NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
387622 | 1mm3 | 5556 | cing | 4-filtered-FRED | STAR | entry | full | 382 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1mm3 # This FRED archive file contains, for PDB entry <1mm3>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1mm3 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1mm3 _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "free and other bound" _Assembly.Molecular_mass 6886.50 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 $Mi2_beta_Chromodomain_helicase_DNA_binding_protein_4__and_transcription_fact A . 1 1 2 . 2 $ZINC_ION B . 1 1 3 . 2 $ZINC_ION C . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 ZN 1 ZN 1 1 3 2 ZN 1 ZN 1 1 stop_ save_ save_Mi2_beta_Chromodomain_helicase_DNA_binding_protein_4__and_transcription_fact _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Mi2 beta Chromodomain helicase DNA binding protein 4 and transcription fact" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GPLGSDHHMEFCRVCKDGGELLCCDTCPSSYHIHCLRPALYEVPDGEWQCPRCTCPALKGK _Entity.Number_of_monomers 61 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 PRO . 1 1 3 LEU . 1 1 4 GLY . 1 1 5 SER . 1 1 6 ASP . 1 1 7 HIS . 1 1 8 HIS . 1 1 9 MET . 1 1 10 GLU . 1 1 11 PHE . 1 1 12 CYS . 1 1 13 ARG . 1 1 14 VAL . 1 1 15 CYS . 1 1 16 LYS . 1 1 17 ASP . 1 1 18 GLY . 1 1 19 GLY . 1 1 20 GLU . 1 1 21 LEU . 1 1 22 LEU . 1 1 23 CYS . 1 1 24 CYS . 1 1 25 ASP . 1 1 26 THR . 1 1 27 CYS . 1 1 28 PRO . 1 1 29 SER . 1 1 30 SER . 1 1 31 TYR . 1 1 32 HIS . 1 1 33 ILE . 1 1 34 HIS . 1 1 35 CYS . 1 1 36 LEU . 1 1 37 ARG . 1 1 38 PRO . 1 1 39 ALA . 1 1 40 LEU . 1 1 41 TYR . 1 1 42 GLU . 1 1 43 VAL . 1 1 44 PRO . 1 1 45 ASP . 1 1 46 GLY . 1 1 47 GLU . 1 1 48 TRP . 1 1 49 GLN . 1 1 50 CYS . 1 1 51 PRO . 1 1 52 ARG . 1 1 53 CYS . 1 1 54 THR . 1 1 55 CYS . 1 1 56 PRO . 1 1 57 ALA . 1 1 58 LEU . 1 1 59 LYS . 1 1 60 GLY . 1 1 61 LYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 PRO 2 2 1 1 LEU 3 3 1 1 GLY 4 4 1 1 SER 5 5 1 1 ASP 6 6 1 1 HIS 7 7 1 1 HIS 8 8 1 1 MET 9 9 1 1 GLU 10 10 1 1 PHE 11 11 1 1 CYS 12 12 1 1 ARG 13 13 1 1 VAL 14 14 1 1 CYS 15 15 1 1 LYS 16 16 1 1 ASP 17 17 1 1 GLY 18 18 1 1 GLY 19 19 1 1 GLU 20 20 1 1 LEU 21 21 1 1 LEU 22 22 1 1 CYS 23 23 1 1 CYS 24 24 1 1 ASP 25 25 1 1 THR 26 26 1 1 CYS 27 27 1 1 PRO 28 28 1 1 SER 29 29 1 1 SER 30 30 1 1 TYR 31 31 1 1 HIS 32 32 1 1 ILE 33 33 1 1 HIS 34 34 1 1 CYS 35 35 1 1 LEU 36 36 1 1 ARG 37 37 1 1 PRO 38 38 1 1 ALA 39 39 1 1 LEU 40 40 1 1 TYR 41 41 1 1 GLU 42 42 1 1 VAL 43 43 1 1 PRO 44 44 1 1 ASP 45 45 1 1 GLY 46 46 1 1 GLU 47 47 1 1 TRP 48 48 1 1 GLN 49 49 1 1 CYS 50 50 1 1 PRO 51 51 1 1 ARG 52 52 1 1 CYS 53 53 1 1 THR 54 54 1 1 CYS 55 55 1 1 PRO 56 56 1 1 ALA 57 57 1 1 LEU 58 58 1 1 LYS 59 59 1 1 GLY 60 60 1 1 LYS 61 61 1 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ZINC ION" _Entity.Type non-polymer loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 ZN $ZN 1 2 stop_ save_ save_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ZN _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 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 7 HIS HA . 7 . HA 1 1 1 1 2 1 1 7 HIS QB . 7 . HB2 1 1 2 1 1 1 1 7 HIS HA . 7 . HA 1 1 2 1 2 1 1 7 HIS HD2 . 7 . HD2 1 1 3 1 1 1 1 7 HIS HA . 7 . HA 1 1 3 1 2 1 1 7 HIS HE1 . 7 . HE1 1 1 4 1 1 1 1 7 HIS HD2 . 7 . HD2 1 1 4 1 2 1 1 8 HIS QB . 8 . HB2 1 1 5 1 1 1 1 8 HIS HA . 8 . HA 1 1 5 1 2 1 1 8 HIS QB . 8 . HB3 1 1 6 1 1 1 1 8 HIS HA . 8 . HA 1 1 6 1 2 1 1 9 MET H . 9 . HN 1 1 7 1 1 1 1 8 HIS HA . 8 . HA 1 1 7 1 2 1 1 28 PRO QB . 28 . HB2 1 1 8 1 1 1 1 8 HIS HA . 8 . HA 1 1 8 1 2 1 1 28 PRO HG3 . 28 . HG3 1 1 9 1 1 1 1 8 HIS QB . 8 . HB3 1 1 9 1 2 1 1 9 MET H . 9 . HN 1 1 10 1 1 1 1 9 MET H . 9 . HN 1 1 10 1 2 1 1 9 MET HG3 . 9 . HG3 1 1 11 1 1 1 1 9 MET HA . 9 . HA 1 1 11 1 2 1 1 9 MET HG3 . 9 . HG3 1 1 12 1 1 1 1 9 MET HA . 9 . HA 1 1 12 1 2 1 1 10 GLU H . 10 . HN 1 1 13 1 1 1 1 9 MET QB . 9 . HB2 1 1 13 1 2 1 1 10 GLU H . 10 . HN 1 1 14 1 1 1 1 9 MET QB . 9 . HB2 1 1 14 1 2 1 1 11 PHE H . 11 . HN 1 1 15 1 1 1 1 9 MET HG3 . 9 . HG3 1 1 15 1 2 1 1 10 GLU H . 10 . HN 1 1 16 1 1 1 1 9 MET HG3 . 9 . HG3 1 1 16 1 2 1 1 11 PHE H . 11 . HN 1 1 17 1 1 1 1 9 MET HG3 . 9 . HG3 1 1 17 1 2 1 1 30 SER H . 30 . HN 1 1 18 1 1 1 1 10 GLU H . 10 . HN 1 1 18 1 2 1 1 11 PHE H . 11 . HN 1 1 19 1 1 1 1 10 GLU HA . 10 . HA 1 1 19 1 2 1 1 11 PHE H . 11 . HN 1 1 20 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1 20 1 2 1 1 11 PHE H . 11 . HN 1 1 21 1 1 1 1 10 GLU HB3 . 10 . HB3 1 1 21 1 2 1 1 11 PHE H . 11 . HN 1 1 22 1 1 1 1 10 GLU HG2 . 10 . HG2 1 1 22 1 2 1 1 11 PHE H . 11 . HN 1 1 23 1 1 1 1 10 GLU HG3 . 10 . HG3 1 1 23 1 2 1 1 11 PHE H . 11 . HN 1 1 24 1 1 1 1 11 PHE H . 11 . HN 1 1 24 1 2 1 1 11 PHE HB2 . 11 . HB2 1 1 25 1 1 1 1 11 PHE H . 11 . HN 1 1 25 1 2 1 1 11 PHE HB3 . 11 . HB3 1 1 26 1 1 1 1 11 PHE HA . 11 . HA 1 1 26 1 2 1 1 11 PHE HB2 . 11 . HB2 1 1 27 1 1 1 1 11 PHE HA . 11 . HA 1 1 27 1 2 1 1 11 PHE HB3 . 11 . HB3 1 1 28 1 1 1 1 11 PHE HA . 11 . HA 1 1 28 1 2 1 1 12 CYS H . 12 . HN 1 1 29 1 1 1 1 11 PHE HA . 11 . HA 1 1 29 1 2 1 1 12 CYS HG . 12 . HG 1 1 30 1 1 1 1 11 PHE HB2 . 11 . HB2 1 1 30 1 2 1 1 12 CYS H . 12 . HN 1 1 31 1 1 1 1 11 PHE HB2 . 11 . HB2 1 1 31 1 2 1 1 16 LYS HA . 16 . HA 1 1 32 1 1 1 1 11 PHE HB3 . 11 . HB3 1 1 32 1 2 1 1 12 CYS H . 12 . HN 1 1 33 1 1 1 1 11 PHE HB3 . 11 . HB3 1 1 33 1 2 1 1 16 LYS HA . 16 . HA 1 1 34 1 1 1 1 12 CYS H . 12 . HN 1 1 34 1 2 1 1 12 CYS HA . 12 . HA 1 1 35 1 1 1 1 12 CYS H . 12 . HN 1 1 35 1 2 1 1 12 CYS HG . 12 . HG 1 1 36 1 1 1 1 12 CYS H . 12 . HN 1 1 36 1 2 1 1 17 ASP H . 17 . HN 1 1 37 1 1 1 1 12 CYS H . 12 . HN 1 1 37 1 2 1 1 18 GLY H . 18 . HN 1 1 38 1 1 1 1 12 CYS HA . 12 . HA 1 1 38 1 2 1 1 12 CYS HB2 . 12 . HB2 1 1 39 1 1 1 1 12 CYS HA . 12 . HA 1 1 39 1 2 1 1 12 CYS HG . 12 . HG 1 1 40 1 1 1 1 12 CYS HA . 12 . HA 1 1 40 1 2 1 1 13 ARG H . 13 . HN 1 1 41 1 1 1 1 12 CYS HA . 12 . HA 1 1 41 1 2 1 1 31 TYR HA . 31 . HA 1 1 42 1 1 1 1 12 CYS HA . 12 . HA 1 1 42 1 2 1 1 32 HIS H . 32 . HN 1 1 43 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 43 1 2 1 1 12 CYS HG . 12 . HG 1 1 44 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 44 1 2 1 1 13 ARG H . 13 . HN 1 1 45 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 45 1 2 1 1 15 CYS H . 15 . HN 1 1 46 1 1 1 1 12 CYS HB2 . 12 . HB2 1 1 46 1 2 1 1 32 HIS H . 32 . HN 1 1 47 1 1 1 1 12 CYS HB3 . 12 . HB3 1 1 47 1 2 1 1 12 CYS HG . 12 . HG 1 1 48 1 1 1 1 12 CYS HB3 . 12 . HB3 1 1 48 1 2 1 1 13 ARG H . 13 . HN 1 1 49 1 1 1 1 12 CYS HB3 . 12 . HB3 1 1 49 1 2 1 1 16 LYS H . 16 . HN 1 1 50 1 1 1 1 12 CYS HG . 12 . HG 1 1 50 1 2 1 1 17 ASP H . 17 . HN 1 1 51 1 1 1 1 12 CYS HG . 12 . HG 1 1 51 1 2 1 1 17 ASP HA . 17 . HA 1 1 52 1 1 1 1 13 ARG H . 13 . HN 1 1 52 1 2 1 1 13 ARG QB . 13 . HB2 1 1 53 1 1 1 1 13 ARG H . 13 . HN 1 1 53 1 2 1 1 14 VAL H . 14 . HN 1 1 54 1 1 1 1 13 ARG H . 13 . HN 1 1 54 1 2 1 1 30 SER H . 30 . HN 1 1 55 1 1 1 1 13 ARG H . 13 . HN 1 1 55 1 2 1 1 30 SER HA . 30 . HA 1 1 56 1 1 1 1 13 ARG H . 13 . HN 1 1 56 1 2 1 1 31 TYR HA . 31 . HA 1 1 57 1 1 1 1 13 ARG HA . 13 . HA 1 1 57 1 2 1 1 13 ARG QB . 13 . HB2 1 1 58 1 1 1 1 13 ARG HA . 13 . HA 1 1 58 1 2 1 1 13 ARG HG2 . 13 . HG2 1 1 59 1 1 1 1 13 ARG HA . 13 . HA 1 1 59 1 2 1 1 14 VAL H . 14 . HN 1 1 60 1 1 1 1 13 ARG HA . 13 . HA 1 1 60 1 2 1 1 16 LYS H . 16 . HN 1 1 61 1 1 1 1 13 ARG QB . 13 . HB2 1 1 61 1 2 1 1 14 VAL H . 14 . HN 1 1 62 1 1 1 1 13 ARG HG2 . 13 . HG2 1 1 62 1 2 1 1 14 VAL H . 14 . HN 1 1 63 1 1 1 1 13 ARG HG3 . 13 . HG3 1 1 63 1 2 1 1 14 VAL H . 14 . HN 1 1 64 1 1 1 1 13 ARG HG3 . 13 . HG3 1 1 64 1 2 1 1 30 SER H . 30 . HN 1 1 65 1 1 1 1 14 VAL H . 14 . HN 1 1 65 1 2 1 1 14 VAL HA . 14 . HA 1 1 66 1 1 1 1 14 VAL H . 14 . HN 1 1 66 1 2 1 1 14 VAL HB . 14 . HB 1 1 67 1 1 1 1 14 VAL H . 14 . HN 1 1 67 1 2 1 1 15 CYS H . 15 . HN 1 1 68 1 1 1 1 14 VAL H . 14 . HN 1 1 68 1 2 1 1 16 LYS H . 16 . HN 1 1 69 1 1 1 1 14 VAL H . 14 . HN 1 1 69 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 70 1 1 1 1 14 VAL HA . 14 . HA 1 1 70 1 2 1 1 15 CYS H . 15 . HN 1 1 71 1 1 1 1 14 VAL HB . 14 . HB 1 1 71 1 2 1 1 15 CYS H . 15 . HN 1 1 72 1 1 1 1 14 VAL HB . 14 . HB 1 1 72 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 73 1 1 1 1 15 CYS H . 15 . HN 1 1 73 1 2 1 1 15 CYS HA . 15 . HA 1 1 74 1 1 1 1 15 CYS H . 15 . HN 1 1 74 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 75 1 1 1 1 15 CYS H . 15 . HN 1 1 75 1 2 1 1 15 CYS HB3 . 15 . HB3 1 1 76 1 1 1 1 15 CYS H . 15 . HN 1 1 76 1 2 1 1 16 LYS H . 16 . HN 1 1 77 1 1 1 1 15 CYS H . 15 . HN 1 1 77 1 2 1 1 16 LYS HA . 16 . HA 1 1 78 1 1 1 1 15 CYS H . 15 . HN 1 1 78 1 2 1 1 17 ASP H . 17 . HN 1 1 79 1 1 1 1 15 CYS H . 15 . HN 1 1 79 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 80 1 1 1 1 15 CYS H . 15 . HN 1 1 80 1 2 1 1 35 CYS HB3 . 35 . HB3 1 1 81 1 1 1 1 15 CYS HA . 15 . HA 1 1 81 1 2 1 1 15 CYS HB2 . 15 . HB2 1 1 82 1 1 1 1 15 CYS HA . 15 . HA 1 1 82 1 2 1 1 15 CYS HB3 . 15 . HB3 1 1 83 1 1 1 1 15 CYS HA . 15 . HA 1 1 83 1 2 1 1 16 LYS H . 16 . HN 1 1 84 1 1 1 1 15 CYS HB2 . 15 . HB2 1 1 84 1 2 1 1 16 LYS H . 16 . HN 1 1 85 1 1 1 1 15 CYS HB3 . 15 . HB3 1 1 85 1 2 1 1 16 LYS H . 16 . HN 1 1 86 1 1 1 1 16 LYS H . 16 . HN 1 1 86 1 2 1 1 16 LYS HA . 16 . HA 1 1 87 1 1 1 1 16 LYS H . 16 . HN 1 1 87 1 2 1 1 16 LYS HB2 . 16 . HB2 1 1 88 1 1 1 1 16 LYS H . 16 . HN 1 1 88 1 2 1 1 16 LYS HB3 . 16 . HB3 1 1 89 1 1 1 1 16 LYS H . 16 . HN 1 1 89 1 2 1 1 16 LYS HD2 . 16 . HD2 1 1 90 1 1 1 1 16 LYS H . 16 . HN 1 1 90 1 2 1 1 16 LYS HD3 . 16 . HD3 1 1 91 1 1 1 1 16 LYS H . 16 . HN 1 1 91 1 2 1 1 16 LYS QE . 16 . HE2 1 1 92 1 1 1 1 16 LYS H . 16 . HN 1 1 92 1 2 1 1 16 LYS HG2 . 16 . HG2 1 1 93 1 1 1 1 16 LYS H . 16 . HN 1 1 93 1 2 1 1 16 LYS HG3 . 16 . HG3 1 1 94 1 1 1 1 16 LYS H . 16 . HN 1 1 94 1 2 1 1 17 ASP H . 17 . HN 1 1 95 1 1 1 1 16 LYS HA . 16 . HA 1 1 95 1 2 1 1 16 LYS QE . 16 . HE2 1 1 96 1 1 1 1 16 LYS HA . 16 . HA 1 1 96 1 2 1 1 17 ASP H . 17 . HN 1 1 97 1 1 1 1 16 LYS HB2 . 16 . HB2 1 1 97 1 2 1 1 17 ASP H . 17 . HN 1 1 98 1 1 1 1 16 LYS HB3 . 16 . HB3 1 1 98 1 2 1 1 16 LYS HG3 . 16 . HG3 1 1 99 1 1 1 1 16 LYS HB3 . 16 . HB3 1 1 99 1 2 1 1 17 ASP H . 17 . HN 1 1 100 1 1 1 1 17 ASP HA . 17 . HA 1 1 100 1 2 1 1 17 ASP HB2 . 17 . HB2 1 1 101 1 1 1 1 17 ASP HA . 17 . HA 1 1 101 1 2 1 1 17 ASP HB3 . 17 . HB3 1 1 102 1 1 1 1 17 ASP HA . 17 . HA 1 1 102 1 2 1 1 18 GLY H . 18 . HN 1 1 103 1 1 1 1 17 ASP HB2 . 17 . HB2 1 1 103 1 2 1 1 18 GLY H . 18 . HN 1 1 104 1 1 1 1 17 ASP HB3 . 17 . HB3 1 1 104 1 2 1 1 18 GLY H . 18 . HN 1 1 105 1 1 1 1 18 GLY HA2 . 18 . HA1 1 1 105 1 2 1 1 19 GLY H . 19 . HN 1 1 106 1 1 1 1 18 GLY HA3 . 18 . HA2 1 1 106 1 2 1 1 19 GLY H . 19 . HN 1 1 107 1 1 1 1 19 GLY HA2 . 19 . HA1 1 1 107 1 2 1 1 20 GLU H . 20 . HN 1 1 108 1 1 1 1 19 GLY HA3 . 19 . HA2 1 1 108 1 2 1 1 20 GLU H . 20 . HN 1 1 109 1 1 1 1 20 GLU HA . 20 . HA 1 1 109 1 2 1 1 21 LEU H . 21 . HN 1 1 110 1 1 1 1 20 GLU HB2 . 20 . HB2 1 1 110 1 2 1 1 21 LEU H . 21 . HN 1 1 111 1 1 1 1 20 GLU HB3 . 20 . HB3 1 1 111 1 2 1 1 21 LEU H . 21 . HN 1 1 112 1 1 1 1 20 GLU HG2 . 20 . HG2 1 1 112 1 2 1 1 21 LEU H . 21 . HN 1 1 113 1 1 1 1 20 GLU HG3 . 20 . HG3 1 1 113 1 2 1 1 21 LEU H . 21 . HN 1 1 114 1 1 1 1 21 LEU H . 21 . HN 1 1 114 1 2 1 1 21 LEU HB3 . 21 . HB3 1 1 115 1 1 1 1 21 LEU H . 21 . HN 1 1 115 1 2 1 1 22 LEU H . 22 . HN 1 1 116 1 1 1 1 21 LEU HA . 21 . HA 1 1 116 1 2 1 1 22 LEU H . 22 . HN 1 1 117 1 1 1 1 21 LEU HB2 . 21 . HB2 1 1 117 1 2 1 1 22 LEU H . 22 . HN 1 1 118 1 1 1 1 21 LEU HB2 . 21 . HB2 1 1 118 1 2 1 1 30 SER HB3 . 30 . HB3 1 1 119 1 1 1 1 21 LEU HB3 . 21 . HB3 1 1 119 1 2 1 1 22 LEU H . 22 . HN 1 1 120 1 1 1 1 21 LEU HG . 21 . HG 1 1 120 1 2 1 1 22 LEU H . 22 . HN 1 1 121 1 1 1 1 22 LEU H . 22 . HN 1 1 121 1 2 1 1 22 LEU HB3 . 22 . HB3 1 1 122 1 1 1 1 22 LEU H . 22 . HN 1 1 122 1 2 1 1 22 LEU HG . 22 . HG 1 1 123 1 1 1 1 22 LEU H . 22 . HN 1 1 123 1 2 1 1 23 CYS H . 23 . HN 1 1 124 1 1 1 1 22 LEU HA . 22 . HA 1 1 124 1 2 1 1 23 CYS H . 23 . HN 1 1 125 1 1 1 1 22 LEU HB2 . 22 . HB2 1 1 125 1 2 1 1 23 CYS H . 23 . HN 1 1 126 1 1 1 1 22 LEU HB3 . 22 . HB3 1 1 126 1 2 1 1 23 CYS H . 23 . HN 1 1 127 1 1 1 1 22 LEU HG . 22 . HG 1 1 127 1 2 1 1 23 CYS H . 23 . HN 1 1 128 1 1 1 1 22 LEU HG . 22 . HG 1 1 128 1 2 1 1 48 TRP HE3 . 48 . HE3 1 1 129 1 1 1 1 23 CYS H . 23 . HN 1 1 129 1 2 1 1 23 CYS HB2 . 23 . HB2 1 1 130 1 1 1 1 23 CYS H . 23 . HN 1 1 130 1 2 1 1 23 CYS HB3 . 23 . HB3 1 1 131 1 1 1 1 23 CYS H . 23 . HN 1 1 131 1 2 1 1 24 CYS H . 24 . HN 1 1 132 1 1 1 1 23 CYS HA . 23 . HA 1 1 132 1 2 1 1 24 CYS H . 24 . HN 1 1 133 1 1 1 1 23 CYS HB2 . 23 . HB2 1 1 133 1 2 1 1 24 CYS H . 24 . HN 1 1 134 1 1 1 1 23 CYS HB3 . 23 . HB3 1 1 134 1 2 1 1 24 CYS H . 24 . HN 1 1 135 1 1 1 1 24 CYS H . 24 . HN 1 1 135 1 2 1 1 24 CYS HB2 . 24 . HB2 1 1 136 1 1 1 1 24 CYS H . 24 . HN 1 1 136 1 2 1 1 25 ASP H . 25 . HN 1 1 137 1 1 1 1 24 CYS H . 24 . HN 1 1 137 1 2 1 1 48 TRP HZ3 . 48 . HZ3 1 1 138 1 1 1 1 24 CYS H . 24 . HN 1 1 138 1 2 1 1 50 CYS QB . 50 . HB2 1 1 139 1 1 1 1 24 CYS HA . 24 . HA 1 1 139 1 2 1 1 25 ASP H . 25 . HN 1 1 140 1 1 1 1 24 CYS HA . 24 . HA 1 1 140 1 2 1 1 48 TRP HE3 . 48 . HE3 1 1 141 1 1 1 1 24 CYS HA . 24 . HA 1 1 141 1 2 1 1 48 TRP HZ3 . 48 . HZ3 1 1 142 1 1 1 1 24 CYS HA . 24 . HA 1 1 142 1 2 1 1 50 CYS H . 50 . HN 1 1 143 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 143 1 2 1 1 25 ASP H . 25 . HN 1 1 144 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 144 1 2 1 1 29 SER H . 29 . HN 1 1 145 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 145 1 2 1 1 48 TRP HE3 . 48 . HE3 1 1 146 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 146 1 2 1 1 48 TRP HZ3 . 48 . HZ3 1 1 147 1 1 1 1 24 CYS HB3 . 24 . HB3 1 1 147 1 2 1 1 25 ASP H . 25 . HN 1 1 148 1 1 1 1 24 CYS HB3 . 24 . HB3 1 1 148 1 2 1 1 26 THR H . 26 . HN 1 1 149 1 1 1 1 24 CYS HB3 . 24 . HB3 1 1 149 1 2 1 1 29 SER H . 29 . HN 1 1 150 1 1 1 1 24 CYS HB3 . 24 . HB3 1 1 150 1 2 1 1 48 TRP HZ3 . 48 . HZ3 1 1 151 1 1 1 1 24 CYS HB3 . 24 . HB3 1 1 151 1 2 1 1 50 CYS QB . 50 . HB2 1 1 152 1 1 1 1 25 ASP H . 25 . HN 1 1 152 1 2 1 1 25 ASP HA . 25 . HA 1 1 153 1 1 1 1 25 ASP H . 25 . HN 1 1 153 1 2 1 1 25 ASP HB3 . 25 . HB3 1 1 154 1 1 1 1 25 ASP H . 25 . HN 1 1 154 1 2 1 1 26 THR H . 26 . HN 1 1 155 1 1 1 1 25 ASP H . 25 . HN 1 1 155 1 2 1 1 48 TRP HE3 . 48 . HE3 1 1 156 1 1 1 1 25 ASP H . 25 . HN 1 1 156 1 2 1 1 49 GLN HA . 49 . HA 1 1 157 1 1 1 1 25 ASP HA . 25 . HA 1 1 157 1 2 1 1 26 THR H . 26 . HN 1 1 158 1 1 1 1 25 ASP HB2 . 25 . HB2 1 1 158 1 2 1 1 26 THR H . 26 . HN 1 1 159 1 1 1 1 25 ASP HB3 . 25 . HB3 1 1 159 1 2 1 1 26 THR H . 26 . HN 1 1 160 1 1 1 1 25 ASP HB3 . 25 . HB3 1 1 160 1 2 1 1 48 TRP H . 48 . HN 1 1 161 1 1 1 1 26 THR H . 26 . HN 1 1 161 1 2 1 1 26 THR HA . 26 . HA 1 1 162 1 1 1 1 26 THR H . 26 . HN 1 1 162 1 2 1 1 27 CYS H . 27 . HN 1 1 163 1 1 1 1 26 THR HA . 26 . HA 1 1 163 1 2 1 1 27 CYS H . 27 . HN 1 1 164 1 1 1 1 26 THR HB . 26 . HB 1 1 164 1 2 1 1 27 CYS H . 27 . HN 1 1 165 1 1 1 1 27 CYS H . 27 . HN 1 1 165 1 2 1 1 27 CYS HA . 27 . HA 1 1 166 1 1 1 1 27 CYS HA . 27 . HA 1 1 166 1 2 1 1 27 CYS HB2 . 27 . HB3 1 1 167 1 1 1 1 27 CYS HA . 27 . HA 1 1 167 1 2 1 1 28 PRO HD2 . 28 . HD2 1 1 168 1 1 1 1 27 CYS HA . 27 . HA 1 1 168 1 2 1 1 28 PRO HD3 . 28 . HD3 1 1 169 1 1 1 1 27 CYS HB2 . 27 . HB3 1 1 169 1 2 1 1 28 PRO HD2 . 28 . HD2 1 1 170 1 1 1 1 27 CYS HB2 . 27 . HB3 1 1 170 1 2 1 1 28 PRO HD3 . 28 . HD3 1 1 171 1 1 1 1 27 CYS HB2 . 27 . HB3 1 1 171 1 2 1 1 50 CYS QB . 50 . HB2 1 1 172 1 1 1 1 27 CYS HB3 . 27 . HB2 1 1 172 1 2 1 1 28 PRO HD2 . 28 . HD2 1 1 173 1 1 1 1 27 CYS HB3 . 27 . HB2 1 1 173 1 2 1 1 28 PRO HD3 . 28 . HD3 1 1 174 1 1 1 1 28 PRO HA . 28 . HA 1 1 174 1 2 1 1 29 SER H . 29 . HN 1 1 175 1 1 1 1 28 PRO QB . 28 . HB2 1 1 175 1 2 1 1 29 SER H . 29 . HN 1 1 176 1 1 1 1 28 PRO HD2 . 28 . HD2 1 1 176 1 2 1 1 29 SER H . 29 . HN 1 1 177 1 1 1 1 28 PRO HD3 . 28 . HD3 1 1 177 1 2 1 1 29 SER H . 29 . HN 1 1 178 1 1 1 1 28 PRO HG3 . 28 . HG3 1 1 178 1 2 1 1 29 SER H . 29 . HN 1 1 179 1 1 1 1 29 SER H . 29 . HN 1 1 179 1 2 1 1 29 SER HB3 . 29 . HB3 1 1 180 1 1 1 1 29 SER H . 29 . HN 1 1 180 1 2 1 1 30 SER H . 30 . HN 1 1 181 1 1 1 1 29 SER HA . 29 . HA 1 1 181 1 2 1 1 30 SER H . 30 . HN 1 1 182 1 1 1 1 29 SER HB2 . 29 . HB2 1 1 182 1 2 1 1 30 SER H . 30 . HN 1 1 183 1 1 1 1 29 SER HB3 . 29 . HB3 1 1 183 1 2 1 1 30 SER H . 30 . HN 1 1 184 1 1 1 1 30 SER H . 30 . HN 1 1 184 1 2 1 1 30 SER HB2 . 30 . HB2 1 1 185 1 1 1 1 30 SER H . 30 . HN 1 1 185 1 2 1 1 30 SER HB3 . 30 . HB3 1 1 186 1 1 1 1 30 SER H . 30 . HN 1 1 186 1 2 1 1 31 TYR H . 31 . HN 1 1 187 1 1 1 1 30 SER HA . 30 . HA 1 1 187 1 2 1 1 30 SER HB3 . 30 . HB3 1 1 188 1 1 1 1 30 SER HA . 30 . HA 1 1 188 1 2 1 1 31 TYR H . 31 . HN 1 1 189 1 1 1 1 30 SER HB2 . 30 . HB2 1 1 189 1 2 1 1 31 TYR H . 31 . HN 1 1 190 1 1 1 1 30 SER HB3 . 30 . HB3 1 1 190 1 2 1 1 31 TYR H . 31 . HN 1 1 191 1 1 1 1 31 TYR H . 31 . HN 1 1 191 1 2 1 1 31 TYR HB2 . 31 . HB2 1 1 192 1 1 1 1 31 TYR H . 31 . HN 1 1 192 1 2 1 1 31 TYR HB3 . 31 . HB3 1 1 193 1 1 1 1 31 TYR H . 31 . HN 1 1 193 1 2 1 1 32 HIS H . 32 . HN 1 1 194 1 1 1 1 31 TYR HA . 31 . HA 1 1 194 1 2 1 1 32 HIS H . 32 . HN 1 1 195 1 1 1 1 31 TYR HB2 . 31 . HB2 1 1 195 1 2 1 1 32 HIS H . 32 . HN 1 1 196 1 1 1 1 31 TYR HB2 . 31 . HB2 1 1 196 1 2 1 1 48 TRP HH2 . 48 . HH2 1 1 197 1 1 1 1 31 TYR HB3 . 31 . HB3 1 1 197 1 2 1 1 32 HIS H . 32 . HN 1 1 198 1 1 1 1 31 TYR HB3 . 31 . HB3 1 1 198 1 2 1 1 48 TRP HH2 . 48 . HH2 1 1 199 1 1 1 1 32 HIS H . 32 . HN 1 1 199 1 2 1 1 32 HIS HB2 . 32 . HB2 1 1 200 1 1 1 1 32 HIS H . 32 . HN 1 1 200 1 2 1 1 32 HIS HB3 . 32 . HB3 1 1 201 1 1 1 1 32 HIS H . 32 . HN 1 1 201 1 2 1 1 32 HIS HD2 . 32 . HD2 1 1 202 1 1 1 1 32 HIS H . 32 . HN 1 1 202 1 2 1 1 32 HIS HE1 . 32 . HE1 1 1 203 1 1 1 1 32 HIS H . 32 . HN 1 1 203 1 2 1 1 33 ILE H . 33 . HN 1 1 204 1 1 1 1 32 HIS H . 32 . HN 1 1 204 1 2 1 1 35 CYS H . 35 . HN 1 1 205 1 1 1 1 32 HIS H . 32 . HN 1 1 205 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 206 1 1 1 1 32 HIS HA . 32 . HA 1 1 206 1 2 1 1 32 HIS HE1 . 32 . HE1 1 1 207 1 1 1 1 32 HIS HA . 32 . HA 1 1 207 1 2 1 1 33 ILE H . 33 . HN 1 1 208 1 1 1 1 32 HIS HB2 . 32 . HB2 1 1 208 1 2 1 1 32 HIS HD2 . 32 . HD2 1 1 209 1 1 1 1 32 HIS HB2 . 32 . HB2 1 1 209 1 2 1 1 32 HIS HE1 . 32 . HE1 1 1 210 1 1 1 1 32 HIS HB2 . 32 . HB2 1 1 210 1 2 1 1 33 ILE H . 33 . HN 1 1 211 1 1 1 1 32 HIS HB2 . 32 . HB2 1 1 211 1 2 1 1 34 HIS H . 34 . HN 1 1 212 1 1 1 1 32 HIS HB2 . 32 . HB2 1 1 212 1 2 1 1 35 CYS H . 35 . HN 1 1 213 1 1 1 1 32 HIS HB3 . 32 . HB3 1 1 213 1 2 1 1 33 ILE H . 33 . HN 1 1 214 1 1 1 1 32 HIS HB3 . 32 . HB3 1 1 214 1 2 1 1 34 HIS H . 34 . HN 1 1 215 1 1 1 1 32 HIS HB3 . 32 . HB3 1 1 215 1 2 1 1 35 CYS H . 35 . HN 1 1 216 1 1 1 1 32 HIS HD2 . 32 . HD2 1 1 216 1 2 1 1 33 ILE H . 33 . HN 1 1 217 1 1 1 1 33 ILE H . 33 . HN 1 1 217 1 2 1 1 33 ILE HA . 33 . HA 1 1 218 1 1 1 1 33 ILE H . 33 . HN 1 1 218 1 2 1 1 33 ILE HB . 33 . HB 1 1 219 1 1 1 1 33 ILE H . 33 . HN 1 1 219 1 2 1 1 33 ILE HG12 . 33 . HG12 1 1 220 1 1 1 1 33 ILE H . 33 . HN 1 1 220 1 2 1 1 34 HIS H . 34 . HN 1 1 221 1 1 1 1 33 ILE HA . 33 . HA 1 1 221 1 2 1 1 33 ILE HB . 33 . HB 1 1 222 1 1 1 1 33 ILE HA . 33 . HA 1 1 222 1 2 1 1 33 ILE HG12 . 33 . HG12 1 1 223 1 1 1 1 33 ILE HA . 33 . HA 1 1 223 1 2 1 1 34 HIS H . 34 . HN 1 1 224 1 1 1 1 33 ILE HA . 33 . HA 1 1 224 1 2 1 1 35 CYS H . 35 . HN 1 1 225 1 1 1 1 33 ILE HA . 33 . HA 1 1 225 1 2 1 1 36 LEU H . 36 . HN 1 1 226 1 1 1 1 33 ILE HA . 33 . HA 1 1 226 1 2 1 1 40 LEU H . 40 . HN 1 1 227 1 1 1 1 33 ILE HB . 33 . HB 1 1 227 1 2 1 1 34 HIS H . 34 . HN 1 1 228 1 1 1 1 33 ILE HB . 33 . HB 1 1 228 1 2 1 1 40 LEU H . 40 . HN 1 1 229 1 1 1 1 33 ILE HG12 . 33 . HG12 1 1 229 1 2 1 1 34 HIS H . 34 . HN 1 1 230 1 1 1 1 34 HIS H . 34 . HN 1 1 230 1 2 1 1 35 CYS H . 35 . HN 1 1 231 1 1 1 1 34 HIS HA . 34 . HA 1 1 231 1 2 1 1 35 CYS H . 35 . HN 1 1 232 1 1 1 1 34 HIS HA . 34 . HA 1 1 232 1 2 1 1 36 LEU H . 36 . HN 1 1 233 1 1 1 1 34 HIS HB2 . 34 . HB2 1 1 233 1 2 1 1 35 CYS H . 35 . HN 1 1 234 1 1 1 1 34 HIS HB3 . 34 . HB3 1 1 234 1 2 1 1 35 CYS H . 35 . HN 1 1 235 1 1 1 1 34 HIS HD2 . 34 . HD2 1 1 235 1 2 1 1 35 CYS HA . 35 . HA 1 1 236 1 1 1 1 35 CYS H . 35 . HN 1 1 236 1 2 1 1 35 CYS HA . 35 . HA 1 1 237 1 1 1 1 35 CYS H . 35 . HN 1 1 237 1 2 1 1 36 LEU H . 36 . HN 1 1 238 1 1 1 1 35 CYS H . 35 . HN 1 1 238 1 2 1 1 36 LEU HG . 36 . HG 1 1 239 1 1 1 1 35 CYS HA . 35 . HA 1 1 239 1 2 1 1 35 CYS HB3 . 35 . HB3 1 1 240 1 1 1 1 35 CYS HA . 35 . HA 1 1 240 1 2 1 1 36 LEU H . 36 . HN 1 1 241 1 1 1 1 35 CYS HB2 . 35 . HB2 1 1 241 1 2 1 1 36 LEU H . 36 . HN 1 1 242 1 1 1 1 35 CYS HB3 . 35 . HB3 1 1 242 1 2 1 1 36 LEU H . 36 . HN 1 1 243 1 1 1 1 36 LEU H . 36 . HN 1 1 243 1 2 1 1 36 LEU HA . 36 . HA 1 1 244 1 1 1 1 36 LEU H . 36 . HN 1 1 244 1 2 1 1 36 LEU HG . 36 . HG 1 1 245 1 1 1 1 36 LEU H . 36 . HN 1 1 245 1 2 1 1 37 ARG H . 37 . HN 1 1 246 1 1 1 1 36 LEU H . 36 . HN 1 1 246 1 2 1 1 39 ALA HA . 39 . HA 1 1 247 1 1 1 1 36 LEU H . 36 . HN 1 1 247 1 2 1 1 40 LEU H . 40 . HN 1 1 248 1 1 1 1 36 LEU HA . 36 . HA 1 1 248 1 2 1 1 37 ARG H . 37 . HN 1 1 249 1 1 1 1 36 LEU QB . 36 . HB2 1 1 249 1 2 1 1 37 ARG H . 37 . HN 1 1 250 1 1 1 1 36 LEU HG . 36 . HG 1 1 250 1 2 1 1 37 ARG H . 37 . HN 1 1 251 1 1 1 1 36 LEU HG . 36 . HG 1 1 251 1 2 1 1 40 LEU H . 40 . HN 1 1 252 1 1 1 1 37 ARG H . 37 . HN 1 1 252 1 2 1 1 37 ARG HD2 . 37 . HD2 1 1 253 1 1 1 1 37 ARG H . 37 . HN 1 1 253 1 2 1 1 37 ARG HD3 . 37 . HD3 1 1 254 1 1 1 1 37 ARG HA . 37 . HA 1 1 254 1 2 1 1 38 PRO HD2 . 38 . HD2 1 1 255 1 1 1 1 37 ARG HA . 37 . HA 1 1 255 1 2 1 1 38 PRO HD3 . 38 . HD3 1 1 256 1 1 1 1 38 PRO HA . 38 . HA 1 1 256 1 2 1 1 38 PRO HB3 . 38 . HB3 1 1 257 1 1 1 1 38 PRO HA . 38 . HA 1 1 257 1 2 1 1 39 ALA H . 39 . HN 1 1 258 1 1 1 1 38 PRO HB2 . 38 . HB2 1 1 258 1 2 1 1 39 ALA H . 39 . HN 1 1 259 1 1 1 1 38 PRO HB3 . 38 . HB3 1 1 259 1 2 1 1 39 ALA H . 39 . HN 1 1 260 1 1 1 1 38 PRO HD3 . 38 . HD3 1 1 260 1 2 1 1 39 ALA H . 39 . HN 1 1 261 1 1 1 1 38 PRO QG . 38 . HG2 1 1 261 1 2 1 1 39 ALA H . 39 . HN 1 1 262 1 1 1 1 39 ALA H . 39 . HN 1 1 262 1 2 1 1 39 ALA HA . 39 . HA 1 1 263 1 1 1 1 39 ALA H . 39 . HN 1 1 263 1 2 1 1 40 LEU H . 40 . HN 1 1 264 1 1 1 1 39 ALA HA . 39 . HA 1 1 264 1 2 1 1 40 LEU H . 40 . HN 1 1 265 1 1 1 1 40 LEU H . 40 . HN 1 1 265 1 2 1 1 40 LEU HB2 . 40 . HB2 1 1 266 1 1 1 1 40 LEU H . 40 . HN 1 1 266 1 2 1 1 40 LEU HB3 . 40 . HB3 1 1 267 1 1 1 1 40 LEU H . 40 . HN 1 1 267 1 2 1 1 40 LEU HG . 40 . HG 1 1 268 1 1 1 1 40 LEU H . 40 . HN 1 1 268 1 2 1 1 41 TYR H . 41 . HN 1 1 269 1 1 1 1 40 LEU HA . 40 . HA 1 1 269 1 2 1 1 41 TYR H . 41 . HN 1 1 270 1 1 1 1 40 LEU HB2 . 40 . HB2 1 1 270 1 2 1 1 41 TYR H . 41 . HN 1 1 271 1 1 1 1 40 LEU HB2 . 40 . HB2 1 1 271 1 2 1 1 42 GLU H . 42 . HN 1 1 272 1 1 1 1 40 LEU HB3 . 40 . HB3 1 1 272 1 2 1 1 41 TYR H . 41 . HN 1 1 273 1 1 1 1 40 LEU HB3 . 40 . HB3 1 1 273 1 2 1 1 42 GLU H . 42 . HN 1 1 274 1 1 1 1 40 LEU HG . 40 . HG 1 1 274 1 2 1 1 41 TYR H . 41 . HN 1 1 275 1 1 1 1 40 LEU HG . 40 . HG 1 1 275 1 2 1 1 42 GLU H . 42 . HN 1 1 276 1 1 1 1 41 TYR H . 41 . HN 1 1 276 1 2 1 1 41 TYR HB2 . 41 . HB2 1 1 277 1 1 1 1 41 TYR H . 41 . HN 1 1 277 1 2 1 1 42 GLU H . 42 . HN 1 1 278 1 1 1 1 41 TYR HA . 41 . HA 1 1 278 1 2 1 1 41 TYR HB2 . 41 . HB2 1 1 279 1 1 1 1 41 TYR HA . 41 . HA 1 1 279 1 2 1 1 42 GLU H . 42 . HN 1 1 280 1 1 1 1 41 TYR HB2 . 41 . HB2 1 1 280 1 2 1 1 42 GLU H . 42 . HN 1 1 281 1 1 1 1 41 TYR HB3 . 41 . HB3 1 1 281 1 2 1 1 42 GLU H . 42 . HN 1 1 282 1 1 1 1 42 GLU H . 42 . HN 1 1 282 1 2 1 1 42 GLU HB2 . 42 . HB2 1 1 283 1 1 1 1 42 GLU H . 42 . HN 1 1 283 1 2 1 1 42 GLU HB3 . 42 . HB3 1 1 284 1 1 1 1 42 GLU H . 42 . HN 1 1 284 1 2 1 1 42 GLU QG . 42 . HG2 1 1 285 1 1 1 1 42 GLU H . 42 . HN 1 1 285 1 2 1 1 43 VAL H . 43 . HN 1 1 286 1 1 1 1 42 GLU HA . 42 . HA 1 1 286 1 2 1 1 43 VAL H . 43 . HN 1 1 287 1 1 1 1 42 GLU HB2 . 42 . HB2 1 1 287 1 2 1 1 43 VAL H . 43 . HN 1 1 288 1 1 1 1 42 GLU HB3 . 42 . HB3 1 1 288 1 2 1 1 43 VAL H . 43 . HN 1 1 289 1 1 1 1 42 GLU QG . 42 . HG2 1 1 289 1 2 1 1 43 VAL H . 43 . HN 1 1 290 1 1 1 1 43 VAL H . 43 . HN 1 1 290 1 2 1 1 44 PRO QD . 44 . HD3 1 1 291 1 1 1 1 43 VAL HA . 43 . HA 1 1 291 1 2 1 1 43 VAL HB . 43 . HB 1 1 292 1 1 1 1 43 VAL HA . 43 . HA 1 1 292 1 2 1 1 44 PRO QD . 44 . HD2 1 1 293 1 1 1 1 43 VAL HA . 43 . HA 1 1 293 1 2 1 1 44 PRO QG . 44 . HG2 1 1 294 1 1 1 1 44 PRO HA . 44 . HA 1 1 294 1 2 1 1 45 ASP H . 45 . HN 1 1 295 1 1 1 1 44 PRO HB2 . 44 . HB2 1 1 295 1 2 1 1 45 ASP H . 45 . HN 1 1 296 1 1 1 1 44 PRO HB2 . 44 . HB2 1 1 296 1 2 1 1 48 TRP HD1 . 48 . HD1 1 1 297 1 1 1 1 44 PRO HB3 . 44 . HB3 1 1 297 1 2 1 1 44 PRO QD . 44 . HD2 1 1 298 1 1 1 1 44 PRO HB3 . 44 . HB3 1 1 298 1 2 1 1 45 ASP H . 45 . HN 1 1 299 1 1 1 1 44 PRO QG . 44 . HG2 1 1 299 1 2 1 1 48 TRP HD1 . 48 . HD1 1 1 300 1 1 1 1 44 PRO QG . 44 . HG2 1 1 300 1 2 1 1 48 TRP HE1 . 48 . HE1 1 1 301 1 1 1 1 45 ASP HA . 45 . HA 1 1 301 1 2 1 1 46 GLY H . 46 . HN 1 1 302 1 1 1 1 45 ASP HB2 . 45 . HB2 1 1 302 1 2 1 1 46 GLY H . 46 . HN 1 1 303 1 1 1 1 45 ASP HB3 . 45 . HB3 1 1 303 1 2 1 1 46 GLY H . 46 . HN 1 1 304 1 1 1 1 46 GLY H . 46 . HN 1 1 304 1 2 1 1 46 GLY QA . 46 . HA1 1 1 305 1 1 1 1 46 GLY H . 46 . HN 1 1 305 1 2 1 1 47 GLU H . 47 . HN 1 1 306 1 1 1 1 46 GLY QA . 46 . HA1 1 1 306 1 2 1 1 47 GLU H . 47 . HN 1 1 307 1 1 1 1 47 GLU H . 47 . HN 1 1 307 1 2 1 1 47 GLU HB3 . 47 . HB3 1 1 308 1 1 1 1 47 GLU HA . 47 . HA 1 1 308 1 2 1 1 48 TRP H . 48 . HN 1 1 309 1 1 1 1 47 GLU HB3 . 47 . HB3 1 1 309 1 2 1 1 48 TRP H . 48 . HN 1 1 310 1 1 1 1 48 TRP H . 48 . HN 1 1 310 1 2 1 1 48 TRP HB2 . 48 . HB2 1 1 311 1 1 1 1 48 TRP H . 48 . HN 1 1 311 1 2 1 1 48 TRP HB3 . 48 . HB3 1 1 312 1 1 1 1 48 TRP H . 48 . HN 1 1 312 1 2 1 1 49 GLN H . 49 . HN 1 1 313 1 1 1 1 48 TRP HA . 48 . HA 1 1 313 1 2 1 1 48 TRP HD1 . 48 . HD1 1 1 314 1 1 1 1 48 TRP HA . 48 . HA 1 1 314 1 2 1 1 49 GLN H . 49 . HN 1 1 315 1 1 1 1 48 TRP HB2 . 48 . HB2 1 1 315 1 2 1 1 49 GLN H . 49 . HN 1 1 316 1 1 1 1 48 TRP HB3 . 48 . HB3 1 1 316 1 2 1 1 48 TRP HD1 . 48 . HD1 1 1 317 1 1 1 1 48 TRP HB3 . 48 . HB3 1 1 317 1 2 1 1 49 GLN H . 49 . HN 1 1 318 1 1 1 1 48 TRP HD1 . 48 . HD1 1 1 318 1 2 1 1 49 GLN H . 49 . HN 1 1 319 1 1 1 1 48 TRP HH2 . 48 . HH2 1 1 319 1 2 1 1 50 CYS HA . 50 . HA 1 1 320 1 1 1 1 48 TRP HH2 . 48 . HH2 1 1 320 1 2 1 1 51 PRO HD2 . 51 . HD2 1 1 321 1 1 1 1 48 TRP HH2 . 48 . HH2 1 1 321 1 2 1 1 51 PRO HD3 . 51 . HD3 1 1 322 1 1 1 1 48 TRP HZ2 . 48 . HZ2 1 1 322 1 2 1 1 50 CYS HA . 50 . HA 1 1 323 1 1 1 1 48 TRP HZ2 . 48 . HZ2 1 1 323 1 2 1 1 51 PRO QG . 51 . HG2 1 1 324 1 1 1 1 48 TRP HZ3 . 48 . HZ3 1 1 324 1 2 1 1 50 CYS HA . 50 . HA 1 1 325 1 1 1 1 48 TRP HZ3 . 48 . HZ3 1 1 325 1 2 1 1 50 CYS QB . 50 . HB2 1 1 326 1 1 1 1 49 GLN H . 49 . HN 1 1 326 1 2 1 1 49 GLN QB . 49 . HB2 1 1 327 1 1 1 1 49 GLN H . 49 . HN 1 1 327 1 2 1 1 49 GLN HG2 . 49 . HG2 1 1 328 1 1 1 1 49 GLN H . 49 . HN 1 1 328 1 2 1 1 49 GLN HG3 . 49 . HG3 1 1 329 1 1 1 1 49 GLN H . 49 . HN 1 1 329 1 2 1 1 50 CYS H . 50 . HN 1 1 330 1 1 1 1 49 GLN HA . 49 . HA 1 1 330 1 2 1 1 49 GLN HE21 . 49 . HE21 1 1 331 1 1 1 1 49 GLN HA . 49 . HA 1 1 331 1 2 1 1 49 GLN HE22 . 49 . HE22 1 1 332 1 1 1 1 49 GLN HA . 49 . HA 1 1 332 1 2 1 1 49 GLN HG2 . 49 . HG2 1 1 333 1 1 1 1 49 GLN HA . 49 . HA 1 1 333 1 2 1 1 49 GLN HG3 . 49 . HG3 1 1 334 1 1 1 1 49 GLN HA . 49 . HA 1 1 334 1 2 1 1 50 CYS H . 50 . HN 1 1 335 1 1 1 1 49 GLN QB . 49 . HB2 1 1 335 1 2 1 1 49 GLN HG3 . 49 . HG3 1 1 336 1 1 1 1 49 GLN QB . 49 . HB2 1 1 336 1 2 1 1 50 CYS H . 50 . HN 1 1 337 1 1 1 1 49 GLN HE21 . 49 . HE21 1 1 337 1 2 1 1 49 GLN HG2 . 49 . HG2 1 1 338 1 1 1 1 49 GLN HE21 . 49 . HE21 1 1 338 1 2 1 1 49 GLN HG3 . 49 . HG3 1 1 339 1 1 1 1 49 GLN HE21 . 49 . HE21 1 1 339 1 2 1 1 53 CYS QB . 53 . HB2 1 1 340 1 1 1 1 49 GLN HE22 . 49 . HE22 1 1 340 1 2 1 1 49 GLN HG2 . 49 . HG2 1 1 341 1 1 1 1 49 GLN HE22 . 49 . HE22 1 1 341 1 2 1 1 49 GLN HG3 . 49 . HG3 1 1 342 1 1 1 1 49 GLN HE22 . 49 . HE22 1 1 342 1 2 1 1 53 CYS QB . 53 . HB2 1 1 343 1 1 1 1 49 GLN HG2 . 49 . HG2 1 1 343 1 2 1 1 50 CYS H . 50 . HN 1 1 344 1 1 1 1 49 GLN HG3 . 49 . HG3 1 1 344 1 2 1 1 50 CYS H . 50 . HN 1 1 345 1 1 1 1 50 CYS H . 50 . HN 1 1 345 1 2 1 1 50 CYS QB . 50 . HB2 1 1 346 1 1 1 1 50 CYS HA . 50 . HA 1 1 346 1 2 1 1 51 PRO HD2 . 51 . HD2 1 1 347 1 1 1 1 50 CYS HA . 50 . HA 1 1 347 1 2 1 1 51 PRO HD3 . 51 . HD3 1 1 348 1 1 1 1 51 PRO HA . 51 . HA 1 1 348 1 2 1 1 51 PRO QB . 51 . HB2 1 1 349 1 1 1 1 51 PRO HA . 51 . HA 1 1 349 1 2 1 1 52 ARG H . 52 . HN 1 1 350 1 1 1 1 51 PRO HA . 51 . HA 1 1 350 1 2 1 1 54 THR H . 54 . HN 1 1 351 1 1 1 1 51 PRO QB . 51 . HB2 1 1 351 1 2 1 1 51 PRO HD2 . 51 . HD2 1 1 352 1 1 1 1 51 PRO QB . 51 . HB2 1 1 352 1 2 1 1 51 PRO HD3 . 51 . HD3 1 1 353 1 1 1 1 51 PRO QB . 51 . HB2 1 1 353 1 2 1 1 52 ARG H . 52 . HN 1 1 354 1 1 1 1 51 PRO HD2 . 51 . HD2 1 1 354 1 2 1 1 52 ARG H . 52 . HN 1 1 355 1 1 1 1 51 PRO HD3 . 51 . HD3 1 1 355 1 2 1 1 52 ARG H . 52 . HN 1 1 356 1 1 1 1 51 PRO QG . 51 . HG2 1 1 356 1 2 1 1 52 ARG H . 52 . HN 1 1 357 1 1 1 1 52 ARG H . 52 . HN 1 1 357 1 2 1 1 52 ARG HA . 52 . HA 1 1 358 1 1 1 1 52 ARG H . 52 . HN 1 1 358 1 2 1 1 52 ARG HD2 . 52 . HD2 1 1 359 1 1 1 1 52 ARG H . 52 . HN 1 1 359 1 2 1 1 52 ARG HD3 . 52 . HD3 1 1 360 1 1 1 1 52 ARG H . 52 . HN 1 1 360 1 2 1 1 52 ARG HG2 . 52 . HG2 1 1 361 1 1 1 1 52 ARG H . 52 . HN 1 1 361 1 2 1 1 53 CYS H . 53 . HN 1 1 362 1 1 1 1 52 ARG H . 52 . HN 1 1 362 1 2 1 1 54 THR H . 54 . HN 1 1 363 1 1 1 1 52 ARG HA . 52 . HA 1 1 363 1 2 1 1 52 ARG HD3 . 52 . HD3 1 1 364 1 1 1 1 52 ARG HA . 52 . HA 1 1 364 1 2 1 1 53 CYS H . 53 . HN 1 1 365 1 1 1 1 52 ARG HB2 . 52 . HB2 1 1 365 1 2 1 1 53 CYS H . 53 . HN 1 1 366 1 1 1 1 52 ARG HB3 . 52 . HB3 1 1 366 1 2 1 1 53 CYS H . 53 . HN 1 1 367 1 1 1 1 52 ARG HG2 . 52 . HG2 1 1 367 1 2 1 1 53 CYS H . 53 . HN 1 1 368 1 1 1 1 52 ARG HG3 . 52 . HG3 1 1 368 1 2 1 1 53 CYS H . 53 . HN 1 1 369 1 1 1 1 53 CYS H . 53 . HN 1 1 369 1 2 1 1 53 CYS HA . 53 . HA 1 1 370 1 1 1 1 53 CYS H . 53 . HN 1 1 370 1 2 1 1 53 CYS QB . 53 . HB2 1 1 371 1 1 1 1 53 CYS H . 53 . HN 1 1 371 1 2 1 1 54 THR H . 54 . HN 1 1 372 1 1 1 1 53 CYS HA . 53 . HA 1 1 372 1 2 1 1 53 CYS QB . 53 . HB2 1 1 373 1 1 1 1 53 CYS HA . 53 . HA 1 1 373 1 2 1 1 54 THR H . 54 . HN 1 1 374 1 1 1 1 53 CYS QB . 53 . HB2 1 1 374 1 2 1 1 54 THR H . 54 . HN 1 1 375 1 1 1 1 54 THR HB . 54 . HB 1 1 375 1 2 1 1 55 CYS H . 55 . HN 1 1 376 1 1 1 1 55 CYS H . 55 . HN 1 1 376 1 2 1 1 55 CYS QB . 55 . HB2 1 1 377 1 1 1 1 56 PRO HA . 56 . HA 1 1 377 1 2 1 1 57 ALA H . 57 . HN 1 1 378 1 1 1 1 56 PRO HB2 . 56 . HB2 1 1 378 1 2 1 1 57 ALA H . 57 . HN 1 1 379 1 1 1 1 56 PRO HB3 . 56 . HB3 1 1 379 1 2 1 1 57 ALA H . 57 . HN 1 1 380 1 1 1 1 56 PRO HG2 . 56 . HG2 1 1 380 1 2 1 1 57 ALA H . 57 . HN 1 1 381 1 1 1 1 56 PRO HG3 . 56 . HG3 1 1 381 1 2 1 1 57 ALA H . 57 . HN 1 1 382 1 1 1 1 57 ALA HA . 57 . HA 1 1 382 1 2 1 1 58 LEU H . 58 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.4 1.7 3.1 1 1 2 1 . . . . . 4.1 2.0 6.0 1 1 3 1 . . . . . 4.0 2.0 6.0 1 1 4 1 . . . . . 4.3 2.0 4.9 1 1 5 1 . . . . . 3.1 2.0 4.3 1 1 6 1 . . . . . 6.0 1.5 6.0 1 1 7 1 . . . . . 5.0 1.9 6.0 1 1 8 1 . . . . . 4.7 2.0 6.0 1 1 9 1 . . . . . 6.0 1.5 6.0 1 1 10 1 . . . . . 3.1 1.9 4.3 1 1 11 1 . . . . . 2.9 1.8 4.0 1 1 12 1 . . . . . 3.0 1.9 4.1 1 1 13 1 . . . . . 6.0 1.5 6.0 1 1 14 1 . . . . . 3.3 1.9 4.7 1 1 15 1 . . . . . 6.0 1.5 6.0 1 1 16 1 . . . . . 3.8 2.0 5.6 1 1 17 1 . . . . . 4.5 2.0 6.0 1 1 18 1 . . . . . 3.8 2.0 5.6 1 1 19 1 . . . . . 2.6 1.7 3.5 1 1 20 1 . . . . . 6.0 1.5 6.0 1 1 21 1 . . . . . 6.0 1.5 6.0 1 1 22 1 . . . . . 6.0 1.5 6.0 1 1 23 1 . . . . . 6.0 1.5 6.0 1 1 24 1 . . . . . 3.9 2.0 5.8 1 1 25 1 . . . . . 4.8 2.0 6.0 1 1 26 1 . . . . . 2.9 1.9 3.9 1 1 27 1 . . . . . 2.4 1.7 3.1 1 1 28 1 . . . . . 6.0 1.5 6.0 1 1 29 1 . . . . . 4.6 1.9 6.0 1 1 30 1 . . . . . 2.9 1.9 3.9 1 1 31 1 . . . . . 4.0 2.0 6.0 1 1 32 1 . . . . . 6.0 1.5 6.0 1 1 33 1 . . . . . 4.2 2.0 6.0 1 1 34 1 . . . . . 2.7 1.8 3.6 1 1 35 1 . . . . . 3.5 1.9 5.1 1 1 36 1 . . . . . 5.7 1.7 6.0 1 1 37 1 . . . . . 4.9 1.9 6.0 1 1 38 1 . . . . . 2.6 1.7 3.5 1 1 39 1 . . . . . 3.9 2.0 5.8 1 1 40 1 . . . . . 6.0 1.5 6.0 1 1 41 1 . . . . . 3.9 2.0 5.8 1 1 42 1 . . . . . 3.8 2.0 5.6 1 1 43 1 . . . . . 2.8 1.8 3.8 1 1 44 1 . . . . . 6.0 1.5 6.0 1 1 45 1 . . . . . 4.5 2.0 6.0 1 1 46 1 . . . . . 4.8 2.0 6.0 1 1 47 1 . . . . . 2.8 1.8 3.8 1 1 48 1 . . . . . 4.0 2.0 6.0 1 1 49 1 . . . . . 3.6 2.0 5.2 1 1 50 1 . . . . . 3.0 1.8 4.2 1 1 51 1 . . . . . 3.8 2.0 5.6 1 1 52 1 . . . . . 2.7 1.8 3.6 1 1 53 1 . . . . . 3.2 1.9 4.5 1 1 54 1 . . . . . 3.8 2.0 5.6 1 1 55 1 . . . . . 4.4 2.0 6.0 1 1 56 1 . . . . . 3.3 1.9 4.7 1 1 57 1 . . . . . 2.9 1.9 3.9 1 1 58 1 . . . . . 3.4 2.0 4.8 1 1 59 1 . . . . . 3.8 2.0 5.6 1 1 60 1 . . . . . 3.6 2.0 5.2 1 1 61 1 . . . . . 3.4 1.9 4.9 1 1 62 1 . . . . . 6.0 1.5 6.0 1 1 63 1 . . . . . 6.0 1.5 6.0 1 1 64 1 . . . . . 4.1 2.0 6.0 1 1 65 1 . . . . . 2.9 1.9 3.9 1 1 66 1 . . . . . 2.3 1.6 3.0 1 1 67 1 . . . . . 2.4 1.7 3.1 1 1 68 1 . . . . . 6.0 0.0 6.0 1 1 69 1 . . . . . 6.0 1.5 6.0 1 1 70 1 . . . . . 4.0 2.0 6.0 1 1 71 1 . . . . . 2.2 1.6 2.8 1 1 72 1 . . . . . 3.7 2.0 5.4 1 1 73 1 . . . . . 2.7 1.8 3.6 1 1 74 1 . . . . . 3.0 1.9 4.1 1 1 75 1 . . . . . 3.4 2.0 4.8 1 1 76 1 . . . . . 2.8 1.8 3.8 1 1 77 1 . . . . . 4.1 2.0 6.0 1 1 78 1 . . . . . 3.2 1.9 4.5 1 1 79 1 . . . . . 6.0 1.5 6.0 1 1 80 1 . . . . . 4.4 2.0 6.0 1 1 81 1 . . . . . 2.2 1.6 2.8 1 1 82 1 . . . . . 2.1 1.5 2.7 1 1 83 1 . . . . . 5.2 1.8 6.0 1 1 84 1 . . . . . 6.0 1.5 6.0 1 1 85 1 . . . . . 6.0 1.5 6.0 1 1 86 1 . . . . . 2.0 1.5 2.5 1 1 87 1 . . . . . 3.2 1.9 4.5 1 1 88 1 . . . . . 4.2 2.0 6.0 1 1 89 1 . . . . . 3.7 2.0 5.4 1 1 90 1 . . . . . 4.5 2.0 6.0 1 1 91 1 . . . . . 6.0 1.5 6.0 1 1 92 1 . . . . . 4.5 2.0 6.0 1 1 93 1 . . . . . 4.6 2.0 6.0 1 1 94 1 . . . . . 2.6 1.7 3.5 1 1 95 1 . . . . . 6.0 1.5 6.0 1 1 96 1 . . . . . 3.2 1.9 4.5 1 1 97 1 . . . . . 6.0 1.5 6.0 1 1 98 1 . . . . . 2.8 1.8 3.8 1 1 99 1 . . . . . 3.8 2.0 5.6 1 1 100 1 . . . . . 2.9 1.8 4.0 1 1 101 1 . . . . . 2.8 1.9 3.7 1 1 102 1 . . . . . 6.0 1.5 6.0 1 1 103 1 . . . . . 6.0 1.5 6.0 1 1 104 1 . . . . . 6.0 1.5 6.0 1 1 105 1 . . . . . 6.0 1.5 6.0 1 1 106 1 . . . . . 6.0 1.5 6.0 1 1 107 1 . . . . . 3.9 2.0 5.8 1 1 108 1 . . . . . 3.8 2.0 5.6 1 1 109 1 . . . . . 2.4 1.7 3.1 1 1 110 1 . . . . . 6.0 1.5 6.0 1 1 111 1 . . . . . 6.0 1.5 6.0 1 1 112 1 . . . . . 6.0 1.5 6.0 1 1 113 1 . . . . . 6.0 1.5 6.0 1 1 114 1 . . . . . 2.7 1.8 3.6 1 1 115 1 . . . . . 6.0 1.5 6.0 1 1 116 1 . . . . . 6.0 1.5 6.0 1 1 117 1 . . . . . 6.0 1.5 6.0 1 1 118 1 . . . . . 3.8 2.0 5.6 1 1 119 1 . . . . . 3.4 1.9 4.9 1 1 120 1 . . . . . 5.1 1.9 6.0 1 1 121 1 . . . . . 2.4 1.7 3.1 1 1 122 1 . . . . . 3.5 2.0 5.0 1 1 123 1 . . . . . 3.7 2.0 5.4 1 1 124 1 . . . . . 2.3 1.7 2.9 1 1 125 1 . . . . . 5.2 1.8 6.0 1 1 126 1 . . . . . 3.3 1.9 4.7 1 1 127 1 . . . . . 6.0 1.5 6.0 1 1 128 1 . . . . . 3.5 1.9 5.1 1 1 129 1 . . . . . 3.5 2.0 5.0 1 1 130 1 . . . . . 2.9 1.8 4.0 1 1 131 1 . . . . . 3.5 2.0 5.0 1 1 132 1 . . . . . 6.0 1.5 6.0 1 1 133 1 . . . . . 6.0 1.5 6.0 1 1 134 1 . . . . . 3.7 2.0 5.4 1 1 135 1 . . . . . 2.5 1.7 3.3 1 1 136 1 . . . . . 6.0 1.5 6.0 1 1 137 1 . . . . . 4.3 2.0 6.0 1 1 138 1 . . . . . 3.6 2.0 5.2 1 1 139 1 . . . . . 2.2 1.6 2.8 1 1 140 1 . . . . . 2.6 1.7 3.5 1 1 141 1 . . . . . 3.2 1.9 4.5 1 1 142 1 . . . . . 3.5 2.0 5.0 1 1 143 1 . . . . . 6.0 1.5 6.0 1 1 144 1 . . . . . 6.0 1.5 6.0 1 1 145 1 . . . . . 4.3 2.0 6.0 1 1 146 1 . . . . . 4.2 2.0 6.0 1 1 147 1 . . . . . 6.0 1.5 6.0 1 1 148 1 . . . . . 3.5 1.9 5.1 1 1 149 1 . . . . . 3.8 2.0 5.6 1 1 150 1 . . . . . 3.9 2.0 5.8 1 1 151 1 . . . . . 3.4 2.0 4.8 1 1 152 1 . . . . . 2.8 1.8 3.8 1 1 153 1 . . . . . 2.6 1.8 3.4 1 1 154 1 . . . . . 2.8 1.8 3.8 1 1 155 1 . . . . . 3.8 2.0 5.6 1 1 156 1 . . . . . 4.1 2.0 6.0 1 1 157 1 . . . . . 3.6 2.0 5.2 1 1 158 1 . . . . . 6.0 1.5 6.0 1 1 159 1 . . . . . 6.0 1.5 6.0 1 1 160 1 . . . . . 3.7 2.0 5.4 1 1 161 1 . . . . . 2.9 1.9 3.9 1 1 162 1 . . . . . 2.2 1.6 2.8 1 1 163 1 . . . . . 6.0 1.5 6.0 1 1 164 1 . . . . . 6.0 1.5 6.0 1 1 165 1 . . . . . 2.9 1.8 4.0 1 1 166 1 . . . . . 2.3 1.6 3.0 1 1 167 1 . . . . . 2.7 1.8 3.6 1 1 168 1 . . . . . 2.2 1.6 2.8 1 1 169 1 . . . . . 6.0 1.5 6.0 1 1 170 1 . . . . . 2.8 1.8 3.8 1 1 171 1 . . . . . 6.0 1.5 6.0 1 1 172 1 . . . . . 3.0 1.8 4.2 1 1 173 1 . . . . . 6.0 1.5 6.0 1 1 174 1 . . . . . 6.0 1.5 6.0 1 1 175 1 . . . . . 6.0 1.5 6.0 1 1 176 1 . . . . . 3.8 2.0 5.6 1 1 177 1 . . . . . 6.0 1.5 6.0 1 1 178 1 . . . . . 3.7 1.9 5.5 1 1 179 1 . . . . . 2.7 1.8 3.6 1 1 180 1 . . . . . 6.0 1.5 6.0 1 1 181 1 . . . . . 2.1 1.5 2.7 1 1 182 1 . . . . . 3.2 1.9 4.5 1 1 183 1 . . . . . 4.2 2.0 6.0 1 1 184 1 . . . . . 4.7 2.0 6.0 1 1 185 1 . . . . . 3.5 2.0 5.0 1 1 186 1 . . . . . 6.0 1.5 6.0 1 1 187 1 . . . . . 2.9 1.9 3.9 1 1 188 1 . . . . . 2.2 1.6 2.8 1 1 189 1 . . . . . 3.7 2.0 5.4 1 1 190 1 . . . . . 3.1 1.9 4.3 1 1 191 1 . . . . . 2.9 1.9 3.9 1 1 192 1 . . . . . 4.8 2.0 6.0 1 1 193 1 . . . . . 3.5 1.9 5.1 1 1 194 1 . . . . . 2.2 1.6 2.8 1 1 195 1 . . . . . 3.7 2.0 5.4 1 1 196 1 . . . . . 3.3 2.0 4.6 1 1 197 1 . . . . . 3.3 1.9 4.7 1 1 198 1 . . . . . 3.6 2.0 5.2 1 1 199 1 . . . . . 4.0 2.0 6.0 1 1 200 1 . . . . . 2.7 1.8 3.6 1 1 201 1 . . . . . 6.0 1.5 6.0 1 1 202 1 . . . . . 6.0 1.5 6.0 1 1 203 1 . . . . . 6.0 1.5 6.0 1 1 204 1 . . . . . 3.9 1.9 5.9 1 1 205 1 . . . . . 3.1 1.9 4.3 1 1 206 1 . . . . . 6.0 1.5 6.0 1 1 207 1 . . . . . 6.0 1.5 6.0 1 1 208 1 . . . . . 3.2 1.9 4.5 1 1 209 1 . . . . . 3.3 1.9 4.7 1 1 210 1 . . . . . 6.0 1.5 6.0 1 1 211 1 . . . . . 3.5 2.0 5.0 1 1 212 1 . . . . . 4.3 2.0 6.0 1 1 213 1 . . . . . 6.0 1.5 6.0 1 1 214 1 . . . . . 6.0 1.1 6.0 1 1 215 1 . . . . . 3.5 1.9 5.1 1 1 216 1 . . . . . 3.6 2.0 5.2 1 1 217 1 . . . . . 2.6 1.7 3.5 1 1 218 1 . . . . . 2.9 1.8 4.0 1 1 219 1 . . . . . 2.4 1.7 3.1 1 1 220 1 . . . . . 4.6 2.0 6.0 1 1 221 1 . . . . . 2.5 1.7 3.3 1 1 222 1 . . . . . 4.7 2.0 6.0 1 1 223 1 . . . . . 6.0 1.5 6.0 1 1 224 1 . . . . . 3.6 2.0 5.2 1 1 225 1 . . . . . 4.8 2.0 6.0 1 1 226 1 . . . . . 3.3 1.9 4.7 1 1 227 1 . . . . . 4.5 2.0 6.0 1 1 228 1 . . . . . 4.1 2.0 6.0 1 1 229 1 . . . . . 6.0 1.5 6.0 1 1 230 1 . . . . . 3.4 2.0 4.8 1 1 231 1 . . . . . 4.3 2.0 6.0 1 1 232 1 . . . . . 3.8 2.0 5.6 1 1 233 1 . . . . . 6.0 1.5 6.0 1 1 234 1 . . . . . 6.0 1.5 6.0 1 1 235 1 . . . . . 4.2 2.0 6.0 1 1 236 1 . . . . . 3.0 1.9 4.1 1 1 237 1 . . . . . 2.5 1.7 3.3 1 1 238 1 . . . . . 4.1 2.0 6.0 1 1 239 1 . . . . . 2.6 1.8 3.4 1 1 240 1 . . . . . 4.9 1.9 6.0 1 1 241 1 . . . . . 4.7 1.9 6.0 1 1 242 1 . . . . . 6.0 1.5 6.0 1 1 243 1 . . . . . 2.9 1.9 3.9 1 1 244 1 . . . . . 2.0 1.5 2.5 1 1 245 1 . . . . . 3.7 2.0 5.4 1 1 246 1 . . . . . 5.4 1.8 6.0 1 1 247 1 . . . . . 4.4 1.9 6.0 1 1 248 1 . . . . . 2.2 1.6 2.8 1 1 249 1 . . . . . 2.9 1.9 3.9 1 1 250 1 . . . . . 6.0 1.5 6.0 1 1 251 1 . . . . . 6.0 0.1 6.0 1 1 252 1 . . . . . 6.0 1.5 6.0 1 1 253 1 . . . . . 6.0 1.5 6.0 1 1 254 1 . . . . . 6.0 1.5 6.0 1 1 255 1 . . . . . 6.0 1.5 6.0 1 1 256 1 . . . . . 2.9 1.9 3.9 1 1 257 1 . . . . . 2.3 1.7 2.9 1 1 258 1 . . . . . 3.4 1.9 4.9 1 1 259 1 . . . . . 3.3 1.9 4.7 1 1 260 1 . . . . . 6.0 1.5 6.0 1 1 261 1 . . . . . 6.0 1.5 6.0 1 1 262 1 . . . . . 2.7 1.8 3.6 1 1 263 1 . . . . . 3.9 2.0 5.8 1 1 264 1 . . . . . 2.0 1.5 2.5 1 1 265 1 . . . . . 2.8 1.8 3.8 1 1 266 1 . . . . . 3.4 1.9 4.9 1 1 267 1 . . . . . 3.1 1.9 4.3 1 1 268 1 . . . . . 6.0 1.5 6.0 1 1 269 1 . . . . . 2.7 1.8 3.6 1 1 270 1 . . . . . 3.5 1.9 5.1 1 1 271 1 . . . . . 6.0 1.2 6.0 1 1 272 1 . . . . . 3.9 2.0 5.8 1 1 273 1 . . . . . 3.2 1.9 4.5 1 1 274 1 . . . . . 6.0 1.5 6.0 1 1 275 1 . . . . . 4.4 2.0 6.0 1 1 276 1 . . . . . 3.3 1.9 4.7 1 1 277 1 . . . . . 3.4 1.9 4.9 1 1 278 1 . . . . . 2.9 1.9 3.9 1 1 279 1 . . . . . 6.0 1.5 6.0 1 1 280 1 . . . . . 6.0 1.3 6.0 1 1 281 1 . . . . . 3.9 2.0 5.8 1 1 282 1 . . . . . 3.6 2.0 5.2 1 1 283 1 . . . . . 3.6 1.9 5.3 1 1 284 1 . . . . . 3.9 2.0 5.8 1 1 285 1 . . . . . 6.0 1.5 6.0 1 1 286 1 . . . . . 6.0 1.5 6.0 1 1 287 1 . . . . . 6.0 1.5 6.0 1 1 288 1 . . . . . 6.0 1.5 6.0 1 1 289 1 . . . . . 3.6 1.9 5.3 1 1 290 1 . . . . . 4.3 2.0 6.0 1 1 291 1 . . . . . 2.8 1.8 3.8 1 1 292 1 . . . . . 2.5 1.7 2.9 1 1 293 1 . . . . . 4.6 1.9 6.0 1 1 294 1 . . . . . 2.7 1.8 3.6 1 1 295 1 . . . . . 4.5 1.9 6.0 1 1 296 1 . . . . . 4.6 1.9 6.0 1 1 297 1 . . . . . 4.1 2.0 6.0 1 1 298 1 . . . . . 6.0 1.5 6.0 1 1 299 1 . . . . . 3.0 1.9 4.1 1 1 300 1 . . . . . 3.3 1.9 4.7 1 1 301 1 . . . . . 2.8 1.8 3.8 1 1 302 1 . . . . . 6.0 1.5 6.0 1 1 303 1 . . . . . 6.0 1.5 6.0 1 1 304 1 . . . . . 2.6 1.7 3.5 1 1 305 1 . . . . . 6.0 1.5 6.0 1 1 306 1 . . . . . 2.2 1.6 2.8 1 1 307 1 . . . . . 3.2 1.9 4.5 1 1 308 1 . . . . . 6.0 1.5 6.0 1 1 309 1 . . . . . 4.2 2.0 6.0 1 1 310 1 . . . . . 3.0 1.8 4.2 1 1 311 1 . . . . . 2.8 1.8 3.8 1 1 312 1 . . . . . 3.9 2.0 5.8 1 1 313 1 . . . . . 2.6 1.8 3.4 1 1 314 1 . . . . . 2.0 1.5 2.5 1 1 315 1 . . . . . 6.0 0.0 6.0 1 1 316 1 . . . . . 3.2 1.9 4.5 1 1 317 1 . . . . . 3.6 1.9 5.3 1 1 318 1 . . . . . 4.4 2.0 6.0 1 1 319 1 . . . . . 3.1 1.9 4.3 1 1 320 1 . . . . . 4.3 2.0 6.0 1 1 321 1 . . . . . 3.8 2.0 5.6 1 1 322 1 . . . . . 2.8 1.8 3.8 1 1 323 1 . . . . . 5.3 1.8 6.0 1 1 324 1 . . . . . 4.0 2.0 6.0 1 1 325 1 . . . . . 3.9 2.0 5.8 1 1 326 1 . . . . . 2.5 1.7 3.3 1 1 327 1 . . . . . 4.0 2.0 6.0 1 1 328 1 . . . . . 4.0 2.0 6.0 1 1 329 1 . . . . . 3.6 2.0 5.2 1 1 330 1 . . . . . 6.0 1.5 6.0 1 1 331 1 . . . . . 6.0 1.5 6.0 1 1 332 1 . . . . . 3.2 2.0 4.4 1 1 333 1 . . . . . 3.3 1.9 4.7 1 1 334 1 . . . . . 2.0 1.5 2.5 1 1 335 1 . . . . . 2.6 1.8 3.4 1 1 336 1 . . . . . 3.6 2.0 5.2 1 1 337 1 . . . . . 3.4 2.0 4.8 1 1 338 1 . . . . . 3.2 2.0 4.4 1 1 339 1 . . . . . 4.3 2.0 6.0 1 1 340 1 . . . . . 4.0 2.0 6.0 1 1 341 1 . . . . . 3.9 2.0 5.8 1 1 342 1 . . . . . 4.2 2.0 6.0 1 1 343 1 . . . . . 3.7 2.0 5.4 1 1 344 1 . . . . . 6.0 1.5 6.0 1 1 345 1 . . . . . 2.5 1.7 3.3 1 1 346 1 . . . . . 2.7 1.8 3.6 1 1 347 1 . . . . . 6.0 1.5 6.0 1 1 348 1 . . . . . 2.3 1.6 3.0 1 1 349 1 . . . . . 6.0 0.0 6.0 1 1 350 1 . . . . . 4.3 2.0 6.0 1 1 351 1 . . . . . 3.1 1.9 4.3 1 1 352 1 . . . . . 3.6 1.9 5.3 1 1 353 1 . . . . . 6.0 1.5 6.0 1 1 354 1 . . . . . 6.0 0.0 6.0 1 1 355 1 . . . . . 6.0 1.5 6.0 1 1 356 1 . . . . . 6.0 1.5 6.0 1 1 357 1 . . . . . 2.9 1.8 4.0 1 1 358 1 . . . . . 6.0 1.5 6.0 1 1 359 1 . . . . . 6.0 1.5 6.0 1 1 360 1 . . . . . 4.9 1.8 6.0 1 1 361 1 . . . . . 2.3 1.6 3.0 1 1 362 1 . . . . . 3.5 2.0 5.0 1 1 363 1 . . . . . 4.4 1.9 6.0 1 1 364 1 . . . . . 6.0 1.5 6.0 1 1 365 1 . . . . . 6.0 1.5 6.0 1 1 366 1 . . . . . 6.0 1.5 6.0 1 1 367 1 . . . . . 6.0 1.5 6.0 1 1 368 1 . . . . . 6.0 1.5 6.0 1 1 369 1 . . . . . 2.9 1.8 4.0 1 1 370 1 . . . . . 2.2 1.6 2.8 1 1 371 1 . . . . . 2.6 1.8 3.4 1 1 372 1 . . . . . 2.3 1.6 3.0 1 1 373 1 . . . . . 4.8 1.9 6.0 1 1 374 1 . . . . . 3.1 1.9 4.3 1 1 375 1 . . . . . 6.0 1.5 6.0 1 1 376 1 . . . . . 3.8 2.0 5.6 1 1 377 1 . . . . . 6.0 1.5 6.0 1 1 378 1 . . . . . 6.0 1.5 6.0 1 1 379 1 . . . . . 6.0 1.5 6.0 1 1 380 1 . . . . . 6.0 1.5 6.0 1 1 381 1 . . . . . 6.0 1.5 6.0 1 1 382 1 . . . . . 6.0 1.5 6.