ZN -2.635 -4.315 -2.479 1.00 . B A . 101 ZN ZN 1 1 5 2077 1 1 1 ARG C C 11.716 -0.794 2.814 1.00 . A A . 1 ARG C 1 1 5 2078 1 1 1 ARG CA C 12.769 -1.237 3.821 1.00 . A A . 1 ARG CA 1 1 5 2079 1 1 1 ARG CB C 12.077 -1.907 5.017 1.00 . A A . 1 ARG CB 1 1 5 2080 1 1 1 ARG CD C 10.200 -1.827 6.698 1.00 . A A . 1 ARG CD 1 1 5 2081 1 1 1 ARG CG C 10.976 -1.059 5.641 1.00 . A A . 1 ARG CG 1 1 5 2082 1 1 1 ARG CZ C 10.648 -3.008 8.815 1.00 . A A . 1 ARG CZ 1 1 5 2083 1 1 1 ARG H1 H 14.239 -0.347 4.998 1.00 . A A . 1 ARG H1 1 1 5 2084 1 1 1 ARG H2 H 12.925 0.660 4.655 1.00 . A A . 1 ARG H2 1 1 5 2085 1 1 1 ARG H3 H 14.074 0.339 3.461 1.00 . A A . 1 ARG H3 1 1 5 2086 1 1 1 ARG HA H 13.437 -1.941 3.349 1.00 . A A . 1 ARG HA 1 1 5 2087 1 1 1 ARG HB2 H 11.641 -2.839 4.692 1.00 . A A . 1 ARG HB2 1 1 5 2088 1 1 1 ARG HB3 H 12.817 -2.112 5.778 1.00 . A A . 1 ARG HB3 1 1 5 2089 1 1 1 ARG HD2 H 9.371 -1.219 7.031 1.00 . A A . 1 ARG HD2 1 1 5 2090 1 1 1 ARG HD3 H 9.819 -2.738 6.257 1.00 . A A . 1 ARG HD3 1 1 5 2091 1 1 1 ARG HE H 11.908 -1.738 7.917 1.00 . A A . 1 ARG HE 1 1 5 2092 1 1 1 ARG HG2 H 11.425 -0.189 6.100 1.00 . A A . 1 ARG HG2 1 1 5 2093 1 1 1 ARG HG3 H 10.296 -0.744 4.863 1.00 . A A . 1 ARG HG3 1 1 5 2094 1 1 1 ARG HH11 H 9.187 -4.251 9.472 1.00 . A A . 1 ARG HH11 1 1 5 2095 1 1 1 ARG HH12 H 8.864 -3.459 7.964 1.00 . A A . 1 ARG HH12 1 1 5 2096 1 1 1 ARG HH21 H 12.344 -2.782 9.900 1.00 . A A . 1 ARG HH21 1 1 5 2097 1 1 1 ARG HH22 H 11.171 -3.871 10.572 1.00 . A A . 1 ARG HH22 1 1 5 2098 1 1 1 ARG N N 13.556 -0.067 4.266 1.00 . A A . 1 ARG N 1 1 5 2099 1 1 1 ARG NE N 11.027 -2.170 7.851 1.00 . A A . 1 ARG NE 1 1 5 2100 1 1 1 ARG NH1 N 9.472 -3.620 8.743 1.00 . A A . 1 ARG NH1 1 1 5 2101 1 1 1 ARG NH2 N 11.451 -3.238 9.844 1.00 . A A . 1 ARG NH2 1 1 5 2102 1 1 1 ARG O O 11.228 0.334 2.880 1.00 . A A . 1 ARG O 1 1 5 2103 1 1 2 PRO C C 8.916 -1.583 1.605 1.00 . A A . 2 PRO C 1 1 5 2104 1 1 2 PRO CA C 10.270 -1.388 0.935 1.00 . A A . 2 PRO CA 1 1 5 2105 1 1 2 PRO CB C 10.472 -2.411 -0.179 1.00 . A A . 2 PRO CB 1 1 5 2106 1 1 2 PRO CD C 12.007 -2.961 1.579 1.00 . A A . 2 PRO CD 1 1 5 2107 1 1 2 PRO CG C 11.153 -3.555 0.485 1.00 . A A . 2 PRO CG 1 1 5 2108 1 1 2 PRO HA H 10.332 -0.388 0.531 1.00 . A A . 2 PRO HA 1 1 5 2109 1 1 2 PRO HB2 H 9.512 -2.699 -0.585 1.00 . A A . 2 PRO HB2 1 1 5 2110 1 1 2 PRO HB3 H 11.088 -1.983 -0.956 1.00 . A A . 2 PRO HB3 1 1 5 2111 1 1 2 PRO HD2 H 11.991 -3.594 2.453 1.00 . A A . 2 PRO HD2 1 1 5 2112 1 1 2 PRO HD3 H 13.020 -2.820 1.231 1.00 . A A . 2 PRO HD3 1 1 5 2113 1 1 2 PRO HG2 H 10.415 -4.222 0.906 1.00 . A A . 2 PRO HG2 1 1 5 2114 1 1 2 PRO HG3 H 11.768 -4.080 -0.230 1.00 . A A . 2 PRO HG3 1 1 5 2115 1 1 2 PRO N N 11.363 -1.661 1.856 1.00 . A A . 2 PRO N 1 1 5 2116 1 1 2 PRO O O 8.756 -2.447 2.471 1.00 . A A . 2 PRO O 1 1 5 2117 1 1 3 PHE C C 5.733 -1.713 0.919 1.00 . A A . 3 PHE C 1 1 5 2118 1 1 3 PHE CA C 6.624 -0.827 1.776 1.00 . A A . 3 PHE CA 1 1 5 2119 1 1 3 PHE CB C 6.055 0.587 1.879 1.00 . A A . 3 PHE CB 1 1 5 2120 1 1 3 PHE CD1 C 7.833 2.319 2.224 1.00 . A A . 3 PHE CD1 1 1 5 2121 1 1 3 PHE CD2 C 6.682 1.476 4.132 1.00 . A A . 3 PHE CD2 1 1 5 2122 1 1 3 PHE CE1 C 8.589 3.138 3.037 1.00 . A A . 3 PHE CE1 1 1 5 2123 1 1 3 PHE CE2 C 7.435 2.294 4.951 1.00 . A A . 3 PHE CE2 1 1 5 2124 1 1 3 PHE CG C 6.871 1.481 2.763 1.00 . A A . 3 PHE CG 1 1 5 2125 1 1 3 PHE CZ C 8.392 3.126 4.403 1.00 . A A . 3 PHE CZ 1 1 5 2126 1 1 3 PHE H H 8.144 -0.130 0.493 1.00 . A A . 3 PHE H 1 1 5 2127 1 1 3 PHE HA H 6.699 -1.254 2.764 1.00 . A A . 3 PHE HA 1 1 5 2128 1 1 3 PHE HB2 H 6.021 1.031 0.897 1.00 . A A . 3 PHE HB2 1 1 5 2129 1 1 3 PHE HB3 H 5.057 0.542 2.284 1.00 . A A . 3 PHE HB3 1 1 5 2130 1 1 3 PHE HD1 H 7.987 2.331 1.155 1.00 . A A . 3 PHE HD1 1 1 5 2131 1 1 3 PHE HD2 H 5.935 0.824 4.560 1.00 . A A . 3 PHE HD2 1 1 5 2132 1 1 3 PHE HE1 H 9.334 3.787 2.604 1.00 . A A . 3 PHE HE1 1 1 5 2133 1 1 3 PHE HE2 H 7.276 2.280 6.019 1.00 . A A . 3 PHE HE2 1 1 5 2134 1 1 3 PHE HZ H 8.982 3.767 5.041 1.00 . A A . 3 PHE HZ 1 1 5 2135 1 1 3 PHE N N 7.956 -0.778 1.207 1.00 . A A . 3 PHE N 1 1 5 2136 1 1 3 PHE O O 5.149 -1.266 -0.063 1.00 . A A . 3 PHE O 1 1 5 2137 1 1 4 NLE C C 3.555 -4.232 1.054 1.00 . A A . 4 NLE C 1 1 5 2138 1 1 4 NLE CA C 4.947 -3.966 0.493 1.00 . A A . 4 NLE CA 1 1 5 2139 1 1 4 NLE CB C 5.756 -5.266 0.446 1.00 . A A . 4 NLE CB 1 1 5 2140 1 1 4 NLE CD C 6.021 -7.589 -0.474 1.00 . A A . 4 NLE CD 1 1 5 2141 1 1 4 NLE CE C 5.406 -8.636 -1.377 1.00 . A A . 4 NLE CE 1 1 5 2142 1 1 4 NLE CG C 5.157 -6.338 -0.452 1.00 . A A . 4 NLE CG 1 1 5 2143 1 1 4 NLE H H 6.063 -3.250 2.139 1.00 . A A . 4 NLE H 1 1 5 2144 1 1 4 NLE HA H 4.850 -3.574 -0.507 1.00 . A A . 4 NLE HA 1 1 5 2145 1 1 4 NLE HB2 H 5.826 -5.666 1.447 1.00 . A A . 4 NLE HB2 1 1 5 2146 1 1 4 NLE HB3 H 6.750 -5.044 0.090 1.00 . A A . 4 NLE HB3 1 1 5 2147 1 1 4 NLE HD2 H 6.097 -7.992 0.526 1.00 . A A . 4 NLE HD2 1 1 5 2148 1 1 4 NLE HD3 H 7.002 -7.340 -0.850 1.00 . A A . 4 NLE HD3 1 1 5 2149 1 1 4 NLE HE1 H 4.433 -8.910 -1.001 1.00 . A A . 4 NLE HE1 1 1 5 2150 1 1 4 NLE HE2 H 6.042 -9.509 -1.401 1.00 . A A . 4 NLE HE2 1 1 5 2151 1 1 4 NLE HE3 H 5.308 -8.236 -2.376 1.00 . A A . 4 NLE HE3 1 1 5 2152 1 1 4 NLE HG2 H 5.077 -5.949 -1.456 1.00 . A A . 4 NLE HG2 1 1 5 2153 1 1 4 NLE HG3 H 4.174 -6.595 -0.084 1.00 . A A . 4 NLE HG3 1 1 5 2154 1 1 4 NLE N N 5.651 -2.977 1.293 1.00 . A A . 4 NLE N 1 1 5 2155 1 1 4 NLE O O 3.378 -4.379 2.268 1.00 . A A . 4 NLE O 1 1 5 2156 1 1 5 CYS C C 1.117 -6.069 0.957 1.00 . A A . 5 CYS C 1 1 5 2157 1 1 5 CYS CA C 1.208 -4.604 0.532 1.00 . A A . 5 CYS CA 1 1 5 2158 1 1 5 CYS CB C 0.259 -4.321 -0.640 1.00 . A A . 5 CYS CB 1 1 5 2159 1 1 5 CYS H H 2.781 -4.068 -0.778 1.00 . A A . 5 CYS H 1 1 5 2160 1 1 5 CYS HA H 0.930 -3.981 1.368 1.00 . A A . 5 CYS HA 1 1 5 2161 1 1 5 CYS HB2 H 0.237 -3.256 -0.825 1.00 . A A . 5 CYS HB2 1 1 5 2162 1 1 5 CYS HB3 H 0.626 -4.823 -1.519 1.00 . A A . 5 CYS HB3 1 1 5 2163 1 1 5 CYS N N 2.574 -4.271 0.163 1.00 . A A . 5 CYS N 1 1 5 2164 1 1 5 CYS O O 1.866 -6.914 0.468 1.00 . A A . 5 CYS O 1 1 5 2165 1 1 5 CYS SG S -1.445 -4.859 -0.363 1.00 . A A . 5 CYS SG 1 1 5 2166 1 1 6 THR C C -1.424 -8.070 2.524 1.00 . A A . 6 THR C 1 1 5 2167 1 1 6 THR CA C 0.050 -7.699 2.407 1.00 . A A . 6 THR CA 1 1 5 2168 1 1 6 THR CB C 0.723 -7.821 3.788 1.00 . A A . 6 THR CB 1 1 5 2169 1 1 6 THR CG2 C 2.228 -7.990 3.653 1.00 . A A . 6 THR CG2 1 1 5 2170 1 1 6 THR H H -0.386 -5.649 2.193 1.00 . A A . 6 THR H 1 1 5 2171 1 1 6 THR HA H 0.532 -8.388 1.731 1.00 . A A . 6 THR HA 1 1 5 2172 1 1 6 THR HB H 0.323 -8.690 4.291 1.00 . A A . 6 THR HB 1 1 5 2173 1 1 6 THR HG1 H -0.094 -6.909 5.343 1.00 . A A . 6 THR HG1 1 1 5 2174 1 1 6 THR HG21 H 2.639 -7.144 3.122 1.00 . A A . 6 THR HG21 1 1 5 2175 1 1 6 THR HG22 H 2.442 -8.897 3.106 1.00 . A A . 6 THR HG22 1 1 5 2176 1 1 6 THR HG23 H 2.675 -8.048 4.636 1.00 . A A . 6 THR HG23 1 1 5 2177 1 1 6 THR N N 0.207 -6.357 1.872 1.00 . A A . 6 THR N 1 1 5 2178 1 1 6 THR O O -1.904 -8.440 3.597 1.00 . A A . 6 THR O 1 1 5 2179 1 1 6 THR OG1 O 0.436 -6.654 4.575 1.00 . A A . 6 THR OG1 1 1 5 2180 1 1 7 TRP C C -3.798 -9.612 0.703 1.00 . A A . 7 TRP C 1 1 5 2181 1 1 7 TRP CA C -3.562 -8.280 1.404 1.00 . A A . 7 TRP CA 1 1 5 2182 1 1 7 TRP CB C -4.350 -7.166 0.715 1.00 . A A . 7 TRP CB 1 1 5 2183 1 1 7 TRP CD1 C -6.738 -7.934 0.192 1.00 . A A . 7 TRP CD1 1 1 5 2184 1 1 7 TRP CD2 C -6.566 -6.631 2.002 1.00 . A A . 7 TRP CD2 1 1 5 2185 1 1 7 TRP CE2 C -7.917 -6.981 1.830 1.00 . A A . 7 TRP CE2 1 1 5 2186 1 1 7 TRP CE3 C -6.212 -5.813 3.079 1.00 . A A . 7 TRP CE3 1 1 5 2187 1 1 7 TRP CG C -5.828 -7.253 0.945 1.00 . A A . 7 TRP CG 1 1 5 2188 1 1 7 TRP CH2 C -8.542 -5.740 3.740 1.00 . A A . 7 TRP CH2 1 1 5 2189 1 1 7 TRP CZ2 C -8.917 -6.540 2.695 1.00 . A A . 7 TRP CZ2 1 1 5 2190 1 1 7 TRP CZ3 C -7.204 -5.376 3.937 1.00 . A A . 7 TRP CZ3 1 1 5 2191 1 1 7 TRP H H -1.712 -7.669 0.587 1.00 . A A . 7 TRP H 1 1 5 2192 1 1 7 TRP HA H -3.893 -8.364 2.429 1.00 . A A . 7 TRP HA 1 1 5 2193 1 1 7 TRP HB2 H -4.010 -6.211 1.083 1.00 . A A . 7 TRP HB2 1 1 5 2194 1 1 7 TRP HB3 H -4.175 -7.219 -0.348 1.00 . A A . 7 TRP HB3 1 1 5 2195 1 1 7 TRP HD1 H -6.488 -8.509 -0.686 1.00 . A A . 7 TRP HD1 1 1 5 2196 1 1 7 TRP HE1 H -8.819 -8.175 0.356 1.00 . A A . 7 TRP HE1 1 1 5 2197 1 1 7 TRP HE3 H -5.185 -5.524 3.246 1.00 . A A . 7 TRP HE3 1 1 5 2198 1 1 7 TRP HH2 H -9.284 -5.376 4.435 1.00 . A A . 7 TRP HH2 1 1 5 2199 1 1 7 TRP HZ2 H -9.954 -6.813 2.557 1.00 . A A . 7 TRP HZ2 1 1 5 2200 1 1 7 TRP HZ3 H -6.949 -4.744 4.775 1.00 . A A . 7 TRP HZ3 1 1 5 2201 1 1 7 TRP N N -2.144 -7.964 1.417 1.00 . A A . 7 TRP N 1 1 5 2202 1 1 7 TRP NE1 N -7.996 -7.778 0.719 1.00 . A A . 7 TRP NE1 1 1 5 2203 1 1 7 TRP O O -4.098 -9.654 -0.492 1.00 . A A . 7 TRP O 1 1 5 2204 1 1 8 ORN C C -1.565 -10.876 -2.527 1.00 . A A . 8 ORN C 1 1 5 2205 1 1 8 ORN CA C -2.193 -12.010 -1.731 1.00 . A A . 8 ORN CA 1 1 5 2206 1 1 8 ORN CB C -1.604 -12.035 -0.317 1.00 . A A . 8 ORN CB 1 1 5 2207 1 1 8 ORN CD C -3.791 -12.061 0.934 1.00 . A A . 8 ORN CD 1 1 5 2208 1 1 8 ORN CG C -2.464 -12.775 0.694 1.00 . A A . 8 ORN CG 1 1 5 2209 1 1 8 ORN H H -2.398 -14.078 -1.838 1.00 . A A . 8 ORN H 1 1 5 2210 1 1 8 ORN HA H -3.256 -11.832 -1.662 1.00 . A A . 8 ORN HA 1 1 5 2211 1 1 8 ORN HB2 H -1.482 -11.018 0.026 1.00 . A A . 8 ORN HB2 1 1 5 2212 1 1 8 ORN HB3 H -0.636 -12.511 -0.351 1.00 . A A . 8 ORN HB3 1 1 5 2213 1 1 8 ORN HD2 H -4.362 -12.623 1.657 1.00 . A A . 8 ORN HD2 1 1 5 2214 1 1 8 ORN HD3 H -4.337 -12.016 0.004 1.00 . A A . 8 ORN HD3 1 1 5 2215 1 1 8 ORN HE1 H -3.317 -10.593 2.367 1.00 . A A . 8 ORN HE1 1 1 5 2216 1 1 8 ORN HG2 H -1.925 -12.842 1.628 1.00 . A A . 8 ORN HG2 1 1 5 2217 1 1 8 ORN HG3 H -2.664 -13.770 0.321 1.00 . A A . 8 ORN HG3 1 1 5 2218 1 1 8 ORN N N -1.989 -13.310 -2.404 1.00 . A A . 8 ORN N 1 1 5 2219 1 1 8 ORN NE N -3.607 -10.699 1.436 1.00 . A A . 8 ORN NE 1 1 5 2220 1 1 8 ORN O O -0.488 -11.026 -3.105 1.00 . A A . 8 ORN O 1 1 5 2221 1 1 9 CYS C C -0.565 -8.001 -2.446 1.00 . A A . 9 CYS C 1 1 5 2222 1 1 9 CYS CA C -1.774 -8.547 -3.201 1.00 . A A . 9 CYS CA 1 1 5 2223 1 1 9 CYS CB C -2.898 -7.512 -3.242 1.00 . A A . 9 CYS CB 1 1 5 2224 1 1 9 CYS H H -3.137 -9.727 -2.109 1.00 . A A . 9 CYS H 1 1 5 2225 1 1 9 CYS HA H -1.483 -8.799 -4.208 1.00 . A A . 9 CYS HA 1 1 5 2226 1 1 9 CYS HB2 H -3.691 -7.876 -3.881 1.00 . A A . 9 CYS HB2 1 1 5 2227 1 1 9 CYS HB3 H -3.286 -7.378 -2.244 1.00 . A A . 9 CYS HB3 1 1 5 2228 1 1 9 CYS N N -2.259 -9.751 -2.552 1.00 . A A . 9 CYS N 1 1 5 2229 1 1 9 CYS O O -0.592 -7.905 -1.217 1.00 . A A . 9 CYS O 1 1 5 2230 1 1 9 CYS SG S -2.405 -5.895 -3.860 1.00 . A A . 9 CYS SG 1 1 5 2231 1 1 10 GLY C C 2.585 -6.343 -3.410 1.00 . A A . 10 GLY C 1 1 5 2232 1 1 10 GLY CA C 1.710 -7.216 -2.532 1.00 . A A . 10 GLY CA 1 1 5 2233 1 1 10 GLY H H 0.439 -7.687 -4.153 1.00 . A A . 10 GLY H 1 1 5 2234 1 1 10 GLY HA2 H 1.453 -6.663 -1.641 1.00 . A A . 10 GLY HA2 1 1 5 2235 1 1 10 GLY HA3 H 2.273 -8.089 -2.244 1.00 . A A . 10 GLY HA3 1 1 5 2236 1 1 10 GLY N N 0.490 -7.650 -3.175 1.00 . A A . 10 GLY N 1 1 5 2237 1 1 10 GLY O O 3.693 -6.736 -3.773 1.00 . A A . 10 GLY O 1 1 5 2238 1 1 11 LYS C C 3.930 -3.565 -3.516 1.00 . A A . 11 LYS C 1 1 5 2239 1 1 11 LYS CA C 2.908 -4.182 -4.468 1.00 . A A . 11 LYS CA 1 1 5 2240 1 1 11 LYS CB C 2.031 -3.083 -5.071 1.00 . A A . 11 LYS CB 1 1 5 2241 1 1 11 LYS CD C 0.330 -2.412 -6.795 1.00 . A A . 11 LYS CD 1 1 5 2242 1 1 11 LYS CE C 1.190 -1.325 -7.424 1.00 . A A . 11 LYS CE 1 1 5 2243 1 1 11 LYS CG C 1.169 -3.550 -6.230 1.00 . A A . 11 LYS CG 1 1 5 2244 1 1 11 LYS H H 1.162 -4.949 -3.548 1.00 . A A . 11 LYS H 1 1 5 2245 1 1 11 LYS HA H 3.433 -4.693 -5.262 1.00 . A A . 11 LYS HA 1 1 5 2246 1 1 11 LYS HB2 H 1.376 -2.703 -4.300 1.00 . A A . 11 LYS HB2 1 1 5 2247 1 1 11 LYS HB3 H 2.665 -2.282 -5.420 1.00 . A A . 11 LYS HB3 1 1 5 2248 1 1 11 LYS HD2 H -0.333 -2.808 -7.548 1.00 . A A . 11 LYS HD2 1 1 5 2249 1 1 11 LYS HD3 H -0.251 -1.979 -5.995 1.00 . A A . 11 LYS HD3 1 1 5 2250 1 1 11 LYS HE2 H 1.842 -0.918 -6.667 1.00 . A A . 11 LYS HE2 1 1 5 2251 1 1 11 LYS HE3 H 1.784 -1.764 -8.211 1.00 . A A . 11 LYS HE3 1 1 5 2252 1 1 11 LYS HG2 H 1.810 -3.933 -7.010 1.00 . A A . 11 LYS HG2 1 1 5 2253 1 1 11 LYS HG3 H 0.511 -4.332 -5.883 1.00 . A A . 11 LYS HG3 1 1 5 2254 1 1 11 LYS HZ1 H 0.976 0.457 -8.489 1.00 . A A . 11 LYS HZ1 1 1 5 2255 1 1 11 LYS HZ2 H -0.139 0.272 -7.237 1.00 . A A . 11 LYS HZ2 1 1 5 2256 1 1 11 LYS HZ3 H -0.326 -0.606 -8.666 1.00 . A A . 11 LYS HZ3 1 1 5 2257 1 1 11 LYS N N 2.092 -5.163 -3.761 1.00 . A A . 11 LYS N 1 1 5 2258 1 1 11 LYS NZ N 0.368 -0.225 -7.993 1.00 . A A . 11 LYS NZ 1 1 5 2259 1 1 11 LYS O O 3.648 -3.390 -2.329 1.00 . A A . 11 LYS O 1 1 5 2260 1 1 12 ARG C C 6.354 -1.196 -3.503 1.00 . A A . 12 ARG C 1 1 5 2261 1 1 12 ARG CA C 6.178 -2.680 -3.211 1.00 . A A . 12 ARG CA 1 1 5 2262 1 1 12 ARG CB C 7.499 -3.407 -3.466 1.00 . A A . 12 ARG CB 1 1 5 2263 1 1 12 ARG CD C 8.786 -5.567 -3.469 1.00 . A A . 12 ARG CD 1 1 5 2264 1 1 12 ARG CG C 7.437 -4.906 -3.221 1.00 . A A . 12 ARG CG 1 1 5 2265 1 1 12 ARG CZ C 10.524 -5.482 -5.229 1.00 . A A . 12 ARG CZ 1 1 5 2266 1 1 12 ARG H H 5.270 -3.389 -4.990 1.00 . A A . 12 ARG H 1 1 5 2267 1 1 12 ARG HA H 5.898 -2.800 -2.175 1.00 . A A . 12 ARG HA 1 1 5 2268 1 1 12 ARG HB2 H 7.792 -3.245 -4.492 1.00 . A A . 12 ARG HB2 1 1 5 2269 1 1 12 ARG HB3 H 8.257 -2.991 -2.817 1.00 . A A . 12 ARG HB3 1 1 5 2270 1 1 12 ARG HD2 H 9.512 -5.134 -2.797 1.00 . A A . 12 ARG HD2 1 1 5 2271 1 1 12 ARG HD3 H 8.698 -6.624 -3.269 1.00 . A A . 12 ARG HD3 1 1 5 2272 1 1 12 ARG HE H 8.569 -5.173 -5.529 1.00 . A A . 12 ARG HE 1 1 5 2273 1 1 12 ARG HG2 H 7.141 -5.082 -2.197 1.00 . A A . 12 ARG HG2 1 1 5 2274 1 1 12 ARG HG3 H 6.705 -5.340 -3.886 1.00 . A A . 12 ARG HG3 1 1 5 2275 1 1 12 ARG HH11 H 11.234 -5.896 -3.376 1.00 . A A . 12 ARG HH11 1 1 5 2276 1 1 12 ARG HH12 H 12.428 -5.841 -4.633 1.00 . A A . 12 ARG HH12 1 1 5 2277 1 1 12 ARG HH21 H 11.804 -5.369 -6.800 1.00 . A A . 12 ARG HH21 1 1 5 2278 1 1 12 ARG HH22 H 10.134 -5.081 -7.176 1.00 . A A . 12 ARG HH22 1 1 5 2279 1 1 12 ARG N N 5.112 -3.247 -4.032 1.00 . A A . 12 ARG N 1 1 5 2280 1 1 12 ARG NE N 9.251 -5.382 -4.846 1.00 . A A . 12 ARG NE 1 1 5 2281 1 1 12 ARG NH1 N 11.472 -5.760 -4.340 1.00 . A A . 12 ARG NH1 1 1 5 2282 1 1 12 ARG NH2 N 10.847 -5.296 -6.503 1.00 . A A . 12 ARG NH2 1 1 5 2283 1 1 12 ARG O O 6.604 -0.801 -4.642 1.00 . A A . 12 ARG O 1 1 5 2284 1 1 13 PHE C C 7.568 1.574 -1.876 1.00 . A A . 13 PHE C 1 1 5 2285 1 1 13 PHE CA C 6.342 1.059 -2.611 1.00 . A A . 13 PHE CA 1 1 5 2286 1 1 13 PHE CB C 5.083 1.725 -2.059 1.00 . A A . 13 PHE CB 1 1 5 2287 1 1 13 PHE CD1 C 3.336 1.914 -3.838 1.00 . A A . 13 PHE CD1 1 1 5 2288 1 1 13 PHE CD2 C 3.152 0.144 -2.255 1.00 . A A . 13 PHE CD2 1 1 5 2289 1 1 13 PHE CE1 C 2.179 1.490 -4.453 1.00 . A A . 13 PHE CE1 1 1 5 2290 1 1 13 PHE CE2 C 1.995 -0.287 -2.867 1.00 . A A . 13 PHE CE2 1 1 5 2291 1 1 13 PHE CG C 3.834 1.247 -2.733 1.00 . A A . 13 PHE CG 1 1 5 2292 1 1 13 PHE CZ C 1.540 0.339 -3.990 1.00 . A A . 13 PHE CZ 1 1 5 2293 1 1 13 PHE H H 6.058 -0.762 -1.580 1.00 . A A . 13 PHE H 1 1 5 2294 1 1 13 PHE HA H 6.433 1.291 -3.660 1.00 . A A . 13 PHE HA 1 1 5 2295 1 1 13 PHE HB2 H 4.996 1.508 -1.004 1.00 . A A . 13 PHE HB2 1 1 5 2296 1 1 13 PHE HB3 H 5.153 2.792 -2.202 1.00 . A A . 13 PHE HB3 1 1 5 2297 1 1 13 PHE HD1 H 3.861 2.778 -4.216 1.00 . A A . 13 PHE HD1 1 1 5 2298 1 1 13 PHE HD2 H 3.533 -0.384 -1.395 1.00 . A A . 13 PHE HD2 1 1 5 2299 1 1 13 PHE HE1 H 1.799 2.019 -5.315 1.00 . A A . 13 PHE HE1 1 1 5 2300 1 1 13 PHE HE2 H 1.470 -1.149 -2.486 1.00 . A A . 13 PHE HE2 1 1 5 2301 1 1 13 PHE HZ H 0.646 -0.016 -4.480 1.00 . A A . 13 PHE HZ 1 1 5 2302 1 1 13 PHE N N 6.233 -0.382 -2.471 1.00 . A A . 13 PHE N 1 1 5 2303 1 1 13 PHE O O 8.018 0.973 -0.904 1.00 . A A . 13 PHE O 1 1 5 2304 1 1 14 THR C C 8.806 4.355 -0.714 1.00 . A A . 14 THR C 1 1 5 2305 1 1 14 THR CA C 9.267 3.291 -1.710 1.00 . A A . 14 THR CA 1 1 5 2306 1 1 14 THR CB C 10.199 3.921 -2.762 1.00 . A A . 14 THR CB 1 1 5 2307 1 1 14 THR CG2 C 11.555 4.261 -2.161 1.00 . A A . 14 THR CG2 1 1 5 2308 1 1 14 THR H H 7.741 3.095 -3.157 1.00 . A A . 14 THR H 1 1 5 2309 1 1 14 THR HA H 9.811 2.521 -1.182 1.00 . A A . 14 THR HA 1 1 5 2310 1 1 14 THR HB H 9.744 4.829 -3.130 1.00 . A A . 14 THR HB 1 1 5 2311 1 1 14 THR HG1 H 9.954 2.161 -3.641 1.00 . A A . 14 THR HG1 1 1 5 2312 1 1 14 THR HG21 H 11.419 4.918 -1.316 1.00 . A A . 14 THR HG21 1 1 5 2313 1 1 14 THR HG22 H 12.166 4.752 -2.905 1.00 . A A . 14 THR HG22 1 1 5 2314 1 1 14 THR HG23 H 12.044 3.353 -1.838 1.00 . A A . 14 THR HG23 1 1 5 2315 1 1 14 THR N N 8.117 2.679 -2.351 1.00 . A A . 14 THR N 1 1 5 2316 1 1 14 THR O O 9.604 4.932 0.031 1.00 . A A . 14 THR O 1 1 5 2317 1 1 14 THR OG1 O 10.382 3.005 -3.855 1.00 . A A . 14 THR OG1 1 1 5 2318 1 1 15 ARG C C 5.739 4.968 0.947 1.00 . A A . 15 ARG C 1 1 5 2319 1 1 15 ARG CA C 6.920 5.580 0.200 1.00 . A A . 15 ARG CA 1 1 5 2320 1 1 15 ARG CB C 6.464 6.825 -0.568 1.00 . A A . 15 ARG CB 1 1 5 2321 1 1 15 ARG CD C 7.097 8.894 -1.834 1.00 . A A . 15 ARG CD 1 1 5 2322 1 1 15 ARG CG C 7.590 7.577 -1.257 1.00 . A A . 15 ARG CG 1 1 5 2323 1 1 15 ARG CZ C 5.449 10.484 -0.898 1.00 . A A . 15 ARG CZ 1 1 5 2324 1 1 15 ARG H H 6.922 4.123 -1.327 1.00 . A A . 15 ARG H 1 1 5 2325 1 1 15 ARG HA H 7.678 5.861 0.916 1.00 . A A . 15 ARG HA 1 1 5 2326 1 1 15 ARG HB2 H 5.752 6.523 -1.321 1.00 . A A . 15 ARG HB2 1 1 5 2327 1 1 15 ARG HB3 H 5.978 7.500 0.120 1.00 . A A . 15 ARG HB3 1 1 5 2328 1 1 15 ARG HD2 H 7.916 9.382 -2.338 1.00 . A A . 15 ARG HD2 1 1 5 2329 1 1 15 ARG HD3 H 6.310 8.690 -2.544 1.00 . A A . 15 ARG HD3 1 1 5 2330 1 1 15 ARG HE H 7.111 9.862 0.031 1.00 . A A . 15 ARG HE 1 1 5 2331 1 1 15 ARG HG2 H 8.371 7.778 -0.540 1.00 . A A . 15 ARG HG2 1 1 5 2332 1 1 15 ARG HG3 H 7.982 6.968 -2.059 1.00 . A A . 15 ARG HG3 1 1 5 2333 1 1 15 ARG HH11 H 5.037 9.876 -2.790 1.00 . A A . 15 ARG HH11 1 1 5 2334 1 1 15 ARG HH12 H 3.873 10.953 -2.091 1.00 . A A . 15 ARG HH12 1 1 5 2335 1 1 15 ARG HH21 H 5.588 11.301 0.954 1.00 . A A . 15 ARG HH21 1 1 5 2336 1 1 15 ARG HH22 H 4.191 11.768 0.038 1.00 . A A . 15 ARG HH22 1 1 5 2337 1 1 15 ARG N N 7.505 4.608 -0.705 1.00 . A A . 15 ARG N 1 1 5 2338 1 1 15 ARG NE N 6.581 9.785 -0.793 1.00 . A A . 15 ARG NE 1 1 5 2339 1 1 15 ARG NH1 N 4.731 10.436 -2.017 1.00 . A A . 15 ARG NH1 1 1 5 2340 1 1 15 ARG NH2 N 5.045 11.246 0.111 1.00 . A A . 15 ARG NH2 1 1 5 2341 1 1 15 ARG O O 4.847 4.361 0.346 1.00 . A A . 15 ARG O 1 1 5 2342 1 1 16 SER C C 3.354 5.245 2.803 1.00 . A A . 16 SER C 1 1 5 2343 1 1 16 SER CA C 4.699 4.605 3.122 1.00 . A A . 16 SER CA 1 1 5 2344 1 1 16 SER CB C 5.068 4.841 4.587 1.00 . A A . 16 SER CB 1 1 5 2345 1 1 16 SER H H 6.477 5.647 2.676 1.00 . A A . 16 SER H 1 1 5 2346 1 1 16 SER HA H 4.633 3.542 2.941 1.00 . A A . 16 SER HA 1 1 5 2347 1 1 16 SER HB2 H 4.186 4.733 5.199 1.00 . A A . 16 SER HB2 1 1 5 2348 1 1 16 SER HB3 H 5.808 4.116 4.892 1.00 . A A . 16 SER HB3 1 1 5 2349 1 1 16 SER HG H 5.091 6.597 5.460 1.00 . A A . 16 SER HG 1 1 5 2350 1 1 16 SER N N 5.745 5.139 2.263 1.00 . A A . 16 SER N 1 1 5 2351 1 1 16 SER O O 2.308 4.608 2.915 1.00 . A A . 16 SER O 1 1 5 2352 1 1 16 SER OG O 5.597 6.144 4.774 1.00 . A A . 16 SER OG 1 1 5 2353 1 1 17 ASP C C 1.593 6.599 0.751 1.00 . A A . 17 ASP C 1 1 5 2354 1 1 17 ASP CA C 2.190 7.224 2.001 1.00 . A A . 17 ASP CA 1 1 5 2355 1 1 17 ASP CB C 2.485 8.702 1.746 1.00 . A A . 17 ASP CB 1 1 5 2356 1 1 17 ASP CG C 2.926 9.435 2.994 1.00 . A A . 17 ASP CG 1 1 5 2357 1 1 17 ASP H H 4.258 6.977 2.385 1.00 . A A . 17 ASP H 1 1 5 2358 1 1 17 ASP HA H 1.474 7.140 2.803 1.00 . A A . 17 ASP HA 1 1 5 2359 1 1 17 ASP HB2 H 3.269 8.784 1.010 1.00 . A A . 17 ASP HB2 1 1 5 2360 1 1 17 ASP HB3 H 1.596 9.177 1.366 1.00 . A A . 17 ASP HB3 1 1 5 2361 1 1 17 ASP N N 3.394 6.509 2.402 1.00 . A A . 17 ASP N 1 1 5 2362 1 1 17 ASP O O 0.379 6.555 0.589 1.00 . A A . 17 ASP O 1 1 5 2363 1 1 17 ASP OD1 O 2.072 9.699 3.868 1.00 . A A . 17 ASP OD1 1 1 5 2364 1 1 17 ASP OD2 O 4.126 9.762 3.105 1.00 . A A . 17 ASP OD2 1 1 5 2365 1 1 18 GLU C C 1.453 4.085 -1.084 1.00 . A A . 18 GLU C 1 1 5 2366 1 1 18 GLU CA C 2.015 5.471 -1.352 1.00 . A A . 18 GLU CA 1 1 5 2367 1 1 18 GLU CB C 3.160 5.404 -2.355 1.00 . A A . 18 GLU CB 1 1 5 2368 1 1 18 GLU CD C 2.424 7.488 -3.557 1.00 . A A . 18 GLU CD 1 1 5 2369 1 1 18 GLU CG C 3.569 6.765 -2.878 1.00 . A A . 18 GLU CG 1 1 5 2370 1 1 18 GLU H H 3.411 6.133 0.082 1.00 . A A . 18 GLU H 1 1 5 2371 1 1 18 GLU HA H 1.230 6.085 -1.763 1.00 . A A . 18 GLU HA 1 1 5 2372 1 1 18 GLU HB2 H 4.017 4.951 -1.878 1.00 . A A . 18 GLU HB2 1 1 5 2373 1 1 18 GLU HB3 H 2.858 4.794 -3.192 1.00 . A A . 18 GLU HB3 1 1 5 2374 1 1 18 GLU HG2 H 3.914 7.368 -2.049 1.00 . A A . 18 GLU HG2 1 1 5 2375 1 1 18 GLU HG3 H 4.371 6.635 -3.589 1.00 . A A . 18 GLU HG3 1 1 5 2376 1 1 18 GLU N N 2.456 6.094 -0.117 1.00 . A A . 18 GLU N 1 1 5 2377 1 1 18 GLU O O 0.550 3.632 -1.786 1.00 . A A . 18 GLU O 1 1 5 2378 1 1 18 GLU OE1 O 1.832 8.391 -2.934 1.00 . A A . 18 GLU OE1 1 1 5 2379 1 1 18 GLU OE2 O 2.111 7.157 -4.718 1.00 . A A . 18 GLU OE2 1 1 5 2380 1 1 19 LEU C C 0.056 2.313 0.960 1.00 . A A . 19 LEU C 1 1 5 2381 1 1 19 LEU CA C 1.440 2.130 0.346 1.00 . A A . 19 LEU CA 1 1 5 2382 1 1 19 LEU CB C 2.366 1.422 1.338 1.00 . A A . 19 LEU CB 1 1 5 2383 1 1 19 LEU CD1 C 1.497 -0.883 0.842 1.00 . A A . 19 LEU CD1 1 1 5 2384 1 1 19 LEU CD2 C 2.749 -0.457 2.962 1.00 . A A . 19 LEU CD2 1 1 5 2385 1 1 19 LEU CG C 1.795 0.131 1.936 1.00 . A A . 19 LEU CG 1 1 5 2386 1 1 19 LEU H H 2.774 3.781 0.395 1.00 . A A . 19 LEU H 1 1 5 2387 1 1 19 LEU HA H 1.342 1.517 -0.538 1.00 . A A . 19 LEU HA 1 1 5 2388 1 1 19 LEU HB2 H 3.291 1.187 0.831 1.00 . A A . 19 LEU HB2 1 1 5 2389 1 1 19 LEU HB3 H 2.582 2.102 2.147 1.00 . A A . 19 LEU HB3 1 1 5 2390 1 1 19 LEU HD11 H 2.408 -1.118 0.313 1.00 . A A . 19 LEU HD11 1 1 5 2391 1 1 19 LEU HD12 H 0.775 -0.468 0.153 1.00 . A A . 19 LEU HD12 1 1 5 2392 1 1 19 LEU HD13 H 1.096 -1.781 1.284 1.00 . A A . 19 LEU HD13 1 1 5 2393 1 1 19 LEU HD21 H 3.046 0.312 3.660 1.00 . A A . 19 LEU HD21 1 1 5 2394 1 1 19 LEU HD22 H 3.623 -0.849 2.461 1.00 . A A . 19 LEU HD22 1 1 5 2395 1 1 19 LEU HD23 H 2.256 -1.255 3.497 1.00 . A A . 19 LEU HD23 1 1 5 2396 1 1 19 LEU HG H 0.865 0.359 2.438 1.00 . A A . 19 LEU HG 1 1 5 2397 1 1 19 LEU N N 1.988 3.414 -0.069 1.00 . A A . 19 LEU N 1 1 5 2398 1 1 19 LEU O O -0.863 1.559 0.660 1.00 . A A . 19 LEU O 1 1 5 2399 1 1 20 GLN C C -2.369 4.056 1.319 1.00 . A A . 20 GLN C 1 1 5 2400 1 1 20 GLN CA C -1.391 3.626 2.407 1.00 . A A . 20 GLN CA 1 1 5 2401 1 1 20 GLN CB C -1.267 4.723 3.465 1.00 . A A . 20 GLN CB 1 1 5 2402 1 1 20 GLN CD C -0.341 5.427 5.699 1.00 . A A . 20 GLN CD 1 1 5 2403 1 1 20 GLN CG C -0.422 4.327 4.664 1.00 . A A . 20 GLN CG 1 1 5 2404 1 1 20 GLN H H 0.692 3.867 2.059 1.00 . A A . 20 GLN H 1 1 5 2405 1 1 20 GLN HA H -1.762 2.725 2.872 1.00 . A A . 20 GLN HA 1 1 5 2406 1 1 20 GLN HB2 H -0.819 5.594 3.010 1.00 . A A . 20 GLN HB2 1 1 5 2407 1 1 20 GLN HB3 H -2.255 4.979 3.817 1.00 . A A . 20 GLN HB3 1 1 5 2408 1 1 20 GLN HE21 H 1.224 6.215 4.771 1.00 . A A . 20 GLN HE21 1 1 5 2409 1 1 20 GLN HE22 H 0.696 7.047 6.191 1.00 . A A . 20 GLN HE22 1 1 5 2410 1 1 20 GLN HG2 H -0.859 3.453 5.125 1.00 . A A . 20 GLN HG2 1 1 5 2411 1 1 20 GLN HG3 H 0.578 4.096 4.327 1.00 . A A . 20 GLN HG3 1 1 5 2412 1 1 20 GLN N N -0.090 3.321 1.816 1.00 . A A . 20 GLN N 1 1 5 2413 1 1 20 GLN NE2 N 0.624 6.317 5.539 1.00 . A A . 20 GLN NE2 1 1 5 2414 1 1 20 GLN O O -3.533 3.641 1.305 1.00 . A A . 20 GLN O 1 1 5 2415 1 1 20 GLN OE1 O -1.148 5.488 6.625 1.00 . A A . 20 GLN OE1 1 1 5 2416 1 1 21 ARG C C -3.143 4.067 -1.500 1.00 . A A . 21 ARG C 1 1 5 2417 1 1 21 ARG CA C -2.617 5.298 -0.776 1.00 . A A . 21 ARG CA 1 1 5 2418 1 1 21 ARG CB C -1.698 6.106 -1.697 1.00 . A A . 21 ARG CB 1 1 5 2419 1 1 21 ARG CD C -1.327 7.318 -3.849 1.00 . A A . 21 ARG CD 1 1 5 2420 1 1 21 ARG CG C -2.350 6.616 -2.969 1.00 . A A . 21 ARG CG 1 1 5 2421 1 1 21 ARG CZ C -1.205 8.381 -6.075 1.00 . A A . 21 ARG CZ 1 1 5 2422 1 1 21 ARG H H -0.966 5.250 0.543 1.00 . A A . 21 ARG H 1 1 5 2423 1 1 21 ARG HA H -3.446 5.913 -0.464 1.00 . A A . 21 ARG HA 1 1 5 2424 1 1 21 ARG HB2 H -1.327 6.958 -1.150 1.00 . A A . 21 ARG HB2 1 1 5 2425 1 1 21 ARG HB3 H -0.861 5.484 -1.977 1.00 . A A . 21 ARG HB3 1 1 5 2426 1 1 21 ARG HD2 H -0.892 8.135 -3.293 1.00 . A A . 21 ARG HD2 1 1 5 2427 1 1 21 ARG HD3 H -0.552 6.611 -4.105 1.00 . A A . 21 ARG HD3 1 1 5 2428 1 1 21 ARG HE H -2.894 7.809 -5.161 1.00 . A A . 21 ARG HE 1 1 5 2429 1 1 21 ARG HG2 H -2.771 5.782 -3.511 1.00 . A A . 21 ARG HG2 1 1 5 2430 1 1 21 ARG HG3 H -3.132 7.316 -2.710 1.00 . A A . 21 ARG HG3 1 1 5 2431 1 1 21 ARG HH11 H 0.614 8.031 -5.220 1.00 . A A . 21 ARG HH11 1 1 5 2432 1 1 21 ARG HH12 H 0.648 8.822 -6.770 1.00 . A A . 21 ARG HH12 1 1 5 2433 1 1 21 ARG HH21 H -2.825 8.839 -7.205 1.00 . A A . 21 ARG HH21 1 1 5 2434 1 1 21 ARG HH22 H -1.293 9.277 -7.892 1.00 . A A . 21 ARG HH22 1 1 5 2435 1 1 21 ARG N N -1.872 4.889 0.409 1.00 . A A . 21 ARG N 1 1 5 2436 1 1 21 ARG NE N -1.913 7.845 -5.080 1.00 . A A . 21 ARG NE 1 1 5 2437 1 1 21 ARG NH1 N 0.124 8.413 -6.018 1.00 . A A . 21 ARG NH1 1 1 5 2438 1 1 21 ARG NH2 N -1.824 8.870 -7.142 1.00 . A A . 21 ARG NH2 1 1 5 2439 1 1 21 ARG O O -4.340 3.949 -1.766 1.00 . A A . 21 ARG O 1 1 5 2440 1 1 22 HIS C C -3.647 1.143 -1.607 1.00 . A A . 22 HIS C 1 1 5 2441 1 1 22 HIS CA C -2.581 1.882 -2.408 1.00 . A A . 22 HIS CA 1 1 5 2442 1 1 22 HIS CB C -1.332 1.005 -2.551 1.00 . A A . 22 HIS CB 1 1 5 2443 1 1 22 HIS CD2 C -1.897 -1.469 -2.081 1.00 . A A . 22 HIS CD2 1 1 5 2444 1 1 22 HIS CE1 C -2.155 -2.180 -4.120 1.00 . A A . 22 HIS CE1 1 1 5 2445 1 1 22 HIS CG C -1.641 -0.416 -2.899 1.00 . A A . 22 HIS CG 1 1 5 2446 1 1 22 HIS H H -1.298 3.305 -1.533 1.00 . A A . 22 HIS H 1 1 5 2447 1 1 22 HIS HA H -2.971 2.101 -3.389 1.00 . A A . 22 HIS HA 1 1 5 2448 1 1 22 HIS HB2 H -0.703 1.410 -3.327 1.00 . A A . 22 HIS HB2 1 1 5 2449 1 1 22 HIS HB3 H -0.790 1.007 -1.616 1.00 . A A . 22 HIS HB3 1 1 5 2450 1 1 22 HIS HD1 H -1.686 -0.362 -5.020 1.00 . A A . 22 HIS HD1 1 1 5 2451 1 1 22 HIS HD2 H -1.837 -1.475 -1.003 1.00 . A A . 22 HIS HD2 1 1 5 2452 1 1 22 HIS HE1 H -2.356 -2.819 -4.964 1.00 . A A . 22 HIS HE1 1 1 5 2453 1 1 22 HIS N N -2.236 3.138 -1.772 1.00 . A A . 22 HIS N 1 1 5 2454 1 1 22 HIS ND1 N -1.799 -0.886 -4.196 1.00 . A A . 22 HIS ND1 1 1 5 2455 1 1 22 HIS NE2 N -2.220 -2.545 -2.868 1.00 . A A . 22 HIS NE2 1 1 5 2456 1 1 22 HIS O O -4.659 0.721 -2.155 1.00 . A A . 22 HIS O 1 1 5 2457 1 1 23 LYS C C -5.709 0.831 0.577 1.00 . A A . 23 LYS C 1 1 5 2458 1 1 23 LYS CA C -4.305 0.242 0.553 1.00 . A A . 23 LYS CA 1 1 5 2459 1 1 23 LYS CB C -3.747 0.154 1.971 1.00 . A A . 23 LYS CB 1 1 5 2460 1 1 23 LYS CD C -2.067 -0.852 3.535 1.00 . A A . 23 LYS CD 1 1 5 2461 1 1 23 LYS CE C -0.928 -1.848 3.683 1.00 . A A . 23 LYS CE 1 1 5 2462 1 1 23 LYS CG C -2.532 -0.750 2.097 1.00 . A A . 23 LYS CG 1 1 5 2463 1 1 23 LYS H H -2.609 1.416 0.077 1.00 . A A . 23 LYS H 1 1 5 2464 1 1 23 LYS HA H -4.364 -0.755 0.148 1.00 . A A . 23 LYS HA 1 1 5 2465 1 1 23 LYS HB2 H -3.468 1.145 2.296 1.00 . A A . 23 LYS HB2 1 1 5 2466 1 1 23 LYS HB3 H -4.519 -0.226 2.622 1.00 . A A . 23 LYS HB3 1 1 5 2467 1 1 23 LYS HD2 H -1.729 0.118 3.863 1.00 . A A . 23 LYS HD2 1 1 5 2468 1 1 23 LYS HD3 H -2.896 -1.174 4.147 1.00 . A A . 