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C -18.783 5.169 6.632 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -18.888 3.753 6.109 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -19.670 3.913 4.181 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -18.453 2.744 4.334 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -18.050 4.392 4.312 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -19.846 3.345 6.395 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -18.105 3.155 6.553 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -18.756 3.696 4.634 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -19.220 6.107 5.968 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 PRO C C -17.150 7.603 7.685 1.00 . A A . 2 PRO C 1 1 1 11 1 1 2 PRO CA C -18.091 6.678 8.457 1.00 . A A . 2 PRO CA 1 1 1 12 1 1 2 PRO CB C -17.524 6.373 9.851 1.00 . A A . 2 PRO CB 1 1 1 13 1 1 2 PRO CD C -17.715 4.291 8.712 1.00 . A A . 2 PRO CD 1 1 1 14 1 1 2 PRO CG C -17.777 4.923 10.071 1.00 . A A . 2 PRO CG 1 1 1 15 1 1 2 PRO HA H -19.053 7.156 8.558 1.00 . A A . 2 PRO HA 1 1 1 16 1 1 2 PRO HB2 H -16.466 6.595 9.867 1.00 . A A . 2 PRO HB2 1 1 1 17 1 1 2 PRO HB3 H -18.031 6.976 10.589 1.00 . A A . 2 PRO HB3 1 1 1 18 1 1 2 PRO HD2 H -16.696 4.028 8.461 1.00 . A A . 2 PRO HD2 1 1 1 19 1 1 2 PRO HD3 H -18.353 3.420 8.667 1.00 . A A . 2 PRO HD3 1 1 1 20 1 1 2 PRO HG2 H -17.011 4.509 10.711 1.00 . A A . 2 PRO HG2 1 1 1 21 1 1 2 PRO HG3 H -18.753 4.781 10.509 1.00 . A A . 2 PRO HG3 1 1 1 22 1 1 2 PRO N N -18.219 5.356 7.835 1.00 . A A . 2 PRO N 1 1 1 23 1 1 2 PRO O O -17.596 8.518 6.989 1.00 . A A . 2 PRO O 1 1 1 24 1 1 3 LEU C C -14.686 7.677 5.665 1.00 . A A . 3 LEU C 1 1 1 25 1 1 3 LEU CA C -14.865 8.166 7.098 1.00 . A A . 3 LEU CA 1 1 1 26 1 1 3 LEU CB C -13.531 8.131 7.847 1.00 . A A . 3 LEU CB 1 1 1 27 1 1 3 LEU CD1 C -13.336 7.679 10.305 1.00 . A A . 3 LEU CD1 1 1 1 28 1 1 3 LEU CD2 C -12.507 9.842 9.367 1.00 . A A . 3 LEU CD2 1 1 1 29 1 1 3 LEU CG C -13.557 8.748 9.247 1.00 . A A . 3 LEU CG 1 1 1 30 1 1 3 LEU H H -15.552 6.593 8.336 1.00 . A A . 3 LEU H 1 1 1 31 1 1 3 LEU HA H -15.228 9.183 7.075 1.00 . A A . 3 LEU HA 1 1 1 32 1 1 3 LEU HB2 H -13.219 7.100 7.935 1.00 . A A . 3 LEU HB2 1 1 1 33 1 1 3 LEU HB3 H -12.798 8.662 7.258 1.00 . A A . 3 LEU HB3 1 1 1 34 1 1 3 LEU HD11 H -13.112 8.149 11.251 1.00 . A A . 3 LEU HD11 1 1 1 35 1 1 3 LEU HD12 H -14.231 7.079 10.404 1.00 . A A . 3 LEU HD12 1 1 1 36 1 1 3 LEU HD13 H -12.511 7.048 10.011 1.00 . A A . 3 LEU HD13 1 1 1 37 1 1 3 LEU HD21 H -12.481 10.417 8.454 1.00 . A A . 3 LEU HD21 1 1 1 38 1 1 3 LEU HD22 H -12.756 10.490 10.194 1.00 . A A . 3 LEU HD22 1 1 1 39 1 1 3 LEU HD23 H -11.541 9.394 9.539 1.00 . A A . 3 LEU HD23 1 1 1 40 1 1 3 LEU HG H -14.527 9.193 9.419 1.00 . A A . 3 LEU HG 1 1 1 41 1 1 3 LEU N N -15.854 7.354 7.790 1.00 . A A . 3 LEU N 1 1 1 42 1 1 3 LEU O O -13.722 6.977 5.348 1.00 . A A . 3 LEU O 1 1 1 43 1 1 4 GLY C C -15.930 5.981 3.425 1.00 . A A . 4 GLY C 1 1 1 44 1 1 4 GLY CA C -15.674 7.471 3.476 1.00 . A A . 4 GLY CA 1 1 1 45 1 1 4 GLY H H -16.471 8.437 5.179 1.00 . A A . 4 GLY H 1 1 1 46 1 1 4 GLY HA2 H -16.440 7.983 2.912 1.00 . A A . 4 GLY HA2 1 1 1 47 1 1 4 GLY HA3 H -14.711 7.678 3.033 1.00 . A A . 4 GLY HA3 1 1 1 48 1 1 4 GLY N N -15.681 7.961 4.836 1.00 . A A . 4 GLY N 1 1 1 49 1 1 4 GLY O O -16.757 5.465 4.178 1.00 . A A . 4 GLY O 1 1 1 50 1 1 5 SER C C -14.212 3.175 3.402 1.00 . A A . 5 SER C 1 1 1 51 1 1 5 SER CA C -15.284 3.827 2.540 1.00 . A A . 5 SER CA 1 1 1 52 1 1 5 SER CB C -15.153 3.359 1.089 1.00 . A A . 5 SER CB 1 1 1 53 1 1 5 SER H H -14.488 5.729 2.070 1.00 . A A . 5 SER H 1 1 1 54 1 1 5 SER HA H -16.255 3.550 2.917 1.00 . A A . 5 SER HA 1 1 1 55 1 1 5 SER HB2 H -14.475 2.519 1.042 1.00 . A A . 5 SER HB2 1 1 1 56 1 1 5 SER HB3 H -16.125 3.061 0.719 1.00 . A A . 5 SER HB3 1 1 1 57 1 1 5 SER HG H -14.782 4.158 -0.670 1.00 . A A . 5 SER HG 1 1 1 58 1 1 5 SER N N -15.171 5.275 2.609 1.00 . A A . 5 SER N 1 1 1 59 1 1 5 SER O O -14.188 1.952 3.550 1.00 . A A . 5 SER O 1 1 1 60 1 1 5 SER OG O -14.651 4.398 0.264 1.00 . A A . 5 SER OG 1 1 1 61 1 1 6 ASP C C -11.131 2.838 3.831 1.00 . A A . 6 ASP C 1 1 1 62 1 1 6 ASP CA C -12.144 3.559 4.712 1.00 . A A . 6 ASP CA 1 1 1 63 1 1 6 ASP CB C -12.569 2.649 5.872 1.00 . A A . 6 ASP CB 1 1 1 64 1 1 6 ASP CG C -11.381 2.001 6.567 1.00 . A A . 6 ASP CG 1 1 1 65 1 1 6 ASP H H -13.370 4.966 3.711 1.00 . A A . 6 ASP H 1 1 1 66 1 1 6 ASP HA H -11.671 4.440 5.121 1.00 . A A . 6 ASP HA 1 1 1 67 1 1 6 ASP HB2 H -13.112 3.234 6.599 1.00 . A A . 6 ASP HB2 1 1 1 68 1 1 6 ASP HB3 H -13.210 1.867 5.491 1.00 . A A . 6 ASP HB3 1 1 1 69 1 1 6 ASP N N -13.296 4.009 3.917 1.00 . A A . 6 ASP N 1 1 1 70 1 1 6 ASP O O -9.990 3.278 3.688 1.00 . A A . 6 ASP O 1 1 1 71 1 1 6 ASP OD1 O -10.667 2.706 7.315 1.00 . A A . 6 ASP OD1 1 1 1 72 1 1 6 ASP OD2 O -11.163 0.782 6.376 1.00 . A A . 6 ASP OD2 1 1 1 73 1 1 7 HIS C C -10.702 1.720 0.896 1.00 . A A . 7 HIS C 1 1 1 74 1 1 7 HIS CA C -10.739 1.037 2.256 1.00 . A A . 7 HIS CA 1 1 1 75 1 1 7 HIS CB C -11.229 -0.403 2.116 1.00 . A A . 7 HIS CB 1 1 1 76 1 1 7 HIS CD2 C -9.188 -1.412 0.925 1.00 . A A . 7 HIS CD2 1 1 1 77 1 1 7 HIS CE1 C -8.819 -3.033 2.332 1.00 . A A . 7 HIS CE1 1 1 1 78 1 1 7 HIS CG C -10.115 -1.374 1.908 1.00 . A A . 7 HIS CG 1 1 1 79 1 1 7 HIS H H -12.520 1.511 3.288 1.00 . A A . 7 HIS H 1 1 1 80 1 1 7 HIS HA H -9.738 1.025 2.662 1.00 . A A . 7 HIS HA 1 1 1 81 1 1 7 HIS HB2 H -11.758 -0.687 3.014 1.00 . A A . 7 HIS HB2 1 1 1 82 1 1 7 HIS HB3 H -11.896 -0.473 1.270 1.00 . A A . 7 HIS HB3 1 1 1 83 1 1 7 HIS HD2 H -9.113 -0.737 0.082 1.00 . A A . 7 HIS HD2 1 1 1 84 1 1 7 HIS HE1 H -8.373 -3.893 2.809 1.00 . A A . 7 HIS HE1 1 1 1 85 1 1 7 HIS HE2 H -7.453 -2.598 0.831 1.00 . A A . 7 HIS HE2 1 1 1 86 1 1 7 HIS N N -11.577 1.775 3.178 1.00 . A A . 7 HIS N 1 1 1 87 1 1 7 HIS ND1 N -9.881 -2.396 2.794 1.00 . A A . 7 HIS ND1 1 1 1 88 1 1 7 HIS NE2 N -8.361 -2.473 1.202 1.00 . A A . 7 HIS NE2 1 1 1 89 1 1 7 HIS O O -11.168 1.178 -0.108 1.00 . A A . 7 HIS O 1 1 1 90 1 1 8 HIS C C -9.194 4.945 -0.019 1.00 . A A . 8 HIS C 1 1 1 91 1 1 8 HIS CA C -10.008 3.704 -0.328 1.00 . A A . 8 HIS CA 1 1 1 92 1 1 8 HIS CB C -11.383 4.090 -0.889 1.00 . A A . 8 HIS CB 1 1 1 93 1 1 8 HIS CD2 C -10.956 4.843 -3.321 1.00 . A A . 8 HIS CD2 1 1 1 94 1 1 8 HIS CE1 C -11.465 6.943 -3.057 1.00 . A A . 8 HIS CE1 1 1 1 95 1 1 8 HIS CG C -11.324 5.055 -2.037 1.00 . A A . 8 HIS CG 1 1 1 96 1 1 8 HIS H H -9.809 3.291 1.730 1.00 . A A . 8 HIS H 1 1 1 97 1 1 8 HIS HA H -9.479 3.107 -1.056 1.00 . A A . 8 HIS HA 1 1 1 98 1 1 8 HIS HB2 H -11.881 3.194 -1.231 1.00 . A A . 8 HIS HB2 1 1 1 99 1 1 8 HIS HB3 H -11.967 4.544 -0.103 1.00 . A A . 8 HIS HB3 1 1 1 100 1 1 8 HIS HD2 H -10.646 3.906 -3.757 1.00 . A A . 8 HIS HD2 1 1 1 101 1 1 8 HIS HE1 H -11.632 7.988 -3.264 1.00 . A A . 8 HIS HE1 1 1 1 102 1 1 8 HIS HE2 H -10.633 6.266 -4.836 1.00 . A A . 8 HIS HE2 1 1 1 103 1 1 8 HIS N N -10.147 2.918 0.883 1.00 . A A . 8 HIS N 1 1 1 104 1 1 8 HIS ND1 N -11.648 6.380 -1.874 1.00 . A A . 8 HIS ND1 1 1 1 105 1 1 8 HIS NE2 N -11.047 6.050 -3.966 1.00 . A A . 8 HIS NE2 1 1 1 106 1 1 8 HIS O O -9.664 5.846 0.677 1.00 . A A . 8 HIS O 1 1 1 107 1 1 9 MET C C -5.913 6.110 -1.137 1.00 . A A . 9 MET C 1 1 1 108 1 1 9 MET CA C -7.054 6.047 -0.141 1.00 . A A . 9 MET CA 1 1 1 109 1 1 9 MET CB C -6.505 5.930 1.287 1.00 . A A . 9 MET CB 1 1 1 110 1 1 9 MET CE C -7.103 2.250 2.158 1.00 . A A . 9 MET CE 1 1 1 111 1 1 9 MET CG C -5.789 4.619 1.572 1.00 . A A . 9 MET CG 1 1 1 112 1 1 9 MET H H -7.600 4.164 -0.937 1.00 . A A . 9 MET H 1 1 1 113 1 1 9 MET HA H -7.627 6.958 -0.219 1.00 . A A . 9 MET HA 1 1 1 114 1 1 9 MET HB2 H -5.808 6.737 1.455 1.00 . A A . 9 MET HB2 1 1 1 115 1 1 9 MET HB3 H -7.326 6.025 1.982 1.00 . A A . 9 MET HB3 1 1 1 116 1 1 9 MET HE1 H -8.182 2.235 2.202 1.00 . A A . 9 MET HE1 1 1 1 117 1 1 9 MET HE2 H -6.785 2.252 1.126 1.00 . A A . 9 MET HE2 1 1 1 118 1 1 9 MET HE3 H -6.711 1.375 2.655 1.00 . A A . 9 MET HE3 1 1 1 119 1 1 9 MET HG2 H -5.853 3.990 0.696 1.00 . A A . 9 MET HG2 1 1 1 120 1 1 9 MET HG3 H -4.753 4.831 1.786 1.00 . A A . 9 MET HG3 1 1 1 121 1 1 9 MET N N -7.944 4.944 -0.440 1.00 . A A . 9 MET N 1 1 1 122 1 1 9 MET O O -5.316 5.091 -1.489 1.00 . A A . 9 MET O 1 1 1 123 1 1 9 MET SD S -6.495 3.727 2.971 1.00 . A A . 9 MET SD 1 1 1 124 1 1 10 GLU C C -3.218 7.821 -1.715 1.00 . A A . 10 GLU C 1 1 1 125 1 1 10 GLU CA C -4.510 7.566 -2.486 1.00 . A A . 10 GLU CA 1 1 1 126 1 1 10 GLU CB C -4.836 8.766 -3.385 1.00 . A A . 10 GLU CB 1 1 1 127 1 1 10 GLU CD C -6.662 10.140 -2.295 1.00 . A A . 10 GLU CD 1 1 1 128 1 1 10 GLU CG C -5.186 10.031 -2.614 1.00 . A A . 10 GLU CG 1 1 1 129 1 1 10 GLU H H -6.128 8.089 -1.234 1.00 . A A . 10 GLU H 1 1 1 130 1 1 10 GLU HA H -4.386 6.687 -3.098 1.00 . A A . 10 GLU HA 1 1 1 131 1 1 10 GLU HB2 H -3.979 8.977 -4.005 1.00 . A A . 10 GLU HB2 1 1 1 132 1 1 10 GLU HB3 H -5.675 8.513 -4.017 1.00 . A A . 10 GLU HB3 1 1 1 133 1 1 10 GLU HG2 H -4.633 10.035 -1.686 1.00 . A A . 10 GLU HG2 1 1 1 134 1 1 10 GLU HG3 H -4.896 10.887 -3.207 1.00 . A A . 10 GLU HG3 1 1 1 135 1 1 10 GLU N N -5.602 7.321 -1.561 1.00 . A A . 10 GLU N 1 1 1 136 1 1 10 GLU O O -2.323 8.527 -2.181 1.00 . A A . 10 GLU O 1 1 1 137 1 1 10 GLU OE1 O -7.116 9.511 -1.313 1.00 . A A . 10 GLU OE1 1 1 1 138 1 1 10 GLU OE2 O -7.380 10.852 -3.022 1.00 . A A . 10 GLU OE2 1 1 1 139 1 1 11 PHE C C -1.799 6.174 1.210 1.00 . A A . 11 PHE C 1 1 1 140 1 1 11 PHE CA C -1.982 7.408 0.335 1.00 . A A . 11 PHE CA 1 1 1 141 1 1 11 PHE CB C -2.118 8.671 1.197 1.00 . A A . 11 PHE CB 1 1 1 142 1 1 11 PHE CD1 C -4.531 8.975 1.825 1.00 . A A . 11 PHE CD1 1 1 1 143 1 1 11 PHE CD2 C -3.001 8.263 3.508 1.00 . A A . 11 PHE CD2 1 1 1 144 1 1 11 PHE CE1 C -5.559 8.947 2.744 1.00 . A A . 11 PHE CE1 1 1 1 145 1 1 11 PHE CE2 C -4.026 8.233 4.433 1.00 . A A . 11 PHE CE2 1 1 1 146 1 1 11 PHE CG C -3.241 8.632 2.195 1.00 . A A . 11 PHE CG 1 1 1 147 1 1 11 PHE CZ C -5.307 8.575 4.051 1.00 . A A . 11 PHE CZ 1 1 1 148 1 1 11 PHE H H -3.885 6.689 -0.215 1.00 . A A . 11 PHE H 1 1 1 149 1 1 11 PHE HA H -1.115 7.510 -0.300 1.00 . A A . 11 PHE HA 1 1 1 150 1 1 11 PHE HB2 H -1.201 8.819 1.745 1.00 . A A . 11 PHE HB2 1 1 1 151 1 1 11 PHE HB3 H -2.281 9.519 0.549 1.00 . A A . 11 PHE HB3 1 1 1 152 1 1 11 PHE HD1 H -4.729 9.267 0.803 1.00 . A A . 11 PHE HD1 1 1 1 153 1 1 11 PHE HD2 H -1.997 7.995 3.807 1.00 . A A . 11 PHE HD2 1 1 1 154 1 1 11 PHE HE1 H -6.561 9.213 2.442 1.00 . A A . 11 PHE HE1 1 1 1 155 1 1 11 PHE HE2 H -3.823 7.942 5.453 1.00 . A A . 11 PHE HE2 1 1 1 156 1 1 11 PHE HZ H -6.110 8.554 4.772 1.00 . A A . 11 PHE HZ 1 1 1 157 1 1 11 PHE N N -3.142 7.249 -0.523 1.00 . A A . 11 PHE N 1 1 1 158 1 1 11 PHE O O -2.597 5.238 1.147 1.00 . A A . 11 PHE O 1 1 1 159 1 1 12 CYS C C -1.310 4.831 3.955 1.00 . A A . 12 CYS C 1 1 1 160 1 1 12 CYS CA C -0.364 4.992 2.778 1.00 . A A . 12 CYS CA 1 1 1 161 1 1 12 CYS CB C 1.069 5.106 3.278 1.00 . A A . 12 CYS CB 1 1 1 162 1 1 12 CYS H H -0.079 6.896 1.908 1.00 . A A . 12 CYS H 1 1 1 163 1 1 12 CYS HA H -0.443 4.116 2.154 1.00 . A A . 12 CYS HA 1 1 1 164 1 1 12 CYS HB2 H 1.327 6.149 3.384 1.00 . A A . 12 CYS HB2 1 1 1 165 1 1 12 CYS HB3 H 1.151 4.618 4.235 1.00 . A A . 12 CYS HB3 1 1 1 166 1 1 12 CYS HG H 3.303 5.176 2.057 1.00 . A A . 12 CYS HG 1 1 1 167 1 1 12 CYS N N -0.704 6.146 1.957 1.00 . A A . 12 CYS N 1 1 1 168 1 1 12 CYS O O -1.541 5.772 4.711 1.00 . A A . 12 CYS O 1 1 1 169 1 1 12 CYS SG S 2.263 4.351 2.169 1.00 . A A . 12 CYS SG 1 1 1 170 1 1 13 ARG C C -2.075 3.600 6.575 1.00 . A A . 13 ARG C 1 1 1 171 1 1 13 ARG CA C -2.708 3.272 5.224 1.00 . A A . 13 ARG CA 1 1 1 172 1 1 13 ARG CB C -3.046 1.780 5.179 1.00 . A A . 13 ARG CB 1 1 1 173 1 1 13 ARG CD C -4.987 0.225 4.833 1.00 . A A . 13 ARG CD 1 1 1 174 1 1 13 ARG CG C -4.240 1.442 4.307 1.00 . A A . 13 ARG CG 1 1 1 175 1 1 13 ARG CZ C -7.353 0.017 5.498 1.00 . A A . 13 ARG CZ 1 1 1 176 1 1 13 ARG H H -1.561 2.907 3.483 1.00 . A A . 13 ARG H 1 1 1 177 1 1 13 ARG HA H -3.616 3.846 5.107 1.00 . A A . 13 ARG HA 1 1 1 178 1 1 13 ARG HB2 H -2.190 1.241 4.799 1.00 . A A . 13 ARG HB2 1 1 1 179 1 1 13 ARG HB3 H -3.254 1.441 6.185 1.00 . A A . 13 ARG HB3 1 1 1 180 1 1 13 ARG HD2 H -5.305 -0.377 3.996 1.00 . A A . 13 ARG HD2 1 1 1 181 1 1 13 ARG HD3 H -4.320 -0.350 5.459 1.00 . A A . 13 ARG HD3 1 1 1 182 1 1 13 ARG HE H -6.056 1.350 6.255 1.00 . A A . 13 ARG HE 1 1 1 183 1 1 13 ARG HG2 H -4.914 2.287 4.291 1.00 . A A . 13 ARG HG2 1 1 1 184 1 1 13 ARG HG3 H -3.894 1.235 3.305 1.00 . A A . 13 ARG HG3 1 1 1 185 1 1 13 ARG HH11 H -6.758 -1.367 4.139 1.00 . A A . 13 ARG HH11 1 1 1 186 1 1 13 ARG HH12 H -8.421 -1.458 4.612 1.00 . A A . 13 ARG HH12 1 1 1 187 1 1 13 ARG HH21 H -8.242 1.216 6.868 1.00 . A A . 13 ARG HH21 1 1 1 188 1 1 13 ARG HH22 H -9.277 0.033 6.130 1.00 . A A . 13 ARG HH22 1 1 1 189 1 1 13 ARG N N -1.809 3.609 4.123 1.00 . A A . 13 ARG N 1 1 1 190 1 1 13 ARG NE N -6.162 0.602 5.613 1.00 . A A . 13 ARG NE 1 1 1 191 1 1 13 ARG NH1 N -7.525 -1.015 4.680 1.00 . A A . 13 ARG NH1 1 1 1 192 1 1 13 ARG NH2 N -8.370 0.450 6.223 1.00 . A A . 13 ARG NH2 1 1 1 193 1 1 13 ARG O O -2.754 4.032 7.503 1.00 . A A . 13 ARG O 1 1 1 194 1 1 14 VAL C C 0.718 4.704 8.046 1.00 . A A . 14 VAL C 1 1 1 195 1 1 14 VAL CA C -0.091 3.409 7.976 1.00 . A A . 14 VAL CA 1 1 1 196 1 1 14 VAL CB C 0.872 2.218 8.181 1.00 . A A . 14 VAL CB 1 1 1 197 1 1 14 VAL CG1 C 1.043 1.917 9.660 1.00 . A A . 14 VAL CG1 1 1 1 198 1 1 14 VAL CG2 C 0.389 0.981 7.426 1.00 . A A . 14 VAL CG2 1 1 1 199 1 1 14 VAL H H -0.336 2.860 5.953 1.00 . A A . 14 VAL H 1 1 1 200 1 1 14 VAL HA H -0.820 3.399 8.772 1.00 . A A . 14 VAL HA 1 1 1 201 1 1 14 VAL HB H 1.839 2.497 7.785 1.00 . A A . 14 VAL HB 1 1 1 202 1 1 14 VAL HG11 H 1.567 0.980 9.779 1.00 . A A . 14 VAL HG11 1 1 1 203 1 1 14 VAL HG12 H 1.614 2.708 10.124 1.00 . A A . 14 VAL HG12 1 1 1 204 1 1 14 VAL HG13 H 0.073 1.850 10.128 1.00 . A A . 14 VAL HG13 1 1 1 205 1 1 14 VAL HG21 H 0.972 0.124 7.728 1.00 . A A . 14 VAL HG21 1 1 1 206 1 1 14 VAL HG22 H -0.652 0.805 7.652 1.00 . A A . 14 VAL HG22 1 1 1 207 1 1 14 VAL HG23 H 0.505 1.135 6.359 1.00 . A A . 14 VAL HG23 1 1 1 208 1 1 14 VAL N N -0.796 3.280 6.705 1.00 . A A . 14 VAL N 1 1 1 209 1 1 14 VAL O O 0.632 5.467 9.009 1.00 . A A . 14 VAL O 1 1 1 210 1 1 15 CYS C C 2.080 7.170 6.238 1.00 . A A . 15 CYS C 1 1 1 211 1 1 15 CYS CA C 2.555 5.937 6.995 1.00 . A A . 15 CYS CA 1 1 1 212 1 1 15 CYS CB C 3.796 5.300 6.398 1.00 . A A . 15 CYS CB 1 1 1 213 1 1 15 CYS H H 1.634 4.169 6.377 1.00 . A A . 15 CYS H 1 1 1 214 1 1 15 CYS HA H 2.786 6.232 8.004 1.00 . A A . 15 CYS HA 1 1 1 215 1 1 15 CYS HB2 H 4.198 5.938 5.628 1.00 . A A . 15 CYS HB2 1 1 1 216 1 1 15 CYS HB3 H 4.534 5.137 7.168 1.00 . A A . 15 CYS HB3 1 1 1 217 1 1 15 CYS N N 1.577 4.866 7.063 1.00 . A A . 15 CYS N 1 1 1 218 1 1 15 CYS O O 2.891 8.029 5.897 1.00 . A A . 15 CYS O 1 1 1 219 1 1 15 CYS SG S 3.368 3.687 5.665 1.00 . A A . 15 CYS SG 1 1 1 220 1 1 16 LYS C C 0.888 9.255 4.598 1.00 . A A . 16 LYS C 1 1 1 221 1 1 16 LYS CA C 0.088 8.541 5.687 1.00 . A A . 16 LYS CA 1 1 1 222 1 1 16 LYS CB C -0.184 9.504 6.846 1.00 . A A . 16 LYS CB 1 1 1 223 1 1 16 LYS CD C -2.355 9.368 8.106 1.00 . A A . 16 LYS CD 1 1 1 224 1 1 16 LYS CE C -2.852 9.362 9.542 1.00 . A A . 16 LYS CE 1 1 1 225 1 1 16 LYS CG C -0.925 8.864 8.010 1.00 . A A . 16 LYS CG 1 1 1 226 1 1 16 LYS H H 0.198 6.646 6.621 1.00 . A A . 16 LYS H 1 1 1 227 1 1 16 LYS HA H -0.858 8.239 5.267 1.00 . A A . 16 LYS HA 1 1 1 228 1 1 16 LYS HB2 H 0.760 9.882 7.213 1.00 . A A . 16 LYS HB2 1 1 1 229 1 1 16 LYS HB3 H -0.775 10.330 6.482 1.00 . A A . 16 LYS HB3 1 1 1 230 1 1 16 LYS HD2 H -2.398 10.377 7.726 1.00 . A A . 16 LYS HD2 1 1 1 231 1 1 16 LYS HD3 H -2.992 8.731 7.512 1.00 . A A . 16 LYS HD3 1 1 1 232 1 1 16 LYS HE2 H -2.028 9.113 10.193 1.00 . A A . 16 LYS HE2 1 1 1 233 1 1 16 LYS HE3 H -3.219 10.348 9.788 1.00 . A A . 16 LYS HE3 1 1 1 234 1 1 16 LYS HG2 H -0.939 7.794 7.869 1.00 . A A . 16 LYS HG2 1 1 1 235 1 1 16 LYS HG3 H -0.408 9.100 8.928 1.00 . A A . 16 LYS HG3 1 1 1 236 1 1 16 LYS HZ1 H -3.952 8.054 10.742 1.00 . A A . 16 LYS HZ1 1 1 1 237 1 1 16 LYS HZ2 H -3.805 7.552 9.127 1.00 . A A . 16 LYS HZ2 1 1 1 238 1 1 16 LYS HZ3 H -4.866 8.809 9.529 1.00 . A A . 16 LYS HZ3 1 1 1 239 1 1 16 LYS N N 0.753 7.326 6.187 1.00 . A A . 16 LYS N 1 1 1 240 1 1 16 LYS NZ N -3.943 8.377 9.750 1.00 . A A . 16 LYS NZ 1 1 1 241 1 1 16 LYS O O 1.405 10.351 4.811 1.00 . A A . 16 LYS O 1 1 1 242 1 1 17 ASP C C 1.067 10.223 1.608 1.00 . A A . 17 ASP C 1 1 1 243 1 1 17 ASP CA C 1.841 9.148 2.366 1.00 . A A . 17 ASP CA 1 1 1 244 1 1 17 ASP CB C 2.238 8.043 1.392 1.00 . A A . 17 ASP CB 1 1 1 245 1 1 17 ASP CG C 3.699 7.672 1.484 1.00 . A A . 17 ASP CG 1 1 1 246 1 1 17 ASP H H 0.690 7.683 3.398 1.00 . A A . 17 ASP H 1 1 1 247 1 1 17 ASP HA H 2.731 9.587 2.789 1.00 . A A . 17 ASP HA 1 1 1 248 1 1 17 ASP HB2 H 1.652 7.162 1.602 1.00 . A A . 17 ASP HB2 1 1 1 249 1 1 17 ASP HB3 H 2.034 8.373 0.384 1.00 . A A . 17 ASP HB3 1 1 1 250 1 1 17 ASP N N 1.041 8.596 3.463 1.00 . A A . 17 ASP N 1 1 1 251 1 1 17 ASP O O -0.003 10.650 2.044 1.00 . A A . 17 ASP O 1 1 1 252 1 1 17 ASP OD1 O 4.561 8.566 1.370 1.00 . A A . 17 ASP OD1 1 1 1 253 1 1 17 ASP OD2 O 3.985 6.476 1.662 1.00 . A A . 17 ASP OD2 1 1 1 254 1 1 18 GLY C C 1.489 11.814 -1.719 1.00 . A A . 18 GLY C 1 1 1 255 1 1 18 GLY CA C 0.920 11.663 -0.319 1.00 . A A . 18 GLY CA 1 1 1 256 1 1 18 GLY H H 2.461 10.291 0.167 1.00 . A A . 18 GLY H 1 1 1 257 1 1 18 GLY HA2 H -0.122 11.385 -0.402 1.00 . A A . 18 GLY HA2 1 1 1 258 1 1 18 GLY HA3 H 0.993 12.614 0.193 1.00 . A A . 18 GLY HA3 1 1 1 259 1 1 18 GLY N N 1.601 10.655 0.471 1.00 . A A . 18 GLY N 1 1 1 260 1 1 18 GLY O O 0.747 12.071 -2.668 1.00 . A A . 18 GLY O 1 1 1 261 1 1 19 GLY C C 3.631 10.511 -3.874 1.00 . A A . 19 GLY C 1 1 1 262 1 1 19 GLY CA C 3.444 11.827 -3.143 1.00 . A A . 19 GLY CA 1 1 1 263 1 1 19 GLY H H 3.350 11.462 -1.055 1.00 . A A . 19 GLY H 1 1 1 264 1 1 19 GLY HA2 H 2.838 12.481 -3.755 1.00 . A A . 19 GLY HA2 1 1 1 265 1 1 19 GLY HA3 H 4.412 12.284 -2.999 1.00 . A A . 19 GLY HA3 1 1 1 266 1 1 19 GLY N N 2.804 11.669 -1.850 1.00 . A A . 19 GLY N 1 1 1 267 1 1 19 GLY O O 2.710 10.025 -4.534 1.00 . A A . 19 GLY O 1 1 1 268 1 1 20 GLU C C 4.368 7.541 -3.716 1.00 . A A . 20 GLU C 1 1 1 269 1 1 20 GLU CA C 5.134 8.662 -4.405 1.00 . A A . 20 GLU CA 1 1 1 270 1 1 20 GLU CB C 6.639 8.370 -4.350 1.00 . A A . 20 GLU CB 1 1 1 271 1 1 20 GLU CD C 7.659 9.504 -6.365 1.00 . A A . 20 GLU CD 1 1 1 272 1 1 20 GLU CG C 7.510 9.507 -4.859 1.00 . A A . 20 GLU CG 1 1 1 273 1 1 20 GLU H H 5.522 10.386 -3.236 1.00 . A A . 20 GLU H 1 1 1 274 1 1 20 GLU HA H 4.819 8.718 -5.436 1.00 . A A . 20 GLU HA 1 1 1 275 1 1 20 GLU HB2 H 6.915 8.165 -3.327 1.00 . A A . 20 GLU HB2 1 1 1 276 1 1 20 GLU HB3 H 6.843 7.495 -4.950 1.00 . A A . 20 GLU HB3 1 1 1 277 1 1 20 GLU HG2 H 7.065 10.445 -4.560 1.00 . A A . 20 GLU HG2 1 1 1 278 1 1 20 GLU HG3 H 8.491 9.418 -4.414 1.00 . A A . 20 GLU HG3 1 1 1 279 1 1 20 GLU N N 4.828 9.940 -3.768 1.00 . A A . 20 GLU N 1 1 1 280 1 1 20 GLU O O 4.395 7.429 -2.489 1.00 . A A . 20 GLU O 1 1 1 281 1 1 20 GLU OE1 O 8.239 8.546 -6.912 1.00 . A A . 20 GLU OE1 1 1 1 282 1 1 20 GLU OE2 O 7.195 10.467 -7.016 1.00 . A A . 20 GLU OE2 1 1 1 283 1 1 21 LEU C C 2.797 4.461 -4.800 1.00 . A A . 21 LEU C 1 1 1 284 1 1 21 LEU CA C 2.788 5.717 -3.930 1.00 . A A . 21 LEU CA 1 1 1 285 1 1 21 LEU CB C 1.348 6.224 -3.771 1.00 . A A . 21 LEU CB 1 1 1 286 1 1 21 LEU CD1 C 1.734 5.897 -1.295 1.00 . A A . 21 LEU CD1 1 1 1 287 1 1 21 LEU CD2 C 1.061 8.138 -2.165 1.00 . A A . 21 LEU CD2 1 1 1 288 1 1 21 LEU CG C 0.926 6.637 -2.351 1.00 . A A . 21 LEU CG 1 1 1 289 1 1 21 LEU H H 3.609 6.928 -5.464 1.00 . A A . 21 LEU H 1 1 1 290 1 1 21 LEU HA H 3.179 5.467 -2.956 1.00 . A A . 21 LEU HA 1 1 1 291 1 1 21 LEU HB2 H 1.222 7.081 -4.418 1.00 . A A . 21 LEU HB2 1 1 1 292 1 1 21 LEU HB3 H 0.680 5.445 -4.105 1.00 . A A . 21 LEU HB3 1 1 1 293 1 1 21 LEU HD11 H 1.230 4.978 -1.038 1.00 . A A . 21 LEU HD11 1 1 1 294 1 1 21 LEU HD12 H 2.716 5.674 -1.683 1.00 . A A . 21 LEU HD12 1 1 1 295 1 1 21 LEU HD13 H 1.826 6.518 -0.415 1.00 . A A . 21 LEU HD13 1 1 1 296 1 1 21 LEU HD21 H 1.649 8.552 -2.972 1.00 . A A . 21 LEU HD21 1 1 1 297 1 1 21 LEU HD22 H 0.081 8.590 -2.164 1.00 . A A . 21 LEU HD22 1 1 1 298 1 1 21 LEU HD23 H 1.551 8.340 -1.223 1.00 . A A . 21 LEU HD23 1 1 1 299 1 1 21 LEU HG H -0.114 6.380 -2.209 1.00 . A A . 21 LEU HG 1 1 1 300 1 1 21 LEU N N 3.627 6.765 -4.493 1.00 . A A . 21 LEU N 1 1 1 301 1 1 21 LEU O O 2.735 4.538 -6.030 1.00 . A A . 21 LEU O 1 1 1 302 1 1 22 LEU C C 1.488 1.287 -4.367 1.00 . A A . 22 LEU C 1 1 1 303 1 1 22 LEU CA C 2.744 2.023 -4.825 1.00 . A A . 22 LEU CA 1 1 1 304 1 1 22 LEU CB C 4.001 1.200 -4.521 1.00 . A A . 22 LEU CB 1 1 1 305 1 1 22 LEU CD1 C 3.924 -0.591 -6.283 1.00 . A A . 22 LEU CD1 1 1 1 306 1 1 22 LEU CD2 C 5.038 -1.040 -4.095 1.00 . A A . 22 LEU CD2 1 1 1 307 1 1 22 LEU CG C 3.901 -0.306 -4.791 1.00 . A A . 22 LEU CG 1 1 1 308 1 1 22 LEU H H 2.833 3.321 -3.162 1.00 . A A . 22 LEU H 1 1 1 309 1 1 22 LEU HA H 2.681 2.204 -5.888 1.00 . A A . 22 LEU HA 1 1 1 310 1 1 22 LEU HB2 H 4.812 1.595 -5.116 1.00 . A A . 22 LEU HB2 1 1 1 311 1 1 22 LEU HB3 H 4.246 1.339 -3.479 1.00 . A A . 22 LEU HB3 1 1 1 312 1 1 22 LEU HD11 H 4.606 -1.405 -6.483 1.00 . A A . 22 LEU HD11 1 1 1 313 1 1 22 LEU HD12 H 2.934 -0.861 -6.614 1.00 . A A . 22 LEU HD12 1 1 1 314 1 1 22 LEU HD13 H 4.253 0.290 -6.813 1.00 . A A . 22 LEU HD13 1 1 1 315 1 1 22 LEU HD21 H 5.463 -0.404 -3.332 1.00 . A A . 22 LEU HD21 1 1 1 316 1 1 22 LEU HD22 H 4.658 -1.944 -3.640 1.00 . A A . 22 LEU HD22 1 1 1 317 1 1 22 LEU HD23 H 5.800 -1.293 -4.819 1.00 . A A . 22 LEU HD23 1 1 1 318 1 1 22 LEU HG H 2.970 -0.678 -4.392 1.00 . A A . 22 LEU HG 1 1 1 319 1 1 22 LEU N N 2.816 3.309 -4.146 1.00 . A A . 22 LEU N 1 1 1 320 1 1 22 LEU O O 1.288 1.078 -3.173 1.00 . A A . 22 LEU O 1 1 1 321 1 1 23 CYS C C -0.926 -0.882 -5.530 1.00 . A A . 23 CYS C 1 1 1 322 1 1 23 CYS CA C -0.738 0.521 -4.964 1.00 . A A . 23 CYS CA 1 1 1 323 1 1 23 CYS CB C -1.821 1.454 -5.508 1.00 . A A . 23 CYS CB 1 1 1 324 1 1 23 CYS H H 0.747 1.360 -6.218 1.00 . A A . 23 CYS H 1 1 1 325 1 1 23 CYS HA H -0.819 0.478 -3.890 1.00 . A A . 23 CYS HA 1 1 1 326 1 1 23 CYS HB2 H -2.173 1.073 -6.454 1.00 . A A . 23 CYS HB2 1 1 1 327 1 1 23 CYS HB3 H -2.644 1.485 -4.808 1.00 . A A . 23 CYS HB3 1 1 1 328 1 1 23 CYS HG H -0.904 3.272 -7.051 1.00 . A A . 23 CYS HG 1 1 1 329 1 1 23 CYS N N 0.575 1.059 -5.297 1.00 . A A . 23 CYS N 1 1 1 330 1 1 23 CYS O O -0.171 -1.311 -6.405 1.00 . A A . 23 CYS O 1 1 1 331 1 1 23 CYS SG S -1.260 3.155 -5.775 1.00 . A A . 23 CYS SG 1 1 1 332 1 1 24 CYS C C -2.844 -2.950 -6.864 1.00 . A A . 24 CYS C 1 1 1 333 1 1 24 CYS CA C -2.199 -2.954 -5.479 1.00 . A A . 24 CYS CA 1 1 1 334 1 1 24 CYS CB C -3.121 -3.659 -4.483 1.00 . A A . 24 CYS CB 1 1 1 335 1 1 24 CYS H H -2.483 -1.220 -4.304 1.00 . A A . 24 CYS H 1 1 1 336 1 1 24 CYS HA H -1.260 -3.485 -5.528 1.00 . A A . 24 CYS HA 1 1 1 337 1 1 24 CYS HB2 H -3.976 -4.054 -5.012 1.00 . A A . 24 CYS HB2 1 1 1 338 1 1 24 CYS HB3 H -2.583 -4.472 -4.021 1.00 . A A . 24 CYS HB3 1 1 1 339 1 1 24 CYS N N -1.926 -1.600 -5.023 1.00 . A A . 24 CYS N 1 1 1 340 1 1 24 CYS O O -3.087 -1.893 -7.450 1.00 . A A . 24 CYS O 1 1 1 341 1 1 24 CYS SG S -3.746 -2.584 -3.147 1.00 . A A . 24 CYS SG 1 1 1 342 1 1 25 ASP C C -5.328 -4.803 -8.331 1.00 . A A . 25 ASP C 1 1 1 343 1 1 25 ASP CA C -3.931 -4.266 -8.597 1.00 . A A . 25 ASP CA 1 1 1 344 1 1 25 ASP CB C -3.179 -5.199 -9.550 1.00 . A A . 25 ASP CB 1 1 1 345 1 1 25 ASP CG C -3.326 -4.784 -11.002 1.00 . A A . 25 ASP CG 1 1 1 346 1 1 25 ASP H H -3.061 -4.930 -6.786 1.00 . A A . 25 ASP H 1 1 1 347 1 1 25 ASP HA H -4.009 -3.285 -9.045 1.00 . A A . 25 ASP HA 1 1 1 348 1 1 25 ASP HB2 H -2.129 -5.195 -9.298 1.00 . A A . 25 ASP HB2 1 1 1 349 1 1 25 ASP HB3 H -3.566 -6.202 -9.441 1.00 . A A . 25 ASP HB3 1 1 1 350 1 1 25 ASP N N -3.213 -4.132 -7.335 1.00 . A A . 25 ASP N 1 1 1 351 1 1 25 ASP O O -5.953 -5.427 -9.192 1.00 . A A . 25 ASP O 1 1 1 352 1 1 25 ASP OD1 O -3.340 -3.568 -11.280 1.00 . A A . 25 ASP OD1 1 1 1 353 1 1 25 ASP OD2 O -3.431 -5.669 -11.876 1.00 . A A . 25 ASP OD2 1 1 1 354 1 1 26 THR C C -7.847 -4.164 -5.891 1.00 . A A . 26 THR C 1 1 1 355 1 1 26 THR CA C -7.028 -5.205 -6.646 1.00 . A A . 26 THR CA 1 1 1 356 1 1 26 THR CB C -6.785 -6.417 -5.728 1.00 . A A . 26 THR CB 1 1 1 357 1 1 26 THR CG2 C -6.560 -7.683 -6.539 1.00 . A A . 26 THR CG2 1 1 1 358 1 1 26 THR H H -5.179 -4.220 -6.431 1.00 . A A . 26 THR H 1 1 1 359 1 1 26 THR HA H -7.581 -5.535 -7.513 1.00 . A A . 26 THR HA 1 1 1 360 1 1 26 THR HB H -7.651 -6.555 -5.097 1.00 . A A . 26 THR HB 1 1 1 361 1 1 26 THR HG1 H -5.927 -5.935 -4.011 1.00 . A A . 26 THR HG1 1 1 1 362 1 1 26 THR HG21 H -7.448 -7.909 -7.112 1.00 . A A . 26 THR HG21 1 1 1 363 1 1 26 THR HG22 H -6.341 -8.505 -5.874 1.00 . A A . 26 THR HG22 1 1 1 364 1 1 26 THR HG23 H -5.726 -7.534 -7.213 1.00 . A A . 26 THR HG23 1 1 1 365 1 1 26 THR N N -5.763 -4.651 -7.090 1.00 . A A . 26 THR N 1 1 1 366 1 1 26 THR O O -9.015 -3.921 -6.202 1.00 . A A . 26 THR O 1 1 1 367 1 1 26 THR OG1 O -5.635 -6.170 -4.902 1.00 . A A . 26 THR OG1 1 1 1 368 1 1 27 CYS C C -7.354 -1.243 -4.171 1.00 . A A . 27 CYS C 1 1 1 369 1 1 27 CYS CA C -7.927 -2.651 -3.994 1.00 . A A . 27 CYS CA 1 1 1 370 1 1 27 CYS CB C -7.776 -3.125 -2.552 1.00 . A A . 27 CYS CB 1 1 1 371 1 1 27 CYS H H -6.330 -3.863 -4.632 1.00 . A A . 27 CYS H 1 1 1 372 1 1 27 CYS HA H -8.974 -2.644 -4.260 1.00 . A A . 27 CYS HA 1 1 1 373 1 1 27 CYS HB2 H -7.303 -2.349 -1.969 1.00 . A A . 27 CYS HB2 1 1 1 374 1 1 27 CYS HB3 H -8.753 -3.335 -2.142 1.00 . A A . 27 CYS HB3 1 1 1 375 1 1 27 CYS N N -7.246 -3.596 -4.857 1.00 . A A . 27 CYS N 1 1 1 376 1 1 27 CYS O O -6.276 -1.073 -4.744 1.00 . A A . 27 CYS O 1 1 1 377 1 1 27 CYS SG S -6.769 -4.638 -2.394 1.00 . A A . 27 CYS SG 1 1 1 378 1 1 28 PRO C C -6.873 1.697 -2.687 1.00 . A A . 28 PRO C 1 1 1 379 1 1 28 PRO CA C -7.668 1.174 -3.884 1.00 . A A . 28 PRO CA 1 1 1 380 1 1 28 PRO CB C -8.997 1.921 -4.024 1.00 . A A . 28 PRO CB 1 1 1 381 1 1 28 PRO CD C -9.403 -0.293 -3.090 1.00 . A A . 28 PRO CD 1 1 1 382 1 1 28 PRO CG C -10.048 1.031 -3.425 1.00 . A A . 28 PRO CG 1 1 1 383 1 1 28 PRO HA H -7.084 1.310 -4.783 1.00 . A A . 28 PRO HA 1 1 1 384 1 1 28 PRO HB2 H -8.936 2.862 -3.496 1.00 . A A . 28 PRO HB2 1 1 1 385 1 1 28 PRO HB3 H -9.193 2.108 -5.069 1.00 . A A . 28 PRO HB3 1 1 1 386 1 1 28 PRO HD2 H -9.304 -0.403 -2.019 1.00 . A A . 28 PRO HD2 1 1 1 387 1 1 28 PRO HD3 H -9.979 -1.109 -3.500 1.00 . A A . 28 PRO HD3 1 1 1 388 1 1 28 PRO HG2 H -10.439 1.486 -2.528 1.00 . A A . 28 PRO HG2 1 1 1 389 1 1 28 PRO HG3 H -10.845 0.884 -4.141 1.00 . A A . 28 PRO HG3 1 1 1 390 1 1 28 PRO N N -8.085 -0.209 -3.727 1.00 . A A . 28 PRO N 1 1 1 391 1 1 28 PRO O O -7.218 2.724 -2.093 1.00 . A A . 28 PRO O 1 1 1 392 1 1 29 SER C C -3.478 1.635 -1.824 1.00 . A A . 29 SER C 1 1 1 393 1 1 29 SER CA C -4.896 1.458 -1.301 1.00 . A A . 29 SER CA 1 1 1 394 1 1 29 SER CB C -4.909 0.448 -0.156 1.00 . A A . 29 SER CB 1 1 1 395 1 1 29 SER H H -5.528 0.229 -2.903 1.00 . A A . 29 SER H 1 1 1 396 1 1 29 SER HA H -5.257 2.407 -0.937 1.00 . A A . 29 SER HA 1 1 1 397 1 1 29 SER HB2 H -4.119 -0.274 -0.307 1.00 . A A . 29 SER HB2 1 1 1 398 1 1 29 SER HB3 H -4.752 0.964 0.780 1.00 . A A . 29 SER HB3 1 1 1 399 1 1 29 SER HG H -5.974 -1.189 0.010 1.00 . A A . 29 SER HG 1 1 1 400 1 1 29 SER N N -5.776 1.023 -2.374 1.00 . A A . 29 SER N 1 1 1 401 1 1 29 SER O O -3.083 0.990 -2.791 1.00 . A A . 29 SER O 1 1 1 402 1 1 29 SER OG O -6.147 -0.238 -0.093 1.00 . A A . 29 SER OG 1 1 1 403 1 1 30 SER C C -0.395 2.740 -0.542 1.00 . A A . 30 SER C 1 1 1 404 1 1 30 SER CA C -1.395 2.862 -1.690 1.00 . A A . 30 SER CA 1 1 1 405 1 1 30 SER CB C -1.357 4.270 -2.285 1.00 . A A . 30 SER CB 1 1 1 406 1 1 30 SER H H -3.126 3.091 -0.505 1.00 . A A . 30 SER H 1 1 1 407 1 1 30 SER HA H -1.135 2.148 -2.458 1.00 . A A . 30 SER HA 1 1 1 408 1 1 30 SER HB2 H -1.292 4.995 -1.488 1.00 . A A . 30 SER HB2 1 1 1 409 1 1 30 SER HB3 H -0.494 4.364 -2.928 1.00 . A A . 30 SER HB3 1 1 1 410 1 1 30 SER HG H -2.815 3.715 -3.471 1.00 . A A . 30 SER HG 1 1 1 411 1 1 30 SER N N -2.742 2.564 -1.236 1.00 . A A . 30 SER N 1 1 1 412 1 1 30 SER O O -0.735 2.999 0.614 1.00 . A A . 30 SER O 1 1 1 413 1 1 30 SER OG O -2.527 4.531 -3.046 1.00 . A A . 30 SER OG 1 1 1 414 1 1 31 TYR C C 3.202 2.518 -0.319 1.00 . A A . 31 TYR C 1 1 1 415 1 1 31 TYR CA C 1.824 2.049 0.167 1.00 . A A . 31 TYR CA 1 1 1 416 1 1 31 TYR CB C 1.895 0.562 0.555 1.00 . A A . 31 TYR CB 1 1 1 417 1 1 31 TYR CD1 C 0.380 0.048 2.525 1.00 . A A . 31 TYR CD1 1 1 1 418 1 1 31 TYR CD2 C -0.332 -0.606 0.344 1.00 . A A . 31 TYR CD2 1 1 1 419 1 1 31 TYR CE1 C -0.776 -0.483 3.063 1.00 . A A . 31 TYR CE1 1 1 1 420 1 1 31 TYR CE2 C -1.487 -1.139 0.874 1.00 . A A . 31 TYR CE2 1 1 1 421 1 1 31 TYR CG C 0.621 -0.002 1.153 1.00 . A A . 31 TYR CG 1 1 1 422 1 1 31 TYR CZ C -1.707 -1.076 2.231 1.00 . A A . 31 TYR CZ 1 1 1 423 1 1 31 TYR H H 0.997 1.995 -1.779 1.00 . A A . 31 TYR H 1 1 1 424 1 1 31 TYR HA H 1.550 2.625 1.037 1.00 . A A . 31 TYR HA 1 1 1 425 1 1 31 TYR HB2 H 2.127 -0.017 -0.325 1.00 . A A . 31 TYR HB2 1 1 1 426 1 1 31 TYR HB3 H 2.687 0.430 1.280 1.00 . A A . 31 TYR HB3 1 1 1 427 1 1 31 TYR HD1 H 1.112 0.509 3.176 1.00 . A A . 31 TYR HD1 1 1 1 428 1 1 31 TYR HD2 H -0.159 -0.653 -0.721 1.00 . A A . 31 TYR HD2 1 1 1 429 1 1 31 TYR HE1 H -0.947 -0.432 4.129 1.00 . A A . 31 TYR HE1 1 1 1 430 1 1 31 TYR HE2 H -2.210 -1.608 0.225 1.00 . A A . 31 TYR HE2 1 1 1 431 1 1 31 TYR HH H -3.412 -1.962 2.037 1.00 . A A . 31 TYR HH 1 1 1 432 1 1 31 TYR N N 0.807 2.266 -0.849 1.00 . A A . 31 TYR N 1 1 1 433 1 1 31 TYR O O 3.367 2.909 -1.474 1.00 . A A . 31 TYR O 1 1 1 434 1 1 31 TYR OH O -2.861 -1.615 2.758 1.00 . A A . 31 TYR OH 1 1 1 435 1 1 32 HIS C C 6.036 1.165 -0.510 1.00 . A A . 32 HIS C 1 1 1 436 1 1 32 HIS CA C 5.608 2.464 0.169 1.00 . A A . 32 HIS CA 1 1 1 437 1 1 32 HIS CB C 6.495 2.650 1.427 1.00 . A A . 32 HIS CB 1 1 1 438 1 1 32 HIS CD2 C 7.544 4.943 1.988 1.00 . A A . 32 HIS CD2 1 1 1 439 1 1 32 HIS CE1 C 6.049 5.594 3.436 1.00 . A A . 32 HIS CE1 1 1 1 440 1 1 32 HIS CG C 6.557 4.018 2.052 1.00 . A A . 32 HIS CG 1 1 1 441 1 1 32 HIS H H 4.001 1.823 1.368 1.00 . A A . 32 HIS H 1 1 1 442 1 1 32 HIS HA H 5.717 3.299 -0.507 1.00 . A A . 32 HIS HA 1 1 1 443 1 1 32 HIS HB2 H 6.142 1.974 2.189 1.00 . A A . 32 HIS HB2 1 1 1 444 1 1 32 HIS HB3 H 7.506 2.372 1.168 1.00 . A A . 32 HIS HB3 1 1 1 445 1 1 32 HIS HD2 H 8.421 4.908 1.357 1.00 . A A . 32 HIS HD2 1 1 1 446 1 1 32 HIS HE1 H 5.526 6.183 4.175 1.00 . A A . 32 HIS HE1 1 1 1 447 1 1 32 HIS HE2 H 7.623 6.840 2.895 1.00 . A A . 32 HIS HE2 1 1 1 448 1 1 32 HIS N N 4.205 2.301 0.530 1.00 . A A . 32 HIS N 1 1 1 449 1 1 32 HIS ND1 N 5.619 4.443 2.962 1.00 . A A . 32 HIS ND1 1 1 1 450 1 1 32 HIS NE2 N 7.220 5.942 2.875 1.00 . A A . 32 HIS NE2 1 1 1 451 1 1 32 HIS O O 5.328 0.637 -1.361 1.00 . A A . 32 HIS O 1 1 1 452 1 1 33 ILE C C 7.672 -1.668 0.923 1.00 . A A . 33 ILE C 1 1 1 453 1 1 33 ILE CA C 7.441 -0.810 -0.329 1.00 . A A . 33 ILE CA 1 1 1 454 1 1 33 ILE CB C 8.718 -0.828 -1.198 1.00 . A A . 33 ILE CB 1 1 1 455 1 1 33 ILE CD1 C 11.221 -0.352 -1.155 1.00 . A A . 33 ILE CD1 1 1 1 456 1 1 33 ILE CG1 C 9.898 -0.213 -0.437 1.00 . A A . 33 ILE CG1 1 1 1 457 1 1 33 ILE CG2 C 8.477 -0.078 -2.499 1.00 . A A . 33 ILE CG2 1 1 1 458 1 1 33 ILE H H 7.536 0.972 0.783 1.00 . A A . 33 ILE H 1 1 1 459 1 1 33 ILE HA H 6.631 -1.237 -0.903 1.00 . A A . 33 ILE HA 1 1 1 460 1 1 33 ILE HB H 8.949 -1.854 -1.439 1.00 . A A . 33 ILE HB 1 1 1 461 1 1 33 ILE HD11 H 11.689 0.618 -1.238 1.00 . A A . 33 ILE HD11 1 1 1 462 1 1 33 ILE HD12 H 11.866 -1.015 -0.596 1.00 . A A . 33 ILE HD12 1 1 1 463 1 1 33 ILE HD13 H 11.055 -0.759 -2.141 1.00 . A A . 33 ILE HD13 1 1 1 464 1 1 33 ILE HG12 H 9.713 0.840 -0.287 1.00 . A A . 33 ILE HG12 1 1 1 465 1 1 33 ILE HG21 H 7.780 -0.632 -3.110 1.00 . A A . 33 ILE HG21 1 1 1 466 1 1 33 ILE HG22 H 8.066 0.897 -2.276 1.00 . A A . 33 ILE HG22 1 1 1 467 1 1 33 ILE HG23 H 9.411 0.037 -3.029 1.00 . A A . 33 ILE HG23 1 1 1 468 1 1 33 ILE N N 7.068 0.543 0.043 1.00 . A A . 33 ILE N 1 1 1 469 1 1 33 ILE O O 8.177 -2.783 0.830 1.00 . A A . 33 ILE O 1 1 1 470 1 1 34 HIS C C 6.692 -1.429 4.489 1.00 . A A . 34 HIS C 1 1 1 471 1 1 34 HIS CA C 7.651 -1.817 3.359 1.00 . A A . 34 HIS CA 1 1 1 472 1 1 34 HIS CB C 9.104 -1.526 3.785 1.00 . A A . 34 HIS CB 1 1 1 473 1 1 34 HIS CD2 C 9.588 0.882 2.995 1.00 . A A . 34 HIS CD2 1 1 1 474 1 1 34 HIS CE1 C 9.859 1.777 4.961 1.00 . A A . 34 HIS CE1 1 1 1 475 1 1 34 HIS CG C 9.422 -0.069 3.945 1.00 . A A . 34 HIS CG 1 1 1 476 1 1 34 HIS H H 6.946 -0.235 2.135 1.00 . A A . 34 HIS H 1 1 1 477 1 1 34 HIS HA H 7.555 -2.876 3.179 1.00 . A A . 34 HIS HA 1 1 1 478 1 1 34 HIS HB2 H 9.294 -2.011 4.731 1.00 . A A . 34 HIS HB2 1 1 1 479 1 1 34 HIS HB3 H 9.774 -1.932 3.041 1.00 . A A . 34 HIS HB3 1 1 1 480 1 1 34 HIS HD2 H 9.509 0.748 1.927 1.00 . A A . 34 HIS HD2 1 1 1 481 1 1 34 HIS HE1 H 10.051 2.504 5.738 1.00 . A A . 34 HIS HE1 1 1 1 482 1 1 34 HIS HE2 H 10.207 2.881 3.234 1.00 . A A . 34 HIS HE2 1 1 1 483 1 1 34 HIS N N 7.347 -1.127 2.104 1.00 . A A . 34 HIS N 1 1 1 484 1 1 34 HIS ND1 N 9.594 0.501 5.184 1.00 . A A . 34 HIS ND1 1 1 1 485 1 1 34 HIS NE2 N 9.866 2.053 3.650 1.00 . A A . 34 HIS NE2 1 1 1 486 1 1 34 HIS O O 7.025 -1.565 5.668 1.00 . A A . 34 HIS O 1 1 1 487 1 1 35 CYS C C 3.850 -1.744 5.774 1.00 . A A . 35 CYS C 1 1 1 488 1 1 35 CYS CA C 4.523 -0.534 5.128 1.00 . A A . 35 CYS CA 1 1 1 489 1 1 35 CYS CB C 3.482 0.335 4.445 1.00 . A A . 35 CYS CB 1 1 1 490 1 1 35 CYS H H 5.297 -0.832 3.184 1.00 . A A . 35 CYS H 1 1 1 491 1 1 35 CYS HA H 5.030 0.042 5.885 1.00 . A A . 35 CYS HA 1 1 1 492 1 1 35 CYS HB2 H 2.668 -0.284 4.096 1.00 . A A . 35 CYS HB2 1 1 1 493 1 1 35 CYS HB3 H 3.108 1.064 5.149 1.00 . A A . 35 CYS HB3 1 1 1 494 1 1 35 CYS N N 5.507 -0.950 4.134 1.00 . A A . 35 CYS N 1 1 1 495 1 1 35 CYS O O 3.265 -1.655 6.855 1.00 . A A . 35 CYS O 1 1 1 496 1 1 35 CYS SG S 4.160 1.228 3.017 1.00 . A A . 35 CYS SG 1 1 1 497 1 1 36 LEU C C 4.366 -5.002 6.172 1.00 . A A . 36 LEU C 1 1 1 498 1 1 36 LEU CA C 3.312 -4.099 5.546 1.00 . A A . 36 LEU CA 1 1 1 499 1 1 36 LEU CB C 2.632 -4.817 4.378 1.00 . A A . 36 LEU CB 1 1 1 500 1 1 36 LEU CD1 C 3.188 -5.462 2.018 1.00 . A A . 36 LEU CD1 1 1 1 501 1 1 36 LEU CD2 C 1.960 -3.332 2.473 1.00 . A A . 36 LEU CD2 1 1 1 502 1 1 36 LEU CG C 3.013 -4.302 2.987 1.00 . A A . 36 LEU CG 1 1 1 503 1 1 36 LEU H H 4.401 -2.864 4.229 1.00 . A A . 36 LEU H 1 1 1 504 1 1 36 LEU HA H 2.572 -3.847 6.289 1.00 . A A . 36 LEU HA 1 1 1 505 1 1 36 LEU HB2 H 2.887 -5.865 4.433 1.00 . A A . 36 LEU HB2 1 1 1 506 1 1 36 LEU HB3 H 1.562 -4.718 4.495 1.00 . A A . 36 LEU HB3 1 1 1 507 1 1 36 LEU HD11 H 2.419 -5.414 1.260 1.00 . A A . 36 LEU HD11 1 1 1 508 1 1 36 LEU HD12 H 4.159 -5.398 1.550 1.00 . A A . 36 LEU HD12 1 1 1 509 1 1 36 LEU HD13 H 3.106 -6.395 2.555 1.00 . A A . 36 LEU HD13 1 1 1 510 1 1 36 LEU HD21 H 2.158 -3.103 1.437 1.00 . A A . 36 LEU HD21 1 1 1 511 1 1 36 LEU HD22 H 0.983 -3.783 2.559 1.00 . A A . 36 LEU HD22 1 1 1 512 1 1 36 LEU HD23 H 1.991 -2.424 3.055 1.00 . A A . 36 LEU HD23 1 1 1 513 1 1 36 LEU HG H 3.954 -3.775 3.051 1.00 . A A . 36 LEU HG 1 1 1 514 1 1 36 LEU N N 3.921 -2.866 5.081 1.00 . A A . 36 LEU N 1 1 1 515 1 1 36 LEU O O 5.562 -4.722 6.073 1.00 . A A . 36 LEU O 1 1 1 516 1 1 37 ARG C C 5.791 -7.666 6.330 1.00 . A A . 37 ARG C 1 1 1 517 1 1 37 ARG CA C 4.852 -7.058 7.381 1.00 . A A . 37 ARG CA 1 1 1 518 1 1 37 ARG CB C 4.098 -8.156 8.131 1.00 . A A . 37 ARG CB 1 1 1 519 1 1 37 ARG CD C 3.937 -8.534 10.608 1.00 . A A . 37 ARG CD 1 1 1 520 1 1 37 ARG CG C 4.821 -8.635 9.376 1.00 . A A . 37 ARG CG 1 1 1 521 1 1 37 ARG CZ C 3.808 -10.765 11.649 1.00 . A A . 37 ARG CZ 1 1 1 522 1 1 37 ARG H H 2.966 -6.281 6.812 1.00 . A A . 37 ARG H 1 1 1 523 1 1 37 ARG HA H 5.456 -6.513 8.092 1.00 . A A . 37 ARG HA 1 1 1 524 1 1 37 ARG HB2 H 3.131 -7.776 8.427 1.00 . A A . 37 ARG HB2 1 1 1 525 1 1 37 ARG HB3 H 3.959 -9.000 7.473 1.00 . A A . 37 ARG HB3 1 1 1 526 1 1 37 ARG HD2 H 4.043 -7.547 11.032 1.00 . A A . 37 ARG HD2 1 1 1 527 1 1 37 ARG HD3 H 2.910 -8.691 10.311 1.00 . A A . 37 ARG HD3 1 1 1 528 1 1 37 ARG HE H 4.960 -9.257 12.297 1.00 . A A . 37 ARG HE 1 1 1 529 1 1 37 ARG HG2 H 5.113 -9.666 9.239 1.00 . A A . 37 ARG HG2 1 1 1 530 1 1 37 ARG HG3 H 5.702 -8.028 9.526 1.00 . A A . 37 ARG HG3 1 1 1 531 1 1 37 ARG HH11 H 2.522 -10.486 10.102 1.00 . A A . 37 ARG HH11 1 1 1 532 1 1 37 ARG HH12 H 2.518 -12.081 10.795 1.00 . A A . 37 ARG HH12 1 1 1 533 1 1 37 ARG HH21 H 4.929 -11.343 13.240 1.00 . A A . 37 ARG HH21 1 1 1 534 1 1 37 ARG HH22 H 3.873 -12.563 12.587 1.00 . A A . 37 ARG HH22 1 1 1 535 1 1 37 ARG N N 3.929 -6.101 6.781 1.00 . A A . 37 ARG N 1 1 1 536 1 1 37 ARG NE N 4.297 -9.526 11.614 1.00 . A A . 37 ARG NE 1 1 1 537 1 1 37 ARG NH1 N 2.874 -11.138 10.781 1.00 . A A . 37 ARG NH1 1 1 1 538 1 1 37 ARG NH2 N 4.237 -11.623 12.564 1.00 . A A . 37 ARG NH2 1 1 1 539 1 1 37 ARG O O 7.009 -7.609 6.503 1.00 . A A . 37 ARG O 1 1 1 540 1 1 38 PRO C C 6.770 -7.555 3.353 1.00 . A A . 38 PRO C 1 1 1 541 1 1 38 PRO CA C 6.106 -8.708 4.105 1.00 . A A . 38 PRO CA 1 1 1 542 1 1 38 PRO CB C 5.125 -9.463 3.190 1.00 . A A . 38 PRO CB 1 1 1 543 1 1 38 PRO CD C 3.838 -8.336 4.862 1.00 . A A . 38 PRO CD 1 1 1 544 1 1 38 PRO CG C 3.829 -9.513 3.934 1.00 . A A . 38 PRO CG 1 1 1 545 1 1 38 PRO HA H 6.866 -9.385 4.470 1.00 . A A . 38 PRO HA 1 1 1 546 1 1 38 PRO HB2 H 5.023 -8.929 2.256 1.00 . A A . 38 PRO HB2 1 1 1 547 1 1 38 PRO HB3 H 5.504 -10.456 2.997 1.00 . A A . 38 PRO HB3 1 1 1 548 1 1 38 PRO HD2 H 3.473 -7.450 4.359 1.00 . A A . 38 PRO HD2 1 1 1 549 1 1 38 PRO HD3 H 3.252 -8.543 5.744 1.00 . A A . 38 PRO HD3 1 1 1 550 1 1 38 PRO HG2 H 3.003 -9.437 3.241 1.00 . A A . 38 PRO HG2 1 1 1 551 1 1 38 PRO HG3 H 3.765 -10.434 4.497 1.00 . A A . 38 PRO HG3 1 1 1 552 1 1 38 PRO N N 5.264 -8.203 5.196 1.00 . A A . 38 PRO N 1 1 1 553 1 1 38 PRO O O 6.345 -7.175 2.260 1.00 . A A . 38 PRO O 1 1 1 554 1 1 39 ALA C C 9.403 -5.948 2.540 1.00 . A A . 39 ALA C 1 1 1 555 1 1 39 ALA CA C 8.299 -5.672 3.547 1.00 . A A . 39 ALA CA 1 1 1 556 1 1 39 ALA CB C 8.847 -4.869 4.717 1.00 . A A . 39 ALA CB 1 1 1 557 1 1 39 ALA H H 7.888 -7.185 4.957 1.00 . A A . 39 ALA H 1 1 1 558 1 1 39 ALA HA H 7.528 -5.082 3.072 1.00 . A A . 39 ALA HA 1 1 1 559 1 1 39 ALA HB1 H 8.030 -4.405 5.249 1.00 . A A . 39 ALA HB1 1 1 1 560 1 1 39 ALA HB2 H 9.384 -5.526 5.385 1.00 . A A . 39 ALA HB2 1 1 1 561 1 1 39 ALA HB3 H 9.515 -4.106 4.347 1.00 . A A . 39 ALA HB3 1 1 1 562 1 1 39 ALA N N 7.692 -6.896 4.037 1.00 . A A . 39 ALA N 1 1 1 563 1 1 39 ALA O O 10.127 -6.940 2.648 1.00 . A A . 39 ALA O 1 1 1 564 1 1 40 LEU C C 11.561 -3.912 0.788 1.00 . A A . 40 LEU C 1 1 1 565 1 1 40 LEU CA C 10.633 -5.104 0.624 1.00 . A A . 40 LEU CA 1 1 1 566 1 1 40 LEU CB C 10.060 -5.103 -0.800 1.00 . A A . 40 LEU CB 1 1 1 567 1 1 40 LEU CD1 C 7.710 -5.957 -1.007 1.00 . A A . 40 LEU CD1 1 1 1 568 1 1 40 LEU CD2 C 9.472 -6.752 -2.590 1.00 . A A . 40 LEU CD2 1 1 1 569 1 1 40 LEU CG C 9.183 -6.301 -1.166 1.00 . A A . 40 LEU CG 1 1 1 570 1 1 40 LEU H H 8.982 -4.235 1.605 1.00 . A A . 40 LEU H 1 1 1 571 1 1 40 LEU HA H 11.185 -6.017 0.790 1.00 . A A . 40 LEU HA 1 1 1 572 1 1 40 LEU HB2 H 9.474 -4.205 -0.927 1.00 . A A . 40 LEU HB2 1 1 1 573 1 1 40 LEU HB3 H 10.887 -5.069 -1.495 1.00 . A A . 40 LEU HB3 1 1 1 574 1 1 40 LEU HD11 H 7.310 -6.475 -0.148 1.00 . A A . 40 LEU HD11 1 1 1 575 1 1 40 LEU HD12 H 7.602 -4.891 -0.866 1.00 . A A . 40 LEU HD12 1 1 1 576 1 1 40 LEU HD13 H 7.172 -6.259 -1.892 1.00 . A A . 40 LEU HD13 1 1 1 577 1 1 40 LEU HD21 H 8.621 -6.528 -3.217 1.00 . A A . 40 LEU HD21 1 1 1 578 1 1 40 LEU HD22 H 10.341 -6.230 -2.964 1.00 . A A . 40 LEU HD22 1 1 1 579 1 1 40 LEU HD23 H 9.657 -7.816 -2.600 1.00 . A A . 40 LEU HD23 1 1 1 580 1 1 40 LEU HG H 9.410 -7.124 -0.503 1.00 . A A . 40 LEU HG 1 1 1 581 1 1 40 LEU N N 9.567 -5.028 1.606 1.00 . A A . 40 LEU N 1 1 1 582 1 1 40 LEU O O 11.120 -2.825 1.160 1.00 . A A . 40 LEU O 1 1 1 583 1 1 41 TYR C C 14.065 -2.603 -1.010 1.00 . A A . 41 TYR C 1 1 1 584 1 1 41 TYR CA C 13.760 -2.982 0.427 1.00 . A A . 41 TYR CA 1 1 1 585 1 1 41 TYR CB C 15.046 -3.344 1.177 1.00 . A A . 41 TYR CB 1 1 1 586 1 1 41 TYR CD1 C 13.807 -2.828 3.324 1.00 . A A . 41 TYR CD1 1 1 1 587 1 1 41 TYR CD2 C 16.190 -2.804 3.364 1.00 . A A . 41 TYR CD2 1 1 1 588 1 1 41 TYR CE1 C 13.777 -2.498 4.667 1.00 . A A . 41 TYR CE1 1 1 1 589 1 1 41 TYR CE2 C 16.167 -2.475 4.706 1.00 . A A . 41 TYR CE2 1 1 1 590 1 1 41 TYR CG C 15.013 -2.984 2.650 1.00 . A A . 41 TYR CG 1 1 1 591 1 1 41 TYR CZ C 14.959 -2.326 5.352 1.00 . A A . 41 TYR CZ 1 1 1 592 1 1 41 TYR H H 13.103 -4.969 0.090 1.00 . A A . 41 TYR H 1 1 1 593 1 1 41 TYR HA H 13.287 -2.142 0.916 1.00 . A A . 41 TYR HA 1 1 1 594 1 1 41 TYR HB2 H 15.209 -4.407 1.101 1.00 . A A . 41 TYR HB2 1 1 1 595 1 1 41 TYR HB3 H 15.877 -2.823 0.726 1.00 . A A . 41 TYR HB3 1 1 1 596 1 1 41 TYR HD1 H 12.883 -2.963 2.783 1.00 . A A . 41 TYR HD1 1 1 1 597 1 1 41 TYR HD2 H 17.136 -2.922 2.855 1.00 . A A . 41 TYR HD2 1 1 1 598 1 1 41 TYR HE1 H 12.830 -2.381 5.174 1.00 . A A . 41 TYR HE1 1 1 1 599 1 1 41 TYR HE2 H 17.094 -2.339 5.242 1.00 . A A . 41 TYR HE2 1 1 1 600 1 1 41 TYR HH H 15.765 -1.560 6.929 1.00 . A A . 41 TYR HH 1 1 1 601 1 1 41 TYR N N 12.819 -4.091 0.436 1.00 . A A . 41 TYR N 1 1 1 602 1 1 41 TYR O O 14.682 -1.574 -1.291 1.00 . A A . 41 TYR O 1 1 1 603 1 1 41 TYR OH O 14.935 -2.005 6.691 1.00 . A A . 41 TYR OH 1 1 1 604 1 1 42 GLU C C 12.371 -2.723 -3.908 1.00 . A A . 42 GLU C 1 1 1 605 1 1 42 GLU CA C 13.699 -3.199 -3.335 1.00 . A A . 42 GLU CA 1 1 1 606 1 1 42 GLU CB C 14.135 -4.496 -4.024 1.00 . A A . 42 GLU CB 1 1 1 607 1 1 42 GLU CD C 13.685 -6.539 -2.587 1.00 . A A . 42 GLU CD 1 1 1 608 1 1 42 GLU CG C 13.214 -5.679 -3.746 1.00 . A A . 42 GLU CG 1 1 1 609 1 1 42 GLU H H 13.043 -4.199 -1.609 1.00 . A A . 42 GLU H 1 1 1 610 1 1 42 GLU HA H 14.449 -2.439 -3.490 1.00 . A A . 42 GLU HA 1 1 1 611 1 1 42 GLU HB2 H 14.163 -4.329 -5.091 1.00 . A A . 42 GLU HB2 1 1 1 612 1 1 42 GLU HB3 H 15.126 -4.753 -3.683 1.00 . A A . 42 GLU HB3 1 1 1 613 1 1 42 GLU HG2 H 12.229 -5.302 -3.513 1.00 . A A . 42 GLU HG2 1 1 1 614 1 1 42 GLU HG3 H 13.163 -6.294 -4.632 1.00 . A A . 42 GLU HG3 1 1 1 615 1 1 42 GLU N N 13.564 -3.424 -1.913 1.00 . A A . 42 GLU N 1 1 1 616 1 1 42 GLU O O 11.305 -3.077 -3.401 1.00 . A A . 42 GLU O 1 1 1 617 1 1 42 GLU OE1 O 13.462 -6.155 -1.418 1.00 . A A . 42 GLU OE1 1 1 1 618 1 1 42 GLU OE2 O 14.287 -7.603 -2.840 1.00 . A A . 42 GLU OE2 1 1 1 619 1 1 43 VAL C C 10.741 -2.517 -6.640 1.00 . A A . 43 VAL C 1 1 1 620 1 1 43 VAL CA C 11.220 -1.481 -5.632 1.00 . A A . 43 VAL CA 1 1 1 621 1 1 43 VAL CB C 11.417 -0.130 -6.354 1.00 . A A . 43 VAL CB 1 1 1 622 1 1 43 VAL CG1 C 10.556 0.945 -5.715 1.00 . A A . 43 VAL CG1 1 1 1 623 1 1 43 VAL CG2 C 12.878 0.292 -6.355 1.00 . A A . 43 VAL CG2 1 1 1 624 1 1 43 VAL H H 13.304 -1.717 -5.356 1.00 . A A . 43 VAL H 1 1 1 625 1 1 43 VAL HA H 10.458 -1.352 -4.874 1.00 . A A . 43 VAL HA 1 1 1 626 1 1 43 VAL HB H 11.100 -0.246 -7.379 1.00 . A A . 