23 LYS HD3 1 1 5 2469 1 1 23 LYS HE2 H -1.275 -2.822 3.368 1.00 . A A . 23 LYS HE2 1 1 5 2470 1 1 23 LYS HE3 H -0.112 -1.535 3.050 1.00 . A A . 23 LYS HE3 1 1 5 2471 1 1 23 LYS HG2 H -2.787 -1.736 1.740 1.00 . A A . 23 LYS HG2 1 1 5 2472 1 1 23 LYS HG3 H -1.729 -0.344 1.497 1.00 . A A . 23 LYS HG3 1 1 5 2473 1 1 23 LYS HZ1 H -0.047 -1.030 5.390 1.00 . A A . 23 LYS HZ1 1 1 5 2474 1 1 23 LYS HZ2 H 0.294 -2.669 5.165 1.00 . A A . 23 LYS HZ2 1 1 5 2475 1 1 23 LYS HZ3 H -1.228 -2.191 5.721 1.00 . A A . 23 LYS HZ3 1 1 5 2476 1 1 23 LYS N N -3.412 1.002 -0.311 1.00 . A A . 23 LYS N 1 1 5 2477 1 1 23 LYS NZ N -0.443 -1.940 5.086 1.00 . A A . 23 LYS NZ 1 1 5 2478 1 1 23 LYS O O -6.664 0.142 0.938 1.00 . A A . 23 LYS O 1 1 5 2479 1 1 24 ARG C C -8.040 2.027 -0.951 1.00 . A A . 24 ARG C 1 1 5 2480 1 1 24 ARG CA C -7.158 2.723 0.092 1.00 . A A . 24 ARG CA 1 1 5 2481 1 1 24 ARG CB C -7.033 4.217 -0.226 1.00 . A A . 24 ARG CB 1 1 5 2482 1 1 24 ARG CD C -6.435 6.519 0.607 1.00 . A A . 24 ARG CD 1 1 5 2483 1 1 24 ARG CG C -6.358 5.021 0.874 1.00 . A A . 24 ARG CG 1 1 5 2484 1 1 24 ARG CZ C -8.106 8.332 0.773 1.00 . A A . 24 ARG CZ 1 1 5 2485 1 1 24 ARG H H -5.040 2.612 -0.074 1.00 . A A . 24 ARG H 1 1 5 2486 1 1 24 ARG HA H -7.625 2.613 1.060 1.00 . A A . 24 ARG HA 1 1 5 2487 1 1 24 ARG HB2 H -6.453 4.332 -1.131 1.00 . A A . 24 ARG HB2 1 1 5 2488 1 1 24 ARG HB3 H -8.018 4.624 -0.388 1.00 . A A . 24 ARG HB3 1 1 5 2489 1 1 24 ARG HD2 H -5.783 7.031 1.299 1.00 . A A . 24 ARG HD2 1 1 5 2490 1 1 24 ARG HD3 H -6.107 6.710 -0.404 1.00 . A A . 24 ARG HD3 1 1 5 2491 1 1 24 ARG HE H -8.515 6.376 0.895 1.00 . A A . 24 ARG HE 1 1 5 2492 1 1 24 ARG HG2 H -6.848 4.809 1.811 1.00 . A A . 24 ARG HG2 1 1 5 2493 1 1 24 ARG HG3 H -5.321 4.729 0.935 1.00 . A A . 24 ARG HG3 1 1 5 2494 1 1 24 ARG HH11 H -7.393 10.224 0.594 1.00 . A A . 24 ARG HH11 1 1 5 2495 1 1 24 ARG HH12 H -6.212 8.965 0.447 1.00 . A A . 24 ARG HH12 1 1 5 2496 1 1 24 ARG HH21 H -9.602 9.688 0.958 1.00 . A A . 24 ARG HH21 1 1 5 2497 1 1 24 ARG HH22 H -10.085 8.026 1.079 1.00 . A A . 24 ARG HH22 1 1 5 2498 1 1 24 ARG N N -5.845 2.093 0.171 1.00 . A A . 24 ARG N 1 1 5 2499 1 1 24 ARG NE N -7.795 7.036 0.769 1.00 . A A . 24 ARG NE 1 1 5 2500 1 1 24 ARG NH1 N -7.161 9.246 0.592 1.00 . A A . 24 ARG NH1 1 1 5 2501 1 1 24 ARG NH2 N -9.363 8.713 0.953 1.00 . A A . 24 ARG NH2 1 1 5 2502 1 1 24 ARG O O -9.261 2.199 -0.958 1.00 . A A . 24 ARG O 1 1 5 2503 1 1 25 THR C C -8.782 -0.774 -2.144 1.00 . A A . 25 THR C 1 1 5 2504 1 1 25 THR CA C -8.178 0.462 -2.801 1.00 . A A . 25 THR CA 1 1 5 2505 1 1 25 THR CB C -7.309 0.037 -4.005 1.00 . A A . 25 THR CB 1 1 5 2506 1 1 25 THR CG2 C -6.783 1.255 -4.744 1.00 . A A . 25 THR CG2 1 1 5 2507 1 1 25 THR H H -6.443 1.182 -1.821 1.00 . A A . 25 THR H 1 1 5 2508 1 1 25 THR HA H -8.981 1.087 -3.168 1.00 . A A . 25 THR HA 1 1 5 2509 1 1 25 THR HB H -7.923 -0.536 -4.683 1.00 . A A . 25 THR HB 1 1 5 2510 1 1 25 THR HG1 H -5.596 -0.246 -3.048 1.00 . A A . 25 THR HG1 1 1 5 2511 1 1 25 THR HG21 H -6.171 0.938 -5.575 1.00 . A A . 25 THR HG21 1 1 5 2512 1 1 25 THR HG22 H -6.192 1.857 -4.071 1.00 . A A . 25 THR HG22 1 1 5 2513 1 1 25 THR HG23 H -7.615 1.837 -5.113 1.00 . A A . 25 THR HG23 1 1 5 2514 1 1 25 THR N N -7.425 1.238 -1.827 1.00 . A A . 25 THR N 1 1 5 2515 1 1 25 THR O O -9.802 -1.298 -2.596 1.00 . A A . 25 THR O 1 1 5 2516 1 1 25 THR OG1 O -6.209 -0.777 -3.575 1.00 . A A . 25 THR OG1 1 1 5 2517 1 1 26 HIS C C -9.666 -1.903 0.720 1.00 . A A . 26 HIS C 1 1 5 2518 1 1 26 HIS CA C -8.655 -2.372 -0.318 1.00 . A A . 26 HIS CA 1 1 5 2519 1 1 26 HIS CB C -7.518 -3.136 0.375 1.00 . A A . 26 HIS CB 1 1 5 2520 1 1 26 HIS CD2 C -5.170 -3.479 -0.657 1.00 . A A . 26 HIS CD2 1 1 5 2521 1 1 26 HIS CE1 C -5.623 -5.032 -2.117 1.00 . A A . 26 HIS CE1 1 1 5 2522 1 1 26 HIS CG C -6.501 -3.732 -0.554 1.00 . A A . 26 HIS CG 1 1 5 2523 1 1 26 HIS H H -7.337 -0.779 -0.758 1.00 . A A . 26 HIS H 1 1 5 2524 1 1 26 HIS HA H -9.150 -3.028 -1.015 1.00 . A A . 26 HIS HA 1 1 5 2525 1 1 26 HIS HB2 H -6.996 -2.463 1.037 1.00 . A A . 26 HIS HB2 1 1 5 2526 1 1 26 HIS HB3 H -7.942 -3.941 0.957 1.00 . A A . 26 HIS HB3 1 1 5 2527 1 1 26 HIS HD1 H -7.656 -5.128 -1.661 1.00 . A A . 26 HIS HD1 1 1 5 2528 1 1 26 HIS HD2 H -4.605 -2.769 -0.073 1.00 . A A . 26 HIS HD2 1 1 5 2529 1 1 26 HIS HE1 H -5.515 -5.777 -2.890 1.00 . A A . 26 HIS HE1 1 1 5 2530 1 1 26 HIS N N -8.153 -1.230 -1.065 1.00 . A A . 26 HIS N 1 1 5 2531 1 1 26 HIS ND1 N -6.778 -4.722 -1.491 1.00 . A A . 26 HIS ND1 1 1 5 2532 1 1 26 HIS NE2 N -4.650 -4.302 -1.635 1.00 . A A . 26 HIS NE2 1 1 5 2533 1 1 26 HIS O O -10.810 -2.355 0.736 1.00 . A A . 26 HIS O 1 1 5 2534 1 1 27 THR C C -11.044 0.615 2.039 1.00 . A A . 27 THR C 1 1 5 2535 1 1 27 THR CA C -10.112 -0.447 2.610 1.00 . A A . 27 THR CA 1 1 5 2536 1 1 27 THR CB C -9.295 0.147 3.773 1.00 . A A . 27 THR CB 1 1 5 2537 1 1 27 THR CG2 C -8.639 -0.956 4.595 1.00 . A A . 27 THR CG2 1 1 5 2538 1 1 27 THR H H -8.330 -0.628 1.493 1.00 . A A . 27 THR H 1 1 5 2539 1 1 27 THR HA H -10.707 -1.263 2.995 1.00 . A A . 27 THR HA 1 1 5 2540 1 1 27 THR HB H -9.962 0.704 4.414 1.00 . A A . 27 THR HB 1 1 5 2541 1 1 27 THR HG1 H -8.715 1.737 2.759 1.00 . A A . 27 THR HG1 1 1 5 2542 1 1 27 THR HG21 H -9.402 -1.600 5.005 1.00 . A A . 27 THR HG21 1 1 5 2543 1 1 27 THR HG22 H -8.068 -0.515 5.399 1.00 . A A . 27 THR HG22 1 1 5 2544 1 1 27 THR HG23 H -7.983 -1.534 3.962 1.00 . A A . 27 THR HG23 1 1 5 2545 1 1 27 THR N N -9.246 -0.975 1.571 1.00 . A A . 27 THR N 1 1 5 2546 1 1 27 THR O O -10.632 1.750 1.788 1.00 . A A . 27 THR O 1 1 5 2547 1 1 27 THR OG1 O -8.289 1.033 3.263 1.00 . A A . 27 THR OG1 1 1 5 2548 1 1 28 GLY C C -13.552 0.788 -0.212 1.00 . A A . 28 GLY C 1 1 5 2549 1 1 28 GLY CA C -13.254 1.140 1.227 1.00 . A A . 28 GLY CA 1 1 5 2550 1 1 28 GLY H H -12.560 -0.686 2.040 1.00 . A A . 28 GLY H 1 1 5 2551 1 1 28 GLY HA2 H -14.169 1.094 1.798 1.00 . A A . 28 GLY HA2 1 1 5 2552 1 1 28 GLY HA3 H -12.860 2.145 1.270 1.00 . A A . 28 GLY HA3 1 1 5 2553 1 1 28 GLY N N -12.290 0.230 1.810 1.00 . A A . 28 GLY N 1 1 5 2554 1 1 28 GLY O O -14.580 1.191 -0.756 1.00 . A A . 28 GLY O 1 1 5 2555 1 1 29 GLU C C -12.888 0.746 -3.171 1.00 . A A . 29 GLU C 1 1 5 2556 1 1 29 GLU CA C -12.790 -0.437 -2.199 1.00 . A A . 29 GLU CA 1 1 5 2557 1 1 29 GLU CB C -14.021 -1.350 -2.307 1.00 . A A . 29 GLU CB 1 1 5 2558 1 1 29 GLU CD C -15.284 -3.075 -3.641 1.00 . A A . 29 GLU CD 1 1 5 2559 1 1 29 GLU CG C -14.128 -2.102 -3.625 1.00 . A A . 29 GLU CG 1 1 5 2560 1 1 29 GLU H H -11.845 -0.238 -0.318 1.00 . A A . 29 GLU H 1 1 5 2561 1 1 29 GLU HA H -11.908 -1.010 -2.448 1.00 . A A . 29 GLU HA 1 1 5 2562 1 1 29 GLU HB2 H -13.987 -2.075 -1.507 1.00 . A A . 29 GLU HB2 1 1 5 2563 1 1 29 GLU HB3 H -14.909 -0.746 -2.191 1.00 . A A . 29 GLU HB3 1 1 5 2564 1 1 29 GLU HG2 H -14.266 -1.387 -4.421 1.00 . A A . 29 GLU HG2 1 1 5 2565 1 1 29 GLU HG3 H -13.211 -2.649 -3.788 1.00 . A A . 29 GLU HG3 1 1 5 2566 1 1 29 GLU N N -12.641 0.028 -0.820 1.00 . A A . 29 GLU N 1 1 5 2567 1 1 29 GLU O O -13.557 0.678 -4.201 1.00 . A A . 29 GLU O 1 1 5 2568 1 1 29 GLU OE1 O -16.441 -2.639 -3.830 1.00 . A A . 29 GLU OE1 1 1 5 2569 1 1 29 GLU OE2 O -15.046 -4.285 -3.463 1.00 . A A . 29 GLU OE2 1 1 5 2570 1 1 30 LYS C C -10.892 3.211 -4.380 1.00 . A A . 30 LYS C 1 1 5 2571 1 1 30 LYS CA C -12.236 3.019 -3.681 1.00 . A A . 30 LYS CA 1 1 5 2572 1 1 30 LYS CB C -12.597 4.252 -2.845 1.00 . A A . 30 LYS CB 1 1 5 2573 1 1 30 LYS CD C -13.028 6.724 -2.764 1.00 . A A . 30 LYS CD 1 1 5 2574 1 1 30 LYS CE C -13.049 8.019 -3.560 1.00 . A A . 30 LYS CE 1 1 5 2575 1 1 30 LYS CG C -12.729 5.530 -3.656 1.00 . A A . 30 LYS CG 1 1 5 2576 1 1 30 LYS H H -11.664 1.830 -2.028 1.00 . A A . 30 LYS H 1 1 5 2577 1 1 30 LYS HA H -12.996 2.869 -4.434 1.00 . A A . 30 LYS HA 1 1 5 2578 1 1 30 LYS HB2 H -13.537 4.071 -2.346 1.00 . A A . 30 LYS HB2 1 1 5 2579 1 1 30 LYS HB3 H -11.831 4.402 -2.103 1.00 . A A . 30 LYS HB3 1 1 5 2580 1 1 30 LYS HD2 H -13.992 6.584 -2.299 1.00 . A A . 30 LYS HD2 1 1 5 2581 1 1 30 LYS HD3 H -12.266 6.793 -2.003 1.00 . A A . 30 LYS HD3 1 1 5 2582 1 1 30 LYS HE2 H -12.108 8.123 -4.077 1.00 . A A . 30 LYS HE2 1 1 5 2583 1 1 30 LYS HE3 H -13.850 7.969 -4.280 1.00 . A A . 30 LYS HE3 1 1 5 2584 1 1 30 LYS HG2 H -11.805 5.708 -4.184 1.00 . A A . 30 LYS HG2 1 1 5 2585 1 1 30 LYS HG3 H -13.535 5.412 -4.365 1.00 . A A . 30 LYS HG3 1 1 5 2586 1 1 30 LYS HZ1 H -12.510 9.252 -1.966 1.00 . A A . 30 LYS HZ1 1 1 5 2587 1 1 30 LYS HZ2 H -14.177 9.149 -2.217 1.00 . A A . 30 LYS HZ2 1 1 5 2588 1 1 30 LYS HZ3 H -13.223 10.075 -3.258 1.00 . A A . 30 LYS HZ3 1 1 5 2589 1 1 30 LYS N N -12.205 1.831 -2.844 1.00 . A A . 30 LYS N 1 1 5 2590 1 1 30 LYS NZ N -13.254 9.204 -2.689 1.00 . A A . 30 LYS NZ 1 1 5 2591 1 1 30 LYS O O -10.734 2.860 -5.548 1.00 . A A . 30 LYS O 1 1 5 2592 1 1 31 NH2 HN1 H -10.117 4.014 -2.740 1.00 . A A . 31 NH2 HN1 1 1 5 2593 1 1 31 NH2 HN2 H -9.050 3.887 -4.094 1.00 . A A . 31 NH2 HN2 1 1 5 2594 1 1 31 NH2 N N -9.923 3.757 -3.665 1.00 . A A . 31 NH2 N 1 1 5 2595 2 2 1 ZN ZN ZN -2.733 -4.347 -2.197 1.00 . B A . 101 ZN ZN 1 1 6 2596 1 1 1 ARG C C 12.128 -1.195 2.415 1.00 . A A . 1 ARG C 1 1 6 2597 1 1 1 ARG CA C 13.297 -1.903 3.086 1.00 . A A . 1 ARG CA 1 1 6 2598 1 1 1 ARG CB C 12.858 -2.410 4.467 1.00 . A A . 1 ARG CB 1 1 6 2599 1 1 1 ARG CD C 13.441 -3.631 6.586 1.00 . A A . 1 ARG CD 1 1 6 2600 1 1 1 ARG CG C 13.935 -3.176 5.219 1.00 . A A . 1 ARG CG 1 1 6 2601 1 1 1 ARG CZ C 14.356 -4.686 8.626 1.00 . A A . 1 ARG CZ 1 1 6 2602 1 1 1 ARG H1 H 15.249 -1.450 3.660 1.00 . A A . 1 ARG H1 1 1 6 2603 1 1 1 ARG H2 H 14.177 -0.148 3.779 1.00 . A A . 1 ARG H2 1 1 6 2604 1 1 1 ARG H3 H 14.734 -0.644 2.266 1.00 . A A . 1 ARG H3 1 1 6 2605 1 1 1 ARG HA H 13.600 -2.740 2.477 1.00 . A A . 1 ARG HA 1 1 6 2606 1 1 1 ARG HB2 H 12.562 -1.565 5.069 1.00 . A A . 1 ARG HB2 1 1 6 2607 1 1 1 ARG HB3 H 12.007 -3.063 4.340 1.00 . A A . 1 ARG HB3 1 1 6 2608 1 1 1 ARG HD2 H 13.111 -2.767 7.145 1.00 . A A . 1 ARG HD2 1 1 6 2609 1 1 1 ARG HD3 H 12.609 -4.306 6.449 1.00 . A A . 1 ARG HD3 1 1 6 2610 1 1 1 ARG HE H 15.328 -4.508 6.884 1.00 . A A . 1 ARG HE 1 1 6 2611 1 1 1 ARG HG2 H 14.214 -4.044 4.641 1.00 . A A . 1 ARG HG2 1 1 6 2612 1 1 1 ARG HG3 H 14.796 -2.535 5.348 1.00 . A A . 1 ARG HG3 1 1 6 2613 1 1 1 ARG HH11 H 13.131 -4.713 10.246 1.00 . A A . 1 ARG HH11 1 1 6 2614 1 1 1 ARG HH12 H 12.469 -3.966 8.828 1.00 . A A . 1 ARG HH12 1 1 6 2615 1 1 1 ARG HH21 H 16.207 -5.508 8.748 1.00 . A A . 1 ARG HH21 1 1 6 2616 1 1 1 ARG HH22 H 15.262 -5.591 10.199 1.00 . A A . 1 ARG HH22 1 1 6 2617 1 1 1 ARG N N 14.444 -0.976 3.208 1.00 . A A . 1 ARG N 1 1 6 2618 1 1 1 ARG NE N 14.485 -4.314 7.350 1.00 . A A . 1 ARG NE 1 1 6 2619 1 1 1 ARG NH1 N 13.229 -4.435 9.286 1.00 . A A . 1 ARG NH1 1 1 6 2620 1 1 1 ARG NH2 N 15.355 -5.311 9.239 1.00 . A A . 1 ARG NH2 1 1 6 2621 1 1 1 ARG O O 11.781 -0.072 2.785 1.00 . A A . 1 ARG O 1 1 6 2622 1 1 2 PRO C C 9.074 -1.426 1.528 1.00 . A A . 2 PRO C 1 1 6 2623 1 1 2 PRO CA C 10.355 -1.265 0.721 1.00 . A A . 2 PRO CA 1 1 6 2624 1 1 2 PRO CB C 10.283 -2.086 -0.564 1.00 . A A . 2 PRO CB 1 1 6 2625 1 1 2 PRO CD C 11.887 -3.151 0.865 1.00 . A A . 2 PRO CD 1 1 6 2626 1 1 2 PRO CG C 10.829 -3.419 -0.179 1.00 . A A . 2 PRO CG 1 1 6 2627 1 1 2 PRO HA H 10.503 -0.222 0.482 1.00 . A A . 2 PRO HA 1 1 6 2628 1 1 2 PRO HB2 H 9.252 -2.156 -0.893 1.00 . A A . 2 PRO HB2 1 1 6 2629 1 1 2 PRO HB3 H 10.884 -1.619 -1.331 1.00 . A A . 2 PRO HB3 1 1 6 2630 1 1 2 PRO HD2 H 11.857 -3.909 1.633 1.00 . A A . 2 PRO HD2 1 1 6 2631 1 1 2 PRO HD3 H 12.865 -3.112 0.409 1.00 . A A . 2 PRO HD3 1 1 6 2632 1 1 2 PRO HG2 H 10.040 -4.030 0.235 1.00 . A A . 2 PRO HG2 1 1 6 2633 1 1 2 PRO HG3 H 11.264 -3.901 -1.041 1.00 . A A . 2 PRO HG3 1 1 6 2634 1 1 2 PRO N N 11.511 -1.832 1.411 1.00 . A A . 2 PRO N 1 1 6 2635 1 1 2 PRO O O 9.012 -2.212 2.475 1.00 . A A . 2 PRO O 1 1 6 2636 1 1 3 PHE C C 5.859 -1.635 0.926 1.00 . A A . 3 PHE C 1 1 6 2637 1 1 3 PHE CA C 6.759 -0.750 1.772 1.00 . A A . 3 PHE CA 1 1 6 2638 1 1 3 PHE CB C 6.153 0.646 1.914 1.00 . A A . 3 PHE CB 1 1 6 2639 1 1 3 PHE CD1 C 7.910 2.402 2.280 1.00 . A A . 3 PHE CD1 1 1 6 2640 1 1 3 PHE CD2 C 6.718 1.569 4.169 1.00 . A A . 3 PHE CD2 1 1 6 2641 1 1 3 PHE CE1 C 8.636 3.240 3.104 1.00 . A A . 3 PHE CE1 1 1 6 2642 1 1 3 PHE CE2 C 7.440 2.404 4.998 1.00 . A A . 3 PHE CE2 1 1 6 2643 1 1 3 PHE CG C 6.944 1.558 2.804 1.00 . A A . 3 PHE CG 1 1 6 2644 1 1 3 PHE CZ C 8.401 3.242 4.465 1.00 . A A . 3 PHE CZ 1 1 6 2645 1 1 3 PHE H H 8.198 -0.036 0.414 1.00 . A A . 3 PHE H 1 1 6 2646 1 1 3 PHE HA H 6.876 -1.194 2.750 1.00 . A A . 3 PHE HA 1 1 6 2647 1 1 3 PHE HB2 H 6.092 1.105 0.940 1.00 . A A . 3 PHE HB2 1 1 6 2648 1 1 3 PHE HB3 H 5.163 0.559 2.326 1.00 . A A . 3 PHE HB3 1 1 6 2649 1 1 3 PHE HD1 H 8.093 2.401 1.215 1.00 . A A . 3 PHE HD1 1 1 6 2650 1 1 3 PHE HD2 H 5.966 0.915 4.586 1.00 . A A . 3 PHE HD2 1 1 6 2651 1 1 3 PHE HE1 H 9.386 3.894 2.682 1.00 . A A . 3 PHE HE1 1 1 6 2652 1 1 3 PHE HE2 H 7.253 2.403 6.062 1.00 . A A . 3 PHE HE2 1 1 6 2653 1 1 3 PHE HZ H 8.967 3.897 5.111 1.00 . A A . 3 PHE HZ 1 1 6 2654 1 1 3 PHE N N 8.064 -0.669 1.150 1.00 . A A . 3 PHE N 1 1 6 2655 1 1 3 PHE O O 5.233 -1.173 -0.026 1.00 . A A . 3 PHE O 1 1 6 2656 1 1 4 NLE C C 3.694 -4.107 1.075 1.00 . A A . 4 NLE C 1 1 6 2657 1 1 4 NLE CA C 5.076 -3.884 0.478 1.00 . A A . 4 NLE CA 1 1 6 2658 1 1 4 NLE CB C 5.839 -5.213 0.422 1.00 . A A . 4 NLE CB 1 1 6 2659 1 1 4 NLE CD C 5.964 -7.569 -0.441 1.00 . A A . 4 NLE CD 1 1 6 2660 1 1 4 NLE CE C 5.261 -8.617 -1.274 1.00 . A A . 4 NLE CE 1 1 6 2661 1 1 4 NLE CG C 5.166 -6.276 -0.434 1.00 . A A . 4 NLE CG 1 1 6 2662 1 1 4 NLE H H 6.317 -3.213 2.053 1.00 . A A . 4 NLE H 1 1 6 2663 1 1 4 NLE HA H 4.966 -3.497 -0.521 1.00 . A A . 4 NLE HA 1 1 6 2664 1 1 4 NLE HB2 H 5.932 -5.600 1.425 1.00 . A A . 4 NLE HB2 1 1 6 2665 1 1 4 NLE HB3 H 6.827 -5.033 0.026 1.00 . A A . 4 NLE HB3 1 1 6 2666 1 1 4 NLE HD2 H 6.063 -7.936 0.572 1.00 . A A . 4 NLE HD2 1 1 6 2667 1 1 4 NLE HD3 H 6.939 -7.386 -0.865 1.00 . A A . 4 NLE HD3 1 1 6 2668 1 1 4 NLE HE1 H 5.152 -8.258 -2.288 1.00 . A A . 4 NLE HE1 1 1 6 2669 1 1 4 NLE HE2 H 4.286 -8.815 -0.855 1.00 . A A . 4 NLE HE2 1 1 6 2670 1 1 4 NLE HE3 H 5.843 -9.526 -1.275 1.00 . A A . 4 NLE HE3 1 1 6 2671 1 1 4 NLE HG2 H 5.082 -5.910 -1.447 1.00 . A A . 4 NLE HG2 1 1 6 2672 1 1 4 NLE HG3 H 4.183 -6.476 -0.035 1.00 . A A . 4 NLE HG3 1 1 6 2673 1 1 4 NLE N N 5.827 -2.913 1.256 1.00 . A A . 4 NLE N 1 1 6 2674 1 1 4 NLE O O 3.544 -4.233 2.293 1.00 . A A . 4 NLE O 1 1 6 2675 1 1 5 CYS C C 1.282 -5.915 1.086 1.00 . A A . 5 CYS C 1 1 6 2676 1 1 5 CYS CA C 1.334 -4.460 0.625 1.00 . A A . 5 CYS CA 1 1 6 2677 1 1 5 CYS CB C 0.358 -4.223 -0.529 1.00 . A A . 5 CYS CB 1 1 6 2678 1 1 5 CYS H H 2.863 -3.918 -0.732 1.00 . A A . 5 CYS H 1 1 6 2679 1 1 5 CYS HA H 1.070 -3.820 1.452 1.00 . A A . 5 CYS HA 1 1 6 2680 1 1 5 CYS HB2 H 0.378 -3.179 -0.799 1.00 . A A . 5 CYS HB2 1 1 6 2681 1 1 5 CYS HB3 H 0.670 -4.812 -1.377 1.00 . A A . 5 CYS HB3 1 1 6 2682 1 1 5 CYS N N 2.687 -4.130 0.213 1.00 . A A . 5 CYS N 1 1 6 2683 1 1 5 CYS O O 1.878 -6.789 0.459 1.00 . A A . 5 CYS O 1 1 6 2684 1 1 5 CYS SG S -1.356 -4.657 -0.156 1.00 . A A . 5 CYS SG 1 1 6 2685 1 1 6 THR C C -0.954 -7.968 2.824 1.00 . A A . 6 THR C 1 1 6 2686 1 1 6 THR CA C 0.499 -7.513 2.733 1.00 . A A . 6 THR CA 1 1 6 2687 1 1 6 THR CB C 1.164 -7.594 4.123 1.00 . A A . 6 THR CB 1 1 6 2688 1 1 6 THR CG2 C 2.682 -7.565 4.005 1.00 . A A . 6 THR CG2 1 1 6 2689 1 1 6 THR H H 0.138 -5.431 2.650 1.00 . A A . 6 THR H 1 1 6 2690 1 1 6 THR HA H 1.027 -8.176 2.066 1.00 . A A . 6 THR HA 1 1 6 2691 1 1 6 THR HB H 0.872 -8.525 4.589 1.00 . A A . 6 THR HB 1 1 6 2692 1 1 6 THR HG1 H 1.195 -5.699 4.682 1.00 . A A . 6 THR HG1 1 1 6 2693 1 1 6 THR HG21 H 3.014 -8.410 3.421 1.00 . A A . 6 THR HG21 1 1 6 2694 1 1 6 THR HG22 H 3.120 -7.612 4.991 1.00 . A A . 6 THR HG22 1 1 6 2695 1 1 6 THR HG23 H 2.986 -6.649 3.519 1.00 . A A . 6 THR HG23 1 1 6 2696 1 1 6 THR N N 0.593 -6.167 2.188 1.00 . A A . 6 THR N 1 1 6 2697 1 1 6 THR O O -1.343 -8.677 3.755 1.00 . A A . 6 THR O 1 1 6 2698 1 1 6 THR OG1 O 0.725 -6.501 4.943 1.00 . A A . 6 THR OG1 1 1 6 2699 1 1 7 TRP C C -3.387 -9.269 1.199 1.00 . A A . 7 TRP C 1 1 6 2700 1 1 7 TRP CA C -3.169 -7.901 1.841 1.00 . A A . 7 TRP CA 1 1 6 2701 1 1 7 TRP CB C -3.967 -6.834 1.091 1.00 . A A . 7 TRP CB 1 1 6 2702 1 1 7 TRP CD1 C -6.381 -7.667 0.921 1.00 . A A . 7 TRP CD1 1 1 6 2703 1 1 7 TRP CD2 C -6.091 -5.958 2.333 1.00 . A A . 7 TRP CD2 1 1 6 2704 1 1 7 TRP CE2 C -7.451 -6.315 2.339 1.00 . A A . 7 TRP CE2 1 1 6 2705 1 1 7 TRP CE3 C -5.665 -4.905 3.144 1.00 . A A . 7 TRP CE3 1 1 6 2706 1 1 7 TRP CG C -5.424 -6.838 1.424 1.00 . A A . 7 TRP CG 1 1 6 2707 1 1 7 TRP CH2 C -7.944 -4.624 3.911 1.00 . A A . 7 TRP CH2 1 1 6 2708 1 1 7 TRP CZ2 C -8.389 -5.654 3.127 1.00 . A A . 7 TRP CZ2 1 1 6 2709 1 1 7 TRP CZ3 C -6.596 -4.249 3.924 1.00 . A A . 7 TRP CZ3 1 1 6 2710 1 1 7 TRP H H -1.388 -7.031 1.109 1.00 . A A . 7 TRP H 1 1 6 2711 1 1 7 TRP HA H -3.509 -7.940 2.865 1.00 . A A . 7 TRP HA 1 1 6 2712 1 1 7 TRP HB2 H -3.572 -5.860 1.333 1.00 . A A . 7 TRP HB2 1 1 6 2713 1 1 7 TRP HB3 H -3.866 -7.003 0.030 1.00 . A A . 7 TRP HB3 1 1 6 2714 1 1 7 TRP HD1 H -6.188 -8.446 0.200 1.00 . A A . 7 TRP HD1 1 1 6 2715 1 1 7 TRP HE1 H -8.449 -7.823 1.269 1.00 . A A . 7 TRP HE1 1 1 6 2716 1 1 7 TRP HE3 H -4.628 -4.602 3.165 1.00 . A A . 7 TRP HE3 1 1 6 2717 1 1 7 TRP HH2 H -8.636 -4.081 4.537 1.00 . A A . 7 TRP HH2 1 1 6 2718 1 1 7 TRP HZ2 H -9.433 -5.932 3.129 1.00 . A A . 7 TRP HZ2 1 1 6 2719 1 1 7 TRP HZ3 H -6.285 -3.430 4.555 1.00 . A A . 7 TRP HZ3 1 1 6 2720 1 1 7 TRP N N -1.756 -7.564 1.847 1.00 . A A . 7 TRP N 1 1 6 2721 1 1 7 TRP NE1 N -7.604 -7.365 1.469 1.00 . A A . 7 TRP NE1 1 1 6 2722 1 1 7 TRP O O -3.698 -9.368 0.012 1.00 . A A . 7 TRP O 1 1 6 2723 1 1 8 ORN C C -1.405 -10.870 -2.196 1.00 . A A . 8 ORN C 1 1 6 2724 1 1 8 ORN CA C -1.898 -11.942 -1.239 1.00 . A A . 8 ORN CA 1 1 6 2725 1 1 8 ORN CB C -1.255 -11.731 0.136 1.00 . A A . 8 ORN CB 1 1 6 2726 1 1 8 ORN CD C -3.345 -11.708 1.541 1.00 . A A . 8 ORN CD 1 1 6 2727 1 1 8 ORN CG C -2.010 -12.394 1.276 1.00 . A A . 8 ORN CG 1 1 6 2728 1 1 8 ORN H H -1.894 -14.019 -1.078 1.00 . A A . 8 ORN H 1 1 6 2729 1 1 8 ORN HA H -2.970 -11.855 -1.144 1.00 . A A . 8 ORN HA 1 1 6 2730 1 1 8 ORN HB2 H -1.208 -10.671 0.336 1.00 . A A . 8 ORN HB2 1 1 6 2731 1 1 8 ORN HB3 H -0.253 -12.130 0.117 1.00 . A A . 8 ORN HB3 1 1 6 2732 1 1 8 ORN HD2 H -3.873 -12.257 2.306 1.00 . A A . 8 ORN HD2 1 1 6 2733 1 1 8 ORN HD3 H -3.926 -11.716 0.632 1.00 . A A . 8 ORN HD3 1 1 6 2734 1 1 8 ORN HE1 H -2.904 -10.169 2.908 1.00 . A A . 8 ORN HE1 1 1 6 2735 1 1 8 ORN HG2 H -1.405 -12.345 2.170 1.00 . A A . 8 ORN HG2 1 1 6 2736 1 1 8 ORN HG3 H -2.192 -13.427 1.021 1.00 . A A . 8 ORN HG3 1 1 6 2737 1 1 8 ORN N N -1.587 -13.293 -1.755 1.00 . A A . 8 ORN N 1 1 6 2738 1 1 8 ORN NE N -3.182 -10.322 1.980 1.00 . A A . 8 ORN NE 1 1 6 2739 1 1 8 ORN O O -0.427 -11.067 -2.919 1.00 . A A . 8 ORN O 1 1 6 2740 1 1 9 CYS C C -0.377 -8.041 -2.325 1.00 . A A . 9 CYS C 1 1 6 2741 1 1 9 CYS CA C -1.662 -8.575 -2.945 1.00 . A A . 9 CYS CA 1 1 6 2742 1 1 9 CYS CB C -2.753 -7.508 -2.914 1.00 . A A . 9 CYS CB 1 1 6 2743 1 1 9 CYS H H -2.937 -9.694 -1.688 1.00 . A A . 9 CYS H 1 1 6 2744 1 1 9 CYS HA H -1.474 -8.869 -3.966 1.00 . A A . 9 CYS HA 1 1 6 2745 1 1 9 CYS HB2 H -3.605 -7.853 -3.479 1.00 . A A . 9 CYS HB2 1 1 6 2746 1 1 9 CYS HB3 H -3.051 -7.346 -1.889 1.00 . A A . 9 CYS HB3 1 1 6 2747 1 1 9 CYS N N -2.100 -9.744 -2.206 1.00 . A A . 9 CYS N 1 1 6 2748 1 1 9 CYS O O -0.334 -7.778 -1.122 1.00 . A A . 9 CYS O 1 1 6 2749 1 1 9 CYS SG S -2.251 -5.916 -3.596 1.00 . A A . 9 CYS SG 1 1 6 2750 1 1 10 GLY C C 2.720 -6.570 -3.502 1.00 . A A . 10 GLY C 1 1 6 2751 1 1 10 GLY CA C 1.953 -7.508 -2.598 1.00 . A A . 10 GLY CA 1 1 6 2752 1 1 10 GLY H H 0.564 -8.059 -4.091 1.00 . A A . 10 GLY H 1 1 6 2753 1 1 10 GLY HA2 H 1.799 -7.023 -1.647 1.00 . A A . 10 GLY HA2 1 1 6 2754 1 1 10 GLY HA3 H 2.543 -8.398 -2.441 1.00 . A A . 10 GLY HA3 1 1 6 2755 1 1 10 GLY N N 0.667 -7.898 -3.131 1.00 . A A . 10 GLY N 1 1 6 2756 1 1 10 GLY O O 3.813 -6.895 -3.963 1.00 . A A . 10 GLY O 1 1 6 2757 1 1 11 LYS C C 3.843 -3.671 -3.580 1.00 . A A . 11 LYS C 1 1 6 2758 1 1 11 LYS CA C 2.853 -4.370 -4.503 1.00 . A A . 11 LYS CA 1 1 6 2759 1 1 11 LYS CB C 1.862 -3.358 -5.080 1.00 . A A . 11 LYS CB 1 1 6 2760 1 1 11 LYS CD C -0.081 -2.911 -6.599 1.00 . A A . 11 LYS CD 1 1 6 2761 1 1 11 LYS CE C -1.032 -3.488 -7.635 1.00 . A A . 11 LYS CE 1 1 6 2762 1 1 11 LYS CG C 0.923 -3.944 -6.120 1.00 . A A . 11 LYS CG 1 1 6 2763 1 1 11 LYS H H 1.234 -5.243 -3.462 1.00 . A A . 11 LYS H 1 1 6 2764 1 1 11 LYS HA H 3.394 -4.840 -5.312 1.00 . A A . 11 LYS HA 1 1 6 2765 1 1 11 LYS HB2 H 1.266 -2.958 -4.274 1.00 . A A . 11 LYS HB2 1 1 6 2766 1 1 11 LYS HB3 H 2.416 -2.553 -5.541 1.00 . A A . 11 LYS HB3 1 1 6 2767 1 1 11 LYS HD2 H -0.653 -2.565 -5.752 1.00 . A A . 11 LYS HD2 1 1 6 2768 1 1 11 LYS HD3 H 0.454 -2.080 -7.036 1.00 . A A . 11 LYS HD3 1 1 6 2769 1 1 11 LYS HE2 H -1.493 -4.374 -7.225 1.00 . A A . 11 LYS HE2 1 1 6 2770 1 1 11 LYS HE3 H -1.795 -2.755 -7.851 1.00 . A A . 11 LYS HE3 1 1 6 2771 1 1 11 LYS HG2 H 1.503 -4.288 -6.963 1.00 . A A . 11 LYS HG2 1 1 6 2772 1 1 11 LYS HG3 H 0.390 -4.776 -5.683 1.00 . A A . 11 LYS HG3 1 1 6 2773 1 1 11 LYS HZ1 H 0.422 -4.533 -8.707 1.00 . A A . 11 LYS HZ1 1 1 6 2774 1 1 11 LYS HZ2 H 0.086 -3.001 -9.328 1.00 . A A . 11 LYS HZ2 1 1 6 2775 1 1 11 LYS HZ3 H -1.005 -4.269 -9.569 1.00 . A A . 11 LYS HZ3 1 1 6 2776 1 1 11 LYS N N 2.148 -5.408 -3.767 1.00 . A A . 11 LYS N 1 1 6 2777 1 1 11 LYS NZ N -0.334 -3.848 -8.897 1.00 . A A . 11 LYS NZ 1 1 6 2778 1 1 11 LYS O O 3.530 -3.399 -2.420 1.00 . A A . 11 LYS O 1 1 6 2779 1 1 12 ARG C C 6.169 -1.277 -3.615 1.00 . A A . 12 ARG C 1 1 6 2780 1 1 12 ARG CA C 6.077 -2.762 -3.290 1.00 . A A . 12 ARG CA 1 1 6 2781 1 1 12 ARG CB C 7.428 -3.437 -3.529 1.00 . A A . 12 ARG CB 1 1 6 2782 1 1 12 ARG CD C 8.795 -5.548 -3.424 1.00 . A A . 12 ARG CD 1 1 6 2783 1 1 12 ARG CG C 7.473 -4.884 -3.067 1.00 . A A . 12 ARG CG 1 1 6 2784 1 1 12 ARG CZ C 9.153 -7.988 -3.606 1.00 . A A . 12 ARG CZ 1 1 6 2785 1 1 12 ARG H H 5.235 -3.656 -5.012 1.00 . A A . 12 ARG H 1 1 6 2786 1 1 12 ARG HA H 5.807 -2.869 -2.249 1.00 . A A . 12 ARG HA 1 1 6 2787 1 1 12 ARG HB2 H 7.648 -3.412 -4.586 1.00 . A A . 12 ARG HB2 1 1 6 2788 1 1 12 ARG HB3 H 8.191 -2.887 -2.998 1.00 . A A . 12 ARG HB3 1 1 6 2789 1 1 12 ARG HD2 H 8.878 -5.597 -4.498 1.00 . A A . 12 ARG HD2 1 1 6 2790 1 1 12 ARG HD3 H 9.603 -4.953 -3.026 1.00 . A A . 12 ARG HD3 1 1 6 2791 1 1 12 ARG HE H 8.760 -7.003 -1.907 1.00 . A A . 12 ARG HE 1 1 6 2792 1 1 12 ARG HG2 H 7.347 -4.914 -1.997 1.00 . A A . 12 ARG HG2 1 1 6 2793 1 1 12 ARG HG3 H 6.669 -5.428 -3.541 1.00 . A A . 12 ARG HG3 1 1 6 2794 1 1 12 ARG HH11 H 9.232 -7.012 -5.384 1.00 . A A . 12 ARG HH11 1 1 6 2795 1 1 12 ARG HH12 H 9.512 -8.720 -5.464 1.00 . A A . 12 ARG HH12 1 1 6 2796 1 1 12 ARG HH21 H 9.443 -9.992 -3.560 1.00 . A A . 12 ARG HH21 1 1 6 2797 1 1 12 ARG HH22 H 9.116 -9.254 -2.025 1.00 . A A . 12 ARG HH22 1 1 6 2798 1 1 12 ARG N N 5.040 -3.408 -4.084 1.00 . A A . 12 ARG N 1 1 6 2799 1 1 12 ARG NE N 8.888 -6.902 -2.878 1.00 . A A . 12 ARG NE 1 1 6 2800 1 1 12 ARG NH1 N 9.310 -7.898 -4.923 1.00 . A A . 12 ARG NH1 1 1 6 2801 1 1 12 ARG NH2 N 9.245 -9.171 -3.015 1.00 . A A . 12 ARG NH2 1 1 6 2802 1 1 12 ARG O O 6.195 -0.883 -4.781 1.00 . A A . 12 ARG O 1 1 6 2803 1 1 13 PHE C C 7.503 1.522 -1.994 1.00 . A A . 13 PHE C 1 1 6 2804 1 1 13 PHE CA C 6.285 0.985 -2.726 1.00 . A A . 13 PHE CA 1 1 6 2805 1 1 13 PHE CB C 5.016 1.629 -2.170 1.00 . A A . 13 PHE CB 1 1 6 2806 1 1 13 PHE CD1 C 3.271 1.591 -3.958 1.00 . A A . 13 PHE CD1 1 1 6 2807 1 1 13 PHE CD2 C 3.083 0.039 -2.160 1.00 . A A . 13 PHE CD2 1 1 6 2808 1 1 13 PHE CE1 C 2.114 1.092 -4.515 1.00 . A A . 13 PHE CE1 1 1 6 2809 1 1 13 PHE CE2 C 1.925 -0.466 -2.712 1.00 . A A . 13 PHE CE2 1 1 6 2810 1 1 13 PHE CG C 3.767 1.071 -2.777 1.00 . A A . 13 PHE CG 1 1 6 2811 1 1 13 PHE CZ C 1.472 0.013 -3.911 1.00 . A A . 13 PHE CZ 1 1 6 2812 1 1 13 PHE H H 6.179 -0.838 -1.668 1.00 . A A . 13 PHE H 1 1 6 2813 1 1 13 PHE HA H 6.370 1.213 -3.777 1.00 . A A . 13 PHE HA 1 1 6 2814 1 1 13 PHE HB2 H 4.972 1.463 -1.103 1.00 . A A . 13 PHE HB2 1 1 6 2815 1 1 13 PHE HB3 H 5.039 2.690 -2.366 1.00 . A A . 13 PHE HB3 1 1 6 2816 1 1 13 PHE HD1 H 3.798 2.399 -4.443 1.00 . A A . 13 PHE HD1 1 1 6 2817 1 1 13 PHE HD2 H 3.465 -0.373 -1.239 1.00 . A A . 13 PHE HD2 1 1 6 2818 1 1 13 PHE HE1 H 1.737 1.507 -5.438 1.00 . A A . 13 PHE HE1 1 1 6 2819 1 1 13 PHE HE2 H 1.398 -1.272 -2.223 1.00 . A A . 13 PHE HE2 1 1 6 2820 1 1 13 PHE HZ H 0.577 -0.399 -4.350 1.00 . A A . 13 PHE HZ 1 1 6 2821 1 1 13 PHE N N 6.210 -0.459 -2.575 1.00 . A A . 13 PHE N 1 1 6 2822 1 1 13 PHE O O 7.983 0.911 -1.047 1.00 . A A . 13 PHE O 1 1 6 2823 1 1 14 THR C C 8.739 4.296 -0.765 1.00 . A A . 14 THR C 1 1 6 2824 1 1 14 THR CA C 9.172 3.262 -1.808 1.00 . A A . 14 THR CA 1 1 6 2825 1 1 14 THR CB C 10.072 3.926 -2.868 1.00 . A A . 14 THR CB 1 1 6 2826 1 1 14 THR CG2 C 11.487 4.131 -2.345 1.00 . A A . 14 THR CG2 1 1 6 2827 1 1 14 THR H H 7.620 3.083 -3.229 1.00 . A A . 14 THR H 1 1 6 2828 1 1 14 THR HA H 9.736 2.480 -1.318 1.00 . A A . 14 THR HA 1 1 6 2829 1 1 14 THR HB H 9.651 4.887 -3.129 1.00 . A A . 14 THR HB 1 1 6 2830 1 1 14 THR HG1 H 10.962 3.225 -4.488 1.00 . A A . 14 THR HG1 1 1 6 2831 1 1 14 THR HG21 H 11.457 4.752 -1.461 1.00 . A A . 14 THR HG21 1 1 6 2832 1 1 14 THR HG22 H 12.085 4.613 -3.104 1.00 . A A . 14 THR HG22 1 1 6 2833 1 1 14 THR HG23 H 11.922 3.175 -2.098 1.00 . A A . 14 THR HG23 1 1 6 2834 1 1 14 THR N N 8.013 2.656 -2.440 1.00 . A A . 14 THR N 1 1 6 2835 1 1 14 THR O O 9.568 4.914 -0.095 1.00 . A A . 14 THR O 1 1 6 2836 1 1 14 THR OG1 O 10.120 3.094 -4.038 1.00 . A A . 14 THR OG1 1 1 6 2837 1 1 15 ARG C C 5.693 4.861 1.064 1.00 . A A . 15 ARG C 1 1 6 2838 1 1 15 ARG CA C 6.876 5.451 0.304 1.00 . A A . 15 ARG CA 1 1 6 2839 1 1 15 ARG CB C 6.422 6.702 -0.457 1.00 . A A . 15 ARG CB 1 1 6 2840 1 1 15 ARG CD C 7.046 8.699 -1.849 1.00 . A A . 15 ARG CD 1 1 6 2841 1 1 15 ARG CG C 7.536 7.408 -1.215 1.00 . A A . 15 ARG CG 1 1 6 2842 1 1 15 ARG CZ C 8.144 10.696 -2.782 1.00 . A A . 15 ARG CZ 1 1 6 2843 1 1 15 ARG H H 6.816 3.907 -1.142 1.00 . A A . 15 ARG H 1 1 6 2844 1 1 15 ARG HA H 7.652 5.720 1.007 1.00 . A A . 15 ARG HA 1 1 6 2845 1 1 15 ARG HB2 H 5.663 6.416 -1.167 1.00 . A A . 15 ARG HB2 1 1 6 2846 1 1 15 ARG HB3 H 5.997 7.401 0.247 1.00 . A A . 15 ARG HB3 1 1 6 2847 1 1 15 ARG HD2 H 6.242 8.470 -2.531 1.00 . A A . 15 ARG HD2 1 1 6 2848 1 1 15 ARG HD3 H 6.682 9.353 -1.070 1.00 . A A . 15 ARG HD3 1 1 6 2849 1 1 15 ARG HE H 8.831 8.825 -2.948 1.00 . A A . 15 ARG HE 1 1 6 2850 1 1 15 ARG HG2 H 8.338 7.636 -0.530 1.00 . A A . 15 ARG HG2 1 1 6 2851 1 1 15 ARG HG3 H 7.899 6.751 -1.991 1.00 . A A . 15 ARG HG3 1 1 6 2852 1 1 15 ARG HH11 H 6.421 11.072 -1.784 1.00 . A A . 15 ARG HH11 1 1 6 2853 1 1 15 ARG HH12 H 7.213 12.464 -2.444 1.00 . A A . 15 ARG HH12 1 1 6 2854 1 1 15 ARG HH21 H 9.873 10.652 -3.842 1.00 . A A . 15 ARG HH21 1 1 6 2855 1 1 15 ARG HH22 H 9.176 12.225 -3.619 1.00 . A A . 15 ARG HH22 1 1 6 2856 1 1 15 ARG N N 7.429 4.467 -0.621 1.00 . A A . 15 ARG N 1 1 6 2857 1 1 15 ARG NE N 8.106 9.382 -2.582 1.00 . A A . 15 ARG NE 1 1 6 2858 1 1 15 ARG NH1 N 7.181 11.473 -2.300 1.00 . A A . 