43 VAL HB 1 1 1 627 1 1 43 VAL HG11 H 9.771 0.480 -5.135 1.00 . A A . 43 VAL HG11 1 1 1 628 1 1 43 VAL HG12 H 11.167 1.558 -5.068 1.00 . A A . 43 VAL HG12 1 1 1 629 1 1 43 VAL HG13 H 10.117 1.562 -6.486 1.00 . A A . 43 VAL HG13 1 1 1 630 1 1 43 VAL HG21 H 13.495 -0.549 -6.634 1.00 . A A . 43 VAL HG21 1 1 1 631 1 1 43 VAL HG22 H 13.018 1.093 -7.064 1.00 . A A . 43 VAL HG22 1 1 1 632 1 1 43 VAL HG23 H 13.155 0.632 -5.368 1.00 . A A . 43 VAL HG23 1 1 1 633 1 1 43 VAL N N 12.430 -1.946 -4.974 1.00 . A A . 43 VAL N 1 1 1 634 1 1 43 VAL O O 11.455 -2.845 -7.589 1.00 . A A . 43 VAL O 1 1 1 635 1 1 44 PRO C C 8.578 -3.501 -8.661 1.00 . A A . 44 PRO C 1 1 1 636 1 1 44 PRO CA C 8.976 -4.091 -7.313 1.00 . A A . 44 PRO CA 1 1 1 637 1 1 44 PRO CB C 7.748 -4.592 -6.547 1.00 . A A . 44 PRO CB 1 1 1 638 1 1 44 PRO CD C 8.639 -2.748 -5.306 1.00 . A A . 44 PRO CD 1 1 1 639 1 1 44 PRO CG C 7.364 -3.463 -5.657 1.00 . A A . 44 PRO CG 1 1 1 640 1 1 44 PRO HA H 9.667 -4.906 -7.469 1.00 . A A . 44 PRO HA 1 1 1 641 1 1 44 PRO HB2 H 6.958 -4.829 -7.245 1.00 . A A . 44 PRO HB2 1 1 1 642 1 1 44 PRO HB3 H 8.009 -5.470 -5.979 1.00 . A A . 44 PRO HB3 1 1 1 643 1 1 44 PRO HD2 H 8.468 -1.683 -5.246 1.00 . A A . 44 PRO HD2 1 1 1 644 1 1 44 PRO HD3 H 9.035 -3.121 -4.375 1.00 . A A . 44 PRO HD3 1 1 1 645 1 1 44 PRO HG2 H 6.692 -2.798 -6.179 1.00 . A A . 44 PRO HG2 1 1 1 646 1 1 44 PRO HG3 H 6.893 -3.847 -4.764 1.00 . A A . 44 PRO HG3 1 1 1 647 1 1 44 PRO N N 9.539 -3.071 -6.430 1.00 . A A . 44 PRO N 1 1 1 648 1 1 44 PRO O O 7.560 -2.815 -8.777 1.00 . A A . 44 PRO O 1 1 1 649 1 1 45 ASP C C 8.175 -3.775 -11.751 1.00 . A A . 45 ASP C 1 1 1 650 1 1 45 ASP CA C 9.262 -3.055 -10.952 1.00 . A A . 45 ASP CA 1 1 1 651 1 1 45 ASP CB C 10.588 -3.045 -11.727 1.00 . A A . 45 ASP CB 1 1 1 652 1 1 45 ASP CG C 10.803 -4.288 -12.569 1.00 . A A . 45 ASP CG 1 1 1 653 1 1 45 ASP H H 10.294 -4.135 -9.455 1.00 . A A . 45 ASP H 1 1 1 654 1 1 45 ASP HA H 8.949 -2.034 -10.794 1.00 . A A . 45 ASP HA 1 1 1 655 1 1 45 ASP HB2 H 10.604 -2.189 -12.385 1.00 . A A . 45 ASP HB2 1 1 1 656 1 1 45 ASP HB3 H 11.404 -2.967 -11.025 1.00 . A A . 45 ASP HB3 1 1 1 657 1 1 45 ASP N N 9.454 -3.663 -9.641 1.00 . A A . 45 ASP N 1 1 1 658 1 1 45 ASP O O 7.615 -3.216 -12.695 1.00 . A A . 45 ASP O 1 1 1 659 1 1 45 ASP OD1 O 11.013 -5.381 -11.991 1.00 . A A . 45 ASP OD1 1 1 1 660 1 1 45 ASP OD2 O 10.787 -4.174 -13.813 1.00 . A A . 45 ASP OD2 1 1 1 661 1 1 46 GLY C C 5.508 -5.704 -11.347 1.00 . A A . 46 GLY C 1 1 1 662 1 1 46 GLY CA C 6.849 -5.763 -12.046 1.00 . A A . 46 GLY CA 1 1 1 663 1 1 46 GLY H H 8.341 -5.396 -10.596 1.00 . A A . 46 GLY H 1 1 1 664 1 1 46 GLY HA2 H 6.738 -5.374 -13.047 1.00 . A A . 46 GLY HA2 1 1 1 665 1 1 46 GLY HA3 H 7.165 -6.795 -12.105 1.00 . A A . 46 GLY HA3 1 1 1 666 1 1 46 GLY N N 7.868 -5.002 -11.359 1.00 . A A . 46 GLY N 1 1 1 667 1 1 46 GLY O O 4.731 -4.769 -11.552 1.00 . A A . 46 GLY O 1 1 1 668 1 1 47 GLU C C 4.189 -6.614 -8.315 1.00 . A A . 47 GLU C 1 1 1 669 1 1 47 GLU CA C 3.968 -6.786 -9.809 1.00 . A A . 47 GLU CA 1 1 1 670 1 1 47 GLU CB C 3.278 -8.124 -10.073 1.00 . A A . 47 GLU CB 1 1 1 671 1 1 47 GLU CD C 3.042 -8.378 -12.568 1.00 . A A . 47 GLU CD 1 1 1 672 1 1 47 GLU CG C 2.333 -8.099 -11.262 1.00 . A A . 47 GLU CG 1 1 1 673 1 1 47 GLU H H 5.897 -7.423 -10.405 1.00 . A A . 47 GLU H 1 1 1 674 1 1 47 GLU HA H 3.336 -5.985 -10.163 1.00 . A A . 47 GLU HA 1 1 1 675 1 1 47 GLU HB2 H 4.030 -8.876 -10.256 1.00 . A A . 47 GLU HB2 1 1 1 676 1 1 47 GLU HB3 H 2.709 -8.401 -9.196 1.00 . A A . 47 GLU HB3 1 1 1 677 1 1 47 GLU HG2 H 1.571 -8.849 -11.117 1.00 . A A . 47 GLU HG2 1 1 1 678 1 1 47 GLU HG3 H 1.871 -7.123 -11.321 1.00 . A A . 47 GLU HG3 1 1 1 679 1 1 47 GLU N N 5.229 -6.709 -10.530 1.00 . A A . 47 GLU N 1 1 1 680 1 1 47 GLU O O 5.315 -6.734 -7.824 1.00 . A A . 47 GLU O 1 1 1 681 1 1 47 GLU OE1 O 3.837 -9.338 -12.625 1.00 . A A . 47 GLU OE1 1 1 1 682 1 1 47 GLU OE2 O 2.810 -7.636 -13.545 1.00 . A A . 47 GLU OE2 1 1 1 683 1 1 48 TRP C C 1.722 -6.149 -5.603 1.00 . A A . 48 TRP C 1 1 1 684 1 1 48 TRP CA C 3.142 -6.196 -6.153 1.00 . A A . 48 TRP CA 1 1 1 685 1 1 48 TRP CB C 3.892 -4.910 -5.780 1.00 . A A . 48 TRP CB 1 1 1 686 1 1 48 TRP CD1 C 4.871 -5.098 -3.421 1.00 . A A . 48 TRP CD1 1 1 1 687 1 1 48 TRP CD2 C 2.999 -3.880 -3.545 1.00 . A A . 48 TRP CD2 1 1 1 688 1 1 48 TRP CE2 C 3.430 -3.907 -2.206 1.00 . A A . 48 TRP CE2 1 1 1 689 1 1 48 TRP CE3 C 1.836 -3.168 -3.867 1.00 . A A . 48 TRP CE3 1 1 1 690 1 1 48 TRP CG C 3.935 -4.650 -4.307 1.00 . A A . 48 TRP CG 1 1 1 691 1 1 48 TRP CH2 C 1.607 -2.568 -1.533 1.00 . A A . 48 TRP CH2 1 1 1 692 1 1 48 TRP CZ2 C 2.739 -3.254 -1.191 1.00 . A A . 48 TRP CZ2 1 1 1 693 1 1 48 TRP CZ3 C 1.152 -2.523 -2.856 1.00 . A A . 48 TRP CZ3 1 1 1 694 1 1 48 TRP H H 2.235 -6.316 -8.057 1.00 . A A . 48 TRP H 1 1 1 695 1 1 48 TRP HA H 3.656 -7.047 -5.728 1.00 . A A . 48 TRP HA 1 1 1 696 1 1 48 TRP HB2 H 4.907 -4.978 -6.136 1.00 . A A . 48 TRP HB2 1 1 1 697 1 1 48 TRP HB3 H 3.405 -4.070 -6.254 1.00 . A A . 48 TRP HB3 1 1 1 698 1 1 48 TRP HD1 H 5.716 -5.714 -3.690 1.00 . A A . 48 TRP HD1 1 1 1 699 1 1 48 TRP HE1 H 5.091 -4.853 -1.348 1.00 . A A . 48 TRP HE1 1 1 1 700 1 1 48 TRP HE3 H 1.474 -3.120 -4.883 1.00 . A A . 48 TRP HE3 1 1 1 701 1 1 48 TRP HH2 H 1.041 -2.047 -0.774 1.00 . A A . 48 TRP HH2 1 1 1 702 1 1 48 TRP HZ2 H 3.075 -3.277 -0.169 1.00 . A A . 48 TRP HZ2 1 1 1 703 1 1 48 TRP HZ3 H 0.249 -1.973 -3.084 1.00 . A A . 48 TRP HZ3 1 1 1 704 1 1 48 TRP N N 3.102 -6.365 -7.599 1.00 . A A . 48 TRP N 1 1 1 705 1 1 48 TRP NE1 N 4.573 -4.659 -2.155 1.00 . A A . 48 TRP NE1 1 1 1 706 1 1 48 TRP O O 0.851 -5.492 -6.178 1.00 . A A . 48 TRP O 1 1 1 707 1 1 49 GLN C C 0.317 -6.678 -2.329 1.00 . A A . 49 GLN C 1 1 1 708 1 1 49 GLN CA C 0.193 -6.784 -3.842 1.00 . A A . 49 GLN CA 1 1 1 709 1 1 49 GLN CB C -0.618 -8.021 -4.218 1.00 . A A . 49 GLN CB 1 1 1 710 1 1 49 GLN CD C -3.039 -8.734 -4.207 1.00 . A A . 49 GLN CD 1 1 1 711 1 1 49 GLN CG C -2.035 -7.695 -4.659 1.00 . A A . 49 GLN CG 1 1 1 712 1 1 49 GLN H H 2.234 -7.295 -4.048 1.00 . A A . 49 GLN H 1 1 1 713 1 1 49 GLN HA H -0.327 -5.910 -4.203 1.00 . A A . 49 GLN HA 1 1 1 714 1 1 49 GLN HB2 H -0.120 -8.536 -5.025 1.00 . A A . 49 GLN HB2 1 1 1 715 1 1 49 GLN HB3 H -0.672 -8.679 -3.361 1.00 . A A . 49 GLN HB3 1 1 1 716 1 1 49 GLN HE21 H -3.450 -7.669 -2.576 1.00 . A A . 49 GLN HE21 1 1 1 717 1 1 49 GLN HE22 H -4.317 -9.162 -2.750 1.00 . A A . 49 GLN HE22 1 1 1 718 1 1 49 GLN HG2 H -2.318 -6.740 -4.242 1.00 . A A . 49 GLN HG2 1 1 1 719 1 1 49 GLN HG3 H -2.059 -7.638 -5.736 1.00 . A A . 49 GLN HG3 1 1 1 720 1 1 49 GLN N N 1.497 -6.809 -4.479 1.00 . A A . 49 GLN N 1 1 1 721 1 1 49 GLN NE2 N -3.664 -8.499 -3.066 1.00 . A A . 49 GLN NE2 1 1 1 722 1 1 49 GLN O O 1.386 -6.909 -1.754 1.00 . A A . 49 GLN O 1 1 1 723 1 1 49 GLN OE1 O -3.251 -9.740 -4.883 1.00 . A A . 49 GLN OE1 1 1 1 724 1 1 50 CYS C C -0.821 -7.445 0.462 1.00 . A A . 50 CYS C 1 1 1 725 1 1 50 CYS CA C -0.874 -6.107 -0.278 1.00 . A A . 50 CYS CA 1 1 1 726 1 1 50 CYS CB C -2.212 -5.429 -0.015 1.00 . A A . 50 CYS CB 1 1 1 727 1 1 50 CYS H H -1.589 -6.118 -2.246 1.00 . A A . 50 CYS H 1 1 1 728 1 1 50 CYS HA H -0.066 -5.468 0.046 1.00 . A A . 50 CYS HA 1 1 1 729 1 1 50 CYS HB2 H -2.611 -5.771 0.929 1.00 . A A . 50 CYS HB2 1 1 1 730 1 1 50 CYS HB3 H -2.074 -4.358 0.013 1.00 . A A . 50 CYS HB3 1 1 1 731 1 1 50 CYS N N -0.785 -6.298 -1.710 1.00 . A A . 50 CYS N 1 1 1 732 1 1 50 CYS O O -1.137 -8.490 -0.114 1.00 . A A . 50 CYS O 1 1 1 733 1 1 50 CYS SG S -3.430 -5.805 -1.320 1.00 . A A . 50 CYS SG 1 1 1 734 1 1 51 PRO C C -2.118 -9.065 2.702 1.00 . A A . 51 PRO C 1 1 1 735 1 1 51 PRO CA C -0.665 -8.621 2.608 1.00 . A A . 51 PRO CA 1 1 1 736 1 1 51 PRO CB C -0.137 -8.172 3.970 1.00 . A A . 51 PRO CB 1 1 1 737 1 1 51 PRO CD C -0.273 -6.219 2.581 1.00 . A A . 51 PRO CD 1 1 1 738 1 1 51 PRO CG C -0.361 -6.700 4.007 1.00 . A A . 51 PRO CG 1 1 1 739 1 1 51 PRO HA H -0.066 -9.423 2.225 1.00 . A A . 51 PRO HA 1 1 1 740 1 1 51 PRO HB2 H -0.685 -8.675 4.754 1.00 . A A . 51 PRO HB2 1 1 1 741 1 1 51 PRO HB3 H 0.913 -8.412 4.050 1.00 . A A . 51 PRO HB3 1 1 1 742 1 1 51 PRO HD2 H -1.012 -5.452 2.398 1.00 . A A . 51 PRO HD2 1 1 1 743 1 1 51 PRO HD3 H 0.718 -5.845 2.372 1.00 . A A . 51 PRO HD3 1 1 1 744 1 1 51 PRO HG2 H -1.339 -6.488 4.413 1.00 . A A . 51 PRO HG2 1 1 1 745 1 1 51 PRO HG3 H 0.403 -6.228 4.607 1.00 . A A . 51 PRO HG3 1 1 1 746 1 1 51 PRO N N -0.559 -7.422 1.781 1.00 . A A . 51 PRO N 1 1 1 747 1 1 51 PRO O O -2.462 -10.206 2.397 1.00 . A A . 51 PRO O 1 1 1 748 1 1 52 ARG C C -5.055 -6.889 2.972 1.00 . A A . 52 ARG C 1 1 1 749 1 1 52 ARG CA C -4.406 -8.263 2.948 1.00 . A A . 52 ARG CA 1 1 1 750 1 1 52 ARG CB C -4.867 -9.083 4.158 1.00 . A A . 52 ARG CB 1 1 1 751 1 1 52 ARG CD C -4.891 -11.585 3.976 1.00 . A A . 52 ARG CD 1 1 1 752 1 1 52 ARG CG C -5.689 -10.306 3.795 1.00 . A A . 52 ARG CG 1 1 1 753 1 1 52 ARG CZ C -4.930 -13.395 2.303 1.00 . A A . 52 ARG CZ 1 1 1 754 1 1 52 ARG H H -2.610 -7.193 3.090 1.00 . A A . 52 ARG H 1 1 1 755 1 1 52 ARG HA H -4.682 -8.774 2.037 1.00 . A A . 52 ARG HA 1 1 1 756 1 1 52 ARG HB2 H -3.998 -9.414 4.706 1.00 . A A . 52 ARG HB2 1 1 1 757 1 1 52 ARG HB3 H -5.466 -8.453 4.799 1.00 . A A . 52 ARG HB3 1 1 1 758 1 1 52 ARG HD2 H -3.989 -11.358 4.525 1.00 . A A . 52 ARG HD2 1 1 1 759 1 1 52 ARG HD3 H -5.486 -12.288 4.540 1.00 . A A . 52 ARG HD3 1 1 1 760 1 1 52 ARG HE H -3.949 -11.658 2.100 1.00 . A A . 52 ARG HE 1 1 1 761 1 1 52 ARG HG2 H -6.561 -10.344 4.431 1.00 . A A . 52 ARG HG2 1 1 1 762 1 1 52 ARG HG3 H -5.999 -10.228 2.762 1.00 . A A . 52 ARG HG3 1 1 1 763 1 1 52 ARG HH11 H -6.024 -13.764 3.979 1.00 . A A . 52 ARG HH11 1 1 1 764 1 1 52 ARG HH12 H -6.015 -15.040 2.798 1.00 . A A . 52 ARG HH12 1 1 1 765 1 1 52 ARG HH21 H -3.968 -13.310 0.517 1.00 . A A . 52 ARG HH21 1 1 1 766 1 1 52 ARG HH22 H -4.856 -14.774 0.816 1.00 . A A . 52 ARG HH22 1 1 1 767 1 1 52 ARG N N -2.967 -8.091 2.961 1.00 . A A . 52 ARG N 1 1 1 768 1 1 52 ARG NE N -4.528 -12.188 2.698 1.00 . A A . 52 ARG NE 1 1 1 769 1 1 52 ARG NH1 N -5.721 -14.125 3.085 1.00 . A A . 52 ARG NH1 1 1 1 770 1 1 52 ARG NH2 N -4.555 -13.865 1.120 1.00 . A A . 52 ARG NH2 1 1 1 771 1 1 52 ARG O O -6.207 -6.742 3.378 1.00 . A A . 52 ARG O 1 1 1 772 1 1 53 CYS C C -5.227 -4.147 4.030 1.00 . A A . 53 CYS C 1 1 1 773 1 1 53 CYS CA C -4.653 -4.480 2.655 1.00 . A A . 53 CYS CA 1 1 1 774 1 1 53 CYS CB C -5.643 -4.146 1.545 1.00 . A A . 53 CYS CB 1 1 1 775 1 1 53 CYS H H -3.369 -6.092 2.257 1.00 . A A . 53 CYS H 1 1 1 776 1 1 53 CYS HA H -3.760 -3.890 2.508 1.00 . A A . 53 CYS HA 1 1 1 777 1 1 53 CYS HB2 H -5.859 -5.047 0.988 1.00 . A A . 53 CYS HB2 1 1 1 778 1 1 53 CYS HB3 H -6.552 -3.768 1.985 1.00 . A A . 53 CYS HB3 1 1 1 779 1 1 53 CYS N N -4.260 -5.882 2.590 1.00 . A A . 53 CYS N 1 1 1 780 1 1 53 CYS O O -6.208 -3.414 4.153 1.00 . A A . 53 CYS O 1 1 1 781 1 1 53 CYS SG S -5.031 -2.898 0.368 1.00 . A A . 53 CYS SG 1 1 1 782 1 1 54 THR C C -3.941 -4.937 7.389 1.00 . A A . 54 THR C 1 1 1 783 1 1 54 THR CA C -5.058 -4.527 6.426 1.00 . A A . 54 THR CA 1 1 1 784 1 1 54 THR CB C -6.361 -5.329 6.700 1.00 . A A . 54 THR CB 1 1 1 785 1 1 54 THR CG2 C -6.105 -6.832 6.725 1.00 . A A . 54 THR CG2 1 1 1 786 1 1 54 THR H H -3.835 -5.300 4.882 1.00 . A A . 54 THR H 1 1 1 787 1 1 54 THR HA H -5.269 -3.478 6.565 1.00 . A A . 54 THR HA 1 1 1 788 1 1 54 THR HB H -7.057 -5.121 5.900 1.00 . A A . 54 THR HB 1 1 1 789 1 1 54 THR HG1 H -7.782 -5.424 8.074 1.00 . A A . 54 THR HG1 1 1 1 790 1 1 54 THR HG21 H -6.940 -7.334 7.193 1.00 . A A . 54 THR HG21 1 1 1 791 1 1 54 THR HG22 H -5.205 -7.034 7.285 1.00 . A A . 54 THR HG22 1 1 1 792 1 1 54 THR HG23 H -5.989 -7.194 5.714 1.00 . A A . 54 THR HG23 1 1 1 793 1 1 54 THR N N -4.611 -4.715 5.056 1.00 . A A . 54 THR N 1 1 1 794 1 1 54 THR O O -2.777 -4.989 6.990 1.00 . A A . 54 THR O 1 1 1 795 1 1 54 THR OG1 O -6.961 -4.923 7.937 1.00 . A A . 54 THR OG1 1 1 1 796 1 1 55 CYS C C -2.573 -6.894 9.164 1.00 . A A . 55 CYS C 1 1 1 797 1 1 55 CYS CA C -3.316 -5.644 9.642 1.00 . A A . 55 CYS CA 1 1 1 798 1 1 55 CYS CB C -4.022 -5.920 10.969 1.00 . A A . 55 CYS CB 1 1 1 799 1 1 55 CYS H H -5.238 -5.156 8.900 1.00 . A A . 55 CYS H 1 1 1 800 1 1 55 CYS HA H -2.604 -4.843 9.780 1.00 . A A . 55 CYS HA 1 1 1 801 1 1 55 CYS HB2 H -3.786 -6.923 11.295 1.00 . A A . 55 CYS HB2 1 1 1 802 1 1 55 CYS HB3 H -3.674 -5.214 11.708 1.00 . A A . 55 CYS HB3 1 1 1 803 1 1 55 CYS HG H -6.181 -4.669 11.519 1.00 . A A . 55 CYS HG 1 1 1 804 1 1 55 CYS N N -4.290 -5.215 8.643 1.00 . A A . 55 CYS N 1 1 1 805 1 1 55 CYS O O -3.195 -7.907 8.836 1.00 . A A . 55 CYS O 1 1 1 806 1 1 55 CYS SG S -5.822 -5.779 10.878 1.00 . A A . 55 CYS SG 1 1 1 807 1 1 56 PRO C C -0.098 -8.978 9.403 1.00 . A A . 56 PRO C 1 1 1 808 1 1 56 PRO CA C -0.447 -7.871 8.407 1.00 . A A . 56 PRO CA 1 1 1 809 1 1 56 PRO CB C 0.814 -7.146 7.940 1.00 . A A . 56 PRO CB 1 1 1 810 1 1 56 PRO CD C -0.450 -5.576 9.233 1.00 . A A . 56 PRO CD 1 1 1 811 1 1 56 PRO CG C 0.950 -5.986 8.865 1.00 . A A . 56 PRO CG 1 1 1 812 1 1 56 PRO HA H -0.946 -8.306 7.554 1.00 . A A . 56 PRO HA 1 1 1 813 1 1 56 PRO HB2 H 1.660 -7.812 8.011 1.00 . A A . 56 PRO HB2 1 1 1 814 1 1 56 PRO HB3 H 0.688 -6.821 6.918 1.00 . A A . 56 PRO HB3 1 1 1 815 1 1 56 PRO HD2 H -0.496 -5.289 10.272 1.00 . A A . 56 PRO HD2 1 1 1 816 1 1 56 PRO HD3 H -0.784 -4.767 8.601 1.00 . A A . 56 PRO HD3 1 1 1 817 1 1 56 PRO HG2 H 1.498 -6.283 9.747 1.00 . A A . 56 PRO HG2 1 1 1 818 1 1 56 PRO HG3 H 1.457 -5.176 8.363 1.00 . A A . 56 PRO HG3 1 1 1 819 1 1 56 PRO N N -1.248 -6.795 8.992 1.00 . A A . 56 PRO N 1 1 1 820 1 1 56 PRO O O 1.041 -9.446 9.453 1.00 . A A . 56 PRO O 1 1 1 821 1 1 57 ALA C C -1.322 -11.864 10.389 1.00 . A A . 57 ALA C 1 1 1 822 1 1 57 ALA CA C -0.915 -10.559 11.054 1.00 . A A . 57 ALA CA 1 1 1 823 1 1 57 ALA CB C -1.715 -10.345 12.327 1.00 . A A . 57 ALA CB 1 1 1 824 1 1 57 ALA H H -1.998 -9.063 10.017 1.00 . A A . 57 ALA H 1 1 1 825 1 1 57 ALA HA H 0.131 -10.609 11.317 1.00 . A A . 57 ALA HA 1 1 1 826 1 1 57 ALA HB1 H -2.725 -10.057 12.073 1.00 . A A . 57 ALA HB1 1 1 1 827 1 1 57 ALA HB2 H -1.735 -11.261 12.900 1.00 . A A . 57 ALA HB2 1 1 1 828 1 1 57 ALA HB3 H -1.256 -9.564 12.914 1.00 . A A . 57 ALA HB3 1 1 1 829 1 1 57 ALA N N -1.100 -9.445 10.136 1.00 . A A . 57 ALA N 1 1 1 830 1 1 57 ALA O O -0.910 -12.944 10.808 1.00 . A A . 57 ALA O 1 1 1 831 1 1 58 LEU C C -1.554 -13.280 7.507 1.00 . A A . 58 LEU C 1 1 1 832 1 1 58 LEU CA C -2.565 -12.914 8.587 1.00 . A A . 58 LEU CA 1 1 1 833 1 1 58 LEU CB C -3.934 -12.644 7.954 1.00 . A A . 58 LEU CB 1 1 1 834 1 1 58 LEU CD1 C -5.515 -10.722 7.685 1.00 . A A . 58 LEU CD1 1 1 1 835 1 1 58 LEU CD2 C -5.797 -12.312 9.596 1.00 . A A . 58 LEU CD2 1 1 1 836 1 1 58 LEU CG C -4.798 -11.616 8.684 1.00 . A A . 58 LEU CG 1 1 1 837 1 1 58 LEU H H -2.381 -10.861 9.036 1.00 . A A . 58 LEU H 1 1 1 838 1 1 58 LEU HA H -2.652 -13.738 9.278 1.00 . A A . 58 LEU HA 1 1 1 839 1 1 58 LEU HB2 H -3.775 -12.297 6.943 1.00 . A A . 58 LEU HB2 1 1 1 840 1 1 58 LEU HB3 H -4.478 -13.575 7.915 1.00 . A A . 58 LEU HB3 1 1 1 841 1 1 58 LEU HD11 H -6.302 -10.179 8.187 1.00 . A A . 58 LEU HD11 1 1 1 842 1 1 58 LEU HD12 H -4.812 -10.024 7.256 1.00 . A A . 58 LEU HD12 1 1 1 843 1 1 58 LEU HD13 H -5.942 -11.330 6.899 1.00 . A A . 58 LEU HD13 1 1 1 844 1 1 58 LEU HD21 H -6.368 -13.029 9.023 1.00 . A A . 58 LEU HD21 1 1 1 845 1 1 58 LEU HD22 H -5.268 -12.823 10.387 1.00 . A A . 58 LEU HD22 1 1 1 846 1 1 58 LEU HD23 H -6.466 -11.580 10.024 1.00 . A A . 58 LEU HD23 1 1 1 847 1 1 58 LEU HG H -4.163 -10.991 9.295 1.00 . A A . 58 LEU HG 1 1 1 848 1 1 58 LEU N N -2.112 -11.751 9.334 1.00 . A A . 58 LEU N 1 1 1 849 1 1 58 LEU O O -0.608 -12.530 7.247 1.00 . A A . 58 LEU O 1 1 1 850 1 1 59 LYS C C -1.323 -14.218 4.468 1.00 . A A . 59 LYS C 1 1 1 851 1 1 59 LYS CA C -0.904 -14.854 5.784 1.00 . A A . 59 LYS CA 1 1 1 852 1 1 59 LYS CB C -0.931 -16.380 5.657 1.00 . A A . 59 LYS CB 1 1 1 853 1 1 59 LYS CD C -0.419 -18.254 4.060 1.00 . A A . 59 LYS CD 1 1 1 854 1 1 59 LYS CE C 0.740 -19.233 3.954 1.00 . A A . 59 LYS CE 1 1 1 855 1 1 59 LYS CG C 0.039 -16.919 4.616 1.00 . A A . 59 LYS CG 1 1 1 856 1 1 59 LYS H H -2.572 -14.945 7.081 1.00 . A A . 59 LYS H 1 1 1 857 1 1 59 LYS HA H 0.101 -14.538 6.020 1.00 . A A . 59 LYS HA 1 1 1 858 1 1 59 LYS HB2 H -0.677 -16.814 6.613 1.00 . A A . 59 LYS HB2 1 1 1 859 1 1 59 LYS HB3 H -1.929 -16.693 5.384 1.00 . A A . 59 LYS HB3 1 1 1 860 1 1 59 LYS HD2 H -1.170 -18.670 4.714 1.00 . A A . 59 LYS HD2 1 1 1 861 1 1 59 LYS HD3 H -0.838 -18.100 3.076 1.00 . A A . 59 LYS HD3 1 1 1 862 1 1 59 LYS HE2 H 1.629 -18.762 4.342 1.00 . A A . 59 LYS HE2 1 1 1 863 1 1 59 LYS HE3 H 0.508 -20.105 4.547 1.00 . A A . 59 LYS HE3 1 1 1 864 1 1 59 LYS HG2 H 0.111 -16.209 3.805 1.00 . A A . 59 LYS HG2 1 1 1 865 1 1 59 LYS HG3 H 1.008 -17.042 5.077 1.00 . A A . 59 LYS HG3 1 1 1 866 1 1 59 LYS HZ1 H 1.054 -18.816 1.928 1.00 . A A . 59 LYS HZ1 1 1 1 867 1 1 59 LYS HZ2 H 0.216 -20.265 2.215 1.00 . A A . 59 LYS HZ2 1 1 1 868 1 1 59 LYS HZ3 H 1.886 -20.185 2.491 1.00 . A A . 59 LYS HZ3 1 1 1 869 1 1 59 LYS N N -1.775 -14.412 6.859 1.00 . A A . 59 LYS N 1 1 1 870 1 1 59 LYS NZ N 0.991 -19.654 2.551 1.00 . A A . 59 LYS NZ 1 1 1 871 1 1 59 LYS O O -2.380 -14.533 3.926 1.00 . A A . 59 LYS O 1 1 1 872 1 1 60 GLY C C -0.226 -13.554 1.519 1.00 . A A . 60 GLY C 1 1 1 873 1 1 60 GLY CA C -0.748 -12.725 2.669 1.00 . A A . 60 GLY CA 1 1 1 874 1 1 60 GLY H H 0.378 -13.168 4.404 1.00 . A A . 60 GLY H 1 1 1 875 1 1 60 GLY HA2 H -1.816 -12.601 2.562 1.00 . A A . 60 GLY HA2 1 1 1 876 1 1 60 GLY HA3 H -0.276 -11.753 2.643 1.00 . A A . 60 GLY HA3 1 1 1 877 1 1 60 GLY N N -0.473 -13.349 3.943 1.00 . A A . 60 GLY N 1 1 1 878 1 1 60 GLY O O -0.829 -13.600 0.446 1.00 . A A . 60 GLY O 1 1 1 879 1 1 61 LYS C C 1.853 -16.444 1.349 1.00 . A A . 61 LYS C 1 1 1 880 1 1 61 LYS CA C 1.484 -15.094 0.748 1.00 . A A . 61 LYS CA 1 1 1 881 1 1 61 LYS CB C 2.726 -14.420 0.153 1.00 . A A . 61 LYS CB 1 1 1 882 1 1 61 LYS CD C 3.695 -14.421 -2.162 1.00 . A A . 61 LYS CD 1 1 1 883 1 1 61 LYS CE C 3.609 -15.907 -2.467 1.00 . A A . 61 LYS CE 1 1 1 884 1 1 61 LYS CG C 2.542 -13.968 -1.285 1.00 . A A . 61 LYS CG 1 1 1 885 1 1 61 LYS H H 1.299 -14.184 2.643 1.00 . A A . 61 LYS H 1 1 1 886 1 1 61 LYS HA H 0.756 -15.247 -0.035 1.00 . A A . 61 LYS HA 1 1 1 887 1 1 61 LYS HB2 H 2.973 -13.555 0.749 1.00 . A A . 61 LYS HB2 1 1 1 888 1 1 61 LYS HB3 H 3.550 -15.117 0.185 1.00 . A A . 61 LYS HB3 1 1 1 889 1 1 61 LYS HD2 H 3.666 -13.870 -3.092 1.00 . A A . 61 LYS HD2 1 1 1 890 1 1 61 LYS HD3 H 4.626 -14.219 -1.651 1.00 . A A . 61 LYS HD3 1 1 1 891 1 1 61 LYS HE2 H 3.365 -16.436 -1.557 1.00 . A A . 61 LYS HE2 1 1 1 892 1 1 61 LYS HE3 H 2.828 -16.064 -3.196 1.00 . A A . 61 LYS HE3 1 1 1 893 1 1 61 LYS HG2 H 1.624 -14.387 -1.670 1.00 . A A . 61 LYS HG2 1 1 1 894 1 1 61 LYS HG3 H 2.486 -12.889 -1.309 1.00 . A A . 61 LYS HG3 1 1 1 895 1 1 61 LYS HZ1 H 5.185 -17.277 -2.461 1.00 . A A . 61 LYS HZ1 1 1 1 896 1 1 61 LYS HZ2 H 5.635 -15.713 -2.938 1.00 . A A . 61 LYS HZ2 1 1 1 897 1 1 61 LYS HZ3 H 4.769 -16.709 -4.005 1.00 . A A . 61 LYS HZ3 1 1 1 898 1 1 61 LYS N N 0.883 -14.240 1.756 1.00 . A A . 61 LYS N 1 1 1 899 1 1 61 LYS NZ N 4.887 -16.438 -3.005 1.00 . A A . 61 LYS NZ 1 1 1 900 1 1 61 LYS O O 1.108 -17.417 1.131 1.00 . A A . 61 LYS O 1 1 1 901 1 1 61 LYS OXT O 2.879 -16.523 2.055 1.00 . A A . 61 LYS OXT 1 1 1 902 2 2 1 ZN ZN ZN -4.724 -3.967 -1.619 1.00 . B A . 62 ZN ZN 1 1 1 903 3 2 1 ZN ZN ZN 3.932 3.507 3.444 1.00 . C A . 63 ZN ZN 1 1 2 904 1 1 1 GLY C C -20.198 0.649 6.125 1.00 . A A . 1 GLY C 1 1 2 905 1 1 1 GLY CA C -20.826 0.149 4.840 1.00 . A A . 1 GLY CA 1 1 2 906 1 1 1 GLY H1 H -19.202 0.315 3.542 1.00 . A A . 1 GLY H1 1 1 2 907 1 1 1 GLY H2 H -20.093 1.747 3.719 1.00 . A A . 1 GLY H2 1 1 2 908 1 1 1 GLY H3 H -20.710 0.475 2.783 1.00 . A A . 1 GLY H3 1 1 2 909 1 1 1 GLY HA2 H -21.869 0.429 4.827 1.00 . A A . 1 GLY HA2 1 1 2 910 1 1 1 GLY HA3 H -20.754 -0.929 4.811 1.00 . A A . 1 GLY HA3 1 1 2 911 1 1 1 GLY N N -20.163 0.709 3.638 1.00 . A A . 1 GLY N 1 1 2 912 1 1 1 GLY O O -19.821 1.820 6.214 1.00 . A A . 1 GLY O 1 1 2 913 1 1 2 PRO C C -18.070 0.629 8.332 1.00 . A A . 2 PRO C 1 1 2 914 1 1 2 PRO CA C -19.517 0.164 8.451 1.00 . A A . 2 PRO CA 1 1 2 915 1 1 2 PRO CB C -19.600 -1.127 9.275 1.00 . A A . 2 PRO CB 1 1 2 916 1 1 2 PRO CD C -20.533 -1.616 7.136 1.00 . A A . 2 PRO CD 1 1 2 917 1 1 2 PRO CG C -20.634 -1.955 8.593 1.00 . A A . 2 PRO CG 1 1 2 918 1 1 2 PRO HA H -20.101 0.936 8.927 1.00 . A A . 2 PRO HA 1 1 2 919 1 1 2 PRO HB2 H -18.638 -1.617 9.276 1.00 . A A . 2 PRO HB2 1 1 2 920 1 1 2 PRO HB3 H -19.890 -0.891 10.288 1.00 . A A . 2 PRO HB3 1 1 2 921 1 1 2 PRO HD2 H -19.804 -2.248 6.653 1.00 . A A . 2 PRO HD2 1 1 2 922 1 1 2 PRO HD3 H -21.496 -1.710 6.657 1.00 . A A . 2 PRO HD3 1 1 2 923 1 1 2 PRO HG2 H -20.428 -3.005 8.750 1.00 . A A . 2 PRO HG2 1 1 2 924 1 1 2 PRO HG3 H -21.614 -1.703 8.969 1.00 . A A . 2 PRO HG3 1 1 2 925 1 1 2 PRO N N -20.086 -0.214 7.152 1.00 . A A . 2 PRO N 1 1 2 926 1 1 2 PRO O O -17.750 1.787 8.616 1.00 . A A . 2 PRO O 1 1 2 927 1 1 3 LEU C C -15.418 -0.229 6.219 1.00 . A A . 3 LEU C 1 1 2 928 1 1 3 LEU CA C -15.807 0.068 7.657 1.00 . A A . 3 LEU CA 1 1 2 929 1 1 3 LEU CB C -14.914 -0.727 8.611 1.00 . A A . 3 LEU CB 1 1 2 930 1 1 3 LEU CD1 C -13.942 -1.016 10.896 1.00 . A A . 3 LEU CD1 1 1 2 931 1 1 3 LEU CD2 C -13.691 1.168 9.703 1.00 . A A . 3 LEU CD2 1 1 2 932 1 1 3 LEU CG C -14.592 -0.035 9.934 1.00 . A A . 3 LEU CG 1 1 2 933 1 1 3 LEU H H -17.525 -1.158 7.621 1.00 . A A . 3 LEU H 1 1 2 934 1 1 3 LEU HA H -15.679 1.122 7.845 1.00 . A A . 3 LEU HA 1 1 2 935 1 1 3 LEU HB2 H -15.403 -1.664 8.829 1.00 . A A . 3 LEU HB2 1 1 2 936 1 1 3 LEU HB3 H -13.982 -0.937 8.105 1.00 . A A . 3 LEU HB3 1 1 2 937 1 1 3 LEU HD11 H -13.346 -0.473 11.616 1.00 . A A . 3 LEU HD11 1 1 2 938 1 1 3 LEU HD12 H -14.707 -1.578 11.411 1.00 . A A . 3 LEU HD12 1 1 2 939 1 1 3 LEU HD13 H -13.309 -1.694 10.345 1.00 . A A . 3 LEU HD13 1 1 2 940 1 1 3 LEU HD21 H -12.911 1.181 10.451 1.00 . A A . 3 LEU HD21 1 1 2 941 1 1 3 LEU HD22 H -13.249 1.102 8.721 1.00 . A A . 3 LEU HD22 1 1 2 942 1 1 3 LEU HD23 H -14.273 2.075 9.775 1.00 . A A . 3 LEU HD23 1 1 2 943 1 1 3 LEU HG H -15.511 0.314 10.384 1.00 . A A . 3 LEU HG 1 1 2 944 1 1 3 LEU N N -17.205 -0.262 7.869 1.00 . A A . 3 LEU N 1 1 2 945 1 1 3 LEU O O -16.062 -1.040 5.547 1.00 . A A . 3 LEU O 1 1 2 946 1 1 4 GLY C C -14.378 1.408 3.487 1.00 . A A . 4 GLY C 1 1 2 947 1 1 4 GLY CA C -13.965 0.258 4.374 1.00 . A A . 4 GLY CA 1 1 2 948 1 1 4 GLY H H -13.932 1.105 6.311 1.00 . A A . 4 GLY H 1 1 2 949 1 1 4 GLY HA2 H -12.889 0.169 4.355 1.00 . A A . 4 GLY HA2 1 1 2 950 1 1 4 GLY HA3 H -14.401 -0.654 3.991 1.00 . A A . 4 GLY HA3 1 1 2 951 1 1 4 GLY N N -14.395 0.449 5.738 1.00 . A A . 4 GLY N 1 1 2 952 1 1 4 GLY O O -14.052 1.433 2.303 1.00 . A A . 4 GLY O 1 1 2 953 1 1 5 SER C C -14.279 4.445 3.060 1.00 . A A . 5 SER C 1 1 2 954 1 1 5 SER CA C -15.492 3.564 3.334 1.00 . A A . 5 SER CA 1 1 2 955 1 1 5 SER CB C -16.538 4.334 4.136 1.00 . A A . 5 SER CB 1 1 2 956 1 1 5 SER H H -15.303 2.305 5.021 1.00 . A A . 5 SER H 1 1 2 957 1 1 5 SER HA H -15.920 3.249 2.395 1.00 . A A . 5 SER HA 1 1 2 958 1 1 5 SER HB2 H -16.107 5.259 4.490 1.00 . A A . 5 SER HB2 1 1 2 959 1 1 5 SER HB3 H -17.386 4.552 3.503 1.00 . A A . 5 SER HB3 1 1 2 960 1 1 5 SER HG H -17.896 3.800 5.445 1.00 . A A . 5 SER HG 1 1 2 961 1 1 5 SER N N -15.080 2.376 4.068 1.00 . A A . 5 SER N 1 1 2 962 1 1 5 SER O O -14.282 5.284 2.156 1.00 . A A . 5 SER O 1 1 2 963 1 1 5 SER OG O -16.978 3.576 5.251 1.00 . A A . 5 SER OG 1 1 2 964 1 1 6 ASP C C -10.911 3.845 3.130 1.00 . A A . 6 ASP C 1 1 2 965 1 1 6 ASP CA C -11.949 4.855 3.603 1.00 . A A . 6 ASP CA 1 1 2 966 1 1 6 ASP CB C -11.494 5.520 4.900 1.00 . A A . 6 ASP CB 1 1 2 967 1 1 6 ASP CG C -10.462 6.604 4.667 1.00 . A A . 6 ASP CG 1 1 2 968 1 1 6 ASP H H -13.272 3.461 4.468 1.00 . A A . 6 ASP H 1 1 2 969 1 1 6 ASP HA H -12.083 5.608 2.840 1.00 . A A . 6 ASP HA 1 1 2 970 1 1 6 ASP HB2 H -12.348 5.962 5.389 1.00 . A A . 6 ASP HB2 1 1 2 971 1 1 6 ASP HB3 H -11.062 4.770 5.546 1.00 . A A . 6 ASP HB3 1 1 2 972 1 1 6 ASP N N -13.217 4.182 3.803 1.00 . A A . 6 ASP N 1 1 2 973 1 1 6 ASP O O -9.935 3.563 3.825 1.00 . A A . 6 ASP O 1 1 2 974 1 1 6 ASP OD1 O -10.611 7.370 3.692 1.00 . A A . 6 ASP OD1 1 1 2 975 1 1 6 ASP OD2 O -9.512 6.705 5.473 1.00 . A A . 6 ASP OD2 1 1 2 976 1 1 7 HIS C C -9.387 2.752 0.431 1.00 . A A . 7 HIS C 1 1 2 977 1 1 7 HIS CA C -10.344 2.168 1.463 1.00 . A A . 7 HIS CA 1 1 2 978 1 1 7 HIS CB C -11.208 1.069 0.834 1.00 . A A . 7 HIS CB 1 1 2 979 1 1 7 HIS CD2 C -9.574 -0.491 -0.413 1.00 . A A . 7 HIS CD2 1 1 2 980 1 1 7 HIS CE1 C -9.969 -2.295 0.745 1.00 . A A . 7 HIS CE1 1 1 2 981 1 1 7 HIS CG C -10.480 -0.211 0.554 1.00 . A A . 7 HIS CG 1 1 2 982 1 1 7 HIS H H -12.044 3.425 1.539 1.00 . A A . 7 HIS H 1 1 2 983 1 1 7 HIS HA H -9.773 1.749 2.278 1.00 . A A . 7 HIS HA 1 1 2 984 1 1 7 HIS HB2 H -12.025 0.841 1.501 1.00 . A A . 7 HIS HB2 1 1 2 985 1 1 7 HIS HB3 H -11.609 1.431 -0.102 1.00 . A A . 7 HIS HB3 1 1 2 986 1 1 7 HIS HD2 H -9.172 0.197 -1.143 1.00 . A A . 7 HIS HD2 1 1 2 987 1 1 7 HIS HE1 H -9.935 -3.319 1.085 1.00 . A A . 7 HIS HE1 1 1 2 988 1 1 7 HIS HE2 H -8.635 -2.326 -0.852 1.00 . A A . 7 HIS HE2 1 1 2 989 1 1 7 HIS N N -11.200 3.215 2.002 1.00 . A A . 7 HIS N 1 1 2 990 1 1 7 HIS ND1 N -10.723 -1.352 1.285 1.00 . A A . 7 HIS ND1 1 1 2 991 1 1 7 HIS NE2 N -9.258 -1.816 -0.282 1.00 . A A . 7 HIS NE2 1 1 2 992 1 1 7 HIS O O -8.186 2.489 0.462 1.00 . A A . 7 HIS O 1 1 2 993 1 1 8 HIS C C -8.397 5.443 -0.897 1.00 . A A . 8 HIS C 1 1 2 994 1 1 8 HIS CA C -9.118 4.230 -1.477 1.00 . A A . 8 HIS CA 1 1 2 995 1 1 8 HIS CB C -9.991 4.626 -2.681 1.00 . A A . 8 HIS CB 1 1 2 996 1 1 8 HIS CD2 C -10.944 6.992 -3.089 1.00 . A A . 8 HIS CD2 1 1 2 997 1 1 8 HIS CE1 C -12.511 6.935 -1.582 1.00 . A A . 8 HIS CE1 1 1 2 998 1 1 8 HIS CG C -10.904 5.799 -2.451 1.00 . A A . 8 HIS CG 1 1 2 999 1 1 8 HIS H H -10.883 3.782 -0.400 1.00 . A A . 8 HIS H 1 1 2 1000 1 1 8 HIS HA H -8.375 3.518 -1.806 1.00 . A A . 8 HIS HA 1 1 2 1001 1 1 8 HIS HB2 H -9.346 4.875 -3.510 1.00 . A A . 8 HIS HB2 1 1 2 1002 1 1 8 HIS HB3 H -10.605 3.781 -2.958 1.00 . A A . 8 HIS HB3 1 1 2 1003 1 1 8 HIS HD2 H -10.296 7.319 -3.890 1.00 . A A . 8 HIS HD2 1 1 2 1004 1 1 8 HIS HE1 H -13.351 7.224 -0.965 1.00 . A A . 8 HIS HE1 1 1 2 1005 1 1 8 HIS HE2 H -12.387 8.515 -2.920 1.00 . A A . 8 HIS HE2 1 1 2 1006 1 1 8 HIS N N -9.924 3.579 -0.455 1.00 . A A . 8 HIS N 1 1 2 1007 1 1 8 HIS ND1 N -11.896 5.769 -1.500 1.00 . A A . 8 HIS ND1 1 1 2 1008 1 1 8 HIS NE2 N -11.971 7.709 -2.530 1.00 . A A . 8 HIS NE2 1 1 2 1009 1 1 8 HIS O O -8.970 6.200 -0.108 1.00 . A A . 8 HIS O 1 1 2 1010 1 1 9 MET C C -5.023 6.824 -1.516 1.00 . A A . 9 MET C 1 1 2 1011 1 1 9 MET CA C -6.320 6.687 -0.730 1.00 . A A . 9 MET CA 1 1 2 1012 1 1 9 MET CB C -6.010 6.477 0.760 1.00 . A A . 9 MET CB 1 1 2 1013 1 1 9 MET CE C -7.094 4.600 3.008 1.00 . A A . 9 MET CE 1 1 2 1014 1 1 9 MET CG C -5.218 5.214 1.063 1.00 . A A . 9 MET CG 1 1 2 1015 1 1 9 MET H H -6.718 4.941 -1.858 1.00 . A A . 9 MET H 1 1 2 1016 1 1 9 MET HA H -6.891 7.596 -0.843 1.00 . A A . 9 MET HA 1 1 2 1017 1 1 9 MET HB2 H -5.441 7.323 1.118 1.00 . A A . 9 MET HB2 1 1 2 1018 1 1 9 MET HB3 H -6.941 6.429 1.304 1.00 . A A . 9 MET HB3 1 1 2 1019 1 1 9 MET HE1 H -7.340 4.726 4.051 1.00 . A A . 9 MET HE1 1 1 2 1020 1 1 9 MET HE2 H -7.580 5.369 2.425 1.00 . A A . 9 MET HE2 1 1 2 1021 1 1 9 MET HE3 H -7.426 3.628 2.675 1.00 . A A . 9 MET HE3 1 1 2 1022 1 1 9 MET HG2 H -5.600 4.408 0.454 1.00 . A A . 9 MET HG2 1 1 2 1023 1 1 9 MET HG3 H -4.182 5.391 0.816 1.00 . A A . 9 MET HG3 1 1 2 1024 1 1 9 MET N N -7.127 5.592 -1.246 1.00 . A A . 9 MET N 1 1 2 1025 1 1 9 MET O O -4.409 5.826 -1.906 1.00 . A A . 9 MET O 1 1 2 1026 1 1 9 MET SD S -5.320 4.725 2.798 1.00 . A A . 9 MET SD 1 1 2 1027 1 1 10 GLU C C -2.186 8.195 -1.565 1.00 . A A . 10 GLU C 1 1 2 1028 1 1 10 GLU CA C -3.389 8.352 -2.484 1.00 . A A . 10 GLU CA 1 1 2 1029 1 1 10 GLU CB C -3.433 9.768 -3.060 1.00 . A A . 10 GLU CB 1 1 2 1030 1 1 10 GLU CD C -5.638 10.934 -2.659 1.00 . A A . 10 GLU CD 1 1 2 1031 1 1 10 GLU CG C -4.788 10.151 -3.636 1.00 . A A . 10 GLU CG 1 1 2 1032 1 1 10 GLU H H -5.176 8.818 -1.443 1.00 . A A . 10 GLU H 1 1 2 1033 1 1 10 GLU HA H -3.307 7.642 -3.294 1.00 . A A . 10 GLU HA 1 1 2 1034 1 1 10 GLU HB2 H -3.186 10.472 -2.279 1.00 . A A . 10 GLU HB2 1 1 2 1035 1 1 10 GLU HB3 H -2.696 9.846 -3.848 1.00 . A A . 10 GLU HB3 1 1 2 1036 1 1 10 GLU HG2 H -4.634 10.752 -4.519 1.00 . A A . 10 GLU HG2 1 1 2 1037 1 1 10 GLU HG3 H -5.316 9.247 -3.905 1.00 . A A . 10 GLU HG3 1 1 2 1038 1 1 10 GLU N N -4.619 8.064 -1.755 1.00 . A A . 10 GLU N 1 1 2 1039 1 1 10 GLU O O -1.065 7.977 -2.018 1.00 . A A . 10 GLU O 1 1 2 1040 1 1 10 GLU OE1 O -6.022 10.369 -1.612 1.00 . A A . 10 GLU OE1 1 1 2 1041 1 1 10 GLU OE2 O -5.928 12.113 -2.930 1.00 . A A . 10 GLU OE2 1 1 2 1042 1 1 11 PHE C C -1.443 6.510 1.127 1.00 . A A . 11 PHE C 1 1 2 1043 1 1 11 PHE CA C -1.429 7.977 0.738 1.00 . A A . 11 PHE CA 1 1 2 1044 1 1 11 PHE CB C -1.648 8.869 1.970 1.00 . A A . 11 PHE CB 1 1 2 1045 1 1 11 PHE CD1 C -4.085 9.466 2.086 1.00 . A A . 11 PHE CD1 1 1 2 1046 1 1 11 PHE CD2 C -3.222 7.922 3.678 1.00 . A A . 11 PHE CD2 1 1 2 1047 1 1 11 PHE CE1 C -5.337 9.362 2.657 1.00 . A A . 11 PHE CE1 1 1 2 1048 1 1 11 PHE CE2 C -4.471 7.815 4.256 1.00 . A A . 11 PHE CE2 1 1 2 1049 1 1 11 PHE CG C -3.015 8.746 2.588 1.00 . A A . 11 PHE CG 1 1 2 1050 1 1 11 PHE CZ C -5.530 8.536 3.743 1.00 . A A . 11 PHE CZ 1 1 2 1051 1 1 11 PHE H H -3.382 8.323 0.021 1.00 . A A . 11 PHE H 1 1 2 1052 1 1 11 PHE HA H -0.464 8.202 0.308 1.00 . A A . 11 PHE HA 1 1 2 1053 1 1 11 PHE HB2 H -0.922 8.610 2.726 1.00 . A A . 11 PHE HB2 1 1 2 1054 1 1 11 PHE HB3 H -1.505 9.903 1.685 1.00 . A A . 11 PHE HB3 1 1 2 1055 1 1 11 PHE HD1 H -3.934 10.114 1.234 1.00 . A A . 11 PHE HD1 1 1 2 1056 1 1 11 PHE HD2 H -2.395 7.358 4.077 1.00 . A A . 11 PHE HD2 1 1 2 1057 1 1 11 PHE HE1 H -6.163 9.927 2.253 1.00 . A A . 11 PHE HE1 1 1 2 1058 1 1 11 PHE HE2 H -4.621 7.165 5.105 1.00 . A A . 11 PHE HE2 1 1 2 1059 1 1 11 PHE HZ H -6.508 8.455 4.193 1.00 . A A . 11 PHE HZ 1 1 2 1060 1 1 11 PHE N N -2.453 8.223 -0.267 1.00 . A A . 11 PHE N 1 1 2 1061 1 1 11 PHE O O -2.172 5.709 0.540 1.00 . A A . 11 PHE O 1 1 2 1062 1 1 12 CYS C C -1.301 4.413 3.618 1.00 . A A . 12 CYS C 1 1 2 1063 1 1 12 CYS CA C -0.426 4.755 2.418 1.00 . A A . 12 CYS CA 1 1 2 1064 1 1 12 CYS CB C 1.043 4.464 2.687 1.00 . A A . 12 CYS CB 1 1 2 1065 1 1 12 CYS H H 0.036 6.813 2.419 1.00 . A A . 12 CYS H 1 1 2 1066 1 1 12 CYS HA H -0.749 4.154 1.580 1.00 . A A . 12 CYS HA 1 1 2 1067 1 1 12 CYS HB2 H 1.383 3.686 2.023 1.00 . A A . 12 CYS HB2 1 1 2 1068 1 1 12 CYS HB3 H 1.606 5.366 2.497 1.00 . A A . 12 CYS HB3 1 1 2 1069 1 1 12 CYS HG H 2.167 4.938 4.872 1.00 . A A . 12 CYS HG 1 1 2 1070 1 1 12 CYS N N -0.572 6.143 2.041 1.00 . A A . 12 CYS N 1 1 2 1071 1 1 12 CYS O O -1.692 5.293 4.381 1.00 . A A . 12 CYS O 1 1 2 1072 1 1 12 CYS SG S 1.425 3.960 4.360 1.00 . A A . 12 CYS SG 1 1 2 1073 1 1 13 ARG C C -2.052 2.703 6.106 1.00 . A A . 13 ARG C 1 1 2 1074 1 1 13 ARG CA C -2.675 2.730 4.708 1.00 . A A . 13 ARG CA 1 1 2 1075 1 1 13 ARG CB C -3.234 1.348 4.360 1.00 . A A . 13 ARG CB 1 1 2 1076 1 1 13 ARG CD C -5.116 0.222 3.127 1.00 . A A . 13 ARG CD 1 1 2 1077 1 1 13 ARG CG C -4.082 1.335 3.098 1.00 . A A . 13 ARG CG 1 1 2 1078 1 1 13 ARG CZ C -7.508 0.087 3.724 1.00 . A A . 13 ARG CZ 1 1 2 1079 1 1 13 ARG H H -1.474 2.534 2.975 1.00 . A A . 13 ARG H 1 1 2 1080 1 1 13 ARG HA H -3.486 3.441 4.710 1.00 . A A . 13 ARG HA 1 1 2 1081 1 1 13 ARG HB2 H -2.412 0.661 4.224 1.00 . A A . 13 ARG HB2 1 1 2 1082 1 1 13 ARG HB3 H -3.846 1.004 5.183 1.00 . A A . 13 ARG HB3 1 1 2 1083 1 1 13 ARG HD2 H -5.437 0.020 2.116 1.00 . A A . 13 ARG HD2 1 1 2 1084 1 1 13 ARG HD3 H -4.661 -0.666 3.542 1.00 . A A . 13 ARG HD3 1 1 2 1085 1 1 13 ARG HE H -6.149 1.212 4.678 1.00 . A A . 13 ARG HE 1 1 2 1086 1 1 13 ARG HG2 H -4.592 2.283 3.011 1.00 . A A . 13 ARG HG2 1 1 2 1087 1 1 13 ARG HG3 H -3.436 1.192 2.243 1.00 . A A . 13 ARG HG3 1 1 2 1088 1 1 13 ARG HH11 H -6.983 -1.009 2.100 1.00 . A A . 13 ARG HH11 1 1 2 1089 1 1 13 ARG HH12 H -8.655 -1.108 2.556 1.00 . A A . 13 ARG HH12 1 1 2 1090 1 1 13 ARG HH21 H -8.364 1.087 5.272 1.00 . A A . 13 ARG HH21 1 1 2 1091 1 1 13 ARG HH22 H -9.434 0.053 4.367 1.00 . A A . 13 ARG HH22 1 1 2 1092 1 1 13 ARG N N -1.721 3.159 3.690 1.00 . A A . 13 ARG N 1 1 2 1093 1 1 13 ARG NE N -6.287 0.577 3.933 1.00 . A A . 13 ARG NE 1 1 2 1094 1 1 13 ARG NH1 N -7.734 -0.743 2.714 1.00 . A A . 13 ARG NH1 1 1 2 1095 1 1 13 ARG NH2 N -8.514 0.443 4.514 1.00 . A A . 13 ARG NH2 1 1 2 1096 1 1 13 ARG O O -2.705 3.062 7.084 1.00 . A A . 13 ARG O 1 1 2 1097 1 1 14 VAL C C 0.501 3.366 7.935 1.00 . A A . 14 VAL C 1 1 2 1098 1 1 14 VAL CA C -0.158 2.058 7.497 1.00 . A A . 14 VAL CA 1 1 2 1099 1 1 14 VAL CB C 0.893 0.934 7.456 1.00 . A A . 14 VAL CB 1 1 2 1100 1 1 14 VAL CG1 C 1.272 0.497 8.862 1.00 . A A . 14 VAL CG1 1 1 2 1101 1 1 14 VAL CG2 C 0.372 -0.245 6.648 1.00 . A A . 14 VAL CG2 1 1 2 1102 1 1 14 VAL H H -0.374 1.892 5.395 1.00 . A A . 14 VAL H 1 1 2 1103 1 1 14 VAL HA H -0.909 1.789 8.226 1.00 . A A . 14 VAL HA 1 1 2 1104 1 1 14 VAL HB H 1.780 1.313 6.970 1.00 . A A . 14 VAL HB 1 1 2 1105 1 1 14 VAL HG11 H 2.282 0.116 8.860 1.00 . A A . 14 VAL HG11 1 1 2 1106 1 1 14 VAL HG12 H 1.208 1.343 9.530 1.00 . A A . 14 VAL HG12 1 1 2 1107 1 1 14 VAL HG13 H 0.595 -0.276 9.193 1.00 . A A . 14 VAL HG13 1 1 2 1108 1 1 14 VAL HG21 H -0.426 0.088 6.000 1.00 . A A . 14 VAL HG21 1 1 2 1109 1 1 14 VAL HG22 H 1.172 -0.655 6.050 1.00 . A A . 14 VAL HG22 1 1 2 1110 1 1 14 VAL HG23 H -0.002 -1.005 7.319 1.00 . A A . 14 VAL HG23 1 1 2 1111 1 1 14 VAL N N -0.823 2.209 6.203 1.00 . A A . 14 VAL N 1 1 2 1112 1 1 14 VAL O O -0.108 4.162 8.649 1.00 . A A . 14 VAL O 1 1 2 1113 1 1 15 CYS C C 1.786 5.977 6.680 1.00 . A A . 15 CYS C 1 1 2 1114 1 1 15 CYS CA C 2.319 4.933 7.634 1.00 . A A . 15 CYS CA 1 1 2 1115 1 1 15 CYS CB C 3.844 4.810 7.542 1.00 . A A . 15 CYS CB 1 1 2 1116 1 1 15 CYS H H 2.064 3.062 6.731 1.00 . A A . 15 CYS H 1 1 2 1117 1 1 15 CYS HA H 2.061 5.235 8.640 1.00 . A A . 15 CYS HA 1 1 2 1118 1 1 15 CYS HB2 H 4.235 5.716 7.101 1.00 . A A . 15 CYS HB2 1 1 2 1119 1 1 15 CYS HB3 H 4.242 4.713 8.543 1.00 . A A . 15 CYS HB3 1 1 2 1120 1 1 15 CYS N N 1.680 3.658 7.393 1.00 . A A . 15 CYS N 1 1 2 1121 1 1 15 CYS O O 2.396 6.207 5.638 1.00 . A A . 15 CYS O 1 1 2 1122 1 1 15 CYS SG S 4.485 3.404 6.558 1.00 . A A . 15 CYS SG 1 1 2 1123 1 1 16 LYS C C 0.448 8.482 5.628 1.00 . A A . 16 LYS C 1 1 2 1124 1 1 16 LYS CA C -0.289 7.236 6.097 1.00 . A A . 16 LYS CA 1 1 2 1125 1 1 16 LYS CB C -1.566 7.638 6.842 1.00 . A A . 16 LYS CB 1 1 2 1126 1 1 16 LYS CD C -2.341 8.804 8.929 1.00 . A A . 16 LYS CD 1 1 2 1127 1 1 16 LYS CE C -1.604 10.054 9.386 1.00 . A A . 16 LYS CE 1 1 2 1128 1 1 16 LYS CG C -1.387 7.775 8.346 1.00 . A A . 16 LYS CG 1 1 2 1129 1 1 16 LYS H H 0.079 5.914 7.658 1.00 . A A . 16 LYS H 1 1 2 1130 1 1 16 LYS HA H -0.572 6.656 5.235 1.00 . A A . 16 LYS HA 1 1 2 1131 1 1 16 LYS HB2 H -1.909 8.587 6.456 1.00 . A A . 16 LYS HB2 1 1 2 1132 1 1 16 LYS HB3 H -2.325 6.892 6.659 1.00 . A A . 16 LYS HB3 1 1 2 1133 1 1 16 LYS HD2 H -3.063 9.079 8.174 1.00 . A A . 16 LYS HD2 1 1 2 1134 1 1 16 LYS HD3 H -2.849 8.368 9.775 1.00 . A A . 16 LYS HD3 1 1 2 1135 1 1 16 LYS HE2 H -0.627 10.070 8.926 1.00 . A A . 16 LYS HE2 1 1 2 1136 1 1 16 LYS HE3 H -2.163 10.924 9.072 1.00 . A A . 16 LYS HE3 1 1 2 1137 1 1 16 LYS HG2 H -1.579 6.818 8.810 1.00 . A A . 16 LYS HG2 1 1 2 1138 1 1 16 LYS HG3 H -0.372 8.080 8.552 1.00 . A A . 16 LYS HG3 1 1 2 1139 1 1 16 LYS HZ1 H -1.029 10.998 11.158 1.00 . A A . 16 LYS HZ1 1 1 2 1140 1 1 16 LYS HZ2 H -0.813 9.315 11.174 1.00 . A A . 16 LYS HZ2 1 1 2 1141 1 1 16 LYS HZ3 H -2.370 9.973 11.329 1.00 . A A . 16 LYS HZ3 1 1 2 1142 1 1 16 LYS N N 0.531 6.368 6.941 1.00 . A A . 16 LYS N 1 1 2 1143 1 1 16 LYS NZ N -1.443 10.088 10.862 1.00 . A A . 16 LYS NZ 1 1 2 1144 1 1 16 LYS O O 0.211 9.596 6.097 1.00 . A A . 16 LYS O 1 1 2 1145 1 1 17 ASP C C 2.249 9.220 2.724 1.00 . A A . 17 ASP C 1 1 2 1146 1 1 17 ASP CA C 2.257 9.278 4.240 1.00 . A A . 17 ASP CA 1 1 2 1147 1 1 17 ASP CB C 3.678 9.080 4.768 1.00 . A A . 17 ASP CB 1 1 2 1148 1 1 17 ASP CG C 4.437 10.384 4.933 1.00 . A A . 17 ASP CG 1 1 2 1149 1 1 17 ASP H H 1.606 7.297 4.576 1.00 . A A . 17 ASP H 1 1 2 1150 1 1 17 ASP HA H 1.881 10.236 4.564 1.00 . A A . 17 ASP HA 1 1 2 1151 1 1 17 ASP HB2 H 3.629 8.594 5.733 1.00 . A A . 17 ASP HB2 1 1 2 1152 1 1 17 ASP HB3 H 4.221 8.443 4.083 1.00 . A A . 17 ASP HB3 1 1 2 1153 1 1 17 ASP N N 1.395 8.245 4.768 1.00 . A A . 17 ASP N 1 1 2 1154 1 1 17 ASP O O 1.724 8.267 2.138 1.00 . A A . 17 ASP O 1 1 2 1155 1 1 17 ASP OD1 O 4.565 11.147 3.949 1.00 . A A . 17 ASP OD1 1 1 2 1156 1 1 17 ASP OD2 O 4.911 10.655 6.054 1.00 . A A . 17 ASP OD2 1 1 2 1157 1 1 18 GLY C C 4.349 9.727 0.199 1.00 . A A . 18 GLY C 1 1 2 1158 1 1 18 GLY CA C 2.995 10.220 0.665 1.00 . A A . 18 GLY CA 1 1 2 1159 1 1 18 GLY H H 3.354 10.875 2.641 1.00 . A A . 18 GLY H 1 1 2 1160 1 1 18 GLY HA2 H 2.227 9.586 0.242 1.00 . A A . 18 GLY HA2 1 1 2 1161 1 1 18 GLY HA3 H 2.849 11.233 0.321 1.00 . A A . 18 GLY HA3 1 1 2 1162 1 1 18 GLY N N 2.886 10.194 2.103 1.00 . A A . 18 GLY N 1 1 2 1163 1 1 18 GLY O O 4.812 8.668 0.630 1.00 . A A . 18 GLY O 1 1 2 1164 1 1 19 GLY C C 6.166 9.094 -2.289 1.00 . A A . 19 GLY C 1 1 2 1165 1 1 19 GLY CA C 6.285 10.115 -1.181 1.00 . A A . 19 GLY CA 1 1 2 1166 1 1 19 GLY H H 4.576 11.338 -0.958 1.00 . A A . 19 GLY H 1 1 2 1167 1 1 19 GLY HA2 H 6.783 10.993 -1.564 1.00 . A A . 19 GLY HA2 1 1 2 1168 1 1 19 GLY HA3 H 6.874 9.696 -0.378 1.00 . A A . 19 GLY HA3 1 1 2 1169 1 1 19 GLY N N 4.989 10.498 -0.665 1.00 . A A . 19 GLY N 1 1 2 1170 1 1 19 GLY O O 5.224 9.140 -3.084 1.00 . A A . 19 GLY O 1 1 2 1171 1 1 20 GLU C C 6.125 6.006 -2.926 1.00 . A A . 20 GLU C 1 1 2 1172 1 1 20 GLU CA C 7.076 7.117 -3.347 1.00 . A A . 20 GLU CA 1 1 2 1173 1 1 20 GLU CB C 8.479 6.560 -3.574 1.00 . A A . 20 GLU CB 1 1 2 1174 1 1 20 GLU CD C 8.348 6.944 -6.062 1.00 . A A . 20 GLU CD 1 1 2 1175 1 1 20 GLU CG C 9.164 7.135 -4.801 1.00 . A A . 20 GLU CG 1 1 2 1176 1 1 20 GLU H H 7.819 8.166 -1.664 1.00 . A A . 20 GLU H 1 1 2 1177 1 1 20 GLU HA H 6.716 7.553 -4.268 1.00 . A A . 20 GLU HA 1 1 2 1178 1 1 20 GLU HB2 H 9.088 6.784 -2.709 1.00 . A A . 20 GLU HB2 1 1 2 1179 1 1 20 GLU HB3 H 8.416 5.488 -3.691 1.00 . A A . 20 GLU HB3 1 1 2 1180 1 1 20 GLU HG2 H 9.321 8.193 -4.646 1.00 . A A . 20 GLU HG2 1 1 2 1181 1 1 20 GLU HG3 H 10.119 6.645 -4.927 1.00 . A A . 20 GLU HG3 1 1 2 1182 1 1 20 GLU N N 7.104 8.165 -2.340 1.00 . A A . 20 GLU N 1 1 2 1183 1 1 20 GLU O O 6.370 5.304 -1.942 1.00 . A A . 20 GLU O 1 1 2 1184 1 1 20 GLU OE1 O 8.427 5.852 -6.667 1.00 . A A . 20 GLU OE1 1 1 2 1185 1 1 20 GLU OE2 O 7.618 7.881 -6.451 1.00 . A A . 20 GLU OE2 1 1 2 1186 1 1 21 LEU C C 3.652 4.019 -4.423 1.00 . A A . 21 LEU C 1 1 2 1187 1 1 21 LEU CA C 3.973 4.943 -3.260 1.00 . A A . 21 LEU CA 1 1 2 1188 1 1 21 LEU CB C 2.701 5.664 -2.813 1.00 . A A . 21 LEU CB 1 1 2 1189 1 1 21 LEU CD1 C 2.184 7.906 -1.844 1.00 . A A . 21 LEU CD1 1 1 2 1190 1 1 21 LEU CD2 C 2.308 5.903 -0.354 1.00 . A A . 21 LEU CD2 1 1 2 1191 1 1 21 LEU CG C 2.867 6.574 -1.599 1.00 . A A . 21 LEU CG 1 1 2 1192 1 1 21 LEU H H 4.832 6.540 -4.353 1.00 . A A . 21 LEU H 1 1 2 1193 1 1 21 LEU HA H 4.346 4.351 -2.438 1.00 . A A . 21 LEU HA 1 1 2 1194 1 1 21 LEU HB2 H 2.344 6.262 -3.639 1.00 . A A . 21 LEU HB2 1 1 2 1195 1 1 21 LEU HB3 H 1.953 4.921 -2.578 1.00 . A A . 21 LEU HB3 1 1 2 1196 1 1 21 LEU HD11 H 2.154 8.103 -2.906 1.00 . A A . 21 LEU HD11 1 1 2 1197 1 1 21 LEU HD12 H 1.178 7.876 -1.455 1.00 . A A . 21 LEU HD12 1 1 2 1198 1 1 21 LEU HD13 H 2.739 8.691 -1.350 1.00 . A A . 21 LEU HD13 1 1 2 1199 1 1 21 LEU HD21 H 1.384 5.401 -0.600 1.00 . A A . 21 LEU HD21 1 1 2 1200 1 1 21 LEU HD22 H 3.022 5.184 0.019 1.00 . A A . 21 LEU HD22 1 1 2 1201 1 1 21 LEU HD23 H 2.121 6.650 0.404 1.00 . A A . 21 LEU HD23 1 1 2 1202 1 1 21 LEU HG H 3.920 6.761 -1.437 1.00 . A A . 21 LEU HG 1 1 2 1203 1 1 21 LEU N N 5.001 5.908 -3.617 1.00 . A A . 21 LEU N 1 1 2 1204 1 1 21 LEU O O 3.578 4.453 -5.575 1.00 . A A . 21 LEU O 1 1 2 1205 1 1 22 LEU C C 1.548 1.301 -4.715 1.00 . A A . 22 LEU C 1 1 2 1206 1 1 22 LEU CA C 2.946 1.788 -5.082 1.00 . A A . 22 LEU CA 1 1 2 1207 1 1 22 LEU CB C 3.934 0.615 -5.148 1.00 . A A . 22 LEU CB 1 1 2 1208 1 1 22 LEU CD1 C 3.553 -1.829 -4.766 1.00 . A A . 22 LEU CD1 1 1 2 1209 1 1 22 LEU CD2 C 4.900 -0.510 -3.126 1.00 . A A . 22 LEU CD2 1 1 2 1210 1 1 22 LEU CG C 3.730 -0.477 -4.095 1.00 . A A . 22 LEU CG 1 1 2 1211 1 1 22 LEU H H 3.402 2.507 -3.149 1.00 . A A . 22 LEU H 1 1 2 1212 1 1 22 LEU HA H 2.907 2.277 -6.045 1.00 . A A . 22 LEU HA 1 1 2 1213 1 1 22 LEU HB2 H 3.852 0.161 -6.124 1.00 . A A . 22 LEU HB2 1 1 2 1214 1 1 22 LEU HB3 H 4.933 1.008 -5.035 1.00 . A A . 22 LEU HB3 1 1 2 1215 1 1 22 LEU HD11 H 3.138 -2.530 -4.057 1.00 . A A . 22 LEU HD11 1 1 2 1216 1 1 22 LEU HD12 H 2.881 -1.728 -5.607 1.00 . A A . 22 LEU HD12 1 1 2 1217 1 1 22 LEU HD13 H 4.511 -2.188 -5.111 1.00 . A A . 22 LEU HD13 1 1 2 1218 1 1 22 LEU HD21 H 4.854 -1.415 -2.538 1.00 . A A . 22 LEU HD21 1 1 2 1219 1 1 22 LEU HD22 H 5.828 -0.488 -3.679 1.00 . A A . 22 LEU HD22 1 1 2 1220 1 1 22 LEU HD23 H 4.850 0.348 -2.471 1.00 . A A . 22 LEU HD23 1 1 2 1221 1 1 22 LEU HG H 2.833 -0.262 -3.533 1.00 . A A . 22 LEU HG 1 1 2 1222 1 1 22 LEU N N 3.381 2.766 -4.099 1.00 . A A . 22 LEU N 1 1 2 1223 1 1 22 LEU O O 1.131 1.431 -3.566 1.00 . A A . 22 LEU O 1 1 2 1224 1 1 23 CYS C C -0.777 -1.041 -5.889 1.00 . A A . 23 CYS C 1 1 2 1225 1 1 23 CYS CA C -0.578 0.408 -5.465 1.00 . A A . 23 CYS CA 1 1 2 1226 1 1 23 CYS CB C -1.538 1.320 -6.232 1.00 . A A . 23 CYS CB 1 1 2 1227 1 1 23 CYS H H 1.161 0.806 -6.609 1.00 . A A . 23 CYS H 1 1 2 1228 1 1 23 CYS HA H -0.781 0.495 -4.408 1.00 . A A . 23 CYS HA 1 1 2 1229 1 1 23 CYS HB2 H -1.990 0.761 -7.038 1.00 . A A . 23 CYS HB2 1 1 2 1230 1 1 23 CYS HB3 H -2.312 1.664 -5.559 1.00 . A A . 23 CYS HB3 1 1 2 1231 1 1 23 CYS HG H 0.411 2.377 -7.482 1.00 . A A . 23 CYS HG 1 1 2 1232 1 1 23 CYS N N 0.798 0.832 -5.697 1.00 . A A . 23 CYS N 1 1 2 1233 1 1 23 CYS O O -0.040 -1.550 -6.741 1.00 . A A . 23 CYS O 1 1 2 1234 1 1 23 CYS SG S -0.739 2.774 -6.950 1.00 . A A . 23 CYS SG 1 1 2 1235 1 1 24 CYS C C -2.709 -3.312 -6.871 1.00 . A A . 24 CYS C 1 1 2 1236 1 1 24 CYS CA C -1.985 -3.117 -5.542 1.00 . A A . 24 CYS CA 1 1 2 1237 1 1 24 CYS CB C -2.809 -3.727 -4.413 1.00 . A A . 24 CYS CB 1 1 2 1238 1 1 24 CYS H H -2.261 -1.274 -4.557 1.00 . A A . 24 CYS H 1 1 2 1239 1 1 24 CYS HA H -1.031 -3.620 -5.588 1.00 . A A . 24 CYS HA 1 1 2 1240 1 1 24 CYS HB2 H -3.652 -4.252 -4.838 1.00 . A A . 24 CYS HB2 1 1 2 1241 1 1 24 CYS HB3 H -2.195 -4.427 -3.869 1.00 . A A . 24 CYS HB3 1 1 2 1242 1 1 24 CYS N N -1.736 -1.716 -5.263 1.00 . A A . 24 CYS N 1 1 2 1243 1 1 24 CYS O O -2.862 -2.381 -7.666 1.00 . A A . 24 CYS O 1 1 2 1244 1 1 24 CYS SG S -3.460 -2.515 -3.217 1.00 . A A . 24 CYS SG 1 1 2 1245 1 1 25 ASP C C -5.327 -4.712 -8.215 1.00 . A A . 25 ASP C 1 1 2 1246 1 1 25 ASP CA C -3.822 -4.898 -8.343 1.00 . A A . 