15 ARG NH1 1 1 6 2859 1 1 15 ARG NH2 N 9.143 11.234 -3.471 1.00 . A A . 15 ARG NH2 1 1 6 2860 1 1 15 ARG O O 4.833 4.195 0.479 1.00 . A A . 15 ARG O 1 1 6 2861 1 1 16 SER C C 3.257 5.280 2.877 1.00 . A A . 16 SER C 1 1 6 2862 1 1 16 SER CA C 4.584 4.613 3.222 1.00 . A A . 16 SER CA 1 1 6 2863 1 1 16 SER CB C 4.933 4.858 4.688 1.00 . A A . 16 SER CB 1 1 6 2864 1 1 16 SER H H 6.363 5.662 2.775 1.00 . A A . 16 SER H 1 1 6 2865 1 1 16 SER HA H 4.497 3.549 3.053 1.00 . A A . 16 SER HA 1 1 6 2866 1 1 16 SER HB2 H 4.051 4.724 5.294 1.00 . A A . 16 SER HB2 1 1 6 2867 1 1 16 SER HB3 H 5.696 4.162 4.998 1.00 . A A . 16 SER HB3 1 1 6 2868 1 1 16 SER HG H 4.718 6.718 5.266 1.00 . A A . 16 SER HG 1 1 6 2869 1 1 16 SER N N 5.653 5.115 2.369 1.00 . A A . 16 SER N 1 1 6 2870 1 1 16 SER O O 2.198 4.662 2.968 1.00 . A A . 16 SER O 1 1 6 2871 1 1 16 SER OG O 5.415 6.177 4.874 1.00 . A A . 16 SER OG 1 1 6 2872 1 1 17 ASP C C 1.579 6.669 0.771 1.00 . A A . 17 ASP C 1 1 6 2873 1 1 17 ASP CA C 2.153 7.286 2.037 1.00 . A A . 17 ASP CA 1 1 6 2874 1 1 17 ASP CB C 2.487 8.761 1.785 1.00 . A A . 17 ASP CB 1 1 6 2875 1 1 17 ASP CG C 2.649 9.565 3.062 1.00 . A A . 17 ASP CG 1 1 6 2876 1 1 17 ASP H H 4.201 7.001 2.500 1.00 . A A . 17 ASP H 1 1 6 2877 1 1 17 ASP HA H 1.412 7.223 2.819 1.00 . A A . 17 ASP HA 1 1 6 2878 1 1 17 ASP HB2 H 3.407 8.824 1.228 1.00 . A A . 17 ASP HB2 1 1 6 2879 1 1 17 ASP HB3 H 1.695 9.203 1.204 1.00 . A A . 17 ASP HB3 1 1 6 2880 1 1 17 ASP N N 3.330 6.547 2.480 1.00 . A A . 17 ASP N 1 1 6 2881 1 1 17 ASP O O 0.370 6.668 0.563 1.00 . A A . 17 ASP O 1 1 6 2882 1 1 17 ASP OD1 O 1.649 10.139 3.542 1.00 . A A . 17 ASP OD1 1 1 6 2883 1 1 17 ASP OD2 O 3.781 9.639 3.587 1.00 . A A . 17 ASP OD2 1 1 6 2884 1 1 18 GLU C C 1.448 4.116 -1.008 1.00 . A A . 18 GLU C 1 1 6 2885 1 1 18 GLU CA C 2.042 5.486 -1.300 1.00 . A A . 18 GLU CA 1 1 6 2886 1 1 18 GLU CB C 3.223 5.363 -2.259 1.00 . A A . 18 GLU CB 1 1 6 2887 1 1 18 GLU CD C 2.662 7.153 -3.954 1.00 . A A . 18 GLU CD 1 1 6 2888 1 1 18 GLU CG C 3.633 6.684 -2.886 1.00 . A A . 18 GLU CG 1 1 6 2889 1 1 18 GLU H H 3.408 6.174 0.152 1.00 . A A . 18 GLU H 1 1 6 2890 1 1 18 GLU HA H 1.282 6.101 -1.756 1.00 . A A . 18 GLU HA 1 1 6 2891 1 1 18 GLU HB2 H 4.071 4.968 -1.721 1.00 . A A . 18 GLU HB2 1 1 6 2892 1 1 18 GLU HB3 H 2.960 4.679 -3.053 1.00 . A A . 18 GLU HB3 1 1 6 2893 1 1 18 GLU HG2 H 3.679 7.436 -2.109 1.00 . A A . 18 GLU HG2 1 1 6 2894 1 1 18 GLU HG3 H 4.609 6.565 -3.332 1.00 . A A . 18 GLU HG3 1 1 6 2895 1 1 18 GLU N N 2.457 6.135 -0.067 1.00 . A A . 18 GLU N 1 1 6 2896 1 1 18 GLU O O 0.515 3.683 -1.681 1.00 . A A . 18 GLU O 1 1 6 2897 1 1 18 GLU OE1 O 2.830 6.749 -5.124 1.00 . A A . 18 GLU OE1 1 1 6 2898 1 1 18 GLU OE2 O 1.737 7.929 -3.639 1.00 . A A . 18 GLU OE2 1 1 6 2899 1 1 19 LEU C C 0.042 2.370 1.025 1.00 . A A . 19 LEU C 1 1 6 2900 1 1 19 LEU CA C 1.433 2.166 0.439 1.00 . A A . 19 LEU CA 1 1 6 2901 1 1 19 LEU CB C 2.344 1.503 1.471 1.00 . A A . 19 LEU CB 1 1 6 2902 1 1 19 LEU CD1 C 1.475 -0.817 1.079 1.00 . A A . 19 LEU CD1 1 1 6 2903 1 1 19 LEU CD2 C 2.720 -0.298 3.178 1.00 . A A . 19 LEU CD2 1 1 6 2904 1 1 19 LEU CG C 1.767 0.244 2.126 1.00 . A A . 19 LEU CG 1 1 6 2905 1 1 19 LEU H H 2.788 3.796 0.448 1.00 . A A . 19 LEU H 1 1 6 2906 1 1 19 LEU HA H 1.354 1.524 -0.426 1.00 . A A . 19 LEU HA 1 1 6 2907 1 1 19 LEU HB2 H 3.272 1.239 0.984 1.00 . A A . 19 LEU HB2 1 1 6 2908 1 1 19 LEU HB3 H 2.555 2.221 2.247 1.00 . A A . 19 LEU HB3 1 1 6 2909 1 1 19 LEU HD11 H 2.394 -1.096 0.585 1.00 . A A . 19 LEU HD11 1 1 6 2910 1 1 19 LEU HD12 H 0.780 -0.424 0.351 1.00 . A A . 19 LEU HD12 1 1 6 2911 1 1 19 LEU HD13 H 1.044 -1.683 1.556 1.00 . A A . 19 LEU HD13 1 1 6 2912 1 1 19 LEU HD21 H 2.240 -1.098 3.720 1.00 . A A . 19 LEU HD21 1 1 6 2913 1 1 19 LEU HD22 H 2.991 0.491 3.863 1.00 . A A . 19 LEU HD22 1 1 6 2914 1 1 19 LEU HD23 H 3.608 -0.677 2.695 1.00 . A A . 19 LEU HD23 1 1 6 2915 1 1 19 LEU HG H 0.834 0.496 2.615 1.00 . A A . 19 LEU HG 1 1 6 2916 1 1 19 LEU N N 1.989 3.439 -0.001 1.00 . A A . 19 LEU N 1 1 6 2917 1 1 19 LEU O O -0.888 1.638 0.702 1.00 . A A . 19 LEU O 1 1 6 2918 1 1 20 GLN C C -2.362 4.084 1.364 1.00 . A A . 20 GLN C 1 1 6 2919 1 1 20 GLN CA C -1.380 3.721 2.470 1.00 . A A . 20 GLN CA 1 1 6 2920 1 1 20 GLN CB C -1.218 4.898 3.433 1.00 . A A . 20 GLN CB 1 1 6 2921 1 1 20 GLN CD C -2.319 6.545 4.994 1.00 . A A . 20 GLN CD 1 1 6 2922 1 1 20 GLN CG C -2.514 5.345 4.091 1.00 . A A . 20 GLN CG 1 1 6 2923 1 1 20 GLN H H 0.709 3.880 2.153 1.00 . A A . 20 GLN H 1 1 6 2924 1 1 20 GLN HA H -1.752 2.864 3.009 1.00 . A A . 20 GLN HA 1 1 6 2925 1 1 20 GLN HB2 H -0.527 4.613 4.211 1.00 . A A . 20 GLN HB2 1 1 6 2926 1 1 20 GLN HB3 H -0.807 5.736 2.891 1.00 . A A . 20 GLN HB3 1 1 6 2927 1 1 20 GLN HE21 H -3.802 5.934 6.160 1.00 . A A . 20 GLN HE21 1 1 6 2928 1 1 20 GLN HE22 H -3.018 7.398 6.643 1.00 . A A . 20 GLN HE22 1 1 6 2929 1 1 20 GLN HG2 H -3.224 5.606 3.320 1.00 . A A . 20 GLN HG2 1 1 6 2930 1 1 20 GLN HG3 H -2.906 4.529 4.679 1.00 . A A . 20 GLN HG3 1 1 6 2931 1 1 20 GLN N N -0.089 3.368 1.891 1.00 . A A . 20 GLN N 1 1 6 2932 1 1 20 GLN NE2 N -3.129 6.635 6.034 1.00 . A A . 20 GLN NE2 1 1 6 2933 1 1 20 GLN O O -3.502 3.607 1.334 1.00 . A A . 20 GLN O 1 1 6 2934 1 1 20 GLN OE1 O -1.450 7.386 4.758 1.00 . A A . 20 GLN OE1 1 1 6 2935 1 1 21 ARG C C -3.149 4.077 -1.463 1.00 . A A . 21 ARG C 1 1 6 2936 1 1 21 ARG CA C -2.650 5.310 -0.725 1.00 . A A . 21 ARG CA 1 1 6 2937 1 1 21 ARG CB C -1.765 6.151 -1.641 1.00 . A A . 21 ARG CB 1 1 6 2938 1 1 21 ARG CD C -1.484 7.522 -3.690 1.00 . A A . 21 ARG CD 1 1 6 2939 1 1 21 ARG CG C -2.463 6.716 -2.860 1.00 . A A . 21 ARG CG 1 1 6 2940 1 1 21 ARG CZ C -1.443 8.895 -5.720 1.00 . A A . 21 ARG CZ 1 1 6 2941 1 1 21 ARG H H -0.991 5.300 0.578 1.00 . A A . 21 ARG H 1 1 6 2942 1 1 21 ARG HA H -3.493 5.900 -0.403 1.00 . A A . 21 ARG HA 1 1 6 2943 1 1 21 ARG HB2 H -1.366 6.975 -1.072 1.00 . A A . 21 ARG HB2 1 1 6 2944 1 1 21 ARG HB3 H -0.945 5.537 -1.982 1.00 . A A . 21 ARG HB3 1 1 6 2945 1 1 21 ARG HD2 H -1.044 8.284 -3.063 1.00 . A A . 21 ARG HD2 1 1 6 2946 1 1 21 ARG HD3 H -0.707 6.861 -4.041 1.00 . A A . 21 ARG HD3 1 1 6 2947 1 1 21 ARG HE H -3.083 8.046 -4.946 1.00 . A A . 21 ARG HE 1 1 6 2948 1 1 21 ARG HG2 H -2.851 5.903 -3.457 1.00 . A A . 21 ARG HG2 1 1 6 2949 1 1 21 ARG HG3 H -3.273 7.358 -2.545 1.00 . A A . 21 ARG HG3 1 1 6 2950 1 1 21 ARG HH11 H 0.372 8.592 -4.844 1.00 . A A . 21 ARG HH11 1 1 6 2951 1 1 21 ARG HH12 H 0.382 9.592 -6.266 1.00 . A A . 21 ARG HH12 1 1 6 2952 1 1 21 ARG HH21 H -3.077 9.365 -6.823 1.00 . A A . 21 ARG HH21 1 1 6 2953 1 1 21 ARG HH22 H -1.580 10.031 -7.392 1.00 . A A . 21 ARG HH22 1 1 6 2954 1 1 21 ARG N N -1.888 4.920 0.450 1.00 . A A . 21 ARG N 1 1 6 2955 1 1 21 ARG NE N -2.112 8.162 -4.836 1.00 . A A . 21 ARG NE 1 1 6 2956 1 1 21 ARG NH1 N -0.125 9.039 -5.602 1.00 . A A . 21 ARG NH1 1 1 6 2957 1 1 21 ARG NH2 N -2.085 9.476 -6.725 1.00 . A A . 21 ARG NH2 1 1 6 2958 1 1 21 ARG O O -4.335 3.958 -1.765 1.00 . A A . 21 ARG O 1 1 6 2959 1 1 22 HIS C C -3.620 1.128 -1.576 1.00 . A A . 22 HIS C 1 1 6 2960 1 1 22 HIS CA C -2.587 1.905 -2.384 1.00 . A A . 22 HIS CA 1 1 6 2961 1 1 22 HIS CB C -1.340 1.043 -2.617 1.00 . A A . 22 HIS CB 1 1 6 2962 1 1 22 HIS CD2 C -1.776 -1.436 -2.066 1.00 . A A . 22 HIS CD2 1 1 6 2963 1 1 22 HIS CE1 C -2.420 -2.143 -4.019 1.00 . A A . 22 HIS CE1 1 1 6 2964 1 1 22 HIS CG C -1.672 -0.385 -2.916 1.00 . A A . 22 HIS CG 1 1 6 2965 1 1 22 HIS H H -1.304 3.300 -1.455 1.00 . A A . 22 HIS H 1 1 6 2966 1 1 22 HIS HA H -3.018 2.156 -3.339 1.00 . A A . 22 HIS HA 1 1 6 2967 1 1 22 HIS HB2 H -0.783 1.441 -3.451 1.00 . A A . 22 HIS HB2 1 1 6 2968 1 1 22 HIS HB3 H -0.722 1.065 -1.730 1.00 . A A . 22 HIS HB3 1 1 6 2969 1 1 22 HIS HD1 H -2.106 -0.331 -4.998 1.00 . A A . 22 HIS HD1 1 1 6 2970 1 1 22 HIS HD2 H -1.517 -1.443 -1.017 1.00 . A A . 22 HIS HD2 1 1 6 2971 1 1 22 HIS HE1 H -2.792 -2.777 -4.809 1.00 . A A . 22 HIS HE1 1 1 6 2972 1 1 22 HIS N N -2.238 3.146 -1.722 1.00 . A A . 22 HIS N 1 1 6 2973 1 1 22 HIS ND1 N -2.071 -0.853 -4.163 1.00 . A A . 22 HIS ND1 1 1 6 2974 1 1 22 HIS NE2 N -2.252 -2.509 -2.777 1.00 . A A . 22 HIS NE2 1 1 6 2975 1 1 22 HIS O O -4.582 0.612 -2.132 1.00 . A A . 22 HIS O 1 1 6 2976 1 1 23 LYS C C -5.732 0.882 0.542 1.00 . A A . 23 LYS C 1 1 6 2977 1 1 23 LYS CA C -4.326 0.305 0.594 1.00 . A A . 23 LYS CA 1 1 6 2978 1 1 23 LYS CB C -3.821 0.275 2.036 1.00 . A A . 23 LYS CB 1 1 6 2979 1 1 23 LYS CD C -2.274 -0.778 3.706 1.00 . A A . 23 LYS CD 1 1 6 2980 1 1 23 LYS CE C -1.083 -1.700 3.907 1.00 . A A . 23 LYS CE 1 1 6 2981 1 1 23 LYS CG C -2.596 -0.605 2.235 1.00 . A A . 23 LYS CG 1 1 6 2982 1 1 23 LYS H H -2.640 1.500 0.127 1.00 . A A . 23 LYS H 1 1 6 2983 1 1 23 LYS HA H -4.362 -0.705 0.223 1.00 . A A . 23 LYS HA 1 1 6 2984 1 1 23 LYS HB2 H -3.569 1.280 2.334 1.00 . A A . 23 LYS HB2 1 1 6 2985 1 1 23 LYS HB3 H -4.612 -0.094 2.672 1.00 . A A . 23 LYS HB3 1 1 6 2986 1 1 23 LYS HD2 H -2.048 0.188 4.130 1.00 . A A . 23 LYS HD2 1 1 6 2987 1 1 23 LYS HD3 H -3.134 -1.201 4.203 1.00 . A A . 23 LYS HD3 1 1 6 2988 1 1 23 LYS HE2 H -1.303 -2.654 3.451 1.00 . A A . 23 LYS HE2 1 1 6 2989 1 1 23 LYS HE3 H -0.222 -1.263 3.426 1.00 . A A . 23 LYS HE3 1 1 6 2990 1 1 23 LYS HG2 H -2.786 -1.575 1.803 1.00 . A A . 23 LYS HG2 1 1 6 2991 1 1 23 LYS HG3 H -1.751 -0.147 1.741 1.00 . A A . 23 LYS HG3 1 1 6 2992 1 1 23 LYS HZ1 H -0.636 -1.001 5.823 1.00 . A A . 23 LYS HZ1 1 1 6 2993 1 1 23 LYS HZ2 H 0.089 -2.479 5.449 1.00 . A A . 23 LYS HZ2 1 1 6 2994 1 1 23 LYS HZ3 H -1.559 -2.417 5.811 1.00 . A A . 23 LYS HZ3 1 1 6 2995 1 1 23 LYS N N -3.419 1.050 -0.268 1.00 . A A . 23 LYS N 1 1 6 2996 1 1 23 LYS NZ N -0.777 -1.913 5.346 1.00 . A A . 23 LYS NZ 1 1 6 2997 1 1 23 LYS O O -6.708 0.189 0.837 1.00 . A A . 23 LYS O 1 1 6 2998 1 1 24 ARG C C -7.928 2.144 -1.186 1.00 . A A . 24 ARG C 1 1 6 2999 1 1 24 ARG CA C -7.142 2.774 -0.031 1.00 . A A . 24 ARG CA 1 1 6 3000 1 1 24 ARG CB C -7.001 4.280 -0.255 1.00 . A A . 24 ARG CB 1 1 6 3001 1 1 24 ARG CD C -6.432 6.522 0.714 1.00 . A A . 24 ARG CD 1 1 6 3002 1 1 24 ARG CG C -6.364 5.016 0.910 1.00 . A A . 24 ARG CG 1 1 6 3003 1 1 24 ARG CZ C -8.191 8.213 0.340 1.00 . A A . 24 ARG CZ 1 1 6 3004 1 1 24 ARG H H -5.021 2.660 -0.067 1.00 . A A . 24 ARG H 1 1 6 3005 1 1 24 ARG HA H -7.692 2.613 0.884 1.00 . A A . 24 ARG HA 1 1 6 3006 1 1 24 ARG HB2 H -6.389 4.444 -1.129 1.00 . A A . 24 ARG HB2 1 1 6 3007 1 1 24 ARG HB3 H -7.979 4.701 -0.427 1.00 . A A . 24 ARG HB3 1 1 6 3008 1 1 24 ARG HD2 H -5.858 7.003 1.493 1.00 . A A . 24 ARG HD2 1 1 6 3009 1 1 24 ARG HD3 H -6.010 6.766 -0.249 1.00 . A A . 24 ARG HD3 1 1 6 3010 1 1 24 ARG HE H -8.483 6.409 1.154 1.00 . A A . 24 ARG HE 1 1 6 3011 1 1 24 ARG HG2 H -6.889 4.757 1.818 1.00 . A A . 24 ARG HG2 1 1 6 3012 1 1 24 ARG HG3 H -5.330 4.718 0.992 1.00 . A A . 24 ARG HG3 1 1 6 3013 1 1 24 ARG HH11 H -7.602 9.941 -0.545 1.00 . A A . 24 ARG HH11 1 1 6 3014 1 1 24 ARG HH12 H -6.357 8.750 -0.340 1.00 . A A . 24 ARG HH12 1 1 6 3015 1 1 24 ARG HH21 H -9.747 9.494 0.153 1.00 . A A . 24 ARG HH21 1 1 6 3016 1 1 24 ARG HH22 H -10.126 7.974 0.894 1.00 . A A . 24 ARG HH22 1 1 6 3017 1 1 24 ARG N N -5.840 2.141 0.129 1.00 . A A . 24 ARG N 1 1 6 3018 1 1 24 ARG NE N -7.809 7.011 0.765 1.00 . A A . 24 ARG NE 1 1 6 3019 1 1 24 ARG NH1 N -7.313 9.033 -0.226 1.00 . A A . 24 ARG NH1 1 1 6 3020 1 1 24 ARG NH2 N -9.456 8.590 0.472 1.00 . A A . 24 ARG NH2 1 1 6 3021 1 1 24 ARG O O -9.078 2.507 -1.428 1.00 . A A . 24 ARG O 1 1 6 3022 1 1 25 THR C C -8.682 -0.762 -2.295 1.00 . A A . 25 THR C 1 1 6 3023 1 1 25 THR CA C -8.018 0.456 -2.927 1.00 . A A . 25 THR CA 1 1 6 3024 1 1 25 THR CB C -7.089 -0.003 -4.072 1.00 . A A . 25 THR CB 1 1 6 3025 1 1 25 THR CG2 C -6.405 1.185 -4.730 1.00 . A A . 25 THR CG2 1 1 6 3026 1 1 25 THR H H -6.352 1.047 -1.762 1.00 . A A . 25 THR H 1 1 6 3027 1 1 25 THR HA H -8.784 1.096 -3.341 1.00 . A A . 25 THR HA 1 1 6 3028 1 1 25 THR HB H -7.687 -0.509 -4.815 1.00 . A A . 25 THR HB 1 1 6 3029 1 1 25 THR HG1 H -5.371 -0.408 -3.175 1.00 . A A . 25 THR HG1 1 1 6 3030 1 1 25 THR HG21 H -5.762 0.836 -5.525 1.00 . A A . 25 THR HG21 1 1 6 3031 1 1 25 THR HG22 H -5.815 1.712 -3.995 1.00 . A A . 25 THR HG22 1 1 6 3032 1 1 25 THR HG23 H -7.151 1.852 -5.136 1.00 . A A . 25 THR HG23 1 1 6 3033 1 1 25 THR N N -7.308 1.216 -1.909 1.00 . A A . 25 THR N 1 1 6 3034 1 1 25 THR O O -9.717 -1.242 -2.766 1.00 . A A . 25 THR O 1 1 6 3035 1 1 25 THR OG1 O -6.096 -0.912 -3.578 1.00 . A A . 25 THR OG1 1 1 6 3036 1 1 26 HIS C C -9.721 -1.855 0.466 1.00 . A A . 26 HIS C 1 1 6 3037 1 1 26 HIS CA C -8.643 -2.371 -0.473 1.00 . A A . 26 HIS CA 1 1 6 3038 1 1 26 HIS CB C -7.563 -3.110 0.328 1.00 . A A . 26 HIS CB 1 1 6 3039 1 1 26 HIS CD2 C -5.170 -3.424 -0.611 1.00 . A A . 26 HIS CD2 1 1 6 3040 1 1 26 HIS CE1 C -5.500 -5.148 -1.902 1.00 . A A . 26 HIS CE1 1 1 6 3041 1 1 26 HIS CG C -6.487 -3.745 -0.503 1.00 . A A . 26 HIS CG 1 1 6 3042 1 1 26 HIS H H -7.244 -0.847 -0.904 1.00 . A A . 26 HIS H 1 1 6 3043 1 1 26 HIS HA H -9.091 -3.050 -1.181 1.00 . A A . 26 HIS HA 1 1 6 3044 1 1 26 HIS HB2 H -7.085 -2.411 0.999 1.00 . A A . 26 HIS HB2 1 1 6 3045 1 1 26 HIS HB3 H -8.032 -3.890 0.911 1.00 . A A . 26 HIS HB3 1 1 6 3046 1 1 26 HIS HD1 H -7.529 -5.321 -1.469 1.00 . A A . 26 HIS HD1 1 1 6 3047 1 1 26 HIS HD2 H -4.659 -2.633 -0.090 1.00 . A A . 26 HIS HD2 1 1 6 3048 1 1 26 HIS HE1 H -5.331 -5.962 -2.589 1.00 . A A . 26 HIS HE1 1 1 6 3049 1 1 26 HIS N N -8.081 -1.255 -1.215 1.00 . A A . 26 HIS N 1 1 6 3050 1 1 26 HIS ND1 N -6.682 -4.844 -1.332 1.00 . A A . 26 HIS ND1 1 1 6 3051 1 1 26 HIS NE2 N -4.584 -4.312 -1.487 1.00 . A A . 26 HIS NE2 1 1 6 3052 1 1 26 HIS O O -10.819 -2.404 0.535 1.00 . A A . 26 HIS O 1 1 6 3053 1 1 27 THR C C -10.802 1.180 1.435 1.00 . A A . 27 THR C 1 1 6 3054 1 1 27 THR CA C -10.346 -0.136 2.061 1.00 . A A . 27 THR CA 1 1 6 3055 1 1 27 THR CB C -9.724 0.123 3.448 1.00 . A A . 27 THR CB 1 1 6 3056 1 1 27 THR CG2 C -10.797 0.472 4.468 1.00 . A A . 27 THR CG2 1 1 6 3057 1 1 27 THR H H -8.487 -0.424 1.111 1.00 . A A . 27 THR H 1 1 6 3058 1 1 27 THR HA H -11.200 -0.788 2.181 1.00 . A A . 27 THR HA 1 1 6 3059 1 1 27 THR HB H -9.033 0.950 3.370 1.00 . A A . 27 THR HB 1 1 6 3060 1 1 27 THR HG1 H -9.522 -1.835 3.646 1.00 . A A . 27 THR HG1 1 1 6 3061 1 1 27 THR HG21 H -10.334 0.659 5.426 1.00 . A A . 27 THR HG21 1 1 6 3062 1 1 27 THR HG22 H -11.490 -0.351 4.558 1.00 . A A . 27 THR HG22 1 1 6 3063 1 1 27 THR HG23 H -11.327 1.357 4.146 1.00 . A A . 27 THR HG23 1 1 6 3064 1 1 27 THR N N -9.397 -0.788 1.180 1.00 . A A . 27 THR N 1 1 6 3065 1 1 27 THR O O -10.495 2.272 1.923 1.00 . A A . 27 THR O 1 1 6 3066 1 1 27 THR OG1 O -9.017 -1.047 3.886 1.00 . A A . 27 THR OG1 1 1 6 3067 1 1 28 GLY C C -13.288 2.753 0.136 1.00 . A A . 28 GLY C 1 1 6 3068 1 1 28 GLY CA C -11.972 2.229 -0.391 1.00 . A A . 28 GLY CA 1 1 6 3069 1 1 28 GLY H H -11.745 0.168 0.002 1.00 . A A . 28 GLY H 1 1 6 3070 1 1 28 GLY HA2 H -11.226 3.003 -0.304 1.00 . A A . 28 GLY HA2 1 1 6 3071 1 1 28 GLY HA3 H -12.091 1.972 -1.434 1.00 . A A . 28 GLY HA3 1 1 6 3072 1 1 28 GLY N N -11.516 1.063 0.329 1.00 . A A . 28 GLY N 1 1 6 3073 1 1 28 GLY O O -14.019 2.037 0.825 1.00 . A A . 28 GLY O 1 1 6 3074 1 1 29 GLU C C -15.930 4.318 -0.771 1.00 . A A . 29 GLU C 1 1 6 3075 1 1 29 GLU CA C -14.830 4.623 0.242 1.00 . A A . 29 GLU CA 1 1 6 3076 1 1 29 GLU CB C -14.640 6.137 0.387 1.00 . A A . 29 GLU CB 1 1 6 3077 1 1 29 GLU CD C -15.649 8.351 1.041 1.00 . A A . 29 GLU CD 1 1 6 3078 1 1 29 GLU CG C -15.823 6.848 1.021 1.00 . A A . 29 GLU CG 1 1 6 3079 1 1 29 GLU H H -12.962 4.518 -0.736 1.00 . A A . 29 GLU H 1 1 6 3080 1 1 29 GLU HA H -15.104 4.202 1.197 1.00 . A A . 29 GLU HA 1 1 6 3081 1 1 29 GLU HB2 H -13.766 6.324 0.997 1.00 . A A . 29 GLU HB2 1 1 6 3082 1 1 29 GLU HB3 H -14.479 6.562 -0.592 1.00 . A A . 29 GLU HB3 1 1 6 3083 1 1 29 GLU HG2 H -16.712 6.612 0.456 1.00 . A A . 29 GLU HG2 1 1 6 3084 1 1 29 GLU HG3 H -15.939 6.499 2.037 1.00 . A A . 29 GLU HG3 1 1 6 3085 1 1 29 GLU N N -13.590 4.001 -0.187 1.00 . A A . 29 GLU N 1 1 6 3086 1 1 29 GLU O O -16.253 5.143 -1.626 1.00 . A A . 29 GLU O 1 1 6 3087 1 1 29 GLU OE1 O -14.925 8.859 1.922 1.00 . A A . 29 GLU OE1 1 1 6 3088 1 1 29 GLU OE2 O -16.229 9.033 0.170 1.00 . A A . 29 GLU OE2 1 1 6 3089 1 1 30 LYS C C -18.674 2.064 -0.848 1.00 . A A . 30 LYS C 1 1 6 3090 1 1 30 LYS CA C -17.515 2.690 -1.613 1.00 . A A . 30 LYS CA 1 1 6 3091 1 1 30 LYS CB C -16.941 1.697 -2.628 1.00 . A A . 30 LYS CB 1 1 6 3092 1 1 30 LYS CD C -17.267 0.412 -4.763 1.00 . A A . 30 LYS CD 1 1 6 3093 1 1 30 LYS CE C -18.206 0.121 -5.923 1.00 . A A . 30 LYS CE 1 1 6 3094 1 1 30 LYS CG C -17.903 1.351 -3.751 1.00 . A A . 30 LYS CG 1 1 6 3095 1 1 30 LYS H H -16.184 2.499 0.014 1.00 . A A . 30 LYS H 1 1 6 3096 1 1 30 LYS HA H -17.874 3.564 -2.137 1.00 . A A . 30 LYS HA 1 1 6 3097 1 1 30 LYS HB2 H -16.049 2.122 -3.066 1.00 . A A . 30 LYS HB2 1 1 6 3098 1 1 30 LYS HB3 H -16.678 0.785 -2.113 1.00 . A A . 30 LYS HB3 1 1 6 3099 1 1 30 LYS HD2 H -16.369 0.867 -5.148 1.00 . A A . 30 LYS HD2 1 1 6 3100 1 1 30 LYS HD3 H -17.022 -0.517 -4.271 1.00 . A A . 30 LYS HD3 1 1 6 3101 1 1 30 LYS HE2 H -17.716 -0.559 -6.603 1.00 . A A . 30 LYS HE2 1 1 6 3102 1 1 30 LYS HE3 H -19.102 -0.342 -5.536 1.00 . A A . 30 LYS HE3 1 1 6 3103 1 1 30 LYS HG2 H -18.776 0.874 -3.331 1.00 . A A . 30 LYS HG2 1 1 6 3104 1 1 30 LYS HG3 H -18.194 2.262 -4.252 1.00 . A A . 30 LYS HG3 1 1 6 3105 1 1 30 LYS HZ1 H -19.198 1.120 -7.461 1.00 . A A . 30 LYS HZ1 1 1 6 3106 1 1 30 LYS HZ2 H -17.728 1.831 -7.022 1.00 . A A . 30 LYS HZ2 1 1 6 3107 1 1 30 LYS HZ3 H -19.083 2.012 -6.031 1.00 . A A . 30 LYS HZ3 1 1 6 3108 1 1 30 LYS N N -16.481 3.117 -0.689 1.00 . A A . 30 LYS N 1 1 6 3109 1 1 30 LYS NZ N -18.580 1.356 -6.660 1.00 . A A . 30 LYS NZ 1 1 6 3110 1 1 30 LYS O O -18.639 0.890 -0.483 1.00 . A A . 30 LYS O 1 1 6 3111 1 1 31 NH2 HN1 H -19.650 3.785 -0.912 1.00 . A A . 31 NH2 HN1 1 1 6 3112 1 1 31 NH2 HN2 H -20.451 2.496 -0.087 1.00 . A A . 31 NH2 HN2 1 1 6 3113 1 1 31 NH2 N N -19.693 2.859 -0.589 1.00 . A A . 31 NH2 N 1 1 6 3114 2 2 1 ZN ZN ZN -2.660 -4.301 -2.018 1.00 . B A . 101 ZN ZN 1 1 7 3115 1 1 1 ARG C C 11.853 -2.027 2.966 1.00 . A A . 1 ARG C 1 1 7 3116 1 1 1 ARG CA C 12.906 -2.930 3.591 1.00 . A A . 1 ARG CA 1 1 7 3117 1 1 1 ARG CB C 12.301 -3.684 4.782 1.00 . A A . 1 ARG CB 1 1 7 3118 1 1 1 ARG CD C 13.450 -5.888 4.369 1.00 . A A . 1 ARG CD 1 1 7 3119 1 1 1 ARG CG C 13.214 -4.755 5.359 1.00 . A A . 1 ARG CG 1 1 7 3120 1 1 1 ARG CZ C 12.074 -7.448 3.039 1.00 . A A . 1 ARG CZ 1 1 7 3121 1 1 1 ARG H1 H 14.498 -1.647 3.209 1.00 . A A . 1 ARG H1 1 1 7 3122 1 1 1 ARG H2 H 14.789 -2.737 4.467 1.00 . A A . 1 ARG H2 1 1 7 3123 1 1 1 ARG H3 H 13.773 -1.408 4.716 1.00 . A A . 1 ARG H3 1 1 7 3124 1 1 1 ARG HA H 13.241 -3.641 2.852 1.00 . A A . 1 ARG HA 1 1 7 3125 1 1 1 ARG HB2 H 12.076 -2.976 5.564 1.00 . A A . 1 ARG HB2 1 1 7 3126 1 1 1 ARG HB3 H 11.385 -4.158 4.463 1.00 . A A . 1 ARG HB3 1 1 7 3127 1 1 1 ARG HD2 H 13.821 -5.471 3.445 1.00 . A A . 1 ARG HD2 1 1 7 3128 1 1 1 ARG HD3 H 14.189 -6.561 4.780 1.00 . A A . 1 ARG HD3 1 1 7 3129 1 1 1 ARG HE H 11.489 -6.558 4.734 1.00 . A A . 1 ARG HE 1 1 7 3130 1 1 1 ARG HG2 H 14.163 -4.308 5.610 1.00 . A A . 1 ARG HG2 1 1 7 3131 1 1 1 ARG HG3 H 12.756 -5.158 6.253 1.00 . A A . 1 ARG HG3 1 1 7 3132 1 1 1 ARG HH11 H 12.913 -8.149 1.336 1.00 . A A . 1 ARG HH11 1 1 7 3133 1 1 1 ARG HH12 H 13.867 -6.995 2.208 1.00 . A A . 1 ARG HH12 1 1 7 3134 1 1 1 ARG HH21 H 10.217 -8.071 3.571 1.00 . A A . 1 ARG HH21 1 1 7 3135 1 1 1 ARG HH22 H 10.840 -8.753 2.100 1.00 . A A . 1 ARG HH22 1 1 7 3136 1 1 1 ARG N N 14.072 -2.127 4.026 1.00 . A A . 1 ARG N 1 1 7 3137 1 1 1 ARG NE N 12.227 -6.641 4.088 1.00 . A A . 1 ARG NE 1 1 7 3138 1 1 1 ARG NH1 N 13.029 -7.541 2.123 1.00 . A A . 1 ARG NH1 1 1 7 3139 1 1 1 ARG NH2 N 10.956 -8.146 2.893 1.00 . A A . 1 ARG NH2 1 1 7 3140 1 1 1 ARG O O 11.520 -0.981 3.522 1.00 . A A . 1 ARG O 1 1 7 3141 1 1 2 PRO C C 8.936 -1.734 1.734 1.00 . A A . 2 PRO C 1 1 7 3142 1 1 2 PRO CA C 10.313 -1.616 1.095 1.00 . A A . 2 PRO CA 1 1 7 3143 1 1 2 PRO CB C 10.303 -2.224 -0.307 1.00 . A A . 2 PRO CB 1 1 7 3144 1 1 2 PRO CD C 11.653 -3.650 1.063 1.00 . A A . 2 PRO CD 1 1 7 3145 1 1 2 PRO CG C 10.696 -3.645 -0.101 1.00 . A A . 2 PRO CG 1 1 7 3146 1 1 2 PRO HA H 10.596 -0.574 1.039 1.00 . A A . 2 PRO HA 1 1 7 3147 1 1 2 PRO HB2 H 9.310 -2.143 -0.730 1.00 . A A . 2 PRO HB2 1 1 7 3148 1 1 2 PRO HB3 H 11.013 -1.705 -0.932 1.00 . A A . 2 PRO HB3 1 1 7 3149 1 1 2 PRO HD2 H 11.489 -4.521 1.682 1.00 . A A . 2 PRO HD2 1 1 7 3150 1 1 2 PRO HD3 H 12.675 -3.624 0.710 1.00 . A A . 2 PRO HD3 1 1 7 3151 1 1 2 PRO HG2 H 9.821 -4.236 0.130 1.00 . A A . 2 PRO HG2 1 1 7 3152 1 1 2 PRO HG3 H 11.180 -4.024 -0.988 1.00 . A A . 2 PRO HG3 1 1 7 3153 1 1 2 PRO N N 11.320 -2.410 1.797 1.00 . A A . 2 PRO N 1 1 7 3154 1 1 2 PRO O O 8.695 -2.607 2.569 1.00 . A A . 2 PRO O 1 1 7 3155 1 1 3 PHE C C 5.829 -1.749 0.952 1.00 . A A . 3 PHE C 1 1 7 3156 1 1 3 PHE CA C 6.679 -0.856 1.840 1.00 . A A . 3 PHE CA 1 1 7 3157 1 1 3 PHE CB C 6.112 0.565 1.862 1.00 . A A . 3 PHE CB 1 1 7 3158 1 1 3 PHE CD1 C 7.912 2.260 2.292 1.00 . A A . 3 PHE CD1 1 1 7 3159 1 1 3 PHE CD2 C 6.494 1.623 4.098 1.00 . A A . 3 PHE CD2 1 1 7 3160 1 1 3 PHE CE1 C 8.594 3.124 3.126 1.00 . A A . 3 PHE CE1 1 1 7 3161 1 1 3 PHE CE2 C 7.171 2.485 4.937 1.00 . A A . 3 PHE CE2 1 1 7 3162 1 1 3 PHE CG C 6.856 1.501 2.770 1.00 . A A . 3 PHE CG 1 1 7 3163 1 1 3 PHE CZ C 8.223 3.237 4.451 1.00 . A A . 3 PHE CZ 1 1 7 3164 1 1 3 PHE H H 8.300 -0.173 0.675 1.00 . A A . 3 PHE H 1 1 7 3165 1 1 3 PHE HA H 6.687 -1.256 2.842 1.00 . A A . 3 PHE HA 1 1 7 3166 1 1 3 PHE HB2 H 6.149 0.975 0.866 1.00 . A A . 3 PHE HB2 1 1 7 3167 1 1 3 PHE HB3 H 5.087 0.531 2.190 1.00 . A A . 3 PHE HB3 1 1 7 3168 1 1 3 PHE HD1 H 8.203 2.171 1.255 1.00 . A A . 3 PHE HD1 1 1 7 3169 1 1 3 PHE HD2 H 5.672 1.035 4.478 1.00 . A A . 3 PHE HD2 1 1 7 3170 1 1 3 PHE HE1 H 9.414 3.711 2.740 1.00 . A A . 3 PHE HE1 1 1 7 3171 1 1 3 PHE HE2 H 6.879 2.571 5.971 1.00 . A A . 3 PHE HE2 1 1 7 3172 1 1 3 PHE HZ H 8.753 3.912 5.105 1.00 . A A . 3 PHE HZ 1 1 7 3173 1 1 3 PHE N N 8.041 -0.847 1.341 1.00 . A A . 3 PHE N 1 1 7 3174 1 1 3 PHE O O 5.188 -1.278 0.016 1.00 . A A . 3 PHE O 1 1 7 3175 1 1 4 NLE C C 3.776 -4.310 0.901 1.00 . A A . 4 NLE C 1 1 7 3176 1 1 4 NLE CA C 5.174 -4.009 0.387 1.00 . A A . 4 NLE CA 1 1 7 3177 1 1 4 NLE CB C 5.987 -5.305 0.309 1.00 . A A . 4 NLE CB 1 1 7 3178 1 1 4 NLE CD C 6.196 -7.631 -0.653 1.00 . A A . 4 NLE CD 1 1 7 3179 1 1 4 NLE CE C 6.028 -8.320 0.683 1.00 . A A . 4 NLE CE 1 1 7 3180 1 1 4 NLE CG C 5.423 -6.321 -0.677 1.00 . A A . 4 NLE CG 1 1 7 3181 1 1 4 NLE H H 6.319 -3.347 2.037 1.00 . A A . 4 NLE H 1 1 7 3182 1 1 4 NLE HA H 5.092 -3.586 -0.598 1.00 . A A . 4 NLE HA 1 1 7 3183 1 1 4 NLE HB2 H 6.008 -5.759 1.286 1.00 . A A . 4 NLE HB2 1 1 7 3184 1 1 4 NLE HB3 H 6.998 -5.067 0.012 1.00 . A A . 4 NLE HB3 1 1 7 3185 1 1 4 NLE HD2 H 7.245 -7.431 -0.813 1.00 . A A . 4 NLE HD2 1 1 7 3186 1 1 4 NLE HD3 H 5.822 -8.283 -1.428 1.00 . A A . 4 NLE HD3 1 1 7 3187 1 1 4 NLE HE1 H 4.979 -8.488 0.871 1.00 . A A . 4 NLE HE1 1 1 7 3188 1 1 4 NLE HE2 H 6.442 -7.700 1.464 1.00 . A A . 4 NLE HE2 1 1 7 3189 1 1 4 NLE HE3 H 6.545 -9.268 0.666 1.00 . A A . 4 NLE HE3 1 1 7 3190 1 1 4 NLE HG2 H 5.471 -5.905 -1.673 1.00 . A A . 4 NLE HG2 1 1 7 3191 1 1 4 NLE HG3 H 4.394 -6.521 -0.421 1.00 . A A . 4 NLE HG3 1 1 7 3192 1 1 4 NLE N N 5.846 -3.039 1.234 1.00 . A A . 4 NLE N 1 1 7 3193 1 1 4 NLE O O 3.572 -4.523 2.095 1.00 . A A . 4 NLE O 1 1 7 3194 1 1 5 CYS C C 1.413 -6.214 0.558 1.00 . A A . 5 CYS C 1 1 7 3195 1 1 5 CYS CA C 1.460 -4.707 0.313 1.00 . A A . 5 CYS CA 1 1 7 3196 1 1 5 CYS CB C 0.501 -4.313 -0.819 1.00 . A A . 5 CYS CB 1 1 7 3197 1 1 5 CYS H H 3.025 -4.032 -0.930 1.00 . A A . 5 CYS H 1 1 7 3198 1 1 5 CYS HA H 1.171 -4.195 1.218 1.00 . A A . 5 CYS HA 1 1 7 3199 1 1 5 CYS HB2 H 0.526 -3.240 -0.944 1.00 . A A . 5 CYS HB2 1 1 7 3200 1 1 5 CYS HB3 H 0.827 -4.782 -1.733 1.00 . A A . 5 CYS HB3 1 1 7 3201 1 1 5 CYS N N 2.815 -4.311 -0.010 1.00 . A A . 5 CYS N 1 1 7 3202 1 1 5 CYS O O 2.111 -6.983 -0.107 1.00 . A A . 5 CYS O 1 1 7 3203 1 1 5 CYS SG S -1.220 -4.789 -0.536 1.00 . A A . 5 CYS SG 1 1 7 3204 1 1 6 THR C C -0.977 -8.430 1.977 1.00 . A A . 6 THR C 1 1 7 3205 1 1 6 THR CA C 0.488 -8.031 1.868 1.00 . A A . 6 THR CA 1 1 7 3206 1 1 6 THR CB C 1.210 -8.340 3.193 1.00 . A A . 6 THR CB 1 1 7 3207 1 1 6 THR CG2 C 2.715 -8.392 2.992 1.00 . A A . 6 THR CG2 1 1 7 3208 1 1 6 THR H H 0.092 -5.967 2.030 1.00 . A A . 6 THR H 1 1 7 3209 1 1 6 THR HA H 0.954 -8.608 1.082 1.00 . A A . 6 THR HA 1 1 7 3210 1 1 6 THR HB H 0.876 -9.304 3.549 1.00 . A A . 6 THR HB 1 1 7 3211 1 1 6 THR HG1 H 0.193 -7.684 4.755 1.00 . A A . 6 THR HG1 1 1 7 3212 1 1 6 THR HG21 H 3.057 -7.447 2.595 1.00 . A A . 6 THR HG21 1 1 7 3213 1 1 6 THR HG22 H 2.958 -9.183 2.299 1.00 . A A . 6 THR HG22 1 1 7 3214 1 1 6 THR HG23 H 3.199 -8.581 3.938 1.00 . A A . 6 THR HG23 1 1 7 3215 1 1 6 THR N N 0.613 -6.625 1.526 1.00 . A A . 6 THR N 1 1 7 3216 1 1 6 THR O O -1.399 -9.033 2.962 1.00 . A A . 6 THR O 1 1 7 3217 1 1 6 THR OG1 O 0.883 -7.342 4.173 1.00 . A A . 6 THR OG1 1 1 7 3218 1 1 7 TRP C C -3.465 -9.691 0.270 1.00 . A A . 7 TRP C 1 1 7 3219 1 1 7 TRP CA C -3.182 -8.361 0.963 1.00 . A A . 7 TRP CA 1 1 7 3220 1 1 7 TRP CB C -3.938 -7.224 0.277 1.00 . A A . 7 TRP CB 1 1 7 3221 1 1 7 TRP CD1 C -6.370 -7.876 -0.174 1.00 . A A . 7 TRP CD1 1 1 7 3222 1 1 7 TRP CD2 C -6.084 -6.555 1.603 1.00 . A A . 7 TRP CD2 1 1 7 3223 1 1 7 TRP CE2 C -7.455 -6.834 1.469 1.00 . A A . 7 TRP CE2 1 1 7 3224 1 1 7 TRP CE3 C -5.661 -5.740 2.655 1.00 . A A . 7 TRP CE3 1 1 7 3225 1 1 7 TRP CG C -5.409 -7.233 0.544 1.00 . A A . 7 TRP CG 1 1 7 3226 1 1 7 TRP CH2 C -7.965 -5.529 3.365 1.00 . A A . 7 TRP CH2 1 1 7 3227 1 1 7 TRP CZ2 C -8.407 -6.325 2.344 1.00 . A A . 7 TRP CZ2 1 1 7 3228 1 1 7 TRP CZ3 C -6.605 -5.235 3.524 1.00 . A A . 7 TRP CZ3 1 1 7 3229 1 1 7 TRP H H -1.358 -7.637 0.180 1.00 . A A . 7 TRP H 1 1 7 3230 1 1 7 TRP HA H -3.506 -8.428 1.991 1.00 . A A . 7 TRP HA 1 1 7 3231 1 1 7 TRP HB2 H -3.545 -6.279 0.617 1.00 . A A . 7 TRP HB2 1 1 7 3232 1 1 7 TRP HB3 H -3.794 -7.303 -0.789 1.00 . A A . 7 TRP HB3 1 1 7 3233 1 1 7 TRP HD1 H -6.173 -8.479 -1.046 1.00 . A A . 7 TRP HD1 1 1 7 3234 1 1 7 TRP HE1 H -8.455 -7.997 0.041 1.00 . A A . 7 TRP HE1 1 1 7 3235 1 1 7 TRP HE3 H -4.615 -5.502 2.791 1.00 . A A . 7 TRP HE3 1 1 7 3236 1 1 7 TRP HH2 H -8.671 -5.111 4.067 1.00 . A A . 7 TRP HH2 1 1 7 3237 1 1 7 TRP HZ2 H -9.459 -6.543 2.236 1.00 . A A . 7 TRP HZ2 1 1 7 3238 1 1 7 TRP HZ3 H -6.298 -4.602 4.343 1.00 . A A . 7 TRP HZ3 1 1 7 3239 1 1 7 TRP N N -1.755 -8.084 0.959 1.00 . A A . 7 TRP N 1 1 7 3240 1 1 7 TRP NE1 N -7.603 -7.642 0.376 1.00 . A A . 7 TRP NE1 1 1 7 3241 1 1 7 TRP O O -3.873 -9.729 -0.896 1.00 . A A . 7 TRP O 1 1 7 3242 1 1 8 ORN C C -1.359 -10.828 -3.059 1.00 . A A . 8 ORN C 1 1 7 3243 1 1 8 ORN CA C -1.958 -11.983 -2.272 1.00 . A A . 8 ORN CA 1 1 7 3244 1 1 8 ORN CB C -1.297 -12.060 -0.892 1.00 . A A . 8 ORN CB 1 1 7 3245 1 1 8 ORN CD C -3.409 -12.143 0.479 1.00 . A A . 8 ORN CD 1 1 7 3246 1 1 8 ORN CG C -2.097 -12.843 0.138 1.00 . A A . 8 ORN CG 1 1 7 3247 1 1 8 ORN H H -2.204 -14.042 -2.462 1.00 . A A . 8 ORN H 1 1 7 3248 1 1 8 ORN HA H -3.016 -11.808 -2.148 1.00 . A A . 8 ORN HA 1 1 7 3249 1 1 8 ORN HB2 H -1.161 -11.057 -0.518 1.00 . A A . 