25 ASP CA 1 1 2 1247 1 1 25 ASP CB C -3.520 -6.356 -8.700 1.00 . A A . 25 ASP CB 1 1 2 1248 1 1 25 ASP CG C -4.063 -6.750 -10.057 1.00 . A A . 25 ASP CG 1 1 2 1249 1 1 25 ASP H H -2.968 -5.235 -6.437 1.00 . A A . 25 ASP H 1 1 2 1250 1 1 25 ASP HA H -3.450 -4.257 -9.129 1.00 . A A . 25 ASP HA 1 1 2 1251 1 1 25 ASP HB2 H -2.452 -6.507 -8.703 1.00 . A A . 25 ASP HB2 1 1 2 1252 1 1 25 ASP HB3 H -3.965 -7.000 -7.956 1.00 . A A . 25 ASP HB3 1 1 2 1253 1 1 25 ASP N N -3.140 -4.541 -7.105 1.00 . A A . 25 ASP N 1 1 2 1254 1 1 25 ASP O O -6.034 -4.552 -9.211 1.00 . A A . 25 ASP O 1 1 2 1255 1 1 25 ASP OD1 O -3.806 -6.023 -11.038 1.00 . A A . 25 ASP OD1 1 1 2 1256 1 1 25 ASP OD2 O -4.741 -7.794 -10.149 1.00 . A A . 25 ASP OD2 1 1 2 1257 1 1 26 THR C C -7.751 -3.524 -6.238 1.00 . A A . 26 THR C 1 1 2 1258 1 1 26 THR CA C -7.259 -4.862 -6.775 1.00 . A A . 26 THR CA 1 1 2 1259 1 1 26 THR CB C -7.636 -5.975 -5.778 1.00 . A A . 26 THR CB 1 1 2 1260 1 1 26 THR CG2 C -7.633 -7.332 -6.464 1.00 . A A . 26 THR CG2 1 1 2 1261 1 1 26 THR H H -5.227 -5.076 -6.258 1.00 . A A . 26 THR H 1 1 2 1262 1 1 26 THR HA H -7.749 -5.070 -7.714 1.00 . A A . 26 THR HA 1 1 2 1263 1 1 26 THR HB H -8.627 -5.780 -5.394 1.00 . A A . 26 THR HB 1 1 2 1264 1 1 26 THR HG1 H -6.998 -5.385 -3.990 1.00 . A A . 26 THR HG1 1 1 2 1265 1 1 26 THR HG21 H -7.125 -8.052 -5.838 1.00 . A A . 26 THR HG21 1 1 2 1266 1 1 26 THR HG22 H -7.119 -7.253 -7.411 1.00 . A A . 26 THR HG22 1 1 2 1267 1 1 26 THR HG23 H -8.649 -7.654 -6.631 1.00 . A A . 26 THR HG23 1 1 2 1268 1 1 26 THR N N -5.828 -4.862 -7.003 1.00 . A A . 26 THR N 1 1 2 1269 1 1 26 THR O O -8.700 -2.936 -6.768 1.00 . A A . 26 THR O 1 1 2 1270 1 1 26 THR OG1 O -6.698 -5.992 -4.689 1.00 . A A . 26 THR OG1 1 1 2 1271 1 1 27 CYS C C -6.947 -0.707 -4.759 1.00 . A A . 27 CYS C 1 1 2 1272 1 1 27 CYS CA C -7.675 -1.988 -4.361 1.00 . A A . 27 CYS CA 1 1 2 1273 1 1 27 CYS CB C -7.473 -2.285 -2.885 1.00 . A A . 27 CYS CB 1 1 2 1274 1 1 27 CYS H H -6.532 -3.716 -4.679 1.00 . A A . 27 CYS H 1 1 2 1275 1 1 27 CYS HA H -8.729 -1.872 -4.558 1.00 . A A . 27 CYS HA 1 1 2 1276 1 1 27 CYS HB2 H -6.769 -1.577 -2.468 1.00 . A A . 27 CYS HB2 1 1 2 1277 1 1 27 CYS HB3 H -8.418 -2.199 -2.370 1.00 . A A . 27 CYS HB3 1 1 2 1278 1 1 27 CYS N N -7.200 -3.138 -5.102 1.00 . A A . 27 CYS N 1 1 2 1279 1 1 27 CYS O O -5.838 -0.744 -5.287 1.00 . A A . 27 CYS O 1 1 2 1280 1 1 27 CYS SG S -6.826 -3.962 -2.594 1.00 . A A . 27 CYS SG 1 1 2 1281 1 1 28 PRO C C -6.194 2.322 -3.708 1.00 . A A . 28 PRO C 1 1 2 1282 1 1 28 PRO CA C -7.026 1.753 -4.856 1.00 . A A . 28 PRO CA 1 1 2 1283 1 1 28 PRO CB C -8.270 2.623 -5.099 1.00 . A A . 28 PRO CB 1 1 2 1284 1 1 28 PRO CD C -8.926 0.594 -3.969 1.00 . A A . 28 PRO CD 1 1 2 1285 1 1 28 PRO CG C -9.456 1.788 -4.710 1.00 . A A . 28 PRO CG 1 1 2 1286 1 1 28 PRO HA H -6.427 1.716 -5.754 1.00 . A A . 28 PRO HA 1 1 2 1287 1 1 28 PRO HB2 H -8.205 3.514 -4.493 1.00 . A A . 28 PRO HB2 1 1 2 1288 1 1 28 PRO HB3 H -8.315 2.900 -6.142 1.00 . A A . 28 PRO HB3 1 1 2 1289 1 1 28 PRO HD2 H -8.883 0.792 -2.907 1.00 . A A . 28 PRO HD2 1 1 2 1290 1 1 28 PRO HD3 H -9.527 -0.279 -4.172 1.00 . A A . 28 PRO HD3 1 1 2 1291 1 1 28 PRO HG2 H -10.110 2.361 -4.069 1.00 . A A . 28 PRO HG2 1 1 2 1292 1 1 28 PRO HG3 H -9.986 1.471 -5.597 1.00 . A A . 28 PRO HG3 1 1 2 1293 1 1 28 PRO N N -7.585 0.450 -4.530 1.00 . A A . 28 PRO N 1 1 2 1294 1 1 28 PRO O O -6.130 3.540 -3.514 1.00 . A A . 28 PRO O 1 1 2 1295 1 1 29 SER C C -3.287 1.997 -2.285 1.00 . A A . 29 SER C 1 1 2 1296 1 1 29 SER CA C -4.731 1.840 -1.832 1.00 . A A . 29 SER CA 1 1 2 1297 1 1 29 SER CB C -4.818 0.806 -0.708 1.00 . A A . 29 SER CB 1 1 2 1298 1 1 29 SER H H -5.650 0.478 -3.155 1.00 . A A . 29 SER H 1 1 2 1299 1 1 29 SER HA H -5.092 2.791 -1.470 1.00 . A A . 29 SER HA 1 1 2 1300 1 1 29 SER HB2 H -3.884 0.264 -0.646 1.00 . A A . 29 SER HB2 1 1 2 1301 1 1 29 SER HB3 H -5.003 1.311 0.229 1.00 . A A . 29 SER HB3 1 1 2 1302 1 1 29 SER HG H -5.613 -0.984 -0.593 1.00 . A A . 29 SER HG 1 1 2 1303 1 1 29 SER N N -5.566 1.436 -2.949 1.00 . A A . 29 SER N 1 1 2 1304 1 1 29 SER O O -2.826 1.292 -3.185 1.00 . A A . 29 SER O 1 1 2 1305 1 1 29 SER OG O -5.868 -0.118 -0.942 1.00 . A A . 29 SER OG 1 1 2 1306 1 1 30 SER C C -0.314 2.748 -0.753 1.00 . A A . 30 SER C 1 1 2 1307 1 1 30 SER CA C -1.173 3.119 -1.955 1.00 . A A . 30 SER CA 1 1 2 1308 1 1 30 SER CB C -0.941 4.574 -2.364 1.00 . A A . 30 SER CB 1 1 2 1309 1 1 30 SER H H -2.984 3.417 -0.919 1.00 . A A . 30 SER H 1 1 2 1310 1 1 30 SER HA H -0.913 2.473 -2.780 1.00 . A A . 30 SER HA 1 1 2 1311 1 1 30 SER HB2 H -0.850 5.187 -1.479 1.00 . A A . 30 SER HB2 1 1 2 1312 1 1 30 SER HB3 H -0.031 4.642 -2.943 1.00 . A A . 30 SER HB3 1 1 2 1313 1 1 30 SER HG H -2.795 5.188 -2.583 1.00 . A A . 30 SER HG 1 1 2 1314 1 1 30 SER N N -2.572 2.904 -1.646 1.00 . A A . 30 SER N 1 1 2 1315 1 1 30 SER O O -0.780 2.793 0.388 1.00 . A A . 30 SER O 1 1 2 1316 1 1 30 SER OG O -2.021 5.061 -3.148 1.00 . A A . 30 SER OG 1 1 2 1317 1 1 31 TYR C C 3.186 2.244 -0.189 1.00 . A A . 31 TYR C 1 1 2 1318 1 1 31 TYR CA C 1.761 1.761 0.034 1.00 . A A . 31 TYR CA 1 1 2 1319 1 1 31 TYR CB C 1.759 0.227 0.075 1.00 . A A . 31 TYR CB 1 1 2 1320 1 1 31 TYR CD1 C -0.599 -0.652 -0.119 1.00 . A A . 31 TYR CD1 1 1 2 1321 1 1 31 TYR CD2 C 0.453 -0.720 2.021 1.00 . A A . 31 TYR CD2 1 1 2 1322 1 1 31 TYR CE1 C -1.734 -1.226 0.418 1.00 . A A . 31 TYR CE1 1 1 2 1323 1 1 31 TYR CE2 C -0.679 -1.293 2.564 1.00 . A A . 31 TYR CE2 1 1 2 1324 1 1 31 TYR CG C 0.514 -0.389 0.673 1.00 . A A . 31 TYR CG 1 1 2 1325 1 1 31 TYR CZ C -1.770 -1.543 1.758 1.00 . A A . 31 TYR CZ 1 1 2 1326 1 1 31 TYR H H 1.148 2.119 -1.957 1.00 . A A . 31 TYR H 1 1 2 1327 1 1 31 TYR HA H 1.402 2.142 0.978 1.00 . A A . 31 TYR HA 1 1 2 1328 1 1 31 TYR HB2 H 1.856 -0.148 -0.931 1.00 . A A . 31 TYR HB2 1 1 2 1329 1 1 31 TYR HB3 H 2.607 -0.107 0.657 1.00 . A A . 31 TYR HB3 1 1 2 1330 1 1 31 TYR HD1 H -0.566 -0.403 -1.170 1.00 . A A . 31 TYR HD1 1 1 2 1331 1 1 31 TYR HD2 H 1.310 -0.523 2.650 1.00 . A A . 31 TYR HD2 1 1 2 1332 1 1 31 TYR HE1 H -2.588 -1.425 -0.213 1.00 . A A . 31 TYR HE1 1 1 2 1333 1 1 31 TYR HE2 H -0.704 -1.545 3.613 1.00 . A A . 31 TYR HE2 1 1 2 1334 1 1 31 TYR HH H -3.527 -2.323 1.576 1.00 . A A . 31 TYR HH 1 1 2 1335 1 1 31 TYR N N 0.881 2.247 -1.017 1.00 . A A . 31 TYR N 1 1 2 1336 1 1 31 TYR O O 3.588 2.511 -1.322 1.00 . A A . 31 TYR O 1 1 2 1337 1 1 31 TYR OH O -2.902 -2.109 2.296 1.00 . A A . 31 TYR OH 1 1 2 1338 1 1 32 HIS C C 6.013 0.890 0.552 1.00 . A A . 32 HIS C 1 1 2 1339 1 1 32 HIS CA C 5.424 2.283 0.735 1.00 . A A . 32 HIS CA 1 1 2 1340 1 1 32 HIS CB C 6.009 2.931 2.000 1.00 . A A . 32 HIS CB 1 1 2 1341 1 1 32 HIS CD2 C 6.023 5.486 1.661 1.00 . A A . 32 HIS CD2 1 1 2 1342 1 1 32 HIS CE1 C 4.534 5.987 3.174 1.00 . A A . 32 HIS CE1 1 1 2 1343 1 1 32 HIS CG C 5.583 4.346 2.244 1.00 . A A . 32 HIS CG 1 1 2 1344 1 1 32 HIS H H 3.638 1.708 1.672 1.00 . A A . 32 HIS H 1 1 2 1345 1 1 32 HIS HA H 5.641 2.891 -0.131 1.00 . A A . 32 HIS HA 1 1 2 1346 1 1 32 HIS HB2 H 5.710 2.351 2.859 1.00 . A A . 32 HIS HB2 1 1 2 1347 1 1 32 HIS HB3 H 7.084 2.918 1.931 1.00 . A A . 32 HIS HB3 1 1 2 1348 1 1 32 HIS HD2 H 6.764 5.565 0.877 1.00 . A A . 32 HIS HD2 1 1 2 1349 1 1 32 HIS HE1 H 3.869 6.555 3.807 1.00 . A A . 32 HIS HE1 1 1 2 1350 1 1 32 HIS HE2 H 5.288 7.445 1.893 1.00 . A A . 32 HIS HE2 1 1 2 1351 1 1 32 HIS N N 3.989 2.124 0.852 1.00 . A A . 32 HIS N 1 1 2 1352 1 1 32 HIS ND1 N 4.643 4.673 3.198 1.00 . A A . 32 HIS ND1 1 1 2 1353 1 1 32 HIS NE2 N 5.354 6.527 2.256 1.00 . A A . 32 HIS NE2 1 1 2 1354 1 1 32 HIS O O 5.271 -0.068 0.334 1.00 . A A . 32 HIS O 1 1 2 1355 1 1 33 ILE C C 8.301 -1.067 2.092 1.00 . A A . 33 ILE C 1 1 2 1356 1 1 33 ILE CA C 7.903 -0.586 0.698 1.00 . A A . 33 ILE CA 1 1 2 1357 1 1 33 ILE CB C 9.115 -0.641 -0.260 1.00 . A A . 33 ILE CB 1 1 2 1358 1 1 33 ILE CD1 C 11.193 0.633 -1.013 1.00 . A A . 33 ILE CD1 1 1 2 1359 1 1 33 ILE CG1 C 10.109 0.489 0.036 1.00 . A A . 33 ILE CG1 1 1 2 1360 1 1 33 ILE CG2 C 8.630 -0.561 -1.700 1.00 . A A . 33 ILE CG2 1 1 2 1361 1 1 33 ILE H H 7.863 1.515 0.990 1.00 . A A . 33 ILE H 1 1 2 1362 1 1 33 ILE HA H 7.150 -1.258 0.315 1.00 . A A . 33 ILE HA 1 1 2 1363 1 1 33 ILE HB H 9.610 -1.592 -0.123 1.00 . A A . 33 ILE HB 1 1 2 1364 1 1 33 ILE HD11 H 12.152 0.402 -0.574 1.00 . A A . 33 ILE HD11 1 1 2 1365 1 1 33 ILE HD12 H 10.995 -0.049 -1.829 1.00 . A A . 33 ILE HD12 1 1 2 1366 1 1 33 ILE HD13 H 11.200 1.646 -1.387 1.00 . A A . 33 ILE HD13 1 1 2 1367 1 1 33 ILE HG12 H 9.572 1.424 0.088 1.00 . A A . 33 ILE HG12 1 1 2 1368 1 1 33 ILE HG21 H 7.716 0.015 -1.736 1.00 . A A . 33 ILE HG21 1 1 2 1369 1 1 33 ILE HG22 H 9.381 -0.081 -2.308 1.00 . A A . 33 ILE HG22 1 1 2 1370 1 1 33 ILE HG23 H 8.444 -1.556 -2.075 1.00 . A A . 33 ILE HG23 1 1 2 1371 1 1 33 ILE N N 7.308 0.740 0.752 1.00 . A A . 33 ILE N 1 1 2 1372 1 1 33 ILE O O 9.119 -1.974 2.238 1.00 . A A . 33 ILE O 1 1 2 1373 1 1 34 HIS C C 6.763 -0.774 5.414 1.00 . A A . 34 HIS C 1 1 2 1374 1 1 34 HIS CA C 7.994 -0.856 4.502 1.00 . A A . 34 HIS CA 1 1 2 1375 1 1 34 HIS CB C 9.118 0.028 5.067 1.00 . A A . 34 HIS CB 1 1 2 1376 1 1 34 HIS CD2 C 8.781 2.441 4.224 1.00 . A A . 34 HIS CD2 1 1 2 1377 1 1 34 HIS CE1 C 8.093 3.308 6.096 1.00 . A A . 34 HIS CE1 1 1 2 1378 1 1 34 HIS CG C 8.760 1.482 5.176 1.00 . A A . 34 HIS CG 1 1 2 1379 1 1 34 HIS H H 7.042 0.235 2.948 1.00 . A A . 34 HIS H 1 1 2 1380 1 1 34 HIS HA H 8.339 -1.879 4.487 1.00 . A A . 34 HIS HA 1 1 2 1381 1 1 34 HIS HB2 H 9.380 -0.322 6.053 1.00 . A A . 34 HIS HB2 1 1 2 1382 1 1 34 HIS HB3 H 9.981 -0.052 4.422 1.00 . A A . 34 HIS HB3 1 1 2 1383 1 1 34 HIS HD2 H 9.076 2.319 3.194 1.00 . A A . 34 HIS HD2 1 1 2 1384 1 1 34 HIS HE1 H 7.741 4.023 6.824 1.00 . A A . 34 HIS HE1 1 1 2 1385 1 1 34 HIS HE2 H 8.488 4.510 4.449 1.00 . A A . 34 HIS HE2 1 1 2 1386 1 1 34 HIS N N 7.693 -0.476 3.121 1.00 . A A . 34 HIS N 1 1 2 1387 1 1 34 HIS ND1 N 8.326 2.032 6.357 1.00 . A A . 34 HIS ND1 1 1 2 1388 1 1 34 HIS NE2 N 8.355 3.602 4.816 1.00 . A A . 34 HIS NE2 1 1 2 1389 1 1 34 HIS O O 6.894 -0.814 6.639 1.00 . A A . 34 HIS O 1 1 2 1390 1 1 35 CYS C C 3.897 -1.908 6.112 1.00 . A A . 35 CYS C 1 1 2 1391 1 1 35 CYS CA C 4.356 -0.536 5.622 1.00 . A A . 35 CYS CA 1 1 2 1392 1 1 35 CYS CB C 3.250 0.109 4.795 1.00 . A A . 35 CYS CB 1 1 2 1393 1 1 35 CYS H H 5.515 -0.587 3.856 1.00 . A A . 35 CYS H 1 1 2 1394 1 1 35 CYS HA H 4.567 0.089 6.476 1.00 . A A . 35 CYS HA 1 1 2 1395 1 1 35 CYS HB2 H 2.690 -0.663 4.288 1.00 . A A . 35 CYS HB2 1 1 2 1396 1 1 35 CYS HB3 H 2.590 0.654 5.453 1.00 . A A . 35 CYS HB3 1 1 2 1397 1 1 35 CYS N N 5.575 -0.642 4.831 1.00 . A A . 35 CYS N 1 1 2 1398 1 1 35 CYS O O 3.154 -2.016 7.088 1.00 . A A . 35 CYS O 1 1 2 1399 1 1 35 CYS SG S 3.858 1.266 3.537 1.00 . A A . 35 CYS SG 1 1 2 1400 1 1 36 LEU C C 4.961 -4.983 6.575 1.00 . A A . 36 LEU C 1 1 2 1401 1 1 36 LEU CA C 3.895 -4.303 5.725 1.00 . A A . 36 LEU CA 1 1 2 1402 1 1 36 LEU CB C 3.641 -5.115 4.450 1.00 . A A . 36 LEU CB 1 1 2 1403 1 1 36 LEU CD1 C 4.094 -5.188 1.989 1.00 . A A . 36 LEU CD1 1 1 2 1404 1 1 36 LEU CD2 C 2.278 -3.723 2.873 1.00 . A A . 36 LEU CD2 1 1 2 1405 1 1 36 LEU CG C 3.652 -4.313 3.147 1.00 . A A . 36 LEU CG 1 1 2 1406 1 1 36 LEU H H 4.869 -2.790 4.616 1.00 . A A . 36 LEU H 1 1 2 1407 1 1 36 LEU HA H 2.979 -4.245 6.294 1.00 . A A . 36 LEU HA 1 1 2 1408 1 1 36 LEU HB2 H 4.399 -5.881 4.381 1.00 . A A . 36 LEU HB2 1 1 2 1409 1 1 36 LEU HB3 H 2.678 -5.595 4.542 1.00 . A A . 36 LEU HB3 1 1 2 1410 1 1 36 LEU HD11 H 3.308 -5.222 1.248 1.00 . A A . 36 LEU HD11 1 1 2 1411 1 1 36 LEU HD12 H 4.991 -4.779 1.547 1.00 . A A . 36 LEU HD12 1 1 2 1412 1 1 36 LEU HD13 H 4.292 -6.187 2.348 1.00 . A A . 36 LEU HD13 1 1 2 1413 1 1 36 LEU HD21 H 2.079 -3.751 1.812 1.00 . A A . 36 LEU HD21 1 1 2 1414 1 1 36 LEU HD22 H 1.529 -4.299 3.395 1.00 . A A . 36 LEU HD22 1 1 2 1415 1 1 36 LEU HD23 H 2.248 -2.699 3.218 1.00 . A A . 36 LEU HD23 1 1 2 1416 1 1 36 LEU HG H 4.355 -3.497 3.239 1.00 . A A . 36 LEU HG 1 1 2 1417 1 1 36 LEU N N 4.300 -2.943 5.395 1.00 . A A . 36 LEU N 1 1 2 1418 1 1 36 LEU O O 5.992 -4.384 6.885 1.00 . A A . 36 LEU O 1 1 2 1419 1 1 37 ARG C C 6.965 -7.275 6.922 1.00 . A A . 37 ARG C 1 1 2 1420 1 1 37 ARG CA C 5.680 -7.001 7.720 1.00 . A A . 37 ARG CA 1 1 2 1421 1 1 37 ARG CB C 5.059 -8.309 8.221 1.00 . A A . 37 ARG CB 1 1 2 1422 1 1 37 ARG CD C 4.998 -7.839 10.692 1.00 . A A . 37 ARG CD 1 1 2 1423 1 1 37 ARG CG C 4.175 -8.134 9.446 1.00 . A A . 37 ARG CG 1 1 2 1424 1 1 37 ARG CZ C 4.096 -5.855 11.850 1.00 . A A . 37 ARG CZ 1 1 2 1425 1 1 37 ARG H H 3.890 -6.676 6.632 1.00 . A A . 37 ARG H 1 1 2 1426 1 1 37 ARG HA H 5.939 -6.394 8.576 1.00 . A A . 37 ARG HA 1 1 2 1427 1 1 37 ARG HB2 H 4.463 -8.736 7.430 1.00 . A A . 37 ARG HB2 1 1 2 1428 1 1 37 ARG HB3 H 5.852 -8.996 8.473 1.00 . A A . 37 ARG HB3 1 1 2 1429 1 1 37 ARG HD2 H 4.590 -8.401 11.518 1.00 . A A . 37 ARG HD2 1 1 2 1430 1 1 37 ARG HD3 H 6.016 -8.149 10.515 1.00 . A A . 37 ARG HD3 1 1 2 1431 1 1 37 ARG HE H 5.688 -5.854 10.637 1.00 . A A . 37 ARG HE 1 1 2 1432 1 1 37 ARG HG2 H 3.492 -7.317 9.273 1.00 . A A . 37 ARG HG2 1 1 2 1433 1 1 37 ARG HG3 H 3.616 -9.046 9.604 1.00 . A A . 37 ARG HG3 1 1 2 1434 1 1 37 ARG HH11 H 3.137 -7.588 12.296 1.00 . A A . 37 ARG HH11 1 1 2 1435 1 1 37 ARG HH12 H 2.501 -6.160 13.068 1.00 . A A . 37 ARG HH12 1 1 2 1436 1 1 37 ARG HH21 H 4.851 -3.984 11.640 1.00 . A A . 37 ARG HH21 1 1 2 1437 1 1 37 ARG HH22 H 3.466 -4.118 12.681 1.00 . A A . 37 ARG HH22 1 1 2 1438 1 1 37 ARG N N 4.722 -6.240 6.929 1.00 . A A . 37 ARG N 1 1 2 1439 1 1 37 ARG NE N 4.989 -6.418 11.038 1.00 . A A . 37 ARG NE 1 1 2 1440 1 1 37 ARG NH1 N 3.171 -6.593 12.450 1.00 . A A . 37 ARG NH1 1 1 2 1441 1 1 37 ARG NH2 N 4.142 -4.549 12.079 1.00 . A A . 37 ARG NH2 1 1 2 1442 1 1 37 ARG O O 8.050 -6.890 7.361 1.00 . A A . 37 ARG O 1 1 2 1443 1 1 38 PRO C C 8.494 -6.864 4.176 1.00 . A A . 38 PRO C 1 1 2 1444 1 1 38 PRO CA C 8.048 -8.137 4.883 1.00 . A A . 38 PRO CA 1 1 2 1445 1 1 38 PRO CB C 7.570 -9.184 3.865 1.00 . A A . 38 PRO CB 1 1 2 1446 1 1 38 PRO CD C 5.663 -8.387 5.068 1.00 . A A . 38 PRO CD 1 1 2 1447 1 1 38 PRO CG C 6.179 -9.548 4.272 1.00 . A A . 38 PRO CG 1 1 2 1448 1 1 38 PRO HA H 8.870 -8.536 5.458 1.00 . A A . 38 PRO HA 1 1 2 1449 1 1 38 PRO HB2 H 7.590 -8.754 2.874 1.00 . A A . 38 PRO HB2 1 1 2 1450 1 1 38 PRO HB3 H 8.224 -10.042 3.899 1.00 . A A . 38 PRO HB3 1 1 2 1451 1 1 38 PRO HD2 H 5.240 -7.636 4.415 1.00 . A A . 38 PRO HD2 1 1 2 1452 1 1 38 PRO HD3 H 4.937 -8.717 5.794 1.00 . A A . 38 PRO HD3 1 1 2 1453 1 1 38 PRO HG2 H 5.569 -9.702 3.394 1.00 . A A . 38 PRO HG2 1 1 2 1454 1 1 38 PRO HG3 H 6.198 -10.439 4.878 1.00 . A A . 38 PRO HG3 1 1 2 1455 1 1 38 PRO N N 6.878 -7.895 5.723 1.00 . A A . 38 PRO N 1 1 2 1456 1 1 38 PRO O O 7.861 -6.422 3.211 1.00 . A A . 38 PRO O 1 1 2 1457 1 1 39 ALA C C 10.691 -5.236 2.779 1.00 . A A . 39 ALA C 1 1 2 1458 1 1 39 ALA CA C 10.047 -5.002 4.139 1.00 . A A . 39 ALA CA 1 1 2 1459 1 1 39 ALA CB C 11.038 -4.352 5.090 1.00 . A A . 39 ALA CB 1 1 2 1460 1 1 39 ALA H H 9.988 -6.637 5.480 1.00 . A A . 39 ALA H 1 1 2 1461 1 1 39 ALA HA H 9.206 -4.331 4.018 1.00 . A A . 39 ALA HA 1 1 2 1462 1 1 39 ALA HB1 H 10.546 -4.129 6.027 1.00 . A A . 39 ALA HB1 1 1 2 1463 1 1 39 ALA HB2 H 11.861 -5.029 5.270 1.00 . A A . 39 ALA HB2 1 1 2 1464 1 1 39 ALA HB3 H 11.412 -3.439 4.652 1.00 . A A . 39 ALA HB3 1 1 2 1465 1 1 39 ALA N N 9.546 -6.249 4.693 1.00 . A A . 39 ALA N 1 1 2 1466 1 1 39 ALA O O 11.539 -6.119 2.623 1.00 . A A . 39 ALA O 1 1 2 1467 1 1 40 LEU C C 11.987 -3.564 0.299 1.00 . A A . 40 LEU C 1 1 2 1468 1 1 40 LEU CA C 10.825 -4.526 0.461 1.00 . A A . 40 LEU CA 1 1 2 1469 1 1 40 LEU CB C 9.742 -4.200 -0.571 1.00 . A A . 40 LEU CB 1 1 2 1470 1 1 40 LEU CD1 C 7.273 -4.254 -0.133 1.00 . A A . 40 LEU CD1 1 1 2 1471 1 1 40 LEU CD2 C 8.277 -5.787 -1.833 1.00 . A A . 40 LEU CD2 1 1 2 1472 1 1 40 LEU CG C 8.495 -5.080 -0.505 1.00 . A A . 40 LEU CG 1 1 2 1473 1 1 40 LEU H H 9.633 -3.728 2.010 1.00 . A A . 40 LEU H 1 1 2 1474 1 1 40 LEU HA H 11.177 -5.535 0.304 1.00 . A A . 40 LEU HA 1 1 2 1475 1 1 40 LEU HB2 H 9.440 -3.172 -0.428 1.00 . A A . 40 LEU HB2 1 1 2 1476 1 1 40 LEU HB3 H 10.172 -4.297 -1.556 1.00 . A A . 40 LEU HB3 1 1 2 1477 1 1 40 LEU HD11 H 6.384 -4.854 -0.253 1.00 . A A . 40 LEU HD11 1 1 2 1478 1 1 40 LEU HD12 H 7.355 -3.933 0.894 1.00 . A A . 40 LEU HD12 1 1 2 1479 1 1 40 LEU HD13 H 7.212 -3.389 -0.778 1.00 . A A . 40 LEU HD13 1 1 2 1480 1 1 40 LEU HD21 H 9.232 -5.970 -2.304 1.00 . A A . 40 LEU HD21 1 1 2 1481 1 1 40 LEU HD22 H 7.774 -6.726 -1.661 1.00 . A A . 40 LEU HD22 1 1 2 1482 1 1 40 LEU HD23 H 7.672 -5.165 -2.475 1.00 . A A . 40 LEU HD23 1 1 2 1483 1 1 40 LEU HG H 8.632 -5.833 0.256 1.00 . A A . 40 LEU HG 1 1 2 1484 1 1 40 LEU N N 10.289 -4.434 1.807 1.00 . A A . 40 LEU N 1 1 2 1485 1 1 40 LEU O O 11.930 -2.426 0.763 1.00 . A A . 40 LEU O 1 1 2 1486 1 1 41 TYR C C 14.133 -2.612 -2.037 1.00 . A A . 41 TYR C 1 1 2 1487 1 1 41 TYR CA C 14.185 -3.167 -0.622 1.00 . A A . 41 TYR CA 1 1 2 1488 1 1 41 TYR CB C 15.472 -3.959 -0.395 1.00 . A A . 41 TYR CB 1 1 2 1489 1 1 41 TYR CD1 C 16.122 -3.251 1.938 1.00 . A A . 41 TYR CD1 1 1 2 1490 1 1 41 TYR CD2 C 15.578 -5.542 1.573 1.00 . A A . 41 TYR CD2 1 1 2 1491 1 1 41 TYR CE1 C 16.348 -3.513 3.276 1.00 . A A . 41 TYR CE1 1 1 2 1492 1 1 41 TYR CE2 C 15.804 -5.812 2.910 1.00 . A A . 41 TYR CE2 1 1 2 1493 1 1 41 TYR CG C 15.734 -4.258 1.064 1.00 . A A . 41 TYR CG 1 1 2 1494 1 1 41 TYR CZ C 16.186 -4.793 3.757 1.00 . A A . 41 TYR CZ 1 1 2 1495 1 1 41 TYR H H 13.009 -4.926 -0.746 1.00 . A A . 41 TYR H 1 1 2 1496 1 1 41 TYR HA H 14.150 -2.344 0.077 1.00 . A A . 41 TYR HA 1 1 2 1497 1 1 41 TYR HB2 H 15.405 -4.898 -0.923 1.00 . A A . 41 TYR HB2 1 1 2 1498 1 1 41 TYR HB3 H 16.310 -3.393 -0.777 1.00 . A A . 41 TYR HB3 1 1 2 1499 1 1 41 TYR HD1 H 16.248 -2.247 1.560 1.00 . A A . 41 TYR HD1 1 1 2 1500 1 1 41 TYR HD2 H 15.281 -6.339 0.909 1.00 . A A . 41 TYR HD2 1 1 2 1501 1 1 41 TYR HE1 H 16.648 -2.715 3.939 1.00 . A A . 41 TYR HE1 1 1 2 1502 1 1 41 TYR HE2 H 15.677 -6.817 3.287 1.00 . A A . 41 TYR HE2 1 1 2 1503 1 1 41 TYR HH H 17.301 -4.765 5.332 1.00 . A A . 41 TYR HH 1 1 2 1504 1 1 41 TYR N N 13.027 -4.010 -0.376 1.00 . A A . 41 TYR N 1 1 2 1505 1 1 41 TYR O O 14.964 -1.789 -2.432 1.00 . A A . 41 TYR O 1 1 2 1506 1 1 41 TYR OH O 16.405 -5.058 5.090 1.00 . A A . 41 TYR OH 1 1 2 1507 1 1 42 GLU C C 11.364 -2.519 -4.391 1.00 . A A . 42 GLU C 1 1 2 1508 1 1 42 GLU CA C 12.864 -2.544 -4.117 1.00 . A A . 42 GLU CA 1 1 2 1509 1 1 42 GLU CB C 13.570 -3.436 -5.140 1.00 . A A . 42 GLU CB 1 1 2 1510 1 1 42 GLU CD C 14.411 -5.745 -5.711 1.00 . A A . 42 GLU CD 1 1 2 1511 1 1 42 GLU CG C 13.632 -4.898 -4.733 1.00 . A A . 42 GLU CG 1 1 2 1512 1 1 42 GLU H H 12.461 -3.642 -2.365 1.00 . A A . 42 GLU H 1 1 2 1513 1 1 42 GLU HA H 13.252 -1.540 -4.190 1.00 . A A . 42 GLU HA 1 1 2 1514 1 1 42 GLU HB2 H 13.043 -3.369 -6.082 1.00 . A A . 42 GLU HB2 1 1 2 1515 1 1 42 GLU HB3 H 14.581 -3.077 -5.277 1.00 . A A . 42 GLU HB3 1 1 2 1516 1 1 42 GLU HG2 H 14.104 -4.970 -3.764 1.00 . A A . 42 GLU HG2 1 1 2 1517 1 1 42 GLU HG3 H 12.624 -5.283 -4.669 1.00 . A A . 42 GLU HG3 1 1 2 1518 1 1 42 GLU N N 13.106 -3.023 -2.766 1.00 . A A . 42 GLU N 1 1 2 1519 1 1 42 GLU O O 10.638 -3.423 -3.967 1.00 . A A . 42 GLU O 1 1 2 1520 1 1 42 GLU OE1 O 13.960 -5.896 -6.866 1.00 . A A . 42 GLU OE1 1 1 2 1521 1 1 42 GLU OE2 O 15.475 -6.273 -5.333 1.00 . A A . 42 GLU OE2 1 1 2 1522 1 1 43 VAL C C 8.951 -2.259 -6.301 1.00 . A A . 43 VAL C 1 1 2 1523 1 1 43 VAL CA C 9.473 -1.256 -5.266 1.00 . A A . 43 VAL CA 1 1 2 1524 1 1 43 VAL CB C 9.163 0.193 -5.722 1.00 . A A . 43 VAL CB 1 1 2 1525 1 1 43 VAL CG1 C 10.104 0.630 -6.834 1.00 . A A . 43 VAL CG1 1 1 2 1526 1 1 43 VAL CG2 C 7.709 0.337 -6.156 1.00 . A A . 43 VAL CG2 1 1 2 1527 1 1 43 VAL H H 11.531 -0.729 -5.261 1.00 . A A . 43 VAL H 1 1 2 1528 1 1 43 VAL HA H 8.956 -1.427 -4.334 1.00 . A A . 43 VAL HA 1 1 2 1529 1 1 43 VAL HB H 9.324 0.848 -4.878 1.00 . A A . 43 VAL HB 1 1 2 1530 1 1 43 VAL HG11 H 10.615 -0.233 -7.234 1.00 . A A . 43 VAL HG11 1 1 2 1531 1 1 43 VAL HG12 H 9.537 1.109 -7.618 1.00 . A A . 43 VAL HG12 1 1 2 1532 1 1 43 VAL HG13 H 10.829 1.325 -6.436 1.00 . A A . 43 VAL HG13 1 1 2 1533 1 1 43 VAL HG21 H 7.639 1.070 -6.947 1.00 . A A . 43 VAL HG21 1 1 2 1534 1 1 43 VAL HG22 H 7.344 -0.613 -6.514 1.00 . A A . 43 VAL HG22 1 1 2 1535 1 1 43 VAL HG23 H 7.111 0.657 -5.315 1.00 . A A . 43 VAL HG23 1 1 2 1536 1 1 43 VAL N N 10.899 -1.445 -5.013 1.00 . A A . 43 VAL N 1 1 2 1537 1 1 43 VAL O O 9.468 -2.354 -7.415 1.00 . A A . 43 VAL O 1 1 2 1538 1 1 44 PRO C C 6.304 -3.593 -7.681 1.00 . A A . 44 PRO C 1 1 2 1539 1 1 44 PRO CA C 7.402 -4.122 -6.758 1.00 . A A . 44 PRO CA 1 1 2 1540 1 1 44 PRO CB C 6.824 -5.111 -5.747 1.00 . A A . 44 PRO CB 1 1 2 1541 1 1 44 PRO CD C 7.400 -3.114 -4.541 1.00 . A A . 44 PRO CD 1 1 2 1542 1 1 44 PRO CG C 6.432 -4.268 -4.581 1.00 . A A . 44 PRO CG 1 1 2 1543 1 1 44 PRO HA H 8.164 -4.610 -7.347 1.00 . A A . 44 PRO HA 1 1 2 1544 1 1 44 PRO HB2 H 5.971 -5.614 -6.178 1.00 . A A . 44 PRO HB2 1 1 2 1545 1 1 44 PRO HB3 H 7.578 -5.836 -5.475 1.00 . A A . 44 PRO HB3 1 1 2 1546 1 1 44 PRO HD2 H 6.883 -2.194 -4.318 1.00 . A A . 44 PRO HD2 1 1 2 1547 1 1 44 PRO HD3 H 8.174 -3.298 -3.811 1.00 . A A . 44 PRO HD3 1 1 2 1548 1 1 44 PRO HG2 H 5.423 -3.906 -4.714 1.00 . A A . 44 PRO HG2 1 1 2 1549 1 1 44 PRO HG3 H 6.506 -4.846 -3.672 1.00 . A A . 44 PRO HG3 1 1 2 1550 1 1 44 PRO N N 7.968 -3.079 -5.902 1.00 . A A . 44 PRO N 1 1 2 1551 1 1 44 PRO O O 5.117 -3.639 -7.349 1.00 . A A . 44 PRO O 1 1 2 1552 1 1 45 ASP C C 5.456 -3.639 -10.885 1.00 . A A . 45 ASP C 1 1 2 1553 1 1 45 ASP CA C 5.745 -2.593 -9.818 1.00 . A A . 45 ASP CA 1 1 2 1554 1 1 45 ASP CB C 6.269 -1.311 -10.468 1.00 . A A . 45 ASP CB 1 1 2 1555 1 1 45 ASP CG C 5.213 -0.613 -11.297 1.00 . A A . 45 ASP CG 1 1 2 1556 1 1 45 ASP H H 7.658 -3.114 -9.072 1.00 . A A . 45 ASP H 1 1 2 1557 1 1 45 ASP HA H 4.828 -2.371 -9.291 1.00 . A A . 45 ASP HA 1 1 2 1558 1 1 45 ASP HB2 H 6.603 -0.634 -9.696 1.00 . A A . 45 ASP HB2 1 1 2 1559 1 1 45 ASP HB3 H 7.103 -1.556 -11.110 1.00 . A A . 45 ASP HB3 1 1 2 1560 1 1 45 ASP N N 6.700 -3.106 -8.848 1.00 . A A . 45 ASP N 1 1 2 1561 1 1 45 ASP O O 6.232 -3.817 -11.826 1.00 . A A . 45 ASP O 1 1 2 1562 1 1 45 ASP OD1 O 4.294 -0.003 -10.710 1.00 . A A . 45 ASP OD1 1 1 2 1563 1 1 45 ASP OD2 O 5.290 -0.671 -12.544 1.00 . A A . 45 ASP OD2 1 1 2 1564 1 1 46 GLY C C 2.983 -6.360 -11.075 1.00 . A A . 46 GLY C 1 1 2 1565 1 1 46 GLY CA C 4.006 -5.408 -11.649 1.00 . A A . 46 GLY CA 1 1 2 1566 1 1 46 GLY H H 3.791 -4.198 -9.923 1.00 . A A . 46 GLY H 1 1 2 1567 1 1 46 GLY HA2 H 3.605 -4.957 -12.544 1.00 . A A . 46 GLY HA2 1 1 2 1568 1 1 46 GLY HA3 H 4.897 -5.964 -11.904 1.00 . A A . 46 GLY HA3 1 1 2 1569 1 1 46 GLY N N 4.361 -4.363 -10.711 1.00 . A A . 46 GLY N 1 1 2 1570 1 1 46 GLY O O 1.808 -6.018 -10.952 1.00 . A A . 46 GLY O 1 1 2 1571 1 1 47 GLU C C 2.763 -8.564 -8.577 1.00 . A A . 47 GLU C 1 1 2 1572 1 1 47 GLU CA C 2.560 -8.534 -10.086 1.00 . A A . 47 GLU CA 1 1 2 1573 1 1 47 GLU CB C 2.829 -9.916 -10.683 1.00 . A A . 47 GLU CB 1 1 2 1574 1 1 47 GLU CD C 2.081 -11.451 -12.538 1.00 . A A . 47 GLU CD 1 1 2 1575 1 1 47 GLU CG C 2.445 -10.035 -12.148 1.00 . A A . 47 GLU CG 1 1 2 1576 1 1 47 GLU H H 4.388 -7.748 -10.797 1.00 . A A . 47 GLU H 1 1 2 1577 1 1 47 GLU HA H 1.540 -8.251 -10.297 1.00 . A A . 47 GLU HA 1 1 2 1578 1 1 47 GLU HB2 H 3.882 -10.137 -10.590 1.00 . A A . 47 GLU HB2 1 1 2 1579 1 1 47 GLU HB3 H 2.266 -10.651 -10.124 1.00 . A A . 47 GLU HB3 1 1 2 1580 1 1 47 GLU HG2 H 1.594 -9.395 -12.339 1.00 . A A . 47 GLU HG2 1 1 2 1581 1 1 47 GLU HG3 H 3.280 -9.714 -12.754 1.00 . A A . 47 GLU HG3 1 1 2 1582 1 1 47 GLU N N 3.434 -7.542 -10.690 1.00 . A A . 47 GLU N 1 1 2 1583 1 1 47 GLU O O 3.604 -9.302 -8.064 1.00 . A A . 47 GLU O 1 1 2 1584 1 1 47 GLU OE1 O 1.324 -12.102 -11.789 1.00 . A A . 47 GLU OE1 1 1 2 1585 1 1 47 GLU OE2 O 2.548 -11.923 -13.596 1.00 . A A . 47 GLU OE2 1 1 2 1586 1 1 48 TRP C C 0.717 -7.418 -5.826 1.00 . A A . 48 TRP C 1 1 2 1587 1 1 48 TRP CA C 2.098 -7.642 -6.428 1.00 . A A . 48 TRP CA 1 1 2 1588 1 1 48 TRP CB C 3.037 -6.496 -6.032 1.00 . A A . 48 TRP CB 1 1 2 1589 1 1 48 TRP CD1 C 4.101 -6.993 -3.752 1.00 . A A . 48 TRP CD1 1 1 2 1590 1 1 48 TRP CD2 C 2.471 -5.460 -3.684 1.00 . A A . 48 TRP CD2 1 1 2 1591 1 1 48 TRP CE2 C 2.969 -5.643 -2.381 1.00 . A A . 48 TRP CE2 1 1 2 1592 1 1 48 TRP CE3 C 1.436 -4.541 -3.888 1.00 . A A . 48 TRP CE3 1 1 2 1593 1 1 48 TRP CG C 3.209 -6.336 -4.548 1.00 . A A . 48 TRP CG 1 1 2 1594 1 1 48 TRP CH2 C 1.456 -4.045 -1.518 1.00 . A A . 48 TRP CH2 1 1 2 1595 1 1 48 TRP CZ2 C 2.469 -4.937 -1.289 1.00 . A A . 48 TRP CZ2 1 1 2 1596 1 1 48 TRP CZ3 C 0.940 -3.844 -2.802 1.00 . A A . 48 TRP CZ3 1 1 2 1597 1 1 48 TRP H H 1.355 -7.171 -8.349 1.00 . A A . 48 TRP H 1 1 2 1598 1 1 48 TRP HA H 2.497 -8.574 -6.056 1.00 . A A . 48 TRP HA 1 1 2 1599 1 1 48 TRP HB2 H 4.012 -6.676 -6.460 1.00 . A A . 48 TRP HB2 1 1 2 1600 1 1 48 TRP HB3 H 2.645 -5.569 -6.425 1.00 . A A . 48 TRP HB3 1 1 2 1601 1 1 48 TRP HD1 H 4.808 -7.728 -4.109 1.00 . A A . 48 TRP HD1 1 1 2 1602 1 1 48 TRP HE1 H 4.493 -6.910 -1.689 1.00 . A A . 48 TRP HE1 1 1 2 1603 1 1 48 TRP HE3 H 1.022 -4.373 -4.873 1.00 . A A . 48 TRP HE3 1 1 2 1604 1 1 48 TRP HH2 H 1.037 -3.480 -0.699 1.00 . A A . 48 TRP HH2 1 1 2 1605 1 1 48 TRP HZ2 H 2.858 -5.077 -0.292 1.00 . A A . 48 TRP HZ2 1 1 2 1606 1 1 48 TRP HZ3 H 0.141 -3.131 -2.940 1.00 . A A . 48 TRP HZ3 1 1 2 1607 1 1 48 TRP N N 2.004 -7.736 -7.877 1.00 . A A . 48 TRP N 1 1 2 1608 1 1 48 TRP NE1 N 3.965 -6.582 -2.449 1.00 . A A . 48 TRP NE1 1 1 2 1609 1 1 48 TRP O O -0.053 -6.584 -6.314 1.00 . A A . 48 TRP O 1 1 2 1610 1 1 49 GLN C C -0.565 -7.692 -2.553 1.00 . A A . 49 GLN C 1 1 2 1611 1 1 49 GLN CA C -0.824 -7.925 -4.031 1.00 . A A . 49 GLN CA 1 1 2 1612 1 1 49 GLN CB C -1.765 -9.108 -4.240 1.00 . A A . 49 GLN CB 1 1 2 1613 1 1 49 GLN CD C -4.150 -8.505 -4.875 1.00 . A A . 49 GLN CD 1 1 2 1614 1 1 49 GLN CG C -2.760 -8.876 -5.368 1.00 . A A . 49 GLN CG 1 1 2 1615 1 1 49 GLN H H 1.109 -8.719 -4.360 1.00 . A A . 49 GLN H 1 1 2 1616 1 1 49 GLN HA H -1.291 -7.039 -4.436 1.00 . A A . 49 GLN HA 1 1 2 1617 1 1 49 GLN HB2 H -1.180 -9.986 -4.476 1.00 . A A . 49 GLN HB2 1 1 2 1618 1 1 49 GLN HB3 H -2.316 -9.282 -3.329 1.00 . A A . 49 GLN HB3 1 1 2 1619 1 1 49 GLN HE21 H -3.520 -6.724 -4.218 1.00 . A A . 49 GLN HE21 1 1 2 1620 1 1 49 GLN HE22 H -5.202 -7.051 -4.008 1.00 . A A . 49 GLN HE22 1 1 2 1621 1 1 49 GLN HG2 H -2.395 -8.073 -5.990 1.00 . A A . 49 GLN HG2 1 1 2 1622 1 1 49 GLN HG3 H -2.832 -9.780 -5.956 1.00 . A A . 49 GLN HG3 1 1 2 1623 1 1 49 GLN N N 0.429 -8.116 -4.739 1.00 . A A . 49 GLN N 1 1 2 1624 1 1 49 GLN NE2 N -4.300 -7.309 -4.308 1.00 . A A . 49 GLN NE2 1 1 2 1625 1 1 49 GLN O O 0.566 -7.813 -2.084 1.00 . A A . 49 GLN O 1 1 2 1626 1 1 49 GLN OE1 O -5.085 -9.295 -4.993 1.00 . A A . 49 GLN OE1 1 1 2 1627 1 1 50 CYS C C -1.701 -7.715 0.518 1.00 . A A . 50 CYS C 1 1 2 1628 1 1 50 CYS CA C -1.424 -6.661 -0.541 1.00 . A A . 50 CYS CA 1 1 2 1629 1 1 50 CYS CB C -2.434 -5.552 -0.397 1.00 . A A . 50 CYS CB 1 1 2 1630 1 1 50 CYS H H -2.401 -6.960 -2.364 1.00 . A A . 50 CYS H 1 1 2 1631 1 1 50 CYS HA H -0.431 -6.261 -0.418 1.00 . A A . 50 CYS HA 1 1 2 1632 1 1 50 CYS HB2 H -2.834 -5.555 0.608 1.00 . A A . 50 CYS HB2 1 1 2 1633 1 1 50 CYS HB3 H -1.959 -4.603 -0.595 1.00 . A A . 50 CYS HB3 1 1 2 1634 1 1 50 CYS N N -1.568 -7.167 -1.885 1.00 . A A . 50 CYS N 1 1 2 1635 1 1 50 CYS O O -2.391 -8.702 0.272 1.00 . A A . 50 CYS O 1 1 2 1636 1 1 50 CYS SG S -3.816 -5.748 -1.563 1.00 . A A . 50 CYS SG 1 1 2 1637 1 1 51 PRO C C -2.542 -7.604 3.790 1.00 . A A . 51 PRO C 1 1 2 1638 1 1 51 PRO CA C -1.507 -8.287 2.889 1.00 . A A . 51 PRO CA 1 1 2 1639 1 1 51 PRO CB C -0.146 -8.323 3.575 1.00 . A A . 51 PRO CB 1 1 2 1640 1 1 51 PRO CD C -0.291 -6.394 2.099 1.00 . A A . 51 PRO CD 1 1 2 1641 1 1 51 PRO CG C 0.477 -6.989 3.263 1.00 . A A . 51 PRO CG 1 1 2 1642 1 1 51 PRO HA H -1.827 -9.283 2.627 1.00 . A A . 51 PRO HA 1 1 2 1643 1 1 51 PRO HB2 H -0.279 -8.459 4.639 1.00 . A A . 51 PRO HB2 1 1 2 1644 1 1 51 PRO HB3 H 0.443 -9.134 3.173 1.00 . A A . 51 PRO HB3 1 1 2 1645 1 1 51 PRO HD2 H -0.831 -5.512 2.409 1.00 . A A . 51 PRO HD2 1 1 2 1646 1 1 51 PRO HD3 H 0.377 -6.164 1.283 1.00 . A A . 51 PRO HD3 1 1 2 1647 1 1 51 PRO HG2 H 0.401 -6.340 4.125 1.00 . A A . 51 PRO HG2 1 1 2 1648 1 1 51 PRO HG3 H 1.513 -7.125 2.992 1.00 . A A . 51 PRO HG3 1 1 2 1649 1 1 51 PRO N N -1.214 -7.475 1.735 1.00 . A A . 51 PRO N 1 1 2 1650 1 1 51 PRO O O -2.562 -7.826 5.002 1.00 . A A . 51 PRO O 1 1 2 1651 1 1 52 ARG C C -5.469 -5.469 3.405 1.00 . A A . 52 ARG C 1 1 2 1652 1 1 52 ARG CA C -4.113 -5.765 4.050 1.00 . A A . 52 ARG CA 1 1 2 1653 1 1 52 ARG CB C -3.397 -4.457 4.374 1.00 . A A . 52 ARG CB 1 1 2 1654 1 1 52 ARG CD C -2.005 -4.517 6.465 1.00 . A A . 52 ARG CD 1 1 2 1655 1 1 52 ARG CG C -3.350 -4.146 5.861 1.00 . A A . 52 ARG CG 1 1 2 1656 1 1 52 ARG CZ C -1.747 -6.139 8.311 1.00 . A A . 52 ARG CZ 1 1 2 1657 1 1 52 ARG H H -3.105 -6.390 2.290 1.00 . A A . 52 ARG H 1 1 2 1658 1 1 52 ARG HA H -4.292 -6.289 4.975 1.00 . A A . 52 ARG HA 1 1 2 1659 1 1 52 ARG HB2 H -2.381 -4.515 4.009 1.00 . A A . 52 ARG HB2 1 1 2 1660 1 1 52 ARG HB3 H -3.906 -3.647 3.873 1.00 . A A . 52 ARG HB3 1 1 2 1661 1 1 52 ARG HD2 H -1.252 -4.458 5.692 1.00 . A A . 52 ARG HD2 1 1 2 1662 1 1 52 ARG HD3 H -1.771 -3.810 7.247 1.00 . A A . 52 ARG HD3 1 1 2 1663 1 1 52 ARG HE H -2.195 -6.615 6.413 1.00 . A A . 52 ARG HE 1 1 2 1664 1 1 52 ARG HG2 H -3.519 -3.090 6.004 1.00 . A A . 52 ARG HG2 1 1 2 1665 1 1 52 ARG HG3 H -4.127 -4.708 6.360 1.00 . A A . 52 ARG HG3 1 1 2 1666 1 1 52 ARG HH11 H -1.487 -4.200 8.850 1.00 . A A . 52 ARG HH11 1 1 2 1667 1 1 52 ARG HH12 H -1.310 -5.359 10.132 1.00 . A A . 52 ARG HH12 1 1 2 1668 1 1 52 ARG HH21 H -1.933 -8.156 8.097 1.00 . A A . 52 ARG HH21 1 1 2 1669 1 1 52 ARG HH22 H -1.531 -7.603 9.697 1.00 . A A . 52 ARG HH22 1 1 2 1670 1 1 52 ARG N N -3.257 -6.619 3.232 1.00 . A A . 52 ARG N 1 1 2 1671 1 1 52 ARG NE N -2.004 -5.869 7.028 1.00 . A A . 52 ARG NE 1 1 2 1672 1 1 52 ARG NH1 N -1.493 -5.155 9.164 1.00 . A A . 52 ARG NH1 1 1 2 1673 1 1 52 ARG NH2 N -1.742 -7.397 8.738 1.00 . A A . 52 ARG NH2 1 1 2 1674 1 1 52 ARG O O -6.499 -5.863 3.950 1.00 . A A . 52 ARG O 1 1 2 1675 1 1 53 CYS C C -7.518 -5.351 1.085 1.00 . A A . 53 CYS C 1 1 2 1676 1 1 53 CYS CA C -6.761 -4.218 1.770 1.00 . A A . 53 CYS CA 1 1 2 1677 1 1 53 CYS CB C -6.537 -3.066 0.792 1.00 . A A . 53 CYS CB 1 1 2 1678 1 1 53 CYS H H -4.661 -4.316 1.958 1.00 . A A . 53 CYS H 1 1 2 1679 1 1 53 CYS HA H -7.363 -3.856 2.592 1.00 . A A . 53 CYS HA 1 1 2 1680 1 1 53 CYS HB2 H -7.105 -3.263 -0.106 1.00 . A A . 53 CYS HB2 1 1 2 1681 1 1 53 CYS HB3 H -6.888 -2.153 1.240 1.00 . A A . 53 CYS HB3 1 1 2 1682 1 1 53 CYS N N -5.494 -4.674 2.328 1.00 . A A . 53 CYS N 1 1 2 1683 1 1 53 CYS O O -8.719 -5.245 0.824 1.00 . A A . 53 CYS O 1 1 2 1684 1 1 53 CYS SG S -4.817 -2.801 0.274 1.00 . A A . 53 CYS SG 1 1 2 1685 1 1 54 THR C C -8.196 -8.417 1.151 1.00 . A A . 54 THR C 1 1 2 1686 1 1 54 THR CA C -7.413 -7.572 0.150 1.00 . A A . 54 THR CA 1 1 2 1687 1 1 54 THR CB C -6.324 -8.415 -0.513 1.00 . A A . 54 THR CB 1 1 2 1688 1 1 54 THR CG2 C -6.364 -8.234 -2.016 1.00 . A A . 54 THR CG2 1 1 2 1689 1 1 54 THR H H -5.861 -6.446 1.015 1.00 . A A . 54 THR H 1 1 2 1690 1 1 54 THR HA H -8.085 -7.214 -0.617 1.00 . A A . 54 THR HA 1 1 2 1691 1 1 54 THR HB H -6.490 -9.454 -0.278 1.00 . A A . 54 THR HB 1 1 2 1692 1 1 54 THR HG1 H -4.637 -7.371 -0.632 1.00 . A A . 54 THR HG1 1 1 2 1693 1 1 54 THR HG21 H -6.287 -7.182 -2.248 1.00 . A A . 54 THR HG21 1 1 2 1694 1 1 54 THR HG22 H -7.293 -8.624 -2.402 1.00 . A A . 54 THR HG22 1 1 2 1695 1 1 54 THR HG23 H -5.535 -8.762 -2.463 1.00 . A A . 54 THR HG23 1 1 2 1696 1 1 54 THR N N -6.816 -6.424 0.797 1.00 . A A . 54 THR N 1 1 2 1697 1 1 54 THR O O -7.618 -9.137 1.967 1.00 . A A . 54 THR O 1 1 2 1698 1 1 54 THR OG1 O -5.040 -8.006 -0.012 1.00 . A A . 54 THR OG1 1 1 2 1699 1 1 55 CYS C C -11.412 -9.790 1.304 1.00 . A A . 55 CYS C 1 1 2 1700 1 1 55 CYS CA C -10.377 -8.971 2.069 1.00 . A A . 55 CYS CA 1 1 2 1701 1 1 55 CYS CB C -11.073 -7.972 3.000 1.00 . A A . 55 CYS CB 1 1 2 1702 1 1 55 CYS H H -9.913 -7.644 0.490 1.00 . A A . 55 CYS H 1 1 2 1703 1 1 55 CYS HA H -9.764 -9.637 2.657 1.00 . A A . 55 CYS HA 1 1 2 1704 1 1 55 CYS HB2 H -12.035 -7.716 2.584 1.00 . A A . 55 CYS HB2 1 1 2 1705 1 1 55 CYS HB3 H -11.214 -8.432 3.968 1.00 . A A . 55 CYS HB3 1 1 2 1706 1 1 55 CYS HG H -9.633 -6.077 2.079 1.00 . A A . 55 CYS HG 1 1 2 1707 1 1 55 CYS N N -9.511 -8.265 1.135 1.00 . A A . 55 CYS N 1 1 2 1708 1 1 55 CYS O O -11.736 -9.474 0.160 1.00 . A A . 55 CYS O 1 1 2 1709 1 1 55 CYS SG S -10.159 -6.431 3.248 1.00 . A A . 55 CYS SG 1 1 2 1710 1 1 56 PRO C C -14.261 -11.090 1.108 1.00 . A A . 56 PRO C 1 1 2 1711 1 1 56 PRO CA C -12.891 -11.755 1.235 1.00 . A A . 56 PRO CA 1 1 2 1712 1 1 56 PRO CB C -12.966 -12.975 2.160 1.00 . A A . 56 PRO CB 1 1 2 1713 1 1 56 PRO CD C -11.522 -11.392 3.223 1.00 . A A . 56 PRO CD 1 1 2 1714 1 1 56 PRO CG C -12.529 -12.474 3.494 1.00 . A A . 56 PRO CG 1 1 2 1715 1 1 56 PRO HA H -12.550 -12.063 0.257 1.00 . A A . 56 PRO HA 1 1 2 1716 1 1 56 PRO HB2 H -13.982 -13.346 2.189 1.00 . A A . 56 PRO HB2 1 1 2 1717 1 1 56 PRO HB3 H -12.307 -13.750 1.793 1.00 . A A . 56 PRO HB3 1 1 2 1718 1 1 56 PRO HD2 H -11.594 -10.615 3.970 1.00 . A A . 56 PRO HD2 1 1 2 1719 1 1 56 PRO HD3 H -10.523 -11.802 3.198 1.00 . A A . 56 PRO HD3 1 1 2 1720 1 1 56 PRO HG2 H -13.377 -12.072 4.029 1.00 . A A . 56 PRO HG2 1 1 2 1721 1 1 56 PRO HG3 H -12.074 -13.276 4.057 1.00 . A A . 56 PRO HG3 1 1 2 1722 1 1 56 PRO N N -11.912 -10.884 1.895 1.00 . A A . 56 PRO N 1 1 2 1723 1 1 56 PRO O O -15.075 -11.474 0.266 1.00 . A A . 56 PRO O 1 1 2 1724 1 1 57 ALA C C -15.749 -8.175 1.010 1.00 . A A . 57 ALA C 1 1 2 1725 1 1 57 ALA CA C -15.771 -9.373 1.953 1.00 . A A . 57 ALA CA 1 1 2 1726 1 1 57 ALA CB C -16.112 -8.927 3.366 1.00 . A A . 57 ALA CB 1 1 2 1727 1 1 57 ALA H H -13.805 -9.824 2.584 1.00 . A A . 57 ALA H 1 1 2 1728 1 1 57 ALA HA H -16.538 -10.061 1.627 1.00 . A A . 57 ALA HA 1 1 2 1729 1 1 57 ALA HB1 H -15.339 -9.260 4.045 1.00 . A A . 57 ALA HB1 1 1 2 1730 1 1 57 ALA HB2 H -16.179 -7.851 3.398 1.00 . A A . 57 ALA HB2 1 1 2 1731 1 1 57 ALA HB3 H -17.059 -9.357 3.661 1.00 . A A . 57 ALA HB3 1 1 2 1732 1 1 57 ALA N N -14.499 -10.084 1.944 1.00 . A A . 57 ALA N 1 1 2 1733 1 1 57 ALA O O -16.765 -7.504 0.820 1.00 . A A . 57 ALA O 1 1 2 1734 1 1 58 LEU C C -13.334 -7.141 -1.536 1.00 . A A . 58 LEU C 1 1 2 1735 1 1 58 LEU CA C -14.453 -6.837 -0.552 1.00 . A A . 58 LEU CA 1 1 2 1736 1 1 58 LEU CB C -14.171 -5.519 0.169 1.00 . A A . 58 LEU CB 1 1 2 1737 1 1 58 LEU CD1 C -15.852 -3.837 -0.623 1.00 . A A . 58 LEU CD1 1 1 2 1738 1 1 58 LEU CD2 C -13.490 -3.138 -0.207 1.00 . A A . 58 LEU CD2 1 1 2 1739 1 1 58 LEU CG C -14.394 -4.263 -0.677 1.00 . A A . 58 LEU CG 1 1 2 1740 1 1 58 LEU H H -13.832 -8.518 0.570 1.00 . A A . 58 LEU H 1 1 2 1741 1 1 58 LEU HA H -15.381 -6.749 -1.099 1.00 . A A . 58 LEU HA 1 1 2 1742 1 1 58 LEU HB2 H -14.810 -5.463 1.039 1.00 . A A . 58 LEU HB2 1 1 2 1743 1 1 58 LEU HB3 H -13.143 -5.525 0.498 1.00 . A A . 58 LEU HB3 1 1 2 1744 1 1 58 LEU HD11 H -16.335 -4.088 -1.556 1.00 . A A . 58 LEU HD11 1 1 2 1745 1 1 58 LEU HD12 H -16.346 -4.350 0.187 1.00 . A A . 58 LEU HD12 1 1 2 1746 1 1 58 LEU HD13 H -15.909 -2.770 -0.462 1.00 . A A . 58 LEU HD13 1 1 2 1747 1 1 58 LEU HD21 H -12.965 -2.724 -1.054 1.00 . A A . 58 LEU HD21 1 1 2 1748 1 1 58 LEU HD22 H -14.087 -2.368 0.259 1.00 . A A . 58 LEU HD22 1 1 2 1749 1 1 58 LEU HD23 H -12.777 -3.523 0.508 1.00 . A A . 58 LEU HD23 1 1 2 1750 1 1 58 LEU HG H -14.150 -4.481 -1.706 1.00 . A A . 58 LEU HG 1 1 2 1751 1 1 58 LEU N N -14.599 -7.930 0.399 1.00 . A A . 58 LEU N 1 1 2 1752 1 1 58 LEU O O -12.153 -7.019 -1.208 1.00 . A A . 58 LEU O 1 1 2 1753 1 1 59 LYS C C -12.502 -6.791 -4.703 1.00 . A A . 59 LYS C 1 1 2 1754 1 1 59 LYS CA C -12.746 -7.949 -3.746 1.00 . A A . 59 LYS CA 1 1 2 1755 1 1 59 LYS CB C -13.240 -9.168 -4.523 1.00 . A A . 59 LYS CB 1 1 2 1756 1 1 59 LYS CD C -12.167 -11.401 -4.105 1.00 . A A . 59 LYS CD 1 1 2 1757 1 1 59 LYS CE C -12.631 -12.371 -5.179 1.00 . A A . 59 LYS CE 1 1 2 1758 1 1 59 LYS CG C -13.273 -10.444 -3.699 1.00 . A A . 59 LYS CG 1 1 2 1759 1 1 59 LYS H H -14.675 -7.676 -2.915 1.00 . A A . 59 LYS H 1 1 2 1760 1 1 59 LYS HA H -11.817 -8.195 -3.254 1.00 . A A . 59 LYS HA 1 1 2 1761 1 1 59 LYS HB2 H -14.240 -8.971 -4.880 1.00 . A A . 59 LYS HB2 1 1 2 1762 1 1 59 LYS HB3 H -12.590 -9.328 -5.371 1.00 . A A . 59 LYS HB3 1 1 2 1763 1 1 59 LYS HD2 H -11.333 -10.832 -4.486 1.00 . A A . 59 LYS HD2 1 1 2 1764 1 1 59 LYS HD3 H -11.853 -11.963 -3.237 1.00 . A A . 59 LYS HD3 1 1 2 1765 1 1 59 LYS HE2 H -12.486 -13.380 -4.822 1.00 . A A . 59 LYS HE2 1 1 2 1766 1 1 59 LYS HE3 H -13.681 -12.205 -5.370 1.00 . A A . 59 LYS HE3 1 1 2 1767 1 1 59 LYS HG2 H -13.150 -10.191 -2.657 1.00 . A A . 59 LYS HG2 1 1 2 1768 1 1 59 LYS HG3 H -14.227 -10.930 -3.843 1.00 . A A . 59 LYS HG3 1 1 2 1769 1 1 59 LYS HZ1 H -12.274 -11.403 -7.000 1.00 . A A . 59 LYS HZ1 1 1 2 1770 1 1 59 LYS HZ2 H -11.933 -13.066 -7.020 1.00 . A A . 59 LYS HZ2 1 1 2 1771 1 1 59 LYS HZ3 H -10.875 -11.995 -6.241 1.00 . A A . 59 LYS HZ3 1 1 2 1772 1 1 59 LYS N N -13.713 -7.583 -2.723 1.00 . A A . 59 LYS N 1 1 2 1773 1 1 59 LYS NZ N -11.878 -12.196 -6.447 1.00 . A A . 59 LYS NZ 1 1 2 1774 1 1 59 LYS O O -13.275 -5.832 -4.748 1.00 . A A . 59 LYS O 1 1 2 1775 1 1 60 GLY C C -11.780 -6.278 -7.837 1.00 . A A . 60 GLY C 1 1 2 1776 1 1 60 GLY CA C -11.173 -5.904 -6.506 1.00 . A A . 60 GLY CA 1 1 2 1777 1 1 60 GLY H H -10.900 -7.723 -5.458 1.00 . A A . 60 GLY H 1 1 2 1778 1 1 60 GLY HA2 H -11.582 -4.958 -6.181 1.00 . A A . 60 GLY HA2 1 1 2 1779 1 1 60 GLY HA3 H -10.104 -5.809 -6.619 1.00 . A A . 60 GLY HA3 1 1 2 1780 1 1 60 GLY N N -11.456 -6.910 -5.506 1.00 . A A . 60 GLY N 1 1 2 1781 1 1 60 GLY O O -12.262 -5.417 -8.581 1.00 . A A . 60 GLY O 1 1 2 1782 1 1 61 LYS C C -13.036 -9.478 -9.019 1.00 . A A . 61 LYS C 1 1 2 1783 1 1 61 LYS CA C -12.455 -8.099 -9.294 1.00 . A A . 61 LYS CA 1 1 2 1784 1 1 61 LYS CB C -11.440 -8.173 -10.441 1.00 . A A . 61 LYS CB 1 1 2 1785 1 1 61 LYS CD C -13.245 -7.411 -12.022 1.00 . A A . 61 LYS CD 1 1 2 1786 1 1 61 LYS CE C -14.407 -8.114 -12.702 1.00 . A A . 61 LYS CE 1 1 2 1787 1 1 61 LYS CG C -12.069 -8.350 -11.817 1.00 . A A . 61 LYS CG 1 1 2 1788 1 1 61 LYS H H -11.486 -8.210 -7.424 1.00 . A A . 61 LYS H 1 1 2 1789 1 1 61 LYS HA H -13.257 -7.431 -9.572 1.00 . A A . 61 LYS HA 1 1 2 1790 1 1 61 LYS HB2 H -10.858 -7.264 -10.451 1.00 . A A . 61 LYS HB2 1 1 2 1791 1 1 61 LYS HB3 H -10.779 -9.009 -10.264 1.00 . A A . 61 LYS HB3 1 1 2 1792 1 1 61 LYS HD2 H -13.571 -7.044 -11.060 1.00 . A A . 61 LYS HD2 1 1 2 1793 1 1 61 LYS HD3 H -12.927 -6.581 -12.638 1.00 . A A . 61 LYS HD3 1 1 2 1794 1 1 61 LYS HE2 H -14.944 -7.396 -13.303 1.00 . A A . 61 LYS HE2 1 1 2 1795 1 1 61 LYS HE3 H -14.016 -8.895 -13.339 1.00 . A A . 61 LYS HE3 1 1 2 1796 1 1 61 LYS HG2 H -11.324 -8.143 -12.571 1.00 . A A . 61 LYS HG2 1 1 2 1797 1 1 61 LYS HG3 H -12.413 -9.369 -11.919 1.00 . A A . 61 LYS HG3 1 1 2 1798 1 1 61 LYS HZ1 H -14.816 -9.127 -10.920 1.00 . A A . 61 LYS HZ1 1 1 2 1799 1 1 61 LYS HZ2 H -15.904 -9.473 -12.174 1.00 . A A . 61 LYS HZ2 1 1 2 1800 1 1 61 LYS HZ3 H -15.999 -7.992 -11.354 1.00 . A A . 61 LYS HZ3 1 1 2 1801 1 1 61 LYS N N -11.832 -7.575 -8.093 1.00 . A A . 61 LYS N 1 1 2 1802 1 1 61 LYS NZ N -15.346 -8.717 -11.720 1.00 . A A . 61 LYS NZ 1 1 2 1803 1 1 61 LYS O O -12.457 -10.210 -8.190 1.00 . A A . 61 LYS O 1 1 2 1804 1 1 61 LYS OXT O -14.064 -9.827 -9.632 1.00 . A A . 61 LYS OXT 1 1 2 1805 2 2 1 ZN ZN ZN -4.711 -3.731 -1.784 1.00 . B A . 62 ZN ZN 1 1 2 1806 3 2 1 ZN ZN ZN 3.623 3.405 4.385 1.00 . C A . 63 ZN ZN 1 1 3 1807 1 1 1 GLY C C -8.857 10.447 0.575 1.00 . A A . 1 GLY C 1 1 3 1808 1 1 1 GLY CA C -7.952 9.332 0.096 1.00 . A A . 1 GLY CA 1 1 3 1809 1 1 1 GLY H1 H -7.909 10.304 -1.751 1.00 . A A . 1 GLY H1 1 1 3 1810 1 1 1 GLY H2 H -7.153 8.792 -1.754 1.00 . A A . 1 GLY H2 1 1 3 1811 1 1 1 GLY H3 H -6.386 10.124 -1.027 1.00 . A A . 1 GLY H3 1 1 3 1812 1 1 1 GLY HA2 H -8.537 8.433 -0.022 1.00 . A A . 1 GLY HA2 1 1 3 1813 1 1 1 GLY HA3 H -7.187 9.158 0.839 1.00 . A A . 1 GLY HA3 1 1 3 1814 1 1 1 GLY N N -7.306 9.659 -1.199 1.00 . A A . 1 GLY N 1 1 3 1815 1 1 1 GLY O O -9.947 10.635 0.029 1.00 . A A . 1 GLY O 1 1 3 1816 1 1 2 PRO C C -9.196 13.552 1.187 1.00 . A A . 2 PRO C 1 1 3 1817 1 1 2 PRO CA C -9.193 12.347 2.124 1.00 . A A . 2 PRO CA 1 1 3 1818 1 1 2 PRO CB C -8.473 12.694 3.438 1.00 . A A . 2 PRO CB 1 1 3 1819 1 1 2 PRO CD C -7.137 11.086 2.271 1.00 . A A . 2 PRO CD 1 1 3 1820 1 1 2 PRO CG C -7.436 11.638 3.632 1.00 . A A . 2 PRO CG 1 1 3 1821 1 1 2 PRO HA H -10.212 12.055 2.335 1.00 . A A . 2 PRO HA 1 1 3 1822 1 1 2 PRO HB2 H -8.024 13.672 3.354 1.00 . A A . 2 PRO HB2 1 1 3 1823 1 1 2 PRO HB3 H -9.188 12.695 4.250 1.00 . A A . 2 PRO HB3 1 1 3 1824 1 1 2 PRO HD2 H -6.367 11.668 1.784 1.00 . A A . 2 PRO HD2 1 1 3 1825 1 1 2 PRO HD3 H -6.847 10.048 2.337 1.00 . A A . 2 PRO HD3 1 1 3 1826 1 1 2 PRO HG2 H -6.545 12.073 4.062 1.00 . A A . 2 PRO HG2 1 1 3 1827 1 1 2 PRO HG3 H -7.822 10.861 4.275 1.00 . A A . 2 PRO HG3 1 1 3 1828 1 1 2 PRO N N -8.420 11.227 1.579 1.00 . A A . 2 PRO N 1 1 3 1829 1 1 2 PRO O O -8.614 14.596 1.490 1.00 . A A . 2 PRO O 1 1 3 1830 1 1 3 LEU C C -11.264 14.365 -1.668 1.00 . A A . 3 LEU C 1 1 3 1831 1 1 3 LEU CA C -9.917 14.438 -0.961 1.00 . A A . 3 LEU CA 1 1 3 1832 1 1 3 LEU CB C -8.778 14.294 -1.975 1.00 . A A . 3 LEU CB 1 1 3 1833 1 1 3 LEU CD1 C -6.386 14.704 -2.607 1.00 . A A . 3 LEU CD1 1 1 3 1834 1 1 3 LEU CD2 C -7.752 16.550 -1.621 1.00 . A A . 3 LEU CD2 1 1 3 1835 1 1 3 LEU CG C -7.494 15.052 -1.627 1.00 . A A . 3 LEU CG 1 1 3 1836 1 1 3 LEU H H -10.264 12.520 -0.140 1.00 . A A . 3 LEU H 1 1 3 1837 1 1 3 LEU HA H -9.831 15.391 -0.459 1.00 . A A . 3 LEU HA 1 1 3 1838 1 1 3 LEU HB2 H -8.537 13.245 -2.069 1.00 . A A . 3 LEU HB2 1 1 3 1839 1 1 3 LEU HB3 H -9.130 14.651 -2.932 1.00 . A A . 3 LEU HB3 1 1 3 1840 1 1 3 LEU HD11 H -6.510 13.686 -2.944 1.00 . A A . 3 LEU HD11 1 1 3 1841 1 1 3 LEU HD12 H -6.432 15.371 -3.455 1.00 . A A . 3 LEU HD12 1 1 3 1842 1 1 3 LEU HD13 H -5.426 14.807 -2.120 1.00 . A A . 3 LEU HD13 1 1 3 1843 1 1 3 LEU HD21 H -7.999 16.870 -0.619 1.00 . A A . 3 LEU HD21 1 1 3 1844 1 1 3 LEU HD22 H -6.866 17.071 -1.956 1.00 . A A . 3 LEU HD22 1 1 3 1845 1 1 3 LEU HD23 H -8.575 16.775 -2.284 1.00 . A A . 3 LEU HD23 1 1 3 1846 1 1 3 LEU HG H -7.168 14.763 -0.637 1.00 . A A . 3 LEU HG 1 1 3 1847 1 1 3 LEU N N -9.836 13.387 0.042 1.00 . A A . 3 LEU N 1 1 3 1848 1 1 3 LEU O O -11.351 14.470 -2.894 1.00 . A A . 3 LEU O 1 1 3 1849 1 1 4 GLY C C -13.849 12.526 -1.951 1.00 . A A . 4 GLY C 1 1 3 1850 1 1 4 GLY CA C -13.629 13.936 -1.442 1.00 . A A . 4 GLY CA 1 1 3 1851 1 1 4 GLY H H -12.159 13.966 0.078 1.00 . A A . 4 GLY H 1 1 3 1852 1 1 4 GLY HA2 H -14.361 14.154 -0.679 1.00 . A A . 4 GLY HA2 1 1 3 1853 1 1 4 GLY HA3 H -13.756 14.629 -2.260 1.00 . A A . 4 GLY HA3 1 1 3 1854 1 1 4 GLY N N -12.304 14.102 -0.886 1.00 . A A . 4 GLY N 1 1 3 1855 1 1 4 GLY O O -13.343 11.568 -1.364 1.00 . A A . 4 GLY O 1 1 3 1856 1 1 5 SER C C -13.542 10.621 -4.402 1.00 . A A . 5 SER C 1 1 3 1857 1 1 5 SER CA C -14.798 11.104 -3.682 1.00 . A A . 5 SER CA 1 1 3 1858 1 1 5 SER CB C -15.971 11.198 -4.658 1.00 . A A . 5 SER CB 1 1 3 1859 1 1 5 SER H H -14.913 13.212 -3.497 1.00 . A A . 5 SER H 1 1 3 1860 1 1 5 SER HA H -15.045 10.403 -2.897 1.00 . A A . 5 SER HA 1 1 3 1861 1 1 5 SER HB2 H -15.601 11.447 -5.644 1.00 . A A . 5 SER HB2 1 1 3 1862 1 1 5 SER HB3 H -16.486 10.250 -4.695 1.00 . A A . 5 SER HB3 1 1 3 1863 1 1 5 SER HG H -17.173 12.015 -3.339 1.00 . A A . 5 SER HG 1 1 3 1864 1 1 5 SER N N -14.559 12.402 -3.064 1.00 . A A . 5 SER N 1 1 3 1865 1 1 5 SER O O -13.329 10.927 -5.578 1.00 . A A . 5 SER O 1 1 3 1866 1 1 5 SER OG O -16.888 12.199 -4.249 1.00 . A A . 5 SER OG 1 1 3 1867 1 1 6 ASP C C -11.382 7.946 -4.289 1.00 . A A . 6 ASP C 1 1 3 1868 1 1 6 ASP CA C -11.416 9.465 -4.212 1.00 . A A . 6 ASP CA 1 1 3 1869 1 1 6 ASP CB C -10.258 9.963 -3.346 1.00 . A A . 6 ASP CB 1 1 3 1870 1 1 6 ASP CG C -8.986 10.192 -4.137 1.00 . A A . 6 ASP CG 1 1 3 1871 1 1 6 ASP H H -12.896 9.748 -2.726 1.00 . A A . 6 ASP H 1 1 3 1872 1 1 6 ASP HA H -11.312 9.867 -5.207 1.00 . A A . 6 ASP HA 1 1 3 1873 1 1 6 ASP HB2 H -10.540 10.897 -2.883 1.00 . A A . 6 ASP HB2 1 1 3 1874 1 1 6 ASP HB3 H -10.055 9.233 -2.576 1.00 . A A . 6 ASP HB3 1 1 3 1875 1 1 6 ASP N N -12.686 9.927 -3.670 1.00 . A A . 6 ASP N 1 1 3 1876 1 1 6 ASP O O -12.192 7.264 -3.662 1.00 . A A . 6 ASP O 1 1 3 1877 1 1 6 ASP OD1 O -8.927 9.790 -5.322 1.00 . A A . 6 ASP OD1 1 1 3 1878 1 1 6 ASP OD2 O -8.042 10.784 -3.579 1.00 . A A . 6 ASP OD2 1 1 3 1879 1 1 7 HIS C C -9.120 5.518 -4.257 1.00 . A A . 7 HIS C 1 1 3 1880 1 1 7 HIS CA C -10.249 5.989 -5.162 1.00 . A A . 7 HIS CA 1 1 3 1881 1 1 7 HIS CB C -9.956 5.614 -6.616 1.00 . A A . 7 HIS CB 1 1 3 1882 1 1 7 HIS CD2 C -9.546 3.114 -7.084 1.00 . A A . 7 HIS CD2 1 1 3 1883 1 1 7 HIS CE1 C -11.618 2.564 -7.475 1.00 . A A . 7 HIS CE1 1 1 3 1884 1 1 7 HIS CG C -10.332 4.209 -6.959 1.00 . A A . 7 HIS CG 1 1 3 1885 1 1 7 HIS H H -9.788 8.027 -5.479 1.00 . A A . 7 HIS H 1 1 3 1886 1 1 7 HIS HA H -11.166 5.512 -4.852 1.00 . A A . 7 HIS HA 1 1 3 1887 1 1 7 HIS HB2 H -10.508 6.274 -7.268 1.00 . A A . 7 HIS HB2 1 1 3 1888 1 1 7 HIS HB3 H -8.897 5.731 -6.806 1.00 . A A . 7 HIS HB3 1 1 3 1889 1 1 7 HIS HD2 H -8.475 3.065 -6.949 1.00 . A A . 7 HIS HD2 1 1 3 1890 1 1 7 HIS HE1 H -12.492 1.978 -7.718 1.00 . A A . 7 HIS HE1 1 1 3 1891 1 1 7 HIS HE2 H -10.106 1.130 -7.530 1.00 . A A . 7 HIS HE2 1 1 3 1892 1 1 7 HIS N N -10.423 7.425 -5.034 1.00 . A A . 7 HIS N 1 1 3 1893 1 1 7 HIS ND1 N -11.639 3.857 -7.206 1.00 . A A . 7 HIS ND1 1 1 3 1894 1 1 7 HIS NE2 N -10.374 2.074 -7.412 1.00 . A A . 7 HIS NE2 1 1 3 1895 1 1 7 HIS O O -9.360 5.072 -3.134 1.00 . A A . 7 HIS O 1 1 3 1896 1 1 8 HIS C C -6.290 6.547 -3.062 1.00 . A A . 8 HIS C 1 1 3 1897 1 1 8 HIS CA C -6.724 5.355 -3.911 1.00 . A A . 8 HIS CA 1 1 3 1898 1 1 8 HIS CB C -5.573 4.868 -4.804 1.00 . A A . 8 HIS CB 1 1 3 1899 1 1 8 HIS CD2 C -3.754 6.272 -5.988 1.00 . A A . 8 HIS CD2 1 1 3 1900 1 1 8 HIS CE1 C -5.078 7.425 -7.274 1.00 . A A . 8 HIS CE1 1 1 3 1901 1 1 8 HIS CG C -5.035 5.905 -5.752 1.00 . A A . 8 HIS CG 1 1 3 1902 1 1 8 HIS H H -7.756 6.142 -5.578 1.00 . A A . 8 HIS H 1 1 3 1903 1 1 8 HIS HA H -7.015 4.551 -3.250 1.00 . A A . 8 HIS HA 1 1 3 1904 1 1 8 HIS HB2 H -4.757 4.547 -4.175 1.00 . A A . 8 HIS HB2 1 1 3 1905 1 1 8 HIS HB3 H -5.916 4.030 -5.392 1.00 . A A . 8 HIS HB3 1 1 3 1906 1 1 8 HIS HD2 H -2.869 5.884 -5.500 1.00 . A A . 8 HIS HD2 1 1 3 1907 1 1 8 HIS HE1 H -5.429 8.132 -8.008 1.00 . A A . 8 HIS HE1 1 1 3 1908 1 1 8 HIS HE2 H -3.015 7.534 -7.506 1.00 . A A . 8 HIS HE2 1 1 3 1909 1 1 8 HIS N N -7.888 5.703 -4.711 1.00 . A A . 8 HIS N 1 1 3 1910 1 1 8 HIS ND1 N -5.868 6.636 -6.566 1.00 . A A . 8 HIS ND1 1 1 3 1911 1 1 8 HIS NE2 N -3.788 7.240 -6.961 1.00 . A A . 8 HIS NE2 1 1 3 1912 1 1 8 HIS O O -6.947 7.590 -3.057 1.00 . A A . 8 HIS O 1 1 3 1913 1 1 9 MET C C -3.478 8.112 -2.061 1.00 . A A . 9 MET C 1 1 3 1914 1 1 9 MET CA C -4.715 7.452 -1.465 1.00 . A A . 9 MET CA 1 1 3 1915 1 1 9 MET CB C -4.387 6.908 -0.071 1.00 . A A . 9 MET CB 1 1 3 1916 1 1 9 MET CE C -6.206 3.528 1.555 1.00 . A A . 9 MET CE 1 1 3 1917 1 1 9 MET CG C -5.434 5.956 0.484 1.00 . A A . 9 MET CG 1 1 3 1918 1 1 9 MET H H -4.715 5.535 -2.365 1.00 . A A . 9 MET H 1 1 3 1919 1 1 9 MET HA H -5.496 8.191 -1.377 1.00 . A A . 9 MET HA 1 1 3 1920 1 1 9 MET HB2 H -3.443 6.385 -0.116 1.00 . A A . 9 MET HB2 1 1 3 1921 1 1 9 MET HB3 H -4.294 7.740 0.612 1.00 . A A . 9 MET HB3 1 1 3 1922 1 1 9 MET HE1 H -6.637 2.878 0.809 1.00 . A A . 9 MET HE1 1 1 3 1923 1 1 9 MET HE2 H -5.925 2.946 2.421 1.00 . A A . 9 MET HE2 1 1 3 1924 1 1 9 MET HE3 H -6.930 4.277 1.843 1.00 . A A . 9 MET HE3 1 1 3 1925 1 1 9 MET HG2 H -5.849 6.384 1.383 1.00 . A A . 9 MET HG2 1 1 3 1926 1 1 9 MET HG3 H -6.218 5.834 -0.250 1.00 . A A . 9 MET HG3 1 1 3 1927 1 1 9 MET N N -5.202 6.389 -2.329 1.00 . A A . 9 MET N 1 1 3 1928 1 1 9 MET O O -2.708 7.477 -2.778 1.00 . A A . 9 MET O 1 1 3 1929 1 1 9 MET SD S -4.755 4.331 0.880 1.00 . A A . 9 MET SD 1 1 3 1930 1 1 10 GLU C C -0.920 9.803 -1.214 1.00 . A A . 10 GLU C 1 1 3 1931 1 1 10 GLU CA C -2.092 10.120 -2.134 1.00 . A A . 10 GLU CA 1 1 3 1932 1 1 10 GLU CB C -2.363 11.635 -2.113 1.00 . A A . 10 GLU CB 1 1 3 1933 1 1 10 GLU CD C -4.365 11.817 -0.564 1.00 . A A . 10 GLU CD 1 1 3 1934 1 1 10 GLU CG C -3.833 12.018 -1.971 1.00 . A A . 10 GLU CG 1 1 3 1935 1 1 10 GLU H H -3.910 9.807 -1.098 1.00 . A A . 10 GLU H 1 1 3 1936 1 1 10 GLU HA H -1.845 9.814 -3.141 1.00 . A A . 10 GLU HA 1 1 3 1937 1 1 10 GLU HB2 H -1.823 12.069 -1.284 1.00 . A A . 10 GLU HB2 1 1 3 1938 1 1 10 GLU HB3 H -1.991 12.063 -3.032 1.00 . A A . 10 GLU HB3 1 1 3 1939 1 1 10 GLU HG2 H -3.946 13.058 -2.236 1.00 . A A . 10 GLU HG2 1 1 3 1940 1 1 10 GLU HG3 H -4.416 11.411 -2.651 1.00 . A A . 10 GLU HG3 1 1 3 1941 1 1 10 GLU N N -3.268 9.370 -1.704 1.00 . A A . 10 GLU N 1 1 3 1942 1 1 10 GLU O O 0.147 10.408 -1.305 1.00 . A A . 10 GLU O 1 1 3 1943 1 1 10 GLU OE1 O -4.025 12.619 0.331 1.00 . A A . 10 GLU OE1 1 1 3 1944 1 1 10 GLU OE2 O -5.115 10.841 -0.350 1.00 . A A . 10 GLU OE2 1 1 3 1945 1 1 11 PHE C C -0.384 7.023 1.045 1.00 . A A . 11 PHE C 1 1 3 1946 1 1 11 PHE CA C -0.190 8.490 0.698 1.00 . A A . 11 PHE CA 1 1 3 1947 1 1 11 PHE CB C -0.354 9.352 1.957 1.00 . A A . 11 PHE CB 1 1 3 1948 1 1 11 PHE CD1 C -2.831 9.763 2.102 1.00 . A A . 11 PHE CD1 1 1 3 1949 1 1 11 PHE CD2 C -1.801 8.459 3.809 1.00 . A A . 11 PHE CD2 1 1 3 1950 1 1 11 PHE CE1 C -4.054 9.610 2.721 1.00 . A A . 11 PHE CE1 1 1 3 1951 1 1 11 PHE CE2 C -3.021 8.305 4.431 1.00 . A A . 11 PHE CE2 1 1 3 1952 1 1 11 PHE CG C -1.689 9.189 2.636 1.00 . A A . 11 PHE CG 1 1 3 1953 1 1 11 PHE CZ C -4.149 8.882 3.887 1.00 . A A . 11 PHE CZ 1 1 3 1954 1 1 11 PHE H H -2.046 8.462 -0.283 1.00 . A A . 11 PHE H 1 1 3 1955 1 1 11 PHE HA H 0.800 8.632 0.292 1.00 . A A . 11 PHE HA 1 1 3 1956 1 1 11 PHE HB2 H 0.414 9.086 2.668 1.00 . A A . 11 PHE HB2 1 1 3 1957 1 1 11 PHE HB3 H -0.241 10.393 1.686 1.00 . A A . 11 PHE HB3 1 1 3 1958 1 1 11 PHE HD1 H -2.759 10.335 1.190 1.00 . A A . 11 PHE HD1 1 1 3 1959 1 1 11 PHE HD2 H -0.918 8.010 4.237 1.00 . A A . 11 PHE HD2 1 1 3 1960 1 1 11 PHE HE1 H -4.936 10.063 2.293 1.00 . A A . 11 PHE HE1 1 1 3 1961 1 1 11 PHE HE2 H -3.092 7.734 5.345 1.00 . A A . 11 PHE HE2 1 1 3 1962 1 1 11 PHE HZ H -5.106 8.761 4.373 1.00 . A A . 11 PHE HZ 1 1 3 1963 1 1 11 PHE N N -1.163 8.883 -0.299 1.00 . A A . 11 PHE N 1 1 3 1964 1 1 11 PHE O O -1.399 6.427 0.690 1.00 . A A . 11 PHE O 1 1 3 1965 1 1 12 CYS C C -0.402 5.111 3.570 1.00 . A A . 12 CYS C 1 1 3 1966 1 1 12 CYS CA C 0.389 5.106 2.267 1.00 . A A . 12 CYS CA 1 1 3 1967 1 1 12 CYS CB C 1.763 4.443 2.442 1.00 . A A . 12 CYS CB 1 1 3 1968 1 1 12 CYS H H 1.298 7.007 2.120 1.00 . A A . 12 CYS H 1 1 3 1969 1 1 12 CYS HA H -0.175 4.562 1.519 1.00 . A A . 12 CYS HA 1 1 3 1970 1 1 12 CYS HB2 H 1.792 3.540 1.851 1.00 . A A . 12 CYS HB2 1 1 3 1971 1 1 12 CYS HB3 H 2.527 5.119 2.087 1.00 . A A . 12 CYS HB3 1 1 3 1972 1 1 12 CYS HG H 2.993 4.943 4.608 1.00 . A A . 12 CYS HG 1 1 3 1973 1 1 12 CYS N N 0.540 6.465 1.801 1.00 . A A . 12 CYS N 1 1 3 1974 1 1 12 CYS O O -0.076 5.859 4.491 1.00 . A A . 12 CYS O 1 1 3 1975 1 1 12 CYS SG S 2.173 3.992 4.141 1.00 . A A . 12 CYS SG 1 1 3 1976 1 1 13 ARG C C -1.806 3.939 6.022 1.00 . A A . 13 ARG C 1 1 3 1977 1 1 13 ARG CA C -2.450 4.419 4.719 1.00 . A A . 13 ARG CA 1 1 3 1978 1 1 13 ARG CB C -3.688 3.571 4.412 1.00 . A A . 13 ARG CB 1 1 3 1979 1 1 13 ARG CD C -3.948 1.132 4.974 1.00 . A A . 13 ARG CD 1 1 3 1980 1 1 13 ARG CG C -3.371 2.143 3.996 1.00 . A A . 13 ARG CG 1 1 3 1981 1 1 13 ARG CZ C -6.299 1.200 5.727 1.00 . A A . 13 ARG CZ 1 1 3 1982 1 1 13 ARG H H -1.780 3.907 2.771 1.00 . A A . 13 ARG H 1 1 3 1983 1 1 13 ARG HA H -2.762 5.445 4.851 1.00 . A A . 13 ARG HA 1 1 3 1984 1 1 13 ARG HB2 H -4.309 3.532 5.293 1.00 . A A . 13 ARG HB2 1 1 3 1985 1 1 13 ARG HB3 H -4.242 4.040 3.613 1.00 . A A . 13 ARG HB3 1 1 3 1986 1 1 13 ARG HD2 H -3.454 0.183 4.825 1.00 . A A . 13 ARG HD2 1 1 3 1987 1 1 13 ARG HD3 H -3.764 1.479 5.980 1.00 . A A . 13 ARG HD3 1 1 3 1988 1 1 13 ARG HE H -5.696 0.640 3.903 1.00 . A A . 13 ARG HE 1 1 3 1989 1 1 13 ARG HG2 H -3.794 1.963 3.018 1.00 . A A . 13 ARG HG2 1 1 3 1990 1 1 13 ARG HG3 H -2.300 2.020 3.955 1.00 . A A . 13 ARG HG3 1 1 3 1991 1 1 13 ARG HH11 H -4.948 1.658 7.173 1.00 . A A . 13 ARG HH11 1 1 3 1992 1 1 13 ARG HH12 H -6.622 1.776 7.648 1.00 . A A . 13 ARG HH12 1 1 3 1993 1 1 13 ARG HH21 H -7.872 0.748 4.532 1.00 . A A . 13 ARG HH21 1 1 3 1994 1 1 13 ARG HH22 H -8.282 1.232 6.151 1.00 . A A . 13 ARG HH22 1 1 3 1995 1 1 13 ARG N N -1.517 4.385 3.587 1.00 . A A . 13 ARG N 1 1 3 1996 1 1 13 ARG NE N -5.386 0.953 4.789 1.00 . A A . 13 ARG NE 1 1 3 1997 1 1 13 ARG NH1 N -5.924 1.569 6.945 1.00 . A A . 13 ARG NH1 1 1 3 1998 1 1 13 ARG NH2 N -7.586 1.049 5.449 1.00 . A A . 13 ARG NH2 1 1 3 1999 1 1 13 ARG O O -2.398 4.061 7.093 1.00 . A A . 13 ARG O 1 1 3 2000 1 1 14 VAL C C 0.744 3.984 7.892 1.00 . A A . 14 VAL C 1 1 3 2001 1 1 14 VAL CA C 0.072 2.857 7.105 1.00 . A A . 14 VAL CA 1 1 3 2002 1 1 14 VAL CB C 1.120 1.792 6.724 1.00 . A A . 14 VAL CB 1 1 3 2003 1 1 14 VAL CG1 C 1.668 1.115 7.969 1.00 . A A . 14 VAL CG1 1 1 3 2004 1 1 14 VAL CG2 C 0.519 0.767 5.770 1.00 . A A . 14 VAL CG2 1 1 3 2005 1 1 14 VAL H H -0.196 3.284 5.050 1.00 . A A . 14 VAL H 1 1 3 2006 1 1 14 VAL HA H -0.669 2.387 7.737 1.00 . A A . 14 VAL HA 1 1 3 2007 1 1 14 VAL HB H 1.939 2.286 6.219 1.00 . A A . 14 VAL HB 1 1 3 2008 1 1 14 VAL HG11 H 1.160 0.176 8.122 1.00 . A A . 14 VAL HG11 1 1 3 2009 1 1 14 VAL HG12 H 2.728 0.936 7.847 1.00 . A A . 14 VAL HG12 1 1 3 2010 1 1 14 VAL HG13 H 1.509 1.754 8.826 1.00 . A A . 14 VAL HG13 1 1 3 2011 1 1 14 VAL HG21 H 0.985 -0.192 5.933 1.00 . A A . 14 VAL HG21 1 1 3 2012 1 1 14 VAL HG22 H -0.544 0.686 5.948 1.00 . A A . 14 VAL HG22 1 1 3 2013 1 1 14 VAL HG23 H 0.689 1.081 4.749 1.00 . A A . 14 VAL HG23 1 1 3 2014 1 1 14 VAL N N -0.614 3.371 5.930 1.00 . A A . 14 VAL N 1 1 3 2015 1 1 14 VAL O O 0.336 4.297 9.008 1.00 . A A . 14 VAL O 1 1 3 2016 1 1 15 CYS C C 1.954 7.007 7.697 1.00 . A A . 15 CYS C 1 1 3 2017 1 1 15 CYS CA C 2.536 5.627 7.998 1.00 . A A . 15 CYS CA 1 1 3 2018 1 1 15 CYS CB C 4.019 5.568 7.605 1.00 . A A . 15 CYS CB 1 1 3 2019 1 1 15 CYS H H 2.085 4.264 6.446 1.00 . A A . 15 CYS H 1 1 3 2020 1 1 15 CYS HA H 2.454 5.448 9.061 1.00 . A A . 15 CYS HA 1 1 3 2021 1 1 15 CYS HB2 H 4.594 6.134 8.322 1.00 . A A . 15 CYS HB2 1 1 3 2022 1 1 15 CYS HB3 H 4.343 4.538 7.629 1.00 . A A . 15 CYS HB3 1 1 3 2023 1 1 15 CYS N N 1.787 4.573 7.319 1.00 . A A . 15 CYS N 1 1 3 2024 1 1 15 CYS O O 2.439 8.017 8.207 1.00 . A A . 15 CYS O 1 1 3 2025 1 1 15 CYS SG S 4.408 6.231 5.949 1.00 . A A . 15 CYS SG 1 1 3 2026 1 1 16 LYS C C 1.145 9.170 5.619 1.00 . A A . 16 LYS C 1 1 3 2027 1 1 16 LYS CA C 0.238 8.266 6.458 1.00 . A A . 16 LYS CA 1 1 3 2028 1 1 16 LYS CB C -0.289 9.021 7.683 1.00 . A A . 16 LYS CB 1 1 3 2029 1 1 16 LYS CD C -2.705 9.445 8.217 1.00 . A A . 16 LYS CD 1 1 3 2030 1 1 16 LYS CE C -2.890 10.112 9.569 1.00 . A A . 16 LYS CE 1 1 3 2031 1 1 16 LYS CG C -1.573 8.435 8.245 1.00 . A A . 16 LYS CG 1 1 3 2032 1 1 16 LYS H H 0.600 6.183 6.485 1.00 . A A . 16 LYS H 1 1 3 2033 1 1 16 LYS HA H -0.605 7.980 5.847 1.00 . A A . 16 LYS HA 1 1 3 2034 1 1 16 LYS HB2 H 0.463 8.999 8.457 1.00 . A A . 16 LYS HB2 1 1 3 2035 1 1 16 LYS HB3 H -0.478 10.048 7.404 1.00 . A A . 16 LYS HB3 1 1 3 2036 1 1 16 LYS HD2 H -2.479 10.203 7.482 1.00 . A A . 16 LYS HD2 1 1 3 2037 1 1 16 LYS HD3 H -3.621 8.940 7.946 1.00 . A A . 16 LYS HD3 1 1 3 2038 1 1 16 LYS HE2 H -3.946 10.212 9.765 1.00 . A A . 16 LYS HE2 1 1 3 2039 1 1 16 LYS HE3 H -2.441 9.488 10.330 1.00 . A A . 16 LYS HE3 1 1 3 2040 1 1 16 LYS HG2 H -1.856 7.575 7.653 1.00 . A A . 16 LYS HG2 1 1 3 2041 1 1 16 LYS HG3 H -1.400 8.129 9.266 1.00 . A A . 16 LYS HG3 1 1 3 2042 1 1 16 LYS HZ1 H -1.807 11.676 8.703 1.00 . A A . 16 LYS HZ1 1 1 3 2043 1 1 16 LYS HZ2 H -1.538 11.492 10.369 1.00 . A A . 16 LYS HZ2 1 1 3 2044 1 1 16 LYS HZ3 H -2.984 12.185 9.814 1.00 . A A . 16 LYS HZ3 1 1 3 2045 1 1 16 LYS N N 0.922 7.032 6.854 1.00 . A A . 16 LYS N 1 1 3 2046 1 1 16 LYS NZ N -2.262 11.459 9.618 1.00 . A A . 16 LYS NZ 1 1 3 2047 1 1 16 LYS O O 0.810 10.322 5.349 1.00 . A A . 16 LYS O 1 1 3 2048 1 1 17 ASP C C 3.046 9.045 2.893 1.00 . A A . 17 ASP C 1 1 3 2049 1 1 17 ASP CA C 3.221 9.384 4.363 1.00 . A A . 17 ASP CA 1 1 3 2050 1 1 17 ASP CB C 4.656 9.067 4.771 1.00 . A A . 17 ASP CB 1 1 3 2051 1 1 17 ASP CG C 5.531 10.301 4.837 1.00 . A A . 17 ASP CG 1 1 3 2052 1 1 17 ASP H H 2.494 7.710 5.435 1.00 . A A . 17 ASP H 1 1 3 2053 1 1 17 ASP HA H 3.033 10.436 4.510 1.00 . A A . 17 ASP HA 1 1 3 2054 1 1 17 ASP HB2 H 4.650 8.586 5.740 1.00 . A A . 17 ASP HB2 1 1 3 2055 1 1 17 ASP HB3 H 5.080 8.385 4.047 1.00 . A A . 17 ASP HB3 1 1 3 2056 1 1 17 ASP N N 2.277 8.632 5.186 1.00 . A A . 17 ASP N 1 1 3 2057 1 1 17 ASP O O 2.722 7.905 2.547 1.00 . A A . 17 ASP O 1 1 3 2058 1 1 17 ASP OD1 O 5.048 11.355 5.303 1.00 . A A . 17 ASP OD1 1 1 3 2059 1 1 17 ASP OD2 O 6.704 10.230 4.414 1.00 . A A . 17 ASP OD2 1 1 3 2060 1 1 18 GLY C C 4.658 9.463 0.037 1.00 . A A . 18 GLY C 1 1 3 2061 1 1 18 GLY CA C 3.287 9.777 0.606 1.00 . A A . 18 GLY CA 1 1 3 2062 1 1 18 GLY H H 3.640 10.884 2.375 1.00 . A A . 18 GLY H 1 1 3 2063 1 1 18 GLY HA2 H 2.623 8.947 0.409 1.00 . A A . 18 GLY HA2 1 1 3 2064 1 1 18 GLY HA3 H 2.902 10.662 0.118 1.00 . A A . 18 GLY HA3 1 1 3 2065 1 1 18 GLY N N 3.337 10.010 2.034 1.00 . A A . 18 GLY N 1 1 3 2066 1 1 18 GLY O O 5.560 9.054 0.770 1.00 . A A . 18 GLY O 1 1 3 2067 1 1 19 GLY C C 5.992 8.286 -2.930 1.00 . A A . 19 GLY C 1 1 3 2068 1 1 19 GLY CA C 6.091 9.389 -1.901 1.00 . A A . 19 GLY CA 1 1 3 2069 1 1 19 GLY H H 4.056 9.975 -1.802 1.00 . A A . 19 GLY H 1 1 3 2070 1 1 19 GLY HA2 H 6.433 10.292 -2.387 1.00 . A A . 19 GLY HA2 1 1 3 2071 1 1 19 GLY HA3 H 6.812 9.103 -1.150 1.00 . A A . 19 GLY HA3 1 1 3 2072 1 1 19 GLY N N 4.818 9.653 -1.262 1.00 . A A . 19 GLY N 1 1 3 2073 1 1 19 GLY O O 5.083 8.287 -3.764 1.00 . A A . 19 GLY O 1 1 3 2074 1 1 20 GLU C C 5.912 5.105 -3.182 1.00 . A A . 20 GLU C 1 1 3 2075 1 1 20 GLU CA C 6.863 6.161 -3.717 1.00 . A A . 20 GLU CA 1 1 3 2076 1 1 20 GLU CB C 8.270 5.582 -3.882 1.00 . A A . 20 GLU CB 1 1 3 2077 1 1 20 GLU CD C 7.922 6.520 -6.206 1.00 . A A . 20 GLU CD 1 1 3 2078 1 1 20 GLU CG C 8.887 5.850 -5.247 1.00 . A A . 20 GLU CG 1 1 3 2079 1 1 20 GLU H H 7.534 7.332 -2.091 1.00 . A A . 20 GLU H 1 1 3 2080 1 1 20 GLU HA H 6.504 6.493 -4.680 1.00 . A A . 20 GLU HA 1 1 3 2081 1 1 20 GLU HB2 H 8.914 6.013 -3.129 1.00 . A A . 20 GLU HB2 1 1 3 2082 1 1 20 GLU HB3 H 8.224 4.514 -3.736 1.00 . A A . 20 GLU HB3 1 1 3 2083 1 1 20 GLU HG2 H 9.748 6.491 -5.121 1.00 . A A . 20 GLU HG2 1 1 3 2084 1 1 20 GLU HG3 H 9.201 4.911 -5.676 1.00 . A A . 20 GLU HG3 1 1 3 2085 1 1 20 GLU N N 6.882 7.311 -2.828 1.00 . A A . 20 GLU N 1 1 3 2086 1 1 20 GLU O O 6.253 4.335 -2.282 1.00 . A A . 20 GLU O 1 1 3 2087 1 1 20 GLU OE1 O 7.050 5.822 -6.767 1.00 . A A . 20 GLU OE1 1 1 3 2088 1 1 20 GLU OE2 O 8.020 7.750 -6.396 1.00 . A A . 20 GLU OE2 1 1 3 2089 1 1 21 LEU C C 3.368 3.145 -4.187 1.00 . A A . 21 LEU C 1 1 3 2090 1 1 21 LEU CA C 3.652 4.251 -3.189 1.00 . A A . 21 LEU CA 1 1 3 2091 1 1 21 LEU CB C 2.368 5.034 -2.904 1.00 . A A . 21 LEU CB 1 1 3 2092 1 1 21 LEU CD1 C 1.373 7.287 -2.469 1.00 . A A . 21 LEU CD1 1 1 3 2093 1 1 21 LEU CD2 C 2.811 6.200 -0.736 1.00 . A A . 21 LEU CD2 1 1 3 2094 1 1 21 LEU CG C 2.573 6.386 -2.226 1.00 . A A . 21 LEU CG 1 1 3 2095 1 1 21 LEU H H 4.465 5.815 -4.354 1.00 . A A . 21 LEU H 1 1 3 2096 1 1 21 LEU HA H 4.003 3.808 -2.269 1.00 . A A . 21 LEU HA 1 1 3 2097 1 1 21 LEU HB2 H 1.854 5.199 -3.841 1.00 . A A . 21 LEU HB2 1 1 3 2098 1 1 21 LEU HB3 H 1.737 4.430 -2.269 1.00 . A A . 21 LEU HB3 1 1 3 2099 1 1 21 LEU HD11 H 0.487 6.681 -2.589 1.00 . A A . 21 LEU HD11 1 1 3 2100 1 1 21 LEU HD12 H 1.243 7.950 -1.626 1.00 . A A . 21 LEU HD12 1 1 3 2101 1 1 21 LEU HD13 H 1.534 7.870 -3.364 1.00 . A A . 21 LEU HD13 1 1 3 2102 1 1 21 LEU HD21 H 2.675 7.143 -0.228 1.00 . A A . 21 LEU HD21 1 1 3 2103 1 1 21 LEU HD22 H 2.110 5.477 -0.347 1.00 . A A . 21 LEU HD22 1 1 3 2104 1 1 21 LEU HD23 H 3.820 5.848 -0.574 1.00 . A A . 21 LEU HD23 1 1 3 2105 1 1 21 LEU HG H 3.443 6.866 -2.648 1.00 . A A . 21 LEU HG 1 1 3 2106 1 1 21 LEU N N 4.688 5.139 -3.675 1.00 . A A . 21 LEU N 1 1 3 2107 1 1 21 LEU O O 3.421 3.356 -5.402 1.00 . A A . 21 LEU O 1 1 3 2108 1 1 22 LEU C C 1.065 0.818 -4.522 1.00 . A A . 22 LEU C 1 1 3 2109 1 1 22 LEU CA C 2.577 0.878 -4.485 1.00 . A A . 22 LEU CA 1 1 3 2110 1 1 22 LEU CB C 3.137 -0.433 -3.928 1.00 . A A . 22 LEU CB 1 1 3 2111 1 1 22 LEU CD1 C 4.476 -0.751 -6.027 1.00 . A A . 22 LEU CD1 1 1 3 2112 1 1 22 LEU CD2 C 5.601 -0.058 -3.905 1.00 . A A . 22 LEU CD2 1 1 3 2113 1 1 22 LEU CG C 4.477 -0.875 -4.511 1.00 . A A . 22 LEU CG 1 1 3 2114 1 1 22 LEU H H 2.908 1.922 -2.689 1.00 . A A . 22 LEU H 1 1 3 2115 1 1 22 LEU HA H 2.955 1.033 -5.486 1.00 . A A . 22 LEU HA 1 1 3 2116 1 1 22 LEU HB2 H 3.252 -0.323 -2.860 1.00 . A A . 22 LEU HB2 1 1 3 2117 1 1 22 LEU HB3 H 2.416 -1.213 -4.115 1.00 . A A . 22 LEU HB3 1 1 3 2118 1 1 22 LEU HD11 H 5.036 0.126 -6.317 1.00 . A A . 22 LEU HD11 1 1 3 2119 1 1 22 LEU HD12 H 4.934 -1.629 -6.461 1.00 . A A . 22 LEU HD12 1 1 3 2120 1 1 22 LEU HD13 H 3.461 -0.662 -6.380 1.00 . A A . 22 LEU HD13 1 1 3 2121 1 1 22 LEU HD21 H 5.192 0.614 -3.165 1.00 . A A . 22 LEU HD21 1 1 3 2122 1 1 22 LEU HD22 H 6.313 -0.720 -3.436 1.00 . A A . 22 LEU HD22 1 1 3 2123 1 1 22 LEU HD23 H 6.091 0.511 -4.679 1.00 . A A . 22 LEU HD23 1 1 3 2124 1 1 22 LEU HG H 4.645 -1.911 -4.262 1.00 . A A . 22 LEU HG 1 1 3 2125 1 1 22 LEU N N 2.988 1.996 -3.666 1.00 . A A . 22 LEU N 1 1 3 2126 1 1 22 LEU O O 0.412 0.823 -3.475 1.00 . A A . 22 LEU O 1 1 3 2127 1 1 23 CYS C C -1.357 -0.746 -5.935 1.00 . A A . 23 CYS C 1 1 3 2128 1 1 23 CYS CA C -0.922 0.710 -5.893 1.00 . A A . 23 CYS CA 1 1 3 2129 1 1 23 CYS CB C -1.343 1.428 -7.176 1.00 . A A . 23 CYS CB 1 1 3 2130 1 1 23 CYS H H 1.094 0.790 -6.514 1.00 . A A . 23 CYS H 1 1 3 2131 1 1 23 CYS HA H -1.390 1.190 -5.046 1.00 . A A . 23 CYS HA 1 1 3 2132 1 1 23 CYS HB2 H -0.842 0.969 -8.015 1.00 . A A . 23 CYS HB2 1 1 3 2133 1 1 23 CYS HB3 H -2.411 1.326 -7.301 1.00 . A A . 23 CYS HB3 1 1 3 2134 1 1 23 CYS HG H 0.305 3.334 -7.610 1.00 . A A . 23 CYS HG 1 1 3 2135 1 1 23 CYS N N 0.514 0.787 -5.719 1.00 . A A . 23 CYS N 1 1 3 2136 1 1 23 CYS O O -0.665 -1.591 -6.511 1.00 . A A . 23 CYS O 1 1 3 2137 1 1 23 CYS SG S -0.950 3.195 -7.199 1.00 . A A . 23 CYS SG 1 1 3 2138 1 1 24 CYS C C -3.175 -3.022 -6.546 1.00 . A A . 24 CYS C 1 1 3 2139 1 1 24 CYS CA C -2.987 -2.390 -5.170 1.00 . A A . 24 CYS CA 1 1 3 2140 1 1 24 CYS CB C -4.332 -2.356 -4.465 1.00 . A A . 24 CYS CB 1 1 3 2141 1 1 24 CYS H H -2.909 -0.328 -4.758 1.00 . A A . 24 CYS H 1 1 3 2142 1 1 24 CYS HA H -2.298 -2.987 -4.594 1.00 . A A . 24 CYS HA 1 1 3 2143 1 1 24 CYS HB2 H -4.905 -1.531 -4.853 1.00 . A A . 24 CYS HB2 1 1 3 2144 1 1 24 CYS HB3 H -4.856 -3.277 -4.669 1.00 . A A . 24 CYS HB3 1 1 3 2145 1 1 24 CYS N N -2.459 -1.039 -5.261 1.00 . A A . 24 CYS N 1 1 3 2146 1 1 24 CYS O O -3.336 -2.326 -7.551 1.00 . A A . 24 CYS O 1 1 3 2147 1 1 24 CYS SG S -4.242 -2.159 -2.663 1.00 . A A . 24 CYS SG 1 1 3 2148 1 1 25 ASP C C -5.106 -5.163 -8.010 1.00 . A A . 25 ASP C 1 1 3 2149 1 1 25 ASP CA C -3.601 -5.066 -7.785 1.00 . A A . 25 ASP CA 1 1 3 2150 1 1 25 ASP CB C -2.998 -6.471 -7.738 1.00 . A A . 25 ASP CB 1 1 3 2151 1 1 25 ASP CG C -2.914 -7.106 -9.110 1.00 . A A . 25 ASP CG 1 1 3 2152 1 1 25 ASP H H -3.270 -4.828 -5.706 1.00 . A A . 25 ASP H 1 1 3 2153 1 1 25 ASP HA H -3.162 -4.522 -8.606 1.00 . A A . 25 ASP HA 1 1 3 2154 1 1 25 ASP HB2 H -2.002 -6.416 -7.325 1.00 . A A . 25 ASP HB2 1 1 3 2155 1 1 25 ASP HB3 H -3.610 -7.100 -7.108 1.00 . A A . 25 ASP HB3 1 1 3 2156 1 1 25 ASP N N -3.307 -4.339 -6.557 1.00 . A A . 25 ASP N 1 1 3 2157 1 1 25 ASP O O -5.562 -5.666 -9.036 1.00 . A A . 25 ASP O 1 1 3 2158 1 1 25 ASP OD1 O -2.338 -6.478 -10.022 1.00 . A A . 25 ASP OD1 1 1 3 2159 1 1 25 ASP OD2 O -3.419 -8.235 -9.287 1.00 . A A . 25 ASP OD2 1 1 3 2160 1 1 26 THR C C -7.987 -3.644 -6.286 1.00 . A A . 26 THR C 1 1 3 2161 1 1 26 THR CA C -7.328 -4.737 -7.136 1.00 . A A . 26 THR CA 1 1 3 2162 1 1 26 THR CB C -7.860 -6.133 -6.720 1.00 . A A . 26 THR CB 1 1 3 2163 1 1 26 THR CG2 C -7.109 -6.682 -5.513 1.00 . A A . 26 THR CG2 1 1 3 2164 1 1 26 THR H H -5.462 -4.275 -6.255 1.00 . A A . 26 THR H 1 1 3 2165 1 1 26 THR HA H -7.595 -4.573 -8.171 1.00 . A A . 26 THR HA 1 1 3 2166 1 1 26 THR HB H -7.710 -6.811 -7.548 1.00 . A A . 26 THR HB 1 1 3 2167 1 1 26 THR HG1 H -9.759 -6.096 -7.266 1.00 . A A . 26 THR HG1 1 1 3 2168 1 1 26 THR HG21 H -7.730 -7.397 -4.995 1.00 . A A . 26 THR HG21 1 1 3 2169 1 1 26 THR HG22 H -6.859 -5.871 -4.845 1.00 . A A . 26 THR HG22 1 1 3 2170 1 1 26 THR HG23 H -6.202 -7.166 -5.844 1.00 . A A . 26 THR HG23 1 1 3 2171 1 1 26 THR N N -5.877 -4.680 -7.044 1.00 . A A . 26 THR N 1 1 3 2172 1 1 26 THR O O -8.871 -2.928 -6.760 1.00 . A A . 26 THR O 1 1 3 2173 1 1 26 THR OG1 O -9.262 -6.074 -6.429 1.00 . A A . 26 THR OG1 1 1 3 2174 1 1 27 CYS C C -7.719 -1.192 -4.322 1.00 . A A . 27 CYS C 1 1 3 2175 1 1 27 CYS CA C -8.206 -2.630 -4.082 1.00 . A A . 27 CYS CA 1 1 3 2176 1 1 27 CYS CB C -7.874 -3.102 -2.671 1.00 . A A . 27 CYS CB 1 1 3 2177 1 1 27 CYS H H -6.943 -4.202 -4.674 1.00 . A A . 27 CYS H 1 1 3 2178 1 1 27 CYS HA H -9.277 -2.665 -4.220 1.00 . A A . 27 CYS HA 1 1 3 2179 1 1 27 CYS HB2 H -7.280 -2.348 -2.175 1.00 . A A . 27 CYS HB2 1 1 3 2180 1 1 27 CYS HB3 H -8.792 -3.252 -2.122 1.00 . A A . 27 CYS HB3 1 1 3 2181 1 1 27 CYS N N -7.604 -3.564 -5.018 1.00 . A A . 27 CYS N 1 1 3 2182 1 1 27 CYS O O -6.847 -0.958 -5.156 1.00 . A A . 27 CYS O 1 1 3 2183 1 1 27 CYS SG S -6.938 -4.667 -2.638 1.00 . A A . 27 CYS SG 1 1 3 2184 1 1 28 PRO C C -7.119 1.773 -2.814 1.00 . A A . 28 PRO C 1 1 3 2185 1 1 28 PRO CA C -8.043 1.206 -3.894 1.00 . A A . 28 PRO CA 1 1 3 2186 1 1 28 PRO CB C -9.423 1.848 -3.811 1.00 . A A . 28 PRO CB 1 1 3 2187 1 1 28 PRO CD C -9.532 -0.350 -2.806 1.00 . A A . 28 PRO CD 1 1 3 2188 1 1 28 PRO CG C -10.167 1.023 -2.811 1.00 . A A . 28 PRO CG 1 1 3 2189 1 1 28 PRO HA H -7.615 1.380 -4.870 1.00 . A A . 28 PRO HA 1 1 3 2190 1 1 28 PRO HB2 H -9.327 2.874 -3.485 1.00 . A A . 28 PRO HB2 1 1 3 2191 1 1 28 PRO HB3 H -9.898 1.815 -4.781 1.00 . A A . 28 PRO HB3 1 1 3 2192 1 1 28 PRO HD2 H -9.232 -0.621 -1.806 1.00 . A A . 28 PRO HD2 1 1 3 2193 1 1 28 PRO HD3 H -10.219 -1.083 -3.205 1.00 . A A . 28 PRO HD3 1 1 3 2194 1 1 28 PRO HG2 H -10.080 1.475 -1.833 1.00 . A A . 28 PRO HG2 1 1 3 2195 1 1 28 PRO HG3 H -11.206 0.953 -3.097 1.00 . A A . 28 PRO HG3 1 1 3 2196 1 1 28 PRO N N -8.359 -0.201 -3.684 1.00 . A A . 28 PRO N 1 1 3 2197 1 1 28 PRO O O -7.384 2.838 -2.254 1.00 . A A . 28 PRO O 1 1 3 2198 1 1 29 SER C C -3.757 1.737 -1.968 1.00 . A A . 29 SER C 1 1 3 2199 1 1 29 SER CA C -5.158 1.460 -1.424 1.00 . A A . 29 SER CA 1 1 3 2200 1 1 29 SER CB C -5.094 0.381 -0.341 1.00 . A A . 29 SER CB 1 1 3 2201 1 1 29 SER H H -5.929 0.168 -2.913 1.00 . A A . 29 SER H 1 1 3 2202 1 1 29 SER HA H -5.551 2.368 -0.989 1.00 . A A . 29 SER HA 1 1 3 2203 1 1 29 SER HB2 H -4.064 0.095 -0.183 1.00 . A A . 29 SER HB2 1 1 3 2204 1 1 29 SER HB3 H -5.507 0.767 0.579 1.00 . A A . 29 SER HB3 1 1 3 2205 1 1 29 SER HG H -5.344 -1.232 -1.433 1.00 . A A . 29 SER HG 1 1 3 2206 1 1 29 SER N N -6.068 1.039 -2.480 1.00 . A A . 29 SER N 1 1 3 2207 1 1 29 SER O O -3.379 1.239 -3.030 1.00 . A A . 29 SER O 1 1 3 2208 1 1 29 SER OG O -5.833 -0.765 -0.730 1.00 . A A . 29 SER OG 1 1 3 2209 1 1 30 SER C C -0.700 2.523 -0.382 1.00 . A A . 30 SER C 1 1 3 2210 1 1 30 SER CA C -1.616 2.818 -1.571 1.00 . A A . 30 SER CA 1 1 3 2211 1 1 30 SER CB C -1.483 4.281 -1.999 1.00 . A A . 30 SER CB 1 1 3 2212 1 1 30 SER H H -3.355 2.884 -0.384 1.00 . A A . 30 SER H 1 1 3 2213 1 1 30 SER HA H -1.337 2.180 -2.397 1.00 . A A . 30 SER HA 1 1 3 2214 1 1 30 SER HB2 H -1.124 4.867 -1.165 1.00 . A A . 30 SER HB2 1 1 3 2215 1 1 30 SER HB3 H -0.777 4.351 -2.815 1.00 . A A . 30 SER HB3 1 1 3 2216 1 1 30 SER HG H -2.597 5.726 -2.722 1.00 . A A . 30 SER HG 1 1 3 2217 1 1 30 SER N N -2.993 2.517 -1.218 1.00 . A A . 30 SER N 1 1 3 2218 1 1 30 SER O O -1.008 2.891 0.757 1.00 . A A . 30 SER O 1 1 3 2219 1 1 30 SER OG O -2.729 4.813 -2.428 1.00 . A A . 30 SER OG 1 1 3 2220 1 1 31 TYR C C 2.694 1.730 0.147 1.00 . A A . 31 TYR C 1 1 3 2221 1 1 31 TYR CA C 1.255 1.348 0.448 1.00 . A A . 31 TYR CA 1 1 3 2222 1 1 31 TYR CB C 1.179 -0.169 0.639 1.00 . A A . 31 TYR CB 1 1 3 2223 1 1 31 TYR CD1 C -0.693 -0.319 2.316 1.00 . A A . 31 TYR CD1 1 1 3 2224 1 1 31 TYR CD2 C -0.918 -1.511 0.266 1.00 . A A . 31 TYR CD2 1 1 3 2225 1 1 31 TYR CE1 C -1.926 -0.782 2.725 1.00 . A A . 31 TYR CE1 1 1 3 2226 1 1 31 TYR CE2 C -2.151 -1.978 0.667 1.00 . A A . 31 TYR CE2 1 1 3 2227 1 1 31 TYR CG C -0.171 -0.672 1.082 1.00 . A A . 31 TYR CG 1 1 3 2228 1 1 31 TYR CZ C -2.652 -1.611 1.897 1.00 . A A . 31 TYR CZ 1 1 3 2229 1 1 31 TYR H H 0.515 1.433 -1.537 1.00 . A A . 31 TYR H 1 1 3 2230 1 1 31 TYR HA H 0.942 1.837 1.360 1.00 . A A . 31 TYR HA 1 1 3 2231 1 1 31 TYR HB2 H 1.418 -0.651 -0.297 1.00 . A A . 31 TYR HB2 1 1 3 2232 1 1 31 TYR HB3 H 1.903 -0.465 1.383 1.00 . A A . 31 TYR HB3 1 1 3 2233 1 1 31 TYR HD1 H -0.122 0.332 2.961 1.00 . A A . 31 TYR HD1 1 1 3 2234 1 1 31 TYR HD2 H -0.523 -1.795 -0.698 1.00 . A A . 31 TYR HD2 1 1 3 2235 1 1 31 TYR HE1 H -2.316 -0.493 3.689 1.00 . A A . 31 TYR HE1 1 1 3 2236 1 1 31 TYR HE2 H -2.713 -2.634 0.022 1.00 . A A . 31 TYR HE2 1 1 3 2237 1 1 31 TYR HH H -4.245 -2.658 1.606 1.00 . A A . 31 TYR HH 1 1 3 2238 1 1 31 TYR N N 0.362 1.770 -0.624 1.00 . A A . 31 TYR N 1 1 3 2239 1 1 31 TYR O O 3.067 1.882 -1.009 1.00 . A A . 31 TYR O 1 1 3 2240 1 1 31 TYR OH O -3.883 -2.072 2.297 1.00 . A A . 31 TYR OH 1 1 3 2241 1 1 32 HIS C C 5.529 0.361 1.015 1.00 . A A . 32 HIS C 1 1 3 2242 1 1 32 HIS CA C 4.965 1.769 0.977 1.00 . A A . 32 HIS CA 1 1 3 2243 1 1 32 HIS CB C 5.626 2.604 2.073 1.00 . A A . 32 HIS CB 1 1 3 2244 1 1 32 HIS CD2 C 6.127 4.769 0.756 1.00 . A A . 32 HIS CD2 1 1 3 2245 1 1 32 HIS CE1 C 5.344 6.165 2.238 1.00 . A A . 32 HIS CE1 1 1 3 2246 1 1 32 HIS CG C 5.645 4.077 1.815 1.00 . A A . 32 HIS CG 1 1 3 2247 1 1 32 HIS H H 3.191 1.380 2.040 1.00 . A A . 32 HIS H 1 1 3 2248 1 1 32 HIS HA H 5.155 2.211 0.010 1.00 . A A . 32 HIS HA 1 1 3 2249 1 1 32 HIS HB2 H 5.099 2.441 3.001 1.00 . A A . 32 HIS HB2 1 1 3 2250 1 1 32 HIS HB3 H 6.649 2.274 2.190 1.00 . A A . 32 HIS HB3 1 1 3 2251 1 1 32 HIS HD2 H 6.579 4.358 -0.135 1.00 . A A . 32 HIS HD2 1 1 3 2252 1 1 32 HIS HE1 H 5.052 7.080 2.731 1.00 . A A . 32 HIS HE1 1 1 3 2253 1 1 32 HIS HE2 H 6.382 6.852 0.572 1.00 . A A . 32 HIS HE2 1 1 3 2254 1 1 32 HIS N N 3.529 1.678 1.172 1.00 . A A . 32 HIS N 1 1 3 2255 1 1 32 HIS ND1 N 5.156 4.960 2.736 1.00 . A A . 32 HIS ND1 1 1 3 2256 1 1 32 HIS NE2 N 5.934 6.104 1.030 1.00 . A A . 32 HIS NE2 1 1 3 2257 1 1 32 HIS O O 4.952 -0.511 1.662 1.00 . A A . 32 HIS O 1 1 3 2258 1 1 33 ILE C C 7.600 -1.688 1.686 1.00 . A A . 33 ILE C 1 1 3 2259 1 1 33 ILE CA C 7.247 -1.187 0.288 1.00 . A A . 33 ILE CA 1 1 3 2260 1 1 33 ILE CB C 8.515 -1.213 -0.591 1.00 . A A . 33 ILE CB 1 1 3 2261 1 1 33 ILE CD1 C 10.551 0.156 -1.288 1.00 . A A . 33 ILE CD1 1 1 3 2262 1 1 33 ILE CG1 C 9.207 0.155 -0.589 1.00 . A A . 33 ILE CG1 1 1 3 2263 1 1 33 ILE CG2 C 8.163 -1.639 -2.010 1.00 . A A . 33 ILE CG2 1 1 3 2264 1 1 33 ILE H H 7.045 0.870 -0.179 1.00 . A A . 33 ILE H 1 1 3 2265 1 1 33 ILE HA H 6.527 -1.866 -0.146 1.00 . A A . 33 ILE HA 1 1 3 2266 1 1 33 ILE HB H 9.192 -1.949 -0.181 1.00 . A A . 33 ILE HB 1 1 3 2267 1 1 33 ILE HD11 H 10.411 -0.052 -2.338 1.00 . A A . 33 ILE HD11 1 1 3 2268 1 1 33 ILE HD12 H 11.018 1.122 -1.171 1.00 . A A . 33 ILE HD12 1 1 3 2269 1 1 33 ILE HD13 H 11.181 -0.604 -0.852 1.00 . A A . 33 ILE HD13 1 1 3 2270 1 1 33 ILE HG12 H 8.573 0.872 -1.088 1.00 . A A . 33 ILE HG12 1 1 3 2271 1 1 33 ILE HG21 H 7.238 -1.169 -2.306 1.00 . A A . 33 ILE HG21 1 1 3 2272 1 1 33 ILE HG22 H 8.951 -1.338 -2.685 1.00 . A A . 33 ILE HG22 1 1 3 2273 1 1 33 ILE HG23 H 8.048 -2.713 -2.046 1.00 . A A . 33 ILE HG23 1 1 3 2274 1 1 33 ILE N N 6.638 0.137 0.330 1.00 . A A . 33 ILE N 1 1 3 2275 1 1 33 ILE O O 7.441 -2.868 1.985 1.00 . A A . 33 ILE O 1 1 3 2276 1 1 34 HIS C C 7.472 -0.776 4.940 1.00 . A A . 34 HIS C 1 1 3 2277 1 1 34 HIS CA C 8.504 -1.170 3.880 1.00 . A A . 34 HIS CA 1 1 3 2278 1 1 34 HIS CB C 9.875 -0.550 4.203 1.00 . A A . 34 HIS CB 1 1 3 2279 1 1 34 HIS CD2 C 9.586 1.842 3.250 1.00 . A A . 34 HIS CD2 1 1 3 2280 1 1 34 HIS CE1 C 10.185 2.927 5.042 1.00 . A A . 34 HIS CE1 1 1 3 2281 1 1 34 HIS CG C 9.895 0.953 4.228 1.00 . A A . 34 HIS CG 1 1 3 2282 1 1 34 HIS H H 8.183 0.137 2.247 1.00 . A A . 34 HIS H 1 1 3 2283 1 1 34 HIS HA H 8.606 -2.245 3.893 1.00 . A A . 34 HIS HA 1 1 3 2284 1 1 34 HIS HB2 H 10.195 -0.896 5.175 1.00 . A A . 34 HIS HB2 1 1 3 2285 1 1 34 HIS HB3 H 10.589 -0.878 3.462 1.00 . A A . 34 HIS HB3 1 1 3 2286 1 1 34 HIS HD2 H 9.254 1.613 2.248 1.00 . A A . 34 HIS HD2 1 1 3 2287 1 1 34 HIS HE1 H 10.413 3.735 5.719 1.00 . A A . 34 HIS HE1 1 1 3 2288 1 1 34 HIS HE2 H 9.493 3.946 3.362 1.00 . A A . 34 HIS HE2 1 1 3 2289 1 1 34 HIS N N 8.079 -0.791 2.537 1.00 . A A . 34 HIS N 1 1 3 2290 1 1 34 HIS ND1 N 10.272 1.645 5.356 1.00 . A A . 34 HIS ND1 1 1 3 2291 1 1 34 HIS NE2 N 9.774 3.092 3.777 1.00 . A A . 34 HIS NE2 1 1 3 2292 1 1 34 HIS O O 7.760 -0.816 6.137 1.00 . A A . 34 HIS O 1 1 3 2293 1 1 35 CYS C C 4.213 -1.272 5.599 1.00 . A A . 35 CYS C 1 1 3 2294 1 1 35 CYS CA C 5.195 -0.114 5.447 1.00 . A A . 35 CYS CA 1 1 3 2295 1 1 35 CYS CB C 4.485 1.169 5.005 1.00 . A A . 35 CYS CB 1 1 3 2296 1 1 35 CYS H H 6.061 -0.489 3.551 1.00 . A A . 35 CYS H 1 1 3 2297 1 1 35 CYS HA H 5.659 0.061 6.406 1.00 . A A . 35 CYS HA 1 1 3 2298 1 1 35 CYS HB2 H 4.338 1.144 3.936 1.00 . A A . 35 CYS HB2 1 1 3 2299 1 1 35 CYS HB3 H 3.524 1.236 5.498 1.00 . A A . 35 CYS HB3 1 1 3 2300 1 1 35 CYS N N 6.258 -0.456 4.510 1.00 . A A . 35 CYS N 1 1 3 2301 1 1 35 CYS O O 3.286 -1.219 6.408 1.00 . A A . 35 CYS O 1 1 3 2302 1 1 35 CYS SG S 5.425 2.677 5.406 1.00 . A A . 35 CYS SG 1 1 3 2303 1 1 36 LEU C C 4.461 -4.492 6.102 1.00 . A A . 36 LEU C 1 1 3 2304 1 1 36 LEU CA C 3.755 -3.592 5.098 1.00 . A A . 36 LEU CA 1 1 3 2305 1 1 36 LEU CB C 3.601 -4.312 3.757 1.00 . A A . 36 LEU CB 1 1 3 2306 1 1 36 LEU CD1 C 3.785 -3.789 1.310 1.00 . A A . 36 LEU CD1 1 1 3 2307 1 1 36 LEU CD2 C 1.582 -3.588 2.455 1.00 . A A . 36 LEU CD2 1 1 3 2308 1 1 36 LEU CG C 3.087 -3.438 2.612 1.00 . A A . 36 LEU CG 1 1 3 2309 1 1 36 LEU H H 5.328 -2.384 4.389 1.00 . A A . 36 LEU H 1 1 3 2310 1 1 36 LEU HA H 2.778 -3.334 5.479 1.00 . A A . 36 LEU HA 1 1 3 2311 1 1 36 LEU HB2 H 4.566 -4.711 3.476 1.00 . A A . 36 LEU HB2 1 1 3 2312 1 1 36 LEU HB3 H 2.915 -5.134 3.890 1.00 . A A . 36 LEU HB3 1 1 3 2313 1 1 36 LEU HD11 H 4.367 -4.688 1.443 1.00 . A A . 36 LEU HD11 1 1 3 2314 1 1 36 LEU HD12 H 3.043 -3.951 0.541 1.00 . A A . 36 LEU HD12 1 1 3 2315 1 1 36 LEU HD13 H 4.434 -2.976 1.018 1.00 . A A . 36 LEU HD13 1 1 3 2316 1 1 36 LEU HD21 H 1.091 -2.714 2.853 1.00 . A A . 36 LEU HD21 1 1 3 2317 1 1 36 LEU HD22 H 1.339 -3.694 1.407 1.00 . A A . 36 LEU HD22 1 1 3 2318 1 1 36 LEU HD23 H 1.249 -4.464 2.992 1.00 . A A . 36 LEU HD23 1 1 3 2319 1 1 36 LEU HG H 3.301 -2.403 2.836 1.00 . A A . 36 LEU HG 1 1 3 2320 1 1 36 LEU N N 4.513 -2.367 4.928 1.00 . A A . 36 LEU N 1 1 3 2321 1 1 36 LEU O O 5.629 -4.263 6.431 1.00 . A A . 36 LEU O 1 1 3 2322 1 1 37 ARG C C 5.578 -7.180 6.858 1.00 . A A . 37 ARG C 1 1 3 2323 1 1 37 ARG CA C 4.375 -6.475 7.501 1.00 . A A . 37 ARG CA 1 1 3 2324 1 1 37 ARG CB C 3.343 -7.489 7.995 1.00 . A A . 37 ARG CB 1 1 3 2325 1 1 37 ARG CD C 2.497 -7.826 10.338 1.00 . A A . 37 ARG CD 1 1 3 2326 1 1 37 ARG CG C 2.447 -6.950 9.098 1.00 . A A . 37 ARG CG 1 1 3 2327 1 1 37 ARG CZ C 2.709 -10.289 10.232 1.00 . A A . 37 ARG CZ 1 1 3 2328 1 1 37 ARG H H 2.848 -5.674 6.253 1.00 . A A . 37 ARG H 1 1 3 2329 1 1 37 ARG HA H 4.732 -5.907 8.348 1.00 . A A . 37 ARG HA 1 1 3 2330 1 1 37 ARG HB2 H 2.718 -7.785 7.165 1.00 . A A . 37 ARG HB2 1 1 3 2331 1 1 37 ARG HB3 H 3.859 -8.358 8.375 1.00 . A A . 37 ARG HB3 1 1 3 2332 1 1 37 ARG HD2 H 3.522 -7.894 10.675 1.00 . A A . 37 ARG HD2 1 1 3 2333 1 1 37 ARG HD3 H 1.894 -7.369 11.109 1.00 . A A . 37 ARG HD3 1 1 3 2334 1 1 37 ARG HE H 1.069 -9.253 9.743 1.00 . A A . 37 ARG HE 1 1 3 2335 1 1 37 ARG HG2 H 2.770 -5.954 9.361 1.00 . A A . 37 ARG HG2 1 1 3 2336 1 1 37 ARG HG3 H 1.429 -6.916 8.736 1.00 . A A . 37 ARG HG3 1 1 3 2337 1 1 37 ARG HH11 H 4.364 -9.336 10.919 1.00 . A A . 37 ARG HH11 1 1 3 2338 1 1 37 ARG HH12 H 4.490 -11.070 10.816 1.00 . A A . 37 ARG HH12 1 1 3 2339 1 1 37 ARG HH21 H 1.233 -11.512 9.573 1.00 . A A . 37 ARG HH21 1 1 3 2340 1 1 37 ARG HH22 H 2.704 -12.316 10.051 1.00 . A A . 37 ARG HH22 1 1 3 2341 1 1 37 ARG N N 3.773 -5.526 6.569 1.00 . A A . 37 ARG N 1 1 3 2342 1 1 37 ARG NE N 1.993 -9.175 10.074 1.00 . A A . 37 ARG NE 1 1 3 2343 1 1 37 ARG NH1 N 3.951 -10.226 10.692 1.00 . A A . 37 ARG NH1 1 1 3 2344 1 1 37 ARG NH2 N 2.173 -11.465 9.929 1.00 . A A . 37 ARG NH2 1 1 3 2345 1 1 37 ARG O O 6.697 -7.065 7.364 1.00 . A A . 37 ARG O 1 1 3 2346 1 1 38 PRO C C 7.249 -7.269 4.143 1.00 . A A . 38 PRO C 1 1 3 2347 1 1 38 PRO CA C 6.521 -8.368 4.912 1.00 . A A . 38 PRO CA 1 1 3 2348 1 1 38 PRO CB C 5.848 -9.358 3.945 1.00 . A A . 38 PRO CB 1 1 3 2349 1 1 38 PRO CD C 4.161 -7.954 4.917 1.00 . A A . 38 PRO CD 1 1 3 2350 1 1 38 PRO CG C 4.376 -9.253 4.200 1.00 . A A . 38 PRO CG 1 1 3 2351 1 1 38 PRO HA H 7.219 -8.889 5.551 1.00 . A A . 38 PRO HA 1 1 3 2352 1 1 38 PRO HB2 H 6.089 -9.086 2.928 1.00 . A A . 38 PRO HB2 1 1 3 2353 1 1 38 PRO HB3 H 6.211 -10.355 4.147 1.00 . A A . 38 PRO HB3 1 1 3 2354 1 1 38 PRO HD2 H 4.035 -7.145 4.212 1.00 . A A . 38 PRO HD2 1 1 3 2355 1 1 38 PRO HD3 H 3.312 -8.019 5.581 1.00 . A A . 38 PRO HD3 1 1 3 2356 1 1 38 PRO HG2 H 3.841 -9.255 3.261 1.00 . A A . 38 PRO HG2 1 1 3 2357 1 1 38 PRO HG3 H 4.053 -10.080 4.816 1.00 . A A . 38 PRO HG3 1 1 3 2358 1 1 38 PRO N N 5.409 -7.809 5.672 1.00 . A A . 38 PRO N 1 1 3 2359 1 1 38 PRO O O 7.153 -7.181 2.917 1.00 . A A . 38 PRO O 1 1 3 2360 1 1 39 ALA C C 9.469 -5.468 3.262 1.00 . A A . 39 ALA C 1 1 3 2361 1 1 39 ALA CA C 8.448 -5.147 4.347 1.00 . A A . 39 ALA CA 1 1 3 2362 1 1 39 ALA CB C 9.097 -4.332 5.455 1.00 . A A . 39 ALA CB 1 1 3 2363 1 1 39 ALA H H 7.760 -6.430 5.876 1.00 . A A . 39 ALA H 1 1 3 2364 1 1 39 ALA HA H 7.661 -4.548 3.915 1.00 . A A . 39 ALA HA 1 1 3 2365 1 1 39 ALA HB1 H 9.403 -3.374 5.063 1.00 . A A . 39 ALA HB1 1 1 3 2366 1 1 39 ALA HB2 H 8.388 -4.184 6.255 1.00 . A A . 39 ALA HB2 1 1 3 2367 1 1 39 ALA HB3 H 9.962 -4.859 5.833 1.00 . A A . 39 ALA HB3 1 1 3 2368 1 1 39 ALA N N 7.835 -6.347 4.900 1.00 . A A . 39 ALA N 1 1 3 2369 1 1 39 ALA O O 10.312 -6.356 3.422 1.00 . A A . 39 ALA O 1 1 3 2370 1 1 40 LEU C C 11.228 -3.599 1.012 1.00 . A A . 40 LEU C 1 1 3 2371 1 1 40 LEU CA C 10.351 -4.843 1.085 1.00 . A A . 40 LEU CA 1 1 3 2372 1 1 40 LEU CB C 9.615 -5.039 -0.245 1.00 . A A . 40 LEU CB 1 1 3 2373 1 1 40 LEU CD1 C 7.134 -5.290 -0.530 1.00 . A A . 40 LEU CD1 1 1 3 2374 1 1 40 LEU CD2 C 8.661 -7.166 -1.159 1.00 . A A . 40 LEU CD2 1 1 3 2375 1 1 40 LEU CG C 8.434 -6.009 -0.200 1.00 . A A . 40 LEU CG 1 1 3 2376 1 1 40 LEU H H 8.722 -4.006 2.133 1.00 . A A . 40 LEU H 1 1 3 2377 1 1 40 LEU HA H 10.973 -5.704 1.280 1.00 . A A . 40 LEU HA 1 1 3 2378 1 1 40 LEU HB2 H 9.251 -4.076 -0.573 1.00 . A A . 40 LEU HB2 1 1 3 2379 1 1 40 LEU HB3 H 10.324 -5.403 -0.972 1.00 . A A . 40 LEU HB3 1 1 3 2380 1 1 40 LEU HD11 H 7.329 -4.236 -0.662 1.00 . A A . 40 LEU HD11 1 1 3 2381 1 1 40 LEU HD12 H 6.720 -5.696 -1.442 1.00 . A A . 40 LEU HD12 1 1 3 2382 1 1 40 LEU HD13 H 6.431 -5.428 0.276 1.00 . A A . 40 LEU HD13 1 1 3 2383 1 1 40 LEU HD21 H 7.710 -7.512 -1.535 1.00 . A A . 40 LEU HD21 1 1 3 2384 1 1 40 LEU HD22 H 9.277 -6.836 -1.982 1.00 . A A . 40 LEU HD22 1 1 3 2385 1 1 40 LEU HD23 H 9.157 -7.971 -0.639 1.00 . A A . 40 LEU HD23 1 1 3 2386 1 1 40 LEU HG H 8.348 -6.412 0.799 1.00 . A A . 40 LEU HG 1 1 3 2387 1 1 40 LEU N N 9.406 -4.711 2.180 1.00 . A A . 40 LEU N 1 1 3 2388 1 1 40 LEU O O 10.808 -2.511 1.403 1.00 . A A . 40 LEU O 1 1 3 2389 1 1 41 TYR C C 13.574 -2.295 -1.071 1.00 . A A . 41 TYR C 1 1 3 2390 1 1 41 TYR CA C 13.376 -2.657 0.393 1.00 . A A . 41 TYR CA 1 1 3 2391 1 1 41 TYR CB C 14.718 -3.035 1.029 1.00 . A A . 41 TYR CB 1 1 3 2392 1 1 41 TYR CD1 C 13.747 -2.213 3.230 1.00 . A A . 41 TYR CD1 1 1 3 2393 1 1 41 TYR CD2 C 16.018 -2.939 3.189 1.00 . A A . 41 TYR CD2 1 1 3 2394 1 1 41 TYR CE1 C 13.859 -1.929 4.579 1.00 . A A . 41 TYR CE1 1 1 3 2395 1 1 41 TYR CE2 C 16.135 -2.661 4.537 1.00 . A A . 41 TYR CE2 1 1 3 2396 1 1 41 TYR CG C 14.824 -2.722 2.511 1.00 . A A . 41 TYR CG 1 1 3 2397 1 1 41 TYR CZ C 15.054 -2.158 5.227 1.00 . A A . 41 TYR CZ 1 1 3 2398 1 1 41 TYR H H 12.717 -4.663 0.211 1.00 . A A . 41 TYR H 1 1 3 2399 1 1 41 TYR HA H 12.961 -1.808 0.910 1.00 . A A . 41 TYR HA 1 1 3 2400 1 1 41 TYR HB2 H 14.873 -4.096 0.910 1.00 . A A . 41 TYR HB2 1 1 3 2401 1 1 41 TYR HB3 H 15.509 -2.503 0.521 1.00 . A A . 41 TYR HB3 1 1 3 2402 1 1 41 TYR HD1 H 12.810 -2.041 2.725 1.00 . A A . 41 TYR HD1 1 1 3 2403 1 1 41 TYR HD2 H 16.864 -3.332 2.646 1.00 . A A . 41 TYR HD2 1 1 3 2404 1 1 41 TYR HE1 H 13.013 -1.532 5.119 1.00 . A A . 41 TYR HE1 1 1 3 2405 1 1 41 TYR HE2 H 17.071 -2.842 5.046 1.00 . A A . 41 TYR HE2 1 1 3 2406 1 1 41 TYR HH H 14.325 -2.048 7.012 1.00 . A A . 41 TYR HH 1 1 3 2407 1 1 41 TYR N N 12.440 -3.765 0.512 1.00 . A A . 41 TYR N 1 1 3 2408 1 1 41 TYR O O 14.302 -1.356 -1.402 1.00 . A A . 41 TYR O 1 1 3 2409 1 1 41 TYR OH O 15.172 -1.872 6.569 1.00 . A A . 41 TYR OH 1 1 3 2410 1 1 42 GLU C C 11.584 -2.689 -3.954 1.00 . A A . 42 GLU C 1 1 3 2411 1 1 42 GLU CA C 12.984 -2.805 -3.369 1.00 . A A . 42 GLU CA 1 1 3 2412 1 1 42 GLU CB C 13.746 -3.944 -4.048 1.00 . A A . 42 GLU CB 1 1 3 2413 1 1 42 GLU CD C 14.900 -4.704 -6.161 1.00 . A A . 42 GLU CD 1 1 3 2414 1 1 42 GLU CG C 14.480 -3.524 -5.311 1.00 . A A . 42 GLU CG 1 1 3 2415 1 1 42 GLU H H 12.335 -3.761 -1.604 1.00 . A A . 42 GLU H 1 1 3 2416 1 1 42 GLU HA H 13.511 -1.877 -3.530 1.00 . A A . 42 GLU HA 1 1 3 2417 1 1 42 GLU HB2 H 14.467 -4.341 -3.352 1.00 . A A . 42 GLU HB2 1 1 3 2418 1 1 42 GLU HB3 H 13.045 -4.724 -4.309 1.00 . A A . 42 GLU HB3 1 1 3 2419 1 1 42 GLU HG2 H 13.828 -2.894 -5.897 1.00 . A A . 42 GLU HG2 1 1 3 2420 1 1 42 GLU HG3 H 15.363 -2.967 -5.032 1.00 . A A . 42 GLU HG3 1 1 3 2421 1 1 42 GLU N N 12.910 -3.038 -1.938 1.00 . A A . 42 GLU N 1 1 3 2422 1 1 42 GLU O O 10.661 -3.375 -3.515 1.00 . A A . 42 GLU O 1 1 3 2423 1 1 42 GLU OE1 O 14.068 -5.604 -6.395 1.00 . A A . 42 GLU OE1 1 1 3 2424 1 1 42 GLU OE2 O 16.068 -4.740 -6.599 1.00 . A A . 42 GLU OE2 1 1 3 2425 1 1 43 VAL C C 9.888 -2.721 -6.614 1.00 . A A . 43 VAL C 1 1 3 2426 1 1 43 VAL CA C 10.143 -1.618 -5.580 1.00 . A A . 43 VAL CA 1 1 3 2427 1 1 43 VAL CB C 10.057 -0.211 -6.237 1.00 . A A . 43 VAL CB 1 1 3 2428 1 1 43 VAL CG1 C 10.593 -0.216 -7.663 1.00 . A A . 43 VAL CG1 1 1 3 2429 1 1 43 VAL CG2 C 8.629 0.313 -6.208 1.00 . A A . 43 VAL CG2 1 1 3 2430 1 1 43 VAL H H 12.207 -1.296 -5.243 1.00 . A A . 43 VAL H 1 1 3 2431 1 1 43 VAL HA H 9.383 -1.679 -4.815 1.00 . A A . 43 VAL HA 1 1 3 2432 1 1 43 VAL HB H 10.670 0.464 -5.658 1.00 . A A . 43 VAL HB 1 1 3 2433 1 1 43 VAL HG11 H 9.769 -0.125 -8.356 1.00 . A A . 43 VAL HG11 1 1 3 2434 1 1 43 VAL HG12 H 11.272 0.612 -7.797 1.00 . A A . 43 VAL HG12 1 1 3 2435 1 1 43 VAL HG13 H 11.115 -1.143 -7.845 1.00 . A A . 43 VAL HG13 1 1 3 2436 1 1 43 VAL HG21 H 8.124 -0.066 -5.331 1.00 . A A . 43 VAL HG21 1 1 3 2437 1 1 43 VAL HG22 H 8.641 1.393 -6.177 1.00 . A A . 43 VAL HG22 1 1 3 2438 1 1 43 VAL HG23 H 8.106 -0.015 -7.094 1.00 . A A . 43 VAL HG23 1 1 3 2439 1 1 43 VAL N N 11.430 -1.816 -4.935 1.00 . A A . 43 VAL N 1 1 3 2440 1 1 43 VAL O O 10.816 -3.171 -7.293 1.00 . A A . 43 VAL O 1 1 3 2441 1 1 44 PRO C C 8.382 -3.922 -9.038 1.00 . A A . 44 PRO C 1 1 3 2442 1 1 44 PRO CA C 8.307 -4.356 -7.572 1.00 . A A . 44 PRO CA 1 1 3 2443 1 1 44 PRO CB C 6.862 -4.700 -7.188 1.00 . A A . 44 PRO CB 1 1 3 2444 1 1 44 PRO CD C 7.546 -2.923 -5.762 1.00 . A A . 44 PRO CD 1 1 3 2445 1 1 44 PRO CG C 6.683 -4.147 -5.818 1.00 . A A . 44 PRO CG 1 1 3 2446 1 1 44 PRO HA H 8.940 -5.220 -7.423 1.00 . A A . 44 PRO HA 1 1 3 2447 1 1 44 PRO HB2 H 6.182 -4.241 -7.890 1.00 . A A . 44 PRO HB2 1 1 3 2448 1 1 44 PRO HB3 H 6.729 -5.772 -7.201 1.00 . A A . 44 PRO HB3 1 1 3 2449 1 1 44 PRO HD2 H 7.004 -2.063 -6.127 1.00 . A A . 44 PRO HD2 1 1 3 2450 1 1 44 PRO HD3 H 7.898 -2.752 -4.756 1.00 . A A . 44 PRO HD3 1 1 3 2451 1 1 44 PRO HG2 H 5.647 -3.887 -5.660 1.00 . A A . 44 PRO HG2 1 1 3 2452 1 1 44 PRO HG3 H 7.006 -4.869 -5.081 1.00 . A A . 44 PRO HG3 1 1 3 2453 1 1 44 PRO N N 8.661 -3.263 -6.659 1.00 . A A . 44 PRO N 1 1 3 2454 1 1 44 PRO O O 8.286 -2.734 -9.350 1.00 . A A . 44 PRO O 1 1 3 2455 1 1 45 ASP C C 7.244 -4.265 -11.921 1.00 . A A . 45 ASP C 1 1 3 2456 1 1 45 ASP CA C 8.617 -4.616 -11.357 1.00 . A A . 45 ASP CA 1 1 3 2457 1 1 45 ASP CB C 9.196 -5.827 -12.094 1.00 . A A . 45 ASP CB 1 1 3 2458 1 1 45 ASP CG C 8.927 -5.792 -13.585 1.00 . A A . 45 ASP CG 1 1 3 2459 1 1 45 ASP H H 8.575 -5.821 -9.618 1.00 . A A . 45 ASP H 1 1 3 2460 1 1 45 ASP HA H 9.276 -3.772 -11.498 1.00 . A A . 45 ASP HA 1 1 3 2461 1 1 45 ASP HB2 H 10.266 -5.852 -11.943 1.00 . A A . 45 ASP HB2 1 1 3 2462 1 1 45 ASP HB3 H 8.760 -6.728 -11.689 1.00 . A A . 45 ASP HB3 1 1 3 2463 1 1 45 ASP N N 8.534 -4.890 -9.927 1.00 . A A . 45 ASP N 1 1 3 2464 1 1 45 ASP O O 7.105 -3.326 -12.705 1.00 . A A . 45 ASP O 1 1 3 2465 1 1 45 ASP OD1 O 9.514 -4.940 -14.281 1.00 . A A . 45 ASP OD1 1 1 3 2466 1 1 45 ASP OD2 O 8.144 -6.633 -14.074 1.00 . A A . 45 ASP OD2 1 1 3 2467 1 1 46 GLY C C 3.872 -5.678 -11.321 1.00 . A A . 46 GLY C 1 1 3 2468 1 1 46 GLY CA C 4.889 -4.772 -11.980 1.00 . A A . 46 GLY CA 1 1 3 2469 1 1 46 GLY H H 6.408 -5.763 -10.885 1.00 . A A . 