8 ORN HB2 1 1 7 3250 1 1 8 ORN HB3 H -0.332 -12.530 -0.995 1.00 . A A . 8 ORN HB3 1 1 7 3251 1 1 8 ORN HD2 H -3.922 -12.717 1.236 1.00 . A A . 8 ORN HD2 1 1 7 3252 1 1 8 ORN HD3 H -4.021 -12.099 -0.409 1.00 . A A . 8 ORN HD3 1 1 7 3253 1 1 8 ORN HE1 H -2.844 -10.678 1.883 1.00 . A A . 8 ORN HE1 1 1 7 3254 1 1 8 ORN HG2 H -1.508 -12.943 1.039 1.00 . A A . 8 ORN HG2 1 1 7 3255 1 1 8 ORN HG3 H -2.315 -13.824 -0.260 1.00 . A A . 8 ORN HG3 1 1 7 3256 1 1 8 ORN N N -1.782 -13.259 -2.999 1.00 . A A . 8 ORN N 1 1 7 3257 1 1 8 ORN NE N -3.201 -10.783 0.975 1.00 . A A . 8 ORN NE 1 1 7 3258 1 1 8 ORN O O -0.320 -10.972 -3.700 1.00 . A A . 8 ORN O 1 1 7 3259 1 1 9 CYS C C -0.269 -8.011 -2.922 1.00 . A A . 9 CYS C 1 1 7 3260 1 1 9 CYS CA C -1.535 -8.474 -3.638 1.00 . A A . 9 CYS CA 1 1 7 3261 1 1 9 CYS CB C -2.609 -7.388 -3.584 1.00 . A A . 9 CYS CB 1 1 7 3262 1 1 9 CYS H H -2.894 -9.660 -2.541 1.00 . A A . 9 CYS H 1 1 7 3263 1 1 9 CYS HA H -1.301 -8.694 -4.668 1.00 . A A . 9 CYS HA 1 1 7 3264 1 1 9 CYS HB2 H -3.427 -7.668 -4.229 1.00 . A A . 9 CYS HB2 1 1 7 3265 1 1 9 CYS HB3 H -2.970 -7.307 -2.572 1.00 . A A . 9 CYS HB3 1 1 7 3266 1 1 9 CYS N N -2.033 -9.689 -3.016 1.00 . A A . 9 CYS N 1 1 7 3267 1 1 9 CYS O O -0.313 -7.670 -1.739 1.00 . A A . 9 CYS O 1 1 7 3268 1 1 9 CYS SG S -2.046 -5.752 -4.095 1.00 . A A . 9 CYS SG 1 1 7 3269 1 1 10 GLY C C 2.856 -6.572 -3.745 1.00 . A A . 10 GLY C 1 1 7 3270 1 1 10 GLY CA C 2.121 -7.678 -3.023 1.00 . A A . 10 GLY CA 1 1 7 3271 1 1 10 GLY H H 0.819 -8.249 -4.586 1.00 . A A . 10 GLY H 1 1 7 3272 1 1 10 GLY HA2 H 1.945 -7.370 -2.004 1.00 . A A . 10 GLY HA2 1 1 7 3273 1 1 10 GLY HA3 H 2.743 -8.559 -3.015 1.00 . A A . 10 GLY HA3 1 1 7 3274 1 1 10 GLY N N 0.853 -8.014 -3.634 1.00 . A A . 10 GLY N 1 1 7 3275 1 1 10 GLY O O 4.051 -6.679 -4.012 1.00 . A A . 10 GLY O 1 1 7 3276 1 1 11 LYS C C 3.609 -3.600 -3.713 1.00 . A A . 11 LYS C 1 1 7 3277 1 1 11 LYS CA C 2.735 -4.352 -4.716 1.00 . A A . 11 LYS CA 1 1 7 3278 1 1 11 LYS CB C 1.631 -3.449 -5.270 1.00 . A A . 11 LYS CB 1 1 7 3279 1 1 11 LYS CD C 0.981 -1.607 -6.841 1.00 . A A . 11 LYS CD 1 1 7 3280 1 1 11 LYS CE C 1.454 -0.411 -7.649 1.00 . A A . 11 LYS CE 1 1 7 3281 1 1 11 LYS CG C 2.132 -2.300 -6.128 1.00 . A A . 11 LYS CG 1 1 7 3282 1 1 11 LYS H H 1.181 -5.509 -3.876 1.00 . A A . 11 LYS H 1 1 7 3283 1 1 11 LYS HA H 3.353 -4.700 -5.529 1.00 . A A . 11 LYS HA 1 1 7 3284 1 1 11 LYS HB2 H 0.961 -4.048 -5.869 1.00 . A A . 11 LYS HB2 1 1 7 3285 1 1 11 LYS HB3 H 1.077 -3.032 -4.441 1.00 . A A . 11 LYS HB3 1 1 7 3286 1 1 11 LYS HD2 H 0.512 -2.313 -7.507 1.00 . A A . 11 LYS HD2 1 1 7 3287 1 1 11 LYS HD3 H 0.264 -1.274 -6.107 1.00 . A A . 11 LYS HD3 1 1 7 3288 1 1 11 LYS HE2 H 1.941 0.288 -6.986 1.00 . A A . 11 LYS HE2 1 1 7 3289 1 1 11 LYS HE3 H 2.160 -0.752 -8.394 1.00 . A A . 11 LYS HE3 1 1 7 3290 1 1 11 LYS HG2 H 2.633 -1.584 -5.496 1.00 . A A . 11 LYS HG2 1 1 7 3291 1 1 11 LYS HG3 H 2.821 -2.684 -6.864 1.00 . A A . 11 LYS HG3 1 1 7 3292 1 1 11 LYS HZ1 H -0.101 -0.349 -9.046 1.00 . A A . 11 LYS HZ1 1 1 7 3293 1 1 11 LYS HZ2 H 0.657 1.142 -8.798 1.00 . A A . 11 LYS HZ2 1 1 7 3294 1 1 11 LYS HZ3 H -0.408 0.534 -7.635 1.00 . A A . 11 LYS HZ3 1 1 7 3295 1 1 11 LYS N N 2.138 -5.512 -4.072 1.00 . A A . 11 LYS N 1 1 7 3296 1 1 11 LYS NZ N 0.323 0.275 -8.329 1.00 . A A . 11 LYS NZ 1 1 7 3297 1 1 11 LYS O O 3.166 -3.300 -2.606 1.00 . A A . 11 LYS O 1 1 7 3298 1 1 12 ARG C C 6.021 -1.236 -3.486 1.00 . A A . 12 ARG C 1 1 7 3299 1 1 12 ARG CA C 5.796 -2.706 -3.164 1.00 . A A . 12 ARG CA 1 1 7 3300 1 1 12 ARG CB C 7.130 -3.461 -3.162 1.00 . A A . 12 ARG CB 1 1 7 3301 1 1 12 ARG CD C 9.242 -4.049 -4.391 1.00 . A A . 12 ARG CD 1 1 7 3302 1 1 12 ARG CG C 7.872 -3.400 -4.486 1.00 . A A . 12 ARG CG 1 1 7 3303 1 1 12 ARG CZ C 11.105 -4.592 -5.909 1.00 . A A . 12 ARG CZ 1 1 7 3304 1 1 12 ARG H H 5.131 -3.526 -5.005 1.00 . A A . 12 ARG H 1 1 7 3305 1 1 12 ARG HA H 5.365 -2.766 -2.180 1.00 . A A . 12 ARG HA 1 1 7 3306 1 1 12 ARG HB2 H 7.767 -3.040 -2.399 1.00 . A A . 12 ARG HB2 1 1 7 3307 1 1 12 ARG HB3 H 6.942 -4.498 -2.929 1.00 . A A . 12 ARG HB3 1 1 7 3308 1 1 12 ARG HD2 H 9.804 -3.569 -3.603 1.00 . A A . 12 ARG HD2 1 1 7 3309 1 1 12 ARG HD3 H 9.116 -5.096 -4.158 1.00 . A A . 12 ARG HD3 1 1 7 3310 1 1 12 ARG HE H 9.623 -3.316 -6.320 1.00 . A A . 12 ARG HE 1 1 7 3311 1 1 12 ARG HG2 H 7.292 -3.918 -5.235 1.00 . A A . 12 ARG HG2 1 1 7 3312 1 1 12 ARG HG3 H 7.990 -2.366 -4.772 1.00 . A A . 12 ARG HG3 1 1 7 3313 1 1 12 ARG HH11 H 11.178 -5.550 -4.123 1.00 . A A . 12 ARG HH11 1 1 7 3314 1 1 12 ARG HH12 H 12.471 -5.920 -5.220 1.00 . A A . 12 ARG HH12 1 1 7 3315 1 1 12 ARG HH21 H 12.555 -4.923 -7.285 1.00 . A A . 12 ARG HH21 1 1 7 3316 1 1 12 ARG HH22 H 11.321 -3.794 -7.758 1.00 . A A . 12 ARG HH22 1 1 7 3317 1 1 12 ARG N N 4.849 -3.323 -4.088 1.00 . A A . 12 ARG N 1 1 7 3318 1 1 12 ARG NE N 9.984 -3.929 -5.641 1.00 . A A . 12 ARG NE 1 1 7 3319 1 1 12 ARG NH1 N 11.627 -5.420 -5.012 1.00 . A A . 12 ARG NH1 1 1 7 3320 1 1 12 ARG NH2 N 11.708 -4.423 -7.079 1.00 . A A . 12 ARG NH2 1 1 7 3321 1 1 12 ARG O O 5.975 -0.824 -4.646 1.00 . A A . 12 ARG O 1 1 7 3322 1 1 13 PHE C C 7.647 1.471 -1.826 1.00 . A A . 13 PHE C 1 1 7 3323 1 1 13 PHE CA C 6.414 0.986 -2.574 1.00 . A A . 13 PHE CA 1 1 7 3324 1 1 13 PHE CB C 5.176 1.683 -2.018 1.00 . A A . 13 PHE CB 1 1 7 3325 1 1 13 PHE CD1 C 3.439 1.713 -3.813 1.00 . A A . 13 PHE CD1 1 1 7 3326 1 1 13 PHE CD2 C 3.179 0.183 -2.005 1.00 . A A . 13 PHE CD2 1 1 7 3327 1 1 13 PHE CE1 C 2.272 1.249 -4.375 1.00 . A A . 13 PHE CE1 1 1 7 3328 1 1 13 PHE CE2 C 2.012 -0.285 -2.562 1.00 . A A . 13 PHE CE2 1 1 7 3329 1 1 13 PHE CG C 3.904 1.186 -2.623 1.00 . A A . 13 PHE CG 1 1 7 3330 1 1 13 PHE CZ C 1.558 0.248 -3.747 1.00 . A A . 13 PHE CZ 1 1 7 3331 1 1 13 PHE H H 6.325 -0.855 -1.549 1.00 . A A . 13 PHE H 1 1 7 3332 1 1 13 PHE HA H 6.513 1.223 -3.621 1.00 . A A . 13 PHE HA 1 1 7 3333 1 1 13 PHE HB2 H 5.122 1.518 -0.953 1.00 . A A . 13 PHE HB2 1 1 7 3334 1 1 13 PHE HB3 H 5.248 2.741 -2.214 1.00 . A A . 13 PHE HB3 1 1 7 3335 1 1 13 PHE HD1 H 3.999 2.493 -4.302 1.00 . A A . 13 PHE HD1 1 1 7 3336 1 1 13 PHE HD2 H 3.540 -0.236 -1.077 1.00 . A A . 13 PHE HD2 1 1 7 3337 1 1 13 PHE HE1 H 1.918 1.666 -5.303 1.00 . A A . 13 PHE HE1 1 1 7 3338 1 1 13 PHE HE2 H 1.454 -1.069 -2.072 1.00 . A A . 13 PHE HE2 1 1 7 3339 1 1 13 PHE HZ H 0.642 -0.116 -4.183 1.00 . A A . 13 PHE HZ 1 1 7 3340 1 1 13 PHE N N 6.261 -0.452 -2.444 1.00 . A A . 13 PHE N 1 1 7 3341 1 1 13 PHE O O 8.126 0.812 -0.901 1.00 . A A . 13 PHE O 1 1 7 3342 1 1 14 THR C C 8.858 4.300 -0.570 1.00 . A A . 14 THR C 1 1 7 3343 1 1 14 THR CA C 9.299 3.228 -1.566 1.00 . A A . 14 THR CA 1 1 7 3344 1 1 14 THR CB C 10.259 3.846 -2.597 1.00 . A A . 14 THR CB 1 1 7 3345 1 1 14 THR CG2 C 11.174 2.790 -3.202 1.00 . A A . 14 THR CG2 1 1 7 3346 1 1 14 THR H H 7.759 3.081 -3.001 1.00 . A A . 14 THR H 1 1 7 3347 1 1 14 THR HA H 9.826 2.451 -1.033 1.00 . A A . 14 THR HA 1 1 7 3348 1 1 14 THR HB H 10.866 4.588 -2.099 1.00 . A A . 14 THR HB 1 1 7 3349 1 1 14 THR HG1 H 9.296 3.836 -4.320 1.00 . A A . 14 THR HG1 1 1 7 3350 1 1 14 THR HG21 H 11.775 2.343 -2.423 1.00 . A A . 14 THR HG21 1 1 7 3351 1 1 14 THR HG22 H 11.822 3.252 -3.934 1.00 . A A . 14 THR HG22 1 1 7 3352 1 1 14 THR HG23 H 10.578 2.028 -3.678 1.00 . A A . 14 THR HG23 1 1 7 3353 1 1 14 THR N N 8.156 2.625 -2.227 1.00 . A A . 14 THR N 1 1 7 3354 1 1 14 THR O O 9.684 4.913 0.109 1.00 . A A . 14 THR O 1 1 7 3355 1 1 14 THR OG1 O 9.503 4.483 -3.634 1.00 . A A . 14 THR OG1 1 1 7 3356 1 1 15 ARG C C 5.788 4.946 1.162 1.00 . A A . 15 ARG C 1 1 7 3357 1 1 15 ARG CA C 7.006 5.511 0.439 1.00 . A A . 15 ARG CA 1 1 7 3358 1 1 15 ARG CB C 6.599 6.797 -0.293 1.00 . A A . 15 ARG CB 1 1 7 3359 1 1 15 ARG CD C 7.359 8.847 -1.528 1.00 . A A . 15 ARG CD 1 1 7 3360 1 1 15 ARG CG C 7.690 7.409 -1.153 1.00 . A A . 15 ARG CG 1 1 7 3361 1 1 15 ARG CZ C 5.330 10.120 -2.131 1.00 . A A . 15 ARG CZ 1 1 7 3362 1 1 15 ARG H H 6.938 4.004 -1.048 1.00 . A A . 15 ARG H 1 1 7 3363 1 1 15 ARG HA H 7.770 5.741 1.167 1.00 . A A . 15 ARG HA 1 1 7 3364 1 1 15 ARG HB2 H 5.758 6.578 -0.930 1.00 . A A . 15 ARG HB2 1 1 7 3365 1 1 15 ARG HB3 H 6.297 7.531 0.439 1.00 . A A . 15 ARG HB3 1 1 7 3366 1 1 15 ARG HD2 H 7.403 9.457 -0.639 1.00 . A A . 15 ARG HD2 1 1 7 3367 1 1 15 ARG HD3 H 8.094 9.196 -2.235 1.00 . A A . 15 ARG HD3 1 1 7 3368 1 1 15 ARG HE H 5.637 8.185 -2.545 1.00 . A A . 15 ARG HE 1 1 7 3369 1 1 15 ARG HG2 H 8.620 7.392 -0.606 1.00 . A A . 15 ARG HG2 1 1 7 3370 1 1 15 ARG HG3 H 7.791 6.824 -2.057 1.00 . A A . 15 ARG HG3 1 1 7 3371 1 1 15 ARG HH11 H 6.772 11.218 -1.209 1.00 . A A . 15 ARG HH11 1 1 7 3372 1 1 15 ARG HH12 H 5.323 12.085 -1.619 1.00 . A A . 15 ARG HH12 1 1 7 3373 1 1 15 ARG HH21 H 3.710 9.326 -3.078 1.00 . A A . 15 ARG HH21 1 1 7 3374 1 1 15 ARG HH22 H 3.598 11.016 -2.673 1.00 . A A . 15 ARG HH22 1 1 7 3375 1 1 15 ARG N N 7.550 4.524 -0.485 1.00 . A A . 15 ARG N 1 1 7 3376 1 1 15 ARG NE N 6.029 8.982 -2.127 1.00 . A A . 15 ARG NE 1 1 7 3377 1 1 15 ARG NH1 N 5.850 11.229 -1.610 1.00 . A A . 15 ARG NH1 1 1 7 3378 1 1 15 ARG NH2 N 4.117 10.158 -2.667 1.00 . A A . 15 ARG NH2 1 1 7 3379 1 1 15 ARG O O 4.944 4.273 0.558 1.00 . A A . 15 ARG O 1 1 7 3380 1 1 16 SER C C 3.293 5.503 2.750 1.00 . A A . 16 SER C 1 1 7 3381 1 1 16 SER CA C 4.559 4.831 3.267 1.00 . A A . 16 SER CA 1 1 7 3382 1 1 16 SER CB C 4.787 5.197 4.742 1.00 . A A . 16 SER CB 1 1 7 3383 1 1 16 SER H H 6.433 5.737 2.884 1.00 . A A . 16 SER H 1 1 7 3384 1 1 16 SER HA H 4.449 3.760 3.180 1.00 . A A . 16 SER HA 1 1 7 3385 1 1 16 SER HB2 H 5.651 4.666 5.111 1.00 . A A . 16 SER HB2 1 1 7 3386 1 1 16 SER HB3 H 4.955 6.260 4.826 1.00 . A A . 16 SER HB3 1 1 7 3387 1 1 16 SER HG H 3.421 3.931 5.361 1.00 . A A . 16 SER HG 1 1 7 3388 1 1 16 SER N N 5.703 5.232 2.457 1.00 . A A . 16 SER N 1 1 7 3389 1 1 16 SER O O 2.206 4.934 2.819 1.00 . A A . 16 SER O 1 1 7 3390 1 1 16 SER OG O 3.667 4.849 5.539 1.00 . A A . 16 SER OG 1 1 7 3391 1 1 17 ASP C C 1.730 6.658 0.498 1.00 . A A . 17 ASP C 1 1 7 3392 1 1 17 ASP CA C 2.342 7.455 1.636 1.00 . A A . 17 ASP CA 1 1 7 3393 1 1 17 ASP CB C 2.819 8.811 1.110 1.00 . A A . 17 ASP CB 1 1 7 3394 1 1 17 ASP CG C 3.459 9.664 2.183 1.00 . A A . 17 ASP CG 1 1 7 3395 1 1 17 ASP H H 4.336 7.139 2.263 1.00 . A A . 17 ASP H 1 1 7 3396 1 1 17 ASP HA H 1.593 7.610 2.397 1.00 . A A . 17 ASP HA 1 1 7 3397 1 1 17 ASP HB2 H 3.541 8.652 0.327 1.00 . A A . 17 ASP HB2 1 1 7 3398 1 1 17 ASP HB3 H 1.975 9.347 0.708 1.00 . A A . 17 ASP HB3 1 1 7 3399 1 1 17 ASP N N 3.450 6.719 2.230 1.00 . A A . 17 ASP N 1 1 7 3400 1 1 17 ASP O O 0.510 6.540 0.390 1.00 . A A . 17 ASP O 1 1 7 3401 1 1 17 ASP OD1 O 2.769 10.545 2.740 1.00 . A A . 17 ASP OD1 1 1 7 3402 1 1 17 ASP OD2 O 4.654 9.459 2.477 1.00 . A A . 17 ASP OD2 1 1 7 3403 1 1 18 GLU C C 1.411 4.062 -1.012 1.00 . A A . 18 GLU C 1 1 7 3404 1 1 18 GLU CA C 2.157 5.301 -1.471 1.00 . A A . 18 GLU CA 1 1 7 3405 1 1 18 GLU CB C 3.352 4.900 -2.330 1.00 . A A . 18 GLU CB 1 1 7 3406 1 1 18 GLU CD C 3.111 6.807 -3.958 1.00 . A A . 18 GLU CD 1 1 7 3407 1 1 18 GLU CG C 4.033 6.068 -3.015 1.00 . A A . 18 GLU CG 1 1 7 3408 1 1 18 GLU H H 3.549 6.174 -0.153 1.00 . A A . 18 GLU H 1 1 7 3409 1 1 18 GLU HA H 1.492 5.913 -2.058 1.00 . A A . 18 GLU HA 1 1 7 3410 1 1 18 GLU HB2 H 4.079 4.409 -1.702 1.00 . A A . 18 GLU HB2 1 1 7 3411 1 1 18 GLU HB3 H 3.019 4.210 -3.090 1.00 . A A . 18 GLU HB3 1 1 7 3412 1 1 18 GLU HG2 H 4.375 6.761 -2.261 1.00 . A A . 18 GLU HG2 1 1 7 3413 1 1 18 GLU HG3 H 4.877 5.695 -3.574 1.00 . A A . 18 GLU HG3 1 1 7 3414 1 1 18 GLU N N 2.593 6.084 -0.329 1.00 . A A . 18 GLU N 1 1 7 3415 1 1 18 GLU O O 0.355 3.733 -1.545 1.00 . A A . 18 GLU O 1 1 7 3416 1 1 18 GLU OE1 O 2.884 8.019 -3.758 1.00 . A A . 18 GLU OE1 1 1 7 3417 1 1 18 GLU OE2 O 2.598 6.172 -4.898 1.00 . A A . 18 GLU OE2 1 1 7 3418 1 1 19 LEU C C -0.025 2.506 1.149 1.00 . A A . 19 LEU C 1 1 7 3419 1 1 19 LEU CA C 1.330 2.183 0.525 1.00 . A A . 19 LEU CA 1 1 7 3420 1 1 19 LEU CB C 2.238 1.500 1.551 1.00 . A A . 19 LEU CB 1 1 7 3421 1 1 19 LEU CD1 C 1.347 -0.818 1.129 1.00 . A A . 19 LEU CD1 1 1 7 3422 1 1 19 LEU CD2 C 2.612 -0.330 3.226 1.00 . A A . 19 LEU CD2 1 1 7 3423 1 1 19 LEU CG C 1.655 0.232 2.188 1.00 . A A . 19 LEU CG 1 1 7 3424 1 1 19 LEU H H 2.801 3.704 0.387 1.00 . A A . 19 LEU H 1 1 7 3425 1 1 19 LEU HA H 1.171 1.510 -0.303 1.00 . A A . 19 LEU HA 1 1 7 3426 1 1 19 LEU HB2 H 3.169 1.243 1.063 1.00 . A A . 19 LEU HB2 1 1 7 3427 1 1 19 LEU HB3 H 2.449 2.205 2.339 1.00 . A A . 19 LEU HB3 1 1 7 3428 1 1 19 LEU HD11 H 2.250 -1.064 0.590 1.00 . A A . 19 LEU HD11 1 1 7 3429 1 1 19 LEU HD12 H 0.611 -0.429 0.439 1.00 . A A . 19 LEU HD12 1 1 7 3430 1 1 19 LEU HD13 H 0.959 -1.706 1.604 1.00 . A A . 19 LEU HD13 1 1 7 3431 1 1 19 LEU HD21 H 3.501 -0.695 2.735 1.00 . A A . 19 LEU HD21 1 1 7 3432 1 1 19 LEU HD22 H 2.133 -1.140 3.756 1.00 . A A . 19 LEU HD22 1 1 7 3433 1 1 19 LEU HD23 H 2.882 0.448 3.924 1.00 . A A . 19 LEU HD23 1 1 7 3434 1 1 19 LEU HG H 0.729 0.484 2.686 1.00 . A A . 19 LEU HG 1 1 7 3435 1 1 19 LEU N N 1.956 3.387 -0.005 1.00 . A A . 19 LEU N 1 1 7 3436 1 1 19 LEU O O -0.976 1.748 0.994 1.00 . A A . 19 LEU O 1 1 7 3437 1 1 20 GLN C C -2.412 4.325 1.354 1.00 . A A . 20 GLN C 1 1 7 3438 1 1 20 GLN CA C -1.370 4.074 2.441 1.00 . A A . 20 GLN CA 1 1 7 3439 1 1 20 GLN CB C -1.168 5.346 3.271 1.00 . A A . 20 GLN CB 1 1 7 3440 1 1 20 GLN CD C -2.272 7.221 4.582 1.00 . A A . 20 GLN CD 1 1 7 3441 1 1 20 GLN CG C -2.465 5.917 3.831 1.00 . A A . 20 GLN CG 1 1 7 3442 1 1 20 GLN H H 0.698 4.183 1.975 1.00 . A A . 20 GLN H 1 1 7 3443 1 1 20 GLN HA H -1.721 3.285 3.086 1.00 . A A . 20 GLN HA 1 1 7 3444 1 1 20 GLN HB2 H -0.512 5.122 4.097 1.00 . A A . 20 GLN HB2 1 1 7 3445 1 1 20 GLN HB3 H -0.705 6.100 2.650 1.00 . A A . 20 GLN HB3 1 1 7 3446 1 1 20 GLN HE21 H -0.739 7.714 3.421 1.00 . A A . 20 GLN HE21 1 1 7 3447 1 1 20 GLN HE22 H -1.145 8.856 4.653 1.00 . A A . 20 GLN HE22 1 1 7 3448 1 1 20 GLN HG2 H -3.146 6.093 3.012 1.00 . A A . 20 GLN HG2 1 1 7 3449 1 1 20 GLN HG3 H -2.897 5.191 4.505 1.00 . A A . 20 GLN HG3 1 1 7 3450 1 1 20 GLN N N -0.109 3.637 1.848 1.00 . A A . 20 GLN N 1 1 7 3451 1 1 20 GLN NE2 N -1.288 8.007 4.177 1.00 . A A . 20 GLN NE2 1 1 7 3452 1 1 20 GLN O O -3.546 3.836 1.430 1.00 . A A . 20 GLN O 1 1 7 3453 1 1 20 GLN OE1 O -3.013 7.525 5.517 1.00 . A A . 20 GLN OE1 1 1 7 3454 1 1 21 ARG C C -3.339 4.090 -1.454 1.00 . A A . 21 ARG C 1 1 7 3455 1 1 21 ARG CA C -2.892 5.380 -0.786 1.00 . A A . 21 ARG CA 1 1 7 3456 1 1 21 ARG CB C -2.182 6.274 -1.804 1.00 . A A . 21 ARG CB 1 1 7 3457 1 1 21 ARG CD C -0.916 8.390 -2.245 1.00 . A A . 21 ARG CD 1 1 7 3458 1 1 21 ARG CG C -1.808 7.646 -1.267 1.00 . A A . 21 ARG CG 1 1 7 3459 1 1 21 ARG CZ C 0.340 10.510 -2.364 1.00 . A A . 21 ARG CZ 1 1 7 3460 1 1 21 ARG H H -1.093 5.433 0.339 1.00 . A A . 21 ARG H 1 1 7 3461 1 1 21 ARG HA H -3.759 5.896 -0.404 1.00 . A A . 21 ARG HA 1 1 7 3462 1 1 21 ARG HB2 H -1.280 5.781 -2.127 1.00 . A A . 21 ARG HB2 1 1 7 3463 1 1 21 ARG HB3 H -2.833 6.410 -2.656 1.00 . A A . 21 ARG HB3 1 1 7 3464 1 1 21 ARG HD2 H -0.043 7.788 -2.447 1.00 . A A . 21 ARG HD2 1 1 7 3465 1 1 21 ARG HD3 H -1.462 8.548 -3.162 1.00 . A A . 21 ARG HD3 1 1 7 3466 1 1 21 ARG HE H -0.831 9.951 -0.836 1.00 . A A . 21 ARG HE 1 1 7 3467 1 1 21 ARG HG2 H -2.709 8.219 -1.108 1.00 . A A . 21 ARG HG2 1 1 7 3468 1 1 21 ARG HG3 H -1.283 7.528 -0.330 1.00 . A A . 21 ARG HG3 1 1 7 3469 1 1 21 ARG HH11 H 0.584 9.291 -3.971 1.00 . A A . 21 ARG HH11 1 1 7 3470 1 1 21 ARG HH12 H 1.448 10.795 -4.042 1.00 . A A . 21 ARG HH12 1 1 7 3471 1 1 21 ARG HH21 H 0.315 11.926 -0.913 1.00 . A A . 21 ARG HH21 1 1 7 3472 1 1 21 ARG HH22 H 1.301 12.296 -2.296 1.00 . A A . 21 ARG HH22 1 1 7 3473 1 1 21 ARG N N -2.012 5.079 0.337 1.00 . A A . 21 ARG N 1 1 7 3474 1 1 21 ARG NE N -0.485 9.685 -1.721 1.00 . A A . 21 ARG NE 1 1 7 3475 1 1 21 ARG NH1 N 0.830 10.172 -3.552 1.00 . A A . 21 ARG NH1 1 1 7 3476 1 1 21 ARG NH2 N 0.678 11.670 -1.815 1.00 . A A . 21 ARG NH2 1 1 7 3477 1 1 21 ARG O O -4.518 3.902 -1.747 1.00 . A A . 21 ARG O 1 1 7 3478 1 1 22 HIS C C -3.631 1.095 -1.404 1.00 . A A . 22 HIS C 1 1 7 3479 1 1 22 HIS CA C -2.664 1.906 -2.267 1.00 . A A . 22 HIS CA 1 1 7 3480 1 1 22 HIS CB C -1.357 1.139 -2.480 1.00 . A A . 22 HIS CB 1 1 7 3481 1 1 22 HIS CD2 C -1.809 -1.367 -2.144 1.00 . A A . 22 HIS CD2 1 1 7 3482 1 1 22 HIS CE1 C -1.924 -2.010 -4.221 1.00 . A A . 22 HIS CE1 1 1 7 3483 1 1 22 HIS CG C -1.571 -0.275 -2.905 1.00 . A A . 22 HIS CG 1 1 7 3484 1 1 22 HIS H H -1.462 3.409 -1.408 1.00 . A A . 22 HIS H 1 1 7 3485 1 1 22 HIS HA H -3.123 2.085 -3.225 1.00 . A A . 22 HIS HA 1 1 7 3486 1 1 22 HIS HB2 H -0.775 1.634 -3.241 1.00 . A A . 22 HIS HB2 1 1 7 3487 1 1 22 HIS HB3 H -0.799 1.128 -1.554 1.00 . A A . 22 HIS HB3 1 1 7 3488 1 1 22 HIS HD1 H -1.496 -0.139 -5.027 1.00 . A A . 22 HIS HD1 1 1 7 3489 1 1 22 HIS HD2 H -1.802 -1.412 -1.065 1.00 . A A . 22 HIS HD2 1 1 7 3490 1 1 22 HIS HE1 H -2.042 -2.627 -5.098 1.00 . A A . 22 HIS HE1 1 1 7 3491 1 1 22 HIS N N -2.387 3.194 -1.665 1.00 . A A . 22 HIS N 1 1 7 3492 1 1 22 HIS ND1 N -1.637 -0.697 -4.229 1.00 . A A . 22 HIS ND1 1 1 7 3493 1 1 22 HIS NE2 N -2.032 -2.427 -2.984 1.00 . A A . 22 HIS NE2 1 1 7 3494 1 1 22 HIS O O -4.553 0.469 -1.920 1.00 . A A . 22 HIS O 1 1 7 3495 1 1 23 LYS C C -5.739 0.828 0.667 1.00 . A A . 23 LYS C 1 1 7 3496 1 1 23 LYS CA C -4.288 0.408 0.847 1.00 . A A . 23 LYS CA 1 1 7 3497 1 1 23 LYS CB C -3.855 0.676 2.289 1.00 . A A . 23 LYS CB 1 1 7 3498 1 1 23 LYS CD C -3.204 -1.560 3.282 1.00 . A A . 23 LYS CD 1 1 7 3499 1 1 23 LYS CE C -4.177 -1.411 4.446 1.00 . A A . 23 LYS CE 1 1 7 3500 1 1 23 LYS CG C -2.713 -0.204 2.780 1.00 . A A . 23 LYS CG 1 1 7 3501 1 1 23 LYS H H -2.636 1.601 0.257 1.00 . A A . 23 LYS H 1 1 7 3502 1 1 23 LYS HA H -4.206 -0.648 0.646 1.00 . A A . 23 LYS HA 1 1 7 3503 1 1 23 LYS HB2 H -3.540 1.706 2.366 1.00 . A A . 23 LYS HB2 1 1 7 3504 1 1 23 LYS HB3 H -4.703 0.521 2.936 1.00 . A A . 23 LYS HB3 1 1 7 3505 1 1 23 LYS HD2 H -3.700 -2.076 2.476 1.00 . A A . 23 LYS HD2 1 1 7 3506 1 1 23 LYS HD3 H -2.353 -2.138 3.610 1.00 . A A . 23 LYS HD3 1 1 7 3507 1 1 23 LYS HE2 H -3.757 -0.724 5.162 1.00 . A A . 23 LYS HE2 1 1 7 3508 1 1 23 LYS HE3 H -5.108 -1.011 4.070 1.00 . A A . 23 LYS HE3 1 1 7 3509 1 1 23 LYS HG2 H -2.024 -0.366 1.965 1.00 . A A . 23 LYS HG2 1 1 7 3510 1 1 23 LYS HG3 H -2.204 0.304 3.585 1.00 . A A . 23 LYS HG3 1 1 7 3511 1 1 23 LYS HZ1 H -3.573 -3.085 5.538 1.00 . A A . 23 LYS HZ1 1 1 7 3512 1 1 23 LYS HZ2 H -4.832 -3.396 4.455 1.00 . A A . 23 LYS HZ2 1 1 7 3513 1 1 23 LYS HZ3 H -5.144 -2.565 5.894 1.00 . A A . 23 LYS HZ3 1 1 7 3514 1 1 23 LYS N N -3.415 1.109 -0.093 1.00 . A A . 23 LYS N 1 1 7 3515 1 1 23 LYS NZ N -4.451 -2.705 5.128 1.00 . A A . 23 LYS NZ 1 1 7 3516 1 1 23 LYS O O -6.655 0.035 0.904 1.00 . A A . 23 LYS O 1 1 7 3517 1 1 24 ARG C C -8.032 1.780 -1.059 1.00 . A A . 24 ARG C 1 1 7 3518 1 1 24 ARG CA C -7.292 2.583 0.007 1.00 . A A . 24 ARG CA 1 1 7 3519 1 1 24 ARG CB C -7.254 4.055 -0.398 1.00 . A A . 24 ARG CB 1 1 7 3520 1 1 24 ARG CD C -6.818 6.435 0.248 1.00 . A A . 24 ARG CD 1 1 7 3521 1 1 24 ARG CG C -6.782 4.986 0.703 1.00 . A A . 24 ARG CG 1 1 7 3522 1 1 24 ARG CZ C -6.266 8.664 1.140 1.00 . A A . 24 ARG CZ 1 1 7 3523 1 1 24 ARG H H -5.169 2.653 0.059 1.00 . A A . 24 ARG H 1 1 7 3524 1 1 24 ARG HA H -7.831 2.495 0.938 1.00 . A A . 24 ARG HA 1 1 7 3525 1 1 24 ARG HB2 H -6.589 4.166 -1.241 1.00 . A A . 24 ARG HB2 1 1 7 3526 1 1 24 ARG HB3 H -8.248 4.358 -0.694 1.00 . A A . 24 ARG HB3 1 1 7 3527 1 1 24 ARG HD2 H -6.164 6.551 -0.602 1.00 . A A . 24 ARG HD2 1 1 7 3528 1 1 24 ARG HD3 H -7.829 6.683 -0.041 1.00 . A A . 24 ARG HD3 1 1 7 3529 1 1 24 ARG HE H -6.197 6.960 2.185 1.00 . A A . 24 ARG HE 1 1 7 3530 1 1 24 ARG HG2 H -7.427 4.871 1.562 1.00 . A A . 24 ARG HG2 1 1 7 3531 1 1 24 ARG HG3 H -5.770 4.726 0.974 1.00 . A A . 24 ARG HG3 1 1 7 3532 1 1 24 ARG HH11 H -6.417 10.207 -0.167 1.00 . A A . 24 ARG HH11 1 1 7 3533 1 1 24 ARG HH12 H -6.794 8.646 -0.819 1.00 . A A . 24 ARG HH12 1 1 7 3534 1 1 24 ARG HH21 H -5.797 10.418 2.037 1.00 . A A . 24 ARG HH21 1 1 7 3535 1 1 24 ARG HH22 H -5.711 9.016 3.058 1.00 . A A . 24 ARG HH22 1 1 7 3536 1 1 24 ARG N N -5.945 2.068 0.232 1.00 . A A . 24 ARG N 1 1 7 3537 1 1 24 ARG NE N -6.391 7.351 1.302 1.00 . A A . 24 ARG NE 1 1 7 3538 1 1 24 ARG NH1 N -6.511 9.216 -0.043 1.00 . A A . 24 ARG NH1 1 1 7 3539 1 1 24 ARG NH2 N -5.894 9.427 2.158 1.00 . A A . 24 ARG NH2 1 1 7 3540 1 1 24 ARG O O -9.260 1.775 -1.092 1.00 . A A . 24 ARG O 1 1 7 3541 1 1 25 THR C C -8.540 -0.959 -2.376 1.00 . A A . 25 THR C 1 1 7 3542 1 1 25 THR CA C -7.908 0.293 -2.974 1.00 . A A . 25 THR CA 1 1 7 3543 1 1 25 THR CB C -6.903 -0.119 -4.075 1.00 . A A . 25 THR CB 1 1 7 3544 1 1 25 THR CG2 C -6.218 1.101 -4.678 1.00 . A A . 25 THR CG2 1 1 7 3545 1 1 25 THR H H -6.310 1.135 -1.864 1.00 . A A . 25 THR H 1 1 7 3546 1 1 25 THR HA H -8.685 0.889 -3.429 1.00 . A A . 25 THR HA 1 1 7 3547 1 1 25 THR HB H -7.445 -0.627 -4.858 1.00 . A A . 25 THR HB 1 1 7 3548 1 1 25 THR HG1 H -5.248 -0.501 -3.056 1.00 . A A . 25 THR HG1 1 1 7 3549 1 1 25 THR HG21 H -5.666 1.620 -3.909 1.00 . A A . 25 THR HG21 1 1 7 3550 1 1 25 THR HG22 H -6.962 1.763 -5.095 1.00 . A A . 25 THR HG22 1 1 7 3551 1 1 25 THR HG23 H -5.539 0.784 -5.456 1.00 . A A . 25 THR HG23 1 1 7 3552 1 1 25 THR N N -7.290 1.096 -1.929 1.00 . A A . 25 THR N 1 1 7 3553 1 1 25 THR O O -9.516 -1.491 -2.907 1.00 . A A . 25 THR O 1 1 7 3554 1 1 25 THR OG1 O -5.911 -1.010 -3.546 1.00 . A A . 25 THR OG1 1 1 7 3555 1 1 26 HIS C C -9.513 -2.192 0.493 1.00 . A A . 26 HIS C 1 1 7 3556 1 1 26 HIS CA C -8.499 -2.594 -0.573 1.00 . A A . 26 HIS CA 1 1 7 3557 1 1 26 HIS CB C -7.370 -3.382 0.097 1.00 . A A . 26 HIS CB 1 1 7 3558 1 1 26 HIS CD2 C -4.986 -3.563 -0.886 1.00 . A A . 26 HIS CD2 1 1 7 3559 1 1 26 HIS CE1 C -5.329 -5.075 -2.417 1.00 . A A . 26 HIS CE1 1 1 7 3560 1 1 26 HIS CG C -6.306 -3.881 -0.832 1.00 . A A . 26 HIS CG 1 1 7 3561 1 1 26 HIS H H -7.200 -0.952 -0.890 1.00 . A A . 26 HIS H 1 1 7 3562 1 1 26 HIS HA H -8.985 -3.222 -1.302 1.00 . A A . 26 HIS HA 1 1 7 3563 1 1 26 HIS HB2 H -6.891 -2.748 0.829 1.00 . A A . 26 HIS HB2 1 1 7 3564 1 1 26 HIS HB3 H -7.795 -4.237 0.602 1.00 . A A . 26 HIS HB3 1 1 7 3565 1 1 26 HIS HD1 H -7.364 -5.289 -2.025 1.00 . A A . 26 HIS HD1 1 1 7 3566 1 1 26 HIS HD2 H -4.471 -2.851 -0.259 1.00 . A A . 26 HIS HD2 1 1 7 3567 1 1 26 HIS HE1 H -5.166 -5.780 -3.219 1.00 . A A . 26 HIS HE1 1 1 7 3568 1 1 26 HIS N N -7.983 -1.417 -1.258 1.00 . A A . 26 HIS N 1 1 7 3569 1 1 26 HIS ND1 N -6.511 -4.844 -1.816 1.00 . A A . 26 HIS ND1 1 1 7 3570 1 1 26 HIS NE2 N -4.405 -4.323 -1.879 1.00 . A A . 26 HIS NE2 1 1 7 3571 1 1 26 HIS O O -10.490 -2.896 0.737 1.00 . A A . 26 HIS O 1 1 7 3572 1 1 27 THR C C -11.053 0.504 1.804 1.00 . A A . 27 THR C 1 1 7 3573 1 1 27 THR CA C -10.094 -0.601 2.231 1.00 . A A . 27 THR CA 1 1 7 3574 1 1 27 THR CB C -9.216 -0.114 3.398 1.00 . A A . 27 THR CB 1 1 7 3575 1 1 27 THR CG2 C -8.526 -1.288 4.079 1.00 . A A . 27 THR CG2 1 1 7 3576 1 1 27 THR H H -8.525 -0.491 0.822 1.00 . A A . 27 THR H 1 1 7 3577 1 1 27 THR HA H -10.673 -1.446 2.576 1.00 . A A . 27 THR HA 1 1 7 3578 1 1 27 THR HB H -9.847 0.382 4.118 1.00 . A A . 27 THR HB 1 1 7 3579 1 1 27 THR HG1 H -7.688 0.388 2.244 1.00 . A A . 27 THR HG1 1 1 7 3580 1 1 27 THR HG21 H -7.879 -0.922 4.862 1.00 . A A . 27 THR HG21 1 1 7 3581 1 1 27 THR HG22 H -7.941 -1.831 3.351 1.00 . A A . 27 THR HG22 1 1 7 3582 1 1 27 THR HG23 H -9.270 -1.946 4.506 1.00 . A A . 27 THR HG23 1 1 7 3583 1 1 27 THR N N -9.273 -1.050 1.119 1.00 . A A . 27 THR N 1 1 7 3584 1 1 27 THR O O -11.366 1.411 2.577 1.00 . A A . 27 THR O 1 1 7 3585 1 1 27 THR OG1 O -8.231 0.814 2.921 1.00 . A A . 27 THR OG1 1 1 7 3586 1 1 28 GLY C C -13.903 0.860 0.253 1.00 . A A . 28 GLY C 1 1 7 3587 1 1 28 GLY CA C -12.490 1.367 0.073 1.00 . A A . 28 GLY CA 1 1 7 3588 1 1 28 GLY H H -11.217 -0.318 -0.005 1.00 . A A . 28 GLY H 1 1 7 3589 1 1 28 GLY HA2 H -12.376 2.297 0.609 1.00 . A A . 28 GLY HA2 1 1 7 3590 1 1 28 GLY HA3 H -12.308 1.539 -0.977 1.00 . A A . 28 GLY HA3 1 1 7 3591 1 1 28 GLY N N -11.524 0.413 0.573 1.00 . A A . 28 GLY N 1 1 7 3592 1 1 28 GLY O O -14.784 1.133 -0.562 1.00 . A A . 28 GLY O 1 1 7 3593 1 1 29 GLU C C -15.914 0.049 2.961 1.00 . A A . 29 GLU C 1 1 7 3594 1 1 29 GLU CA C -15.399 -0.484 1.625 1.00 . A A . 29 GLU CA 1 1 7 3595 1 1 29 GLU CB C -15.262 -2.011 1.661 1.00 . A A . 29 GLU CB 1 1 7 3596 1 1 29 GLU CD C -16.400 -4.257 1.674 1.00 . A A . 29 GLU CD 1 1 7 3597 1 1 29 GLU CG C -16.585 -2.757 1.654 1.00 . A A . 29 GLU CG 1 1 7 3598 1 1 29 GLU H H -13.364 -0.038 1.946 1.00 . A A . 29 GLU H 1 1 7 3599 1 1 29 GLU HA H -16.089 -0.203 0.843 1.00 . A A . 29 GLU HA 1 1 7 3600 1 1 29 GLU HB2 H -14.691 -2.329 0.800 1.00 . A A . 29 GLU HB2 1 1 7 3601 1 1 29 GLU HB3 H -14.725 -2.289 2.557 1.00 . A A . 29 GLU HB3 1 1 7 3602 1 1 29 GLU HG2 H -17.151 -2.466 2.526 1.00 . A A . 29 GLU HG2 1 1 7 3603 1 1 29 GLU HG3 H -17.133 -2.487 0.764 1.00 . A A . 29 GLU HG3 1 1 7 3604 1 1 29 GLU N N -14.109 0.114 1.327 1.00 . A A . 29 GLU N 1 1 7 3605 1 1 29 GLU O O -16.757 -0.562 3.620 1.00 . A A . 29 GLU O 1 1 7 3606 1 1 29 GLU OE1 O -16.314 -4.836 2.780 1.00 . A A . 29 GLU OE1 1 1 7 3607 1 1 29 GLU OE2 O -16.345 -4.869 0.589 1.00 . A A . 29 GLU OE2 1 1 7 3608 1 1 30 LYS C C -16.623 3.060 4.335 1.00 . A A . 30 LYS C 1 1 7 3609 1 1 30 LYS CA C -15.785 1.818 4.609 1.00 . A A . 30 LYS CA 1 1 7 3610 1 1 30 LYS CB C -14.549 2.187 5.434 1.00 . A A . 30 LYS CB 1 1 7 3611 1 1 30 LYS CD C -13.643 3.131 7.582 1.00 . A A . 30 LYS CD 1 1 7 3612 1 1 30 LYS CE C -13.978 3.532 9.010 1.00 . A A . 30 LYS CE 1 1 7 3613 1 1 30 LYS CG C -14.882 2.675 6.834 1.00 . A A . 30 LYS CG 1 1 7 3614 1 1 30 LYS H H -14.733 1.644 2.787 1.00 . A A . 30 LYS H 1 1 7 3615 1 1 30 LYS HA H -16.382 1.108 5.162 1.00 . A A . 30 LYS HA 1 1 7 3616 1 1 30 LYS HB2 H -13.912 1.318 5.521 1.00 . A A . 30 LYS HB2 1 1 7 3617 1 1 30 LYS HB3 H -14.008 2.969 4.921 1.00 . A A . 30 LYS HB3 1 1 7 3618 1 1 30 LYS HD2 H -12.928 2.323 7.604 1.00 . A A . 30 LYS HD2 1 1 7 3619 1 1 30 LYS HD3 H -13.215 3.981 7.070 1.00 . A A . 30 LYS HD3 1 1 7 3620 1 1 30 LYS HE2 H -14.361 2.668 9.530 1.00 . A A . 30 LYS HE2 1 1 7 3621 1 1 30 LYS HE3 H -13.077 3.872 9.495 1.00 . A A . 30 LYS HE3 1 1 7 3622 1 1 30 LYS HG2 H -15.569 3.504 6.758 1.00 . A A . 30 LYS HG2 1 1 7 3623 1 1 30 LYS HG3 H -15.346 1.869 7.382 1.00 . A A . 30 LYS HG3 1 1 7 3624 1 1 30 LYS HZ1 H -15.855 4.332 8.558 1.00 . A A . 30 LYS HZ1 1 1 7 3625 1 1 30 LYS HZ2 H -14.621 5.484 8.631 1.00 . A A . 30 LYS HZ2 1 1 7 3626 1 1 30 LYS HZ3 H -15.243 4.821 10.056 1.00 . A A . 30 LYS HZ3 1 1 7 3627 1 1 30 LYS N N -15.394 1.197 3.357 1.00 . A A . 30 LYS N 1 1 7 3628 1 1 30 LYS NZ N -14.995 4.616 9.067 1.00 . A A . 30 LYS NZ 1 1 7 3629 1 1 30 LYS O O -16.092 4.153 4.138 1.00 . A A . 30 LYS O 1 1 7 3630 1 1 31 NH2 HN1 H -18.286 1.987 4.464 1.00 . A A . 31 NH2 HN1 1 1 7 3631 1 1 31 NH2 HN2 H -18.497 3.665 4.117 1.00 . A A . 31 NH2 HN2 1 1 7 3632 1 1 31 NH2 N N -17.931 2.887 4.301 1.00 . A A . 31 NH2 N 1 1 7 3633 2 2 1 ZN ZN ZN -2.476 -4.271 -2.392 1.00 . B A . 101 ZN ZN 1 1 8 3634 1 1 1 ARG C C 11.798 -1.461 2.721 1.00 . A A . 1 ARG C 1 1 8 3635 1 1 1 ARG CA C 12.806 -2.200 3.594 1.00 . A A . 1 ARG CA 1 1 8 3636 1 1 1 ARG CB C 12.113 -2.690 4.874 1.00 . A A . 1 ARG CB 1 1 8 3637 1 1 1 ARG CD C 10.628 -2.118 6.834 1.00 . A A . 1 ARG CD 1 1 8 3638 1 1 1 ARG CG C 11.492 -1.573 5.705 1.00 . A A . 1 ARG CG 1 1 8 3639 1 1 1 ARG CZ C 8.735 -1.127 8.081 1.00 . A A . 1 ARG CZ 1 1 8 3640 1 1 1 ARG H1 H 14.438 -1.031 3.055 1.00 . A A . 1 ARG H1 1 1 8 3641 1 1 1 ARG H2 H 14.614 -1.805 4.545 1.00 . A A . 1 ARG H2 1 1 8 3642 1 1 1 ARG H3 H 13.601 -0.459 4.405 1.00 . A A . 1 ARG H3 1 1 8 3643 1 1 1 ARG HA H 13.187 -3.050 3.047 1.00 . A A . 1 ARG HA 1 1 8 3644 1 1 1 ARG HB2 H 11.331 -3.383 4.603 1.00 . A A . 1 ARG HB2 1 1 8 3645 1 1 1 ARG HB3 H 12.839 -3.205 5.488 1.00 . A A . 1 ARG HB3 1 1 8 3646 1 1 1 ARG HD2 H 9.875 -2.771 6.418 1.00 . A A . 1 ARG HD2 1 1 8 3647 1 1 1 ARG HD3 H 11.254 -2.679 7.511 1.00 . A A . 1 ARG HD3 1 1 8 3648 1 1 1 ARG HE H 10.479 -0.215 7.714 1.00 . A A . 1 ARG HE 1 1 8 3649 1 1 1 ARG HG2 H 12.284 -0.977 6.133 1.00 . A A . 1 ARG HG2 1 1 8 3650 1 1 1 ARG HG3 H 10.883 -0.954 5.060 1.00 . A A . 1 ARG HG3 1 1 8 3651 1 1 1 ARG HH11 H 7.078 -2.275 8.288 1.00 . A A . 1 ARG HH11 1 1 8 3652 1 1 1 ARG HH12 H 8.368 -2.996 7.381 1.00 . A A . 1 ARG HH12 1 1 8 3653 1 1 1 ARG HH21 H 8.768 0.733 8.888 1.00 . A A . 1 ARG HH21 1 1 8 3654 1 1 1 ARG HH22 H 7.301 -0.162 9.136 1.00 . A A . 1 ARG HH22 1 1 8 3655 1 1 1 ARG N N 13.942 -1.314 3.925 1.00 . A A . 1 ARG N 1 1 8 3656 1 1 1 ARG NE N 9.969 -1.045 7.579 1.00 . A A . 1 ARG NE 1 1 8 3657 1 1 1 ARG NH1 N 8.004 -2.222 7.904 1.00 . A A . 1 ARG NH1 1 1 8 3658 1 1 1 ARG NH2 N 8.227 -0.104 8.755 1.00 . A A . 1 ARG NH2 1 1 8 3659 1 1 1 ARG O O 11.504 -0.291 2.964 1.00 . A A . 1 ARG O 1 1 8 3660 1 1 2 PRO C C 8.857 -1.686 1.517 1.00 . A A . 2 PRO C 1 1 8 3661 1 1 2 PRO CA C 10.217 -1.547 0.851 1.00 . A A . 2 PRO CA 1 1 8 3662 1 1 2 PRO CB C 10.273 -2.388 -0.420 1.00 . A A . 2 PRO CB 1 1 8 3663 1 1 2 PRO CD C 11.673 -3.459 1.210 1.00 . A A . 2 PRO CD 1 1 8 3664 1 1 2 PRO CG C 10.763 -3.719 0.033 1.00 . A A . 2 PRO CG 1 1 8 3665 1 1 2 PRO HA H 10.404 -0.510 0.618 1.00 . A A . 2 PRO HA 1 1 8 3666 1 1 2 PRO HB2 H 9.283 -2.454 -0.854 1.00 . A A . 2 PRO HB2 1 1 8 3667 1 1 2 PRO HB3 H 10.952 -1.936 -1.127 1.00 . A A . 2 PRO HB3 1 1 8 3668 1 1 2 PRO HD2 H 11.513 -4.197 1.981 1.00 . A A . 2 PRO HD2 1 1 8 3669 1 1 2 PRO HD3 H 12.707 -3.462 0.894 1.00 . A A . 2 PRO HD3 1 1 8 3670 1 1 2 PRO HG2 H 9.925 -4.332 0.336 1.00 . A A . 2 PRO HG2 1 1 8 3671 1 1 2 PRO HG3 H 11.309 -4.200 -0.764 1.00 . A A . 2 PRO HG3 1 1 8 3672 1 1 2 PRO N N 11.273 -2.118 1.678 1.00 . A A . 2 PRO N 1 1 8 3673 1 1 2 PRO O O 8.598 -2.662 2.224 1.00 . A A . 2 PRO O 1 1 8 3674 1 1 3 PHE C C 5.769 -1.633 0.995 1.00 . A A . 3 PHE C 1 1 8 3675 1 1 3 PHE CA C 6.656 -0.744 1.852 1.00 . A A . 3 PHE CA 1 1 8 3676 1 1 3 PHE CB C 6.100 0.677 1.940 1.00 . A A . 3 PHE CB 1 1 8 3677 1 1 3 PHE CD1 C 7.880 2.401 2.349 1.00 . A A . 3 PHE CD1 1 1 8 3678 1 1 3 PHE CD2 C 6.675 1.545 4.219 1.00 . A A . 3 PHE CD2 1 1 8 3679 1 1 3 PHE CE1 C 8.622 3.206 3.192 1.00 . A A . 3 PHE CE1 1 1 8 3680 1 1 3 PHE CE2 C 7.413 2.349 5.066 1.00 . A A . 3 PHE CE2 1 1 8 3681 1 1 3 PHE CG C 6.899 1.561 2.853 1.00 . A A . 3 PHE CG 1 1 8 3682 1 1 3 PHE CZ C 8.388 3.180 4.551 1.00 . A A . 3 PHE CZ 1 1 8 3683 1 1 3 PHE H H 8.252 0.028 0.707 1.00 . A A . 3 PHE H 1 1 8 3684 1 1 3 PHE HA H 6.719 -1.164 2.845 1.00 . A A . 3 PHE HA 1 1 8 3685 1 1 3 PHE HB2 H 6.103 1.121 0.957 1.00 . A A . 3 PHE HB2 1 1 8 3686 1 1 3 PHE HB3 H 5.090 0.641 2.312 1.00 . A A . 3 PHE HB3 1 1 8 3687 1 1 3 PHE HD1 H 8.064 2.423 1.284 1.00 . A A . 3 PHE HD1 1 1 8 3688 1 1 3 PHE HD2 H 5.912 0.896 4.621 1.00 . A A . 3 PHE HD2 1 1 8 3689 1 1 3 PHE HE1 H 9.383 3.857 2.787 1.00 . A A . 3 PHE HE1 1 1 8 3690 1 1 3 PHE HE2 H 7.228 2.326 6.128 1.00 . A A . 3 PHE HE2 1 1 8 3691 1 1 3 PHE HZ H 8.966 3.808 5.211 1.00 . A A . 3 PHE HZ 1 1 8 3692 1 1 3 PHE N N 7.993 -0.719 1.290 1.00 . A A . 3 PHE N 1 1 8 3693 1 1 3 PHE O O 5.154 -1.180 0.034 1.00 . A A . 3 PHE O 1 1 8 3694 1 1 4 NLE C C 3.679 -4.211 1.031 1.00 . A A . 4 NLE C 1 1 8 3695 1 1 4 NLE CA C 5.080 -3.912 0.524 1.00 . A A . 4 NLE CA 1 1 8 3696 1 1 4 NLE CB C 5.916 -5.196 0.517 1.00 . A A . 4 NLE CB 1 1 8 3697 1 1 4 NLE CD C 6.239 -7.533 -0.335 1.00 . A A . 4 NLE CD 1 1 8 3698 1 1 4 NLE CE C 5.678 -8.601 -1.246 1.00 . A A . 4 NLE CE 1 1 8 3699 1 1 4 NLE CG C 5.362 -6.294 -0.373 1.00 . A A . 4 NLE CG 1 1 8 3700 1 1 4 NLE H H 6.160 -3.179 2.183 1.00 . A A . 4 NLE H 1 1 8 3701 1 1 4 NLE HA H 5.011 -3.530 -0.481 1.00 . A A . 4 NLE HA 1 1 8 3702 1 1 4 NLE HB2 H 5.971 -5.576 1.525 1.00 . A A . 4 NLE HB2 1 1 8 3703 1 1 4 NLE HB3 H 6.915 -4.959 0.179 1.00 . A A . 4 NLE HB3 1 1 8 3704 1 1 4 NLE HD2 H 6.274 -7.919 0.673 1.00 . A A . 4 NLE HD2 1 1 8 3705 1 1 4 NLE HD3 H 7.235 -7.280 -0.670 1.00 . A A . 4 NLE HD3 1 1 8 3706 1 1 4 NLE HE1 H 6.318 -9.470 -1.220 1.00 . A A . 4 NLE HE1 1 1 8 3707 1 1 4 NLE HE2 H 5.628 -8.221 -2.257 1.00 . A A . 4 NLE HE2 1 1 8 3708 1 1 4 NLE HE3 H 4.687 -8.873 -0.914 1.00 . A A . 4 NLE HE3 1 1 8 3709 1 1 4 NLE HG2 H 5.310 -5.931 -1.390 1.00 . A A . 4 NLE HG2 1 1 8 3710 1 1 4 NLE HG3 H 4.371 -6.557 -0.032 1.00 . A A . 4 NLE HG3 1 1 8 3711 1 1 4 NLE N N 5.737 -2.906 1.343 1.00 . A A . 4 NLE N 1 1 8 3712 1 1 4 NLE O O 3.467 -4.402 2.229 1.00 . A A . 4 NLE O 1 1 8 3713 1 1 5 CYS C C 1.322 -6.134 0.696 1.00 . A A . 5 CYS C 1 1 8 3714 1 1 5 CYS CA C 1.369 -4.632 0.432 1.00 . A A . 5 CYS CA 1 1 8 3715 1 1 5 CYS CB C 0.417 -4.259 -0.709 1.00 . A A . 5 CYS CB 1 1 8 3716 1 1 5 CYS H H 2.946 -3.986 -0.813 1.00 . A A . 5 CYS H 1 1 8 3717 1 1 5 CYS HA H 1.071 -4.109 1.327 1.00 . A A . 5 CYS HA 1 1 8 3718 1 1 5 CYS HB2 H 0.422 -3.186 -0.838 1.00 . A A . 5 CYS HB2 1 1 8 3719 1 1 5 CYS HB3 H 0.759 -4.725 -1.619 1.00 . A A . 5 CYS HB3 1 1 8 3720 1 1 5 CYS N N 2.726 -4.237 0.111 1.00 . A A . 5 CYS N 1 1 8 3721 1 1 5 CYS O O 1.962 -6.917 -0.009 1.00 . A A . 5 CYS O 1 1 8 3722 1 1 5 CYS SG S -1.296 -4.769 -0.436 1.00 . A A . 5 CYS SG 1 1 8 3723 1 1 6 THR C C -0.989 -8.346 2.200 1.00 . A A . 6 THR C 1 1 8 3724 1 1 6 THR CA C 0.472 -7.928 2.094 1.00 . A A . 6 THR CA 1 1 8 3725 1 1 6 THR CB C 1.194 -8.203 3.425 1.00 . A A . 6 THR CB 1 1 8 3726 1 1 6 THR CG2 C 2.699 -8.281 3.222 1.00 . A A . 6 THR CG2 1 1 8 3727 1 1 6 THR H H 0.116 -5.857 2.258 1.00 . A A . 6 THR H 1 1 8 3728 1 1 6 THR HA H 0.945 -8.516 1.324 1.00 . A A . 6 THR HA 1 1 8 3729 1 1 6 THR HB H 0.849 -9.149 3.817 1.00 . A A . 6 THR HB 1 1 8 3730 1 1 6 THR HG1 H 0.257 -7.501 5.017 1.00 . A A . 6 THR HG1 1 1 8 3731 1 1 6 THR HG21 H 3.056 -7.345 2.819 1.00 . A A . 6 THR HG21 1 1 8 3732 1 1 6 THR HG22 H 2.929 -9.080 2.533 1.00 . A A . 6 THR HG22 1 1 8 3733 1 1 6 THR HG23 H 3.180 -8.473 4.169 1.00 . A A . 6 THR HG23 1 1 8 3734 1 1 6 THR N N 0.587 -6.527 1.724 1.00 . A A . 6 THR N 1 1 8 3735 1 1 6 THR O O -1.398 -9.000 3.162 1.00 . A A . 6 THR O 1 1 8 3736 1 1 6 THR OG1 O 0.886 -7.165 4.368 1.00 . A A . 6 THR OG1 1 1 8 3737 1 1 7 TRP C C -3.471 -9.580 0.491 1.00 . A A . 7 TRP C 1 1 8 3738 1 1 7 TRP CA C -3.196 -8.263 1.207 1.00 . A A . 7 TRP CA 1 1 8 3739 1 1 7 TRP CB C -3.973 -7.129 0.541 1.00 . A A . 7 TRP CB 1 1 8 3740 1 1 7 TRP CD1 C -6.398 -7.920 0.320 1.00 . A A . 7 TRP CD1 1 1 8 3741 1 1 7 TRP CD2 C -6.094 -6.282 1.810 1.00 . A A . 7 TRP CD2 1 1 8 3742 1 1 7 TRP CE2 C -7.460 -6.617 1.788 1.00 . A A . 7 TRP CE2 1 1 8 3743 1 1 7 TRP CE3 C -5.660 -5.273 2.672 1.00 . A A . 7 TRP CE3 1 1 8 3744 1 1 7 TRP CG C -5.433 -7.128 0.868 1.00 . A A . 7 TRP CG 1 1 8 3745 1 1 7 TRP CH2 C -7.943 -4.991 3.430 1.00 . A A . 7 TRP CH2 1 1 8 3746 1 1 7 TRP CZ2 C -8.396 -5.977 2.596 1.00 . A A . 7 TRP CZ2 1 1 8 3747 1 1 7 TRP CZ3 C -6.588 -4.637 3.472 1.00 . A A . 7 TRP CZ3 1 1 8 3748 1 1 7 TRP H H -1.386 -7.493 0.438 1.00 . A A . 7 TRP H 1 1 8 3749 1 1 7 TRP HA H -3.515 -8.352 2.234 1.00 . A A . 7 TRP HA 1 1 8 3750 1 1 7 TRP HB2 H -3.562 -6.182 0.856 1.00 . A A . 7 TRP HB2 1 1 8 3751 1 1 7 TRP HB3 H -3.873 -7.219 -0.529 1.00 . A A . 7 TRP HB3 1 1 8 3752 1 1 7 TRP HD1 H -6.211 -8.672 -0.431 1.00 . A A . 7 TRP HD1 1 1 8 3753 1 1 7 TRP HE1 H -8.470 -8.058 0.640 1.00 . A A . 7 TRP HE1 1 1 8 3754 1 1 7 TRP HE3 H -4.619 -4.988 2.716 1.00 . A A . 7 TRP HE3 1 1 8 3755 1 1 7 TRP HH2 H -8.634 -4.464 4.071 1.00 . A A . 7 TRP HH2 1 1 8 3756 1 1 7 TRP HZ2 H -9.443 -6.239 2.575 1.00 . A A . 7 TRP HZ2 1 1 8 3757 1 1 7 TRP HZ3 H -6.271 -3.852 4.143 1.00 . A A . 7 TRP HZ3 1 1 8 3758 1 1 7 TRP N N -1.775 -7.971 1.202 1.00 . A A . 7 TRP N 1 1 8 3759 1 1 7 TRP NE1 N -7.621 -7.623 0.871 1.00 . A A . 7 TRP NE1 1 1 8 3760 1 1 7 TRP O O -3.854 -9.596 -0.682 1.00 . A A . 7 TRP O 1 1 8 3761 1 1 8 ORN C C -1.369 -10.926 -2.908 1.00 . A A . 8 ORN C 1 1 8 3762 1 1 8 ORN CA C -1.936 -12.072 -2.082 1.00 . A A . 8 ORN CA 1 1 8 3763 1 1 8 ORN CB C -1.312 -12.046 -0.683 1.00 . A A . 8 ORN CB 1 1 8 3764 1 1 8 ORN CD C -3.440 -12.035 0.667 1.00 . A A . 8 ORN CD 1 1 8 3765 1 1 8 ORN CG C -2.131 -12.764 0.378 1.00 . A A . 8 ORN CG 1 1 8 3766 1 1 8 ORN H H -2.147 -13.399 -3.672 1.00 . A A . 8 ORN H 1 1 8 3767 1 1 8 ORN HA H -3.003 -11.937 -1.993 1.00 . A A . 8 ORN HA 1 1 8 3768 1 1 8 ORN HB2 H -1.196 -11.017 -0.378 1.00 . A A . 8 ORN HB2 1 1 8 3769 1 1 8 ORN HB3 H -0.338 -12.509 -0.729 1.00 . A A . 8 ORN HB3 1 1 8 3770 1 1 8 ORN HD2 H -3.998 -12.604 1.397 1.00 . A A . 8 ORN HD2 1 1 8 3771 1 1 8 ORN HD3 H -4.010 -11.970 -0.246 1.00 . A A . 8 ORN HD3 1 1 8 3772 1 1 8 ORN HE1 H -2.877 -10.593 2.096 1.00 . A A . 8 ORN HE1 1 1 8 3773 1 1 8 ORN HG2 H -1.552 -12.822 1.288 1.00 . A A . 8 ORN HG2 1 1 8 3774 1 1 8 ORN HG3 H -2.356 -13.762 0.031 1.00 . A A . 8 ORN HG3 1 1 8 3775 1 1 8 ORN N N -1.689 -13.377 -2.739 1.00 . A A . 8 ORN N 1 1 8 3776 1 1 8 ORN NE N -3.227 -10.683 1.184 1.00 . A A . 8 ORN NE 1 1 8 3777 1 1 8 ORN O O -0.373 -11.083 -3.617 1.00 . A A . 8 ORN O 1 1 8 3778 1 1 9 CYS C C -0.270 -8.094 -2.779 1.00 . A A . 9 CYS C 1 1 8 3779 1 1 9 CYS CA C -1.556 -8.559 -3.449 1.00 . A A . 9 CYS CA 1 1 8 3780 1 1 9 CYS CB C -2.636 -7.482 -3.341 1.00 . A A . 9 CYS CB 1 1 8 3781 1 1 9 CYS H H -2.848 -9.744 -2.278 1.00 . A A . 9 CYS H 1 1 8 3782 1 1 9 CYS HA H -1.363 -8.772 -4.489 1.00 . A A . 9 CYS HA 1 1 8 3783 1 1 9 CYS HB2 H -3.500 -7.791 -3.909 1.00 . A A . 9 CYS HB2 1 1 8 3784 1 1 9 CYS HB3 H -2.916 -7.374 -2.305 1.00 . A A . 9 CYS HB3 1 1 8 3785 1 1 9 CYS N N -2.022 -9.776 -2.810 1.00 . A A . 9 CYS N 1 1 8 3786 1 1 9 CYS O O -0.271 -7.764 -1.593 1.00 . A A . 9 CYS O 1 1 8 3787 1 1 9 CYS SG S -2.142 -5.854 -3.945 1.00 . A A . 9 CYS SG 1 1 8 3788 1 1 10 GLY C C 2.861 -6.720 -3.770 1.00 . A A . 10 GLY C 1 1 8 3789 1 1 10 GLY CA C 2.106 -7.750 -2.961 1.00 . A A . 10 GLY CA 1 1 8 3790 1 1 10 GLY H H 0.752 -8.269 -4.492 1.00 . A A . 10 GLY H 1 1 8 3791 1 1 10 GLY HA2 H 1.957 -7.369 -1.962 1.00 . A A . 10 GLY HA2 1 1 8 3792 1 1 10 GLY HA3 H 2.696 -8.650 -2.907 1.00 . A A . 10 GLY HA3 1 1 8 3793 1 1 10 GLY N N 0.821 -8.074 -3.533 1.00 . A A . 10 GLY N 1 1 8 3794 1 1 10 GLY O O 3.944 -6.995 -4.287 1.00 . A A . 10 GLY O 1 1 8 3795 1 1 11 LYS C C 3.834 -3.679 -3.644 1.00 . A A . 11 LYS C 1 1 8 3796 1 1 11 LYS CA C 2.908 -4.433 -4.596 1.00 . A A . 11 LYS CA 1 1 8 3797 1 1 11 LYS CB C 1.825 -3.510 -5.164 1.00 . A A . 11 LYS CB 1 1 8 3798 1 1 11 LYS CD C 1.167 -1.970 -7.021 1.00 . A A . 11 LYS CD 1 1 8 3799 1 1 11 LYS CE C 1.634 -1.027 -8.119 1.00 . A A . 11 LYS CE 1 1 8 3800 1 1 11 LYS CG C 2.322 -2.499 -6.186 1.00 . A A . 11 LYS CG 1 1 8 3801 1 1 11 LYS H H 1.394 -5.408 -3.496 1.00 . A A . 11 LYS H 1 1 8 3802 1 1 11 LYS HA H 3.493 -4.841 -5.408 1.00 . A A . 11 LYS HA 1 1 8 3803 1 1 11 LYS HB2 H 1.068 -4.115 -5.638 1.00 . A A . 11 LYS HB2 1 1 8 3804 1 1 11 LYS HB3 H 1.372 -2.967 -4.347 1.00 . A A . 11 LYS HB3 1 1 8 3805 1 1 11 LYS HD2 H 0.658 -2.805 -7.476 1.00 . A A . 11 LYS HD2 1 1 8 3806 1 1 11 LYS HD3 H 0.482 -1.442 -6.374 1.00 . A A . 11 LYS HD3 1 1 8 3807 1 1 11 LYS HE2 H 2.450 -1.494 -8.649 1.00 . A A . 11 LYS HE2 1 1 8 3808 1 1 11 LYS HE3 H 0.814 -0.860 -8.802 1.00 . A A . 11 LYS HE3 1 1 8 3809 1 1 11 LYS HG2 H 2.792 -1.676 -5.667 1.00 . A A . 11 LYS HG2 1 1 8 3810 1 1 11 LYS HG3 H 3.038 -2.978 -6.837 1.00 . A A . 11 LYS HG3 1 1 8 3811 1 1 11 LYS HZ1 H 1.328 0.749 -7.067 1.00 . A A . 11 LYS HZ1 1 1 8 3812 1 1 11 LYS HZ2 H 2.387 0.901 -8.374 1.00 . A A . 11 LYS HZ2 1 1 8 3813 1 1 11 LYS HZ3 H 2.905 0.149 -6.953 1.00 . A A . 11 LYS HZ3 1 1 8 3814 1 1 11 LYS N N 2.278 -5.539 -3.890 1.00 . A A . 11 LYS N 1 1 8 3815 1 1 11 LYS NZ N 2.095 0.282 -7.589 1.00 . A A . 11 LYS NZ 1 1 8 3816 1 1 11 LYS O O 3.460 -3.389 -2.507 1.00 . A A . 11 LYS O 1 1 8 3817 1 1 12 ARG C C 6.150 -1.267 -3.528 1.00 . A A . 12 ARG C 1 1 8 3818 1 1 12 ARG CA C 6.051 -2.757 -3.252 1.00 . A A . 12 ARG CA 1 1 8 3819 1 1 12 ARG CB C 7.418 -3.413 -3.464 1.00 . A A . 12 ARG CB 1 1 8 3820 1 1 12 ARG CD C 8.828 -5.487 -3.287 1.00 . A A . 12 ARG CD 1 1 8 3821 1 1 12 ARG CG C 7.481 -4.850 -2.981 1.00 . A A . 12 ARG CG 1 1 8 3822 1 1 12 ARG CZ C 8.881 -7.955 -3.406 1.00 . A A . 12 ARG CZ 1 1 8 3823 1 1 12 ARG H H 5.264 -3.590 -5.035 1.00 . A A . 12 ARG H 1 1 8 3824 1 1 12 ARG HA H 5.750 -2.898 -2.224 1.00 . A A . 12 ARG HA 1 1 8 3825 1 1 12 ARG HB2 H 7.651 -3.398 -4.518 1.00 . A A . 12 ARG HB2 1 1 8 3826 1 1 12 ARG HB3 H 8.163 -2.842 -2.930 1.00 . A A . 12 ARG HB3 1 1 8 3827 1 1 12 ARG HD2 H 8.947 -5.558 -4.358 1.00 . A A . 12 ARG HD2 1 1 8 3828 1 1 12 ARG HD3 H 9.608 -4.862 -2.880 1.00 . A A . 12 ARG HD3 1 1 8 3829 1 1 12 ARG HE H 9.075 -6.877 -1.732 1.00 . A A . 12 ARG HE 1 1 8 3830 1 1 12 ARG HG2 H 7.321 -4.867 -1.913 1.00 . A A . 12 ARG HG2 1 1 8 3831 1 1 12 ARG HG3 H 6.703 -5.417 -3.471 1.00 . A A . 12 ARG HG3 1 1 8 3832 1 1 12 ARG HH11 H 8.604 -7.048 -5.202 1.00 . A A . 12 ARG HH11 1 1 8 3833 1 1 12 ARG HH12 H 8.654 -8.782 -5.244 1.00 . A A . 12 ARG HH12 1 1 8 3834 1 1 12 ARG HH21 H 8.965 -9.976 -3.311 1.00 . A A . 12 ARG HH21 1 1 8 3835 1 1 12 ARG HH22 H 9.159 -9.155 -1.796 1.00 . A A . 12 ARG HH22 1 1 8 3836 1 1 12 ARG N N 5.045 -3.389 -4.100 1.00 . A A . 12 ARG N 1 1 8 3837 1 1 12 ARG NE N 8.939 -6.823 -2.706 1.00 . A A . 12 ARG NE 1 1 8 3838 1 1 12 ARG NH1 N 8.699 -7.926 -4.722 1.00 . A A . 12 ARG NH1 1 1 8 3839 1 1 12 ARG NH2 N 9.010 -9.121 -2.787 1.00 . A A . 12 ARG NH2 1 1 8 3840 1 1 12 ARG O O 6.177 -0.843 -4.684 1.00 . A A . 12 ARG O 1 1 8 3841 1 1 13 PHE C C 7.513 1.505 -1.885 1.00 . A A . 13 PHE C 1 1 8 3842 1 1 13 PHE CA C 6.272 0.969 -2.579 1.00 . A A . 13 PHE CA 1 1 8 3843 1 1 13 PHE CB C 5.018 1.593 -1.971 1.00 . A A . 13 PHE CB 1 1 8 3844 1 1 13 PHE CD1 C 3.249 1.713 -3.729 1.00 . A A . 13 PHE CD1 1 1 8 3845 1 1 13 PHE CD2 C 3.093 0.005 -2.078 1.00 . A A . 13 PHE CD2 1 1 8 3846 1 1 13 PHE CE1 C 2.085 1.266 -4.310 1.00 . A A . 13 PHE CE1 1 1 8 3847 1 1 13 PHE CE2 C 1.928 -0.450 -2.655 1.00 . A A . 13 PHE CE2 1 1 8 3848 1 1 13 PHE CG C 3.764 1.088 -2.610 1.00 . A A . 13 PHE CG 1 1 8 3849 1 1 13 PHE CZ C 1.466 0.127 -3.811 1.00 . A A . 13 PHE CZ 1 1 8 3850 1 1 13 PHE H H 6.193 -0.882 -1.568 1.00 . A A . 13 PHE H 1 1 8 3851 1 1 13 PHE HA H 6.316 1.220 -3.627 1.00 . A A . 13 PHE HA 1 1 8 3852 1 1 13 PHE HB2 H 4.974 1.359 -0.917 1.00 . A A . 13 PHE HB2 1 1 8 3853 1 1 13 PHE HB3 H 5.053 2.663 -2.100 1.00 . A A . 13 PHE HB3 1 1 8 3854 1 1 13 PHE HD1 H 3.768 2.561 -4.147 1.00 . A A . 13 PHE HD1 1 1 8 3855 1 1 13 PHE HD2 H 3.491 -0.489 -1.205 1.00 . A A . 13 PHE HD2 1 1 8 3856 1 1 13 PHE HE1 H 1.692 1.762 -5.185 1.00 . A A . 13 PHE HE1 1 1 8 3857 1 1 13 PHE HE2 H 1.410 -1.295 -2.233 1.00 . A A . 13 PHE HE2 1 1 8 3858 1 1 13 PHE HZ H 0.568 -0.246 -4.277 1.00 . A A . 13 PHE HZ 1 1 8 3859 1 1 13 PHE N N 6.207 -0.479 -2.466 1.00 . A A . 13 PHE N 1 1 8 3860 1 1 13 PHE O O 8.011 0.911 -0.930 1.00 . A A . 13 PHE O 1 1 8 3861 1 1 14 THR C C 8.785 4.239 -0.718 1.00 . A A . 14 THR C 1 1 8 3862 1 1 14 THR CA C 9.188 3.256 -1.817 1.00 . A A . 14 THR CA 1 1 8 3863 1 1 14 THR CB C 9.966 4.002 -2.920 1.00 . A A . 14 THR CB 1 1 8 3864 1 1 14 THR CG2 C 11.374 4.355 -2.461 1.00 . A A . 14 THR CG2 1 1 8 3865 1 1 14 THR H H 7.584 3.028 -3.165 1.00 . A A . 14 THR H 1 1 8 3866 1 1 14 THR HA H 9.824 2.491 -1.398 1.00 . A A . 14 THR HA 1 1 8 3867 1 1 14 THR HB H 9.438 4.915 -3.160 1.00 . A A . 14 THR HB 1 1 8 3868 1 1 14 THR HG1 H 10.476 2.345 -3.864 1.00 . A A . 14 THR HG1 1 1 8 3869 1 1 14 THR HG21 H 11.885 4.890 -3.247 1.00 . A A . 14 THR HG21 1 1 8 3870 1 1 14 THR HG22 H 11.915 3.450 -2.232 1.00 . A A . 14 THR HG22 1 1 8 3871 1 1 14 THR HG23 H 11.321 4.976 -1.578 1.00 . A A . 14 THR HG23 1 1 8 3872 1 1 14 THR N N 8.013 2.621 -2.382 1.00 . A A . 14 THR N 1 1 8 3873 1 1 14 THR O O 9.614 4.683 0.077 1.00 . A A . 14 THR O 1 1 8 3874 1 1 14 THR OG1 O 10.042 3.176 -4.090 1.00 . A A . 14 THR OG1 1 1 8 3875 1 1 15 ARG C C 5.749 4.989 0.999 1.00 . A A . 15 ARG C 1 1 8 3876 1 1 15 ARG CA C 6.989 5.530 0.292 1.00 . A A . 15 ARG CA 1 1 8 3877 1 1 15 ARG CB C 6.669 6.859 -0.400 1.00 . A A . 15 ARG CB 1 1 8 3878 1 1 15 ARG CD C 7.544 8.910 -1.577 1.00 . A A . 15 ARG CD 1 1 8 3879 1 1 15 ARG CG C 7.900 7.578 -0.934 1.00 . A A . 15 ARG CG 1 1 8 3880 1 1 15 ARG CZ C 6.094 9.735 -3.396 1.00 . A A . 15 ARG CZ 1 1 8 3881 1 1 15 ARG H H 6.875 4.141 -1.301 1.00 . A A . 15 ARG H 1 1 8 3882 1 1 15 ARG HA H 7.762 5.693 1.025 1.00 . A A . 15 ARG HA 1 1 8 3883 1 1 15 ARG HB2 H 6.003 6.671 -1.230 1.00 . A A . 15 ARG HB2 1 1 8 3884 1 1 15 ARG HB3 H 6.175 7.510 0.305 1.00 . A A . 15 ARG HB3 1 1 8 3885 1 1 15 ARG HD2 H 6.988 9.504 -0.868 1.00 . A A . 15 ARG HD2 1 1 8 3886 1 1 15 ARG HD3 H 8.458 9.423 -1.836 1.00 . A A . 15 ARG HD3 1 1 8 3887 1 1 15 ARG HE H 6.698 7.838 -3.176 1.00 . A A . 15 ARG HE 1 1 8 3888 1 1 15 ARG HG2 H 8.581 7.757 -0.115 1.00 . A A . 15 ARG HG2 1 1 8 3889 1 1 15 ARG HG3 H 8.378 6.949 -1.671 1.00 . A A . 15 ARG HG3 1 1 8 3890 1 1 15 ARG HH11 H 6.624 11.149 -2.041 1.00 . A A . 15 ARG HH11 1 1 8 3891 1 1 15 ARG HH12 H 5.631 11.710 -3.348 1.00 . A A . 15 ARG HH12 1 1 8 3892 1 1 15 ARG HH21 H 5.409 8.576 -4.911 1.00 . A A . 15 ARG HH21 1 1 8 3893 1 1 15 ARG HH22 H 4.943 10.245 -4.983 1.00 . A A . 15 ARG HH22 1 1 8 3894 1 1 15 ARG N N 7.498 4.568 -0.675 1.00 . A A . 15 ARG N 1 1 8 3895 1 1 15 ARG NE N 6.740 8.742 -2.786 1.00 . A A . 15 ARG NE 1 1 8 3896 1 1 15 ARG NH1 N 6.119 10.962 -2.888 1.00 . A A . 15 ARG NH1 1 1 8 3897 1 1 15 ARG NH2 N 5.428 9.499 -4.519 1.00 . A A . 15 ARG NH2 1 1 8 3898 1 1 15 ARG O O 4.844 4.426 0.373 1.00 . A A . 15 ARG O 1 1 8 3899 1 1 16 SER C C 3.315 5.339 2.817 1.00 . A A . 16 SER C 1 1 8 3900 1 1 16 SER CA C 4.644 4.666 3.160 1.00 . A A . 16 SER CA 1 1 8 3901 1 1 16 SER CB C 4.984 4.884 4.639 1.00 . A A . 16 SER CB 1 1 8 3902 1 1 16 SER H H 6.463 5.666 2.739 1.00 . A A . 16 SER H 1 1 8 3903 1 1 16 SER HA H 4.556 3.605 2.976 1.00 . A A . 16 SER HA 1 1 8 3904 1 1 16 SER HB2 H 5.922 4.397 4.867 1.00 . A A . 16 SER HB2 1 1 8 3905 1 1 16 SER HB3 H 5.076 5.941 4.832 1.00 . A A . 16 SER HB3 1 1 8 3906 1 1 16 SER HG H 3.903 4.910 6.271 1.00 . A A . 16 SER HG 1 1 8 3907 1 1 16 SER N N 5.724 5.172 2.318 1.00 . A A . 16 SER N 1 1 8 3908 1 1 16 SER O O 2.250 4.726 2.927 1.00 . A A . 16 SER O 1 1 8 3909 1 1 16 SER OG O 3.982 4.352 5.489 1.00 . A A . 16 SER OG 1 1 8 3910 1 1 17 ASP C C 1.586 6.695 0.739 1.00 . A A . 17 ASP C 1 1 8 3911 1 1 17 ASP CA C 2.193 7.334 1.975 1.00 . A A . 17 ASP CA 1 1 8 3912 1 1 17 ASP CB C 2.518 8.803 1.687 1.00 . A A . 17 ASP CB 1 1 8 3913 1 1 17 ASP CG C 2.813 9.603 2.938 1.00 . A A . 17 ASP CG 1 1 8 3914 1 1 17 ASP H H 4.254 7.050 2.376 1.00 . A A . 17 ASP H 1 1 8 3915 1 1 17 ASP HA H 1.473 7.283 2.777 1.00 . A A . 17 ASP HA 1 1 8 3916 1 1 17 ASP HB2 H 3.380 8.852 1.043 1.00 . A A . 17 ASP HB2 1 1 8 3917 1 1 17 ASP HB3 H 1.678 9.254 1.184 1.00 . A A . 17 ASP HB3 1 1 8 3918 1 1 17 ASP N N 3.383 6.600 2.396 1.00 . A A . 17 ASP N 1 1 8 3919 1 1 17 ASP O O 0.367 6.684 0.569 1.00 . A A . 17 ASP O 1 1 8 3920 1 1 17 ASP OD1 O 1.870 10.182 3.519 1.00 . A A . 17 ASP OD1 1 1 8 3921 1 1 17 ASP OD2 O 3.985 9.653 3.357 1.00 . A A . 17 ASP OD2 1 1 8 3922 1 1 18 GLU C C 1.428 4.116 -1.010 1.00 . A A . 18 GLU C 1 1 8 3923 1 1 18 GLU CA C 1.999 5.487 -1.328 1.00 . A A . 18 GLU CA 1 1 8 3924 1 1 18 GLU CB C 3.141 5.373 -2.334 1.00 . A A . 18 GLU CB 1 1 8 3925 1 1 18 GLU CD C 2.353 7.312 -3.738 1.00 . A A . 18 GLU CD 1 1 8 3926 1 1 18 GLU CG C 3.511 6.698 -2.974 1.00 . A A . 18 GLU CG 1 1 8 3927 1 1 18 GLU H H 3.401 6.192 0.080 1.00 . A A . 18 GLU H 1 1 8 3928 1 1 18 GLU HA H 1.216 6.090 -1.761 1.00 . A A . 18 GLU HA 1 1 8 3929 1 1 18 GLU HB2 H 4.014 4.984 -1.832 1.00 . A A . 18 GLU HB2 1 1 8 3930 1 1 18 GLU HB3 H 2.851 4.689 -3.117 1.00 . A A . 18 GLU HB3 1 1 8 3931 1 1 18 GLU HG2 H 3.815 7.387 -2.198 1.00 . A A . 18 GLU HG2 1 1 8 3932 1 1 18 GLU HG3 H 4.330 6.536 -3.658 1.00 . A A . 18 GLU HG3 1 1 8 3933 1 1 18 GLU N N 2.444 6.153 -0.115 1.00 . A A . 18 GLU N 1 1 8 3934 1 1 18 GLU O O 0.482 3.672 -1.653 1.00 . A A . 18 GLU O 1 1 8 3935 1 1 18 GLU OE1 O 1.751 8.284 -3.236 1.00 . A A . 18 GLU OE1 1 1 8 3936 1 1 18 GLU OE2 O 2.038 6.827 -4.842 1.00 . A A . 18 GLU OE2 1 1 8 3937 1 1 19 LEU C C 0.053 2.392 1.030 1.00 . A A . 19 LEU C 1 1 8 3938 1 1 19 LEU CA C 1.447 2.180 0.449 1.00 . A A . 19 LEU CA 1 1 8 3939 1 1 19 LEU CB C 2.359 1.526 1.490 1.00 . A A . 19 LEU CB 1 1 8 3940 1 1 19 LEU CD1 C 1.566 -0.831 1.107 1.00 . A A . 19 LEU CD1 1 1 8 3941 1 1 19 LEU CD2 C 2.706 -0.233 3.251 1.00 . A A . 19 LEU CD2 1 1 8 3942 1 1 19 LEU CG C 1.789 0.262 2.143 1.00 . A A . 19 LEU CG 1 1 8 3943 1 1 19 LEU H H 2.814 3.805 0.407 1.00 . A A . 19 LEU H 1 1 8 3944 1 1 19 LEU HA H 1.366 1.527 -0.407 1.00 . A A . 19 LEU HA 1 1 8 3945 1 1 19 LEU HB2 H 3.294 1.272 1.009 1.00 . A A . 19 LEU HB2 1 1 8 3946 1 1 19 LEU HB3 H 2.559 2.245 2.266 1.00 . A A . 19 LEU HB3 1 1 8 3947 1 1 19 LEU HD11 H 2.502 -1.062 0.621 1.00 . A A . 19 LEU HD11 1 1 8 3948 1 1 19 LEU HD12 H 0.850 -0.491 0.372 1.00 . A A . 19 LEU HD12 1 1 8 3949 1 1 19 LEU HD13 H 1.187 -1.717 1.595 1.00 . A A . 19 LEU HD13 1 1 8 3950 1 1 19 LEU HD21 H 2.941 0.585 3.917 1.00 . A A . 19 LEU HD21 1 1 8 3951 1 1 19 LEU HD22 H 3.615 -0.623 2.820 1.00 . A A . 19 LEU HD22 1 1 8 3952 1 1 19 LEU HD23 H 2.209 -1.015 3.805 1.00 . A A . 19 LEU HD23 1 1 8 3953 1 1 19 LEU HG H 0.831 0.499 2.585 1.00 . A A . 19 LEU HG 1 1 8 3954 1 1 19 LEU N N 2.000 3.447 -0.013 1.00 . A A . 19 LEU N 1 1 8 3955 1 1 19 LEU O O -0.877 1.659 0.705 1.00 . A A . 19 LEU O 1 1 8 3956 1 1 20 GLN C C -2.378 4.137 1.373 1.00 . A A . 20 GLN C 1 1 8 3957 1 1 20 GLN CA C -1.387 3.741 2.466 1.00 . A A . 20 GLN CA 1 1 8 3958 1 1 20 GLN CB C -1.237 4.872 3.486 1.00 . A A . 20 GLN CB 1 1 8 3959 1 1 20 GLN CD C -2.391 6.384 5.155 1.00 . A A . 20 GLN CD 1 1 8 3960 1 1 20 GLN CG C -2.562 5.367 4.045 1.00 . A A . 20 GLN CG 1 1 8 3961 1 1 20 GLN H H 0.698 3.945 2.120 1.00 . A A . 20 GLN H 1 1 8 3962 1 1 20 GLN HA H -1.755 2.858 2.967 1.00 . A A . 20 GLN HA 1 1 8 3963 1 1 20 GLN HB2 H -0.635 4.520 4.311 1.00 . A A . 20 GLN HB2 1 1 8 3964 1 1 20 GLN HB3 H -0.735 5.705 3.015 1.00 . A A . 20 GLN HB3 1 1 8 3965 1 1 20 GLN HE21 H -4.079 7.289 4.624 1.00 . A A . 20 GLN HE21 1 1 8 3966 1 1 20 GLN HE22 H -3.247 7.973 5.977 1.00 . A A . 20 GLN HE22 1 1 8 3967 1 1 20 GLN HG2 H -3.126 5.823 3.245 1.00 . A A . 20 GLN HG2 1 1 8 3968 1 1 20 GLN HG3 H -3.110 4.523 4.433 1.00 . A A . 20 GLN HG3 1 1 8 3969 1 1 20 GLN N N -0.090 3.409 1.878 1.00 . A A . 20 GLN N 1 1 8 3970 1 1 20 GLN NE2 N -3.332 7.309 5.263 1.00 . A A . 20 GLN NE2 1 1 8 3971 1 1 20 GLN O O -3.540 3.711 1.378 1.00 . A A . 20 GLN O 1 1 8 3972 1 1 20 GLN OE1 O -1.415 6.344 5.904 1.00 . A A . 20 GLN OE1 1 1 8 3973 1 1 21 ARG C C -3.206 4.098 -1.428 1.00 . A A . 21 ARG C 1 1 8 3974 1 1 21 ARG CA C -2.663 5.340 -0.737 1.00 . A A . 21 ARG CA 1 1 8 3975 1 1 21 ARG CB C -1.757 6.119 -1.694 1.00 . A A . 21 ARG CB 1 1 8 3976 1 1 21 ARG CD C -1.442 7.323 -3.859 1.00 . A A . 21 ARG CD 1 1 8 3977 1 1 21 ARG CG C -2.442 6.624 -2.951 1.00 . A A . 21 ARG CG 1 1 8 3978 1 1 21 ARG CZ C -1.417 8.346 -6.104 1.00 . A A . 21 ARG CZ 1 1 8 3979 1 1 21 ARG H H -0.985 5.312 0.554 1.00 . A A . 21 ARG H 1 1 8 3980 1 1 21 ARG HA H -3.483 5.967 -0.425 1.00 . A A . 21 ARG HA 1 1 8 3981 1 1 21 ARG HB2 H -1.354 6.972 -1.171 1.00 . A A . 21 ARG HB2 1 1 8 3982 1 1 21 ARG HB3 H -0.942 5.480 -1.993 1.00 . A A . 21 ARG HB3 1 1 8 3983 1 1 21 ARG HD2 H -0.957 8.109 -3.301 1.00 . A A . 21 ARG HD2 1 1 8 3984 1 1 21 ARG HD3 H -0.705 6.603 -4.180 1.00 . A A . 21 ARG HD3 1 1 8 3985 1 1 21 ARG HE H -3.058 7.986 -5.021 1.00 . A A . 21 ARG HE 1 1 8 3986 1 1 21 ARG HG2 H -2.874 5.787 -3.479 1.00 . A A . 21 ARG HG2 1 1 8 3987 1 1 21 ARG HG3 H -3.218 7.321 -2.675 1.00 . A A . 21 ARG HG3 1 1 8 3988 1 1 21 ARG HH11 H 0.425 7.821 -5.409 1.00 . A A . 21 ARG HH11 1 1 8 3989 1 1 21 ARG HH12 H 0.400 8.567 -6.976 1.00 . A A . 21 ARG HH12 1 1 8 3990 1 1 21 ARG HH21 H -3.084 8.980 -7.071 1.00 . A A . 21 ARG HH21 1 1 8 3991 1 1 21 ARG HH22 H -1.593 9.233 -7.920 1.00 . A A . 21 ARG HH22 1 1 8 3992 1 1 21 ARG N N -1.895 4.954 0.441 1.00 . A A . 21 ARG N 1 1 8 3993 1 1 21 ARG NE N -2.079 7.906 -5.037 1.00 . A A . 21 ARG NE 1 1 8 3994 1 1 21 ARG NH1 N -0.092 8.238 -6.169 1.00 . A A . 21 ARG NH1 1 1 8 3995 1 1 21 ARG NH2 N -2.085 8.896 -7.112 1.00 . A A . 21 ARG NH2 1 1 8 3996 1 1 21 ARG O O -4.413 3.963 -1.644 1.00 . A A . 21 ARG O 1 1 8 3997 1 1 22 HIS C C -3.658 1.145 -1.534 1.00 . A A . 22 HIS C 1 1 8 3998 1 1 22 HIS CA C -2.642 1.923 -2.370 1.00 . A A . 22 HIS CA 1 1 8 3999 1 1 22 HIS CB C -1.370 1.096 -2.584 1.00 . A A . 22 HIS CB 1 1 8 4000 1 1 22 HIS CD2 C -1.847 -1.399 -2.159 1.00 . A A . 22 HIS CD2 1 1 8 4001 1 1 22 HIS CE1 C -2.042 -2.098 -4.211 1.00 . A A . 22 HIS CE1 1 1 8 4002 1 1 22 HIS CG C -1.629 -0.327 -2.960 1.00 . A A . 22 HIS CG 1 1 8 4003 1 1 22 HIS H H -1.353 3.360 -1.531 1.00 . A A . 22 HIS H 1 1 8 4004 1 1 22 HIS HA H -3.081 2.144 -3.331 1.00 . A A . 22 HIS HA 1 1 8 4005 1 1 22 HIS HB2 H -0.787 1.547 -3.372 1.00 . A A . 22 HIS HB2 1 1 8 4006 1 1 22 HIS HB3 H -0.791 1.099 -1.670 1.00 . A A . 22 HIS HB3 1 1 8 4007 1 1 22 HIS HD1 H -1.627 -0.251 -5.082 1.00 . A A . 22 HIS HD1 1 1 8 4008 1 1 22 HIS HD2 H -1.790 -1.417 -1.082 1.00 . A A . 22 HIS HD2 1 1 8 4009 1 1 22 HIS HE1 H -2.192 -2.738 -5.065 1.00 . A A . 22 HIS HE1 1 1 8 4010 1 1 22 HIS N N -2.299 3.182 -1.737 1.00 . A A . 22 HIS N 1 1 8 4011 1 1 22 HIS ND1 N -1.743 -0.788 -4.266 1.00 . A A . 22 HIS ND1 1 1 8 4012 1 1 22 HIS NE2 N -2.110 -2.481 -2.961 1.00 . A A . 22 HIS NE2 1 1 8 4013 1 1 22 HIS O O -4.628 0.623 -2.065 1.00 . A A . 22 HIS O 1 1 8 4014 1 1 23 LYS C C -5.752 0.859 0.577 1.00 . A A . 23 LYS C 1 1 8 4015 1 1 23 LYS CA C -4.317 0.358 0.680 1.00 . A A . 23 LYS CA 1 1 8 4016 1 1 23 LYS CB C -3.836 0.480 2.125 1.00 . A A . 23 LYS CB 1 1 8 4017 1 1 23 LYS CD C -2.787 -1.798 2.304 1.00 . A A . 23 LYS CD 1 1 8 4018 1 1 23 LYS CE C -1.547 -2.572 2.712 1.00 . A A . 23 LYS CE 1 1 8 4019 1 1 23 LYS CG C -2.568 -0.299 2.427 1.00 . A A . 23 LYS CG 1 1 8 4020 1 1 23 LYS H H -2.637 1.534 0.139 1.00 . A A . 23 LYS H 1 1 8 4021 1 1 23 LYS HA H -4.297 -0.680 0.393 1.00 . A A . 23 LYS HA 1 1 8 4022 1 1 23 LYS HB2 H -3.649 1.522 2.339 1.00 . A A . 23 LYS HB2 1 1 8 4023 1 1 23 LYS HB3 H -4.615 0.122 2.779 1.00 . A A . 23 LYS HB3 1 1 8 4024 1 1 23 LYS HD2 H -3.606 -2.085 2.947 1.00 . A A . 23 LYS HD2 1 1 8 4025 1 1 23 LYS HD3 H -3.030 -2.034 1.281 1.00 . A A . 23 LYS HD3 1 1 8 4026 1 1 23 LYS HE2 H -1.723 -3.625 2.552 1.00 . A A . 23 LYS HE2 1 1 8 4027 1 1 23 LYS HE3 H -0.719 -2.248 2.097 1.00 . A A . 23 LYS HE3 1 1 8 4028 1 1 23 LYS HG2 H -1.797 -0.003 1.731 1.00 . A A . 23 LYS HG2 1 1 8 4029 1 1 23 LYS HG3 H -2.251 -0.073 3.434 1.00 . A A . 