46 GLY H 1 1 3 2470 1 1 46 GLY HA2 H 4.631 -3.744 -11.772 1.00 . A A . 46 GLY HA2 1 1 3 2471 1 1 46 GLY HA3 H 4.859 -4.930 -13.046 1.00 . A A . 46 GLY HA3 1 1 3 2472 1 1 46 GLY N N 6.234 -5.020 -11.510 1.00 . A A . 46 GLY N 1 1 3 2473 1 1 46 GLY O O 2.833 -5.215 -10.850 1.00 . A A . 46 GLY O 1 1 3 2474 1 1 47 GLU C C 3.309 -7.954 -9.212 1.00 . A A . 47 GLU C 1 1 3 2475 1 1 47 GLU CA C 3.248 -7.958 -10.739 1.00 . A A . 47 GLU CA 1 1 3 2476 1 1 47 GLU CB C 3.585 -9.349 -11.273 1.00 . A A . 47 GLU CB 1 1 3 2477 1 1 47 GLU CD C 2.234 -11.081 -12.495 1.00 . A A . 47 GLU CD 1 1 3 2478 1 1 47 GLU CG C 2.849 -9.703 -12.550 1.00 . A A . 47 GLU CG 1 1 3 2479 1 1 47 GLU H H 4.995 -7.281 -11.729 1.00 . A A . 47 GLU H 1 1 3 2480 1 1 47 GLU HA H 2.246 -7.699 -11.047 1.00 . A A . 47 GLU HA 1 1 3 2481 1 1 47 GLU HB2 H 4.646 -9.398 -11.470 1.00 . A A . 47 GLU HB2 1 1 3 2482 1 1 47 GLU HB3 H 3.333 -10.082 -10.521 1.00 . A A . 47 GLU HB3 1 1 3 2483 1 1 47 GLU HG2 H 2.063 -8.980 -12.710 1.00 . A A . 47 GLU HG2 1 1 3 2484 1 1 47 GLU HG3 H 3.545 -9.666 -13.375 1.00 . A A . 47 GLU HG3 1 1 3 2485 1 1 47 GLU N N 4.157 -6.971 -11.308 1.00 . A A . 47 GLU N 1 1 3 2486 1 1 47 GLU O O 3.961 -8.804 -8.603 1.00 . A A . 47 GLU O 1 1 3 2487 1 1 47 GLU OE1 O 2.911 -12.055 -12.880 1.00 . A A . 47 GLU OE1 1 1 3 2488 1 1 47 GLU OE2 O 1.071 -11.202 -12.064 1.00 . A A . 47 GLU OE2 1 1 3 2489 1 1 48 TRP C C 1.201 -7.235 -6.619 1.00 . A A . 48 TRP C 1 1 3 2490 1 1 48 TRP CA C 2.585 -6.892 -7.154 1.00 . A A . 48 TRP CA 1 1 3 2491 1 1 48 TRP CB C 2.979 -5.474 -6.719 1.00 . A A . 48 TRP CB 1 1 3 2492 1 1 48 TRP CD1 C 3.997 -5.912 -4.408 1.00 . A A . 48 TRP CD1 1 1 3 2493 1 1 48 TRP CD2 C 2.269 -4.485 -4.389 1.00 . A A . 48 TRP CD2 1 1 3 2494 1 1 48 TRP CE2 C 2.738 -4.645 -3.069 1.00 . A A . 48 TRP CE2 1 1 3 2495 1 1 48 TRP CE3 C 1.183 -3.632 -4.617 1.00 . A A . 48 TRP CE3 1 1 3 2496 1 1 48 TRP CG C 3.092 -5.307 -5.231 1.00 . A A . 48 TRP CG 1 1 3 2497 1 1 48 TRP CH2 C 1.106 -3.154 -2.240 1.00 . A A . 48 TRP CH2 1 1 3 2498 1 1 48 TRP CZ2 C 2.162 -3.982 -1.986 1.00 . A A . 48 TRP CZ2 1 1 3 2499 1 1 48 TRP CZ3 C 0.615 -2.975 -3.540 1.00 . A A . 48 TRP CZ3 1 1 3 2500 1 1 48 TRP H H 2.098 -6.371 -9.144 1.00 . A A . 48 TRP H 1 1 3 2501 1 1 48 TRP HA H 3.299 -7.594 -6.751 1.00 . A A . 48 TRP HA 1 1 3 2502 1 1 48 TRP HB2 H 3.936 -5.226 -7.152 1.00 . A A . 48 TRP HB2 1 1 3 2503 1 1 48 TRP HB3 H 2.236 -4.777 -7.077 1.00 . A A . 48 TRP HB3 1 1 3 2504 1 1 48 TRP HD1 H 4.758 -6.600 -4.743 1.00 . A A . 48 TRP HD1 1 1 3 2505 1 1 48 TRP HE1 H 4.317 -5.815 -2.335 1.00 . A A . 48 TRP HE1 1 1 3 2506 1 1 48 TRP HE3 H 0.785 -3.483 -5.611 1.00 . A A . 48 TRP HE3 1 1 3 2507 1 1 48 TRP HH2 H 0.630 -2.619 -1.430 1.00 . A A . 48 TRP HH2 1 1 3 2508 1 1 48 TRP HZ2 H 2.526 -4.109 -0.976 1.00 . A A . 48 TRP HZ2 1 1 3 2509 1 1 48 TRP HZ3 H -0.219 -2.309 -3.698 1.00 . A A . 48 TRP HZ3 1 1 3 2510 1 1 48 TRP N N 2.616 -7.006 -8.603 1.00 . A A . 48 TRP N 1 1 3 2511 1 1 48 TRP NE1 N 3.793 -5.518 -3.108 1.00 . A A . 48 TRP NE1 1 1 3 2512 1 1 48 TRP O O 0.185 -6.917 -7.240 1.00 . A A . 48 TRP O 1 1 3 2513 1 1 49 GLN C C 0.067 -7.727 -3.304 1.00 . A A . 49 GLN C 1 1 3 2514 1 1 49 GLN CA C -0.069 -8.136 -4.757 1.00 . A A . 49 GLN CA 1 1 3 2515 1 1 49 GLN CB C -0.397 -9.625 -4.862 1.00 . A A . 49 GLN CB 1 1 3 2516 1 1 49 GLN CD C -2.831 -10.046 -4.375 1.00 . A A . 49 GLN CD 1 1 3 2517 1 1 49 GLN CG C -1.772 -9.905 -5.444 1.00 . A A . 49 GLN CG 1 1 3 2518 1 1 49 GLN H H 2.017 -7.996 -4.974 1.00 . A A . 49 GLN H 1 1 3 2519 1 1 49 GLN HA H -0.858 -7.561 -5.216 1.00 . A A . 49 GLN HA 1 1 3 2520 1 1 49 GLN HB2 H 0.341 -10.099 -5.493 1.00 . A A . 49 GLN HB2 1 1 3 2521 1 1 49 GLN HB3 H -0.350 -10.062 -3.876 1.00 . A A . 49 GLN HB3 1 1 3 2522 1 1 49 GLN HE21 H -3.220 -8.103 -4.459 1.00 . A A . 49 GLN HE21 1 1 3 2523 1 1 49 GLN HE22 H -4.130 -9.003 -3.296 1.00 . A A . 49 GLN HE22 1 1 3 2524 1 1 49 GLN HG2 H -2.045 -9.090 -6.097 1.00 . A A . 49 GLN HG2 1 1 3 2525 1 1 49 GLN HG3 H -1.730 -10.822 -6.012 1.00 . A A . 49 GLN HG3 1 1 3 2526 1 1 49 GLN N N 1.172 -7.831 -5.442 1.00 . A A . 49 GLN N 1 1 3 2527 1 1 49 GLN NE2 N -3.461 -8.942 -4.015 1.00 . A A . 49 GLN NE2 1 1 3 2528 1 1 49 GLN O O 1.135 -7.890 -2.714 1.00 . A A . 49 GLN O 1 1 3 2529 1 1 49 GLN OE1 O -3.082 -11.142 -3.872 1.00 . A A . 49 GLN OE1 1 1 3 2530 1 1 50 CYS C C -0.981 -7.515 -0.370 1.00 . A A . 50 CYS C 1 1 3 2531 1 1 50 CYS CA C -0.868 -6.468 -1.469 1.00 . A A . 50 CYS CA 1 1 3 2532 1 1 50 CYS CB C -1.973 -5.439 -1.319 1.00 . A A . 50 CYS CB 1 1 3 2533 1 1 50 CYS H H -1.728 -6.855 -3.343 1.00 . A A . 50 CYS H 1 1 3 2534 1 1 50 CYS HA H 0.085 -5.970 -1.381 1.00 . A A . 50 CYS HA 1 1 3 2535 1 1 50 CYS HB2 H -2.342 -5.461 -0.304 1.00 . A A . 50 CYS HB2 1 1 3 2536 1 1 50 CYS HB3 H -1.572 -4.458 -1.531 1.00 . A A . 50 CYS HB3 1 1 3 2537 1 1 50 CYS N N -0.946 -7.053 -2.788 1.00 . A A . 50 CYS N 1 1 3 2538 1 1 50 CYS O O -2.042 -8.105 -0.160 1.00 . A A . 50 CYS O 1 1 3 2539 1 1 50 CYS SG S -3.388 -5.709 -2.429 1.00 . A A . 50 CYS SG 1 1 3 2540 1 1 51 PRO C C -0.642 -7.865 2.793 1.00 . A A . 51 PRO C 1 1 3 2541 1 1 51 PRO CA C 0.058 -8.530 1.609 1.00 . A A . 51 PRO CA 1 1 3 2542 1 1 51 PRO CB C 1.544 -8.721 1.894 1.00 . A A . 51 PRO CB 1 1 3 2543 1 1 51 PRO CD C 1.337 -6.900 0.340 1.00 . A A . 51 PRO CD 1 1 3 2544 1 1 51 PRO CG C 2.167 -7.430 1.481 1.00 . A A . 51 PRO CG 1 1 3 2545 1 1 51 PRO HA H -0.404 -9.484 1.394 1.00 . A A . 51 PRO HA 1 1 3 2546 1 1 51 PRO HB2 H 1.690 -8.914 2.947 1.00 . A A . 51 PRO HB2 1 1 3 2547 1 1 51 PRO HB3 H 1.925 -9.546 1.312 1.00 . A A . 51 PRO HB3 1 1 3 2548 1 1 51 PRO HD2 H 1.160 -5.841 0.466 1.00 . A A . 51 PRO HD2 1 1 3 2549 1 1 51 PRO HD3 H 1.827 -7.091 -0.603 1.00 . A A . 51 PRO HD3 1 1 3 2550 1 1 51 PRO HG2 H 2.150 -6.734 2.308 1.00 . A A . 51 PRO HG2 1 1 3 2551 1 1 51 PRO HG3 H 3.183 -7.599 1.157 1.00 . A A . 51 PRO HG3 1 1 3 2552 1 1 51 PRO N N 0.073 -7.657 0.441 1.00 . A A . 51 PRO N 1 1 3 2553 1 1 51 PRO O O -0.173 -7.930 3.929 1.00 . A A . 51 PRO O 1 1 3 2554 1 1 52 ARG C C -3.945 -6.595 3.359 1.00 . A A . 52 ARG C 1 1 3 2555 1 1 52 ARG CA C -2.442 -6.392 3.507 1.00 . A A . 52 ARG CA 1 1 3 2556 1 1 52 ARG CB C -2.102 -4.903 3.403 1.00 . A A . 52 ARG CB 1 1 3 2557 1 1 52 ARG CD C -2.118 -4.630 5.906 1.00 . A A . 52 ARG CD 1 1 3 2558 1 1 52 ARG CG C -1.363 -4.358 4.615 1.00 . A A . 52 ARG CG 1 1 3 2559 1 1 52 ARG CZ C -2.899 -2.632 7.128 1.00 . A A . 52 ARG CZ 1 1 3 2560 1 1 52 ARG H H -2.012 -7.098 1.559 1.00 . A A . 52 ARG H 1 1 3 2561 1 1 52 ARG HA H -2.134 -6.755 4.476 1.00 . A A . 52 ARG HA 1 1 3 2562 1 1 52 ARG HB2 H -1.482 -4.748 2.531 1.00 . A A . 52 ARG HB2 1 1 3 2563 1 1 52 ARG HB3 H -3.019 -4.345 3.284 1.00 . A A . 52 ARG HB3 1 1 3 2564 1 1 52 ARG HD2 H -2.644 -5.570 5.812 1.00 . A A . 52 ARG HD2 1 1 3 2565 1 1 52 ARG HD3 H -1.407 -4.696 6.717 1.00 . A A . 52 ARG HD3 1 1 3 2566 1 1 52 ARG HE H -3.938 -3.588 5.702 1.00 . A A . 52 ARG HE 1 1 3 2567 1 1 52 ARG HG2 H -0.394 -4.829 4.673 1.00 . A A . 52 ARG HG2 1 1 3 2568 1 1 52 ARG HG3 H -1.242 -3.290 4.497 1.00 . A A . 52 ARG HG3 1 1 3 2569 1 1 52 ARG HH11 H -1.004 -3.206 7.577 1.00 . A A . 52 ARG HH11 1 1 3 2570 1 1 52 ARG HH12 H -1.605 -1.850 8.486 1.00 . A A . 52 ARG HH12 1 1 3 2571 1 1 52 ARG HH21 H -4.739 -1.795 6.877 1.00 . A A . 52 ARG HH21 1 1 3 2572 1 1 52 ARG HH22 H -3.725 -1.040 8.074 1.00 . A A . 52 ARG HH22 1 1 3 2573 1 1 52 ARG N N -1.719 -7.148 2.497 1.00 . A A . 52 ARG N 1 1 3 2574 1 1 52 ARG NE N -3.087 -3.577 6.209 1.00 . A A . 52 ARG NE 1 1 3 2575 1 1 52 ARG NH1 N -1.743 -2.555 7.779 1.00 . A A . 52 ARG NH1 1 1 3 2576 1 1 52 ARG NH2 N -3.860 -1.749 7.380 1.00 . A A . 52 ARG NH2 1 1 3 2577 1 1 52 ARG O O -4.580 -7.212 4.214 1.00 . A A . 52 ARG O 1 1 3 2578 1 1 53 CYS C C -6.368 -7.529 1.678 1.00 . A A . 53 CYS C 1 1 3 2579 1 1 53 CYS CA C -5.945 -6.117 2.069 1.00 . A A . 53 CYS CA 1 1 3 2580 1 1 53 CYS CB C -6.334 -5.127 0.979 1.00 . A A . 53 CYS CB 1 1 3 2581 1 1 53 CYS H H -3.968 -5.509 1.674 1.00 . A A . 53 CYS H 1 1 3 2582 1 1 53 CYS HA H -6.442 -5.843 2.987 1.00 . A A . 53 CYS HA 1 1 3 2583 1 1 53 CYS HB2 H -6.669 -5.673 0.111 1.00 . A A . 53 CYS HB2 1 1 3 2584 1 1 53 CYS HB3 H -7.134 -4.499 1.339 1.00 . A A . 53 CYS HB3 1 1 3 2585 1 1 53 CYS N N -4.514 -6.038 2.296 1.00 . A A . 53 CYS N 1 1 3 2586 1 1 53 CYS O O -7.436 -8.000 2.074 1.00 . A A . 53 CYS O 1 1 3 2587 1 1 53 CYS SG S -4.966 -4.043 0.460 1.00 . A A . 53 CYS SG 1 1 3 2588 1 1 54 THR C C -4.911 -10.555 1.164 1.00 . A A . 54 THR C 1 1 3 2589 1 1 54 THR CA C -5.818 -9.546 0.460 1.00 . A A . 54 THR CA 1 1 3 2590 1 1 54 THR CB C -5.657 -9.668 -1.068 1.00 . A A . 54 THR CB 1 1 3 2591 1 1 54 THR CG2 C -6.897 -9.157 -1.782 1.00 . A A . 54 THR CG2 1 1 3 2592 1 1 54 THR H H -4.687 -7.775 0.636 1.00 . A A . 54 THR H 1 1 3 2593 1 1 54 THR HA H -6.846 -9.767 0.709 1.00 . A A . 54 THR HA 1 1 3 2594 1 1 54 THR HB H -5.518 -10.709 -1.319 1.00 . A A . 54 THR HB 1 1 3 2595 1 1 54 THR HG1 H -4.666 -7.981 -1.377 1.00 . A A . 54 THR HG1 1 1 3 2596 1 1 54 THR HG21 H -6.686 -9.044 -2.834 1.00 . A A . 54 THR HG21 1 1 3 2597 1 1 54 THR HG22 H -7.183 -8.202 -1.366 1.00 . A A . 54 THR HG22 1 1 3 2598 1 1 54 THR HG23 H -7.706 -9.862 -1.651 1.00 . A A . 54 THR HG23 1 1 3 2599 1 1 54 THR N N -5.527 -8.197 0.905 1.00 . A A . 54 THR N 1 1 3 2600 1 1 54 THR O O -4.047 -10.175 1.956 1.00 . A A . 54 THR O 1 1 3 2601 1 1 54 THR OG1 O -4.513 -8.925 -1.506 1.00 . A A . 54 THR OG1 1 1 3 2602 1 1 55 CYS C C -3.008 -13.074 0.844 1.00 . A A . 55 CYS C 1 1 3 2603 1 1 55 CYS CA C -4.354 -12.893 1.541 1.00 . A A . 55 CYS CA 1 1 3 2604 1 1 55 CYS CB C -5.143 -14.204 1.520 1.00 . A A . 55 CYS CB 1 1 3 2605 1 1 55 CYS H H -5.848 -12.084 0.276 1.00 . A A . 55 CYS H 1 1 3 2606 1 1 55 CYS HA H -4.179 -12.604 2.566 1.00 . A A . 55 CYS HA 1 1 3 2607 1 1 55 CYS HB2 H -4.842 -14.784 0.660 1.00 . A A . 55 CYS HB2 1 1 3 2608 1 1 55 CYS HB3 H -4.925 -14.762 2.420 1.00 . A A . 55 CYS HB3 1 1 3 2609 1 1 55 CYS HG H -7.245 -13.662 0.174 1.00 . A A . 55 CYS HG 1 1 3 2610 1 1 55 CYS N N -5.134 -11.837 0.905 1.00 . A A . 55 CYS N 1 1 3 2611 1 1 55 CYS O O -2.954 -13.381 -0.351 1.00 . A A . 55 CYS O 1 1 3 2612 1 1 55 CYS SG S -6.936 -13.974 1.431 1.00 . A A . 55 CYS SG 1 1 3 2613 1 1 56 PRO C C -0.156 -14.470 0.839 1.00 . A A . 56 PRO C 1 1 3 2614 1 1 56 PRO CA C -0.546 -13.008 1.044 1.00 . A A . 56 PRO CA 1 1 3 2615 1 1 56 PRO CB C 0.347 -12.364 2.119 1.00 . A A . 56 PRO CB 1 1 3 2616 1 1 56 PRO CD C -1.879 -12.495 2.994 1.00 . A A . 56 PRO CD 1 1 3 2617 1 1 56 PRO CG C -0.584 -11.751 3.116 1.00 . A A . 56 PRO CG 1 1 3 2618 1 1 56 PRO HA H -0.435 -12.475 0.112 1.00 . A A . 56 PRO HA 1 1 3 2619 1 1 56 PRO HB2 H 0.965 -13.124 2.576 1.00 . A A . 56 PRO HB2 1 1 3 2620 1 1 56 PRO HB3 H 0.978 -11.615 1.660 1.00 . A A . 56 PRO HB3 1 1 3 2621 1 1 56 PRO HD2 H -1.873 -13.369 3.628 1.00 . A A . 56 PRO HD2 1 1 3 2622 1 1 56 PRO HD3 H -2.712 -11.851 3.238 1.00 . A A . 56 PRO HD3 1 1 3 2623 1 1 56 PRO HG2 H -0.181 -11.862 4.112 1.00 . A A . 56 PRO HG2 1 1 3 2624 1 1 56 PRO HG3 H -0.730 -10.706 2.886 1.00 . A A . 56 PRO HG3 1 1 3 2625 1 1 56 PRO N N -1.901 -12.873 1.580 1.00 . A A . 56 PRO N 1 1 3 2626 1 1 56 PRO O O 0.648 -15.024 1.590 1.00 . A A . 56 PRO O 1 1 3 2627 1 1 57 ALA C C 0.342 -16.719 -1.617 1.00 . A A . 57 ALA C 1 1 3 2628 1 1 57 ALA CA C -0.541 -16.524 -0.391 1.00 . A A . 57 ALA CA 1 1 3 2629 1 1 57 ALA CB C -1.863 -17.256 -0.561 1.00 . A A . 57 ALA CB 1 1 3 2630 1 1 57 ALA H H -1.456 -14.634 -0.667 1.00 . A A . 57 ALA H 1 1 3 2631 1 1 57 ALA HA H -0.037 -16.937 0.471 1.00 . A A . 57 ALA HA 1 1 3 2632 1 1 57 ALA HB1 H -2.624 -16.556 -0.871 1.00 . A A . 57 ALA HB1 1 1 3 2633 1 1 57 ALA HB2 H -1.756 -18.026 -1.311 1.00 . A A . 57 ALA HB2 1 1 3 2634 1 1 57 ALA HB3 H -2.148 -17.706 0.378 1.00 . A A . 57 ALA HB3 1 1 3 2635 1 1 57 ALA N N -0.778 -15.111 -0.137 1.00 . A A . 57 ALA N 1 1 3 2636 1 1 57 ALA O O 0.490 -17.835 -2.119 1.00 . A A . 57 ALA O 1 1 3 2637 1 1 58 LEU C C 2.774 -14.502 -3.222 1.00 . A A . 58 LEU C 1 1 3 2638 1 1 58 LEU CA C 1.814 -15.685 -3.244 1.00 . A A . 58 LEU CA 1 1 3 2639 1 1 58 LEU CB C 0.995 -15.682 -4.539 1.00 . A A . 58 LEU CB 1 1 3 2640 1 1 58 LEU CD1 C 1.945 -17.909 -5.208 1.00 . A A . 58 LEU CD1 1 1 3 2641 1 1 58 LEU CD2 C 0.578 -16.596 -6.837 1.00 . A A . 58 LEU CD2 1 1 3 2642 1 1 58 LEU CG C 1.573 -16.515 -5.687 1.00 . A A . 58 LEU CG 1 1 3 2643 1 1 58 LEU H H 0.785 -14.773 -1.641 1.00 . A A . 58 LEU H 1 1 3 2644 1 1 58 LEU HA H 2.386 -16.599 -3.187 1.00 . A A . 58 LEU HA 1 1 3 2645 1 1 58 LEU HB2 H 0.008 -16.057 -4.314 1.00 . A A . 58 LEU HB2 1 1 3 2646 1 1 58 LEU HB3 H 0.905 -14.662 -4.878 1.00 . A A . 58 LEU HB3 1 1 3 2647 1 1 58 LEU HD11 H 1.241 -18.625 -5.605 1.00 . A A . 58 LEU HD11 1 1 3 2648 1 1 58 LEU HD12 H 2.940 -18.153 -5.550 1.00 . A A . 58 LEU HD12 1 1 3 2649 1 1 58 LEU HD13 H 1.918 -17.937 -4.129 1.00 . A A . 58 LEU HD13 1 1 3 2650 1 1 58 LEU HD21 H 0.393 -15.605 -7.225 1.00 . A A . 58 LEU HD21 1 1 3 2651 1 1 58 LEU HD22 H 0.984 -17.220 -7.620 1.00 . A A . 58 LEU HD22 1 1 3 2652 1 1 58 LEU HD23 H -0.348 -17.022 -6.481 1.00 . A A . 58 LEU HD23 1 1 3 2653 1 1 58 LEU HG H 2.470 -16.036 -6.053 1.00 . A A . 58 LEU HG 1 1 3 2654 1 1 58 LEU N N 0.934 -15.633 -2.090 1.00 . A A . 58 LEU N 1 1 3 2655 1 1 58 LEU O O 2.757 -13.708 -2.275 1.00 . A A . 58 LEU O 1 1 3 2656 1 1 59 LYS C C 5.746 -13.496 -3.432 1.00 . A A . 59 LYS C 1 1 3 2657 1 1 59 LYS CA C 4.588 -13.326 -4.409 1.00 . A A . 59 LYS CA 1 1 3 2658 1 1 59 LYS CB C 3.947 -11.943 -4.240 1.00 . A A . 59 LYS CB 1 1 3 2659 1 1 59 LYS CD C 2.762 -10.767 -6.114 1.00 . A A . 59 LYS CD 1 1 3 2660 1 1 59 LYS CE C 2.620 -11.498 -7.437 1.00 . A A . 59 LYS CE 1 1 3 2661 1 1 59 LYS CG C 4.102 -11.050 -5.460 1.00 . A A . 59 LYS CG 1 1 3 2662 1 1 59 LYS H H 3.540 -15.072 -4.977 1.00 . A A . 59 LYS H 1 1 3 2663 1 1 59 LYS HA H 4.984 -13.395 -5.411 1.00 . A A . 59 LYS HA 1 1 3 2664 1 1 59 LYS HB2 H 2.893 -12.069 -4.043 1.00 . A A . 59 LYS HB2 1 1 3 2665 1 1 59 LYS HB3 H 4.405 -11.447 -3.397 1.00 . A A . 59 LYS HB3 1 1 3 2666 1 1 59 LYS HD2 H 1.974 -11.092 -5.451 1.00 . A A . 59 LYS HD2 1 1 3 2667 1 1 59 LYS HD3 H 2.674 -9.705 -6.288 1.00 . A A . 59 LYS HD3 1 1 3 2668 1 1 59 LYS HE2 H 2.982 -10.859 -8.226 1.00 . A A . 59 LYS HE2 1 1 3 2669 1 1 59 LYS HE3 H 3.214 -12.400 -7.402 1.00 . A A . 59 LYS HE3 1 1 3 2670 1 1 59 LYS HG2 H 4.549 -10.115 -5.157 1.00 . A A . 59 LYS HG2 1 1 3 2671 1 1 59 LYS HG3 H 4.746 -11.543 -6.175 1.00 . A A . 59 LYS HG3 1 1 3 2672 1 1 59 LYS HZ1 H 1.159 -12.519 -8.527 1.00 . A A . 59 LYS HZ1 1 1 3 2673 1 1 59 LYS HZ2 H 0.658 -11.003 -7.956 1.00 . A A . 59 LYS HZ2 1 1 3 2674 1 1 59 LYS HZ3 H 0.777 -12.315 -6.885 1.00 . A A . 59 LYS HZ3 1 1 3 2675 1 1 59 LYS N N 3.598 -14.398 -4.266 1.00 . A A . 59 LYS N 1 1 3 2676 1 1 59 LYS NZ N 1.207 -11.859 -7.720 1.00 . A A . 59 LYS NZ 1 1 3 2677 1 1 59 LYS O O 6.857 -13.839 -3.834 1.00 . A A . 59 LYS O 1 1 3 2678 1 1 60 GLY C C 6.011 -13.770 0.196 1.00 . A A . 60 GLY C 1 1 3 2679 1 1 60 GLY CA C 6.541 -13.395 -1.166 1.00 . A A . 60 GLY CA 1 1 3 2680 1 1 60 GLY H H 4.582 -13.024 -1.877 1.00 . A A . 60 GLY H 1 1 3 2681 1 1 60 GLY HA2 H 7.234 -14.157 -1.490 1.00 . A A . 60 GLY HA2 1 1 3 2682 1 1 60 GLY HA3 H 7.065 -12.454 -1.091 1.00 . A A . 60 GLY HA3 1 1 3 2683 1 1 60 GLY N N 5.493 -13.269 -2.155 1.00 . A A . 60 GLY N 1 1 3 2684 1 1 60 GLY O O 5.763 -12.903 1.034 1.00 . A A . 60 GLY O 1 1 3 2685 1 1 61 LYS C C 6.475 -16.478 2.320 1.00 . A A . 61 LYS C 1 1 3 2686 1 1 61 LYS CA C 5.421 -15.560 1.720 1.00 . A A . 61 LYS CA 1 1 3 2687 1 1 61 LYS CB C 4.088 -16.299 1.572 1.00 . A A . 61 LYS CB 1 1 3 2688 1 1 61 LYS CD C 3.077 -15.500 3.737 1.00 . A A . 61 LYS CD 1 1 3 2689 1 1 61 LYS CE C 3.683 -15.567 5.130 1.00 . A A . 61 LYS CE 1 1 3 2690 1 1 61 LYS CG C 3.465 -16.710 2.899 1.00 . A A . 61 LYS CG 1 1 3 2691 1 1 61 LYS H H 6.111 -15.707 -0.273 1.00 . A A . 61 LYS H 1 1 3 2692 1 1 61 LYS HA H 5.285 -14.711 2.374 1.00 . A A . 61 LYS HA 1 1 3 2693 1 1 61 LYS HB2 H 3.389 -15.657 1.056 1.00 . A A . 61 LYS HB2 1 1 3 2694 1 1 61 LYS HB3 H 4.248 -17.191 0.983 1.00 . A A . 61 LYS HB3 1 1 3 2695 1 1 61 LYS HD2 H 3.427 -14.605 3.245 1.00 . A A . 61 LYS HD2 1 1 3 2696 1 1 61 LYS HD3 H 2.002 -15.467 3.824 1.00 . A A . 61 LYS HD3 1 1 3 2697 1 1 61 LYS HE2 H 3.062 -14.997 5.806 1.00 . A A . 61 LYS HE2 1 1 3 2698 1 1 61 LYS HE3 H 3.707 -16.599 5.448 1.00 . A A . 61 LYS HE3 1 1 3 2699 1 1 61 LYS HG2 H 2.582 -17.296 2.701 1.00 . A A . 61 LYS HG2 1 1 3 2700 1 1 61 LYS HG3 H 4.178 -17.305 3.452 1.00 . A A . 61 LYS HG3 1 1 3 2701 1 1 61 LYS HZ1 H 5.098 -14.093 4.680 1.00 . A A . 61 LYS HZ1 1 1 3 2702 1 1 61 LYS HZ2 H 5.725 -15.670 4.692 1.00 . A A . 61 LYS HZ2 1 1 3 2703 1 1 61 LYS HZ3 H 5.370 -14.883 6.154 1.00 . A A . 61 LYS HZ3 1 1 3 2704 1 1 61 LYS N N 5.872 -15.063 0.432 1.00 . A A . 61 LYS N 1 1 3 2705 1 1 61 LYS NZ N 5.063 -15.016 5.167 1.00 . A A . 61 LYS NZ 1 1 3 2706 1 1 61 LYS O O 7.183 -17.159 1.547 1.00 . A A . 61 LYS O 1 1 3 2707 1 1 61 LYS OXT O 6.605 -16.508 3.562 1.00 . A A . 61 LYS OXT 1 1 3 2708 2 2 1 ZN ZN ZN -4.878 -4.149 -1.819 1.00 . B A . 62 ZN ZN 1 1 3 2709 3 2 1 ZN ZN ZN 4.322 4.490 4.486 1.00 . C A . 63 ZN ZN 1 1 4 2710 1 1 1 GLY C C -13.832 -1.709 13.585 1.00 . A A . 1 GLY C 1 1 4 2711 1 1 1 GLY CA C -15.186 -1.365 14.164 1.00 . A A . 1 GLY CA 1 1 4 2712 1 1 1 GLY H1 H -14.515 0.611 14.128 1.00 . A A . 1 GLY H1 1 1 4 2713 1 1 1 GLY H2 H -15.100 0.103 15.636 1.00 . A A . 1 GLY H2 1 1 4 2714 1 1 1 GLY H3 H -16.186 0.451 14.382 1.00 . A A . 1 GLY H3 1 1 4 2715 1 1 1 GLY HA2 H -15.381 -2.009 15.009 1.00 . A A . 1 GLY HA2 1 1 4 2716 1 1 1 GLY HA3 H -15.943 -1.532 13.412 1.00 . A A . 1 GLY HA3 1 1 4 2717 1 1 1 GLY N N -15.252 0.047 14.608 1.00 . A A . 1 GLY N 1 1 4 2718 1 1 1 GLY O O -13.035 -0.814 13.297 1.00 . A A . 1 GLY O 1 1 4 2719 1 1 2 PRO C C -12.088 -3.061 11.397 1.00 . A A . 2 PRO C 1 1 4 2720 1 1 2 PRO CA C -12.251 -3.449 12.863 1.00 . A A . 2 PRO CA 1 1 4 2721 1 1 2 PRO CB C -12.302 -4.972 13.014 1.00 . A A . 2 PRO CB 1 1 4 2722 1 1 2 PRO CD C -14.412 -4.136 13.754 1.00 . A A . 2 PRO CD 1 1 4 2723 1 1 2 PRO CG C -13.754 -5.303 13.074 1.00 . A A . 2 PRO CG 1 1 4 2724 1 1 2 PRO HA H -11.420 -3.056 13.433 1.00 . A A . 2 PRO HA 1 1 4 2725 1 1 2 PRO HB2 H -11.824 -5.436 12.163 1.00 . A A . 2 PRO HB2 1 1 4 2726 1 1 2 PRO HB3 H -11.797 -5.262 13.920 1.00 . A A . 2 PRO HB3 1 1 4 2727 1 1 2 PRO HD2 H -15.406 -3.984 13.362 1.00 . A A . 2 PRO HD2 1 1 4 2728 1 1 2 PRO HD3 H -14.444 -4.290 14.822 1.00 . A A . 2 PRO HD3 1 1 4 2729 1 1 2 PRO HG2 H -14.147 -5.425 12.076 1.00 . A A . 2 PRO HG2 1 1 4 2730 1 1 2 PRO HG3 H -13.902 -6.205 13.650 1.00 . A A . 2 PRO HG3 1 1 4 2731 1 1 2 PRO N N -13.533 -3.004 13.413 1.00 . A A . 2 PRO N 1 1 4 2732 1 1 2 PRO O O -10.973 -2.886 10.911 1.00 . A A . 2 PRO O 1 1 4 2733 1 1 3 LEU C C -13.581 -1.045 9.155 1.00 . A A . 3 LEU C 1 1 4 2734 1 1 3 LEU CA C -13.191 -2.506 9.307 1.00 . A A . 3 LEU CA 1 1 4 2735 1 1 3 LEU CB C -14.146 -3.385 8.496 1.00 . A A . 3 LEU CB 1 1 4 2736 1 1 3 LEU CD1 C -14.045 -5.881 8.665 1.00 . A A . 3 LEU CD1 1 1 4 2737 1 1 3 LEU CD2 C -13.822 -4.771 6.437 1.00 . A A . 3 LEU CD2 1 1 4 2738 1 1 3 LEU CG C -13.527 -4.658 7.924 1.00 . A A . 3 LEU CG 1 1 4 2739 1 1 3 LEU H H -14.073 -3.010 11.160 1.00 . A A . 3 LEU H 1 1 4 2740 1 1 3 LEU HA H -12.186 -2.641 8.936 1.00 . A A . 3 LEU HA 1 1 4 2741 1 1 3 LEU HB2 H -14.972 -3.666 9.133 1.00 . A A . 3 LEU HB2 1 1 4 2742 1 1 3 LEU HB3 H -14.529 -2.798 7.674 1.00 . A A . 3 LEU HB3 1 1 4 2743 1 1 3 LEU HD11 H -13.248 -6.306 9.257 1.00 . A A . 3 LEU HD11 1 1 4 2744 1 1 3 LEU HD12 H -14.860 -5.590 9.312 1.00 . A A . 3 LEU HD12 1 1 4 2745 1 1 3 LEU HD13 H -14.393 -6.612 7.952 1.00 . A A . 3 LEU HD13 1 1 4 2746 1 1 3 LEU HD21 H -14.816 -4.395 6.238 1.00 . A A . 3 LEU HD21 1 1 4 2747 1 1 3 LEU HD22 H -13.100 -4.193 5.882 1.00 . A A . 3 LEU HD22 1 1 4 2748 1 1 3 LEU HD23 H -13.762 -5.806 6.136 1.00 . A A . 3 LEU HD23 1 1 4 2749 1 1 3 LEU HG H -12.455 -4.621 8.052 1.00 . A A . 3 LEU HG 1 1 4 2750 1 1 3 LEU N N -13.208 -2.895 10.707 1.00 . A A . 3 LEU N 1 1 4 2751 1 1 3 LEU O O -14.486 -0.556 9.834 1.00 . A A . 3 LEU O 1 1 4 2752 1 1 4 GLY C C -13.178 1.309 6.502 1.00 . A A . 4 GLY C 1 1 4 2753 1 1 4 GLY CA C -13.216 1.026 7.984 1.00 . A A . 4 GLY CA 1 1 4 2754 1 1 4 GLY H H -12.188 -0.806 7.742 1.00 . A A . 4 GLY H 1 1 4 2755 1 1 4 GLY HA2 H -14.204 1.246 8.362 1.00 . A A . 4 GLY HA2 1 1 4 2756 1 1 4 GLY HA3 H -12.497 1.658 8.483 1.00 . A A . 4 GLY HA3 1 1 4 2757 1 1 4 GLY N N -12.902 -0.356 8.256 1.00 . A A . 4 GLY N 1 1 4 2758 1 1 4 GLY O O -12.788 0.443 5.717 1.00 . A A . 4 GLY O 1 1 4 2759 1 1 5 SER C C -12.138 3.277 4.261 1.00 . A A . 5 SER C 1 1 4 2760 1 1 5 SER CA C -13.548 2.899 4.708 1.00 . A A . 5 SER CA 1 1 4 2761 1 1 5 SER CB C -14.514 4.059 4.485 1.00 . A A . 5 SER CB 1 1 4 2762 1 1 5 SER H H -13.845 3.171 6.785 1.00 . A A . 5 SER H 1 1 4 2763 1 1 5 SER HA H -13.878 2.049 4.127 1.00 . A A . 5 SER HA 1 1 4 2764 1 1 5 SER HB2 H -13.977 4.992 4.568 1.00 . A A . 5 SER HB2 1 1 4 2765 1 1 5 SER HB3 H -14.952 3.979 3.502 1.00 . A A . 5 SER HB3 1 1 4 2766 1 1 5 SER HG H -15.757 4.952 5.718 1.00 . A A . 5 SER HG 1 1 4 2767 1 1 5 SER N N -13.555 2.513 6.112 1.00 . A A . 5 SER N 1 1 4 2768 1 1 5 SER O O -11.891 4.383 3.781 1.00 . A A . 5 SER O 1 1 4 2769 1 1 5 SER OG O -15.553 4.041 5.453 1.00 . A A . 5 SER OG 1 1 4 2770 1 1 6 ASP C C -9.622 2.155 2.581 1.00 . A A . 6 ASP C 1 1 4 2771 1 1 6 ASP CA C -9.830 2.540 4.038 1.00 . A A . 6 ASP CA 1 1 4 2772 1 1 6 ASP CB C -8.902 1.711 4.932 1.00 . A A . 6 ASP CB 1 1 4 2773 1 1 6 ASP CG C -8.209 2.538 5.999 1.00 . A A . 6 ASP CG 1 1 4 2774 1 1 6 ASP H H -11.490 1.468 4.791 1.00 . A A . 6 ASP H 1 1 4 2775 1 1 6 ASP HA H -9.598 3.588 4.163 1.00 . A A . 6 ASP HA 1 1 4 2776 1 1 6 ASP HB2 H -9.478 0.943 5.423 1.00 . A A . 6 ASP HB2 1 1 4 2777 1 1 6 ASP HB3 H -8.144 1.246 4.316 1.00 . A A . 6 ASP HB3 1 1 4 2778 1 1 6 ASP N N -11.219 2.336 4.417 1.00 . A A . 6 ASP N 1 1 4 2779 1 1 6 ASP O O -8.988 1.144 2.277 1.00 . A A . 6 ASP O 1 1 4 2780 1 1 6 ASP OD1 O -8.426 3.767 6.055 1.00 . A A . 6 ASP OD1 1 1 4 2781 1 1 6 ASP OD2 O -7.443 1.956 6.796 1.00 . A A . 6 ASP OD2 1 1 4 2782 1 1 7 HIS C C -9.423 3.720 -0.477 1.00 . A A . 7 HIS C 1 1 4 2783 1 1 7 HIS CA C -10.168 2.617 0.262 1.00 . A A . 7 HIS CA 1 1 4 2784 1 1 7 HIS CB C -11.578 2.454 -0.314 1.00 . A A . 7 HIS CB 1 1 4 2785 1 1 7 HIS CD2 C -11.718 1.354 -2.642 1.00 . A A . 7 HIS CD2 1 1 4 2786 1 1 7 HIS CE1 C -11.933 -0.706 -1.971 1.00 . A A . 7 HIS CE1 1 1 4 2787 1 1 7 HIS CG C -11.708 1.323 -1.288 1.00 . A A . 7 HIS CG 1 1 4 2788 1 1 7 HIS H H -10.784 3.668 1.994 1.00 . A A . 7 HIS H 1 1 4 2789 1 1 7 HIS HA H -9.627 1.691 0.139 1.00 . A A . 7 HIS HA 1 1 4 2790 1 1 7 HIS HB2 H -12.270 2.274 0.497 1.00 . A A . 7 HIS HB2 1 1 4 2791 1 1 7 HIS HB3 H -11.859 3.365 -0.821 1.00 . A A . 7 HIS HB3 1 1 4 2792 1 1 7 HIS HD2 H -11.631 2.229 -3.269 1.00 . A A . 7 HIS HD2 1 1 4 2793 1 1 7 HIS HE1 H -12.043 -1.781 -1.984 1.00 . A A . 7 HIS HE1 1 1 4 2794 1 1 7 HIS HE2 H -11.706 -0.266 -3.990 1.00 . A A . 7 HIS HE2 1 1 4 2795 1 1 7 HIS N N -10.235 2.912 1.686 1.00 . A A . 7 HIS N 1 1 4 2796 1 1 7 HIS ND1 N -11.845 0.020 -0.869 1.00 . A A . 7 HIS ND1 1 1 4 2797 1 1 7 HIS NE2 N -11.863 0.058 -3.069 1.00 . A A . 7 HIS NE2 1 1 4 2798 1 1 7 HIS O O -8.463 3.457 -1.201 1.00 . A A . 7 HIS O 1 1 4 2799 1 1 8 HIS C C -8.332 6.835 0.018 1.00 . A A . 8 HIS C 1 1 4 2800 1 1 8 HIS CA C -9.255 6.097 -0.944 1.00 . A A . 8 HIS CA 1 1 4 2801 1 1 8 HIS CB C -10.338 7.049 -1.472 1.00 . A A . 8 HIS CB 1 1 4 2802 1 1 8 HIS CD2 C -9.071 8.647 -3.064 1.00 . A A . 8 HIS CD2 1 1 4 2803 1 1 8 HIS CE1 C -9.405 10.486 -1.944 1.00 . A A . 8 HIS CE1 1 1 4 2804 1 1 8 HIS CG C -9.808 8.369 -1.961 1.00 . A A . 8 HIS CG 1 1 4 2805 1 1 8 HIS H H -10.643 5.098 0.303 1.00 . A A . 8 HIS H 1 1 4 2806 1 1 8 HIS HA H -8.674 5.732 -1.776 1.00 . A A . 8 HIS HA 1 1 4 2807 1 1 8 HIS HB2 H -10.853 6.573 -2.292 1.00 . A A . 8 HIS HB2 1 1 4 2808 1 1 8 HIS HB3 H -11.046 7.247 -0.679 1.00 . A A . 8 HIS HB3 1 1 4 2809 1 1 8 HIS HD2 H -8.737 7.944 -3.813 1.00 . A A . 8 HIS HD2 1 1 4 2810 1 1 8 HIS HE1 H -9.373 11.526 -1.650 1.00 . A A . 8 HIS HE1 1 1 4 2811 1 1 8 HIS HE2 H -8.410 10.521 -3.771 1.00 . A A . 8 HIS HE2 1 1 4 2812 1 1 8 HIS N N -9.871 4.952 -0.291 1.00 . A A . 8 HIS N 1 1 4 2813 1 1 8 HIS ND1 N -10.019 9.533 -1.259 1.00 . A A . 8 HIS ND1 1 1 4 2814 1 1 8 HIS NE2 N -8.821 9.995 -3.043 1.00 . A A . 8 HIS NE2 1 1 4 2815 1 1 8 HIS O O -8.771 7.323 1.059 1.00 . A A . 8 HIS O 1 1 4 2816 1 1 9 MET C C -4.872 8.040 -0.447 1.00 . A A . 9 MET C 1 1 4 2817 1 1 9 MET CA C -6.102 7.730 0.403 1.00 . A A . 9 MET CA 1 1 4 2818 1 1 9 MET CB C -5.697 6.985 1.686 1.00 . A A . 9 MET CB 1 1 4 2819 1 1 9 MET CE C -5.645 2.834 1.583 1.00 . A A . 9 MET CE 1 1 4 2820 1 1 9 MET CG C -5.192 5.569 1.459 1.00 . A A . 9 MET CG 1 1 4 2821 1 1 9 MET H H -6.794 6.575 -1.232 1.00 . A A . 9 MET H 1 1 4 2822 1 1 9 MET HA H -6.571 8.663 0.677 1.00 . A A . 9 MET HA 1 1 4 2823 1 1 9 MET HB2 H -4.915 7.544 2.176 1.00 . A A . 9 MET HB2 1 1 4 2824 1 1 9 MET HB3 H -6.554 6.936 2.343 1.00 . A A . 9 MET HB3 1 1 4 2825 1 1 9 MET HE1 H -5.874 1.987 2.213 1.00 . A A . 9 MET HE1 1 1 4 2826 1 1 9 MET HE2 H -6.203 2.760 0.662 1.00 . A A . 9 MET HE2 1 1 4 2827 1 1 9 MET HE3 H -4.587 2.843 1.364 1.00 . A A . 9 MET HE3 1 1 4 2828 1 1 9 MET HG2 H -5.300 5.327 0.411 1.00 . A A . 9 MET HG2 1 1 4 2829 1 1 9 MET HG3 H -4.148 5.529 1.732 1.00 . A A . 9 MET HG3 1 1 4 2830 1 1 9 MET N N -7.072 6.966 -0.371 1.00 . A A . 9 MET N 1 1 4 2831 1 1 9 MET O O -4.279 7.146 -1.054 1.00 . A A . 9 MET O 1 1 4 2832 1 1 9 MET SD S -6.094 4.346 2.434 1.00 . A A . 9 MET SD 1 1 4 2833 1 1 10 GLU C C -2.070 9.633 -0.423 1.00 . A A . 10 GLU C 1 1 4 2834 1 1 10 GLU CA C -3.340 9.754 -1.261 1.00 . A A . 10 GLU CA 1 1 4 2835 1 1 10 GLU CB C -3.535 11.199 -1.727 1.00 . A A . 10 GLU CB 1 1 4 2836 1 1 10 GLU CD C -4.070 11.058 -4.194 1.00 . A A . 10 GLU CD 1 1 4 2837 1 1 10 GLU CG C -4.597 11.351 -2.803 1.00 . A A . 10 GLU CG 1 1 4 2838 1 1 10 GLU H H -5.009 9.979 0.030 1.00 . A A . 10 GLU H 1 1 4 2839 1 1 10 GLU HA H -3.251 9.111 -2.124 1.00 . A A . 10 GLU HA 1 1 4 2840 1 1 10 GLU HB2 H -3.822 11.804 -0.879 1.00 . A A . 10 GLU HB2 1 1 4 2841 1 1 10 GLU HB3 H -2.599 11.568 -2.121 1.00 . A A . 10 GLU HB3 1 1 4 2842 1 1 10 GLU HG2 H -5.405 10.666 -2.592 1.00 . A A . 10 GLU HG2 1 1 4 2843 1 1 10 GLU HG3 H -4.971 12.364 -2.782 1.00 . A A . 10 GLU HG3 1 1 4 2844 1 1 10 GLU N N -4.497 9.312 -0.488 1.00 . A A . 10 GLU N 1 1 4 2845 1 1 10 GLU O O -1.231 10.535 -0.399 1.00 . A A . 10 GLU O 1 1 4 2846 1 1 10 GLU OE1 O -2.846 11.179 -4.412 1.00 . A A . 10 GLU OE1 1 1 4 2847 1 1 10 GLU OE2 O -4.879 10.709 -5.078 1.00 . A A . 10 GLU OE2 1 1 4 2848 1 1 11 PHE C C -0.899 6.820 1.643 1.00 . A A . 11 PHE C 1 1 4 2849 1 1 11 PHE CA C -0.855 8.267 1.192 1.00 . A A . 11 PHE CA 1 1 4 2850 1 1 11 PHE CB C -0.900 9.207 2.408 1.00 . A A . 11 PHE CB 1 1 4 2851 1 1 11 PHE CD1 C -3.279 9.766 2.994 1.00 . A A . 11 PHE CD1 1 1 4 2852 1 1 11 PHE CD2 C -2.128 8.181 4.347 1.00 . A A . 11 PHE CD2 1 1 4 2853 1 1 11 PHE CE1 C -4.409 9.617 3.776 1.00 . A A . 11 PHE CE1 1 1 4 2854 1 1 11 PHE CE2 C -3.253 8.028 5.133 1.00 . A A . 11 PHE CE2 1 1 4 2855 1 1 11 PHE CG C -2.127 9.047 3.269 1.00 . A A . 11 PHE CG 1 1 4 2856 1 1 11 PHE CZ C -4.396 8.748 4.847 1.00 . A A . 11 PHE CZ 1 1 4 2857 1 1 11 PHE H H -2.698 7.868 0.252 1.00 . A A . 11 PHE H 1 1 4 2858 1 1 11 PHE HA H 0.062 8.432 0.647 1.00 . A A . 11 PHE HA 1 1 4 2859 1 1 11 PHE HB2 H -0.036 9.020 3.028 1.00 . A A . 11 PHE HB2 1 1 4 2860 1 1 11 PHE HB3 H -0.870 10.229 2.059 1.00 . A A . 11 PHE HB3 1 1 4 2861 1 1 11 PHE HD1 H -3.291 10.444 2.155 1.00 . A A . 11 PHE HD1 1 1 4 2862 1 1 11 PHE HD2 H -1.233 7.620 4.571 1.00 . A A . 11 PHE HD2 1 1 4 2863 1 1 11 PHE HE1 H -5.301 10.183 3.548 1.00 . A A . 11 PHE HE1 1 1 4 2864 1 1 11 PHE HE2 H -3.239 7.347 5.969 1.00 . A A . 11 PHE HE2 1 1 4 2865 1 1 11 PHE HZ H -5.279 8.629 5.457 1.00 . A A . 11 PHE HZ 1 1 4 2866 1 1 11 PHE N N -1.973 8.528 0.301 1.00 . A A . 11 PHE N 1 1 4 2867 1 1 11 PHE O O -1.935 6.164 1.536 1.00 . A A . 11 PHE O 1 1 4 2868 1 1 12 CYS C C -0.428 4.979 4.093 1.00 . A A . 12 CYS C 1 1 4 2869 1 1 12 CYS CA C 0.243 4.994 2.724 1.00 . A A . 12 CYS CA 1 1 4 2870 1 1 12 CYS CB C 1.691 4.494 2.794 1.00 . A A . 12 CYS CB 1 1 4 2871 1 1 12 CYS H H 0.984 6.927 2.297 1.00 . A A . 12 CYS H 1 1 4 2872 1 1 12 CYS HA H -0.318 4.356 2.055 1.00 . A A . 12 CYS HA 1 1 4 2873 1 1 12 CYS HB2 H 1.773 3.580 2.228 1.00 . A A . 12 CYS HB2 1 1 4 2874 1 1 12 CYS HB3 H 2.339 5.239 2.358 1.00 . A A . 12 CYS HB3 1 1 4 2875 1 1 12 CYS HG H 3.160 5.124 4.755 1.00 . A A . 12 CYS HG 1 1 4 2876 1 1 12 CYS N N 0.201 6.338 2.191 1.00 . A A . 12 CYS N 1 1 4 2877 1 1 12 CYS O O -0.121 5.814 4.947 1.00 . A A . 12 CYS O 1 1 4 2878 1 1 12 CYS SG S 2.294 4.154 4.460 1.00 . A A . 12 CYS SG 1 1 4 2879 1 1 13 ARG C C -1.590 3.634 6.682 1.00 . A A . 13 ARG C 1 1 4 2880 1 1 13 ARG CA C -2.304 4.165 5.433 1.00 . A A . 13 ARG CA 1 1 4 2881 1 1 13 ARG CB C -3.593 3.374 5.173 1.00 . A A . 13 ARG CB 1 1 4 2882 1 1 13 ARG CD C -4.588 1.158 5.805 1.00 . A A . 13 ARG CD 1 1 4 2883 1 1 13 ARG CG C -3.409 1.862 5.154 1.00 . A A . 13 ARG CG 1 1 4 2884 1 1 13 ARG CZ C -5.563 -1.104 5.943 1.00 . A A . 13 ARG CZ 1 1 4 2885 1 1 13 ARG H H -1.731 3.602 3.467 1.00 . A A . 13 ARG H 1 1 4 2886 1 1 13 ARG HA H -2.570 5.195 5.615 1.00 . A A . 13 ARG HA 1 1 4 2887 1 1 13 ARG HB2 H -4.308 3.616 5.946 1.00 . A A . 13 ARG HB2 1 1 4 2888 1 1 13 ARG HB3 H -3.996 3.677 4.218 1.00 . A A . 13 ARG HB3 1 1 4 2889 1 1 13 ARG HD2 H -4.549 1.338 6.869 1.00 . A A . 13 ARG HD2 1 1 4 2890 1 1 13 ARG HD3 H -5.503 1.572 5.406 1.00 . A A . 13 ARG HD3 1 1 4 2891 1 1 13 ARG HE H -3.781 -0.666 5.126 1.00 . A A . 13 ARG HE 1 1 4 2892 1 1 13 ARG HG2 H -3.324 1.529 4.129 1.00 . A A . 13 ARG HG2 1 1 4 2893 1 1 13 ARG HG3 H -2.509 1.610 5.694 1.00 . A A . 13 ARG HG3 1 1 4 2894 1 1 13 ARG HH11 H -6.789 0.381 6.605 1.00 . A A . 13 ARG HH11 1 1 4 2895 1 1 13 ARG HH12 H -7.416 -1.237 6.756 1.00 . A A . 13 ARG HH12 1 1 4 2896 1 1 13 ARG HH21 H -4.609 -2.797 5.337 1.00 . A A . 13 ARG HH21 1 1 4 2897 1 1 13 ARG HH22 H -6.183 -3.033 6.055 1.00 . A A . 13 ARG HH22 1 1 4 2898 1 1 13 ARG N N -1.452 4.145 4.237 1.00 . A A . 13 ARG N 1 1 4 2899 1 1 13 ARG NE N -4.579 -0.284 5.572 1.00 . A A . 13 ARG NE 1 1 4 2900 1 1 13 ARG NH1 N -6.676 -0.616 6.479 1.00 . A A . 13 ARG NH1 1 1 4 2901 1 1 13 ARG NH2 N -5.442 -2.412 5.762 1.00 . A A . 13 ARG NH2 1 1 4 2902 1 1 13 ARG O O -2.222 3.387 7.709 1.00 . A A . 13 ARG O 1 1 4 2903 1 1 14 VAL C C 1.170 4.382 8.436 1.00 . A A . 14 VAL C 1 1 4 2904 1 1 14 VAL CA C 0.521 3.164 7.782 1.00 . A A . 14 VAL CA 1 1 4 2905 1 1 14 VAL CB C 1.621 2.152 7.394 1.00 . A A . 14 VAL CB 1 1 4 2906 1 1 14 VAL CG1 C 2.230 1.512 8.635 1.00 . A A . 14 VAL CG1 1 1 4 2907 1 1 14 VAL CG2 C 1.071 1.088 6.454 1.00 . A A . 14 VAL CG2 1 1 4 2908 1 1 14 VAL H H 0.186 3.863 5.817 1.00 . A A . 14 VAL H 1 1 4 2909 1 1 14 VAL HA H -0.142 2.691 8.494 1.00 . A A . 14 VAL HA 1 1 4 2910 1 1 14 VAL HB H 2.404 2.685 6.875 1.00 . A A . 14 VAL HB 1 1 4 2911 1 1 14 VAL HG11 H 1.446 1.268 9.337 1.00 . A A . 14 VAL HG11 1 1 4 2912 1 1 14 VAL HG12 H 2.754 0.610 8.354 1.00 . A A . 14 VAL HG12 1 1 4 2913 1 1 14 VAL HG13 H 2.921 2.203 9.093 1.00 . A A . 14 VAL HG13 1 1 4 2914 1 1 14 VAL HG21 H 1.353 1.325 5.439 1.00 . A A . 14 VAL HG21 1 1 4 2915 1 1 14 VAL HG22 H 1.474 0.125 6.724 1.00 . A A . 14 VAL HG22 1 1 4 2916 1 1 14 VAL HG23 H -0.007 1.061 6.530 1.00 . A A . 14 VAL HG23 1 1 4 2917 1 1 14 VAL N N -0.270 3.566 6.628 1.00 . A A . 14 VAL N 1 1 4 2918 1 1 14 VAL O O 0.818 4.762 9.553 1.00 . A A . 14 VAL O 1 1 4 2919 1 1 15 CYS C C 2.235 7.433 7.923 1.00 . A A . 15 CYS C 1 1 4 2920 1 1 15 CYS CA C 2.897 6.097 8.271 1.00 . A A . 15 CYS CA 1 1 4 2921 1 1 15 CYS CB C 4.327 6.047 7.726 1.00 . A A . 15 CYS CB 1 1 4 2922 1 1 15 CYS H H 2.396 4.591 6.882 1.00 . A A . 15 CYS H 1 1 4 2923 1 1 15 CYS HA H 2.931 5.998 9.346 1.00 . A A . 15 CYS HA 1 1 4 2924 1 1 15 CYS HB2 H 4.967 6.648 8.357 1.00 . A A . 15 CYS HB2 1 1 4 2925 1 1 15 CYS HB3 H 4.673 5.025 7.743 1.00 . A A . 15 CYS HB3 1 1 4 2926 1 1 15 CYS N N 2.140 4.969 7.742 1.00 . A A . 15 CYS N 1 1 4 2927 1 1 15 CYS O O 2.685 8.492 8.370 1.00 . A A . 15 CYS O 1 1 4 2928 1 1 15 CYS SG S 4.504 6.661 6.020 1.00 . A A . 15 CYS SG 1 1 4 2929 1 1 16 LYS C C 1.209 9.365 5.608 1.00 . A A . 16 LYS C 1 1 4 2930 1 1 16 LYS CA C 0.437 8.542 6.640 1.00 . A A . 16 LYS CA 1 1 4 2931 1 1 16 LYS CB C 0.024 9.428 7.819 1.00 . A A . 16 LYS CB 1 1 4 2932 1 1 16 LYS CD C -1.315 8.441 9.692 1.00 . A A . 16 LYS CD 1 1 4 2933 1 1 16 LYS CE C -1.817 7.008 9.612 1.00 . A A . 16 LYS CE 1 1 4 2934 1 1 16 LYS CG C -1.369 9.129 8.340 1.00 . A A . 16 LYS CG 1 1 4 2935 1 1 16 LYS H H 0.916 6.483 6.765 1.00 . A A . 16 LYS H 1 1 4 2936 1 1 16 LYS HA H -0.461 8.175 6.164 1.00 . A A . 16 LYS HA 1 1 4 2937 1 1 16 LYS HB2 H 0.728 9.284 8.626 1.00 . A A . 16 LYS HB2 1 1 4 2938 1 1 16 LYS HB3 H 0.056 10.461 7.506 1.00 . A A . 16 LYS HB3 1 1 4 2939 1 1 16 LYS HD2 H -0.294 8.435 10.042 1.00 . A A . 16 LYS HD2 1 1 4 2940 1 1 16 LYS HD3 H -1.933 8.989 10.388 1.00 . A A . 16 LYS HD3 1 1 4 2941 1 1 16 LYS HE2 H -1.582 6.612 8.635 1.00 . A A . 16 LYS HE2 1 1 4 2942 1 1 16 LYS HE3 H -1.314 6.423 10.368 1.00 . A A . 16 LYS HE3 1 1 4 2943 1 1 16 LYS HG2 H -1.912 10.056 8.440 1.00 . A A . 16 LYS HG2 1 1 4 2944 1 1 16 LYS HG3 H -1.876 8.485 7.635 1.00 . A A . 16 LYS HG3 1 1 4 2945 1 1 16 LYS HZ1 H -3.492 6.536 10.773 1.00 . A A . 16 LYS HZ1 1 1 4 2946 1 1 16 LYS HZ2 H -3.720 6.306 9.110 1.00 . A A . 16 LYS HZ2 1 1 4 2947 1 1 16 LYS HZ3 H -3.715 7.873 9.752 1.00 . A A . 16 LYS HZ3 1 1 4 2948 1 1 16 LYS N N 1.192 7.364 7.092 1.00 . A A . 16 LYS N 1 1 4 2949 1 1 16 LYS NZ N -3.285 6.925 9.827 1.00 . A A . 16 LYS NZ 1 1 4 2950 1 1 16 LYS O O 0.705 10.369 5.108 1.00 . A A . 16 LYS O 1 1 4 2951 1 1 17 ASP C C 2.722 9.089 2.828 1.00 . A A . 17 ASP C 1 1 4 2952 1 1 17 ASP CA C 3.178 9.565 4.197 1.00 . A A . 17 ASP CA 1 1 4 2953 1 1 17 ASP CB C 4.661 9.264 4.375 1.00 . A A . 17 ASP CB 1 1 4 2954 1 1 17 ASP CG C 5.526 10.504 4.330 1.00 . A A . 17 ASP CG 1 1 4 2955 1 1 17 ASP H H 2.741 8.081 5.646 1.00 . A A . 17 ASP H 1 1 4 2956 1 1 17 ASP HA H 3.013 10.628 4.276 1.00 . A A . 17 ASP HA 1 1 4 2957 1 1 17 ASP HB2 H 4.806 8.782 5.332 1.00 . A A . 17 ASP HB2 1 1 4 2958 1 1 17 ASP HB3 H 4.978 8.591 3.591 1.00 . A A . 17 ASP HB3 1 1 4 2959 1 1 17 ASP N N 2.394 8.903 5.237 1.00 . A A . 17 ASP N 1 1 4 2960 1 1 17 ASP O O 2.310 7.935 2.678 1.00 . A A . 17 ASP O 1 1 4 2961 1 1 17 ASP OD1 O 5.578 11.163 3.270 1.00 . A A . 17 ASP OD1 1 1 4 2962 1 1 17 ASP OD2 O 6.169 10.819 5.352 1.00 . A A . 17 ASP OD2 1 1 4 2963 1 1 18 GLY C C 3.054 10.225 -0.605 1.00 . A A . 18 GLY C 1 1 4 2964 1 1 18 GLY CA C 2.257 9.614 0.529 1.00 . A A . 18 GLY CA 1 1 4 2965 1 1 18 GLY H H 3.062 10.891 2.014 1.00 . A A . 18 GLY H 1 1 4 2966 1 1 18 GLY HA2 H 2.290 8.538 0.432 1.00 . A A . 18 GLY HA2 1 1 4 2967 1 1 18 GLY HA3 H 1.229 9.940 0.444 1.00 . A A . 18 GLY HA3 1 1 4 2968 1 1 18 GLY N N 2.748 9.974 1.841 1.00 . A A . 18 GLY N 1 1 4 2969 1 1 18 GLY O O 2.480 10.814 -1.519 1.00 . A A . 18 GLY O 1 1 4 2970 1 1 19 GLY C C 5.090 9.596 -2.894 1.00 . A A . 19 GLY C 1 1 4 2971 1 1 19 GLY CA C 5.192 10.498 -1.678 1.00 . A A . 19 GLY CA 1 1 4 2972 1 1 19 GLY H H 4.768 9.516 0.149 1.00 . A A . 19 GLY H 1 1 4 2973 1 1 19 GLY HA2 H 4.877 11.495 -1.951 1.00 . A A . 19 GLY HA2 1 1 4 2974 1 1 19 GLY HA3 H 6.221 10.530 -1.351 1.00 . A A . 19 GLY HA3 1 1 4 2975 1 1 19 GLY N N 4.363 10.025 -0.588 1.00 . A A . 19 GLY N 1 1 4 2976 1 1 19 GLY O O 4.514 9.976 -3.916 1.00 . A A . 19 GLY O 1 1 4 2977 1 1 20 GLU C C 4.704 6.185 -3.333 1.00 . A A . 20 GLU C 1 1 4 2978 1 1 20 GLU CA C 5.505 7.387 -3.821 1.00 . A A . 20 GLU CA 1 1 4 2979 1 1 20 GLU CB C 6.898 6.950 -4.269 1.00 . A A . 20 GLU CB 1 1 4 2980 1 1 20 GLU CD C 9.008 7.829 -5.329 1.00 . A A . 20 GLU CD 1 1 4 2981 1 1 20 GLU CG C 7.497 7.855 -5.329 1.00 . A A . 20 GLU CG 1 1 4 2982 1 1 20 GLU H H 6.022 8.129 -1.909 1.00 . A A . 20 GLU H 1 1 4 2983 1 1 20 GLU HA H 4.987 7.837 -4.656 1.00 . A A . 20 GLU HA 1 1 4 2984 1 1 20 GLU HB2 H 7.557 6.948 -3.413 1.00 . A A . 20 GLU HB2 1 1 4 2985 1 1 20 GLU HB3 H 6.839 5.951 -4.671 1.00 . A A . 20 GLU HB3 1 1 4 2986 1 1 20 GLU HG2 H 7.147 7.531 -6.298 1.00 . A A . 20 GLU HG2 1 1 4 2987 1 1 20 GLU HG3 H 7.167 8.866 -5.148 1.00 . A A . 20 GLU HG3 1 1 4 2988 1 1 20 GLU N N 5.598 8.381 -2.762 1.00 . A A . 20 GLU N 1 1 4 2989 1 1 20 GLU O O 5.166 5.426 -2.477 1.00 . A A . 20 GLU O 1 1 4 2990 1 1 20 GLU OE1 O 9.585 6.824 -5.791 1.00 . A A . 20 GLU OE1 1 1 4 2991 1 1 20 GLU OE2 O 9.624 8.816 -4.877 1.00 . A A . 20 GLU OE2 1 1 4 2992 1 1 21 LEU C C 2.488 3.881 -4.260 1.00 . A A . 21 LEU C 1 1 4 2993 1 1 21 LEU CA C 2.556 5.058 -3.298 1.00 . A A . 21 LEU CA 1 1 4 2994 1 1 21 LEU CB C 1.149 5.631 -3.098 1.00 . A A . 21 LEU CB 1 1 4 2995 1 1 21 LEU CD1 C 2.029 6.151 -0.786 1.00 . A A . 21 LEU CD1 1 1 4 2996 1 1 21 LEU CD2 C 0.809 7.898 -2.101 1.00 . A A . 21 LEU CD2 1 1 4 2997 1 1 21 LEU CG C 0.921 6.413 -1.799 1.00 . A A . 21 LEU CG 1 1 4 2998 1 1 21 LEU H H 3.119 6.778 -4.397 1.00 . A A . 21 LEU H 1 1 4 2999 1 1 21 LEU HA H 2.927 4.709 -2.347 1.00 . A A . 21 LEU HA 1 1 4 3000 1 1 21 LEU HB2 H 0.936 6.287 -3.929 1.00 . A A . 21 LEU HB2 1 1 4 3001 1 1 21 LEU HB3 H 0.446 4.811 -3.125 1.00 . A A . 21 LEU HB3 1 1 4 3002 1 1 21 LEU HD11 H 1.608 6.117 0.208 1.00 . A A . 21 LEU HD11 1 1 4 3003 1 1 21 LEU HD12 H 2.505 5.207 -1.009 1.00 . A A . 21 LEU HD12 1 1 4 3004 1 1 21 LEU HD13 H 2.760 6.944 -0.842 1.00 . A A . 21 LEU HD13 1 1 4 3005 1 1 21 LEU HD21 H 1.555 8.437 -1.536 1.00 . A A . 21 LEU HD21 1 1 4 3006 1 1 21 LEU HD22 H 0.966 8.066 -3.157 1.00 . A A . 21 LEU HD22 1 1 4 3007 1 1 21 LEU HD23 H -0.175 8.248 -1.823 1.00 . A A . 21 LEU HD23 1 1 4 3008 1 1 21 LEU HG H -0.010 6.093 -1.357 1.00 . A A . 21 LEU HG 1 1 4 3009 1 1 21 LEU N N 3.462 6.091 -3.781 1.00 . A A . 21 LEU N 1 1 4 3010 1 1 21 LEU O O 1.963 3.999 -5.369 1.00 . A A . 21 LEU O 1 1 4 3011 1 1 22 LEU C C 1.406 0.855 -4.163 1.00 . A A . 22 LEU C 1 1 4 3012 1 1 22 LEU CA C 2.747 1.486 -4.515 1.00 . A A . 22 LEU CA 1 1 4 3013 1 1 22 LEU CB C 3.908 0.535 -4.195 1.00 . A A . 22 LEU CB 1 1 4 3014 1 1 22 LEU CD1 C 3.707 -1.790 -5.108 1.00 . A A . 22 LEU CD1 1 1 4 3015 1 1 22 LEU CD2 C 4.342 -1.440 -2.715 1.00 . A A . 22 LEU CD2 1 1 4 3016 1 1 22 LEU CG C 3.520 -0.912 -3.881 1.00 . A A . 22 LEU CG 1 1 4 3017 1 1 22 LEU H H 3.203 2.682 -2.838 1.00 . A A . 22 LEU H 1 1 4 3018 1 1 22 LEU HA H 2.760 1.726 -5.569 1.00 . A A . 22 LEU HA 1 1 4 3019 1 1 22 LEU HB2 H 4.578 0.526 -5.042 1.00 . A A . 22 LEU HB2 1 1 4 3020 1 1 22 LEU HB3 H 4.441 0.931 -3.344 1.00 . A A . 22 LEU HB3 1 1 4 3021 1 1 22 LEU HD11 H 4.763 -1.938 -5.284 1.00 . A A . 22 LEU HD11 1 1 4 3022 1 1 22 LEU HD12 H 3.233 -2.744 -4.942 1.00 . A A . 22 LEU HD12 1 1 4 3023 1 1 22 LEU HD13 H 3.262 -1.310 -5.968 1.00 . A A . 22 LEU HD13 1 1 4 3024 1 1 22 LEU HD21 H 4.569 -0.631 -2.039 1.00 . A A . 22 LEU HD21 1 1 4 3025 1 1 22 LEU HD22 H 3.779 -2.200 -2.192 1.00 . A A . 22 LEU HD22 1 1 4 3026 1 1 22 LEU HD23 H 5.262 -1.867 -3.087 1.00 . A A . 22 LEU HD23 1 1 4 3027 1 1 22 LEU HG H 2.478 -0.947 -3.600 1.00 . A A . 22 LEU HG 1 1 4 3028 1 1 22 LEU N N 2.895 2.723 -3.771 1.00 . A A . 22 LEU N 1 1 4 3029 1 1 22 LEU O O 0.966 0.933 -3.017 1.00 . A A . 22 LEU O 1 1 4 3030 1 1 23 CYS C C -0.663 -1.660 -5.593 1.00 . A A . 23 CYS C 1 1 4 3031 1 1 23 CYS CA C -0.596 -0.272 -4.962 1.00 . A A . 23 CYS CA 1 1 4 3032 1 1 23 CYS CB C -1.679 0.629 -5.561 1.00 . A A . 23 CYS CB 1 1 4 3033 1 1 23 CYS H H 1.108 0.328 -6.070 1.00 . A A . 23 CYS H 1 1 4 3034 1 1 23 CYS HA H -0.759 -0.364 -3.900 1.00 . A A . 23 CYS HA 1 1 4 3035 1 1 23 CYS HB2 H -1.935 0.263 -6.545 1.00 . A A . 23 CYS HB2 1 1 4 3036 1 1 23 CYS HB3 H -2.556 0.591 -4.931 1.00 . A A . 23 CYS HB3 1 1 4 3037 1 1 23 CYS HG H 0.071 2.470 -5.346 1.00 . A A . 23 CYS HG 1 1 4 3038 1 1 23 CYS N N 0.722 0.318 -5.164 1.00 . A A . 23 CYS N 1 1 4 3039 1 1 23 CYS O O 0.157 -2.001 -6.452 1.00 . A A . 23 CYS O 1 1 4 3040 1 1 23 CYS SG S -1.193 2.366 -5.731 1.00 . A A . 23 CYS SG 1 1 4 3041 1 1 24 CYS C C -2.486 -3.925 -6.919 1.00 . A A . 24 CYS C 1 1 4 3042 1 1 24 CYS CA C -1.739 -3.843 -5.590 1.00 . A A . 24 CYS CA 1 1 4 3043 1 1 24 CYS CB C -2.484 -4.649 -4.532 1.00 . A A . 24 CYS CB 1 1 4 3044 1 1 24 CYS H H -2.208 -2.155 -4.420 1.00 . A A . 24 CYS H 1 1 4 3045 1 1 24 CYS HA H -0.750 -4.254 -5.715 1.00 . A A . 24 CYS HA 1 1 4 3046 1 1 24 CYS HB2 H -3.007 -5.463 -5.010 1.00 . A A . 24 CYS HB2 1 1 4 3047 1 1 24 CYS HB3 H -1.774 -5.047 -3.820 1.00 . A A . 24 CYS HB3 1 1 4 3048 1 1 24 CYS N N -1.607 -2.471 -5.130 1.00 . A A . 24 CYS N 1 1 4 3049 1 1 24 CYS O O -2.543 -2.961 -7.688 1.00 . A A . 24 CYS O 1 1 4 3050 1 1 24 CYS SG S -3.707 -3.671 -3.604 1.00 . A A . 24 CYS SG 1 1 4 3051 1 1 25 ASP C C -5.337 -5.181 -8.089 1.00 . A A . 25 ASP C 1 1 4 3052 1 1 25 ASP CA C -3.853 -5.309 -8.372 1.00 . A A . 25 ASP CA 1 1 4 3053 1 1 25 ASP CB C -3.587 -6.711 -8.914 1.00 . A A . 25 ASP CB 1 1 4 3054 1 1 25 ASP CG C -3.969 -6.853 -10.371 1.00 . A A . 25 ASP CG 1 1 4 3055 1 1 25 ASP H H -2.994 -5.797 -6.502 1.00 . A A . 25 ASP H 1 1 4 3056 1 1 25 ASP HA H -3.562 -4.577 -9.110 1.00 . A A . 25 ASP HA 1 1 4 3057 1 1 25 ASP HB2 H -2.542 -6.946 -8.806 1.00 . A A . 25 ASP HB2 1 1 4 3058 1 1 25 ASP HB3 H -4.167 -7.420 -8.342 1.00 . A A . 25 ASP HB3 1 1 4 3059 1 1 25 ASP N N -3.077 -5.079 -7.163 1.00 . A A . 25 ASP N 1 1 4 3060 1 1 25 ASP O O -6.123 -4.850 -8.974 1.00 . A A . 25 ASP O 1 1 4 3061 1 1 25 ASP OD1 O -3.315 -6.226 -11.228 1.00 . A A . 25 ASP OD1 1 1 4 3062 1 1 25 ASP OD2 O -4.924 -7.599 -10.673 1.00 . A A . 25 ASP OD2 1 1 4 3063 1 1 26 THR C C -7.719 -4.669 -5.823 1.00 . A A . 26 THR C 1 1 4 3064 1 1 26 THR CA C -7.133 -5.838 -6.614 1.00 . A A . 26 THR CA 1 1 4 3065 1 1 26 THR CB C -7.318 -7.152 -5.843 1.00 . A A . 26 THR CB 1 1 4 3066 1 1 26 THR CG2 C -7.806 -8.245 -6.778 1.00 . A A . 26 THR CG2 1 1 4 3067 1 1 26 THR H H -5.066 -6.067 -6.328 1.00 . A A . 26 THR H 1 1 4 3068 1 1 26 THR HA H -7.667 -5.924 -7.548 1.00 . A A . 26 THR HA 1 1 4 3069 1 1 26 THR HB H -8.042 -7.008 -5.055 1.00 . A A . 26 THR HB 1 1 4 3070 1 1 26 THR HG1 H -6.032 -7.327 -4.342 1.00 . A A . 26 THR HG1 1 1 4 3071 1 1 26 THR HG21 H -7.994 -9.147 -6.212 1.00 . A A . 26 THR HG21 1 1 4 3072 1 1 26 THR HG22 H -7.047 -8.440 -7.524 1.00 . A A . 26 THR HG22 1 1 4 3073 1 1 26 THR HG23 H -8.715 -7.924 -7.263 1.00 . A A . 26 THR HG23 1 1 4 3074 1 1 26 THR N N -5.731 -5.659 -6.923 1.00 . A A . 26 THR N 1 1 4 3075 1 1 26 THR O O -8.932 -4.451 -5.848 1.00 . A A . 26 THR O 1 1 4 3076 1 1 26 THR OG1 O -6.061 -7.549 -5.285 1.00 . A A . 26 THR OG1 1 1 4 3077 1 1 27 CYS C C -6.463 -1.500 -4.710 1.00 . A A . 27 CYS C 1 1 4 3078 1 1 27 CYS CA C -7.335 -2.727 -4.427 1.00 . A A . 27 CYS CA 1 1 4 3079 1 1 27 CYS CB C -7.340 -3.022 -2.922 1.00 . A A . 27 CYS CB 1 1 4 3080 1 1 27 CYS H H -5.903 -4.067 -5.220 1.00 . A A . 27 CYS H 1 1 4 3081 1 1 27 CYS HA H -8.345 -2.518 -4.746 1.00 . A A . 27 CYS HA 1 1 4 3082 1 1 27 CYS HB2 H -6.556 -2.447 -2.453 1.00 . A A . 27 CYS HB2 1 1 4 3083 1 1 27 CYS HB3 H -8.292 -2.716 -2.512 1.00 . A A . 