23 LYS HG3 1 1 8 4030 1 1 23 LYS HZ1 H -1.058 -1.335 4.324 1.00 . A A . 23 LYS HZ1 1 1 8 4031 1 1 23 LYS HZ2 H -0.337 -2.862 4.387 1.00 . A A . 23 LYS HZ2 1 1 8 4032 1 1 23 LYS HZ3 H -1.977 -2.689 4.750 1.00 . A A . 23 LYS HZ3 1 1 8 4033 1 1 23 LYS N N -3.430 1.085 -0.226 1.00 . A A . 23 LYS N 1 1 8 4034 1 1 23 LYS NZ N -1.204 -2.348 4.140 1.00 . A A . 23 LYS NZ 1 1 8 4035 1 1 23 LYS O O -6.700 0.097 0.789 1.00 . A A . 23 LYS O 1 1 8 4036 1 1 24 ARG C C -8.013 2.088 -1.080 1.00 . A A . 24 ARG C 1 1 8 4037 1 1 24 ARG CA C -7.244 2.714 0.086 1.00 . A A . 24 ARG CA 1 1 8 4038 1 1 24 ARG CB C -7.167 4.231 -0.085 1.00 . A A . 24 ARG CB 1 1 8 4039 1 1 24 ARG CD C -6.819 6.477 0.982 1.00 . A A . 24 ARG CD 1 1 8 4040 1 1 24 ARG CG C -6.815 4.970 1.194 1.00 . A A . 24 ARG CG 1 1 8 4041 1 1 24 ARG CZ C -8.666 8.114 0.842 1.00 . A A . 24 ARG CZ 1 1 8 4042 1 1 24 ARG H H -5.114 2.699 0.066 1.00 . A A . 24 ARG H 1 1 8 4043 1 1 24 ARG HA H -7.783 2.500 0.997 1.00 . A A . 24 ARG HA 1 1 8 4044 1 1 24 ARG HB2 H -6.415 4.460 -0.825 1.00 . A A . 24 ARG HB2 1 1 8 4045 1 1 24 ARG HB3 H -8.123 4.592 -0.432 1.00 . A A . 24 ARG HB3 1 1 8 4046 1 1 24 ARG HD2 H -6.599 6.962 1.921 1.00 . A A . 24 ARG HD2 1 1 8 4047 1 1 24 ARG HD3 H -6.054 6.729 0.262 1.00 . A A . 24 ARG HD3 1 1 8 4048 1 1 24 ARG HE H -8.584 6.386 -0.160 1.00 . A A . 24 ARG HE 1 1 8 4049 1 1 24 ARG HG2 H -7.541 4.721 1.953 1.00 . A A . 24 ARG HG2 1 1 8 4050 1 1 24 ARG HG3 H -5.832 4.662 1.518 1.00 . A A . 24 ARG HG3 1 1 8 4051 1 1 24 ARG HH11 H -8.488 9.774 1.994 1.00 . A A . 24 ARG HH11 1 1 8 4052 1 1 24 ARG HH12 H -7.199 8.627 2.150 1.00 . A A . 24 ARG HH12 1 1 8 4053 1 1 24 ARG HH21 H -10.253 9.346 0.572 1.00 . A A . 24 ARG HH21 1 1 8 4054 1 1 24 ARG HH22 H -10.284 7.879 -0.356 1.00 . A A . 24 ARG HH22 1 1 8 4055 1 1 24 ARG N N -5.912 2.134 0.228 1.00 . A A . 24 ARG N 1 1 8 4056 1 1 24 ARG NE N -8.110 6.957 0.488 1.00 . A A . 24 ARG NE 1 1 8 4057 1 1 24 ARG NH1 N -8.070 8.902 1.731 1.00 . A A . 24 ARG NH1 1 1 8 4058 1 1 24 ARG NH2 N -9.827 8.476 0.312 1.00 . A A . 24 ARG NH2 1 1 8 4059 1 1 24 ARG O O -9.204 2.353 -1.255 1.00 . A A . 24 ARG O 1 1 8 4060 1 1 25 THR C C -8.634 -0.738 -2.389 1.00 . A A . 25 THR C 1 1 8 4061 1 1 25 THR CA C -8.007 0.541 -2.948 1.00 . A A . 25 THR CA 1 1 8 4062 1 1 25 THR CB C -7.048 0.205 -4.125 1.00 . A A . 25 THR CB 1 1 8 4063 1 1 25 THR CG2 C -6.251 -1.067 -3.864 1.00 . A A . 25 THR CG2 1 1 8 4064 1 1 25 THR H H -6.372 1.147 -1.746 1.00 . A A . 25 THR H 1 1 8 4065 1 1 25 THR HA H -8.796 1.173 -3.326 1.00 . A A . 25 THR HA 1 1 8 4066 1 1 25 THR HB H -6.356 1.025 -4.252 1.00 . A A . 25 THR HB 1 1 8 4067 1 1 25 THR HG1 H -8.146 0.893 -5.613 1.00 . A A . 25 THR HG1 1 1 8 4068 1 1 25 THR HG21 H -5.627 -1.283 -4.719 1.00 . A A . 25 THR HG21 1 1 8 4069 1 1 25 THR HG22 H -6.931 -1.888 -3.697 1.00 . A A . 25 THR HG22 1 1 8 4070 1 1 25 THR HG23 H -5.631 -0.930 -2.991 1.00 . A A . 25 THR HG23 1 1 8 4071 1 1 25 THR N N -7.339 1.266 -1.879 1.00 . A A . 25 THR N 1 1 8 4072 1 1 25 THR O O -9.649 -1.220 -2.895 1.00 . A A . 25 THR O 1 1 8 4073 1 1 25 THR OG1 O -7.797 0.036 -5.336 1.00 . A A . 25 THR OG1 1 1 8 4074 1 1 26 HIS C C -9.678 -2.075 0.282 1.00 . A A . 26 HIS C 1 1 8 4075 1 1 26 HIS CA C -8.560 -2.460 -0.672 1.00 . A A . 26 HIS CA 1 1 8 4076 1 1 26 HIS CB C -7.458 -3.201 0.093 1.00 . A A . 26 HIS CB 1 1 8 4077 1 1 26 HIS CD2 C -5.069 -3.474 -0.863 1.00 . A A . 26 HIS CD2 1 1 8 4078 1 1 26 HIS CE1 C -5.406 -5.132 -2.236 1.00 . A A . 26 HIS CE1 1 1 8 4079 1 1 26 HIS CG C -6.386 -3.791 -0.773 1.00 . A A . 26 HIS CG 1 1 8 4080 1 1 26 HIS H H -7.240 -0.831 -0.950 1.00 . A A . 26 HIS H 1 1 8 4081 1 1 26 HIS HA H -8.959 -3.107 -1.437 1.00 . A A . 26 HIS HA 1 1 8 4082 1 1 26 HIS HB2 H -6.981 -2.512 0.775 1.00 . A A . 26 HIS HB2 1 1 8 4083 1 1 26 HIS HB3 H -7.905 -4.003 0.661 1.00 . A A . 26 HIS HB3 1 1 8 4084 1 1 26 HIS HD1 H -7.439 -5.311 -1.817 1.00 . A A . 26 HIS HD1 1 1 8 4085 1 1 26 HIS HD2 H -4.556 -2.700 -0.314 1.00 . A A . 26 HIS HD2 1 1 8 4086 1 1 26 HIS HE1 H -5.241 -5.913 -2.962 1.00 . A A . 26 HIS HE1 1 1 8 4087 1 1 26 HIS N N -8.041 -1.266 -1.320 1.00 . A A . 26 HIS N 1 1 8 4088 1 1 26 HIS ND1 N -6.587 -4.849 -1.654 1.00 . A A . 26 HIS ND1 1 1 8 4089 1 1 26 HIS NE2 N -4.485 -4.324 -1.780 1.00 . A A . 26 HIS NE2 1 1 8 4090 1 1 26 HIS O O -10.734 -2.709 0.316 1.00 . A A . 26 HIS O 1 1 8 4091 1 1 27 THR C C -10.109 0.937 2.329 1.00 . A A . 27 THR C 1 1 8 4092 1 1 27 THR CA C -10.438 -0.510 1.967 1.00 . A A . 27 THR CA 1 1 8 4093 1 1 27 THR CB C -10.542 -1.386 3.241 1.00 . A A . 27 THR CB 1 1 8 4094 1 1 27 THR CG2 C -9.290 -1.276 4.101 1.00 . A A . 27 THR CG2 1 1 8 4095 1 1 27 THR H H -8.567 -0.572 0.993 1.00 . A A . 27 THR H 1 1 8 4096 1 1 27 THR HA H -11.392 -0.533 1.462 1.00 . A A . 27 THR HA 1 1 8 4097 1 1 27 THR HB H -10.656 -2.415 2.934 1.00 . A A . 27 THR HB 1 1 8 4098 1 1 27 THR HG1 H -12.485 -1.369 3.599 1.00 . A A . 27 THR HG1 1 1 8 4099 1 1 27 THR HG21 H -9.397 -1.902 4.976 1.00 . A A . 27 THR HG21 1 1 8 4100 1 1 27 THR HG22 H -9.155 -0.250 4.409 1.00 . A A . 27 THR HG22 1 1 8 4101 1 1 27 THR HG23 H -8.431 -1.596 3.530 1.00 . A A . 27 THR HG23 1 1 8 4102 1 1 27 THR N N -9.442 -1.023 1.050 1.00 . A A . 27 THR N 1 1 8 4103 1 1 27 THR O O -8.938 1.322 2.381 1.00 . A A . 27 THR O 1 1 8 4104 1 1 27 THR OG1 O -11.690 -1.009 4.013 1.00 . A A . 27 THR OG1 1 1 8 4105 1 1 28 GLY C C -11.942 3.982 2.042 1.00 . A A . 28 GLY C 1 1 8 4106 1 1 28 GLY CA C -10.948 3.144 2.810 1.00 . A A . 28 GLY CA 1 1 8 4107 1 1 28 GLY H H -12.046 1.357 2.559 1.00 . A A . 28 GLY H 1 1 8 4108 1 1 28 GLY HA2 H -11.067 3.331 3.867 1.00 . A A . 28 GLY HA2 1 1 8 4109 1 1 28 GLY HA3 H -9.950 3.423 2.512 1.00 . A A . 28 GLY HA3 1 1 8 4110 1 1 28 GLY N N -11.140 1.733 2.556 1.00 . A A . 28 GLY N 1 1 8 4111 1 1 28 GLY O O -11.571 4.942 1.364 1.00 . A A . 28 GLY O 1 1 8 4112 1 1 29 GLU C C -14.705 5.553 2.160 1.00 . A A . 29 GLU C 1 1 8 4113 1 1 29 GLU CA C -14.274 4.289 1.423 1.00 . A A . 29 GLU CA 1 1 8 4114 1 1 29 GLU CB C -15.469 3.347 1.244 1.00 . A A . 29 GLU CB 1 1 8 4115 1 1 29 GLU CD C -16.330 1.155 0.346 1.00 . A A . 29 GLU CD 1 1 8 4116 1 1 29 GLU CG C -15.156 2.106 0.424 1.00 . A A . 29 GLU CG 1 1 8 4117 1 1 29 GLU H H -13.439 2.877 2.752 1.00 . A A . 29 GLU H 1 1 8 4118 1 1 29 GLU HA H -13.891 4.563 0.452 1.00 . A A . 29 GLU HA 1 1 8 4119 1 1 29 GLU HB2 H -15.813 3.032 2.218 1.00 . A A . 29 GLU HB2 1 1 8 4120 1 1 29 GLU HB3 H -16.265 3.885 0.752 1.00 . A A . 29 GLU HB3 1 1 8 4121 1 1 29 GLU HG2 H -14.893 2.409 -0.578 1.00 . A A . 29 GLU HG2 1 1 8 4122 1 1 29 GLU HG3 H -14.321 1.589 0.872 1.00 . A A . 29 GLU HG3 1 1 8 4123 1 1 29 GLU N N -13.209 3.615 2.150 1.00 . A A . 29 GLU N 1 1 8 4124 1 1 29 GLU O O -15.797 5.613 2.726 1.00 . A A . 29 GLU O 1 1 8 4125 1 1 29 GLU OE1 O -16.494 0.328 1.266 1.00 . A A . 29 GLU OE1 1 1 8 4126 1 1 29 GLU OE2 O -17.097 1.231 -0.636 1.00 . A A . 29 GLU OE2 1 1 8 4127 1 1 30 LYS C C -15.133 8.638 2.116 1.00 . A A . 30 LYS C 1 1 8 4128 1 1 30 LYS CA C -14.084 7.809 2.843 1.00 . A A . 30 LYS CA 1 1 8 4129 1 1 30 LYS CB C -12.783 8.609 2.973 1.00 . A A . 30 LYS CB 1 1 8 4130 1 1 30 LYS CD C -12.074 7.464 5.109 1.00 . A A . 30 LYS CD 1 1 8 4131 1 1 30 LYS CE C -12.381 8.675 5.976 1.00 . A A . 30 LYS CE 1 1 8 4132 1 1 30 LYS CG C -11.669 7.864 3.697 1.00 . A A . 30 LYS CG 1 1 8 4133 1 1 30 LYS H H -13.005 6.452 1.635 1.00 . A A . 30 LYS H 1 1 8 4134 1 1 30 LYS HA H -14.451 7.570 3.830 1.00 . A A . 30 LYS HA 1 1 8 4135 1 1 30 LYS HB2 H -12.431 8.860 1.984 1.00 . A A . 30 LYS HB2 1 1 8 4136 1 1 30 LYS HB3 H -12.987 9.521 3.513 1.00 . A A . 30 LYS HB3 1 1 8 4137 1 1 30 LYS HD2 H -12.954 6.842 5.058 1.00 . A A . 30 LYS HD2 1 1 8 4138 1 1 30 LYS HD3 H -11.266 6.907 5.560 1.00 . A A . 30 LYS HD3 1 1 8 4139 1 1 30 LYS HE2 H -11.508 9.309 6.008 1.00 . A A . 30 LYS HE2 1 1 8 4140 1 1 30 LYS HE3 H -13.204 9.218 5.533 1.00 . A A . 30 LYS HE3 1 1 8 4141 1 1 30 LYS HG2 H -11.426 6.972 3.139 1.00 . A A . 30 LYS HG2 1 1 8 4142 1 1 30 LYS HG3 H -10.799 8.503 3.749 1.00 . A A . 30 LYS HG3 1 1 8 4143 1 1 30 LYS HZ1 H -13.559 7.635 7.347 1.00 . A A . 30 LYS HZ1 1 1 8 4144 1 1 30 LYS HZ2 H -13.011 9.128 7.911 1.00 . A A . 30 LYS HZ2 1 1 8 4145 1 1 30 LYS HZ3 H -11.947 7.815 7.830 1.00 . A A . 30 LYS HZ3 1 1 8 4146 1 1 30 LYS N N -13.838 6.556 2.142 1.00 . A A . 30 LYS N 1 1 8 4147 1 1 30 LYS NZ N -12.750 8.285 7.362 1.00 . A A . 30 LYS NZ 1 1 8 4148 1 1 30 LYS O O -14.815 9.421 1.222 1.00 . A A . 30 LYS O 1 1 8 4149 1 1 31 NH2 HN1 H -16.558 7.814 3.213 1.00 . A A . 31 NH2 HN1 1 1 8 4150 1 1 31 NH2 HN2 H -17.086 8.968 2.035 1.00 . A A . 31 NH2 HN2 1 1 8 4151 1 1 31 NH2 N N -16.384 8.456 2.491 1.00 . A A . 31 NH2 N 1 1 8 4152 2 2 1 ZN ZN ZN -2.557 -4.304 -2.301 1.00 . B A . 101 ZN ZN 1 1 9 4153 1 1 1 ARG C C 11.728 -0.930 2.540 1.00 . A A . 1 ARG C 1 1 9 4154 1 1 1 ARG CA C 12.743 -1.321 3.608 1.00 . A A . 1 ARG CA 1 1 9 4155 1 1 1 ARG CB C 12.007 -1.660 4.913 1.00 . A A . 1 ARG CB 1 1 9 4156 1 1 1 ARG CD C 10.301 -0.956 6.631 1.00 . A A . 1 ARG CD 1 1 9 4157 1 1 1 ARG CG C 11.202 -0.502 5.490 1.00 . A A . 1 ARG CG 1 1 9 4158 1 1 1 ARG CZ C 8.276 0.085 7.599 1.00 . A A . 1 ARG CZ 1 1 9 4159 1 1 1 ARG H1 H 13.207 0.645 4.101 1.00 . A A . 1 ARG H1 1 1 9 4160 1 1 1 ARG H2 H 14.236 -0.034 2.947 1.00 . A A . 1 ARG H2 1 1 9 4161 1 1 1 ARG H3 H 14.385 -0.474 4.571 1.00 . A A . 1 ARG H3 1 1 9 4162 1 1 1 ARG HA H 13.289 -2.188 3.269 1.00 . A A . 1 ARG HA 1 1 9 4163 1 1 1 ARG HB2 H 11.331 -2.482 4.727 1.00 . A A . 1 ARG HB2 1 1 9 4164 1 1 1 ARG HB3 H 12.733 -1.967 5.651 1.00 . A A . 1 ARG HB3 1 1 9 4165 1 1 1 ARG HD2 H 9.602 -1.684 6.252 1.00 . A A . 1 ARG HD2 1 1 9 4166 1 1 1 ARG HD3 H 10.911 -1.408 7.398 1.00 . A A . 1 ARG HD3 1 1 9 4167 1 1 1 ARG HE H 10.036 1.006 7.340 1.00 . A A . 1 ARG HE 1 1 9 4168 1 1 1 ARG HG2 H 11.883 0.250 5.860 1.00 . A A . 1 ARG HG2 1 1 9 4169 1 1 1 ARG HG3 H 10.589 -0.080 4.708 1.00 . A A . 1 ARG HG3 1 1 9 4170 1 1 1 ARG HH11 H 6.623 -1.081 7.709 1.00 . A A . 1 ARG HH11 1 1 9 4171 1 1 1 ARG HH12 H 8.007 -1.829 6.977 1.00 . A A . 1 ARG HH12 1 1 9 4172 1 1 1 ARG HH21 H 8.199 1.996 8.280 1.00 . A A . 1 ARG HH21 1 1 9 4173 1 1 1 ARG HH22 H 6.725 1.094 8.426 1.00 . A A . 1 ARG HH22 1 1 9 4174 1 1 1 ARG N N 13.710 -0.221 3.822 1.00 . A A . 1 ARG N 1 1 9 4175 1 1 1 ARG NE N 9.553 0.157 7.216 1.00 . A A . 1 ARG NE 1 1 9 4176 1 1 1 ARG NH1 N 7.582 -1.032 7.417 1.00 . A A . 1 ARG NH1 1 1 9 4177 1 1 1 ARG NH2 N 7.688 1.140 8.149 1.00 . A A . 1 ARG NH2 1 1 9 4178 1 1 1 ARG O O 11.268 0.213 2.505 1.00 . A A . 1 ARG O 1 1 9 4179 1 1 2 PRO C C 8.947 -1.803 1.278 1.00 . A A . 2 PRO C 1 1 9 4180 1 1 2 PRO CA C 10.328 -1.629 0.656 1.00 . A A . 2 PRO CA 1 1 9 4181 1 1 2 PRO CB C 10.589 -2.699 -0.400 1.00 . A A . 2 PRO CB 1 1 9 4182 1 1 2 PRO CD C 11.989 -3.199 1.493 1.00 . A A . 2 PRO CD 1 1 9 4183 1 1 2 PRO CG C 11.226 -3.822 0.348 1.00 . A A . 2 PRO CG 1 1 9 4184 1 1 2 PRO HA H 10.406 -0.647 0.213 1.00 . A A . 2 PRO HA 1 1 9 4185 1 1 2 PRO HB2 H 9.651 -3.001 -0.846 1.00 . A A . 2 PRO HB2 1 1 9 4186 1 1 2 PRO HB3 H 11.248 -2.307 -1.161 1.00 . A A . 2 PRO HB3 1 1 9 4187 1 1 2 PRO HD2 H 11.856 -3.781 2.394 1.00 . A A . 2 PRO HD2 1 1 9 4188 1 1 2 PRO HD3 H 13.038 -3.119 1.248 1.00 . A A . 2 PRO HD3 1 1 9 4189 1 1 2 PRO HG2 H 10.462 -4.488 0.726 1.00 . A A . 2 PRO HG2 1 1 9 4190 1 1 2 PRO HG3 H 11.899 -4.359 -0.304 1.00 . A A . 2 PRO HG3 1 1 9 4191 1 1 2 PRO N N 11.380 -1.860 1.638 1.00 . A A . 2 PRO N 1 1 9 4192 1 1 2 PRO O O 8.693 -2.775 1.988 1.00 . A A . 2 PRO O 1 1 9 4193 1 1 3 PHE C C 5.818 -1.795 0.794 1.00 . A A . 3 PHE C 1 1 9 4194 1 1 3 PHE CA C 6.733 -0.889 1.602 1.00 . A A . 3 PHE CA 1 1 9 4195 1 1 3 PHE CB C 6.178 0.531 1.700 1.00 . A A . 3 PHE CB 1 1 9 4196 1 1 3 PHE CD1 C 7.969 2.250 2.063 1.00 . A A . 3 PHE CD1 1 1 9 4197 1 1 3 PHE CD2 C 6.836 1.365 3.961 1.00 . A A . 3 PHE CD2 1 1 9 4198 1 1 3 PHE CE1 C 8.744 3.041 2.889 1.00 . A A . 3 PHE CE1 1 1 9 4199 1 1 3 PHE CE2 C 7.606 2.155 4.792 1.00 . A A . 3 PHE CE2 1 1 9 4200 1 1 3 PHE CG C 7.007 1.406 2.591 1.00 . A A . 3 PHE CG 1 1 9 4201 1 1 3 PHE CZ C 8.561 2.993 4.255 1.00 . A A . 3 PHE CZ 1 1 9 4202 1 1 3 PHE H H 8.297 -0.138 0.395 1.00 . A A . 3 PHE H 1 1 9 4203 1 1 3 PHE HA H 6.824 -1.295 2.599 1.00 . A A . 3 PHE HA 1 1 9 4204 1 1 3 PHE HB2 H 6.155 0.976 0.717 1.00 . A A . 3 PHE HB2 1 1 9 4205 1 1 3 PHE HB3 H 5.178 0.499 2.101 1.00 . A A . 3 PHE HB3 1 1 9 4206 1 1 3 PHE HD1 H 8.112 2.290 0.993 1.00 . A A . 3 PHE HD1 1 1 9 4207 1 1 3 PHE HD2 H 6.086 0.711 4.382 1.00 . A A . 3 PHE HD2 1 1 9 4208 1 1 3 PHE HE1 H 9.490 3.696 2.466 1.00 . A A . 3 PHE HE1 1 1 9 4209 1 1 3 PHE HE2 H 7.459 2.116 5.861 1.00 . A A . 3 PHE HE2 1 1 9 4210 1 1 3 PHE HZ H 9.166 3.610 4.903 1.00 . A A . 3 PHE HZ 1 1 9 4211 1 1 3 PHE N N 8.061 -0.863 1.013 1.00 . A A . 3 PHE N 1 1 9 4212 1 1 3 PHE O O 5.227 -1.383 -0.199 1.00 . A A . 3 PHE O 1 1 9 4213 1 1 4 NLE C C 3.587 -4.208 1.011 1.00 . A A . 4 NLE C 1 1 9 4214 1 1 4 NLE CA C 5.013 -4.068 0.498 1.00 . A A . 4 NLE CA 1 1 9 4215 1 1 4 NLE CB C 5.757 -5.401 0.634 1.00 . A A . 4 NLE CB 1 1 9 4216 1 1 4 NLE CD C 5.979 -7.811 -0.030 1.00 . A A . 4 NLE CD 1 1 9 4217 1 1 4 NLE CE C 5.399 -8.915 -0.887 1.00 . A A . 4 NLE CE 1 1 9 4218 1 1 4 NLE CG C 5.174 -6.531 -0.200 1.00 . A A . 4 NLE CG 1 1 9 4219 1 1 4 NLE H H 6.158 -3.271 2.082 1.00 . A A . 4 NLE H 1 1 9 4220 1 1 4 NLE HA H 4.984 -3.783 -0.542 1.00 . A A . 4 NLE HA 1 1 9 4221 1 1 4 NLE HB2 H 5.733 -5.703 1.671 1.00 . A A . 4 NLE HB2 1 1 9 4222 1 1 4 NLE HB3 H 6.785 -5.258 0.338 1.00 . A A . 4 NLE HB3 1 1 9 4223 1 1 4 NLE HD2 H 5.945 -8.119 1.004 1.00 . A A . 4 NLE HD2 1 1 9 4224 1 1 4 NLE HD3 H 7.001 -7.636 -0.332 1.00 . A A . 4 NLE HD3 1 1 9 4225 1 1 4 NLE HE1 H 4.385 -9.114 -0.579 1.00 . A A . 4 NLE HE1 1 1 9 4226 1 1 4 NLE HE2 H 5.993 -9.810 -0.772 1.00 . A A . 4 NLE HE2 1 1 9 4227 1 1 4 NLE HE3 H 5.407 -8.608 -1.922 1.00 . A A . 4 NLE HE3 1 1 9 4228 1 1 4 NLE HG2 H 5.186 -6.244 -1.241 1.00 . A A . 4 NLE HG2 1 1 9 4229 1 1 4 NLE HG3 H 4.158 -6.713 0.116 1.00 . A A . 4 NLE HG3 1 1 9 4230 1 1 4 NLE N N 5.731 -3.038 1.229 1.00 . A A . 4 NLE N 1 1 9 4231 1 1 4 NLE O O 3.355 -4.249 2.223 1.00 . A A . 4 NLE O 1 1 9 4232 1 1 5 CYS C C 1.096 -5.900 1.013 1.00 . A A . 5 CYS C 1 1 9 4233 1 1 5 CYS CA C 1.248 -4.503 0.426 1.00 . A A . 5 CYS CA 1 1 9 4234 1 1 5 CYS CB C 0.351 -4.336 -0.804 1.00 . A A . 5 CYS CB 1 1 9 4235 1 1 5 CYS H H 2.883 -4.118 -0.856 1.00 . A A . 5 CYS H 1 1 9 4236 1 1 5 CYS HA H 0.957 -3.781 1.172 1.00 . A A . 5 CYS HA 1 1 9 4237 1 1 5 CYS HB2 H 0.376 -3.303 -1.121 1.00 . A A . 5 CYS HB2 1 1 9 4238 1 1 5 CYS HB3 H 0.724 -4.959 -1.600 1.00 . A A . 5 CYS HB3 1 1 9 4239 1 1 5 CYS N N 2.637 -4.257 0.085 1.00 . A A . 5 CYS N 1 1 9 4240 1 1 5 CYS O O 1.767 -6.842 0.587 1.00 . A A . 5 CYS O 1 1 9 4241 1 1 5 CYS SG S -1.379 -4.778 -0.516 1.00 . A A . 5 CYS SG 1 1 9 4242 1 1 6 THR C C -1.394 -7.785 2.537 1.00 . A A . 6 THR C 1 1 9 4243 1 1 6 THR CA C 0.035 -7.282 2.693 1.00 . A A . 6 THR CA 1 1 9 4244 1 1 6 THR CB C 0.372 -7.126 4.182 1.00 . A A . 6 THR CB 1 1 9 4245 1 1 6 THR CG2 C 1.878 -7.120 4.400 1.00 . A A . 6 THR CG2 1 1 9 4246 1 1 6 THR H H -0.290 -5.244 2.282 1.00 . A A . 6 THR H 1 1 9 4247 1 1 6 THR HA H 0.711 -8.006 2.266 1.00 . A A . 6 THR HA 1 1 9 4248 1 1 6 THR HB H -0.053 -7.958 4.724 1.00 . A A . 6 THR HB 1 1 9 4249 1 1 6 THR HG1 H -0.685 -6.082 5.491 1.00 . A A . 6 THR HG1 1 1 9 4250 1 1 6 THR HG21 H 2.293 -8.062 4.072 1.00 . A A . 6 THR HG21 1 1 9 4251 1 1 6 THR HG22 H 2.089 -6.978 5.448 1.00 . A A . 6 THR HG22 1 1 9 4252 1 1 6 THR HG23 H 2.320 -6.315 3.831 1.00 . A A . 6 THR HG23 1 1 9 4253 1 1 6 THR N N 0.230 -6.024 2.002 1.00 . A A . 6 THR N 1 1 9 4254 1 1 6 THR O O -1.929 -8.464 3.417 1.00 . A A . 6 THR O 1 1 9 4255 1 1 6 THR OG1 O -0.196 -5.903 4.677 1.00 . A A . 6 THR OG1 1 1 9 4256 1 1 7 TRP C C -3.359 -9.053 0.183 1.00 . A A . 7 TRP C 1 1 9 4257 1 1 7 TRP CA C -3.369 -7.878 1.151 1.00 . A A . 7 TRP CA 1 1 9 4258 1 1 7 TRP CB C -4.183 -6.717 0.581 1.00 . A A . 7 TRP CB 1 1 9 4259 1 1 7 TRP CD1 C -6.548 -7.633 0.231 1.00 . A A . 7 TRP CD1 1 1 9 4260 1 1 7 TRP CD2 C -6.379 -6.086 1.836 1.00 . A A . 7 TRP CD2 1 1 9 4261 1 1 7 TRP CE2 C -7.720 -6.497 1.754 1.00 . A A . 7 TRP CE2 1 1 9 4262 1 1 7 TRP CE3 C -6.026 -5.116 2.775 1.00 . A A . 7 TRP CE3 1 1 9 4263 1 1 7 TRP CG C -5.647 -6.826 0.859 1.00 . A A . 7 TRP CG 1 1 9 4264 1 1 7 TRP CH2 C -8.337 -5.019 3.488 1.00 . A A . 7 TRP CH2 1 1 9 4265 1 1 7 TRP CZ2 C -8.711 -5.970 2.578 1.00 . A A . 7 TRP CZ2 1 1 9 4266 1 1 7 TRP CZ3 C -7.008 -4.591 3.592 1.00 . A A . 7 TRP CZ3 1 1 9 4267 1 1 7 TRP H H -1.530 -6.932 0.735 1.00 . A A . 7 TRP H 1 1 9 4268 1 1 7 TRP HA H -3.809 -8.195 2.083 1.00 . A A . 7 TRP HA 1 1 9 4269 1 1 7 TRP HB2 H -3.832 -5.794 1.012 1.00 . A A . 7 TRP HB2 1 1 9 4270 1 1 7 TRP HB3 H -4.049 -6.682 -0.487 1.00 . A A . 7 TRP HB3 1 1 9 4271 1 1 7 TRP HD1 H -6.299 -8.316 -0.564 1.00 . A A . 7 TRP HD1 1 1 9 4272 1 1 7 TRP HE1 H -8.617 -7.913 0.488 1.00 . A A . 7 TRP HE1 1 1 9 4273 1 1 7 TRP HE3 H -5.004 -4.776 2.866 1.00 . A A . 7 TRP HE3 1 1 9 4274 1 1 7 TRP HH2 H -9.073 -4.581 4.145 1.00 . A A . 7 TRP HH2 1 1 9 4275 1 1 7 TRP HZ2 H -9.740 -6.291 2.512 1.00 . A A . 7 TRP HZ2 1 1 9 4276 1 1 7 TRP HZ3 H -6.755 -3.838 4.323 1.00 . A A . 7 TRP HZ3 1 1 9 4277 1 1 7 TRP N N -2.009 -7.458 1.414 1.00 . A A . 7 TRP N 1 1 9 4278 1 1 7 TRP NE1 N -7.799 -7.446 0.768 1.00 . A A . 7 TRP NE1 1 1 9 4279 1 1 7 TRP O O -3.706 -8.915 -0.990 1.00 . A A . 7 TRP O 1 1 9 4280 1 1 8 ORN C C -1.432 -10.851 -3.494 1.00 . A A . 8 ORN C 1 1 9 4281 1 1 8 ORN CA C -2.079 -12.155 -3.044 1.00 . A A . 8 ORN CA 1 1 9 4282 1 1 8 ORN CB C -1.396 -12.668 -1.770 1.00 . A A . 8 ORN CB 1 1 9 4283 1 1 8 ORN CD C -2.832 -11.424 -0.114 1.00 . A A . 8 ORN CD 1 1 9 4284 1 1 8 ORN CG C -1.417 -11.670 -0.622 1.00 . A A . 8 ORN CG 1 1 9 4285 1 1 8 ORN H H -0.987 -13.331 -4.366 1.00 . A A . 8 ORN H 1 1 9 4286 1 1 8 ORN HA H -3.123 -11.974 -2.841 1.00 . A A . 8 ORN HA 1 1 9 4287 1 1 8 ORN HB2 H -0.368 -12.905 -1.996 1.00 . A A . 8 ORN HB2 1 1 9 4288 1 1 8 ORN HB3 H -1.900 -13.566 -1.445 1.00 . A A . 8 ORN HB3 1 1 9 4289 1 1 8 ORN HD2 H -3.133 -12.261 0.500 1.00 . A A . 8 ORN HD2 1 1 9 4290 1 1 8 ORN HD3 H -3.497 -11.342 -0.958 1.00 . A A . 8 ORN HD3 1 1 9 4291 1 1 8 ORN HE1 H -2.639 -10.236 1.611 1.00 . A A . 8 ORN HE1 1 1 9 4292 1 1 8 ORN HG2 H -1.000 -10.735 -0.966 1.00 . A A . 8 ORN HG2 1 1 9 4293 1 1 8 ORN HG3 H -0.817 -12.057 0.188 1.00 . A A . 8 ORN HG3 1 1 9 4294 1 1 8 ORN N N -1.983 -13.165 -4.120 1.00 . A A . 8 ORN N 1 1 9 4295 1 1 8 ORN NE N -2.920 -10.201 0.672 1.00 . A A . 8 ORN NE 1 1 9 4296 1 1 8 ORN O O -0.363 -10.861 -4.106 1.00 . A A . 8 ORN O 1 1 9 4297 1 1 9 CYS C C -0.404 -8.021 -2.705 1.00 . A A . 9 CYS C 1 1 9 4298 1 1 9 CYS CA C -1.582 -8.430 -3.584 1.00 . A A . 9 CYS CA 1 1 9 4299 1 1 9 CYS CB C -2.700 -7.395 -3.490 1.00 . A A . 9 CYS CB 1 1 9 4300 1 1 9 CYS H H -2.911 -9.788 -2.666 1.00 . A A . 9 CYS H 1 1 9 4301 1 1 9 CYS HA H -1.249 -8.498 -4.609 1.00 . A A . 9 CYS HA 1 1 9 4302 1 1 9 CYS HB2 H -3.537 -7.721 -4.087 1.00 . A A . 9 CYS HB2 1 1 9 4303 1 1 9 CYS HB3 H -3.013 -7.310 -2.459 1.00 . A A . 9 CYS HB3 1 1 9 4304 1 1 9 CYS N N -2.078 -9.734 -3.187 1.00 . A A . 9 CYS N 1 1 9 4305 1 1 9 CYS O O -0.542 -7.885 -1.487 1.00 . A A . 9 CYS O 1 1 9 4306 1 1 9 CYS SG S -2.232 -5.746 -4.058 1.00 . A A . 9 CYS SG 1 1 9 4307 1 1 10 GLY C C 2.846 -6.544 -3.375 1.00 . A A . 10 GLY C 1 1 9 4308 1 1 10 GLY CA C 1.941 -7.476 -2.595 1.00 . A A . 10 GLY CA 1 1 9 4309 1 1 10 GLY H H 0.792 -7.927 -4.303 1.00 . A A . 10 GLY H 1 1 9 4310 1 1 10 GLY HA2 H 1.653 -6.995 -1.672 1.00 . A A . 10 GLY HA2 1 1 9 4311 1 1 10 GLY HA3 H 2.484 -8.377 -2.363 1.00 . A A . 10 GLY HA3 1 1 9 4312 1 1 10 GLY N N 0.750 -7.829 -3.329 1.00 . A A . 10 GLY N 1 1 9 4313 1 1 10 GLY O O 4.033 -6.824 -3.547 1.00 . A A . 10 GLY O 1 1 9 4314 1 1 11 LYS C C 4.002 -3.728 -3.548 1.00 . A A . 11 LYS C 1 1 9 4315 1 1 11 LYS CA C 3.081 -4.425 -4.543 1.00 . A A . 11 LYS CA 1 1 9 4316 1 1 11 LYS CB C 2.185 -3.396 -5.238 1.00 . A A . 11 LYS CB 1 1 9 4317 1 1 11 LYS CD C 0.879 -2.758 -7.286 1.00 . A A . 11 LYS CD 1 1 9 4318 1 1 11 LYS CE C 0.510 -3.148 -8.711 1.00 . A A . 11 LYS CE 1 1 9 4319 1 1 11 LYS CG C 1.624 -3.873 -6.568 1.00 . A A . 11 LYS CG 1 1 9 4320 1 1 11 LYS H H 1.316 -5.332 -3.796 1.00 . A A . 11 LYS H 1 1 9 4321 1 1 11 LYS HA H 3.691 -4.917 -5.287 1.00 . A A . 11 LYS HA 1 1 9 4322 1 1 11 LYS HB2 H 1.354 -3.161 -4.588 1.00 . A A . 11 LYS HB2 1 1 9 4323 1 1 11 LYS HB3 H 2.757 -2.497 -5.415 1.00 . A A . 11 LYS HB3 1 1 9 4324 1 1 11 LYS HD2 H -0.026 -2.536 -6.739 1.00 . A A . 11 LYS HD2 1 1 9 4325 1 1 11 LYS HD3 H 1.508 -1.880 -7.313 1.00 . A A . 11 LYS HD3 1 1 9 4326 1 1 11 LYS HE2 H 0.047 -2.302 -9.193 1.00 . A A . 11 LYS HE2 1 1 9 4327 1 1 11 LYS HE3 H 1.413 -3.411 -9.241 1.00 . A A . 11 LYS HE3 1 1 9 4328 1 1 11 LYS HG2 H 2.440 -4.209 -7.191 1.00 . A A . 11 LYS HG2 1 1 9 4329 1 1 11 LYS HG3 H 0.944 -4.690 -6.388 1.00 . A A . 11 LYS HG3 1 1 9 4330 1 1 11 LYS HZ1 H -1.293 -4.083 -8.224 1.00 . A A . 11 LYS HZ1 1 1 9 4331 1 1 11 LYS HZ2 H 0.014 -5.147 -8.349 1.00 . A A . 11 LYS HZ2 1 1 9 4332 1 1 11 LYS HZ3 H -0.689 -4.506 -9.744 1.00 . A A . 11 LYS HZ3 1 1 9 4333 1 1 11 LYS N N 2.286 -5.449 -3.873 1.00 . A A . 11 LYS N 1 1 9 4334 1 1 11 LYS NZ N -0.428 -4.300 -8.758 1.00 . A A . 11 LYS NZ 1 1 9 4335 1 1 11 LYS O O 3.630 -3.508 -2.397 1.00 . A A . 11 LYS O 1 1 9 4336 1 1 12 ARG C C 6.379 -1.299 -3.524 1.00 . A A . 12 ARG C 1 1 9 4337 1 1 12 ARG CA C 6.186 -2.757 -3.134 1.00 . A A . 12 ARG CA 1 1 9 4338 1 1 12 ARG CB C 7.522 -3.502 -3.190 1.00 . A A . 12 ARG CB 1 1 9 4339 1 1 12 ARG CD C 8.787 -5.626 -2.698 1.00 . A A . 12 ARG CD 1 1 9 4340 1 1 12 ARG CG C 7.432 -4.935 -2.693 1.00 . A A . 12 ARG CG 1 1 9 4341 1 1 12 ARG CZ C 9.681 -7.602 -1.516 1.00 . A A . 12 ARG CZ 1 1 9 4342 1 1 12 ARG H H 5.433 -3.576 -4.930 1.00 . A A . 12 ARG H 1 1 9 4343 1 1 12 ARG HA H 5.807 -2.792 -2.122 1.00 . A A . 12 ARG HA 1 1 9 4344 1 1 12 ARG HB2 H 7.867 -3.521 -4.212 1.00 . A A . 12 ARG HB2 1 1 9 4345 1 1 12 ARG HB3 H 8.243 -2.976 -2.583 1.00 . A A . 12 ARG HB3 1 1 9 4346 1 1 12 ARG HD2 H 9.155 -5.665 -3.712 1.00 . A A . 12 ARG HD2 1 1 9 4347 1 1 12 ARG HD3 H 9.472 -5.057 -2.086 1.00 . A A . 12 ARG HD3 1 1 9 4348 1 1 12 ARG HE H 7.845 -7.462 -2.305 1.00 . A A . 12 ARG HE 1 1 9 4349 1 1 12 ARG HG2 H 7.050 -4.929 -1.683 1.00 . A A . 12 ARG HG2 1 1 9 4350 1 1 12 ARG HG3 H 6.755 -5.484 -3.330 1.00 . A A . 12 ARG HG3 1 1 9 4351 1 1 12 ARG HH11 H 11.019 -6.098 -1.752 1.00 . A A . 12 ARG HH11 1 1 9 4352 1 1 12 ARG HH12 H 11.599 -7.475 -0.876 1.00 . A A . 12 ARG HH12 1 1 9 4353 1 1 12 ARG HH21 H 10.224 -9.292 -0.534 1.00 . A A . 12 ARG HH21 1 1 9 4354 1 1 12 ARG HH22 H 8.609 -9.284 -1.161 1.00 . A A . 12 ARG HH22 1 1 9 4355 1 1 12 ARG N N 5.204 -3.397 -3.994 1.00 . A A . 12 ARG N 1 1 9 4356 1 1 12 ARG NE N 8.698 -6.986 -2.171 1.00 . A A . 12 ARG NE 1 1 9 4357 1 1 12 ARG NH1 N 10.861 -7.011 -1.369 1.00 . A A . 12 ARG NH1 1 1 9 4358 1 1 12 ARG NH2 N 9.488 -8.823 -1.030 1.00 . A A . 12 ARG NH2 1 1 9 4359 1 1 12 ARG O O 6.570 -0.978 -4.699 1.00 . A A . 12 ARG O 1 1 9 4360 1 1 13 PHE C C 7.645 1.558 -2.027 1.00 . A A . 13 PHE C 1 1 9 4361 1 1 13 PHE CA C 6.415 1.003 -2.737 1.00 . A A . 13 PHE CA 1 1 9 4362 1 1 13 PHE CB C 5.146 1.670 -2.209 1.00 . A A . 13 PHE CB 1 1 9 4363 1 1 13 PHE CD1 C 3.426 1.628 -4.032 1.00 . A A . 13 PHE CD1 1 1 9 4364 1 1 13 PHE CD2 C 3.183 0.112 -2.210 1.00 . A A . 13 PHE CD2 1 1 9 4365 1 1 13 PHE CE1 C 2.271 1.134 -4.602 1.00 . A A . 13 PHE CE1 1 1 9 4366 1 1 13 PHE CE2 C 2.027 -0.386 -2.774 1.00 . A A . 13 PHE CE2 1 1 9 4367 1 1 13 PHE CG C 3.894 1.124 -2.830 1.00 . A A . 13 PHE CG 1 1 9 4368 1 1 13 PHE CZ C 1.587 0.103 -3.985 1.00 . A A . 13 PHE CZ 1 1 9 4369 1 1 13 PHE H H 6.198 -0.767 -1.615 1.00 . A A . 13 PHE H 1 1 9 4370 1 1 13 PHE HA H 6.500 1.189 -3.796 1.00 . A A . 13 PHE HA 1 1 9 4371 1 1 13 PHE HB2 H 5.081 1.519 -1.140 1.00 . A A . 13 PHE HB2 1 1 9 4372 1 1 13 PHE HB3 H 5.189 2.728 -2.418 1.00 . A A . 13 PHE HB3 1 1 9 4373 1 1 13 PHE HD1 H 3.972 2.419 -4.522 1.00 . A A . 13 PHE HD1 1 1 9 4374 1 1 13 PHE HD2 H 3.540 -0.287 -1.272 1.00 . A A . 13 PHE HD2 1 1 9 4375 1 1 13 PHE HE1 H 1.915 1.536 -5.540 1.00 . A A . 13 PHE HE1 1 1 9 4376 1 1 13 PHE HE2 H 1.481 -1.174 -2.280 1.00 . A A . 13 PHE HE2 1 1 9 4377 1 1 13 PHE HZ H 0.690 -0.294 -4.434 1.00 . A A . 13 PHE HZ 1 1 9 4378 1 1 13 PHE N N 6.321 -0.431 -2.530 1.00 . A A . 13 PHE N 1 1 9 4379 1 1 13 PHE O O 8.282 0.860 -1.232 1.00 . A A . 13 PHE O 1 1 9 4380 1 1 14 THR C C 8.806 4.352 -0.586 1.00 . A A . 14 THR C 1 1 9 4381 1 1 14 THR CA C 9.164 3.432 -1.750 1.00 . A A . 14 THR CA 1 1 9 4382 1 1 14 THR CB C 9.945 4.233 -2.809 1.00 . A A . 14 THR CB 1 1 9 4383 1 1 14 THR CG2 C 10.829 3.319 -3.644 1.00 . A A . 14 THR CG2 1 1 9 4384 1 1 14 THR H H 7.436 3.313 -2.965 1.00 . A A . 14 THR H 1 1 9 4385 1 1 14 THR HA H 9.809 2.647 -1.381 1.00 . A A . 14 THR HA 1 1 9 4386 1 1 14 THR HB H 10.575 4.948 -2.297 1.00 . A A . 14 THR HB 1 1 9 4387 1 1 14 THR HG1 H 8.136 4.903 -3.301 1.00 . A A . 14 THR HG1 1 1 9 4388 1 1 14 THR HG21 H 10.217 2.587 -4.145 1.00 . A A . 14 THR HG21 1 1 9 4389 1 1 14 THR HG22 H 11.539 2.817 -3.004 1.00 . A A . 14 THR HG22 1 1 9 4390 1 1 14 THR HG23 H 11.361 3.905 -4.378 1.00 . A A . 14 THR HG23 1 1 9 4391 1 1 14 THR N N 7.988 2.801 -2.330 1.00 . A A . 14 THR N 1 1 9 4392 1 1 14 THR O O 9.668 4.738 0.200 1.00 . A A . 14 THR O 1 1 9 4393 1 1 14 THR OG1 O 9.038 4.949 -3.666 1.00 . A A . 14 THR OG1 1 1 9 4394 1 1 15 ARG C C 5.811 5.026 1.221 1.00 . A A . 15 ARG C 1 1 9 4395 1 1 15 ARG CA C 7.075 5.591 0.580 1.00 . A A . 15 ARG CA 1 1 9 4396 1 1 15 ARG CB C 6.807 7.001 0.034 1.00 . A A . 15 ARG CB 1 1 9 4397 1 1 15 ARG CD C 7.687 9.011 -1.209 1.00 . A A . 15 ARG CD 1 1 9 4398 1 1 15 ARG CG C 7.976 7.593 -0.741 1.00 . A A . 15 ARG CG 1 1 9 4399 1 1 15 ARG CZ C 7.376 11.259 -0.231 1.00 . A A . 15 ARG CZ 1 1 9 4400 1 1 15 ARG H H 6.888 4.391 -1.155 1.00 . A A . 15 ARG H 1 1 9 4401 1 1 15 ARG HA H 7.855 5.641 1.325 1.00 . A A . 15 ARG HA 1 1 9 4402 1 1 15 ARG HB2 H 5.953 6.964 -0.621 1.00 . A A . 15 ARG HB2 1 1 9 4403 1 1 15 ARG HB3 H 6.586 7.660 0.862 1.00 . A A . 15 ARG HB3 1 1 9 4404 1 1 15 ARG HD2 H 8.488 9.332 -1.858 1.00 . A A . 15 ARG HD2 1 1 9 4405 1 1 15 ARG HD3 H 6.759 9.012 -1.758 1.00 . A A . 15 ARG HD3 1 1 9 4406 1 1 15 ARG HE H 7.673 9.578 0.816 1.00 . A A . 15 ARG HE 1 1 9 4407 1 1 15 ARG HG2 H 8.846 7.608 -0.102 1.00 . A A . 15 ARG HG2 1 1 9 4408 1 1 15 ARG HG3 H 8.174 6.972 -1.603 1.00 . A A . 15 ARG HG3 1 1 9 4409 1 1 15 ARG HH11 H 7.260 11.211 -2.257 1.00 . A A . 15 ARG HH11 1 1 9 4410 1 1 15 ARG HH12 H 7.073 12.779 -1.541 1.00 . A A . 15 ARG HH12 1 1 9 4411 1 1 15 ARG HH21 H 7.417 11.638 1.758 1.00 . A A . 15 ARG HH21 1 1 9 4412 1 1 15 ARG HH22 H 7.159 13.022 0.747 1.00 . A A . 15 ARG HH22 1 1 9 4413 1 1 15 ARG N N 7.535 4.714 -0.487 1.00 . A A . 15 ARG N 1 1 9 4414 1 1 15 ARG NE N 7.580 9.948 -0.092 1.00 . A A . 15 ARG NE 1 1 9 4415 1 1 15 ARG NH1 N 7.225 11.793 -1.439 1.00 . A A . 15 ARG NH1 1 1 9 4416 1 1 15 ARG NH2 N 7.314 12.035 0.843 1.00 . A A . 15 ARG NH2 1 1 9 4417 1 1 15 ARG O O 4.961 4.436 0.543 1.00 . A A . 15 ARG O 1 1 9 4418 1 1 16 SER C C 3.249 5.292 2.770 1.00 . A A . 16 SER C 1 1 9 4419 1 1 16 SER CA C 4.560 4.714 3.298 1.00 . A A . 16 SER CA 1 1 9 4420 1 1 16 SER CB C 4.724 5.074 4.776 1.00 . A A . 