27 CYS HB3 1 1 4 3084 1 1 27 CYS N N -6.867 -3.887 -5.170 1.00 . A A . 27 CYS N 1 1 4 3085 1 1 27 CYS O O -5.318 -1.630 -5.128 1.00 . A A . 27 CYS O 1 1 4 3086 1 1 27 CYS SG S -7.079 -4.771 -2.473 1.00 . A A . 27 CYS SG 1 1 4 3087 1 1 28 PRO C C -5.421 1.265 -3.324 1.00 . A A . 28 PRO C 1 1 4 3088 1 1 28 PRO CA C -6.220 0.945 -4.586 1.00 . A A . 28 PRO CA 1 1 4 3089 1 1 28 PRO CB C -7.316 1.981 -4.807 1.00 . A A . 28 PRO CB 1 1 4 3090 1 1 28 PRO CD C -8.335 -0.029 -3.925 1.00 . A A . 28 PRO CD 1 1 4 3091 1 1 28 PRO CG C -8.482 1.473 -4.019 1.00 . A A . 28 PRO CG 1 1 4 3092 1 1 28 PRO HA H -5.560 0.915 -5.442 1.00 . A A . 28 PRO HA 1 1 4 3093 1 1 28 PRO HB2 H -6.982 2.943 -4.449 1.00 . A A . 28 PRO HB2 1 1 4 3094 1 1 28 PRO HB3 H -7.549 2.043 -5.860 1.00 . A A . 28 PRO HB3 1 1 4 3095 1 1 28 PRO HD2 H -8.424 -0.350 -2.898 1.00 . A A . 28 PRO HD2 1 1 4 3096 1 1 28 PRO HD3 H -9.077 -0.518 -4.539 1.00 . A A . 28 PRO HD3 1 1 4 3097 1 1 28 PRO HG2 H -8.470 1.909 -3.031 1.00 . A A . 28 PRO HG2 1 1 4 3098 1 1 28 PRO HG3 H -9.401 1.726 -4.526 1.00 . A A . 28 PRO HG3 1 1 4 3099 1 1 28 PRO N N -6.979 -0.291 -4.437 1.00 . A A . 28 PRO N 1 1 4 3100 1 1 28 PRO O O -5.309 2.426 -2.919 1.00 . A A . 28 PRO O 1 1 4 3101 1 1 29 SER C C -2.887 1.002 -1.598 1.00 . A A . 29 SER C 1 1 4 3102 1 1 29 SER CA C -4.247 0.346 -1.401 1.00 . A A . 29 SER CA 1 1 4 3103 1 1 29 SER CB C -4.088 -1.035 -0.766 1.00 . A A . 29 SER CB 1 1 4 3104 1 1 29 SER H H -5.145 -0.685 -3.003 1.00 . A A . 29 SER H 1 1 4 3105 1 1 29 SER HA H -4.842 0.967 -0.748 1.00 . A A . 29 SER HA 1 1 4 3106 1 1 29 SER HB2 H -3.042 -1.308 -0.755 1.00 . A A . 29 SER HB2 1 1 4 3107 1 1 29 SER HB3 H -4.465 -1.012 0.246 1.00 . A A . 29 SER HB3 1 1 4 3108 1 1 29 SER HG H -4.218 -2.414 -2.161 1.00 . A A . 29 SER HG 1 1 4 3109 1 1 29 SER N N -4.955 0.216 -2.661 1.00 . A A . 29 SER N 1 1 4 3110 1 1 29 SER O O -1.932 0.367 -2.041 1.00 . A A . 29 SER O 1 1 4 3111 1 1 29 SER OG O -4.810 -2.008 -1.503 1.00 . A A . 29 SER OG 1 1 4 3112 1 1 30 SER C C -0.663 2.783 -0.276 1.00 . A A . 30 SER C 1 1 4 3113 1 1 30 SER CA C -1.598 3.045 -1.453 1.00 . A A . 30 SER CA 1 1 4 3114 1 1 30 SER CB C -1.944 4.528 -1.552 1.00 . A A . 30 SER CB 1 1 4 3115 1 1 30 SER H H -3.630 2.754 -1.003 1.00 . A A . 30 SER H 1 1 4 3116 1 1 30 SER HA H -1.117 2.727 -2.365 1.00 . A A . 30 SER HA 1 1 4 3117 1 1 30 SER HB2 H -1.697 5.019 -0.621 1.00 . A A . 30 SER HB2 1 1 4 3118 1 1 30 SER HB3 H -1.382 4.976 -2.358 1.00 . A A . 30 SER HB3 1 1 4 3119 1 1 30 SER HG H -3.602 5.592 -1.547 1.00 . A A . 30 SER HG 1 1 4 3120 1 1 30 SER N N -2.821 2.288 -1.301 1.00 . A A . 30 SER N 1 1 4 3121 1 1 30 SER O O -1.023 3.012 0.882 1.00 . A A . 30 SER O 1 1 4 3122 1 1 30 SER OG O -3.333 4.699 -1.808 1.00 . A A . 30 SER OG 1 1 4 3123 1 1 31 TYR C C 2.824 2.183 0.165 1.00 . A A . 31 TYR C 1 1 4 3124 1 1 31 TYR CA C 1.397 1.768 0.483 1.00 . A A . 31 TYR CA 1 1 4 3125 1 1 31 TYR CB C 1.350 0.253 0.661 1.00 . A A . 31 TYR CB 1 1 4 3126 1 1 31 TYR CD1 C 0.180 0.111 2.889 1.00 . A A . 31 TYR CD1 1 1 4 3127 1 1 31 TYR CD2 C -0.793 -1.013 1.027 1.00 . A A . 31 TYR CD2 1 1 4 3128 1 1 31 TYR CE1 C -0.842 -0.337 3.699 1.00 . A A . 31 TYR CE1 1 1 4 3129 1 1 31 TYR CE2 C -1.818 -1.467 1.830 1.00 . A A . 31 TYR CE2 1 1 4 3130 1 1 31 TYR CG C 0.223 -0.223 1.542 1.00 . A A . 31 TYR CG 1 1 4 3131 1 1 31 TYR CZ C -1.840 -1.123 3.165 1.00 . A A . 31 TYR CZ 1 1 4 3132 1 1 31 TYR H H 0.662 1.910 -1.495 1.00 . A A . 31 TYR H 1 1 4 3133 1 1 31 TYR HA H 1.089 2.239 1.403 1.00 . A A . 31 TYR HA 1 1 4 3134 1 1 31 TYR HB2 H 1.232 -0.211 -0.307 1.00 . A A . 31 TYR HB2 1 1 4 3135 1 1 31 TYR HB3 H 2.278 -0.080 1.102 1.00 . A A . 31 TYR HB3 1 1 4 3136 1 1 31 TYR HD1 H 0.963 0.730 3.301 1.00 . A A . 31 TYR HD1 1 1 4 3137 1 1 31 TYR HD2 H -0.772 -1.276 -0.021 1.00 . A A . 31 TYR HD2 1 1 4 3138 1 1 31 TYR HE1 H -0.859 -0.067 4.744 1.00 . A A . 31 TYR HE1 1 1 4 3139 1 1 31 TYR HE2 H -2.600 -2.081 1.410 1.00 . A A . 31 TYR HE2 1 1 4 3140 1 1 31 TYR HH H -2.520 -2.269 4.557 1.00 . A A . 31 TYR HH 1 1 4 3141 1 1 31 TYR N N 0.477 2.176 -0.562 1.00 . A A . 31 TYR N 1 1 4 3142 1 1 31 TYR O O 3.148 2.517 -0.974 1.00 . A A . 31 TYR O 1 1 4 3143 1 1 31 TYR OH O -2.858 -1.573 3.969 1.00 . A A . 31 TYR OH 1 1 4 3144 1 1 32 HIS C C 5.779 0.822 0.982 1.00 . A A . 32 HIS C 1 1 4 3145 1 1 32 HIS CA C 5.120 2.188 0.960 1.00 . A A . 32 HIS CA 1 1 4 3146 1 1 32 HIS CB C 5.711 3.062 2.065 1.00 . A A . 32 HIS CB 1 1 4 3147 1 1 32 HIS CD2 C 5.894 5.252 0.718 1.00 . A A . 32 HIS CD2 1 1 4 3148 1 1 32 HIS CE1 C 5.093 6.575 2.250 1.00 . A A . 32 HIS CE1 1 1 4 3149 1 1 32 HIS CG C 5.576 4.529 1.817 1.00 . A A . 32 HIS CG 1 1 4 3150 1 1 32 HIS H H 3.378 1.622 1.990 1.00 . A A . 32 HIS H 1 1 4 3151 1 1 32 HIS HA H 5.286 2.653 0.000 1.00 . A A . 32 HIS HA 1 1 4 3152 1 1 32 HIS HB2 H 5.212 2.838 2.995 1.00 . A A . 32 HIS HB2 1 1 4 3153 1 1 32 HIS HB3 H 6.763 2.839 2.166 1.00 . A A . 32 HIS HB3 1 1 4 3154 1 1 32 HIS HD2 H 6.303 4.874 -0.208 1.00 . A A . 32 HIS HD2 1 1 4 3155 1 1 32 HIS HE1 H 4.746 7.460 2.758 1.00 . A A . 32 HIS HE1 1 1 4 3156 1 1 32 HIS HE2 H 5.968 7.343 0.531 1.00 . A A . 32 HIS HE2 1 1 4 3157 1 1 32 HIS N N 3.692 2.012 1.150 1.00 . A A . 32 HIS N 1 1 4 3158 1 1 32 HIS ND1 N 5.073 5.368 2.771 1.00 . A A . 32 HIS ND1 1 1 4 3159 1 1 32 HIS NE2 N 5.586 6.561 0.999 1.00 . A A . 32 HIS NE2 1 1 4 3160 1 1 32 HIS O O 5.244 -0.108 1.583 1.00 . A A . 32 HIS O 1 1 4 3161 1 1 33 ILE C C 8.131 -1.046 1.602 1.00 . A A . 33 ILE C 1 1 4 3162 1 1 33 ILE CA C 7.601 -0.592 0.240 1.00 . A A . 33 ILE CA 1 1 4 3163 1 1 33 ILE CB C 8.761 -0.540 -0.782 1.00 . A A . 33 ILE CB 1 1 4 3164 1 1 33 ILE CD1 C 11.206 0.130 -1.057 1.00 . A A . 33 ILE CD1 1 1 4 3165 1 1 33 ILE CG1 C 9.940 0.273 -0.238 1.00 . A A . 33 ILE CG1 1 1 4 3166 1 1 33 ILE CG2 C 8.272 0.054 -2.093 1.00 . A A . 33 ILE CG2 1 1 4 3167 1 1 33 ILE H H 7.290 1.467 -0.145 1.00 . A A . 33 ILE H 1 1 4 3168 1 1 33 ILE HA H 6.882 -1.320 -0.108 1.00 . A A . 33 ILE HA 1 1 4 3169 1 1 33 ILE HB H 9.087 -1.550 -0.973 1.00 . A A . 33 ILE HB 1 1 4 3170 1 1 33 ILE HD11 H 11.319 0.991 -1.699 1.00 . A A . 33 ILE HD11 1 1 4 3171 1 1 33 ILE HD12 H 12.058 0.059 -0.396 1.00 . A A . 33 ILE HD12 1 1 4 3172 1 1 33 ILE HD13 H 11.145 -0.763 -1.662 1.00 . A A . 33 ILE HD13 1 1 4 3173 1 1 33 ILE HG12 H 9.672 1.318 -0.225 1.00 . A A . 33 ILE HG12 1 1 4 3174 1 1 33 ILE HG21 H 7.617 0.888 -1.887 1.00 . A A . 33 ILE HG21 1 1 4 3175 1 1 33 ILE HG22 H 9.118 0.397 -2.670 1.00 . A A . 33 ILE HG22 1 1 4 3176 1 1 33 ILE HG23 H 7.734 -0.698 -2.652 1.00 . A A . 33 ILE HG23 1 1 4 3177 1 1 33 ILE N N 6.917 0.693 0.326 1.00 . A A . 33 ILE N 1 1 4 3178 1 1 33 ILE O O 8.422 -2.224 1.801 1.00 . A A . 33 ILE O 1 1 4 3179 1 1 34 HIS C C 7.913 -0.202 4.955 1.00 . A A . 34 HIS C 1 1 4 3180 1 1 34 HIS CA C 8.908 -0.386 3.811 1.00 . A A . 34 HIS CA 1 1 4 3181 1 1 34 HIS CB C 10.127 0.518 4.035 1.00 . A A . 34 HIS CB 1 1 4 3182 1 1 34 HIS CD2 C 9.907 3.005 4.698 1.00 . A A . 34 HIS CD2 1 1 4 3183 1 1 34 HIS CE1 C 9.382 3.777 2.733 1.00 . A A . 34 HIS CE1 1 1 4 3184 1 1 34 HIS CG C 9.860 1.980 3.817 1.00 . A A . 34 HIS CG 1 1 4 3185 1 1 34 HIS H H 8.122 0.835 2.273 1.00 . A A . 34 HIS H 1 1 4 3186 1 1 34 HIS HA H 9.237 -1.414 3.800 1.00 . A A . 34 HIS HA 1 1 4 3187 1 1 34 HIS HB2 H 10.473 0.394 5.052 1.00 . A A . 34 HIS HB2 1 1 4 3188 1 1 34 HIS HB3 H 10.914 0.220 3.357 1.00 . A A . 34 HIS HB3 1 1 4 3189 1 1 34 HIS HD2 H 10.139 2.941 5.751 1.00 . A A . 34 HIS HD2 1 1 4 3190 1 1 34 HIS HE1 H 9.122 4.460 1.938 1.00 . A A . 34 HIS HE1 1 1 4 3191 1 1 34 HIS HE2 H 9.767 5.069 4.309 1.00 . A A . 34 HIS HE2 1 1 4 3192 1 1 34 HIS N N 8.309 -0.098 2.513 1.00 . A A . 34 HIS N 1 1 4 3193 1 1 34 HIS ND1 N 9.527 2.474 2.577 1.00 . A A . 34 HIS ND1 1 1 4 3194 1 1 34 HIS NE2 N 9.604 4.147 4.000 1.00 . A A . 34 HIS NE2 1 1 4 3195 1 1 34 HIS O O 8.285 -0.299 6.124 1.00 . A A . 34 HIS O 1 1 4 3196 1 1 35 CYS C C 4.753 -0.860 5.877 1.00 . A A . 35 CYS C 1 1 4 3197 1 1 35 CYS CA C 5.658 0.352 5.655 1.00 . A A . 35 CYS CA 1 1 4 3198 1 1 35 CYS CB C 4.835 1.588 5.287 1.00 . A A . 35 CYS CB 1 1 4 3199 1 1 35 CYS H H 6.422 0.190 3.684 1.00 . A A . 35 CYS H 1 1 4 3200 1 1 35 CYS HA H 6.185 0.552 6.576 1.00 . A A . 35 CYS HA 1 1 4 3201 1 1 35 CYS HB2 H 4.492 1.495 4.268 1.00 . A A . 35 CYS HB2 1 1 4 3202 1 1 35 CYS HB3 H 3.982 1.659 5.948 1.00 . A A . 35 CYS HB3 1 1 4 3203 1 1 35 CYS N N 6.663 0.098 4.628 1.00 . A A . 35 CYS N 1 1 4 3204 1 1 35 CYS O O 3.823 -0.818 6.684 1.00 . A A . 35 CYS O 1 1 4 3205 1 1 35 CYS SG S 5.777 3.144 5.420 1.00 . A A . 35 CYS SG 1 1 4 3206 1 1 36 LEU C C 5.239 -4.188 6.278 1.00 . A A . 36 LEU C 1 1 4 3207 1 1 36 LEU CA C 4.391 -3.218 5.475 1.00 . A A . 36 LEU CA 1 1 4 3208 1 1 36 LEU CB C 4.016 -3.858 4.140 1.00 . A A . 36 LEU CB 1 1 4 3209 1 1 36 LEU CD1 C 4.217 -3.179 1.743 1.00 . A A . 36 LEU CD1 1 1 4 3210 1 1 36 LEU CD2 C 2.028 -2.962 2.924 1.00 . A A . 36 LEU CD2 1 1 4 3211 1 1 36 LEU CG C 3.538 -2.885 3.067 1.00 . A A . 36 LEU CG 1 1 4 3212 1 1 36 LEU H H 5.920 -1.978 4.716 1.00 . A A . 36 LEU H 1 1 4 3213 1 1 36 LEU HA H 3.490 -2.996 6.029 1.00 . A A . 36 LEU HA 1 1 4 3214 1 1 36 LEU HB2 H 4.882 -4.380 3.763 1.00 . A A . 36 LEU HB2 1 1 4 3215 1 1 36 LEU HB3 H 3.231 -4.578 4.317 1.00 . A A . 36 LEU HB3 1 1 4 3216 1 1 36 LEU HD11 H 3.493 -3.100 0.944 1.00 . A A . 36 LEU HD11 1 1 4 3217 1 1 36 LEU HD12 H 5.013 -2.467 1.579 1.00 . A A . 36 LEU HD12 1 1 4 3218 1 1 36 LEU HD13 H 4.624 -4.177 1.762 1.00 . A A . 36 LEU HD13 1 1 4 3219 1 1 36 LEU HD21 H 1.776 -3.654 2.134 1.00 . A A . 36 LEU HD21 1 1 4 3220 1 1 36 LEU HD22 H 1.595 -3.304 3.854 1.00 . A A . 36 LEU HD22 1 1 4 3221 1 1 36 LEU HD23 H 1.639 -1.984 2.685 1.00 . A A . 36 LEU HD23 1 1 4 3222 1 1 36 LEU HG H 3.796 -1.878 3.360 1.00 . A A . 36 LEU HG 1 1 4 3223 1 1 36 LEU N N 5.109 -1.972 5.262 1.00 . A A . 36 LEU N 1 1 4 3224 1 1 36 LEU O O 6.459 -4.032 6.361 1.00 . A A . 36 LEU O 1 1 4 3225 1 1 37 ARG C C 6.175 -7.095 6.468 1.00 . A A . 37 ARG C 1 1 4 3226 1 1 37 ARG CA C 5.318 -6.305 7.462 1.00 . A A . 37 ARG CA 1 1 4 3227 1 1 37 ARG CB C 4.347 -7.225 8.202 1.00 . A A . 37 ARG CB 1 1 4 3228 1 1 37 ARG CD C 2.538 -6.175 9.596 1.00 . A A . 37 ARG CD 1 1 4 3229 1 1 37 ARG CG C 3.961 -6.710 9.577 1.00 . A A . 37 ARG CG 1 1 4 3230 1 1 37 ARG CZ C 2.364 -4.769 11.617 1.00 . A A . 37 ARG CZ 1 1 4 3231 1 1 37 ARG H H 3.638 -5.347 6.594 1.00 . A A . 37 ARG H 1 1 4 3232 1 1 37 ARG HA H 5.974 -5.839 8.184 1.00 . A A . 37 ARG HA 1 1 4 3233 1 1 37 ARG HB2 H 3.448 -7.332 7.613 1.00 . A A . 37 ARG HB2 1 1 4 3234 1 1 37 ARG HB3 H 4.807 -8.195 8.320 1.00 . A A . 37 ARG HB3 1 1 4 3235 1 1 37 ARG HD2 H 2.202 -6.045 8.578 1.00 . A A . 37 ARG HD2 1 1 4 3236 1 1 37 ARG HD3 H 1.904 -6.893 10.095 1.00 . A A . 37 ARG HD3 1 1 4 3237 1 1 37 ARG HE H 2.454 -4.075 9.737 1.00 . A A . 37 ARG HE 1 1 4 3238 1 1 37 ARG HG2 H 4.038 -7.522 10.286 1.00 . A A . 37 ARG HG2 1 1 4 3239 1 1 37 ARG HG3 H 4.639 -5.918 9.858 1.00 . A A . 37 ARG HG3 1 1 4 3240 1 1 37 ARG HH11 H 2.344 -6.770 11.987 1.00 . A A . 37 ARG HH11 1 1 4 3241 1 1 37 ARG HH12 H 2.278 -5.749 13.398 1.00 . A A . 37 ARG HH12 1 1 4 3242 1 1 37 ARG HH21 H 2.324 -2.739 11.586 1.00 . A A . 37 ARG HH21 1 1 4 3243 1 1 37 ARG HH22 H 2.250 -3.465 13.165 1.00 . A A . 37 ARG HH22 1 1 4 3244 1 1 37 ARG N N 4.603 -5.240 6.774 1.00 . A A . 37 ARG N 1 1 4 3245 1 1 37 ARG NE N 2.445 -4.894 10.292 1.00 . A A . 37 ARG NE 1 1 4 3246 1 1 37 ARG NH1 N 2.321 -5.848 12.394 1.00 . A A . 37 ARG NH1 1 1 4 3247 1 1 37 ARG NH2 N 2.307 -3.564 12.167 1.00 . A A . 37 ARG NH2 1 1 4 3248 1 1 37 ARG O O 7.398 -7.124 6.603 1.00 . A A . 37 ARG O 1 1 4 3249 1 1 38 PRO C C 6.968 -7.190 3.401 1.00 . A A . 38 PRO C 1 1 4 3250 1 1 38 PRO CA C 6.337 -8.253 4.295 1.00 . A A . 38 PRO CA 1 1 4 3251 1 1 38 PRO CB C 5.282 -9.062 3.515 1.00 . A A . 38 PRO CB 1 1 4 3252 1 1 38 PRO CD C 4.153 -7.582 5.031 1.00 . A A . 38 PRO CD 1 1 4 3253 1 1 38 PRO CG C 3.978 -8.826 4.211 1.00 . A A . 38 PRO CG 1 1 4 3254 1 1 38 PRO HA H 7.104 -8.913 4.676 1.00 . A A . 38 PRO HA 1 1 4 3255 1 1 38 PRO HB2 H 5.246 -8.713 2.493 1.00 . A A . 38 PRO HB2 1 1 4 3256 1 1 38 PRO HB3 H 5.550 -10.108 3.530 1.00 . A A . 38 PRO HB3 1 1 4 3257 1 1 38 PRO HD2 H 3.923 -6.705 4.445 1.00 . A A . 38 PRO HD2 1 1 4 3258 1 1 38 PRO HD3 H 3.540 -7.621 5.919 1.00 . A A . 38 PRO HD3 1 1 4 3259 1 1 38 PRO HG2 H 3.193 -8.686 3.485 1.00 . A A . 38 PRO HG2 1 1 4 3260 1 1 38 PRO HG3 H 3.750 -9.665 4.851 1.00 . A A . 38 PRO HG3 1 1 4 3261 1 1 38 PRO N N 5.578 -7.629 5.374 1.00 . A A . 38 PRO N 1 1 4 3262 1 1 38 PRO O O 6.562 -7.004 2.250 1.00 . A A . 38 PRO O 1 1 4 3263 1 1 39 ALA C C 9.318 -5.645 2.177 1.00 . A A . 39 ALA C 1 1 4 3264 1 1 39 ALA CA C 8.415 -5.233 3.329 1.00 . A A . 39 ALA CA 1 1 4 3265 1 1 39 ALA CB C 9.187 -4.380 4.324 1.00 . A A . 39 ALA CB 1 1 4 3266 1 1 39 ALA H H 8.019 -6.518 4.959 1.00 . A A . 39 ALA H 1 1 4 3267 1 1 39 ALA HA H 7.604 -4.636 2.939 1.00 . A A . 39 ALA HA 1 1 4 3268 1 1 39 ALA HB1 H 9.027 -3.334 4.105 1.00 . A A . 39 ALA HB1 1 1 4 3269 1 1 39 ALA HB2 H 8.843 -4.595 5.325 1.00 . A A . 39 ALA HB2 1 1 4 3270 1 1 39 ALA HB3 H 10.241 -4.606 4.250 1.00 . A A . 39 ALA HB3 1 1 4 3271 1 1 39 ALA N N 7.837 -6.387 3.999 1.00 . A A . 39 ALA N 1 1 4 3272 1 1 39 ALA O O 9.934 -6.716 2.200 1.00 . A A . 39 ALA O 1 1 4 3273 1 1 40 LEU C C 11.454 -3.999 0.102 1.00 . A A . 40 LEU C 1 1 4 3274 1 1 40 LEU CA C 10.285 -4.970 0.052 1.00 . A A . 40 LEU CA 1 1 4 3275 1 1 40 LEU CB C 9.493 -4.780 -1.246 1.00 . A A . 40 LEU CB 1 1 4 3276 1 1 40 LEU CD1 C 6.999 -4.532 -1.165 1.00 . A A . 40 LEU CD1 1 1 4 3277 1 1 40 LEU CD2 C 8.033 -6.298 -2.602 1.00 . A A . 40 LEU CD2 1 1 4 3278 1 1 40 LEU CG C 8.153 -5.515 -1.304 1.00 . A A . 40 LEU CG 1 1 4 3279 1 1 40 LEU H H 8.944 -3.905 1.282 1.00 . A A . 40 LEU H 1 1 4 3280 1 1 40 LEU HA H 10.662 -5.979 0.097 1.00 . A A . 40 LEU HA 1 1 4 3281 1 1 40 LEU HB2 H 9.308 -3.724 -1.379 1.00 . A A . 40 LEU HB2 1 1 4 3282 1 1 40 LEU HB3 H 10.103 -5.127 -2.067 1.00 . A A . 40 LEU HB3 1 1 4 3283 1 1 40 LEU HD11 H 7.374 -3.584 -0.810 1.00 . A A . 40 LEU HD11 1 1 4 3284 1 1 40 LEU HD12 H 6.526 -4.396 -2.126 1.00 . A A . 40 LEU HD12 1 1 4 3285 1 1 40 LEU HD13 H 6.280 -4.922 -0.461 1.00 . A A . 40 LEU HD13 1 1 4 3286 1 1 40 LEU HD21 H 7.035 -6.701 -2.690 1.00 . A A . 40 LEU HD21 1 1 4 3287 1 1 40 LEU HD22 H 8.234 -5.644 -3.436 1.00 . A A . 40 LEU HD22 1 1 4 3288 1 1 40 LEU HD23 H 8.749 -7.107 -2.600 1.00 . A A . 40 LEU HD23 1 1 4 3289 1 1 40 LEU HG H 8.098 -6.214 -0.483 1.00 . A A . 40 LEU HG 1 1 4 3290 1 1 40 LEU N N 9.427 -4.759 1.202 1.00 . A A . 40 LEU N 1 1 4 3291 1 1 40 LEU O O 11.327 -2.886 0.618 1.00 . A A . 40 LEU O 1 1 4 3292 1 1 41 TYR C C 13.945 -2.830 -1.669 1.00 . A A . 41 TYR C 1 1 4 3293 1 1 41 TYR CA C 13.795 -3.606 -0.369 1.00 . A A . 41 TYR CA 1 1 4 3294 1 1 41 TYR CB C 15.029 -4.468 -0.095 1.00 . A A . 41 TYR CB 1 1 4 3295 1 1 41 TYR CD1 C 14.695 -4.257 2.395 1.00 . A A . 41 TYR CD1 1 1 4 3296 1 1 41 TYR CD2 C 15.353 -6.377 1.527 1.00 . A A . 41 TYR CD2 1 1 4 3297 1 1 41 TYR CE1 C 14.675 -4.779 3.672 1.00 . A A . 41 TYR CE1 1 1 4 3298 1 1 41 TYR CE2 C 15.340 -6.906 2.804 1.00 . A A . 41 TYR CE2 1 1 4 3299 1 1 41 TYR CG C 15.035 -5.045 1.302 1.00 . A A . 41 TYR CG 1 1 4 3300 1 1 41 TYR CZ C 14.999 -6.102 3.872 1.00 . A A . 41 TYR CZ 1 1 4 3301 1 1 41 TYR H H 12.646 -5.343 -0.771 1.00 . A A . 41 TYR H 1 1 4 3302 1 1 41 TYR HA H 13.683 -2.899 0.440 1.00 . A A . 41 TYR HA 1 1 4 3303 1 1 41 TYR HB2 H 15.054 -5.289 -0.799 1.00 . A A . 41 TYR HB2 1 1 4 3304 1 1 41 TYR HB3 H 15.917 -3.866 -0.214 1.00 . A A . 41 TYR HB3 1 1 4 3305 1 1 41 TYR HD1 H 14.445 -3.217 2.235 1.00 . A A . 41 TYR HD1 1 1 4 3306 1 1 41 TYR HD2 H 15.617 -7.002 0.688 1.00 . A A . 41 TYR HD2 1 1 4 3307 1 1 41 TYR HE1 H 14.406 -4.149 4.509 1.00 . A A . 41 TYR HE1 1 1 4 3308 1 1 41 TYR HE2 H 15.595 -7.944 2.961 1.00 . A A . 41 TYR HE2 1 1 4 3309 1 1 41 TYR HH H 14.353 -6.117 5.694 1.00 . A A . 41 TYR HH 1 1 4 3310 1 1 41 TYR N N 12.599 -4.432 -0.394 1.00 . A A . 41 TYR N 1 1 4 3311 1 1 41 TYR O O 14.822 -1.979 -1.796 1.00 . A A . 41 TYR O 1 1 4 3312 1 1 41 TYR OH O 14.975 -6.626 5.145 1.00 . A A . 41 TYR OH 1 1 4 3313 1 1 42 GLU C C 11.474 -1.922 -4.091 1.00 . A A . 42 GLU C 1 1 4 3314 1 1 42 GLU CA C 12.929 -2.262 -3.801 1.00 . A A . 42 GLU CA 1 1 4 3315 1 1 42 GLU CB C 13.537 -3.036 -4.973 1.00 . A A . 42 GLU CB 1 1 4 3316 1 1 42 GLU CD C 14.594 -0.835 -5.651 1.00 . A A . 42 GLU CD 1 1 4 3317 1 1 42 GLU CG C 14.734 -2.346 -5.609 1.00 . A A . 42 GLU CG 1 1 4 3318 1 1 42 GLU H H 12.279 -3.671 -2.373 1.00 . A A . 42 GLU H 1 1 4 3319 1 1 42 GLU HA H 13.483 -1.345 -3.653 1.00 . A A . 42 GLU HA 1 1 4 3320 1 1 42 GLU HB2 H 13.854 -4.006 -4.621 1.00 . A A . 42 GLU HB2 1 1 4 3321 1 1 42 GLU HB3 H 12.781 -3.168 -5.732 1.00 . A A . 42 GLU HB3 1 1 4 3322 1 1 42 GLU HG2 H 15.619 -2.594 -5.042 1.00 . A A . 42 GLU HG2 1 1 4 3323 1 1 42 GLU HG3 H 14.846 -2.710 -6.621 1.00 . A A . 42 GLU HG3 1 1 4 3324 1 1 42 GLU N N 13.003 -3.035 -2.573 1.00 . A A . 42 GLU N 1 1 4 3325 1 1 42 GLU O O 10.571 -2.465 -3.454 1.00 . A A . 42 GLU O 1 1 4 3326 1 1 42 GLU OE1 O 13.602 -0.340 -6.223 1.00 . A A . 42 GLU OE1 1 1 4 3327 1 1 42 GLU OE2 O 15.474 -0.136 -5.106 1.00 . A A . 42 GLU OE2 1 1 4 3328 1 1 43 VAL C C 9.310 -1.482 -6.462 1.00 . A A . 43 VAL C 1 1 4 3329 1 1 43 VAL CA C 9.890 -0.606 -5.351 1.00 . A A . 43 VAL CA 1 1 4 3330 1 1 43 VAL CB C 9.816 0.894 -5.736 1.00 . A A . 43 VAL CB 1 1 4 3331 1 1 43 VAL CG1 C 10.613 1.196 -6.999 1.00 . A A . 43 VAL CG1 1 1 4 3332 1 1 43 VAL CG2 C 8.369 1.339 -5.891 1.00 . A A . 43 VAL CG2 1 1 4 3333 1 1 43 VAL H H 12.008 -0.606 -5.501 1.00 . A A . 43 VAL H 1 1 4 3334 1 1 43 VAL HA H 9.292 -0.747 -4.464 1.00 . A A . 43 VAL HA 1 1 4 3335 1 1 43 VAL HB H 10.252 1.464 -4.928 1.00 . A A . 43 VAL HB 1 1 4 3336 1 1 43 VAL HG11 H 10.979 0.274 -7.423 1.00 . A A . 43 VAL HG11 1 1 4 3337 1 1 43 VAL HG12 H 9.979 1.697 -7.715 1.00 . A A . 43 VAL HG12 1 1 4 3338 1 1 43 VAL HG13 H 11.449 1.835 -6.752 1.00 . A A . 43 VAL HG13 1 1 4 3339 1 1 43 VAL HG21 H 8.191 1.634 -6.914 1.00 . A A . 43 VAL HG21 1 1 4 3340 1 1 43 VAL HG22 H 7.712 0.521 -5.632 1.00 . A A . 43 VAL HG22 1 1 4 3341 1 1 43 VAL HG23 H 8.179 2.176 -5.236 1.00 . A A . 43 VAL HG23 1 1 4 3342 1 1 43 VAL N N 11.245 -1.015 -5.024 1.00 . A A . 43 VAL N 1 1 4 3343 1 1 43 VAL O O 9.889 -1.614 -7.544 1.00 . A A . 43 VAL O 1 1 4 3344 1 1 44 PRO C C 6.761 -2.358 -8.153 1.00 . A A . 44 PRO C 1 1 4 3345 1 1 44 PRO CA C 7.575 -3.101 -7.104 1.00 . A A . 44 PRO CA 1 1 4 3346 1 1 44 PRO CB C 6.654 -3.962 -6.226 1.00 . A A . 44 PRO CB 1 1 4 3347 1 1 44 PRO CD C 7.529 -2.193 -4.869 1.00 . A A . 44 PRO CD 1 1 4 3348 1 1 44 PRO CG C 6.968 -3.582 -4.816 1.00 . A A . 44 PRO CG 1 1 4 3349 1 1 44 PRO HA H 8.307 -3.729 -7.592 1.00 . A A . 44 PRO HA 1 1 4 3350 1 1 44 PRO HB2 H 5.624 -3.748 -6.469 1.00 . A A . 44 PRO HB2 1 1 4 3351 1 1 44 PRO HB3 H 6.860 -5.007 -6.408 1.00 . A A . 44 PRO HB3 1 1 4 3352 1 1 44 PRO HD2 H 6.736 -1.461 -4.835 1.00 . A A . 44 PRO HD2 1 1 4 3353 1 1 44 PRO HD3 H 8.230 -2.035 -4.063 1.00 . A A . 44 PRO HD3 1 1 4 3354 1 1 44 PRO HG2 H 6.067 -3.599 -4.221 1.00 . A A . 44 PRO HG2 1 1 4 3355 1 1 44 PRO HG3 H 7.699 -4.264 -4.408 1.00 . A A . 44 PRO HG3 1 1 4 3356 1 1 44 PRO N N 8.207 -2.180 -6.166 1.00 . A A . 44 PRO N 1 1 4 3357 1 1 44 PRO O O 5.713 -1.788 -7.853 1.00 . A A . 44 PRO O 1 1 4 3358 1 1 45 ASP C C 5.914 -2.680 -11.395 1.00 . A A . 45 ASP C 1 1 4 3359 1 1 45 ASP CA C 6.576 -1.667 -10.470 1.00 . A A . 45 ASP CA 1 1 4 3360 1 1 45 ASP CB C 7.563 -0.799 -11.255 1.00 . A A . 45 ASP CB 1 1 4 3361 1 1 45 ASP CG C 6.908 0.419 -11.879 1.00 . A A . 45 ASP CG 1 1 4 3362 1 1 45 ASP H H 8.102 -2.821 -9.560 1.00 . A A . 45 ASP H 1 1 4 3363 1 1 45 ASP HA H 5.812 -1.034 -10.040 1.00 . A A . 45 ASP HA 1 1 4 3364 1 1 45 ASP HB2 H 8.343 -0.461 -10.590 1.00 . A A . 45 ASP HB2 1 1 4 3365 1 1 45 ASP HB3 H 8.002 -1.392 -12.045 1.00 . A A . 45 ASP HB3 1 1 4 3366 1 1 45 ASP N N 7.255 -2.352 -9.379 1.00 . A A . 45 ASP N 1 1 4 3367 1 1 45 ASP O O 5.439 -2.336 -12.478 1.00 . A A . 45 ASP O 1 1 4 3368 1 1 45 ASP OD1 O 5.970 0.976 -11.272 1.00 . A A . 45 ASP OD1 1 1 4 3369 1 1 45 ASP OD2 O 7.337 0.832 -12.975 1.00 . A A . 45 ASP OD2 1 1 4 3370 1 1 46 GLY C C 4.031 -5.517 -11.143 1.00 . A A . 46 GLY C 1 1 4 3371 1 1 46 GLY CA C 5.313 -4.992 -11.756 1.00 . A A . 46 GLY CA 1 1 4 3372 1 1 46 GLY H H 6.316 -4.146 -10.101 1.00 . A A . 46 GLY H 1 1 4 3373 1 1 46 GLY HA2 H 5.100 -4.613 -12.744 1.00 . A A . 46 GLY HA2 1 1 4 3374 1 1 46 GLY HA3 H 6.019 -5.805 -11.837 1.00 . A A . 46 GLY HA3 1 1 4 3375 1 1 46 GLY N N 5.905 -3.935 -10.963 1.00 . A A . 46 GLY N 1 1 4 3376 1 1 46 GLY O O 2.950 -4.987 -11.399 1.00 . A A . 46 GLY O 1 1 4 3377 1 1 47 GLU C C 3.165 -7.118 -8.146 1.00 . A A . 47 GLU C 1 1 4 3378 1 1 47 GLU CA C 2.990 -7.129 -9.658 1.00 . A A . 47 GLU CA 1 1 4 3379 1 1 47 GLU CB C 2.771 -8.563 -10.145 1.00 . A A . 47 GLU CB 1 1 4 3380 1 1 47 GLU CD C 3.827 -9.175 -12.354 1.00 . A A . 47 GLU CD 1 1 4 3381 1 1 47 GLU CG C 2.582 -8.676 -11.650 1.00 . A A . 47 GLU CG 1 1 4 3382 1 1 47 GLU H H 5.043 -6.897 -10.114 1.00 . A A . 47 GLU H 1 1 4 3383 1 1 47 GLU HA H 2.127 -6.533 -9.914 1.00 . A A . 47 GLU HA 1 1 4 3384 1 1 47 GLU HB2 H 3.628 -9.159 -9.867 1.00 . A A . 47 GLU HB2 1 1 4 3385 1 1 47 GLU HB3 H 1.893 -8.965 -9.663 1.00 . A A . 47 GLU HB3 1 1 4 3386 1 1 47 GLU HG2 H 1.772 -9.361 -11.850 1.00 . A A . 47 GLU HG2 1 1 4 3387 1 1 47 GLU HG3 H 2.331 -7.701 -12.042 1.00 . A A . 47 GLU HG3 1 1 4 3388 1 1 47 GLU N N 4.150 -6.540 -10.312 1.00 . A A . 47 GLU N 1 1 4 3389 1 1 47 GLU O O 4.274 -7.308 -7.641 1.00 . A A . 47 GLU O 1 1 4 3390 1 1 47 GLU OE1 O 4.067 -10.402 -12.351 1.00 . A A . 47 GLU OE1 1 1 4 3391 1 1 47 GLU OE2 O 4.570 -8.346 -12.914 1.00 . A A . 47 GLU OE2 1 1 4 3392 1 1 48 TRP C C 0.720 -7.103 -5.396 1.00 . A A . 48 TRP C 1 1 4 3393 1 1 48 TRP CA C 2.104 -6.816 -5.978 1.00 . A A . 48 TRP CA 1 1 4 3394 1 1 48 TRP CB C 2.598 -5.440 -5.520 1.00 . A A . 48 TRP CB 1 1 4 3395 1 1 48 TRP CD1 C 3.749 -6.005 -3.297 1.00 . A A . 48 TRP CD1 1 1 4 3396 1 1 48 TRP CD2 C 2.062 -4.545 -3.119 1.00 . A A . 48 TRP CD2 1 1 4 3397 1 1 48 TRP CE2 C 2.596 -4.770 -1.839 1.00 . A A . 48 TRP CE2 1 1 4 3398 1 1 48 TRP CE3 C 0.988 -3.659 -3.256 1.00 . A A . 48 TRP CE3 1 1 4 3399 1 1 48 TRP CG C 2.812 -5.344 -4.039 1.00 . A A . 48 TRP CG 1 1 4 3400 1 1 48 TRP CH2 C 1.041 -3.280 -0.866 1.00 . A A . 48 TRP CH2 1 1 4 3401 1 1 48 TRP CZ2 C 2.091 -4.142 -0.703 1.00 . A A . 48 TRP CZ2 1 1 4 3402 1 1 48 TRP CZ3 C 0.490 -3.036 -2.129 1.00 . A A . 48 TRP CZ3 1 1 4 3403 1 1 48 TRP H H 1.220 -6.718 -7.898 1.00 . A A . 48 TRP H 1 1 4 3404 1 1 48 TRP HA H 2.793 -7.571 -5.629 1.00 . A A . 48 TRP HA 1 1 4 3405 1 1 48 TRP HB2 H 3.537 -5.222 -6.007 1.00 . A A . 48 TRP HB2 1 1 4 3406 1 1 48 TRP HB3 H 1.871 -4.692 -5.801 1.00 . A A . 48 TRP HB3 1 1 4 3407 1 1 48 TRP HD1 H 4.473 -6.696 -3.706 1.00 . A A . 48 TRP HD1 1 1 4 3408 1 1 48 TRP HE1 H 4.184 -6.011 -1.236 1.00 . A A . 48 TRP HE1 1 1 4 3409 1 1 48 TRP HE3 H 0.550 -3.461 -4.223 1.00 . A A . 48 TRP HE3 1 1 4 3410 1 1 48 TRP HH2 H 0.621 -2.770 -0.012 1.00 . A A . 48 TRP HH2 1 1 4 3411 1 1 48 TRP HZ2 H 2.506 -4.317 0.280 1.00 . A A . 48 TRP HZ2 1 1 4 3412 1 1 48 TRP HZ3 H -0.339 -2.348 -2.217 1.00 . A A . 48 TRP HZ3 1 1 4 3413 1 1 48 TRP N N 2.073 -6.875 -7.431 1.00 . A A . 48 TRP N 1 1 4 3414 1 1 48 TRP NE1 N 3.625 -5.666 -1.972 1.00 . A A . 48 TRP NE1 1 1 4 3415 1 1 48 TRP O O -0.298 -6.923 -6.069 1.00 . A A . 48 TRP O 1 1 4 3416 1 1 49 GLN C C -0.476 -7.357 -2.029 1.00 . A A . 49 GLN C 1 1 4 3417 1 1 49 GLN CA C -0.538 -7.883 -3.458 1.00 . A A . 49 GLN CA 1 1 4 3418 1 1 49 GLN CB C -0.756 -9.396 -3.440 1.00 . A A . 49 GLN CB 1 1 4 3419 1 1 49 GLN CD C -2.626 -9.808 -5.072 1.00 . A A . 49 GLN CD 1 1 4 3420 1 1 49 GLN CG C -2.203 -9.807 -3.620 1.00 . A A . 49 GLN CG 1 1 4 3421 1 1 49 GLN H H 1.549 -7.702 -3.685 1.00 . A A . 49 GLN H 1 1 4 3422 1 1 49 GLN HA H -1.354 -7.406 -3.980 1.00 . A A . 49 GLN HA 1 1 4 3423 1 1 49 GLN HB2 H -0.175 -9.841 -4.235 1.00 . A A . 49 GLN HB2 1 1 4 3424 1 1 49 GLN HB3 H -0.408 -9.785 -2.494 1.00 . A A . 49 GLN HB3 1 1 4 3425 1 1 49 GLN HE21 H -3.956 -8.382 -4.696 1.00 . A A . 49 GLN HE21 1 1 4 3426 1 1 49 GLN HE22 H -3.881 -8.944 -6.338 1.00 . A A . 49 GLN HE22 1 1 4 3427 1 1 49 GLN HG2 H -2.337 -10.801 -3.221 1.00 . A A . 49 GLN HG2 1 1 4 3428 1 1 49 GLN HG3 H -2.830 -9.114 -3.079 1.00 . A A . 49 GLN HG3 1 1 4 3429 1 1 49 GLN N N 0.698 -7.567 -4.154 1.00 . A A . 49 GLN N 1 1 4 3430 1 1 49 GLN NE2 N -3.579 -8.962 -5.406 1.00 . A A . 49 GLN NE2 1 1 4 3431 1 1 49 GLN O O 0.442 -7.704 -1.280 1.00 . A A . 49 GLN O 1 1 4 3432 1 1 49 GLN OE1 O -2.098 -10.568 -5.885 1.00 . A A . 49 GLN OE1 1 1 4 3433 1 1 50 CYS C C -2.089 -7.007 0.663 1.00 . A A . 50 CYS C 1 1 4 3434 1 1 50 CYS CA C -1.488 -5.988 -0.302 1.00 . A A . 50 CYS CA 1 1 4 3435 1 1 50 CYS CB C -2.291 -4.676 -0.271 1.00 . A A . 50 CYS CB 1 1 4 3436 1 1 50 CYS H H -2.156 -6.308 -2.282 1.00 . A A . 50 CYS H 1 1 4 3437 1 1 50 CYS HA H -0.472 -5.784 0.004 1.00 . A A . 50 CYS HA 1 1 4 3438 1 1 50 CYS HB2 H -1.986 -4.097 0.589 1.00 . A A . 50 CYS HB2 1 1 4 3439 1 1 50 CYS HB3 H -2.075 -4.113 -1.168 1.00 . A A . 50 CYS HB3 1 1 4 3440 1 1 50 CYS N N -1.444 -6.534 -1.649 1.00 . A A . 50 CYS N 1 1 4 3441 1 1 50 CYS O O -2.738 -7.967 0.239 1.00 . A A . 50 CYS O 1 1 4 3442 1 1 50 CYS SG S -4.102 -4.887 -0.172 1.00 . A A . 50 CYS SG 1 1 4 3443 1 1 51 PRO C C -3.955 -7.511 3.158 1.00 . A A . 51 PRO C 1 1 4 3444 1 1 51 PRO CA C -2.447 -7.705 2.997 1.00 . A A . 51 PRO CA 1 1 4 3445 1 1 51 PRO CB C -1.715 -7.296 4.286 1.00 . A A . 51 PRO CB 1 1 4 3446 1 1 51 PRO CD C -1.091 -5.743 2.576 1.00 . A A . 51 PRO CD 1 1 4 3447 1 1 51 PRO CG C -0.625 -6.368 3.857 1.00 . A A . 51 PRO CG 1 1 4 3448 1 1 51 PRO HA H -2.240 -8.742 2.775 1.00 . A A . 51 PRO HA 1 1 4 3449 1 1 51 PRO HB2 H -2.407 -6.803 4.954 1.00 . A A . 51 PRO HB2 1 1 4 3450 1 1 51 PRO HB3 H -1.314 -8.176 4.766 1.00 . A A . 51 PRO HB3 1 1 4 3451 1 1 51 PRO HD2 H -1.697 -4.870 2.776 1.00 . A A . 51 PRO HD2 1 1 4 3452 1 1 51 PRO HD3 H -0.252 -5.491 1.948 1.00 . A A . 51 PRO HD3 1 1 4 3453 1 1 51 PRO HG2 H -0.467 -5.611 4.610 1.00 . A A . 51 PRO HG2 1 1 4 3454 1 1 51 PRO HG3 H 0.285 -6.926 3.689 1.00 . A A . 51 PRO HG3 1 1 4 3455 1 1 51 PRO N N -1.889 -6.819 1.976 1.00 . A A . 51 PRO N 1 1 4 3456 1 1 51 PRO O O -4.579 -8.113 4.030 1.00 . A A . 51 PRO O 1 1 4 3457 1 1 52 ARG C C -6.640 -6.766 1.077 1.00 . A A . 52 ARG C 1 1 4 3458 1 1 52 ARG CA C -5.946 -6.343 2.377 1.00 . A A . 52 ARG CA 1 1 4 3459 1 1 52 ARG CB C -6.134 -4.845 2.626 1.00 . A A . 52 ARG CB 1 1 4 3460 1 1 52 ARG CD C -7.778 -2.982 2.977 1.00 . A A . 52 ARG CD 1 1 4 3461 1 1 52 ARG CG C -7.492 -4.462 3.191 1.00 . A A . 52 ARG CG 1 1 4 3462 1 1 52 ARG CZ C -8.517 -2.882 0.615 1.00 . A A . 52 ARG CZ 1 1 4 3463 1 1 52 ARG H H -3.964 -6.189 1.650 1.00 . A A . 52 ARG H 1 1 4 3464 1 1 52 ARG HA H -6.375 -6.897 3.197 1.00 . A A . 52 ARG HA 1 1 4 3465 1 1 52 ARG HB2 H -5.379 -4.515 3.323 1.00 . A A . 52 ARG HB2 1 1 4 3466 1 1 52 ARG HB3 H -5.999 -4.323 1.691 1.00 . A A . 52 ARG HB3 1 1 4 3467 1 1 52 ARG HD2 H -8.153 -2.563 3.900 1.00 . A A . 52 ARG HD2 1 1 4 3468 1 1 52 ARG HD3 H -6.856 -2.487 2.709 1.00 . A A . 52 ARG HD3 1 1 4 3469 1 1 52 ARG HE H -9.674 -2.494 2.206 1.00 . A A . 52 ARG HE 1 1 4 3470 1 1 52 ARG HG2 H -8.256 -5.042 2.696 1.00 . A A . 52 ARG HG2 1 1 4 3471 1 1 52 ARG HG3 H -7.505 -4.672 4.250 1.00 . A A . 52 ARG HG3 1 1 4 3472 1 1 52 ARG HH11 H -6.539 -3.263 0.842 1.00 . A A . 52 ARG HH11 1 1 4 3473 1 1 52 ARG HH12 H -7.109 -3.270 -0.796 1.00 . A A . 52 ARG HH12 1 1 4 3474 1 1 52 ARG HH21 H -10.415 -2.470 0.039 1.00 . A A . 52 ARG HH21 1 1 4 3475 1 1 52 ARG HH22 H -9.308 -2.830 -1.248 1.00 . A A . 52 ARG HH22 1 1 4 3476 1 1 52 ARG N N -4.524 -6.649 2.323 1.00 . A A . 52 ARG N 1 1 4 3477 1 1 52 ARG NE N -8.765 -2.749 1.920 1.00 . A A . 52 ARG NE 1 1 4 3478 1 1 52 ARG NH1 N -7.290 -3.155 0.190 1.00 . A A . 52 ARG NH1 1 1 4 3479 1 1 52 ARG NH2 N -9.490 -2.706 -0.269 1.00 . A A . 52 ARG NH2 1 1 4 3480 1 1 52 ARG O O -7.856 -6.606 0.929 1.00 . A A . 52 ARG O 1 1 4 3481 1 1 53 CYS C C -7.455 -8.894 -0.887 1.00 . A A . 53 CYS C 1 1 4 3482 1 1 53 CYS CA C -6.392 -7.822 -1.116 1.00 . A A . 53 CYS CA 1 1 4 3483 1 1 53 CYS CB C -5.262 -8.416 -1.959 1.00 . A A . 53 CYS CB 1 1 4 3484 1 1 53 CYS H H -4.912 -7.463 0.349 1.00 . A A . 53 CYS H 1 1 4 3485 1 1 53 CYS HA H -6.830 -6.986 -1.641 1.00 . A A . 53 CYS HA 1 1 4 3486 1 1 53 CYS HB2 H -4.550 -8.887 -1.298 1.00 . A A . 53 CYS HB2 1 1 4 3487 1 1 53 CYS HB3 H -5.678 -9.167 -2.616 1.00 . A A . 53 CYS HB3 1 1 4 3488 1 1 53 CYS N N -5.865 -7.343 0.157 1.00 . A A . 53 CYS N 1 1 4 3489 1 1 53 CYS O O -8.433 -8.992 -1.628 1.00 . A A . 53 CYS O 1 1 4 3490 1 1 53 CYS SG S -4.339 -7.229 -2.995 1.00 . A A . 53 CYS SG 1 1 4 3491 1 1 54 THR C C -9.085 -10.510 1.509 1.00 . A A . 54 THR C 1 1 4 3492 1 1 54 THR CA C -8.096 -10.853 0.399 1.00 . A A . 54 THR CA 1 1 4 3493 1 1 54 THR CB C -7.281 -12.089 0.811 1.00 . A A . 54 THR CB 1 1 4 3494 1 1 54 THR CG2 C -6.867 -12.891 -0.410 1.00 . A A . 54 THR CG2 1 1 4 3495 1 1 54 THR H H -6.390 -9.633 0.629 1.00 . A A . 54 THR H 1 1 4 3496 1 1 54 THR HA H -8.643 -11.092 -0.500 1.00 . A A . 54 THR HA 1 1 4 3497 1 1 54 THR HB H -7.889 -12.712 1.449 1.00 . A A . 54 THR HB 1 1 4 3498 1 1 54 THR HG1 H -5.457 -11.329 0.901 1.00 . A A . 54 THR HG1 1 1 4 3499 1 1 54 THR HG21 H -6.209 -13.692 -0.109 1.00 . A A . 54 THR HG21 1 1 4 3500 1 1 54 THR HG22 H -6.352 -12.243 -1.104 1.00 . A A . 54 THR HG22 1 1 4 3501 1 1 54 THR HG23 H -7.745 -13.303 -0.886 1.00 . A A . 54 THR HG23 1 1 4 3502 1 1 54 THR N N -7.214 -9.734 0.108 1.00 . A A . 54 THR N 1 1 4 3503 1 1 54 THR O O -9.739 -11.393 2.067 1.00 . A A . 54 THR O 1 1 4 3504 1 1 54 THR OG1 O -6.110 -11.676 1.528 1.00 . A A . 54 THR OG1 1 1 4 3505 1 1 55 CYS C C -11.302 -8.044 2.195 1.00 . A A . 55 CYS C 1 1 4 3506 1 1 55 CYS CA C -10.125 -8.767 2.839 1.00 . A A . 55 CYS CA 1 1 4 3507 1 1 55 CYS CB C -9.406 -7.848 3.827 1.00 . A A . 55 CYS CB 1 1 4 3508 1 1 55 CYS H H -8.667 -8.565 1.323 1.00 . A A . 55 CYS H 1 1 4 3509 1 1 55 CYS HA H -10.495 -9.633 3.366 1.00 . A A . 55 CYS HA 1 1 4 3510 1 1 55 CYS HB2 H -9.251 -6.885 3.365 1.00 . A A . 55 CYS HB2 1 1 4 3511 1 1 55 CYS HB3 H -10.022 -7.727 4.707 1.00 . A A . 55 CYS HB3 1 1 4 3512 1 1 55 CYS HG H -7.891 -9.792 4.475 1.00 . A A . 55 CYS HG 1 1 4 3513 1 1 55 CYS N N -9.199 -9.226 1.817 1.00 . A A . 55 CYS N 1 1 4 3514 1 1 55 CYS O O -11.188 -6.882 1.798 1.00 . A A . 55 CYS O 1 1 4 3515 1 1 55 CYS SG S -7.794 -8.471 4.357 1.00 . A A . 55 CYS SG 1 1 4 3516 1 1 56 PRO C C -14.488 -7.405 2.418 1.00 . A A . 56 PRO C 1 1 4 3517 1 1 56 PRO CA C -13.631 -8.184 1.422 1.00 . A A . 56 PRO CA 1 1 4 3518 1 1 56 PRO CB C -14.358 -9.432 0.929 1.00 . A A . 56 PRO CB 1 1 4 3519 1 1 56 PRO CD C -12.641 -10.145 2.456 1.00 . A A . 56 PRO CD 1 1 4 3520 1 1 56 PRO CG C -14.014 -10.483 1.927 1.00 . A A . 56 PRO CG 1 1 4 3521 1 1 56 PRO HA H -13.384 -7.550 0.583 1.00 . A A . 56 PRO HA 1 1 4 3522 1 1 56 PRO HB2 H -15.423 -9.246 0.899 1.00 . A A . 56 PRO HB2 1 1 4 3523 1 1 56 PRO HB3 H -14.004 -9.693 -0.057 1.00 . A A . 56 PRO HB3 1 1 4 3524 1 1 56 PRO HD2 H -12.621 -10.236 3.532 1.00 . A A . 56 PRO HD2 1 1 4 3525 1 1 56 PRO HD3 H -11.898 -10.789 2.010 1.00 . A A . 56 PRO HD3 1 1 4 3526 1 1 56 PRO HG2 H -14.736 -10.475 2.731 1.00 . A A . 56 PRO HG2 1 1 4 3527 1 1 56 PRO HG3 H -14.001 -11.452 1.448 1.00 . A A . 56 PRO HG3 1 1 4 3528 1 1 56 PRO N N -12.437 -8.741 2.044 1.00 . A A . 56 PRO N 1 1 4 3529 1 1 56 PRO O O -13.958 -6.668 3.257 1.00 . A A . 56 PRO O 1 1 4 3530 1 1 57 ALA C C -16.640 -5.357 3.002 1.00 . A A . 57 ALA C 1 1 4 3531 1 1 57 ALA CA C -16.762 -6.869 3.170 1.00 . A A . 57 ALA CA 1 1 4 3532 1 1 57 ALA CB C -16.582 -7.276 4.628 1.00 . A A . 57 ALA CB 1 1 4 3533 1 1 57 ALA H H -16.154 -8.154 1.610 1.00 . A A . 57 ALA H 1 1 4 3534 1 1 57 ALA HA H -17.755 -7.169 2.863 1.00 . A A . 57 ALA HA 1 1 4 3535 1 1 57 ALA HB1 H -15.668 -7.841 4.735 1.00 . A A . 57 ALA HB1 1 1 4 3536 1 1 57 ALA HB2 H -16.532 -6.389 5.245 1.00 . A A . 57 ALA HB2 1 1 4 3537 1 1 57 ALA HB3 H -17.419 -7.882 4.939 1.00 . A A . 57 ALA HB3 1 1 4 3538 1 1 57 ALA N N -15.808 -7.563 2.309 1.00 . A A . 57 ALA N 1 1 4 3539 1 1 57 ALA O O -16.783 -4.596 3.959 1.00 . A A . 57 ALA O 1 1 4 3540 1 1 58 LEU C C -17.564 -2.884 1.158 1.00 . A A . 58 LEU C 1 1 4 3541 1 1 58 LEU CA C -16.215 -3.517 1.471 1.00 . A A . 58 LEU CA 1 1 4 3542 1 1 58 LEU CB C -15.260 -3.329 0.292 1.00 . A A . 58 LEU CB 1 1 4 3543 1 1 58 LEU CD1 C -13.200 -4.117 -0.906 1.00 . A A . 58 LEU CD1 1 1 4 3544 1 1 58 LEU CD2 C -13.041 -3.315 1.453 1.00 . A A . 58 LEU CD2 1 1 4 3545 1 1 58 LEU CG C -13.910 -4.034 0.435 1.00 . A A . 58 LEU CG 1 1 4 3546 1 1 58 LEU H H -16.274 -5.591 1.050 1.00 . A A . 58 LEU H 1 1 4 3547 1 1 58 LEU HA H -15.799 -3.035 2.343 1.00 . A A . 58 LEU HA 1 1 4 3548 1 1 58 LEU HB2 H -15.743 -3.701 -0.601 1.00 . A A . 58 LEU HB2 1 1 4 3549 1 1 58 LEU HB3 H -15.078 -2.271 0.168 1.00 . A A . 58 LEU HB3 1 1 4 3550 1 1 58 LEU HD11 H -12.149 -3.912 -0.769 1.00 . A A . 58 LEU HD11 1 1 4 3551 1 1 58 LEU HD12 H -13.323 -5.108 -1.318 1.00 . A A . 58 LEU HD12 1 1 4 3552 1 1 58 LEU HD13 H -13.623 -3.391 -1.585 1.00 . A A . 58 LEU HD13 1 1 4 3553 1 1 58 LEU HD21 H -13.649 -2.999 2.289 1.00 . A A . 58 LEU HD21 1 1 4 3554 1 1 58 LEU HD22 H -12.269 -3.984 1.802 1.00 . A A . 58 LEU HD22 1 1 4 3555 1 1 58 LEU HD23 H -12.585 -2.450 0.992 1.00 . A A . 58 LEU HD23 1 1 4 3556 1 1 58 LEU HG H -14.074 -5.042 0.787 1.00 . A A . 58 LEU HG 1 1 4 3557 1 1 58 LEU N N -16.372 -4.932 1.774 1.00 . A A . 58 LEU N 1 1 4 3558 1 1 58 LEU O O -17.701 -1.658 1.154 1.00 . A A . 58 LEU O 1 1 4 3559 1 1 59 LYS C C -19.942 -2.342 -0.574 1.00 . A A . 59 LYS C 1 1 4 3560 1 1 59 LYS CA C -19.915 -3.306 0.609 1.00 . A A . 59 LYS CA 1 1 4 3561 1 1 59 LYS CB C -20.563 -2.663 1.836 1.00 . A A . 59 LYS CB 1 1 4 3562 1 1 59 LYS CD C -22.913 -2.044 2.465 1.00 . A A . 59 LYS CD 1 1 4 3563 1 1 59 LYS CE C -23.780 -1.669 1.276 1.00 . A A . 59 LYS CE 1 1 4 3564 1 1 59 LYS CG C -21.964 -3.179 2.121 1.00 . A A . 59 LYS CG 1 1 4 3565 1 1 59 LYS H H -18.369 -4.705 0.952 1.00 . A A . 59 LYS H 1 1 4 3566 1 1 59 LYS HA H -20.481 -4.187 0.344 1.00 . A A . 59 LYS HA 1 1 4 3567 1 1 59 LYS HB2 H -19.946 -2.861 2.700 1.00 . A A . 59 LYS HB2 1 1 4 3568 1 1 59 LYS HB3 H -20.620 -1.595 1.682 1.00 . A A . 59 LYS HB3 1 1 4 3569 1 1 59 LYS HD2 H -23.549 -2.354 3.281 1.00 . A A . 59 LYS HD2 1 1 4 3570 1 1 59 LYS HD3 H -22.333 -1.183 2.764 1.00 . A A . 59 LYS HD3 1 1 4 3571 1 1 59 LYS HE2 H -23.618 -2.389 0.489 1.00 . A A . 59 LYS HE2 1 1 4 3572 1 1 59 LYS HE3 H -24.815 -1.697 1.581 1.00 . A A . 59 LYS HE3 1 1 4 3573 1 1 59 LYS HG2 H -22.332 -3.691 1.244 1.00 . A A . 59 LYS HG2 1 1 4 3574 1 1 59 LYS HG3 H -21.922 -3.868 2.952 1.00 . A A . 59 LYS HG3 1 1 4 3575 1 1 59 LYS HZ1 H -23.578 -0.287 -0.277 1.00 . A A . 59 LYS HZ1 1 1 4 3576 1 1 59 LYS HZ2 H -22.482 -0.049 0.998 1.00 . A A . 59 LYS HZ2 1 1 4 3577 1 1 59 LYS HZ3 H -24.108 0.390 1.185 1.00 . A A . 59 LYS HZ3 1 1 4 3578 1 1 59 LYS N N -18.557 -3.738 0.912 1.00 . A A . 59 LYS N 1 1 4 3579 1 1 59 LYS NZ N -23.464 -0.312 0.760 1.00 . A A . 59 LYS NZ 1 1 4 3580 1 1 59 LYS O O -20.569 -1.282 -0.510 1.00 . A A . 59 LYS O 1 1 4 3581 1 1 60 GLY C C -20.599 -2.069 -3.643 1.00 . A A . 60 GLY C 1 1 4 3582 1 1 60 GLY CA C -19.299 -1.944 -2.877 1.00 . A A . 60 GLY CA 1 1 4 3583 1 1 60 GLY H H -18.853 -3.624 -1.666 1.00 . A A . 60 GLY H 1 1 4 3584 1 1 60 GLY HA2 H -19.147 -0.910 -2.610 1.00 . A A . 60 GLY HA2 1 1 4 3585 1 1 60 GLY HA3 H -18.487 -2.268 -3.511 1.00 . A A . 60 GLY HA3 1 1 4 3586 1 1 60 GLY N N -19.302 -2.748 -1.668 1.00 . A A . 60 GLY N 1 1 4 3587 1 1 60 GLY O O -20.624 -2.568 -4.769 1.00 . A A . 60 GLY O 1 1 4 3588 1 1 61 LYS C C -23.885 -0.609 -3.080 1.00 . A A . 61 LYS C 1 1 4 3589 1 1 61 LYS CA C -23.005 -1.734 -3.604 1.00 . A A . 61 LYS CA 1 1 4 3590 1 1 61 LYS CB C -23.640 -3.086 -3.275 1.00 . A A . 61 LYS CB 1 1 4 3591 1 1 61 LYS CD C -25.700 -4.323 -4.002 1.00 . A A . 61 LYS CD 1 1 4 3592 1 1 61 LYS CE C -26.840 -3.324 -4.110 1.00 . A A . 61 LYS CE 1 1 4 3593 1 1 61 LYS CG C -24.381 -3.711 -4.444 1.00 . A A . 61 LYS CG 1 1 4 3594 1 1 61 LYS H H -21.592 -1.274 -2.109 1.00 . A A . 61 LYS H 1 1 4 3595 1 1 61 LYS HA H -22.903 -1.637 -4.674 1.00 . A A . 61 LYS HA 1 1 4 3596 1 1 61 LYS HB2 H -22.862 -3.769 -2.963 1.00 . A A . 61 LYS HB2 1 1 4 3597 1 1 61 LYS HB3 H -24.339 -2.955 -2.461 1.00 . A A . 61 LYS HB3 1 1 4 3598 1 1 61 LYS HD2 H -25.920 -5.173 -4.630 1.00 . A A . 61 LYS HD2 1 1 4 3599 1 1 61 LYS HD3 H -25.611 -4.645 -2.974 1.00 . A A . 61 LYS HD3 1 1 4 3600 1 1 61 LYS HE2 H -26.489 -2.451 -4.638 1.00 . A A . 61 LYS HE2 1 1 4 3601 1 1 61 LYS HE3 H -27.648 -3.779 -4.665 1.00 . A A . 61 LYS HE3 1 1 4 3602 1 1 61 LYS HG2 H -24.579 -2.948 -5.183 1.00 . A A . 61 LYS HG2 1 1 4 3603 1 1 61 LYS HG3 H -23.762 -4.485 -4.877 1.00 . A A . 61 LYS HG3 1 1 4 3604 1 1 61 LYS HZ1 H -28.345 -3.182 -2.665 1.00 . A A . 61 LYS HZ1 1 1 4 3605 1 1 61 LYS HZ2 H -27.264 -1.873 -2.667 1.00 . A A . 61 LYS HZ2 1 1 4 3606 1 1 61 LYS HZ3 H -26.787 -3.368 -2.017 1.00 . A A . 61 LYS HZ3 1 1 4 3607 1 1 61 LYS N N -21.684 -1.647 -3.012 1.00 . A A . 61 LYS N 1 1 4 3608 1 1 61 LYS NZ N -27.343 -2.909 -2.772 1.00 . A A . 61 LYS NZ 1 1 4 3609 1 1 61 LYS O O -24.533 0.071 -3.899 1.00 . A A . 61 LYS O 1 1 4 3610 1 1 61 LYS OXT O -23.931 -0.415 -1.849 1.00 . A A . 61 LYS OXT 1 1 4 3611 2 2 1 ZN ZN ZN -4.816 -5.131 -2.294 1.00 . B A . 62 ZN ZN 1 1 4 3612 3 2 1 ZN ZN ZN 4.440 4.856 4.599 1.00 . C A . 63 ZN ZN 1 1 5 3613 1 1 1 GLY C C -14.099 4.306 14.742 1.00 . A A . 1 GLY C 1 1 5 3614 1 1 1 GLY CA C -14.731 5.438 15.524 1.00 . A A . 1 GLY CA 1 1 5 3615 1 1 1 GLY H1 H -15.278 7.428 15.226 1.00 . A A . 1 GLY H1 1 1 5 3616 1 1 1 GLY H2 H -15.905 6.358 14.070 1.00 . A A . 1 GLY H2 1 1 5 3617 1 1 1 GLY H3 H -14.270 6.799 14.017 1.00 . A A . 1 GLY H3 1 1 5 3618 1 1 1 GLY HA2 H -14.036 5.769 16.284 1.00 . A A . 1 GLY HA2 1 1 5 3619 1 1 1 GLY HA3 H -15.631 5.080 16.004 1.00 . A A . 1 GLY HA3 1 1 5 3620 1 1 1 GLY N N -15.069 6.585 14.653 1.00 . A A . 1 GLY N 1 1 5 3621 1 1 1 GLY O O -14.059 4.354 13.513 1.00 . A A . 1 GLY O 1 1 5 3622 1 1 2 PRO C C -13.912 1.158 14.193 1.00 . A A . 2 PRO C 1 1 5 3623 1 1 2 PRO CA C -12.907 2.153 14.772 1.00 . A A . 2 PRO CA 1 1 5 3624 1 1 2 PRO CB C -12.104 1.515 15.904 1.00 . A A . 2 PRO CB 1 1 5 3625 1 1 2 PRO CD C -13.526 3.178 16.896 1.00 . A A . 2 PRO CD 1 1 5 3626 1 1 2 PRO CG C -12.859 1.849 17.146 1.00 . A A . 2 PRO CG 1 1 5 3627 1 1 2 PRO HA H -12.237 2.479 13.991 1.00 . A A . 2 PRO HA 1 1 5 3628 1 1 2 PRO HB2 H -12.051 0.447 15.750 1.00 . A A . 2 PRO HB2 1 1 5 3629 1 1 2 PRO HB3 H -11.109 1.932 15.924 1.00 . A A . 2 PRO HB3 1 1 5 3630 1 1 2 PRO HD2 H -14.527 3.178 17.304 1.00 . A A . 2 PRO HD2 1 1 5 3631 1 1 2 PRO HD3 H -12.944 3.978 17.325 1.00 . A A . 2 PRO HD3 1 1 5 3632 1 1 2 PRO HG2 H -13.602 1.089 17.340 1.00 . A A . 2 PRO HG2 1 1 5 3633 1 1 2 PRO HG3 H -12.177 1.927 17.976 1.00 . A A . 2 PRO HG3 1 1 5 3634 1 1 2 PRO N N -13.561 3.287 15.426 1.00 . A A . 2 PRO N 1 1 5 3635 1 1 2 PRO O O -14.360 0.230 14.872 1.00 . A A . 2 PRO O 1 1 5 3636 1 1 3 LEU C C -14.525 -0.704 11.635 1.00 . A A . 3 LEU C 1 1 5 3637 1 1 3 LEU CA C -15.226 0.495 12.261 1.00 . A A . 3 LEU CA 1 1 5 3638 1 1 3 LEU CB C -15.992 1.265 11.181 1.00 . A A . 3 LEU CB 1 1 5 3639 1 1 3 LEU CD1 C -16.384 3.558 10.262 1.00 . A A . 3 LEU CD1 1 1 5 3640 1 1 3 LEU CD2 C -17.669 2.783 12.258 1.00 . A A . 3 LEU CD2 1 1 5 3641 1 1 3 LEU CG C -16.340 2.714 11.526 1.00 . A A . 3 LEU CG 1 1 5 3642 1 1 3 LEU H H -13.872 2.115 12.438 1.00 . A A . 3 LEU H 1 1 5 3643 1 1 3 LEU HA H -15.928 0.137 13.001 1.00 . A A . 3 LEU HA 1 1 5 3644 1 1 3 LEU HB2 H -15.395 1.266 10.282 1.00 . A A . 3 LEU HB2 1 1 5 3645 1 1 3 LEU HB3 H -16.913 0.737 10.978 1.00 . A A . 3 LEU HB3 1 1 5 3646 1 1 3 LEU HD11 H -17.299 4.131 10.245 1.00 . A A . 3 LEU HD11 1 1 5 3647 1 1 3 LEU HD12 H -15.537 4.227 10.246 1.00 . A A . 3 LEU HD12 1 1 5 3648 1 1 3 LEU HD13 H -16.349 2.911 9.397 1.00 . A A . 3 LEU HD13 1 1 5 3649 1 1 3 LEU HD21 H -18.462 2.465 11.596 1.00 . A A . 3 LEU HD21 1 1 5 3650 1 1 3 LEU HD22 H -17.639 2.134 13.121 1.00 . A A . 3 LEU HD22 1 1 5 3651 1 1 3 LEU HD23 H -17.852 3.798 12.577 1.00 . A A . 3 LEU HD23 1 1 5 3652 1 1 3 LEU HG H -15.575 3.117 12.174 1.00 . A A . 3 LEU HG 1 1 5 3653 1 1 3 LEU N N -14.269 1.362 12.934 1.00 . A A . 3 LEU N 1 1 5 3654 1 1 3 LEU O O -13.382 -0.601 11.188 1.00 . A A . 3 LEU O 1 1 5 3655 1 1 4 GLY C C -14.708 -2.982 9.493 1.00 . A A . 4 GLY C 1 1 5 3656 1 1 4 GLY CA C -14.661 -3.033 11.004 1.00 . A A . 4 GLY CA 1 1 5 3657 1 1 4 GLY H H -16.132 -1.854 11.971 1.00 . A A . 4 GLY H 1 1 5 3658 1 1 4 GLY HA2 H -13.634 -3.138 11.322 1.00 . A A . 4 GLY HA2 1 1 5 3659 1 1 4 GLY HA3 H -15.224 -3.891 11.343 1.00 . A A . 4 GLY HA3 1 1 5 3660 1 1 4 GLY N N -15.220 -1.835 11.597 1.00 . A A . 4 GLY N 1 1 5 3661 1 1 4 GLY O O -13.975 -3.704 8.812 1.00 . A A . 4 GLY O 1 1 5 3662 1 1 5 SER C C -14.332 -1.351 6.985 1.00 . A A . 5 SER C 1 1 5 3663 1 1 5 SER CA C -15.653 -1.858 7.546 1.00 . A A . 5 SER CA 1 1 5 3664 1 1 5 SER CB C -16.762 -0.840 7.275 1.00 . A A . 5 SER CB 1 1 5 3665 1 1 5 SER H H -16.058 -1.512 9.582 1.00 . A A . 5 SER H 1 1 5 3666 1 1 5 SER HA H -15.904 -2.800 7.076 1.00 . A A . 5 SER HA 1 1 5 3667 1 1 5 SER HB2 H -16.337 0.043 6.819 1.00 . A A . 5 SER HB2 1 1 5 3668 1 1 5 SER HB3 H -17.493 -1.273 6.607 1.00 . A A . 5 SER HB3 1 1 5 3669 1 1 5 SER HG H -17.764 0.433 8.398 1.00 . A A . 5 SER HG 1 1 5 3670 1 1 5 SER N N -15.537 -2.079 8.976 1.00 . A A . 5 SER N 1 1 5 3671 1 1 5 SER O O -13.808 -0.333 7.441 1.00 . A A . 5 SER O 1 1 5 3672 1 1 5 SER OG O -17.410 -0.465 8.485 1.00 . A A . 5 SER OG 1 1 5 3673 1 1 6 ASP C C -12.599 -0.565 4.542 1.00 . A A . 6 ASP C 1 1 5 3674 1 1 6 ASP CA C -12.470 -1.751 5.484 1.00 . A A . 6 ASP CA 1 1 5 3675 1 1 6 ASP CB C -11.861 -2.936 4.743 1.00 . A A . 6 ASP CB 1 1 5 3676 1 1 6 ASP CG C -10.410 -2.688 4.406 1.00 . A A . 6 ASP CG 1 1 5 3677 1 1 6 ASP H H -14.206 -2.932 5.769 1.00 . A A . 6 ASP H 1 1 5 3678 1 1 6 ASP HA H -11.815 -1.474 6.299 1.00 . A A . 6 ASP HA 1 1 5 3679 1 1 6 ASP HB2 H -11.927 -3.819 5.363 1.00 . A A . 6 ASP HB2 1 1 5 3680 1 1 6 ASP HB3 H -12.403 -3.101 3.824 1.00 . A A . 6 ASP HB3 1 1 5 3681 1 1 6 ASP N N -13.762 -2.101 6.055 1.00 . A A . 6 ASP N 1 1 5 3682 1 1 6 ASP O O -13.451 -0.555 3.648 1.00 . A A . 6 ASP O 1 1 5 3683 1 1 6 ASP OD1 O -9.588 -2.605 5.345 1.00 . A A . 6 ASP OD1 1 1 5 3684 1 1 6 ASP OD2 O -10.087 -2.550 3.208 1.00 . A A . 6 ASP OD2 1 1 5 3685 1 1 7 HIS C C -10.693 1.690 2.969 1.00 . A A . 7 HIS C 1 1 5 3686 1 1 7 HIS CA C -11.833 1.660 3.973 1.00 . A A . 7 HIS CA 1 1 5 3687 1 1 7 HIS CB C -11.778 2.902 4.864 1.00 . A A . 7 HIS CB 1 1 5 3688 1 1 7 HIS CD2 C -12.230 4.539 2.915 1.00 . A A . 7 HIS CD2 1 1 5 3689 1 1 7 HIS CE1 C -13.311 6.037 4.064 1.00 . A A . 7 HIS CE1 1 1 5 3690 1 1 7 HIS CG C -12.310 4.140 4.209 1.00 . A A . 7 HIS CG 1 1 5 3691 1 1 7 HIS H H -11.139 0.391 5.514 1.00 . A A . 7 HIS H 1 1 5 3692 1 1 7 HIS HA H -12.770 1.660 3.433 1.00 . A A . 7 HIS HA 1 1 5 3693 1 1 7 HIS HB2 H -12.360 2.724 5.756 1.00 . A A . 