16 SER CB 1 1 9 4421 1 1 16 SER H H 6.425 5.670 3.012 1.00 . A A . 16 SER H 1 1 9 4422 1 1 16 SER HA H 4.534 3.639 3.200 1.00 . A A . 16 SER HA 1 1 9 4423 1 1 16 SER HB2 H 4.639 6.143 4.899 1.00 . A A . 16 SER HB2 1 1 9 4424 1 1 16 SER HB3 H 3.951 4.583 5.348 1.00 . A A . 16 SER HB3 1 1 9 4425 1 1 16 SER HG H 6.618 5.384 5.188 1.00 . A A . 16 SER HG 1 1 9 4426 1 1 16 SER N N 5.703 5.204 2.535 1.00 . A A . 16 SER N 1 1 9 4427 1 1 16 SER O O 2.217 4.626 2.800 1.00 . A A . 16 SER O 1 1 9 4428 1 1 16 SER OG O 5.986 4.657 5.266 1.00 . A A . 16 SER OG 1 1 9 4429 1 1 17 ASP C C 1.632 6.497 0.480 1.00 . A A . 17 ASP C 1 1 9 4430 1 1 17 ASP CA C 2.117 7.193 1.743 1.00 . A A . 17 ASP CA 1 1 9 4431 1 1 17 ASP CB C 2.404 8.665 1.452 1.00 . A A . 17 ASP CB 1 1 9 4432 1 1 17 ASP CG C 1.169 9.421 1.003 1.00 . A A . 17 ASP CG 1 1 9 4433 1 1 17 ASP H H 4.158 7.003 2.281 1.00 . A A . 17 ASP H 1 1 9 4434 1 1 17 ASP HA H 1.342 7.129 2.491 1.00 . A A . 17 ASP HA 1 1 9 4435 1 1 17 ASP HB2 H 2.782 9.135 2.348 1.00 . A A . 17 ASP HB2 1 1 9 4436 1 1 17 ASP HB3 H 3.149 8.735 0.676 1.00 . A A . 17 ASP HB3 1 1 9 4437 1 1 17 ASP N N 3.302 6.526 2.277 1.00 . A A . 17 ASP N 1 1 9 4438 1 1 17 ASP O O 0.429 6.388 0.248 1.00 . A A . 17 ASP O 1 1 9 4439 1 1 17 ASP OD1 O 0.927 9.505 -0.219 1.00 . A A . 17 ASP OD1 1 1 9 4440 1 1 17 ASP OD2 O 0.435 9.938 1.872 1.00 . A A . 17 ASP OD2 1 1 9 4441 1 1 18 GLU C C 1.466 4.011 -1.151 1.00 . A A . 18 GLU C 1 1 9 4442 1 1 18 GLU CA C 2.241 5.260 -1.530 1.00 . A A . 18 GLU CA 1 1 9 4443 1 1 18 GLU CB C 3.504 4.846 -2.288 1.00 . A A . 18 GLU CB 1 1 9 4444 1 1 18 GLU CD C 5.539 5.509 -3.612 1.00 . A A . 18 GLU CD 1 1 9 4445 1 1 18 GLU CG C 4.337 5.996 -2.824 1.00 . A A . 18 GLU CG 1 1 9 4446 1 1 18 GLU H H 3.512 6.150 -0.096 1.00 . A A . 18 GLU H 1 1 9 4447 1 1 18 GLU HA H 1.626 5.882 -2.162 1.00 . A A . 18 GLU HA 1 1 9 4448 1 1 18 GLU HB2 H 4.127 4.275 -1.621 1.00 . A A . 18 GLU HB2 1 1 9 4449 1 1 18 GLU HB3 H 3.217 4.221 -3.121 1.00 . A A . 18 GLU HB3 1 1 9 4450 1 1 18 GLU HG2 H 3.720 6.604 -3.470 1.00 . A A . 18 GLU HG2 1 1 9 4451 1 1 18 GLU HG3 H 4.685 6.587 -1.994 1.00 . A A . 18 GLU HG3 1 1 9 4452 1 1 18 GLU N N 2.574 6.011 -0.325 1.00 . A A . 18 GLU N 1 1 9 4453 1 1 18 GLU O O 0.431 3.695 -1.741 1.00 . A A . 18 GLU O 1 1 9 4454 1 1 18 GLU OE1 O 6.497 5.002 -2.995 1.00 . A A . 18 GLU OE1 1 1 9 4455 1 1 18 GLU OE2 O 5.537 5.641 -4.852 1.00 . A A . 18 GLU OE2 1 1 9 4456 1 1 19 LEU C C 0.001 2.376 0.977 1.00 . A A . 19 LEU C 1 1 9 4457 1 1 19 LEU CA C 1.360 2.092 0.340 1.00 . A A . 19 LEU CA 1 1 9 4458 1 1 19 LEU CB C 2.284 1.392 1.339 1.00 . A A . 19 LEU CB 1 1 9 4459 1 1 19 LEU CD1 C 1.315 -0.897 0.962 1.00 . A A . 19 LEU CD1 1 1 9 4460 1 1 19 LEU CD2 C 2.687 -0.437 2.998 1.00 . A A . 19 LEU CD2 1 1 9 4461 1 1 19 LEU CG C 1.697 0.145 2.004 1.00 . A A . 19 LEU CG 1 1 9 4462 1 1 19 LEU H H 2.806 3.636 0.285 1.00 . A A . 19 LEU H 1 1 9 4463 1 1 19 LEU HA H 1.211 1.445 -0.510 1.00 . A A . 19 LEU HA 1 1 9 4464 1 1 19 LEU HB2 H 3.189 1.108 0.821 1.00 . A A . 19 LEU HB2 1 1 9 4465 1 1 19 LEU HB3 H 2.540 2.097 2.112 1.00 . A A . 19 LEU HB3 1 1 9 4466 1 1 19 LEU HD11 H 0.898 -1.760 1.455 1.00 . A A . 19 LEU HD11 1 1 9 4467 1 1 19 LEU HD12 H 2.193 -1.190 0.405 1.00 . A A . 19 LEU HD12 1 1 9 4468 1 1 19 LEU HD13 H 0.582 -0.480 0.286 1.00 . A A . 19 LEU HD13 1 1 9 4469 1 1 19 LEU HD21 H 2.992 0.332 3.693 1.00 . A A . 19 LEU HD21 1 1 9 4470 1 1 19 LEU HD22 H 3.553 -0.810 2.470 1.00 . A A . 19 LEU HD22 1 1 9 4471 1 1 19 LEU HD23 H 2.219 -1.246 3.539 1.00 . A A . 19 LEU HD23 1 1 9 4472 1 1 19 LEU HG H 0.801 0.422 2.544 1.00 . A A . 19 LEU HG 1 1 9 4473 1 1 19 LEU N N 1.979 3.316 -0.143 1.00 . A A . 19 LEU N 1 1 9 4474 1 1 19 LEU O O -0.959 1.650 0.742 1.00 . A A . 19 LEU O 1 1 9 4475 1 1 20 GLN C C -2.383 4.193 1.404 1.00 . A A . 20 GLN C 1 1 9 4476 1 1 20 GLN CA C -1.324 3.809 2.430 1.00 . A A . 20 GLN CA 1 1 9 4477 1 1 20 GLN CB C -1.086 4.957 3.408 1.00 . A A . 20 GLN CB 1 1 9 4478 1 1 20 GLN CD C -1.262 3.564 5.496 1.00 . A A . 20 GLN CD 1 1 9 4479 1 1 20 GLN CG C -0.406 4.523 4.694 1.00 . A A . 20 GLN CG 1 1 9 4480 1 1 20 GLN H H 0.732 3.972 1.932 1.00 . A A . 20 GLN H 1 1 9 4481 1 1 20 GLN HA H -1.674 2.950 2.981 1.00 . A A . 20 GLN HA 1 1 9 4482 1 1 20 GLN HB2 H -0.466 5.700 2.930 1.00 . A A . 20 GLN HB2 1 1 9 4483 1 1 20 GLN HB3 H -2.037 5.401 3.661 1.00 . A A . 20 GLN HB3 1 1 9 4484 1 1 20 GLN HE21 H -0.430 2.011 4.583 1.00 . A A . 20 GLN HE21 1 1 9 4485 1 1 20 GLN HE22 H -1.647 1.631 5.751 1.00 . A A . 20 GLN HE22 1 1 9 4486 1 1 20 GLN HG2 H 0.526 4.035 4.449 1.00 . A A . 20 GLN HG2 1 1 9 4487 1 1 20 GLN HG3 H -0.208 5.397 5.297 1.00 . A A . 20 GLN HG3 1 1 9 4488 1 1 20 GLN N N -0.074 3.431 1.776 1.00 . A A . 20 GLN N 1 1 9 4489 1 1 20 GLN NE2 N -1.093 2.273 5.254 1.00 . A A . 20 GLN NE2 1 1 9 4490 1 1 20 GLN O O -3.534 3.751 1.487 1.00 . A A . 20 GLN O 1 1 9 4491 1 1 20 GLN OE1 O -2.069 3.981 6.325 1.00 . A A . 20 GLN OE1 1 1 9 4492 1 1 21 ARG C C -3.324 4.129 -1.400 1.00 . A A . 21 ARG C 1 1 9 4493 1 1 21 ARG CA C -2.858 5.378 -0.665 1.00 . A A . 21 ARG CA 1 1 9 4494 1 1 21 ARG CB C -2.129 6.327 -1.620 1.00 . A A . 21 ARG CB 1 1 9 4495 1 1 21 ARG CD C -2.083 7.496 -3.838 1.00 . A A . 21 ARG CD 1 1 9 4496 1 1 21 ARG CG C -2.867 6.575 -2.921 1.00 . A A . 21 ARG CG 1 1 9 4497 1 1 21 ARG CZ C -2.326 8.404 -6.124 1.00 . A A . 21 ARG CZ 1 1 9 4498 1 1 21 ARG H H -1.063 5.358 0.458 1.00 . A A . 21 ARG H 1 1 9 4499 1 1 21 ARG HA H -3.718 5.882 -0.251 1.00 . A A . 21 ARG HA 1 1 9 4500 1 1 21 ARG HB2 H -1.990 7.277 -1.126 1.00 . A A . 21 ARG HB2 1 1 9 4501 1 1 21 ARG HB3 H -1.163 5.910 -1.854 1.00 . A A . 21 ARG HB3 1 1 9 4502 1 1 21 ARG HD2 H -2.119 8.498 -3.439 1.00 . A A . 21 ARG HD2 1 1 9 4503 1 1 21 ARG HD3 H -1.057 7.161 -3.875 1.00 . A A . 21 ARG HD3 1 1 9 4504 1 1 21 ARG HE H -3.247 6.769 -5.428 1.00 . A A . 21 ARG HE 1 1 9 4505 1 1 21 ARG HG2 H -3.023 5.631 -3.421 1.00 . A A . 21 ARG HG2 1 1 9 4506 1 1 21 ARG HG3 H -3.821 7.028 -2.699 1.00 . A A . 21 ARG HG3 1 1 9 4507 1 1 21 ARG HH11 H -1.136 9.522 -4.914 1.00 . A A . 21 ARG HH11 1 1 9 4508 1 1 21 ARG HH12 H -1.287 10.094 -6.544 1.00 . A A . 21 ARG HH12 1 1 9 4509 1 1 21 ARG HH21 H -3.441 7.520 -7.570 1.00 . A A . 21 ARG HH21 1 1 9 4510 1 1 21 ARG HH22 H -2.608 8.963 -8.051 1.00 . A A . 21 ARG HH22 1 1 9 4511 1 1 21 ARG N N -1.981 5.003 0.435 1.00 . A A . 21 ARG N 1 1 9 4512 1 1 21 ARG NE N -2.631 7.501 -5.192 1.00 . A A . 21 ARG NE 1 1 9 4513 1 1 21 ARG NH1 N -1.520 9.423 -5.838 1.00 . A A . 21 ARG NH1 1 1 9 4514 1 1 21 ARG NH2 N -2.831 8.286 -7.345 1.00 . A A . 21 ARG NH2 1 1 9 4515 1 1 21 ARG O O -4.509 3.973 -1.694 1.00 . A A . 21 ARG O 1 1 9 4516 1 1 22 HIS C C -3.723 1.180 -1.494 1.00 . A A . 22 HIS C 1 1 9 4517 1 1 22 HIS CA C -2.688 1.962 -2.307 1.00 . A A . 22 HIS CA 1 1 9 4518 1 1 22 HIS CB C -1.401 1.143 -2.485 1.00 . A A . 22 HIS CB 1 1 9 4519 1 1 22 HIS CD2 C -1.905 -1.354 -2.136 1.00 . A A . 22 HIS CD2 1 1 9 4520 1 1 22 HIS CE1 C -2.006 -2.013 -4.207 1.00 . A A . 22 HIS CE1 1 1 9 4521 1 1 22 HIS CG C -1.642 -0.271 -2.901 1.00 . A A . 22 HIS CG 1 1 9 4522 1 1 22 HIS H H -1.454 3.419 -1.410 1.00 . A A . 22 HIS H 1 1 9 4523 1 1 22 HIS HA H -3.103 2.180 -3.279 1.00 . A A . 22 HIS HA 1 1 9 4524 1 1 22 HIS HB2 H -0.785 1.609 -3.239 1.00 . A A . 22 HIS HB2 1 1 9 4525 1 1 22 HIS HB3 H -0.862 1.126 -1.550 1.00 . A A . 22 HIS HB3 1 1 9 4526 1 1 22 HIS HD1 H -1.543 -0.153 -5.023 1.00 . A A . 22 HIS HD1 1 1 9 4527 1 1 22 HIS HD2 H -1.904 -1.392 -1.058 1.00 . A A . 22 HIS HD2 1 1 9 4528 1 1 22 HIS HE1 H -2.118 -2.636 -5.080 1.00 . A A . 22 HIS HE1 1 1 9 4529 1 1 22 HIS N N -2.384 3.228 -1.662 1.00 . A A . 22 HIS N 1 1 9 4530 1 1 22 HIS ND1 N -1.698 -0.705 -4.222 1.00 . A A . 22 HIS ND1 1 1 9 4531 1 1 22 HIS NE2 N -2.137 -2.417 -2.969 1.00 . A A . 22 HIS NE2 1 1 9 4532 1 1 22 HIS O O -4.712 0.694 -2.038 1.00 . A A . 22 HIS O 1 1 9 4533 1 1 23 LYS C C -5.814 0.870 0.651 1.00 . A A . 23 LYS C 1 1 9 4534 1 1 23 LYS CA C -4.384 0.342 0.704 1.00 . A A . 23 LYS CA 1 1 9 4535 1 1 23 LYS CB C -3.869 0.403 2.144 1.00 . A A . 23 LYS CB 1 1 9 4536 1 1 23 LYS CD C -2.940 -1.929 2.339 1.00 . A A . 23 LYS CD 1 1 9 4537 1 1 23 LYS CE C -1.765 -2.763 2.822 1.00 . A A . 23 LYS CE 1 1 9 4538 1 1 23 LYS CG C -2.633 -0.442 2.409 1.00 . A A . 23 LYS CG 1 1 9 4539 1 1 23 LYS H H -2.701 1.522 0.187 1.00 . A A . 23 LYS H 1 1 9 4540 1 1 23 LYS HA H -4.387 -0.685 0.380 1.00 . A A . 23 LYS HA 1 1 9 4541 1 1 23 LYS HB2 H -3.630 1.428 2.379 1.00 . A A . 23 LYS HB2 1 1 9 4542 1 1 23 LYS HB3 H -4.654 0.068 2.805 1.00 . A A . 23 LYS HB3 1 1 9 4543 1 1 23 LYS HD2 H -3.797 -2.139 2.960 1.00 . A A . 23 LYS HD2 1 1 9 4544 1 1 23 LYS HD3 H -3.160 -2.195 1.317 1.00 . A A . 23 LYS HD3 1 1 9 4545 1 1 23 LYS HE2 H -2.021 -3.808 2.728 1.00 . A A . 23 LYS HE2 1 1 9 4546 1 1 23 LYS HE3 H -0.909 -2.546 2.200 1.00 . A A . 23 LYS HE3 1 1 9 4547 1 1 23 LYS HG2 H -1.884 -0.208 1.668 1.00 . A A . 23 LYS HG2 1 1 9 4548 1 1 23 LYS HG3 H -2.252 -0.208 3.392 1.00 . A A . 23 LYS HG3 1 1 9 4549 1 1 23 LYS HZ1 H -1.135 -1.481 4.350 1.00 . A A . 23 LYS HZ1 1 1 9 4550 1 1 23 LYS HZ2 H -0.634 -3.083 4.550 1.00 . A A . 23 LYS HZ2 1 1 9 4551 1 1 23 LYS HZ3 H -2.241 -2.656 4.854 1.00 . A A . 23 LYS HZ3 1 1 9 4552 1 1 23 LYS N N -3.496 1.085 -0.190 1.00 . A A . 23 LYS N 1 1 9 4553 1 1 23 LYS NZ N -1.420 -2.475 4.242 1.00 . A A . 23 LYS NZ 1 1 9 4554 1 1 23 LYS O O -6.767 0.127 0.914 1.00 . A A . 23 LYS O 1 1 9 4555 1 1 24 ARG C C -8.144 2.035 -0.848 1.00 . A A . 24 ARG C 1 1 9 4556 1 1 24 ARG CA C -7.299 2.735 0.214 1.00 . A A . 24 ARG CA 1 1 9 4557 1 1 24 ARG CB C -7.226 4.237 -0.068 1.00 . A A . 24 ARG CB 1 1 9 4558 1 1 24 ARG CD C -6.747 6.521 0.883 1.00 . A A . 24 ARG CD 1 1 9 4559 1 1 24 ARG CG C -6.526 5.023 1.028 1.00 . A A . 24 ARG CG 1 1 9 4560 1 1 24 ARG CZ C -5.872 8.296 -0.587 1.00 . A A . 24 ARG CZ 1 1 9 4561 1 1 24 ARG H H -5.178 2.688 0.085 1.00 . A A . 24 ARG H 1 1 9 4562 1 1 24 ARG HA H -7.774 2.587 1.173 1.00 . A A . 24 ARG HA 1 1 9 4563 1 1 24 ARG HB2 H -6.692 4.394 -0.993 1.00 . A A . 24 ARG HB2 1 1 9 4564 1 1 24 ARG HB3 H -8.230 4.622 -0.172 1.00 . A A . 24 ARG HB3 1 1 9 4565 1 1 24 ARG HD2 H -7.803 6.723 0.977 1.00 . A A . 24 ARG HD2 1 1 9 4566 1 1 24 ARG HD3 H -6.215 7.026 1.677 1.00 . A A . 24 ARG HD3 1 1 9 4567 1 1 24 ARG HE H -6.302 6.428 -1.174 1.00 . A A . 24 ARG HE 1 1 9 4568 1 1 24 ARG HG2 H -6.912 4.705 1.985 1.00 . A A . 24 ARG HG2 1 1 9 4569 1 1 24 ARG HG3 H -5.467 4.819 0.982 1.00 . A A . 24 ARG HG3 1 1 9 4570 1 1 24 ARG HH11 H -5.486 10.075 0.312 1.00 . A A . 24 ARG HH11 1 1 9 4571 1 1 24 ARG HH12 H -6.032 8.816 1.370 1.00 . A A . 24 ARG HH12 1 1 9 4572 1 1 24 ARG HH21 H -5.577 8.084 -2.583 1.00 . A A . 24 ARG HH21 1 1 9 4573 1 1 24 ARG HH22 H -5.216 9.658 -1.942 1.00 . A A . 24 ARG HH22 1 1 9 4574 1 1 24 ARG N N -5.971 2.141 0.296 1.00 . A A . 24 ARG N 1 1 9 4575 1 1 24 ARG NE N -6.282 7.041 -0.403 1.00 . A A . 24 ARG NE 1 1 9 4576 1 1 24 ARG NH1 N -5.792 9.129 0.447 1.00 . A A . 24 ARG NH1 1 1 9 4577 1 1 24 ARG NH2 N -5.528 8.714 -1.800 1.00 . A A . 24 ARG NH2 1 1 9 4578 1 1 24 ARG O O -9.368 1.987 -0.739 1.00 . A A . 24 ARG O 1 1 9 4579 1 1 25 THR C C -8.760 -0.570 -2.411 1.00 . A A . 25 THR C 1 1 9 4580 1 1 25 THR CA C -8.203 0.761 -2.912 1.00 . A A . 25 THR CA 1 1 9 4581 1 1 25 THR CB C -7.316 0.523 -4.155 1.00 . A A . 25 THR CB 1 1 9 4582 1 1 25 THR CG2 C -6.779 1.842 -4.693 1.00 . A A . 25 THR CG2 1 1 9 4583 1 1 25 THR H H -6.507 1.497 -1.874 1.00 . A A . 25 THR H 1 1 9 4584 1 1 25 THR HA H -9.032 1.389 -3.208 1.00 . A A . 25 THR HA 1 1 9 4585 1 1 25 THR HB H -7.919 0.062 -4.921 1.00 . A A . 25 THR HB 1 1 9 4586 1 1 25 THR HG1 H -5.631 0.091 -3.206 1.00 . A A . 25 THR HG1 1 1 9 4587 1 1 25 THR HG21 H -7.604 2.475 -4.984 1.00 . A A . 25 THR HG21 1 1 9 4588 1 1 25 THR HG22 H -6.151 1.652 -5.549 1.00 . A A . 25 THR HG22 1 1 9 4589 1 1 25 THR HG23 H -6.201 2.336 -3.925 1.00 . A A . 25 THR HG23 1 1 9 4590 1 1 25 THR N N -7.488 1.456 -1.850 1.00 . A A . 25 THR N 1 1 9 4591 1 1 25 THR O O -9.750 -1.080 -2.937 1.00 . A A . 25 THR O 1 1 9 4592 1 1 25 THR OG1 O -6.219 -0.346 -3.842 1.00 . A A . 25 THR OG1 1 1 9 4593 1 1 26 HIS C C -9.714 -1.991 0.245 1.00 . A A . 26 HIS C 1 1 9 4594 1 1 26 HIS CA C -8.628 -2.345 -0.756 1.00 . A A . 26 HIS CA 1 1 9 4595 1 1 26 HIS CB C -7.520 -3.104 -0.022 1.00 . A A . 26 HIS CB 1 1 9 4596 1 1 26 HIS CD2 C -5.137 -3.399 -0.954 1.00 . A A . 26 HIS CD2 1 1 9 4597 1 1 26 HIS CE1 C -5.489 -5.007 -2.380 1.00 . A A . 26 HIS CE1 1 1 9 4598 1 1 26 HIS CG C -6.461 -3.686 -0.898 1.00 . A A . 26 HIS CG 1 1 9 4599 1 1 26 HIS H H -7.302 -0.715 -1.044 1.00 . A A . 26 HIS H 1 1 9 4600 1 1 26 HIS HA H -9.046 -2.974 -1.525 1.00 . A A . 26 HIS HA 1 1 9 4601 1 1 26 HIS HB2 H -7.034 -2.430 0.667 1.00 . A A . 26 HIS HB2 1 1 9 4602 1 1 26 HIS HB3 H -7.965 -3.914 0.537 1.00 . A A . 26 HIS HB3 1 1 9 4603 1 1 26 HIS HD1 H -7.535 -5.148 -2.009 1.00 . A A . 26 HIS HD1 1 1 9 4604 1 1 26 HIS HD2 H -4.615 -2.659 -0.369 1.00 . A A . 26 HIS HD2 1 1 9 4605 1 1 26 HIS HE1 H -5.329 -5.769 -3.127 1.00 . A A . 26 HIS HE1 1 1 9 4606 1 1 26 HIS N N -8.124 -1.130 -1.385 1.00 . A A . 26 HIS N 1 1 9 4607 1 1 26 HIS ND1 N -6.674 -4.712 -1.814 1.00 . A A . 26 HIS ND1 1 1 9 4608 1 1 26 HIS NE2 N -4.560 -4.235 -1.883 1.00 . A A . 26 HIS NE2 1 1 9 4609 1 1 26 HIS O O -10.705 -2.707 0.390 1.00 . A A . 26 HIS O 1 1 9 4610 1 1 27 THR C C -11.799 -0.112 1.374 1.00 . A A . 27 THR C 1 1 9 4611 1 1 27 THR CA C -10.428 -0.430 1.965 1.00 . A A . 27 THR CA 1 1 9 4612 1 1 27 THR CB C -9.873 0.810 2.697 1.00 . A A . 27 THR CB 1 1 9 4613 1 1 27 THR CG2 C -10.724 1.148 3.912 1.00 . A A . 27 THR CG2 1 1 9 4614 1 1 27 THR H H -8.710 -0.343 0.742 1.00 . A A . 27 THR H 1 1 9 4615 1 1 27 THR HA H -10.536 -1.228 2.684 1.00 . A A . 27 THR HA 1 1 9 4616 1 1 27 THR HB H -9.887 1.651 2.018 1.00 . A A . 27 THR HB 1 1 9 4617 1 1 27 THR HG1 H -7.972 0.369 2.345 1.00 . A A . 27 THR HG1 1 1 9 4618 1 1 27 THR HG21 H -10.329 2.030 4.394 1.00 . A A . 27 THR HG21 1 1 9 4619 1 1 27 THR HG22 H -10.704 0.320 4.606 1.00 . A A . 27 THR HG22 1 1 9 4620 1 1 27 THR HG23 H -11.742 1.332 3.601 1.00 . A A . 27 THR HG23 1 1 9 4621 1 1 27 THR N N -9.509 -0.878 0.934 1.00 . A A . 27 THR N 1 1 9 4622 1 1 27 THR O O -12.831 -0.389 1.989 1.00 . A A . 27 THR O 1 1 9 4623 1 1 27 THR OG1 O -8.520 0.563 3.115 1.00 . A A . 27 THR OG1 1 1 9 4624 1 1 28 GLY C C -12.860 1.312 -1.869 1.00 . A A . 28 GLY C 1 1 9 4625 1 1 28 GLY CA C -13.061 0.763 -0.474 1.00 . A A . 28 GLY CA 1 1 9 4626 1 1 28 GLY H H -10.962 0.651 -0.277 1.00 . A A . 28 GLY H 1 1 9 4627 1 1 28 GLY HA2 H -13.659 -0.135 -0.533 1.00 . A A . 28 GLY HA2 1 1 9 4628 1 1 28 GLY HA3 H -13.586 1.496 0.118 1.00 . A A . 28 GLY HA3 1 1 9 4629 1 1 28 GLY N N -11.810 0.448 0.174 1.00 . A A . 28 GLY N 1 1 9 4630 1 1 28 GLY O O -11.752 1.268 -2.407 1.00 . A A . 28 GLY O 1 1 9 4631 1 1 29 GLU C C -14.747 3.644 -3.863 1.00 . A A . 29 GLU C 1 1 9 4632 1 1 29 GLU CA C -13.881 2.394 -3.787 1.00 . A A . 29 GLU CA 1 1 9 4633 1 1 29 GLU CB C -14.347 1.359 -4.817 1.00 . A A . 29 GLU CB 1 1 9 4634 1 1 29 GLU CD C -14.607 0.784 -7.256 1.00 . A A . 29 GLU CD 1 1 9 4635 1 1 29 GLU CG C -14.366 1.879 -6.244 1.00 . A A . 29 GLU CG 1 1 9 4636 1 1 29 GLU H H -14.780 1.826 -1.966 1.00 . A A . 29 GLU H 1 1 9 4637 1 1 29 GLU HA H -12.859 2.667 -3.995 1.00 . A A . 29 GLU HA 1 1 9 4638 1 1 29 GLU HB2 H -13.688 0.504 -4.775 1.00 . A A . 29 GLU HB2 1 1 9 4639 1 1 29 GLU HB3 H -15.347 1.042 -4.561 1.00 . A A . 29 GLU HB3 1 1 9 4640 1 1 29 GLU HG2 H -15.153 2.612 -6.334 1.00 . A A . 29 GLU HG2 1 1 9 4641 1 1 29 GLU HG3 H -13.415 2.346 -6.457 1.00 . A A . 29 GLU HG3 1 1 9 4642 1 1 29 GLU N N -13.930 1.827 -2.451 1.00 . A A . 29 GLU N 1 1 9 4643 1 1 29 GLU O O -14.445 4.580 -4.603 1.00 . A A . 29 GLU O 1 1 9 4644 1 1 29 GLU OE1 O -15.748 0.284 -7.330 1.00 . A A . 29 GLU OE1 1 1 9 4645 1 1 29 GLU OE2 O -13.661 0.422 -7.987 1.00 . A A . 29 GLU OE2 1 1 9 4646 1 1 30 LYS C C -16.013 6.024 -2.529 1.00 . A A . 30 LYS C 1 1 9 4647 1 1 30 LYS CA C -16.732 4.782 -3.045 1.00 . A A . 30 LYS CA 1 1 9 4648 1 1 30 LYS CB C -17.929 4.449 -2.157 1.00 . A A . 30 LYS CB 1 1 9 4649 1 1 30 LYS CD C -19.786 2.819 -1.670 1.00 . A A . 30 LYS CD 1 1 9 4650 1 1 30 LYS CE C -20.735 3.914 -1.203 1.00 . A A . 30 LYS CE 1 1 9 4651 1 1 30 LYS CG C -18.794 3.325 -2.705 1.00 . A A . 30 LYS CG 1 1 9 4652 1 1 30 LYS H H -16.016 2.865 -2.534 1.00 . A A . 30 LYS H 1 1 9 4653 1 1 30 LYS HA H -17.078 4.970 -4.051 1.00 . A A . 30 LYS HA 1 1 9 4654 1 1 30 LYS HB2 H -17.569 4.155 -1.182 1.00 . A A . 30 LYS HB2 1 1 9 4655 1 1 30 LYS HB3 H -18.544 5.331 -2.055 1.00 . A A . 30 LYS HB3 1 1 9 4656 1 1 30 LYS HD2 H -20.365 2.019 -2.104 1.00 . A A . 30 LYS HD2 1 1 9 4657 1 1 30 LYS HD3 H -19.238 2.445 -0.820 1.00 . A A . 30 LYS HD3 1 1 9 4658 1 1 30 LYS HE2 H -20.158 4.706 -0.752 1.00 . A A . 30 LYS HE2 1 1 9 4659 1 1 30 LYS HE3 H -21.268 4.301 -2.059 1.00 . A A . 30 LYS HE3 1 1 9 4660 1 1 30 LYS HG2 H -19.340 3.690 -3.562 1.00 . A A . 30 LYS HG2 1 1 9 4661 1 1 30 LYS HG3 H -18.154 2.508 -3.006 1.00 . A A . 30 LYS HG3 1 1 9 4662 1 1 30 LYS HZ1 H -22.302 2.659 -0.633 1.00 . A A . 30 LYS HZ1 1 1 9 4663 1 1 30 LYS HZ2 H -22.341 4.179 0.103 1.00 . A A . 30 LYS HZ2 1 1 9 4664 1 1 30 LYS HZ3 H -21.224 3.019 0.621 1.00 . A A . 30 LYS HZ3 1 1 9 4665 1 1 30 LYS N N -15.824 3.649 -3.090 1.00 . A A . 30 LYS N 1 1 9 4666 1 1 30 LYS NZ N -21.718 3.408 -0.209 1.00 . A A . 30 LYS NZ 1 1 9 4667 1 1 30 LYS O O -15.805 6.989 -3.266 1.00 . A A . 30 LYS O 1 1 9 4668 1 1 31 NH2 HN1 H -15.828 5.193 -0.739 1.00 . A A . 31 NH2 HN1 1 1 9 4669 1 1 31 NH2 HN2 H -15.158 6.776 -0.907 1.00 . A A . 31 NH2 HN2 1 1 9 4670 1 1 31 NH2 N N -15.628 5.997 -1.266 1.00 . A A . 31 NH2 N 1 1 9 4671 2 2 1 ZN ZN ZN -2.625 -4.247 -2.369 1.00 . B A . 101 ZN ZN 1 1 10 4672 1 1 1 ARG C C 11.903 -0.953 2.713 1.00 . A A . 1 ARG C 1 1 10 4673 1 1 1 ARG CA C 13.092 -1.440 3.533 1.00 . A A . 1 ARG CA 1 1 10 4674 1 1 1 ARG CB C 12.587 -2.162 4.788 1.00 . A A . 1 ARG CB 1 1 10 4675 1 1 1 ARG CD C 13.143 -3.321 6.947 1.00 . A A . 1 ARG CD 1 1 10 4676 1 1 1 ARG CG C 13.694 -2.722 5.663 1.00 . A A . 1 ARG CG 1 1 10 4677 1 1 1 ARG CZ C 13.999 -4.367 9.013 1.00 . A A . 1 ARG CZ 1 1 10 4678 1 1 1 ARG H1 H 14.295 0.187 3.054 1.00 . A A . 1 ARG H1 1 1 10 4679 1 1 1 ARG H2 H 14.775 -0.625 4.455 1.00 . A A . 1 ARG H2 1 1 10 4680 1 1 1 ARG H3 H 13.418 0.386 4.484 1.00 . A A . 1 ARG H3 1 1 10 4681 1 1 1 ARG HA H 13.677 -2.124 2.938 1.00 . A A . 1 ARG HA 1 1 10 4682 1 1 1 ARG HB2 H 12.009 -1.468 5.377 1.00 . A A . 1 ARG HB2 1 1 10 4683 1 1 1 ARG HB3 H 11.949 -2.979 4.483 1.00 . A A . 1 ARG HB3 1 1 10 4684 1 1 1 ARG HD2 H 12.623 -2.550 7.496 1.00 . A A . 1 ARG HD2 1 1 10 4685 1 1 1 ARG HD3 H 12.450 -4.111 6.695 1.00 . A A . 1 ARG HD3 1 1 10 4686 1 1 1 ARG HE H 15.113 -3.874 7.425 1.00 . A A . 1 ARG HE 1 1 10 4687 1 1 1 ARG HG2 H 14.219 -3.489 5.114 1.00 . A A . 1 ARG HG2 1 1 10 4688 1 1 1 ARG HG3 H 14.378 -1.925 5.913 1.00 . A A . 1 ARG HG3 1 1 10 4689 1 1 1 ARG HH11 H 12.627 -4.733 10.460 1.00 . A A . 1 ARG HH11 1 1 10 4690 1 1 1 ARG HH12 H 12.009 -3.979 9.027 1.00 . A A . 1 ARG HH12 1 1 10 4691 1 1 1 ARG HH21 H 15.942 -4.871 9.314 1.00 . A A . 1 ARG HH21 1 1 10 4692 1 1 1 ARG HH22 H 14.866 -5.245 10.624 1.00 . A A . 1 ARG HH22 1 1 10 4693 1 1 1 ARG N N 13.955 -0.295 3.911 1.00 . A A . 1 ARG N 1 1 10 4694 1 1 1 ARG NE N 14.202 -3.869 7.793 1.00 . A A . 1 ARG NE 1 1 10 4695 1 1 1 ARG NH1 N 12.781 -4.359 9.542 1.00 . A A . 1 ARG NH1 1 1 10 4696 1 1 1 ARG NH2 N 15.017 -4.867 9.705 1.00 . A A . 1 ARG NH2 1 1 10 4697 1 1 1 ARG O O 11.272 0.042 3.064 1.00 . A A . 1 ARG O 1 1 10 4698 1 1 2 PRO C C 9.116 -1.594 1.452 1.00 . A A . 2 PRO C 1 1 10 4699 1 1 2 PRO CA C 10.439 -1.279 0.767 1.00 . A A . 2 PRO CA 1 1 10 4700 1 1 2 PRO CB C 10.612 -2.143 -0.482 1.00 . A A . 2 PRO CB 1 1 10 4701 1 1 2 PRO CD C 12.321 -2.796 1.061 1.00 . A A . 2 PRO CD 1 1 10 4702 1 1 2 PRO CG C 11.418 -3.310 -0.030 1.00 . A A . 2 PRO CG 1 1 10 4703 1 1 2 PRO HA H 10.460 -0.234 0.494 1.00 . A A . 2 PRO HA 1 1 10 4704 1 1 2 PRO HB2 H 9.641 -2.450 -0.847 1.00 . A A . 2 PRO HB2 1 1 10 4705 1 1 2 PRO HB3 H 11.128 -1.579 -1.244 1.00 . A A . 2 PRO HB3 1 1 10 4706 1 1 2 PRO HD2 H 12.460 -3.550 1.820 1.00 . A A . 2 PRO HD2 1 1 10 4707 1 1 2 PRO HD3 H 13.272 -2.490 0.652 1.00 . A A . 2 PRO HD3 1 1 10 4708 1 1 2 PRO HG2 H 10.763 -4.079 0.355 1.00 . A A . 2 PRO HG2 1 1 10 4709 1 1 2 PRO HG3 H 12.002 -3.692 -0.852 1.00 . A A . 2 PRO HG3 1 1 10 4710 1 1 2 PRO N N 11.586 -1.636 1.600 1.00 . A A . 2 PRO N 1 1 10 4711 1 1 2 PRO O O 8.997 -2.577 2.192 1.00 . A A . 2 PRO O 1 1 10 4712 1 1 3 PHE C C 5.964 -1.834 0.929 1.00 . A A . 3 PHE C 1 1 10 4713 1 1 3 PHE CA C 6.814 -0.917 1.794 1.00 . A A . 3 PHE CA 1 1 10 4714 1 1 3 PHE CB C 6.146 0.450 1.953 1.00 . A A . 3 PHE CB 1 1 10 4715 1 1 3 PHE CD1 C 7.804 2.304 2.238 1.00 . A A . 3 PHE CD1 1 1 10 4716 1 1 3 PHE CD2 C 6.792 1.385 4.190 1.00 . A A . 3 PHE CD2 1 1 10 4717 1 1 3 PHE CE1 C 8.527 3.181 3.023 1.00 . A A . 3 PHE CE1 1 1 10 4718 1 1 3 PHE CE2 C 7.512 2.260 4.980 1.00 . A A . 3 PHE CE2 1 1 10 4719 1 1 3 PHE CG C 6.931 1.399 2.812 1.00 . A A . 3 PHE CG 1 1 10 4720 1 1 3 PHE CZ C 8.382 3.147 4.408 1.00 . A A . 3 PHE CZ 1 1 10 4721 1 1 3 PHE H H 8.279 -0.018 0.570 1.00 . A A . 3 PHE H 1 1 10 4722 1 1 3 PHE HA H 6.939 -1.367 2.769 1.00 . A A . 3 PHE HA 1 1 10 4723 1 1 3 PHE HB2 H 6.027 0.902 0.981 1.00 . A A . 3 PHE HB2 1 1 10 4724 1 1 3 PHE HB3 H 5.178 0.319 2.402 1.00 . A A . 3 PHE HB3 1 1 10 4725 1 1 3 PHE HD1 H 7.919 2.322 1.164 1.00 . A A . 3 PHE HD1 1 1 10 4726 1 1 3 PHE HD2 H 6.113 0.681 4.649 1.00 . A A . 3 PHE HD2 1 1 10 4727 1 1 3 PHE HE1 H 9.206 3.881 2.562 1.00 . A A . 3 PHE HE1 1 1 10 4728 1 1 3 PHE HE2 H 7.396 2.239 6.053 1.00 . A A . 3 PHE HE2 1 1 10 4729 1 1 3 PHE HZ H 8.946 3.827 5.030 1.00 . A A . 3 PHE HZ 1 1 10 4730 1 1 3 PHE N N 8.127 -0.760 1.197 1.00 . A A . 3 PHE N 1 1 10 4731 1 1 3 PHE O O 5.564 -1.465 -0.168 1.00 . A A . 3 PHE O 1 1 10 4732 1 1 4 NLE C C 3.559 -4.170 1.108 1.00 . A A . 4 NLE C 1 1 10 4733 1 1 4 NLE CA C 5.001 -4.036 0.642 1.00 . A A . 4 NLE CA 1 1 10 4734 1 1 4 NLE CB C 5.719 -5.384 0.762 1.00 . A A . 4 NLE CB 1 1 10 4735 1 1 4 NLE CD C 5.773 -7.835 0.207 1.00 . A A . 4 NLE CD 1 1 10 4736 1 1 4 NLE CE C 5.069 -8.947 -0.538 1.00 . A A . 4 NLE CE 1 1 10 4737 1 1 4 NLE CG C 5.052 -6.515 -0.008 1.00 . A A . 4 NLE CG 1 1 10 4738 1 1 4 NLE H H 5.989 -3.244 2.331 1.00 . A A . 4 NLE H 1 1 10 4739 1 1 4 NLE HA H 5.008 -3.723 -0.391 1.00 . A A . 4 NLE HA 1 1 10 4740 1 1 4 NLE HB2 H 5.757 -5.662 1.804 1.00 . A A . 4 NLE HB2 1 1 10 4741 1 1 4 NLE HB3 H 6.728 -5.276 0.394 1.00 . A A . 4 NLE HB3 1 1 10 4742 1 1 4 NLE HD2 H 5.783 -8.074 1.261 1.00 . A A . 4 NLE HD2 1 1 10 4743 1 1 4 NLE HD3 H 6.784 -7.757 -0.164 1.00 . A A . 4 NLE HD3 1 1 10 4744 1 1 4 NLE HE1 H 4.054 -9.037 -0.177 1.00 . A A . 4 NLE HE1 1 1 10 4745 1 1 4 NLE HE2 H 5.592 -9.879 -0.376 1.00 . A A . 4 NLE HE2 1 1 10 4746 1 1 4 NLE HE3 H 5.057 -8.721 -1.594 1.00 . A A . 4 NLE HE3 1 1 10 4747 1 1 4 NLE HG2 H 5.064 -6.276 -1.061 1.00 . A A . 4 NLE HG2 1 1 10 4748 1 1 4 NLE HG3 H 4.032 -6.615 0.330 1.00 . A A . 4 NLE HG3 1 1 10 4749 1 1 4 NLE N N 5.708 -3.031 1.419 1.00 . A A . 4 NLE N 1 1 10 4750 1 1 4 NLE O O 3.287 -4.198 2.310 1.00 . A A . 4 NLE O 1 1 10 4751 1 1 5 CYS C C 1.065 -5.896 0.991 1.00 . A A . 5 CYS C 1 1 10 4752 1 1 5 CYS CA C 1.242 -4.476 0.463 1.00 . A A . 5 CYS CA 1 1 10 4753 1 1 5 CYS CB C 0.368 -4.257 -0.773 1.00 . A A . 5 CYS CB 1 1 10 4754 1 1 5 CYS H H 2.911 -4.103 -0.783 1.00 . A A . 5 CYS H 1 1 10 4755 1 1 5 CYS HA H 0.946 -3.781 1.232 1.00 . A A . 5 CYS HA 1 1 10 4756 1 1 5 CYS HB2 H 0.407 -3.214 -1.053 1.00 . A A . 5 CYS HB2 1 1 10 4757 1 1 5 CYS HB3 H 0.746 -4.856 -1.584 1.00 . A A . 5 CYS HB3 1 1 10 4758 1 1 5 CYS N N 2.640 -4.231 0.154 1.00 . A A . 5 CYS N 1 1 10 4759 1 1 5 CYS O O 1.604 -6.850 0.428 1.00 . A A . 5 CYS O 1 1 10 4760 1 1 5 CYS SG S -1.368 -4.691 -0.521 1.00 . A A . 5 CYS SG 1 1 10 4761 1 1 6 THR C C -1.291 -7.846 2.512 1.00 . A A . 6 THR C 1 1 10 4762 1 1 6 THR CA C 0.126 -7.317 2.716 1.00 . A A . 6 THR CA 1 1 10 4763 1 1 6 THR CB C 0.430 -7.219 4.221 1.00 . A A . 6 THR CB 1 1 10 4764 1 1 6 THR CG2 C 1.930 -7.219 4.473 1.00 . A A . 6 THR CG2 1 1 10 4765 1 1 6 THR H H -0.115 -5.239 2.458 1.00 . A A . 6 THR H 1 1 10 4766 1 1 6 THR HA H 0.824 -8.012 2.277 1.00 . A A . 6 THR HA 1 1 10 4767 1 1 6 THR HB H -0.005 -8.073 4.718 1.00 . A A . 6 THR HB 1 1 10 4768 1 1 6 THR HG1 H 0.550 -5.377 4.928 1.00 . A A . 6 THR HG1 1 1 10 4769 1 1 6 THR HG21 H 2.118 -7.125 5.532 1.00 . A A . 6 THR HG21 1 1 10 4770 1 1 6 THR HG22 H 2.384 -6.390 3.951 1.00 . A A . 6 THR HG22 1 1 10 4771 1 1 6 THR HG23 H 2.354 -8.146 4.116 1.00 . A A . 6 THR HG23 1 1 10 4772 1 1 6 THR N N 0.318 -6.029 2.074 1.00 . A A . 6 THR N 1 1 10 4773 1 1 6 THR O O -1.748 -8.722 3.249 1.00 . A A . 6 THR O 1 1 10 4774 1 1 6 THR OG1 O -0.150 -6.021 4.756 1.00 . A A . 6 THR OG1 1 1 10 4775 1 1 7 TRP C C -3.358 -8.880 0.218 1.00 . A A . 7 TRP C 1 1 10 4776 1 1 7 TRP CA C -3.345 -7.746 1.239 1.00 . A A . 7 TRP CA 1 1 10 4777 1 1 7 TRP CB C -4.173 -6.566 0.733 1.00 . A A . 7 TRP CB 1 1 10 4778 1 1 7 TRP CD1 C -6.456 -7.586 0.178 1.00 . A A . 7 TRP CD1 1 1 10 4779 1 1 7 TRP CD2 C -6.490 -6.092 1.841 1.00 . A A . 7 TRP CD2 1 1 10 4780 1 1 7 TRP CE2 C -7.799 -6.567 1.642 1.00 . A A . 7 TRP CE2 1 1 10 4781 1 1 7 TRP CE3 C -6.260 -5.140 2.835 1.00 . A A . 7 TRP CE3 1 1 10 4782 1 1 7 TRP CG C -5.648 -6.757 0.898 1.00 . A A . 7 TRP CG 1 1 10 4783 1 1 7 TRP CH2 C -8.623 -5.186 3.373 1.00 . A A . 7 TRP CH2 1 1 10 4784 1 1 7 TRP CZ2 C -8.876 -6.121 2.405 1.00 . A A . 7 TRP CZ2 1 1 10 4785 1 1 7 TRP CZ3 C -7.329 -4.695 3.590 1.00 . A A . 7 TRP CZ3 1 1 10 4786 1 1 7 TRP H H -1.560 -6.660 0.922 1.00 . A A . 7 TRP H 1 1 10 4787 1 1 7 TRP HA H -3.772 -8.103 2.164 1.00 . A A . 7 TRP HA 1 1 10 4788 1 1 7 TRP HB2 H -3.891 -5.677 1.273 1.00 . A A . 7 TRP HB2 1 1 10 4789 1 1 7 TRP HB3 H -3.971 -6.419 -0.317 1.00 . A A . 7 TRP HB3 1 1 10 4790 1 1 7 TRP HD1 H -6.112 -8.227 -0.619 1.00 . A A . 7 TRP HD1 1 1 10 4791 1 1 7 TRP HE1 H -8.519 -7.980 0.265 1.00 . A A . 7 TRP HE1 1 1 10 4792 1 1 7 TRP HE3 H -5.269 -4.751 3.015 1.00 . A A . 7 TRP HE3 1 1 10 4793 1 1 7 TRP HH2 H -9.428 -4.810 3.986 1.00 . A A . 7 TRP HH2 1 1 10 4794 1 1 7 TRP HZ2 H -9.879 -6.492 2.249 1.00 . A A . 7 TRP HZ2 1 1 10 4795 1 1 7 TRP HZ3 H -7.172 -3.957 4.362 1.00 . A A . 7 TRP HZ3 1 1 10 4796 1 1 7 TRP N N -1.980 -7.330 1.505 1.00 . A A . 7 TRP N 1 1 10 4797 1 1 7 TRP NE1 N -7.752 -7.482 0.622 1.00 . A A . 7 TRP NE1 1 1 10 4798 1 1 7 TRP O O -3.569 -8.658 -0.973 1.00 . A A . 7 TRP O 1 1 10 4799 1 1 8 ORN C C -1.799 -10.834 -3.690 1.00 . A A . 8 ORN C 1 1 10 4800 1 1 8 ORN CA C -2.474 -12.074 -3.106 1.00 . A A . 8 ORN CA 1 1 10 4801 1 1 8 ORN CB C -1.718 -12.558 -1.861 1.00 . A A . 8 ORN CB 1 1 10 4802 1 1 8 ORN CD C -3.072 -11.286 -0.157 1.00 . A A . 8 ORN CD 1 1 10 4803 1 1 8 ORN CG C -1.683 -11.541 -0.730 1.00 . A A . 8 ORN CG 1 1 10 4804 1 1 8 ORN H H -1.564 -13.396 -4.428 1.00 . A A . 8 ORN H 1 1 10 4805 1 1 8 ORN HA H -3.486 -11.822 -2.831 1.00 . A A . 8 ORN HA 1 1 10 4806 1 1 8 ORN HB2 H -0.701 -12.790 -2.139 1.00 . A A . 8 ORN HB2 1 1 10 4807 1 1 8 ORN HB3 H -2.196 -13.453 -1.491 1.00 . A A . 8 ORN HB3 1 1 10 4808 1 1 8 ORN HD2 H -3.367 -12.142 0.432 1.00 . A A . 8 ORN HD2 1 1 10 4809 1 1 8 ORN HD3 H -3.767 -11.156 -0.971 1.00 . A A . 8 ORN HD3 1 1 10 4810 1 1 8 ORN HE1 H -2.940 -10.206 1.645 1.00 . A A . 8 ORN HE1 1 1 10 4811 1 1 8 ORN HG2 H -1.284 -10.611 -1.111 1.00 . A A . 8 ORN HG2 1 1 10 4812 1 1 8 ORN HG3 H -1.043 -11.913 0.056 1.00 . A A . 8 ORN HG3 1 1 10 4813 1 1 8 ORN N N -2.526 -13.149 -4.120 1.00 . A A . 8 ORN N 1 1 10 4814 1 1 8 ORN NE N -3.106 -10.095 0.685 1.00 . A A . 8 ORN NE 1 1 10 4815 1 1 8 ORN O O -0.941 -10.936 -4.568 1.00 . A A . 8 ORN O 1 1 10 4816 1 1 9 CYS C C -0.425 -8.075 -2.765 1.00 . A A . 9 CYS C 1 1 10 4817 1 1 9 CYS CA C -1.628 -8.411 -3.643 1.00 . A A . 9 CYS CA 1 1 10 4818 1 1 9 CYS CB C -2.683 -7.308 -3.554 1.00 . A A . 9 CYS CB 1 1 10 4819 1 1 9 CYS H H -2.942 -9.649 -2.557 1.00 . A A . 9 CYS H 1 1 10 4820 1 1 9 CYS HA H -1.307 -8.516 -4.667 1.00 . A A . 9 CYS HA 1 1 10 4821 1 1 9 CYS HB2 H -3.524 -7.576 -4.174 1.00 . A A . 9 CYS HB2 1 1 10 4822 1 1 9 CYS HB3 H -3.013 -7.227 -2.528 1.00 . A A . 9 CYS HB3 1 1 10 4823 1 1 9 CYS N N -2.212 -9.668 -3.218 1.00 . A A . 9 CYS N 1 1 10 4824 1 1 9 CYS O O -0.518 -8.116 -1.537 1.00 . A A . 9 CYS O 1 1 10 4825 1 1 9 CYS SG S -2.118 -5.678 -4.079 1.00 . A A . 9 CYS SG 1 1 10 4826 1 1 10 GLY C C 2.812 -6.478 -3.333 1.00 . A A . 10 GLY C 1 1 10 4827 1 1 10 GLY CA C 1.907 -7.474 -2.640 1.00 . A A . 10 GLY CA 1 1 10 4828 1 1 10 GLY H H 0.714 -7.708 -4.370 1.00 . A A . 10 GLY H 1 1 10 4829 1 1 10 GLY HA2 H 1.629 -7.079 -1.675 1.00 . A A . 10 GLY HA2 1 1 10 4830 1 1 10 GLY HA3 H 2.448 -8.396 -2.497 1.00 . A A . 10 GLY HA3 1 1 10 4831 1 1 10 GLY N N 0.701 -7.756 -3.390 1.00 . A A . 10 GLY N 1 1 10 4832 1 1 10 GLY O O 4.027 -6.668 -3.385 1.00 . A A . 10 GLY O 1 1 10 4833 1 1 11 LYS C C 3.962 -3.702 -3.575 1.00 . A A . 11 LYS C 1 1 10 4834 1 1 11 LYS CA C 2.989 -4.373 -4.542 1.00 . A A . 11 LYS CA 1 1 10 4835 1 1 11 LYS CB C 2.058 -3.318 -5.147 1.00 . A A . 11 LYS CB 1 1 10 4836 1 1 11 LYS CD C 0.494 -2.693 -7.010 1.00 . A A . 11 LYS CD 1 1 10 4837 1 1 11 LYS CE C -0.330 -3.200 -8.184 1.00 . A A . 11 LYS CE 1 1 10 4838 1 1 11 LYS CG C 1.221 -3.830 -6.307 1.00 . A A . 11 LYS CG 1 1 10 4839 1 1 11 LYS H H 1.248 -5.339 -3.818 1.00 . A A . 11 LYS H 1 1 10 4840 1 1 11 LYS HA H 3.555 -4.837 -5.334 1.00 . A A . 11 LYS HA 1 1 10 4841 1 1 11 LYS HB2 H 1.385 -2.966 -4.378 1.00 . A A . 11 LYS HB2 1 1 10 4842 1 1 11 LYS HB3 H 2.653 -2.488 -5.499 1.00 . A A . 11 LYS HB3 1 1 10 4843 1 1 11 LYS HD2 H -0.163 -2.208 -6.306 1.00 . A A . 11 LYS HD2 1 1 10 4844 1 1 11 LYS HD3 H 1.224 -1.984 -7.374 1.00 . A A . 11 LYS HD3 1 1 10 4845 1 1 11 LYS HE2 H 0.323 -3.717 -8.870 1.00 . A A . 11 LYS HE2 1 1 10 4846 1 1 11 LYS HE3 H -1.074 -3.889 -7.811 1.00 . A A . 11 LYS HE3 1 1 10 4847 1 1 11 LYS HG2 H 1.870 -4.324 -7.015 1.00 . A A . 11 LYS HG2 1 1 10 4848 1 1 11 LYS HG3 H 0.493 -4.533 -5.931 1.00 . A A . 11 LYS HG3 1 1 10 4849 1 1 11 LYS HZ1 H -1.561 -2.473 -9.706 1.00 . A A . 11 LYS HZ1 1 1 10 4850 1 1 11 LYS HZ2 H -0.314 -1.418 -9.275 1.00 . A A . 11 LYS HZ2 1 1 10 4851 1 1 11 LYS HZ3 H -1.659 -1.592 -8.265 1.00 . A A . 11 LYS HZ3 1 1 10 4852 1 1 11 LYS N N 2.221 -5.418 -3.871 1.00 . A A . 11 LYS N 1 1 10 4853 1 1 11 LYS NZ N -1.013 -2.095 -8.908 1.00 . A A . 11 LYS NZ 1 1 10 4854 1 1 11 LYS O O 3.653 -3.519 -2.396 1.00 . A A . 11 LYS O 1 1 10 4855 1 1 12 ARG C C 6.156 -1.185 -3.560 1.00 . A A . 12 ARG C 1 1 10 4856 1 1 12 ARG CA C 6.153 -2.678 -3.278 1.00 . A A . 12 ARG CA 1 1 10 4857 1 1 12 ARG CB C 7.545 -3.249 -3.562 1.00 . A A . 12 ARG CB 1 1 10 4858 1 1 12 ARG CD C 9.064 -5.245 -3.645 1.00 . A A . 12 ARG CD 1 1 10 4859 1 1 12 ARG CG C 7.671 -4.738 -3.299 1.00 . A A . 12 ARG CG 1 1 10 4860 1 1 12 ARG CZ C 9.818 -5.844 -5.923 1.00 . A A . 12 ARG CZ 1 1 10 4861 1 1 12 ARG H H 5.327 -3.538 -5.025 1.00 . A A . 12 ARG H 1 1 10 4862 1 1 12 ARG HA H 5.909 -2.835 -2.236 1.00 . A A . 12 ARG HA 1 1 10 4863 1 1 12 ARG HB2 H 7.786 -3.071 -4.600 1.00 . A A . 12 ARG HB2 1 1 10 4864 1 1 12 ARG HB3 H 8.265 -2.735 -2.943 1.00 . A A . 12 ARG HB3 1 1 10 4865 1 1 12 ARG HD2 H 9.781 -4.778 -2.983 1.00 . A A . 12 ARG HD2 1 1 10 4866 1 1 12 ARG HD3 H 9.090 -6.314 -3.505 1.00 . A A . 12 ARG HD3 1 1 10 4867 1 1 12 ARG HE H 9.370 -3.991 -5.308 1.00 . A A . 12 ARG HE 1 1 10 4868 1 1 12 ARG HG2 H 7.477 -4.927 -2.254 1.00 . A A . 12 ARG HG2 1 1 10 4869 1 1 12 ARG HG3 H 6.945 -5.263 -3.902 1.00 . A A . 12 ARG HG3 1 1 10 4870 1 1 12 ARG HH11 H 9.778 -7.409 -4.634 1.00 . A A . 12 ARG HH11 1 1 10 4871 1 1 12 ARG HH12 H 10.253 -7.794 -6.253 1.00 . A A . 12 ARG HH12 1 1 10 4872 1 1 12 ARG HH21 H 10.380 -6.148 -7.845 1.00 . A A . 12 ARG HH21 1 1 10 4873 1 1 12 ARG HH22 H 10.006 -4.504 -7.426 1.00 . A A . 12 ARG HH22 1 1 10 4874 1 1 12 ARG N N 5.139 -3.348 -4.082 1.00 . A A . 12 ARG N 1 1 10 4875 1 1 12 ARG NE N 9.428 -4.936 -5.028 1.00 . A A . 12 ARG NE 1 1 10 4876 1 1 12 ARG NH1 N 9.960 -7.116 -5.575 1.00 . A A . 12 ARG NH1 1 1 10 4877 1 1 12 ARG NH2 N 10.088 -5.469 -7.164 1.00 . A A . 12 ARG NH2 1 1 10 4878 1 1 12 ARG O O 5.972 -0.757 -4.703 1.00 . A A . 12 ARG O 1 1 10 4879 1 1 13 PHE C C 7.621 1.596 -1.908 1.00 . A A . 13 PHE C 1 1 10 4880 1 1 13 PHE CA C 6.396 1.047 -2.625 1.00 . A A . 13 PHE CA 1 1 10 4881 1 1 13 PHE CB C 5.128 1.642 -2.012 1.00 . A A . 13 PHE CB 1 1 10 4882 1 1 13 PHE CD1 C 3.315 1.658 -3.738 1.00 . A A . 13 PHE CD1 1 1 10 4883 1 1 13 PHE CD2 C 3.241 0.000 -2.028 1.00 . A A . 13 PHE CD2 1 1 10 4884 1 1 13 PHE CE1 C 2.157 1.144 -4.287 1.00 . A A . 13 PHE CE1 1 1 10 4885 1 1 13 PHE CE2 C 2.086 -0.517 -2.572 1.00 . A A . 13 PHE CE2 1 1 10 4886 1 1 13 PHE CG C 3.868 1.092 -2.605 1.00 . A A . 13 PHE CG 1 1 10 4887 1 1 13 PHE CZ C 1.544 0.056 -3.703 1.00 . A A . 13 PHE CZ 1 1 10 4888 1 1 13 PHE H H 6.487 -0.810 -1.631 1.00 . A A . 13 PHE H 1 1 10 4889 1 1 13 PHE HA H 6.443 1.307 -3.671 1.00 . A A . 13 PHE HA 1 1 10 4890 1 1 13 PHE HB2 H 5.116 1.432 -0.954 1.00 . A A . 13 PHE HB2 1 1 10 4891 1 1 13 PHE HB3 H 5.130 2.711 -2.165 1.00 . A A . 13 PHE HB3 1 1 10 4892 1 1 13 PHE HD1 H 3.797 2.509 -4.194 1.00 . A A . 13 PHE HD1 1 1 10 4893 1 1 13 PHE HD2 H 3.669 -0.449 -1.145 1.00 . A A . 13 PHE HD2 1 1 10 4894 1 1 13 PHE HE1 H 1.734 1.591 -5.171 1.00 . A A . 13 PHE HE1 1 1 10 4895 1 1 13 PHE HE2 H 1.607 -1.369 -2.111 1.00 . A A . 13 PHE HE2 1 1 10 4896 1 1 13 PHE HZ H 0.637 -0.346 -4.129 1.00 . A A . 13 PHE HZ 1 1 10 4897 1 1 13 PHE N N 6.364 -0.401 -2.516 1.00 . A A . 13 PHE N 1 1 10 4898 1 1 13 PHE O O 8.069 1.038 -0.906 1.00 . A A . 13 PHE O 1 1 10 4899 1 1 14 THR C C 8.877 4.294 -0.717 1.00 . A A . 14 THR C 1 1 10 4900 1 1 14 THR CA C 9.321 3.327 -1.816 1.00 . A A . 14 THR CA 1 1 10 4901 1 1 14 THR CB C 10.143 4.086 -2.880 1.00 . A A . 14 THR CB 1 1 10 4902 1 1 14 THR CG2 C 11.474 4.566 -2.315 1.00 . A A . 14 THR CG2 1 1 10 4903 1 1 14 THR H H 7.789 3.064 -3.251 1.00 . A A . 14 THR H 1 1 10 4904 1 1 14 THR HA H 9.943 2.558 -1.381 1.00 . A A . 14 THR HA 1 1 10 4905 1 1 14 THR HB H 9.575 4.946 -3.209 1.00 . A A . 14 THR HB 1 1 10 4906 1 1 14 THR HG1 H 9.809 2.456 -3.945 1.00 . A A . 14 THR HG1 1 1 10 4907 1 1 14 THR HG21 H 12.027 5.082 -3.086 1.00 . A A . 14 THR HG21 1 1 10 4908 1 1 14 THR HG22 H 12.047 3.719 -1.970 1.00 . A A . 14 THR HG22 1 1 10 4909 1 1 14 THR HG23 H 11.294 5.239 -1.490 1.00 . A A . 14 THR HG23 1 1 10 4910 1 1 14 THR N N 8.166 2.684 -2.426 1.00 . A A . 14 THR N 1 1 10 4911 1 1 14 THR O O 9.681 4.747 0.101 1.00 . A A . 14 THR O 1 1 10 4912 1 1 14 THR OG1 O 10.388 3.227 -4.000 1.00 . A A . 14 THR OG1 1 1 10 4913 1 1 15 ARG C C 5.803 4.980 0.946 1.00 . A A . 15 ARG C 1 1 10 4914 1 1 15 ARG CA C 7.043 5.548 0.257 1.00 . A A . 15 ARG CA 1 1 10 4915 1 1 15 ARG CB C 6.709 6.853 -0.471 1.00 . A A . 15 ARG CB 1 1 10 4916 1 1 15 ARG CD C 7.554 8.763 -1.882 1.00 . A A . 15 ARG CD 1 1 10 4917 1 1 15 ARG CG C 7.926 7.521 -1.091 1.00 . A A . 15 ARG CG 1 1 10 4918 1 1 15 ARG CZ C 6.372 9.357 -3.963 1.00 . A A . 15 ARG CZ 1 1 10 4919 1 1 15 ARG H H 6.981 4.146 -1.321 1.00 . A A . 15 ARG H 1 1 10 4920 1 1 15 ARG HA H 7.800 5.743 1.003 1.00 . A A . 15 ARG HA 1 1 10 4921 1 1 15 ARG HB2 H 6.002 6.641 -1.258 1.00 . A A . 15 ARG HB2 1 1 10 4922 1 1 15 ARG HB3 H 6.262 7.541 0.227 1.00 . A A . 15 ARG HB3 1 1 10 4923 1 1 15 ARG HD2 H 6.950 9.404 -1.260 1.00 . A A . 15 ARG HD2 1 1 10 4924 1 1 15 ARG HD3 H 8.459 9.282 -2.158 1.00 . A A . 15 ARG HD3 1 1 10 4925 1 1 15 ARG HE H 6.619 7.484 -3.273 1.00 . A A . 15 ARG HE 1 1 10 4926 1 1 15 ARG HG2 H 8.609 7.799 -0.305 1.00 . A A . 15 ARG HG2 1 1 10 4927 1 1 15 ARG HG3 H 8.409 6.816 -1.754 1.00 . A A . 15 ARG HG3 1 1 10 4928 1 1 15 ARG HH11 H 7.099 10.935 -2.921 1.00 . A A . 15 ARG HH11 1 1 10 4929 1 1 15 ARG HH12 H 6.269 11.335 -4.390 1.00 . A A . 15 ARG HH12 1 1 10 4930 1 1 15 ARG HH21 H 5.516 8.008 -5.219 1.00 . A A . 15 ARG HH21 1 1 10 4931 1 1 15 ARG HH22 H 5.371 9.674 -5.699 1.00 . A A . 15 ARG HH22 1 1 10 4932 1 1 15 ARG N N 7.587 4.589 -0.689 1.00 . A A . 15 ARG N 1 1 10 4933 1 1 15 ARG NE N 6.806 8.443 -3.094 1.00 . A A . 15 ARG NE 1 1 10 4934 1 1 15 ARG NH1 N 6.599 10.645 -3.740 1.00 . A A . 15 ARG NH1 1 1 10 4935 1 1 15 ARG NH2 N 5.699 8.984 -5.047 1.00 . A A . 15 ARG NH2 1 1 10 4936 1 1 15 ARG O O 4.923 4.399 0.302 1.00 . A A . 15 ARG O 1 1 10 4937 1 1 16 SER C C 3.331 5.212 2.770 1.00 . A A . 16 SER C 1 1 10 4938 1 1 16 SER CA C 4.684 4.580 3.083 1.00 . A A . 16 SER CA 1 1 10 4939 1 1 16 SER CB C 5.029 4.752 4.562 1.00 . A A . 16 SER CB 1 1 10 4940 1 1 16 SER H H 6.446 5.679 2.706 1.00 . A A . 16 SER H 1 1 10 4941 1 1 16 SER HA H 4.632 3.524 2.858 1.00 . A A . 16 SER HA 1 1 10 4942 1 1 16 SER HB2 H 4.133 4.648 5.154 1.00 . A A . 16 SER HB2 1 1 10 4943 1 1 16 SER HB3 H 5.744 3.997 4.855 1.00 . A A . 16 SER HB3 1 1 10 4944 1 1 16 SER HG H 4.979 6.552 5.342 1.00 . A A . 16 SER HG 1 1 10 4945 1 1 16 SER N N 5.748 5.149 2.265 1.00 . A A . 16 SER N 1 1 10 4946 1 1 16 SER O O 2.290 4.564 2.906 1.00 . A A . 16 SER O 1 1 10 4947 1 1 16 SER OG O 5.590 6.030 4.806 1.00 . A A . 16 SER OG 1 1 10 4948 1 1 17 ASP C C 1.553 6.565 0.689 1.00 . A A . 17 ASP C 1 1 10 4949 1 1 17 ASP CA C 2.120 7.163 1.968 1.00 . A A . 17 ASP CA 1 1 10 4950 1 1 17 ASP CB C 2.368 8.662 1.781 1.00 . A A . 17 ASP CB 1 1 10 4951 1 1 17 ASP CG C 1.105 9.418 1.406 1.00 . A A . 17 ASP CG 1 1 10 4952 1 1 17 ASP H H 4.202 6.954 2.317 1.00 . A A . 17 ASP H 1 1 10 4953 1 1 17 ASP HA H 1.401 7.023 2.761 1.00 . A A . 17 ASP HA 1 1 10 4954 1 1 17 ASP HB2 H 2.752 9.074 2.701 1.00 . A A . 17 ASP HB2 1 1 10 4955 1 1 17 ASP HB3 H 3.095 8.804 0.998 1.00 . A A . 17 ASP HB3 1 1 10 4956 1 1 17 ASP N N 3.347 6.472 2.353 1.00 . A A . 17 ASP N 1 1 10 4957 1 1 17 ASP O O 0.342 6.524 0.496 1.00 . A A . 17 ASP O 1 1 10 4958 1 1 17 ASP OD1 O 0.246 9.631 2.287 1.00 . A A . 17 ASP OD1 1 1 10 4959 1 1 17 ASP OD2 O 0.971 9.820 0.232 1.00 . A A . 17 ASP OD2 1 1 10 4960 1 1 18 GLU C C 1.350 4.094 -1.057 1.00 . A A . 18 GLU C 1 1 10 4961 1 1 18 GLU CA C 2.014 5.415 -1.395 1.00 . A A . 18 GLU CA 1 1 10 4962 1 1 18 GLU CB C 3.194 5.176 -2.334 1.00 . A A . 18 GLU CB 1 1 10 4963 1 1 18 GLU CD C 4.890 6.171 -3.897 1.00 . A A . 18 GLU CD 1 1 10 4964 1 1 18 GLU CG C 3.802 6.448 -2.884 1.00 . A A . 18 GLU CG 1 1 10 4965 1 1 18 GLU H H 3.391 6.164 0.018 1.00 . A A . 18 GLU H 1 1 10 4966 1 1 18 GLU HA H 1.294 6.051 -1.887 1.00 . A A . 18 GLU HA 1 1 10 4967 1 1 18 GLU HB2 H 3.962 4.645 -1.794 1.00 . A A . 18 GLU HB2 1 1 10 4968 1 1 18 GLU HB3 H 2.863 4.570 -3.164 1.00 . A A . 18 GLU HB3 1 1 10 4969 1 1 18 GLU HG2 H 3.025 7.028 -3.360 1.00 . A A . 18 GLU HG2 1 1 10 4970 1 1 18 GLU HG3 H 4.224 7.011 -2.067 1.00 . A A . 18 GLU HG3 1 1 10 4971 1 1 18 GLU N N 2.437 6.081 -0.175 1.00 . A A . 18 GLU N 1 1 10 4972 1 1 18 GLU O O 0.345 3.726 -1.659 1.00 . A A . 18 GLU O 1 1 10 4973 1 1 18 GLU OE1 O 6.017 5.836 -3.482 1.00 . A A . 18 GLU OE1 1 1 10 4974 1 1 18 GLU OE2 O 4.632 6.315 -5.109 1.00 . A A . 18 GLU OE2 1 1 10 4975 1 1 19 LEU C C -0.028 2.378 1.019 1.00 . A A . 19 LEU C 1 1 10 4976 1 1 19 LEU CA C 1.340 2.141 0.389 1.00 . A A . 19 LEU CA 1 1 10 4977 1 1 19 LEU CB C 2.274 1.457 1.390 1.00 . A A . 19 LEU CB 1 1 10 4978 1 1 19 LEU CD1 C 1.303 -0.829 1.019 1.00 . A A . 19 LEU CD1 1 1 10 4979 1 1 19 LEU CD2 C 2.703 -0.384 3.035 1.00 . A A . 19 LEU CD2 1 1 10 4980 1 1 19 LEU CG C 1.698 0.206 2.060 1.00 . A A . 19 LEU CG 1 1 10 4981 1 1 19 LEU H H 2.747 3.724 0.329 1.00 . A A . 19 LEU H 1 1 10 4982 1 1 19 LEU HA H 1.217 1.498 -0.468 1.00 . A A . 19 LEU HA 1 1 10 4983 1 1 19 LEU HB2 H 3.179 1.179 0.870 1.00 . A A . 19 LEU HB2 1 1 10 4984 1 1 19 LEU HB3 H 2.526 2.169 2.159 1.00 . A A . 19 LEU HB3 1 1 10 4985 1 1 19 LEU HD11 H 0.883 -1.691 1.512 1.00 . A A . 19 LEU HD11 1 1 10 4986 1 1 19 LEU HD12 H 2.175 -1.126 0.456 1.00 . A A . 19 LEU HD12 1 1 10 4987 1 1 19 LEU HD13 H 0.568 -0.403 0.350 1.00 . A A . 19 LEU HD13 1 1 10 4988 1 1 19 LEU HD21 H 2.229 -1.167 3.607 1.00 . A A . 19 LEU HD21 1 1 10 4989 1 1 19 LEU HD22 H 3.056 0.389 3.703 1.00 . A A . 19 LEU HD22 1 1 10 4990 1 1 19 LEU HD23 H 3.535 -0.797 2.487 1.00 . A A . 19 LEU HD23 1 1 10 4991 1 1 19 LEU HG H 0.810 0.478 2.616 1.00 . A A . 19 LEU HG 1 1 10 4992 1 1 19 LEU N N 1.916 3.394 -0.079 1.00 . A A . 19 LEU N 1 1 10 4993 1 1 19 LEU O O -0.975 1.648 0.740 1.00 . A A . 19 LEU O 1 1 10 4994 1 1 20 GLN C C -2.436 4.107 1.414 1.00 . A A . 20 GLN C 1 1 10 4995 1 1 20 GLN CA C -1.407 3.748 2.480 1.00 . A A . 20 GLN CA 1 1 10 4996 1 1 20 GLN CB C -1.243 4.919 3.446 1.00 . A A . 20 GLN CB 1 1 10 4997 1 1 20 GLN CD C -2.407 6.602 4.930 1.00 . A A . 20 GLN CD 1 1 10 4998 1 1 20 GLN CG C -2.561 5.394 4.036 1.00 . A A . 20 GLN CG 1 1 10 4999 1 1 20 GLN H H 0.671 3.926 2.078 1.00 . A A . 20 GLN H 1 1 10 5000 1 1 20 GLN HA H -1.753 2.884 3.026 1.00 . A A . 20 GLN HA 1 1 10 5001 1 1 20 GLN HB2 H -0.598 4.617 4.257 1.00 . A A . 20 GLN HB2 1 1 10 5002 1 1 20 GLN HB3 H -0.789 5.745 2.921 1.00 . A A . 20 GLN HB3 1 1 10 5003 1 1 20 GLN HE21 H -3.973 6.022 6.001 1.00 . A A . 20 GLN HE21 1 1 10 5004 1 1 20 GLN HE22 H -3.206 7.485 6.516 1.00 . A A . 20 GLN HE22 1 1 10 5005 1 1 20 GLN HG2 H -3.228 5.651 3.226 1.00 . A A . 20 GLN HG2 1 1 10 5006 1 1 20 GLN HG3 H -2.993 4.591 4.612 1.00 . A A . 20 GLN HG3 1 1 10 5007 1 1 20 GLN N N -0.131 3.400 1.861 1.00 . A A . 20 GLN N 1 1 10 5008 1 1 20 GLN NE2 N -3.282 6.716 5.912 1.00 . A A . 20 GLN NE2 1 1 10 5009 1 1 20 GLN O O -3.562 3.601 1.420 1.00 . A A . 20 GLN O 1 1 10 5010 1 1 20 GLN OE1 O -1.520 7.432 4.733 1.00 . A A . 20 GLN OE1 1 1 10 5011 1 1 21 ARG C C -3.340 4.163 -1.393 1.00 . A A . 21 ARG C 1 1 10 5012 1 1 21 ARG CA C -2.888 5.387 -0.607 1.00 . A A . 21 ARG CA 1 1 10 5013 1 1 21 ARG CB C -2.140 6.356 -1.521 1.00 . A A . 21 ARG CB 1 1 10 5014 1 1 21 ARG CD C -2.110 7.693 -3.628 1.00 . A A . 21 ARG CD 1 1 10 5015 1 1 21 ARG CG C -2.960 6.856 -2.692 1.00 . A A . 21 ARG CG 1 1 10 5016 1 1 21 ARG CZ C -2.750 7.697 -6.005 1.00 . A A . 21 ARG CZ 1 1 10 5017 1 1 21 ARG H H -1.129 5.362 0.570 1.00 . A A . 21 ARG H 1 1 10 5018 1 1 21 ARG HA H -3.754 5.881 -0.197 1.00 . A A . 21 ARG HA 1 1 10 5019 1 1 21 ARG HB2 H -1.829 7.212 -0.940 1.00 . A A . 21 ARG HB2 1 1 10 5020 1 1 21 ARG HB3 H -1.265 5.861 -1.909 1.00 . A A . 21 ARG HB3 1 1 10 5021 1 1 21 ARG HD2 H -1.722 8.538 -3.080 1.00 . A A . 21 ARG HD2 1 1 10 5022 1 1 21 ARG HD3 H -1.287 7.092 -3.982 1.00 . A A . 21 ARG HD3 1 1 10 5023 1 1 21 ARG HE H -3.487 8.929 -4.612 1.00 . A A . 21 ARG HE 1 1 10 5024 1 1 21 ARG HG2 H -3.356 6.011 -3.233 1.00 . A A . 21 ARG HG2 1 1 10 5025 1 1 21 ARG HG3 H -3.772 7.463 -2.319 1.00 . A A . 21 ARG HG3 1 1 10 5026 1 1 21 ARG HH11 H -1.470 6.212 -5.489 1.00 . A A . 21 ARG HH11 1 1 10 5027 1 1 21 ARG HH12 H -1.885 6.283 -7.171 1.00 . A A . 21 ARG HH12 1 1 10 5028 1 1 21 ARG HH21 H -4.019 9.036 -6.837 1.00 . A A . 21 ARG HH21 1 1 10 5029 1 1 21 ARG HH22 H -3.332 7.881 -7.934 1.00 . A A . 21 ARG HH22 1 1 10 5030 1 1 21 ARG N N -2.032 4.979 0.498 1.00 . A A . 21 ARG N 1 1 10 5031 1 1 21 ARG NE N -2.869 8.181 -4.772 1.00 . A A . 21 ARG NE 1 1 10 5032 1 1 21 ARG NH1 N -1.973 6.647 -6.240 1.00 . A A . 21 ARG NH1 1 1 10 5033 1 1 21 ARG NH2 N -3.420 8.249 -7.005 1.00 . A A . 21 ARG NH2 1 1 10 5034 1 1 21 ARG O O -4.516 4.029 -1.733 1.00 . A A . 21 ARG O 1 1 10 5035 1 1 22 HIS C C -3.691 1.189 -1.552 1.00 . A A . 22 HIS C 1 1 10 5036 1 1 22 HIS CA C -2.680 2.021 -2.335 1.00 . A A . 22 HIS CA 1 1 10 5037 1 1 22 HIS CB C -1.386 1.223 -2.555 1.00 . A A . 22 HIS CB 1 1 10 5038 1 1 22 HIS CD2 C -1.850 -1.284 -2.185 1.00 . A A . 22 HIS CD2 1 1 10 5039 1 1 22 HIS CE1 C -2.054 -1.936 -4.248 1.00 . A A . 22 HIS CE1 1 1 10 5040 1 1 22 HIS CG C -1.628 -0.196 -2.963 1.00 . A A . 22 HIS CG 1 1 10 5041 1 1 22 HIS H H -1.475 3.445 -1.357 1.00 . A A . 22 HIS H 1 1 10 5042 1 1 22 HIS HA H -3.105 2.268 -3.294 1.00 . A A . 22 HIS HA 1 1 10 5043 1 1 22 HIS HB2 H -0.802 1.698 -3.327 1.00 . A A . 22 HIS HB2 1 1 10 5044 1 1 22 HIS HB3 H -0.818 1.212 -1.635 1.00 . A A . 22 HIS HB3 1 1 10 5045 1 1 22 HIS HD1 H -1.631 -0.077 -5.085 1.00 . A A . 22 HIS HD1 1 1 10 5046 1 1 22 HIS HD2 H -1.795 -1.325 -1.108 1.00 . A A . 22 HIS HD2 1 1 10 5047 1 1 22 HIS HE1 H -2.217 -2.557 -5.114 1.00 . A A . 22 HIS HE1 1 1 10 5048 1 1 22 HIS N N -2.396 3.264 -1.645 1.00 . A A . 22 HIS N 1 1 10 5049 1 1 22 HIS ND1 N -1.748 -0.628 -4.279 1.00 . A A . 22 HIS ND1 1 1 10 5050 1 1 22 HIS NE2 N -2.122 -2.345 -3.010 1.00 . A A . 22 HIS NE2 1 1 10 5051 1 1 22 HIS O O -4.654 0.687 -2.118 1.00 . A A . 22 HIS O 1 1 10 5052 1 1 23 LYS C C -5.778 0.802 0.569 1.00 . A A . 23 LYS C 1 1 10 5053 1 1 23 LYS CA C -4.358 0.255 0.590 1.00 . A A . 23 LYS CA 1 1 10 5054 1 1 23 LYS CB C -3.851 0.194 2.030 1.00 . A A . 23 LYS CB 1 1 10 5055 1 1 23 LYS CD C -2.312 -0.876 3.694 1.00 . A A . 23 LYS CD 1 1 10 5056 1 1 23 LYS CE C -1.210 -1.900 3.902 1.00 . A A . 23 LYS CE 1 1 10 5057 1 1 23 LYS CG C -2.646 -0.710 2.223 1.00 . A A . 23 LYS CG 1 1 10 5058 1 1 23 LYS H H -2.689 1.490 0.153 1.00 . A A . 23 LYS H 1 1 10 5059 1 1 23 LYS HA H -4.372 -0.744 0.187 1.00 . A A . 23 LYS HA 1 1 10 5060 1 1 23 LYS HB2 H -3.578 1.191 2.344 1.00 . A A . 23 LYS HB2 1 1 10 5061 1 1 23 LYS HB3 H -4.647 -0.168 2.661 1.00 . A A . 23 LYS HB3 1 1 10 5062 1 1 23 LYS HD2 H -1.985 0.075 4.088 1.00 . A A . 23 LYS HD2 1 1 10 5063 1 1 23 LYS HD3 H -3.199 -1.201 4.219 1.00 . A A . 23 LYS HD3 1 1 10 5064 1 1 23 LYS HE2 H -1.516 -2.836 3.459 1.00 . A A . 23 LYS HE2 1 1 10 5065 1 1 23 LYS HE3 H -0.312 -1.547 3.415 1.00 . A A . 23 LYS HE3 1 1 10 5066 1 1 23 LYS HG2 H -2.861 -1.680 1.801 1.00 . A A . 23 LYS HG2 1 1 10 5067 1 1 23 LYS HG3 H -1.795 -0.276 1.718 1.00 . A A . 23 LYS HG3 1 1 10 5068 1 1 23 LYS HZ1 H -1.779 -2.443 5.835 1.00 . A A . 23 LYS HZ1 1 1 10 5069 1 1 23 LYS HZ2 H -0.598 -1.238 5.786 1.00 . A A . 23 LYS HZ2 1 1 10 5070 1 1 23 LYS HZ3 H -0.182 -2.842 5.457 1.00 . A A . 23 LYS HZ3 1 1 10 5071 1 1 23 LYS N N -3.471 1.050 -0.251 1.00 . A A . 23 LYS N 1 1 10 5072 1 1 23 LYS NZ N -0.923 -2.121 5.345 1.00 . A A . 23 LYS NZ 1 1 10 5073 1 1 23 LYS O O -6.738 0.074 0.833 1.00 . A A . 23 LYS O 1 1 10 5074 1 1 24 ARG C C -8.008 2.180 -1.061 1.00 . A A . 24 ARG C 1 1 10 5075 1 1 24 ARG CA C -7.222 2.700 0.144 1.00 . A A . 24 ARG CA 1 1 10 5076 1 1 24 ARG CB C -7.093 4.222 0.102 1.00 . A A . 24 ARG CB 1 1 10 5077 1 1 24 ARG CD C -6.524 6.330 1.359 1.00 . A A . 24 ARG CD 1 1 10 5078 1 1 24 ARG CG C -6.635 4.815 1.425 1.00 . A A . 24 ARG CG 1 1 10 5079 1 1 24 ARG CZ C -8.032 8.272 1.168 1.00 . A A . 24 ARG CZ 1 1 10 5080 1 1 24 ARG H H -5.107 2.614 0.037 1.00 . A A . 24 ARG H 1 1 10 5081 1 1 24 ARG HA H -7.761 2.428 1.040 1.00 . A A . 24 ARG HA 1 1 10 5082 1 1 24 ARG HB2 H -6.374 4.492 -0.658 1.00 . A A . 24 ARG HB2 1 1 10 5083 1 1 24 ARG HB3 H -8.051 4.648 -0.151 1.00 . A A . 24 ARG HB3 1 1 10 5084 1 1 24 ARG HD2 H -6.177 6.693 2.314 1.00 . A A . 24 ARG HD2 1 1 10 5085 1 1 24 ARG HD3 H -5.807 6.593 0.595 1.00 . A A . 24 ARG HD3 1 1 10 5086 1 1 24 ARG HE H -8.526 6.384 0.718 1.00 . A A . 24 ARG HE 1 1 10 5087 1 1 24 ARG HG2 H -7.350 4.551 2.190 1.00 . A A . 24 ARG HG2 1 1 10 5088 1 1 24 ARG HG3 H -5.669 4.402 1.677 1.00 . A A . 24 ARG HG3 1 1 10 5089 1 1 24 ARG HH11 H -6.189 8.709 1.896 1.00 . A A . 24 ARG HH11 1 1 10 5090 1 1 24 ARG HH12 H -7.257 10.064 1.712 1.00 . A A . 24 ARG HH12 1 1 10 5091 1 1 24 ARG HH21 H -9.387 9.754 0.916 1.00 . A A . 24 ARG HH21 1 1 10 5092 1 1 24 ARG HH22 H -9.934 8.164 0.480 1.00 . A A . 24 ARG HH22 1 1 10 5093 1 1 24 ARG N N -5.912 2.077 0.230 1.00 . A A . 24 ARG N 1 1 10 5094 1 1 24 ARG NE N -7.801 6.965 1.048 1.00 . A A . 24 ARG NE 1 1 10 5095 1 1 24 ARG NH1 N -7.084 9.079 1.632 1.00 . A A . 24 ARG NH1 1 1 10 5096 1 1 24 ARG NH2 N -9.211 8.770 0.827 1.00 . A A . 24 ARG NH2 1 1 10 5097 1 1 24 ARG O O -9.182 2.502 -1.223 1.00 . A A . 24 ARG O 1 1 10 5098 1 1 25 THR C C -8.721 -0.584 -2.430 1.00 . A A . 25 THR C 1 1 10 5099 1 1 25 THR CA C -8.077 0.688 -2.973 1.00 . A A . 25 THR CA 1 1 10 5100 1 1 25 THR CB C -7.158 0.336 -4.164 1.00 . A A . 25 THR CB 1 1 10 5101 1 1 25 THR CG2 C -6.518 1.589 -4.743 1.00 . A A . 25 THR CG2 1 1 10 5102 1 1 25 THR H H -6.398 1.238 -1.801 1.00 . A A . 25 THR H 1 1 10 5103 1 1 25 THR HA H -8.856 1.349 -3.327 1.00 . A A . 25 THR HA 1 1 10 5104 1 1 25 THR HB H -7.758 -0.128 -4.932 1.00 . A A . 25 THR HB 1 1 10 5105 1 1 25 THR HG1 H -5.426 -0.099 -3.310 1.00 . A A . 25 THR HG1 1 1 10 5106 1 1 25 THR HG21 H -7.290 2.266 -5.079 1.00 . A A . 25 THR HG21 1 1 10 5107 1 1 25 THR HG22 H -5.887 1.319 -5.578 1.00 . A A . 25 THR HG22 1 1 10 5108 1 1 25 THR HG23 H -5.921 2.073 -3.983 1.00 . A A . 25 THR HG23 1 1 10 5109 1 1 25 THR N N -7.367 1.371 -1.900 1.00 . A A . 25 THR N 1 1 10 5110 1 1 25 THR O O -9.793 -0.995 -2.875 1.00 . A A . 25 THR O 1 1 10 5111 1 1 25 THR OG1 O -6.136 -0.583 -3.755 1.00 . A A . 25 THR OG1 1 1 10 5112 1 1 26 HIS C C -9.619 -1.895 0.291 1.00 . A A . 26 HIS C 1 1 10 5113 1 1 26 HIS CA C -8.623 -2.359 -0.762 1.00 . A A . 26 HIS CA 1 1 10 5114 1 1 26 HIS CB C -7.534 -3.190 -0.071 1.00 . A A . 26 HIS CB 1 1 10 5115 1 1 26 HIS CD2 C -5.135 -3.414 -1.002 1.00 . A A . 26 HIS CD2 1 1 10 5116 1 1 26 HIS CE1 C -5.442 -4.989 -2.473 1.00 . A A . 26 HIS CE1 1 1 10 5117 1 1 26 HIS CG C -6.456 -3.725 -0.965 1.00 . A A . 26 HIS CG 1 1 10 5118 1 1 26 HIS H H -7.187 -0.856 -1.167 1.00 . A A . 26 HIS H 1 1 10 5119 1 1 26 HIS HA H -9.133 -2.967 -1.492 1.00 . A A . 26 HIS HA 1 1 10 5120 1 1 26 HIS HB2 H -7.055 -2.575 0.675 1.00 . A A . 26 HIS HB2 1 1 10 5121 1 1 26 HIS HB3 H -8.002 -4.032 0.420 1.00 . A A . 26 HIS HB3 1 1 10 5122 1 1 26 HIS HD1 H -7.488 -5.176 -2.126 1.00 . A A . 26 HIS HD1 1 1 10 5123 1 1 26 HIS HD2 H -4.632 -2.683 -0.390 1.00 . A A . 26 HIS HD2 1 1 10 5124 1 1 26 HIS HE1 H -5.260 -5.732 -3.233 1.00 . A A . 26 HIS HE1 1 1 10 5125 1 1 26 HIS N N -8.065 -1.196 -1.443 1.00 . A A . 26 HIS N 1 1 10 5126 1 1 26 HIS ND1 N -6.640 -4.728 -1.912 1.00 . A A . 26 HIS ND1 1 1 10 5127 1 1 26 HIS NE2 N -4.530 -4.215 -1.945 1.00 . A A . 26 HIS NE2 1 1 10 5128 1 1 26 HIS O O -10.397 -2.680 0.834 1.00 . A A . 26 HIS O 1 1 10 5129 1 1 27 THR C C -10.275 -0.583 2.924 1.00 . A A . 27 THR C 1 1 10 5130 1 1 27 THR CA C -10.378 0.084 1.561 1.00 . A A . 27 THR CA 1 1 10 5131 1 1 27 THR CB C -11.858 0.219 1.121 1.00 . A A . 27 THR CB 1 1 10 5132 1 1 27 THR CG2 C -11.984 1.206 -0.028 1.00 . A A . 27 THR CG2 1 1 10 5133 1 1 27 THR H H -8.891 -0.058 0.075 1.00 . A A . 27 THR H 1 1 10 5134 1 1 27 THR HA H -9.984 1.088 1.663 1.00 . A A . 27 THR HA 1 1 10 5135 1 1 27 THR HB H -12.424 0.597 1.957 1.00 . A A . 27 THR HB 1 1 10 5136 1 1 27 THR HG1 H -11.771 -1.749 0.911 1.00 . A A . 27 THR HG1 1 1 10 5137 1 1 27 THR HG21 H -13.015 1.266 -0.341 1.00 . A A . 27 THR HG21 1 1 10 5138 1 1 27 THR HG22 H -11.376 0.873 -0.857 1.00 . A A . 27 THR HG22 1 1 10 5139 1 1 27 THR HG23 H -11.649 2.181 0.295 1.00 . A A . 27 THR HG23 1 1 10 5140 1 1 27 THR N N -9.551 -0.592 0.566 1.00 . A A . 27 THR N 1 1 10 5141 1 1 27 THR O O -11.281 -0.921 3.548 1.00 . A A . 27 THR O 1 1 10 5142 1 1 27 THR OG1 O -12.411 -1.046 0.723 1.00 . A A . 27 THR OG1 1 1 10 5143 1 1 28 GLY C C -9.390 -0.446 5.774 1.00 . A A . 28 GLY C 1 1 10 5144 1 1 28 GLY CA C -8.796 -1.322 4.692 1.00 . A A . 28 GLY CA 1 1 10 5145 1 1 28 GLY H H -8.281 -0.527 2.803 1.00 . A A . 28 GLY H 1 1 10 5146 1 1 28 GLY HA2 H -9.241 -2.305 4.747 1.00 . A A . 28 GLY HA2 1 1 10 5147 1 1 28 GLY HA3 H -7.733 -1.406 4.853 1.00 . A A . 28 GLY HA3 1 1 10 5148 1 1 28 GLY N N -9.037 -0.771 3.374 1.00 . A A . 28 GLY N 1 1 10 5149 1 1 28 GLY O O -9.392 0.782 5.654 1.00 . A A . 28 GLY O 1 1 10 5150 1 1 29 GLU C C -9.664 0.329 8.834 1.00 . A A . 29 GLU C 1 1 10 5151 1 1 29 GLU CA C -10.622 -0.328 7.848 1.00 . A A . 29 GLU CA 1 1 10 5152 1 1 29 GLU CB C -11.585 -1.259 8.580 1.00 . A A . 29 GLU CB 1 1 10 5153 1 1 29 GLU CD C -13.624 -1.471 10.032 1.00 . A A . 29 GLU CD 1 1 10 5154 1 1 29 GLU CG C -12.603 -0.531 9.436 1.00 . A A . 29 GLU CG 1 1 10 5155 1 1 29 GLU H H -9.770 -2.027 6.930 1.00 . A A . 29 GLU H 1 1 10 5156 1 1 29 GLU HA H -11.192 0.445 7.354 1.00 . A A . 29 GLU HA 1 1 10 5157 1 1 29 GLU HB2 H -12.116 -1.855 7.853 1.00 . A A . 29 GLU HB2 1 1 10 5158 1 1 29 GLU HB3 H -11.015 -1.917 9.221 1.00 . A A . 29 GLU HB3 1 1 10 5159 1 1 29 GLU HG2 H -12.086 -0.027 10.241 1.00 . A A . 29 GLU HG2 1 1 10 5160 1 1 29 GLU HG3 H -13.117 0.197 8.825 1.00 . A A . 29 GLU HG3 1 1 10 5161 1 1 29 GLU N N -9.896 -1.060 6.828 1.00 . A A . 29 GLU N 1 1 10 5162 1 1 29 GLU O O -9.081 -0.334 9.695 1.00 . A A . 29 GLU O 1 1 10 5163 1 1 29 GLU OE1 O -13.466 -1.853 11.211 1.00 . A A . 29 GLU OE1 1 1 10 5164 1 1 29 GLU OE2 O -14.594 -1.828 9.329 1.00 . A A . 29 GLU OE2 1 1 10 5165 1 1 30 LYS C C -9.545 3.320 10.425 1.00 . A A . 30 LYS C 1 1 10 5166 1 1 30 LYS CA C -8.664 2.409 9.584 1.00 . A A . 30 LYS CA 1 1 10 5167 1 1 30 LYS CB C -7.633 3.238 8.810 1.00 . A A . 30 LYS CB 1 1 10 5168 1 1 30 LYS CD C -5.702 1.689 9.235 1.00 . A A . 30 LYS CD 1 1 10 5169 1 1 30 LYS CE C -4.457 1.051 8.643 1.00 . A A . 30 LYS CE 1 1 10 5170 1 1 30 LYS CG C -6.521 2.416 8.180 1.00 . A A . 30 LYS CG 1 1 10 5171 1 1 30 LYS H H -9.918 2.084 7.921 1.00 . A A . 30 LYS H 1 1 10 5172 1 1 30 LYS HA H -8.150 1.721 10.239 1.00 . A A . 30 LYS HA 1 1 10 5173 1 1 30 LYS HB2 H -8.140 3.775 8.023 1.00 . A A . 30 LYS HB2 1 1 10 5174 1 1 30 LYS HB3 H -7.184 3.951 9.485 1.00 . A A . 30 LYS HB3 1 1 10 5175 1 1 30 LYS HD2 H -5.403 2.398 9.994 1.00 . A A . 30 LYS HD2 1 1 10 5176 1 1 30 LYS HD3 H -6.312 0.919 9.681 1.00 . A A . 30 LYS HD3 1 1 10 5177 1 1 30 LYS HE2 H -3.852 1.824 8.195 1.00 . A A . 30 LYS HE2 1 1 10 5178 1 1 30 LYS HE3 H -3.900 0.577 9.437 1.00 . A A . 30 LYS HE3 1 1 10 5179 1 1 30 LYS HG2 H -6.957 1.687 7.513 1.00 . A A . 30 LYS HG2 1 1 10 5180 1 1 30 LYS HG3 H -5.871 3.074 7.622 1.00 . A A . 30 LYS HG3 1 1 10 5181 1 1 30 LYS HZ1 H -5.326 0.471 6.836 1.00 . A A . 30 LYS HZ1 1 1 10 5182 1 1 30 LYS HZ2 H -5.347 -0.731 8.022 1.00 . A A . 30 LYS HZ2 1 1 10 5183 1 1 30 LYS HZ3 H -3.908 -0.368 7.214 1.00 . A A . 30 LYS HZ3 1 1 10 5184 1 1 30 LYS N N -9.484 1.631 8.676 1.00 . A A . 30 LYS N 1 1 10 5185 1 1 30 LYS NZ N -4.784 0.035 7.607 1.00 . A A . 30 LYS NZ 1 1 10 5186 1 1 30 LYS O O -9.717 3.109 11.624 1.00 . A A . 30 LYS O 1 1 10 5187 1 1 31 NH2 HN1 H -9.923 4.442 8.833 1.00 . A A . 31 NH2 HN1 1 1 10 5188 1 1 31 NH2 HN2 H -10.676 4.945 10.306 1.00 . A A . 31 NH2 HN2 1 1 10 5189 1 1 31 NH2 N N -10.103 4.337 9.793 1.00 . A A . 31 NH2 N 1 1 10 5190 2 2 1 ZN ZN ZN -2.584 -4.181 -2.403 1.00 . B A . 101 ZN ZN 1 1 stop_ save_
Contact the webmaster for help, if required. Wednesday, July 3, 2024 12:57:01 AM GMT (wattos1)