7 HIS HB2 1 1 5 3694 1 1 7 HIS HB3 H -10.752 3.092 5.142 1.00 . A A . 7 HIS HB3 1 1 5 3695 1 1 7 HIS HD2 H -11.762 4.002 2.099 1.00 . A A . 7 HIS HD2 1 1 5 3696 1 1 7 HIS HE1 H -13.860 6.932 4.318 1.00 . A A . 7 HIS HE1 1 1 5 3697 1 1 7 HIS HE2 H -12.791 6.389 2.086 1.00 . A A . 7 HIS HE2 1 1 5 3698 1 1 7 HIS N N -11.786 0.452 4.774 1.00 . A A . 7 HIS N 1 1 5 3699 1 1 7 HIS ND1 N -12.993 5.089 4.929 1.00 . A A . 7 HIS ND1 1 1 5 3700 1 1 7 HIS NE2 N -12.870 5.748 2.833 1.00 . A A . 7 HIS NE2 1 1 5 3701 1 1 7 HIS O O -9.552 2.001 3.312 1.00 . A A . 7 HIS O 1 1 5 3702 1 1 8 HIS C C -9.879 2.915 0.181 1.00 . A A . 8 HIS C 1 1 5 3703 1 1 8 HIS CA C -10.060 1.474 0.637 1.00 . A A . 8 HIS CA 1 1 5 3704 1 1 8 HIS CB C -10.509 0.603 -0.547 1.00 . A A . 8 HIS CB 1 1 5 3705 1 1 8 HIS CD2 C -12.699 1.064 -1.845 1.00 . A A . 8 HIS CD2 1 1 5 3706 1 1 8 HIS CE1 C -14.071 0.166 -0.413 1.00 . A A . 8 HIS CE1 1 1 5 3707 1 1 8 HIS CG C -11.994 0.586 -0.790 1.00 . A A . 8 HIS CG 1 1 5 3708 1 1 8 HIS H H -11.959 1.194 1.511 1.00 . A A . 8 HIS H 1 1 5 3709 1 1 8 HIS HA H -9.118 1.103 1.011 1.00 . A A . 8 HIS HA 1 1 5 3710 1 1 8 HIS HB2 H -10.039 0.971 -1.445 1.00 . A A . 8 HIS HB2 1 1 5 3711 1 1 8 HIS HB3 H -10.189 -0.416 -0.375 1.00 . A A . 8 HIS HB3 1 1 5 3712 1 1 8 HIS HD2 H -12.301 1.561 -2.716 1.00 . A A . 8 HIS HD2 1 1 5 3713 1 1 8 HIS HE1 H -14.984 -0.176 0.054 1.00 . A A . 8 HIS HE1 1 1 5 3714 1 1 8 HIS HE2 H -14.751 0.843 -2.250 1.00 . A A . 8 HIS HE2 1 1 5 3715 1 1 8 HIS N N -11.024 1.412 1.720 1.00 . A A . 8 HIS N 1 1 5 3716 1 1 8 HIS ND1 N -12.868 0.020 0.110 1.00 . A A . 8 HIS ND1 1 1 5 3717 1 1 8 HIS NE2 N -14.019 0.790 -1.595 1.00 . A A . 8 HIS NE2 1 1 5 3718 1 1 8 HIS O O -10.855 3.602 -0.120 1.00 . A A . 8 HIS O 1 1 5 3719 1 1 9 MET C C -6.875 4.835 -0.671 1.00 . A A . 9 MET C 1 1 5 3720 1 1 9 MET CA C -8.327 4.749 -0.209 1.00 . A A . 9 MET CA 1 1 5 3721 1 1 9 MET CB C -8.585 5.700 0.967 1.00 . A A . 9 MET CB 1 1 5 3722 1 1 9 MET CE C -7.786 9.296 -0.886 1.00 . A A . 9 MET CE 1 1 5 3723 1 1 9 MET CG C -8.019 7.099 0.778 1.00 . A A . 9 MET CG 1 1 5 3724 1 1 9 MET H H -7.905 2.790 0.455 1.00 . A A . 9 MET H 1 1 5 3725 1 1 9 MET HA H -8.973 5.019 -1.031 1.00 . A A . 9 MET HA 1 1 5 3726 1 1 9 MET HB2 H -9.651 5.787 1.115 1.00 . A A . 9 MET HB2 1 1 5 3727 1 1 9 MET HB3 H -8.143 5.277 1.857 1.00 . A A . 9 MET HB3 1 1 5 3728 1 1 9 MET HE1 H -7.907 9.473 -1.944 1.00 . A A . 9 MET HE1 1 1 5 3729 1 1 9 MET HE2 H -7.916 10.226 -0.349 1.00 . A A . 9 MET HE2 1 1 5 3730 1 1 9 MET HE3 H -6.797 8.905 -0.696 1.00 . A A . 9 MET HE3 1 1 5 3731 1 1 9 MET HG2 H -7.975 7.585 1.742 1.00 . A A . 9 MET HG2 1 1 5 3732 1 1 9 MET HG3 H -7.021 7.013 0.373 1.00 . A A . 9 MET HG3 1 1 5 3733 1 1 9 MET N N -8.638 3.380 0.178 1.00 . A A . 9 MET N 1 1 5 3734 1 1 9 MET O O -6.028 4.068 -0.209 1.00 . A A . 9 MET O 1 1 5 3735 1 1 9 MET SD S -9.010 8.111 -0.333 1.00 . A A . 9 MET SD 1 1 5 3736 1 1 10 GLU C C -4.325 6.591 -1.315 1.00 . A A . 10 GLU C 1 1 5 3737 1 1 10 GLU CA C -5.283 5.825 -2.225 1.00 . A A . 10 GLU CA 1 1 5 3738 1 1 10 GLU CB C -5.377 6.519 -3.580 1.00 . A A . 10 GLU CB 1 1 5 3739 1 1 10 GLU CD C -4.395 6.396 -5.898 1.00 . A A . 10 GLU CD 1 1 5 3740 1 1 10 GLU CG C -4.115 6.392 -4.412 1.00 . A A . 10 GLU CG 1 1 5 3741 1 1 10 GLU H H -7.343 6.245 -2.011 1.00 . A A . 10 GLU H 1 1 5 3742 1 1 10 GLU HA H -4.895 4.827 -2.373 1.00 . A A . 10 GLU HA 1 1 5 3743 1 1 10 GLU HB2 H -6.196 6.089 -4.138 1.00 . A A . 10 GLU HB2 1 1 5 3744 1 1 10 GLU HB3 H -5.574 7.569 -3.418 1.00 . A A . 10 GLU HB3 1 1 5 3745 1 1 10 GLU HG2 H -3.462 7.220 -4.181 1.00 . A A . 10 GLU HG2 1 1 5 3746 1 1 10 GLU HG3 H -3.624 5.465 -4.154 1.00 . A A . 10 GLU HG3 1 1 5 3747 1 1 10 GLU N N -6.611 5.704 -1.640 1.00 . A A . 10 GLU N 1 1 5 3748 1 1 10 GLU O O -4.085 7.784 -1.512 1.00 . A A . 10 GLU O 1 1 5 3749 1 1 10 GLU OE1 O -4.882 7.426 -6.411 1.00 . A A . 10 GLU OE1 1 1 5 3750 1 1 10 GLU OE2 O -4.113 5.377 -6.564 1.00 . A A . 10 GLU OE2 1 1 5 3751 1 1 11 PHE C C -2.192 5.360 1.445 1.00 . A A . 11 PHE C 1 1 5 3752 1 1 11 PHE CA C -2.751 6.456 0.547 1.00 . A A . 11 PHE CA 1 1 5 3753 1 1 11 PHE CB C -3.355 7.590 1.393 1.00 . A A . 11 PHE CB 1 1 5 3754 1 1 11 PHE CD1 C -5.225 6.279 2.441 1.00 . A A . 11 PHE CD1 1 1 5 3755 1 1 11 PHE CD2 C -3.785 7.533 3.866 1.00 . A A . 11 PHE CD2 1 1 5 3756 1 1 11 PHE CE1 C -5.945 5.851 3.541 1.00 . A A . 11 PHE CE1 1 1 5 3757 1 1 11 PHE CE2 C -4.501 7.110 4.969 1.00 . A A . 11 PHE CE2 1 1 5 3758 1 1 11 PHE CG C -4.138 7.123 2.591 1.00 . A A . 11 PHE CG 1 1 5 3759 1 1 11 PHE CZ C -5.583 6.267 4.806 1.00 . A A . 11 PHE CZ 1 1 5 3760 1 1 11 PHE H H -3.966 4.933 -0.267 1.00 . A A . 11 PHE H 1 1 5 3761 1 1 11 PHE HA H -1.949 6.853 -0.057 1.00 . A A . 11 PHE HA 1 1 5 3762 1 1 11 PHE HB2 H -2.556 8.223 1.748 1.00 . A A . 11 PHE HB2 1 1 5 3763 1 1 11 PHE HB3 H -4.017 8.175 0.771 1.00 . A A . 11 PHE HB3 1 1 5 3764 1 1 11 PHE HD1 H -5.508 5.953 1.448 1.00 . A A . 11 PHE HD1 1 1 5 3765 1 1 11 PHE HD2 H -2.939 8.192 3.996 1.00 . A A . 11 PHE HD2 1 1 5 3766 1 1 11 PHE HE1 H -6.790 5.193 3.411 1.00 . A A . 11 PHE HE1 1 1 5 3767 1 1 11 PHE HE2 H -4.217 7.437 5.957 1.00 . A A . 11 PHE HE2 1 1 5 3768 1 1 11 PHE HZ H -6.145 5.934 5.667 1.00 . A A . 11 PHE HZ 1 1 5 3769 1 1 11 PHE N N -3.744 5.884 -0.355 1.00 . A A . 11 PHE N 1 1 5 3770 1 1 11 PHE O O -2.788 4.284 1.550 1.00 . A A . 11 PHE O 1 1 5 3771 1 1 12 CYS C C -1.377 4.464 4.207 1.00 . A A . 12 CYS C 1 1 5 3772 1 1 12 CYS CA C -0.469 4.662 3.009 1.00 . A A . 12 CYS CA 1 1 5 3773 1 1 12 CYS CB C 0.904 5.121 3.487 1.00 . A A . 12 CYS CB 1 1 5 3774 1 1 12 CYS H H -0.625 6.500 1.960 1.00 . A A . 12 CYS H 1 1 5 3775 1 1 12 CYS HA H -0.369 3.724 2.487 1.00 . A A . 12 CYS HA 1 1 5 3776 1 1 12 CYS HB2 H 0.900 6.195 3.592 1.00 . A A . 12 CYS HB2 1 1 5 3777 1 1 12 CYS HB3 H 1.111 4.671 4.448 1.00 . A A . 12 CYS HB3 1 1 5 3778 1 1 12 CYS HG H 3.160 5.669 2.461 1.00 . A A . 12 CYS HG 1 1 5 3779 1 1 12 CYS N N -1.061 5.629 2.092 1.00 . A A . 12 CYS N 1 1 5 3780 1 1 12 CYS O O -1.638 5.398 4.961 1.00 . A A . 12 CYS O 1 1 5 3781 1 1 12 CYS SG S 2.258 4.687 2.377 1.00 . A A . 12 CYS SG 1 1 5 3782 1 1 13 ARG C C -2.231 3.167 6.795 1.00 . A A . 13 ARG C 1 1 5 3783 1 1 13 ARG CA C -2.854 2.956 5.408 1.00 . A A . 13 ARG CA 1 1 5 3784 1 1 13 ARG CB C -3.357 1.520 5.272 1.00 . A A . 13 ARG CB 1 1 5 3785 1 1 13 ARG CD C -4.936 -0.086 4.172 1.00 . A A . 13 ARG CD 1 1 5 3786 1 1 13 ARG CG C -4.543 1.372 4.331 1.00 . A A . 13 ARG CG 1 1 5 3787 1 1 13 ARG CZ C -7.095 -0.975 3.390 1.00 . A A . 13 ARG CZ 1 1 5 3788 1 1 13 ARG H H -1.706 2.582 3.654 1.00 . A A . 13 ARG H 1 1 5 3789 1 1 13 ARG HA H -3.693 3.629 5.301 1.00 . A A . 13 ARG HA 1 1 5 3790 1 1 13 ARG HB2 H -2.550 0.904 4.900 1.00 . A A . 13 ARG HB2 1 1 5 3791 1 1 13 ARG HB3 H -3.651 1.161 6.247 1.00 . A A . 13 ARG HB3 1 1 5 3792 1 1 13 ARG HD2 H -4.061 -0.649 3.881 1.00 . A A . 13 ARG HD2 1 1 5 3793 1 1 13 ARG HD3 H -5.294 -0.451 5.123 1.00 . A A . 13 ARG HD3 1 1 5 3794 1 1 13 ARG HE H -5.831 0.103 2.274 1.00 . A A . 13 ARG HE 1 1 5 3795 1 1 13 ARG HG2 H -5.382 1.920 4.733 1.00 . A A . 13 ARG HG2 1 1 5 3796 1 1 13 ARG HG3 H -4.277 1.772 3.364 1.00 . A A . 13 ARG HG3 1 1 5 3797 1 1 13 ARG HH11 H -6.638 -1.428 5.320 1.00 . A A . 13 ARG HH11 1 1 5 3798 1 1 13 ARG HH12 H -8.172 -2.039 4.752 1.00 . A A . 13 ARG HH12 1 1 5 3799 1 1 13 ARG HH21 H -7.814 -0.744 1.511 1.00 . A A . 13 ARG HH21 1 1 5 3800 1 1 13 ARG HH22 H -8.837 -1.656 2.593 1.00 . A A . 13 ARG HH22 1 1 5 3801 1 1 13 ARG N N -1.904 3.262 4.338 1.00 . A A . 13 ARG N 1 1 5 3802 1 1 13 ARG NE N -5.979 -0.287 3.166 1.00 . A A . 13 ARG NE 1 1 5 3803 1 1 13 ARG NH1 N -7.316 -1.526 4.579 1.00 . A A . 13 ARG NH1 1 1 5 3804 1 1 13 ARG NH2 N -7.983 -1.137 2.418 1.00 . A A . 13 ARG NH2 1 1 5 3805 1 1 13 ARG O O -2.942 3.394 7.774 1.00 . A A . 13 ARG O 1 1 5 3806 1 1 14 VAL C C 0.473 4.597 8.252 1.00 . A A . 14 VAL C 1 1 5 3807 1 1 14 VAL CA C -0.199 3.223 8.148 1.00 . A A . 14 VAL CA 1 1 5 3808 1 1 14 VAL CB C 0.879 2.129 8.327 1.00 . A A . 14 VAL CB 1 1 5 3809 1 1 14 VAL CG1 C 1.062 1.793 9.797 1.00 . A A . 14 VAL CG1 1 1 5 3810 1 1 14 VAL CG2 C 0.531 0.880 7.529 1.00 . A A . 14 VAL CG2 1 1 5 3811 1 1 14 VAL H H -0.394 2.877 6.066 1.00 . A A . 14 VAL H 1 1 5 3812 1 1 14 VAL HA H -0.921 3.124 8.944 1.00 . A A . 14 VAL HA 1 1 5 3813 1 1 14 VAL HB H 1.816 2.516 7.953 1.00 . A A . 14 VAL HB 1 1 5 3814 1 1 14 VAL HG11 H 0.922 0.731 9.944 1.00 . A A . 14 VAL HG11 1 1 5 3815 1 1 14 VAL HG12 H 2.058 2.070 10.108 1.00 . A A . 14 VAL HG12 1 1 5 3816 1 1 14 VAL HG13 H 0.337 2.336 10.384 1.00 . A A . 14 VAL HG13 1 1 5 3817 1 1 14 VAL HG21 H -0.537 0.842 7.371 1.00 . A A . 14 VAL HG21 1 1 5 3818 1 1 14 VAL HG22 H 1.035 0.912 6.574 1.00 . A A . 14 VAL HG22 1 1 5 3819 1 1 14 VAL HG23 H 0.847 0.002 8.074 1.00 . A A . 14 VAL HG23 1 1 5 3820 1 1 14 VAL N N -0.906 3.074 6.875 1.00 . A A . 14 VAL N 1 1 5 3821 1 1 14 VAL O O 0.095 5.429 9.076 1.00 . A A . 14 VAL O 1 1 5 3822 1 1 15 CYS C C 1.568 7.210 6.646 1.00 . A A . 15 CYS C 1 1 5 3823 1 1 15 CYS CA C 2.256 6.041 7.356 1.00 . A A . 15 CYS CA 1 1 5 3824 1 1 15 CYS CB C 3.593 5.656 6.735 1.00 . A A . 15 CYS CB 1 1 5 3825 1 1 15 CYS H H 1.724 4.089 6.789 1.00 . A A . 15 CYS H 1 1 5 3826 1 1 15 CYS HA H 2.442 6.337 8.374 1.00 . A A . 15 CYS HA 1 1 5 3827 1 1 15 CYS HB2 H 3.861 6.375 5.980 1.00 . A A . 15 CYS HB2 1 1 5 3828 1 1 15 CYS HB3 H 4.355 5.620 7.498 1.00 . A A . 15 CYS HB3 1 1 5 3829 1 1 15 CYS N N 1.467 4.811 7.403 1.00 . A A . 15 CYS N 1 1 5 3830 1 1 15 CYS O O 2.110 8.316 6.619 1.00 . A A . 15 CYS O 1 1 5 3831 1 1 15 CYS SG S 3.483 4.010 5.962 1.00 . A A . 15 CYS SG 1 1 5 3832 1 1 16 LYS C C 0.086 9.062 4.896 1.00 . A A . 16 LYS C 1 1 5 3833 1 1 16 LYS CA C -0.602 8.083 5.845 1.00 . A A . 16 LYS CA 1 1 5 3834 1 1 16 LYS CB C -1.180 8.840 7.040 1.00 . A A . 16 LYS CB 1 1 5 3835 1 1 16 LYS CD C -2.933 8.927 8.829 1.00 . A A . 16 LYS CD 1 1 5 3836 1 1 16 LYS CE C -3.413 8.106 10.013 1.00 . A A . 16 LYS CE 1 1 5 3837 1 1 16 LYS CG C -2.237 8.060 7.797 1.00 . A A . 16 LYS CG 1 1 5 3838 1 1 16 LYS H H -0.111 6.146 6.534 1.00 . A A . 16 LYS H 1 1 5 3839 1 1 16 LYS HA H -1.416 7.614 5.315 1.00 . A A . 16 LYS HA 1 1 5 3840 1 1 16 LYS HB2 H -0.377 9.075 7.725 1.00 . A A . 16 LYS HB2 1 1 5 3841 1 1 16 LYS HB3 H -1.623 9.760 6.689 1.00 . A A . 16 LYS HB3 1 1 5 3842 1 1 16 LYS HD2 H -2.240 9.677 9.180 1.00 . A A . 16 LYS HD2 1 1 5 3843 1 1 16 LYS HD3 H -3.783 9.408 8.367 1.00 . A A . 16 LYS HD3 1 1 5 3844 1 1 16 LYS HE2 H -3.101 7.083 9.875 1.00 . A A . 16 LYS HE2 1 1 5 3845 1 1 16 LYS HE3 H -2.966 8.501 10.913 1.00 . A A . 16 LYS HE3 1 1 5 3846 1 1 16 LYS HG2 H -2.971 7.693 7.095 1.00 . A A . 16 LYS HG2 1 1 5 3847 1 1 16 LYS HG3 H -1.767 7.225 8.299 1.00 . A A . 16 LYS HG3 1 1 5 3848 1 1 16 LYS HZ1 H -5.339 8.023 9.217 1.00 . A A . 16 LYS HZ1 1 1 5 3849 1 1 16 LYS HZ2 H -5.191 9.071 10.542 1.00 . A A . 16 LYS HZ2 1 1 5 3850 1 1 16 LYS HZ3 H -5.217 7.390 10.786 1.00 . A A . 16 LYS HZ3 1 1 5 3851 1 1 16 LYS N N 0.289 7.012 6.317 1.00 . A A . 16 LYS N 1 1 5 3852 1 1 16 LYS NZ N -4.891 8.149 10.150 1.00 . A A . 16 LYS NZ 1 1 5 3853 1 1 16 LYS O O -0.051 10.280 5.032 1.00 . A A . 16 LYS O 1 1 5 3854 1 1 17 ASP C C 1.108 9.091 1.602 1.00 . A A . 17 ASP C 1 1 5 3855 1 1 17 ASP CA C 1.580 9.359 3.020 1.00 . A A . 17 ASP CA 1 1 5 3856 1 1 17 ASP CB C 3.083 9.097 3.121 1.00 . A A . 17 ASP CB 1 1 5 3857 1 1 17 ASP CG C 3.427 7.653 2.868 1.00 . A A . 17 ASP CG 1 1 5 3858 1 1 17 ASP H H 0.964 7.556 3.938 1.00 . A A . 17 ASP H 1 1 5 3859 1 1 17 ASP HA H 1.386 10.393 3.263 1.00 . A A . 17 ASP HA 1 1 5 3860 1 1 17 ASP HB2 H 3.598 9.700 2.389 1.00 . A A . 17 ASP HB2 1 1 5 3861 1 1 17 ASP HB3 H 3.425 9.363 4.108 1.00 . A A . 17 ASP HB3 1 1 5 3862 1 1 17 ASP N N 0.851 8.531 3.967 1.00 . A A . 17 ASP N 1 1 5 3863 1 1 17 ASP O O 0.397 8.115 1.350 1.00 . A A . 17 ASP O 1 1 5 3864 1 1 17 ASP OD1 O 3.309 6.838 3.804 1.00 . A A . 17 ASP OD1 1 1 5 3865 1 1 17 ASP OD2 O 3.816 7.317 1.735 1.00 . A A . 17 ASP OD2 1 1 5 3866 1 1 18 GLY C C 2.263 10.229 -1.628 1.00 . A A . 18 GLY C 1 1 5 3867 1 1 18 GLY CA C 1.136 9.821 -0.703 1.00 . A A . 18 GLY CA 1 1 5 3868 1 1 18 GLY H H 2.068 10.726 0.963 1.00 . A A . 18 GLY H 1 1 5 3869 1 1 18 GLY HA2 H 0.882 8.788 -0.893 1.00 . A A . 18 GLY HA2 1 1 5 3870 1 1 18 GLY HA3 H 0.272 10.439 -0.906 1.00 . A A . 18 GLY HA3 1 1 5 3871 1 1 18 GLY N N 1.505 9.966 0.688 1.00 . A A . 18 GLY N 1 1 5 3872 1 1 18 GLY O O 3.405 10.385 -1.193 1.00 . A A . 18 GLY O 1 1 5 3873 1 1 19 GLY C C 3.419 9.655 -4.708 1.00 . A A . 19 GLY C 1 1 5 3874 1 1 19 GLY CA C 2.957 10.816 -3.859 1.00 . A A . 19 GLY CA 1 1 5 3875 1 1 19 GLY H H 1.012 10.290 -3.189 1.00 . A A . 19 GLY H 1 1 5 3876 1 1 19 GLY HA2 H 2.548 11.580 -4.503 1.00 . A A . 19 GLY HA2 1 1 5 3877 1 1 19 GLY HA3 H 3.806 11.221 -3.328 1.00 . A A . 19 GLY HA3 1 1 5 3878 1 1 19 GLY N N 1.947 10.418 -2.898 1.00 . A A . 19 GLY N 1 1 5 3879 1 1 19 GLY O O 2.626 9.068 -5.452 1.00 . A A . 19 GLY O 1 1 5 3880 1 1 20 GLU C C 4.803 6.824 -4.505 1.00 . A A . 20 GLU C 1 1 5 3881 1 1 20 GLU CA C 5.207 8.098 -5.236 1.00 . A A . 20 GLU CA 1 1 5 3882 1 1 20 GLU CB C 6.729 8.194 -5.364 1.00 . A A . 20 GLU CB 1 1 5 3883 1 1 20 GLU CD C 6.064 9.438 -7.479 1.00 . A A . 20 GLU CD 1 1 5 3884 1 1 20 GLU CG C 7.198 9.001 -6.569 1.00 . A A . 20 GLU CG 1 1 5 3885 1 1 20 GLU H H 5.239 9.722 -3.873 1.00 . A A . 20 GLU H 1 1 5 3886 1 1 20 GLU HA H 4.770 8.081 -6.225 1.00 . A A . 20 GLU HA 1 1 5 3887 1 1 20 GLU HB2 H 7.124 8.660 -4.473 1.00 . A A . 20 GLU HB2 1 1 5 3888 1 1 20 GLU HB3 H 7.135 7.196 -5.446 1.00 . A A . 20 GLU HB3 1 1 5 3889 1 1 20 GLU HG2 H 7.708 9.883 -6.216 1.00 . A A . 20 GLU HG2 1 1 5 3890 1 1 20 GLU HG3 H 7.885 8.397 -7.143 1.00 . A A . 20 GLU HG3 1 1 5 3891 1 1 20 GLU N N 4.673 9.258 -4.536 1.00 . A A . 20 GLU N 1 1 5 3892 1 1 20 GLU O O 5.631 6.126 -3.920 1.00 . A A . 20 GLU O 1 1 5 3893 1 1 20 GLU OE1 O 5.649 8.640 -8.349 1.00 . A A . 20 GLU OE1 1 1 5 3894 1 1 20 GLU OE2 O 5.581 10.580 -7.328 1.00 . A A . 20 GLU OE2 1 1 5 3895 1 1 21 LEU C C 2.890 4.231 -4.585 1.00 . A A . 21 LEU C 1 1 5 3896 1 1 21 LEU CA C 2.915 5.495 -3.733 1.00 . A A . 21 LEU CA 1 1 5 3897 1 1 21 LEU CB C 1.490 5.874 -3.324 1.00 . A A . 21 LEU CB 1 1 5 3898 1 1 21 LEU CD1 C 2.329 6.091 -0.954 1.00 . A A . 21 LEU CD1 1 1 5 3899 1 1 21 LEU CD2 C -0.051 6.604 -1.503 1.00 . A A . 21 LEU CD2 1 1 5 3900 1 1 21 LEU CG C 1.147 5.734 -1.838 1.00 . A A . 21 LEU CG 1 1 5 3901 1 1 21 LEU H H 2.905 7.252 -4.895 1.00 . A A . 21 LEU H 1 1 5 3902 1 1 21 LEU HA H 3.506 5.319 -2.849 1.00 . A A . 21 LEU HA 1 1 5 3903 1 1 21 LEU HB2 H 1.324 6.904 -3.607 1.00 . A A . 21 LEU HB2 1 1 5 3904 1 1 21 LEU HB3 H 0.806 5.256 -3.884 1.00 . A A . 21 LEU HB3 1 1 5 3905 1 1 21 LEU HD11 H 3.217 5.602 -1.324 1.00 . A A . 21 LEU HD11 1 1 5 3906 1 1 21 LEU HD12 H 2.476 7.160 -0.961 1.00 . A A . 21 LEU HD12 1 1 5 3907 1 1 21 LEU HD13 H 2.130 5.760 0.059 1.00 . A A . 21 LEU HD13 1 1 5 3908 1 1 21 LEU HD21 H 0.213 7.290 -0.712 1.00 . A A . 21 LEU HD21 1 1 5 3909 1 1 21 LEU HD22 H -0.345 7.164 -2.380 1.00 . A A . 21 LEU HD22 1 1 5 3910 1 1 21 LEU HD23 H -0.871 5.981 -1.181 1.00 . A A . 21 LEU HD23 1 1 5 3911 1 1 21 LEU HG H 0.879 4.708 -1.634 1.00 . A A . 21 LEU HG 1 1 5 3912 1 1 21 LEU N N 3.501 6.602 -4.464 1.00 . A A . 21 LEU N 1 1 5 3913 1 1 21 LEU O O 2.394 4.241 -5.712 1.00 . A A . 21 LEU O 1 1 5 3914 1 1 22 LEU C C 1.878 1.227 -4.373 1.00 . A A . 22 LEU C 1 1 5 3915 1 1 22 LEU CA C 3.249 1.831 -4.653 1.00 . A A . 22 LEU CA 1 1 5 3916 1 1 22 LEU CB C 4.369 0.912 -4.153 1.00 . A A . 22 LEU CB 1 1 5 3917 1 1 22 LEU CD1 C 4.385 -0.964 -5.821 1.00 . A A . 22 LEU CD1 1 1 5 3918 1 1 22 LEU CD2 C 5.052 -1.388 -3.449 1.00 . A A . 22 LEU CD2 1 1 5 3919 1 1 22 LEU CG C 4.143 -0.586 -4.369 1.00 . A A . 22 LEU CG 1 1 5 3920 1 1 22 LEU H H 3.643 3.175 -3.068 1.00 . A A . 22 LEU H 1 1 5 3921 1 1 22 LEU HA H 3.357 1.982 -5.718 1.00 . A A . 22 LEU HA 1 1 5 3922 1 1 22 LEU HB2 H 5.284 1.190 -4.659 1.00 . A A . 22 LEU HB2 1 1 5 3923 1 1 22 LEU HB3 H 4.500 1.083 -3.094 1.00 . A A . 22 LEU HB3 1 1 5 3924 1 1 22 LEU HD11 H 3.455 -0.902 -6.369 1.00 . A A . 22 LEU HD11 1 1 5 3925 1 1 22 LEU HD12 H 5.104 -0.286 -6.255 1.00 . A A . 22 LEU HD12 1 1 5 3926 1 1 22 LEU HD13 H 4.765 -1.974 -5.873 1.00 . A A . 22 LEU HD13 1 1 5 3927 1 1 22 LEU HD21 H 6.011 -1.527 -3.924 1.00 . A A . 22 LEU HD21 1 1 5 3928 1 1 22 LEU HD22 H 5.183 -0.853 -2.520 1.00 . A A . 22 LEU HD22 1 1 5 3929 1 1 22 LEU HD23 H 4.605 -2.351 -3.251 1.00 . A A . 22 LEU HD23 1 1 5 3930 1 1 22 LEU HG H 3.119 -0.829 -4.125 1.00 . A A . 22 LEU HG 1 1 5 3931 1 1 22 LEU N N 3.335 3.130 -4.004 1.00 . A A . 22 LEU N 1 1 5 3932 1 1 22 LEU O O 1.520 0.996 -3.220 1.00 . A A . 22 LEU O 1 1 5 3933 1 1 23 CYS C C -0.539 -0.720 -5.295 1.00 . A A . 23 CYS C 1 1 5 3934 1 1 23 CYS CA C -0.344 0.790 -5.233 1.00 . A A . 23 CYS CA 1 1 5 3935 1 1 23 CYS CB C -1.193 1.459 -6.314 1.00 . A A . 23 CYS CB 1 1 5 3936 1 1 23 CYS H H 1.348 1.506 -6.274 1.00 . A A . 23 CYS H 1 1 5 3937 1 1 23 CYS HA H -0.670 1.145 -4.267 1.00 . A A . 23 CYS HA 1 1 5 3938 1 1 23 CYS HB2 H -1.609 0.697 -6.956 1.00 . A A . 23 CYS HB2 1 1 5 3939 1 1 23 CYS HB3 H -1.996 2.008 -5.844 1.00 . A A . 23 CYS HB3 1 1 5 3940 1 1 23 CYS HG H -0.327 3.807 -6.779 1.00 . A A . 23 CYS HG 1 1 5 3941 1 1 23 CYS N N 1.050 1.169 -5.401 1.00 . A A . 23 CYS N 1 1 5 3942 1 1 23 CYS O O 0.266 -1.437 -5.893 1.00 . A A . 23 CYS O 1 1 5 3943 1 1 23 CYS SG S -0.269 2.611 -7.356 1.00 . A A . 23 CYS SG 1 1 5 3944 1 1 24 CYS C C -2.480 -2.906 -6.285 1.00 . A A . 24 CYS C 1 1 5 3945 1 1 24 CYS CA C -2.096 -2.553 -4.848 1.00 . A A . 24 CYS CA 1 1 5 3946 1 1 24 CYS CB C -3.303 -2.749 -3.919 1.00 . A A . 24 CYS CB 1 1 5 3947 1 1 24 CYS H H -2.291 -0.515 -4.366 1.00 . A A . 24 CYS H 1 1 5 3948 1 1 24 CYS HA H -1.281 -3.182 -4.523 1.00 . A A . 24 CYS HA 1 1 5 3949 1 1 24 CYS HB2 H -3.113 -2.224 -2.996 1.00 . A A . 24 CYS HB2 1 1 5 3950 1 1 24 CYS HB3 H -4.175 -2.317 -4.391 1.00 . A A . 24 CYS HB3 1 1 5 3951 1 1 24 CYS N N -1.676 -1.164 -4.770 1.00 . A A . 24 CYS N 1 1 5 3952 1 1 24 CYS O O -2.185 -2.170 -7.230 1.00 . A A . 24 CYS O 1 1 5 3953 1 1 24 CYS SG S -3.718 -4.472 -3.480 1.00 . A A . 24 CYS SG 1 1 5 3954 1 1 25 ASP C C -5.246 -4.655 -7.630 1.00 . A A . 25 ASP C 1 1 5 3955 1 1 25 ASP CA C -3.751 -4.371 -7.727 1.00 . A A . 25 ASP CA 1 1 5 3956 1 1 25 ASP CB C -2.992 -5.594 -8.269 1.00 . A A . 25 ASP CB 1 1 5 3957 1 1 25 ASP CG C -3.860 -6.537 -9.085 1.00 . A A . 25 ASP CG 1 1 5 3958 1 1 25 ASP H H -3.493 -4.475 -5.623 1.00 . A A . 25 ASP H 1 1 5 3959 1 1 25 ASP HA H -3.605 -3.540 -8.403 1.00 . A A . 25 ASP HA 1 1 5 3960 1 1 25 ASP HB2 H -2.183 -5.254 -8.899 1.00 . A A . 25 ASP HB2 1 1 5 3961 1 1 25 ASP HB3 H -2.581 -6.148 -7.436 1.00 . A A . 25 ASP HB3 1 1 5 3962 1 1 25 ASP N N -3.230 -3.976 -6.428 1.00 . A A . 25 ASP N 1 1 5 3963 1 1 25 ASP O O -5.999 -4.412 -8.573 1.00 . A A . 25 ASP O 1 1 5 3964 1 1 25 ASP OD1 O -4.108 -6.258 -10.278 1.00 . A A . 25 ASP OD1 1 1 5 3965 1 1 25 ASP OD2 O -4.292 -7.571 -8.535 1.00 . A A . 25 ASP OD2 1 1 5 3966 1 1 26 THR C C -7.810 -4.341 -5.530 1.00 . A A . 26 THR C 1 1 5 3967 1 1 26 THR CA C -7.085 -5.456 -6.285 1.00 . A A . 26 THR CA 1 1 5 3968 1 1 26 THR CB C -7.273 -6.816 -5.561 1.00 . A A . 26 THR CB 1 1 5 3969 1 1 26 THR CG2 C -5.942 -7.534 -5.371 1.00 . A A . 26 THR CG2 1 1 5 3970 1 1 26 THR H H -5.052 -5.287 -5.743 1.00 . A A . 26 THR H 1 1 5 3971 1 1 26 THR HA H -7.530 -5.542 -7.268 1.00 . A A . 26 THR HA 1 1 5 3972 1 1 26 THR HB H -7.906 -7.441 -6.175 1.00 . A A . 26 THR HB 1 1 5 3973 1 1 26 THR HG1 H -7.238 -6.433 -3.612 1.00 . A A . 26 THR HG1 1 1 5 3974 1 1 26 THR HG21 H -5.527 -7.274 -4.407 1.00 . A A . 26 THR HG21 1 1 5 3975 1 1 26 THR HG22 H -5.256 -7.233 -6.150 1.00 . A A . 26 THR HG22 1 1 5 3976 1 1 26 THR HG23 H -6.096 -8.602 -5.419 1.00 . A A . 26 THR HG23 1 1 5 3977 1 1 26 THR N N -5.682 -5.138 -6.476 1.00 . A A . 26 THR N 1 1 5 3978 1 1 26 THR O O -9.036 -4.230 -5.607 1.00 . A A . 26 THR O 1 1 5 3979 1 1 26 THR OG1 O -7.909 -6.637 -4.290 1.00 . A A . 26 THR OG1 1 1 5 3980 1 1 27 CYS C C -6.807 -1.053 -4.473 1.00 . A A . 27 CYS C 1 1 5 3981 1 1 27 CYS CA C -7.642 -2.310 -4.217 1.00 . A A . 27 CYS CA 1 1 5 3982 1 1 27 CYS CB C -7.777 -2.593 -2.714 1.00 . A A . 27 CYS CB 1 1 5 3983 1 1 27 CYS H H -6.074 -3.529 -4.936 1.00 . A A . 27 CYS H 1 1 5 3984 1 1 27 CYS HA H -8.626 -2.157 -4.633 1.00 . A A . 27 CYS HA 1 1 5 3985 1 1 27 CYS HB2 H -8.531 -1.942 -2.301 1.00 . A A . 27 CYS HB2 1 1 5 3986 1 1 27 CYS HB3 H -8.085 -3.618 -2.578 1.00 . A A . 27 CYS HB3 1 1 5 3987 1 1 27 CYS N N -7.053 -3.454 -4.892 1.00 . A A . 27 CYS N 1 1 5 3988 1 1 27 CYS O O -5.713 -1.135 -5.026 1.00 . A A . 27 CYS O 1 1 5 3989 1 1 27 CYS SG S -6.255 -2.341 -1.745 1.00 . A A . 27 CYS SG 1 1 5 3990 1 1 28 PRO C C -5.708 1.823 -3.373 1.00 . A A . 28 PRO C 1 1 5 3991 1 1 28 PRO CA C -6.685 1.409 -4.472 1.00 . A A . 28 PRO CA 1 1 5 3992 1 1 28 PRO CB C -7.842 2.401 -4.546 1.00 . A A . 28 PRO CB 1 1 5 3993 1 1 28 PRO CD C -8.739 0.350 -3.705 1.00 . A A . 28 PRO CD 1 1 5 3994 1 1 28 PRO CG C -8.860 1.847 -3.610 1.00 . A A . 28 PRO CG 1 1 5 3995 1 1 28 PRO HA H -6.168 1.383 -5.420 1.00 . A A . 28 PRO HA 1 1 5 3996 1 1 28 PRO HB2 H -7.502 3.379 -4.233 1.00 . A A . 28 PRO HB2 1 1 5 3997 1 1 28 PRO HB3 H -8.219 2.449 -5.557 1.00 . A A . 28 PRO HB3 1 1 5 3998 1 1 28 PRO HD2 H -8.876 -0.103 -2.733 1.00 . A A . 28 PRO HD2 1 1 5 3999 1 1 28 PRO HD3 H -9.459 -0.043 -4.409 1.00 . A A . 28 PRO HD3 1 1 5 4000 1 1 28 PRO HG2 H -8.651 2.176 -2.603 1.00 . A A . 28 PRO HG2 1 1 5 4001 1 1 28 PRO HG3 H -9.848 2.164 -3.913 1.00 . A A . 28 PRO HG3 1 1 5 4002 1 1 28 PRO N N -7.362 0.139 -4.192 1.00 . A A . 28 PRO N 1 1 5 4003 1 1 28 PRO O O -5.072 2.874 -3.462 1.00 . A A . 28 PRO O 1 1 5 4004 1 1 29 SER C C -3.212 1.230 -1.751 1.00 . A A . 29 SER C 1 1 5 4005 1 1 29 SER CA C -4.653 1.282 -1.255 1.00 . A A . 29 SER CA 1 1 5 4006 1 1 29 SER CB C -4.859 0.295 -0.105 1.00 . A A . 29 SER CB 1 1 5 4007 1 1 29 SER H H -6.075 0.145 -2.340 1.00 . A A . 29 SER H 1 1 5 4008 1 1 29 SER HA H -4.862 2.280 -0.904 1.00 . A A . 29 SER HA 1 1 5 4009 1 1 29 SER HB2 H -4.277 -0.598 -0.290 1.00 . A A . 29 SER HB2 1 1 5 4010 1 1 29 SER HB3 H -4.534 0.748 0.820 1.00 . A A . 29 SER HB3 1 1 5 4011 1 1 29 SER HG H -6.402 -0.843 -0.549 1.00 . A A . 29 SER HG 1 1 5 4012 1 1 29 SER N N -5.574 0.991 -2.346 1.00 . A A . 29 SER N 1 1 5 4013 1 1 29 SER O O -2.848 0.364 -2.547 1.00 . A A . 29 SER O 1 1 5 4014 1 1 29 SER OG O -6.229 -0.069 0.020 1.00 . A A . 29 SER OG 1 1 5 4015 1 1 30 SER C C -0.091 2.516 -0.619 1.00 . A A . 30 SER C 1 1 5 4016 1 1 30 SER CA C -1.032 2.276 -1.795 1.00 . A A . 30 SER CA 1 1 5 4017 1 1 30 SER CB C -0.870 3.368 -2.849 1.00 . A A . 30 SER CB 1 1 5 4018 1 1 30 SER H H -2.759 2.903 -0.755 1.00 . A A . 30 SER H 1 1 5 4019 1 1 30 SER HA H -0.786 1.324 -2.236 1.00 . A A . 30 SER HA 1 1 5 4020 1 1 30 SER HB2 H -0.417 4.238 -2.395 1.00 . A A . 30 SER HB2 1 1 5 4021 1 1 30 SER HB3 H -0.235 3.006 -3.645 1.00 . A A . 30 SER HB3 1 1 5 4022 1 1 30 SER HG H -2.772 3.049 -3.228 1.00 . A A . 30 SER HG 1 1 5 4023 1 1 30 SER N N -2.412 2.206 -1.349 1.00 . A A . 30 SER N 1 1 5 4024 1 1 30 SER O O -0.541 2.797 0.491 1.00 . A A . 30 SER O 1 1 5 4025 1 1 30 SER OG O -2.124 3.742 -3.401 1.00 . A A . 30 SER OG 1 1 5 4026 1 1 31 TYR C C 3.521 2.787 -0.190 1.00 . A A . 31 TYR C 1 1 5 4027 1 1 31 TYR CA C 2.157 2.256 0.260 1.00 . A A . 31 TYR CA 1 1 5 4028 1 1 31 TYR CB C 2.329 0.831 0.804 1.00 . A A . 31 TYR CB 1 1 5 4029 1 1 31 TYR CD1 C 1.031 0.580 2.956 1.00 . A A . 31 TYR CD1 1 1 5 4030 1 1 31 TYR CD2 C 0.154 -0.428 0.983 1.00 . A A . 31 TYR CD2 1 1 5 4031 1 1 31 TYR CE1 C -0.043 0.103 3.679 1.00 . A A . 31 TYR CE1 1 1 5 4032 1 1 31 TYR CE2 C -0.923 -0.903 1.699 1.00 . A A . 31 TYR CE2 1 1 5 4033 1 1 31 TYR CG C 1.148 0.321 1.596 1.00 . A A . 31 TYR CG 1 1 5 4034 1 1 31 TYR CZ C -1.015 -0.636 3.045 1.00 . A A . 31 TYR CZ 1 1 5 4035 1 1 31 TYR H H 1.472 1.896 -1.711 1.00 . A A . 31 TYR H 1 1 5 4036 1 1 31 TYR HA H 1.773 2.889 1.043 1.00 . A A . 31 TYR HA 1 1 5 4037 1 1 31 TYR HB2 H 2.482 0.156 -0.024 1.00 . A A . 31 TYR HB2 1 1 5 4038 1 1 31 TYR HB3 H 3.196 0.799 1.448 1.00 . A A . 31 TYR HB3 1 1 5 4039 1 1 31 TYR HD1 H 1.797 1.161 3.449 1.00 . A A . 31 TYR HD1 1 1 5 4040 1 1 31 TYR HD2 H 0.229 -0.638 -0.073 1.00 . A A . 31 TYR HD2 1 1 5 4041 1 1 31 TYR HE1 H -0.119 0.313 4.736 1.00 . A A . 31 TYR HE1 1 1 5 4042 1 1 31 TYR HE2 H -1.689 -1.479 1.205 1.00 . A A . 31 TYR HE2 1 1 5 4043 1 1 31 TYR HH H -1.765 -1.531 4.575 1.00 . A A . 31 TYR HH 1 1 5 4044 1 1 31 TYR N N 1.192 2.241 -0.828 1.00 . A A . 31 TYR N 1 1 5 4045 1 1 31 TYR O O 3.742 3.051 -1.371 1.00 . A A . 31 TYR O 1 1 5 4046 1 1 31 TYR OH O -2.082 -1.113 3.759 1.00 . A A . 31 TYR OH 1 1 5 4047 1 1 32 HIS C C 6.384 1.560 -0.141 1.00 . A A . 32 HIS C 1 1 5 4048 1 1 32 HIS CA C 5.890 2.889 0.441 1.00 . A A . 32 HIS CA 1 1 5 4049 1 1 32 HIS CB C 6.693 3.166 1.738 1.00 . A A . 32 HIS CB 1 1 5 4050 1 1 32 HIS CD2 C 7.614 5.530 2.218 1.00 . A A . 32 HIS CD2 1 1 5 4051 1 1 32 HIS CE1 C 6.063 6.166 3.612 1.00 . A A . 32 HIS CE1 1 1 5 4052 1 1 32 HIS CG C 6.669 4.562 2.303 1.00 . A A . 32 HIS CG 1 1 5 4053 1 1 32 HIS H H 4.238 2.302 1.596 1.00 . A A . 32 HIS H 1 1 5 4054 1 1 32 HIS HA H 6.017 3.689 -0.273 1.00 . A A . 32 HIS HA 1 1 5 4055 1 1 32 HIS HB2 H 6.325 2.513 2.511 1.00 . A A . 32 HIS HB2 1 1 5 4056 1 1 32 HIS HB3 H 7.728 2.919 1.554 1.00 . A A . 32 HIS HB3 1 1 5 4057 1 1 32 HIS HD2 H 8.504 5.511 1.606 1.00 . A A . 32 HIS HD2 1 1 5 4058 1 1 32 HIS HE1 H 5.505 6.757 4.325 1.00 . A A . 32 HIS HE1 1 1 5 4059 1 1 32 HIS HE2 H 7.554 7.476 3.009 1.00 . A A . 32 HIS HE2 1 1 5 4060 1 1 32 HIS N N 4.473 2.713 0.735 1.00 . A A . 32 HIS N 1 1 5 4061 1 1 32 HIS ND1 N 5.691 4.978 3.181 1.00 . A A . 32 HIS ND1 1 1 5 4062 1 1 32 HIS NE2 N 7.225 6.549 3.055 1.00 . A A . 32 HIS NE2 1 1 5 4063 1 1 32 HIS O O 5.626 0.842 -0.790 1.00 . A A . 32 HIS O 1 1 5 4064 1 1 33 ILE C C 8.422 -0.906 1.372 1.00 . A A . 33 ILE C 1 1 5 4065 1 1 33 ILE CA C 7.993 -0.241 0.060 1.00 . A A . 33 ILE CA 1 1 5 4066 1 1 33 ILE CB C 9.150 -0.286 -0.963 1.00 . A A . 33 ILE CB 1 1 5 4067 1 1 33 ILE CD1 C 11.593 0.344 -1.314 1.00 . A A . 33 ILE CD1 1 1 5 4068 1 1 33 ILE CG1 C 10.355 0.509 -0.459 1.00 . A A . 33 ILE CG1 1 1 5 4069 1 1 33 ILE CG2 C 8.678 0.255 -2.302 1.00 . A A . 33 ILE CG2 1 1 5 4070 1 1 33 ILE H H 8.059 1.671 0.940 1.00 . A A . 33 ILE H 1 1 5 4071 1 1 33 ILE HA H 7.158 -0.792 -0.348 1.00 . A A . 33 ILE HA 1 1 5 4072 1 1 33 ILE HB H 9.439 -1.318 -1.102 1.00 . A A . 33 ILE HB 1 1 5 4073 1 1 33 ILE HD11 H 12.473 0.476 -0.702 1.00 . A A . 33 ILE HD11 1 1 5 4074 1 1 33 ILE HD12 H 11.600 -0.644 -1.749 1.00 . A A . 33 ILE HD12 1 1 5 4075 1 1 33 ILE HD13 H 11.587 1.083 -2.101 1.00 . A A . 33 ILE HD13 1 1 5 4076 1 1 33 ILE HG12 H 10.106 1.559 -0.439 1.00 . A A . 33 ILE HG12 1 1 5 4077 1 1 33 ILE HG21 H 8.061 -0.482 -2.790 1.00 . A A . 33 ILE HG21 1 1 5 4078 1 1 33 ILE HG22 H 8.104 1.157 -2.139 1.00 . A A . 33 ILE HG22 1 1 5 4079 1 1 33 ILE HG23 H 9.533 0.479 -2.923 1.00 . A A . 33 ILE HG23 1 1 5 4080 1 1 33 ILE N N 7.547 1.118 0.316 1.00 . A A . 33 ILE N 1 1 5 4081 1 1 33 ILE O O 9.143 -1.901 1.373 1.00 . A A . 33 ILE O 1 1 5 4082 1 1 34 HIS C C 7.391 -0.549 4.895 1.00 . A A . 34 HIS C 1 1 5 4083 1 1 34 HIS CA C 8.453 -0.789 3.810 1.00 . A A . 34 HIS CA 1 1 5 4084 1 1 34 HIS CB C 9.761 -0.073 4.189 1.00 . A A . 34 HIS CB 1 1 5 4085 1 1 34 HIS CD2 C 10.599 -2.058 5.623 1.00 . A A . 34 HIS CD2 1 1 5 4086 1 1 34 HIS CE1 C 11.949 -0.928 6.906 1.00 . A A . 34 HIS CE1 1 1 5 4087 1 1 34 HIS CG C 10.565 -0.754 5.262 1.00 . A A . 34 HIS CG 1 1 5 4088 1 1 34 HIS H H 7.479 0.504 2.436 1.00 . A A . 34 HIS H 1 1 5 4089 1 1 34 HIS HA H 8.642 -1.849 3.734 1.00 . A A . 34 HIS HA 1 1 5 4090 1 1 34 HIS HB2 H 10.386 0.000 3.311 1.00 . A A . 34 HIS HB2 1 1 5 4091 1 1 34 HIS HB3 H 9.525 0.923 4.535 1.00 . A A . 34 HIS HB3 1 1 5 4092 1 1 34 HIS HD2 H 10.041 -2.868 5.176 1.00 . A A . 34 HIS HD2 1 1 5 4093 1 1 34 HIS HE1 H 12.670 -0.688 7.675 1.00 . A A . 34 HIS HE1 1 1 5 4094 1 1 34 HIS HE2 H 11.774 -2.993 7.109 1.00 . A A . 34 HIS HE2 1 1 5 4095 1 1 34 HIS N N 8.017 -0.311 2.494 1.00 . A A . 34 HIS N 1 1 5 4096 1 1 34 HIS ND1 N 11.422 -0.044 6.074 1.00 . A A . 34 HIS ND1 1 1 5 4097 1 1 34 HIS NE2 N 11.479 -2.157 6.668 1.00 . A A . 34 HIS NE2 1 1 5 4098 1 1 34 HIS O O 7.688 -0.636 6.089 1.00 . A A . 34 HIS O 1 1 5 4099 1 1 35 CYS C C 4.607 -1.157 6.167 1.00 . A A . 35 CYS C 1 1 5 4100 1 1 35 CYS CA C 5.114 0.102 5.463 1.00 . A A . 35 CYS CA 1 1 5 4101 1 1 35 CYS CB C 3.946 0.768 4.747 1.00 . A A . 35 CYS CB 1 1 5 4102 1 1 35 CYS H H 5.976 -0.116 3.541 1.00 . A A . 35 CYS H 1 1 5 4103 1 1 35 CYS HA H 5.516 0.782 6.197 1.00 . A A . 35 CYS HA 1 1 5 4104 1 1 35 CYS HB2 H 3.236 0.011 4.444 1.00 . A A . 35 CYS HB2 1 1 5 4105 1 1 35 CYS HB3 H 3.465 1.459 5.423 1.00 . A A . 35 CYS HB3 1 1 5 4106 1 1 35 CYS N N 6.168 -0.208 4.497 1.00 . A A . 35 CYS N 1 1 5 4107 1 1 35 CYS O O 4.295 -1.137 7.358 1.00 . A A . 35 CYS O 1 1 5 4108 1 1 35 CYS SG S 4.434 1.698 3.264 1.00 . A A . 35 CYS SG 1 1 5 4109 1 1 36 LEU C C 4.826 -4.359 6.516 1.00 . A A . 36 LEU C 1 1 5 4110 1 1 36 LEU CA C 3.795 -3.428 5.887 1.00 . A A . 36 LEU CA 1 1 5 4111 1 1 36 LEU CB C 3.062 -4.147 4.749 1.00 . A A . 36 LEU CB 1 1 5 4112 1 1 36 LEU CD1 C 3.601 -5.128 2.504 1.00 . A A . 36 LEU CD1 1 1 5 4113 1 1 36 LEU CD2 C 2.754 -2.787 2.661 1.00 . A A . 36 LEU CD2 1 1 5 4114 1 1 36 LEU CG C 3.592 -3.859 3.339 1.00 . A A . 36 LEU CG 1 1 5 4115 1 1 36 LEU H H 4.615 -2.132 4.434 1.00 . A A . 36 LEU H 1 1 5 4116 1 1 36 LEU HA H 3.077 -3.147 6.641 1.00 . A A . 36 LEU HA 1 1 5 4117 1 1 36 LEU HB2 H 3.128 -5.210 4.925 1.00 . A A . 36 LEU HB2 1 1 5 4118 1 1 36 LEU HB3 H 2.022 -3.858 4.783 1.00 . A A . 36 LEU HB3 1 1 5 4119 1 1 36 LEU HD11 H 4.017 -4.914 1.529 1.00 . A A . 36 LEU HD11 1 1 5 4120 1 1 36 LEU HD12 H 4.203 -5.879 2.994 1.00 . A A . 36 LEU HD12 1 1 5 4121 1 1 36 LEU HD13 H 2.591 -5.492 2.391 1.00 . A A . 36 LEU HD13 1 1 5 4122 1 1 36 LEU HD21 H 1.745 -2.821 3.048 1.00 . A A . 36 LEU HD21 1 1 5 4123 1 1 36 LEU HD22 H 3.183 -1.816 2.858 1.00 . A A . 36 LEU HD22 1 1 5 4124 1 1 36 LEU HD23 H 2.736 -2.964 1.596 1.00 . A A . 36 LEU HD23 1 1 5 4125 1 1 36 LEU HG H 4.607 -3.497 3.409 1.00 . A A . 36 LEU HG 1 1 5 4126 1 1 36 LEU N N 4.411 -2.207 5.388 1.00 . A A . 36 LEU N 1 1 5 4127 1 1 36 LEU O O 6.020 -4.052 6.544 1.00 . A A . 36 LEU O 1 1 5 4128 1 1 37 ARG C C 6.196 -7.084 6.569 1.00 . A A . 37 ARG C 1 1 5 4129 1 1 37 ARG CA C 5.227 -6.503 7.607 1.00 . A A . 37 ARG CA 1 1 5 4130 1 1 37 ARG CB C 4.405 -7.615 8.268 1.00 . A A . 37 ARG CB 1 1 5 4131 1 1 37 ARG CD C 4.730 -6.815 10.628 1.00 . A A . 37 ARG CD 1 1 5 4132 1 1 37 ARG CG C 4.886 -7.977 9.665 1.00 . A A . 37 ARG CG 1 1 5 4133 1 1 37 ARG CZ C 6.153 -5.151 11.763 1.00 . A A . 37 ARG CZ 1 1 5 4134 1 1 37 ARG H H 3.388 -5.689 6.936 1.00 . A A . 37 ARG H 1 1 5 4135 1 1 37 ARG HA H 5.809 -6.004 8.369 1.00 . A A . 37 ARG HA 1 1 5 4136 1 1 37 ARG HB2 H 3.376 -7.295 8.337 1.00 . A A . 37 ARG HB2 1 1 5 4137 1 1 37 ARG HB3 H 4.458 -8.500 7.652 1.00 . A A . 37 ARG HB3 1 1 5 4138 1 1 37 ARG HD2 H 4.127 -6.053 10.158 1.00 . A A . 37 ARG HD2 1 1 5 4139 1 1 37 ARG HD3 H 4.233 -7.168 11.519 1.00 . A A . 37 ARG HD3 1 1 5 4140 1 1 37 ARG HE H 6.837 -6.688 10.664 1.00 . A A . 37 ARG HE 1 1 5 4141 1 1 37 ARG HG2 H 4.307 -8.812 10.029 1.00 . A A . 37 ARG HG2 1 1 5 4142 1 1 37 ARG HG3 H 5.928 -8.253 9.615 1.00 . A A . 37 ARG HG3 1 1 5 4143 1 1 37 ARG HH11 H 4.155 -4.855 11.972 1.00 . A A . 37 ARG HH11 1 1 5 4144 1 1 37 ARG HH12 H 5.165 -3.693 12.778 1.00 . A A . 37 ARG HH12 1 1 5 4145 1 1 37 ARG HH21 H 8.184 -5.160 11.721 1.00 . A A . 37 ARG HH21 1 1 5 4146 1 1 37 ARG HH22 H 7.464 -3.870 12.642 1.00 . A A . 37 ARG HH22 1 1 5 4147 1 1 37 ARG N N 4.355 -5.502 7.003 1.00 . A A . 37 ARG N 1 1 5 4148 1 1 37 ARG NE N 6.022 -6.235 11.002 1.00 . A A . 37 ARG NE 1 1 5 4149 1 1 37 ARG NH1 N 5.075 -4.517 12.208 1.00 . A A . 37 ARG NH1 1 1 5 4150 1 1 37 ARG NH2 N 7.363 -4.692 12.066 1.00 . A A . 37 ARG NH2 1 1 5 4151 1 1 37 ARG O O 7.409 -7.003 6.758 1.00 . A A . 37 ARG O 1 1 5 4152 1 1 38 PRO C C 7.258 -6.947 3.640 1.00 . A A . 38 PRO C 1 1 5 4153 1 1 38 PRO CA C 6.559 -8.105 4.347 1.00 . A A . 38 PRO CA 1 1 5 4154 1 1 38 PRO CB C 5.595 -8.820 3.385 1.00 . A A . 38 PRO CB 1 1 5 4155 1 1 38 PRO CD C 4.276 -7.763 5.070 1.00 . A A . 38 PRO CD 1 1 5 4156 1 1 38 PRO CG C 4.298 -8.919 4.117 1.00 . A A . 38 PRO CG 1 1 5 4157 1 1 38 PRO HA H 7.299 -8.804 4.711 1.00 . A A . 38 PRO HA 1 1 5 4158 1 1 38 PRO HB2 H 5.493 -8.240 2.480 1.00 . A A . 38 PRO HB2 1 1 5 4159 1 1 38 PRO HB3 H 5.986 -9.799 3.147 1.00 . A A . 38 PRO HB3 1 1 5 4160 1 1 38 PRO HD2 H 3.904 -6.874 4.583 1.00 . A A . 38 PRO HD2 1 1 5 4161 1 1 38 PRO HD3 H 3.680 -7.999 5.940 1.00 . A A . 38 PRO HD3 1 1 5 4162 1 1 38 PRO HG2 H 3.474 -8.847 3.421 1.00 . A A . 38 PRO HG2 1 1 5 4163 1 1 38 PRO HG3 H 4.253 -9.852 4.658 1.00 . A A . 38 PRO HG3 1 1 5 4164 1 1 38 PRO N N 5.694 -7.621 5.428 1.00 . A A . 38 PRO N 1 1 5 4165 1 1 38 PRO O O 6.663 -6.264 2.807 1.00 . A A . 38 PRO O 1 1 5 4166 1 1 39 ALA C C 9.704 -5.728 2.161 1.00 . A A . 39 ALA C 1 1 5 4167 1 1 39 ALA CA C 9.196 -5.500 3.576 1.00 . A A . 39 ALA CA 1 1 5 4168 1 1 39 ALA CB C 10.349 -5.166 4.505 1.00 . A A . 39 ALA CB 1 1 5 4169 1 1 39 ALA H H 8.858 -7.182 4.808 1.00 . A A . 39 ALA H 1 1 5 4170 1 1 39 ALA HA H 8.519 -4.659 3.572 1.00 . A A . 39 ALA HA 1 1 5 4171 1 1 39 ALA HB1 H 11.196 -4.837 3.921 1.00 . A A . 39 ALA HB1 1 1 5 4172 1 1 39 ALA HB2 H 10.048 -4.376 5.179 1.00 . A A . 39 ALA HB2 1 1 5 4173 1 1 39 ALA HB3 H 10.621 -6.042 5.074 1.00 . A A . 39 ALA HB3 1 1 5 4174 1 1 39 ALA N N 8.471 -6.652 4.074 1.00 . A A . 39 ALA N 1 1 5 4175 1 1 39 ALA O O 10.356 -6.736 1.875 1.00 . A A . 39 ALA O 1 1 5 4176 1 1 40 LEU C C 11.318 -4.080 -0.111 1.00 . A A . 40 LEU C 1 1 5 4177 1 1 40 LEU CA C 9.970 -4.783 -0.056 1.00 . A A . 40 LEU CA 1 1 5 4178 1 1 40 LEU CB C 8.990 -4.102 -1.023 1.00 . A A . 40 LEU CB 1 1 5 4179 1 1 40 LEU CD1 C 7.761 -6.302 -1.123 1.00 . A A . 40 LEU CD1 1 1 5 4180 1 1 40 LEU CD2 C 6.631 -4.281 -0.177 1.00 . A A . 40 LEU CD2 1 1 5 4181 1 1 40 LEU CG C 7.630 -4.790 -1.206 1.00 . A A . 40 LEU CG 1 1 5 4182 1 1 40 LEU H H 9.011 -3.938 1.620 1.00 . A A . 40 LEU H 1 1 5 4183 1 1 40 LEU HA H 10.097 -5.816 -0.344 1.00 . A A . 40 LEU HA 1 1 5 4184 1 1 40 LEU HB2 H 8.810 -3.099 -0.665 1.00 . A A . 40 LEU HB2 1 1 5 4185 1 1 40 LEU HB3 H 9.466 -4.037 -1.992 1.00 . A A . 40 LEU HB3 1 1 5 4186 1 1 40 LEU HD11 H 6.778 -6.745 -1.055 1.00 . A A . 40 LEU HD11 1 1 5 4187 1 1 40 LEU HD12 H 8.260 -6.668 -2.008 1.00 . A A . 40 LEU HD12 1 1 5 4188 1 1 40 LEU HD13 H 8.337 -6.567 -0.248 1.00 . A A . 40 LEU HD13 1 1 5 4189 1 1 40 LEU HD21 H 6.394 -5.072 0.518 1.00 . A A . 40 LEU HD21 1 1 5 4190 1 1 40 LEU HD22 H 7.059 -3.446 0.358 1.00 . A A . 40 LEU HD22 1 1 5 4191 1 1 40 LEU HD23 H 5.732 -3.961 -0.681 1.00 . A A . 40 LEU HD23 1 1 5 4192 1 1 40 LEU HG H 7.247 -4.547 -2.187 1.00 . A A . 40 LEU HG 1 1 5 4193 1 1 40 LEU N N 9.469 -4.746 1.304 1.00 . A A . 40 LEU N 1 1 5 4194 1 1 40 LEU O O 11.388 -2.853 -0.139 1.00 . A A . 40 LEU O 1 1 5 4195 1 1 41 TYR C C 14.126 -3.772 -1.385 1.00 . A A . 41 TYR C 1 1 5 4196 1 1 41 TYR CA C 13.733 -4.293 -0.010 1.00 . A A . 41 TYR CA 1 1 5 4197 1 1 41 TYR CB C 14.738 -5.336 0.478 1.00 . A A . 41 TYR CB 1 1 5 4198 1 1 41 TYR CD1 C 14.625 -4.807 2.947 1.00 . A A . 41 TYR CD1 1 1 5 4199 1 1 41 TYR CD2 C 14.245 -7.056 2.257 1.00 . A A . 41 TYR CD2 1 1 5 4200 1 1 41 TYR CE1 C 14.438 -5.177 4.266 1.00 . A A . 41 TYR CE1 1 1 5 4201 1 1 41 TYR CE2 C 14.058 -7.433 3.572 1.00 . A A . 41 TYR CE2 1 1 5 4202 1 1 41 TYR CG C 14.531 -5.740 1.921 1.00 . A A . 41 TYR CG 1 1 5 4203 1 1 41 TYR CZ C 14.156 -6.491 4.573 1.00 . A A . 41 TYR CZ 1 1 5 4204 1 1 41 TYR H H 12.271 -5.829 0.033 1.00 . A A . 41 TYR H 1 1 5 4205 1 1 41 TYR HA H 13.728 -3.465 0.683 1.00 . A A . 41 TYR HA 1 1 5 4206 1 1 41 TYR HB2 H 14.652 -6.224 -0.131 1.00 . A A . 41 TYR HB2 1 1 5 4207 1 1 41 TYR HB3 H 15.738 -4.937 0.385 1.00 . A A . 41 TYR HB3 1 1 5 4208 1 1 41 TYR HD1 H 14.843 -3.778 2.703 1.00 . A A . 41 TYR HD1 1 1 5 4209 1 1 41 TYR HD2 H 14.167 -7.792 1.470 1.00 . A A . 41 TYR HD2 1 1 5 4210 1 1 41 TYR HE1 H 14.515 -4.438 5.050 1.00 . A A . 41 TYR HE1 1 1 5 4211 1 1 41 TYR HE2 H 13.834 -8.462 3.812 1.00 . A A . 41 TYR HE2 1 1 5 4212 1 1 41 TYR HH H 14.194 -7.808 5.985 1.00 . A A . 41 TYR HH 1 1 5 4213 1 1 41 TYR N N 12.388 -4.856 -0.039 1.00 . A A . 41 TYR N 1 1 5 4214 1 1 41 TYR O O 15.026 -2.941 -1.515 1.00 . A A . 41 TYR O 1 1 5 4215 1 1 41 TYR OH O 13.977 -6.866 5.887 1.00 . A A . 41 TYR OH 1 1 5 4216 1 1 42 GLU C C 12.140 -3.423 -4.334 1.00 . A A . 42 GLU C 1 1 5 4217 1 1 42 GLU CA C 13.515 -3.685 -3.739 1.00 . A A . 42 GLU CA 1 1 5 4218 1 1 42 GLU CB C 14.281 -4.694 -4.597 1.00 . A A . 42 GLU CB 1 1 5 4219 1 1 42 GLU CD C 15.177 -6.986 -4.052 1.00 . A A . 42 GLU CD 1 1 5 4220 1 1 42 GLU CG C 13.944 -6.144 -4.289 1.00 . A A . 42 GLU CG 1 1 5 4221 1 1 42 GLU H H 12.599 -4.763 -2.180 1.00 . A A . 42 GLU H 1 1 5 4222 1 1 42 GLU HA H 14.065 -2.757 -3.698 1.00 . A A . 42 GLU HA 1 1 5 4223 1 1 42 GLU HB2 H 14.053 -4.510 -5.637 1.00 . A A . 42 GLU HB2 1 1 5 4224 1 1 42 GLU HB3 H 15.341 -4.553 -4.440 1.00 . A A . 42 GLU HB3 1 1 5 4225 1 1 42 GLU HG2 H 13.329 -6.176 -3.403 1.00 . A A . 42 GLU HG2 1 1 5 4226 1 1 42 GLU HG3 H 13.397 -6.559 -5.123 1.00 . A A . 42 GLU HG3 1 1 5 4227 1 1 42 GLU N N 13.359 -4.179 -2.381 1.00 . A A . 42 GLU N 1 1 5 4228 1 1 42 GLU O O 11.141 -3.942 -3.830 1.00 . A A . 42 GLU O 1 1 5 4229 1 1 42 GLU OE1 O 15.958 -7.187 -5.007 1.00 . A A . 42 GLU OE1 1 1 5 4230 1 1 42 GLU OE2 O 15.374 -7.455 -2.913 1.00 . A A . 42 GLU OE2 1 1 5 4231 1 1 43 VAL C C 10.206 -3.527 -6.683 1.00 . A A . 43 VAL C 1 1 5 4232 1 1 43 VAL CA C 10.809 -2.289 -6.022 1.00 . A A . 43 VAL CA 1 1 5 4233 1 1 43 VAL CB C 10.945 -1.164 -7.073 1.00 . A A . 43 VAL CB 1 1 5 4234 1 1 43 VAL CG1 C 9.868 -0.109 -6.859 1.00 . A A . 43 VAL CG1 1 1 5 4235 1 1 43 VAL CG2 C 12.326 -0.525 -7.029 1.00 . A A . 43 VAL CG2 1 1 5 4236 1 1 43 VAL H H 12.912 -2.234 -5.742 1.00 . A A . 43 VAL H 1 1 5 4237 1 1 43 VAL HA H 10.135 -1.947 -5.248 1.00 . A A . 43 VAL HA 1 1 5 4238 1 1 43 VAL HB H 10.803 -1.596 -8.052 1.00 . A A . 43 VAL HB 1 1 5 4239 1 1 43 VAL HG11 H 10.333 0.840 -6.638 1.00 . A A . 43 VAL HG11 1 1 5 4240 1 1 43 VAL HG12 H 9.270 -0.018 -7.754 1.00 . A A . 43 VAL HG12 1 1 5 4241 1 1 43 VAL HG13 H 9.236 -0.403 -6.034 1.00 . A A . 43 VAL HG13 1 1 5 4242 1 1 43 VAL HG21 H 13.077 -1.297 -6.934 1.00 . A A . 43 VAL HG21 1 1 5 4243 1 1 43 VAL HG22 H 12.495 0.031 -7.940 1.00 . A A . 43 VAL HG22 1 1 5 4244 1 1 43 VAL HG23 H 12.387 0.142 -6.183 1.00 . A A . 43 VAL HG23 1 1 5 4245 1 1 43 VAL N N 12.082 -2.615 -5.384 1.00 . A A . 43 VAL N 1 1 5 4246 1 1 43 VAL O O 10.824 -4.144 -7.555 1.00 . A A . 43 VAL O 1 1 5 4247 1 1 44 PRO C C 7.619 -4.956 -7.994 1.00 . A A . 44 PRO C 1 1 5 4248 1 1 44 PRO CA C 8.378 -5.175 -6.689 1.00 . A A . 44 PRO CA 1 1 5 4249 1 1 44 PRO CB C 7.420 -5.526 -5.552 1.00 . A A . 44 PRO CB 1 1 5 4250 1 1 44 PRO CD C 8.282 -3.333 -5.101 1.00 . A A . 44 PRO CD 1 1 5 4251 1 1 44 PRO CG C 7.074 -4.216 -4.933 1.00 . A A . 44 PRO CG 1 1 5 4252 1 1 44 PRO HA H 9.089 -5.979 -6.822 1.00 . A A . 44 PRO HA 1 1 5 4253 1 1 44 PRO HB2 H 6.547 -6.019 -5.954 1.00 . A A . 44 PRO HB2 1 1 5 4254 1 1 44 PRO HB3 H 7.916 -6.179 -4.847 1.00 . A A . 44 PRO HB3 1 1 5 4255 1 1 44 PRO HD2 H 7.981 -2.328 -5.363 1.00 . A A . 44 PRO HD2 1 1 5 4256 1 1 44 PRO HD3 H 8.870 -3.326 -4.195 1.00 . A A . 44 PRO HD3 1 1 5 4257 1 1 44 PRO HG2 H 6.223 -3.783 -5.436 1.00 . A A . 44 PRO HG2 1 1 5 4258 1 1 44 PRO HG3 H 6.858 -4.354 -3.883 1.00 . A A . 44 PRO HG3 1 1 5 4259 1 1 44 PRO N N 9.030 -3.959 -6.207 1.00 . A A . 44 PRO N 1 1 5 4260 1 1 44 PRO O O 6.393 -4.841 -8.004 1.00 . A A . 44 PRO O 1 1 5 4261 1 1 45 ASP C C 6.962 -5.976 -10.796 1.00 . A A . 45 ASP C 1 1 5 4262 1 1 45 ASP CA C 7.750 -4.732 -10.410 1.00 . A A . 45 ASP CA 1 1 5 4263 1 1 45 ASP CB C 8.821 -4.443 -11.466 1.00 . A A . 45 ASP CB 1 1 5 4264 1 1 45 ASP CG C 8.300 -4.613 -12.881 1.00 . A A . 45 ASP CG 1 1 5 4265 1 1 45 ASP H H 9.329 -5.002 -9.025 1.00 . A A . 45 ASP H 1 1 5 4266 1 1 45 ASP HA H 7.072 -3.893 -10.354 1.00 . A A . 45 ASP HA 1 1 5 4267 1 1 45 ASP HB2 H 9.165 -3.426 -11.352 1.00 . A A . 45 ASP HB2 1 1 5 4268 1 1 45 ASP HB3 H 9.650 -5.120 -11.323 1.00 . A A . 45 ASP HB3 1 1 5 4269 1 1 45 ASP N N 8.355 -4.906 -9.095 1.00 . A A . 45 ASP N 1 1 5 4270 1 1 45 ASP O O 7.440 -7.099 -10.619 1.00 . A A . 45 ASP O 1 1 5 4271 1 1 45 ASP OD1 O 7.421 -3.829 -13.292 1.00 . A A . 45 ASP OD1 1 1 5 4272 1 1 45 ASP OD2 O 8.764 -5.534 -13.585 1.00 . A A . 45 ASP OD2 1 1 5 4273 1 1 46 GLY C C 3.543 -6.815 -10.989 1.00 . A A . 46 GLY C 1 1 5 4274 1 1 46 GLY CA C 4.900 -6.891 -11.651 1.00 . A A . 46 GLY CA 1 1 5 4275 1 1 46 GLY H H 5.405 -4.858 -11.363 1.00 . A A . 46 GLY H 1 1 5 4276 1 1 46 GLY HA2 H 4.769 -6.887 -12.723 1.00 . A A . 46 GLY HA2 1 1 5 4277 1 1 46 GLY HA3 H 5.384 -7.810 -11.359 1.00 . A A . 46 GLY HA3 1 1 5 4278 1 1 46 GLY N N 5.745 -5.776 -11.279 1.00 . A A . 46 GLY N 1 1 5 4279 1 1 46 GLY O O 2.913 -5.755 -10.977 1.00 . A A . 46 GLY O 1 1 5 4280 1 1 47 GLU C C 2.083 -7.863 -8.177 1.00 . A A . 47 GLU C 1 1 5 4281 1 1 47 GLU CA C 1.847 -7.954 -9.680 1.00 . A A . 47 GLU CA 1 1 5 4282 1 1 47 GLU CB C 1.072 -9.234 -10.003 1.00 . A A . 47 GLU CB 1 1 5 4283 1 1 47 GLU CD C 1.492 -11.046 -11.706 1.00 . A A . 47 GLU CD 1 1 5 4284 1 1 47 GLU CG C 1.079 -9.609 -11.475 1.00 . A A . 47 GLU CG 1 1 5 4285 1 1 47 GLU H H 3.680 -8.721 -10.405 1.00 . A A . 47 GLU H 1 1 5 4286 1 1 47 GLU HA H 1.265 -7.100 -9.991 1.00 . A A . 47 GLU HA 1 1 5 4287 1 1 47 GLU HB2 H 1.504 -10.052 -9.445 1.00 . A A . 47 GLU HB2 1 1 5 4288 1 1 47 GLU HB3 H 0.045 -9.105 -9.693 1.00 . A A . 47 GLU HB3 1 1 5 4289 1 1 47 GLU HG2 H 0.087 -9.468 -11.875 1.00 . A A . 47 GLU HG2 1 1 5 4290 1 1 47 GLU HG3 H 1.772 -8.963 -11.993 1.00 . A A . 47 GLU HG3 1 1 5 4291 1 1 47 GLU N N 3.114 -7.918 -10.395 1.00 . A A . 47 GLU N 1 1 5 4292 1 1 47 GLU O O 2.498 -8.837 -7.544 1.00 . A A . 47 GLU O 1 1 5 4293 1 1 47 GLU OE1 O 0.834 -11.957 -11.161 1.00 . A A . 47 GLU OE1 1 1 5 4294 1 1 47 GLU OE2 O 2.483 -11.273 -12.427 1.00 . A A . 47 GLU OE2 1 1 5 4295 1 1 48 TRP C C 0.581 -6.322 -5.526 1.00 . A A . 48 TRP C 1 1 5 4296 1 1 48 TRP CA C 1.946 -6.505 -6.173 1.00 . A A . 48 TRP CA 1 1 5 4297 1 1 48 TRP CB C 2.837 -5.290 -5.883 1.00 . A A . 48 TRP CB 1 1 5 4298 1 1 48 TRP CD1 C 4.089 -5.834 -3.713 1.00 . A A . 48 TRP CD1 1 1 5 4299 1 1 48 TRP CD2 C 2.550 -4.224 -3.503 1.00 . A A . 48 TRP CD2 1 1 5 4300 1 1 48 TRP CE2 C 3.160 -4.428 -2.249 1.00 . A A . 48 TRP CE2 1 1 5 4301 1 1 48 TRP CE3 C 1.552 -3.256 -3.613 1.00 . A A . 48 TRP CE3 1 1 5 4302 1 1 48 TRP CG C 3.161 -5.132 -4.426 1.00 . A A . 48 TRP CG 1 1 5 4303 1 1 48 TRP CH2 C 1.817 -2.760 -1.257 1.00 . A A . 48 TRP CH2 1 1 5 4304 1 1 48 TRP CZ2 C 2.798 -3.701 -1.118 1.00 . A A . 48 TRP CZ2 1 1 5 4305 1 1 48 TRP CZ3 C 1.194 -2.534 -2.490 1.00 . A A . 48 TRP CZ3 1 1 5 4306 1 1 48 TRP H H 1.440 -5.969 -8.158 1.00 . A A . 48 TRP H 1 1 5 4307 1 1 48 TRP HA H 2.410 -7.389 -5.762 1.00 . A A . 48 TRP HA 1 1 5 4308 1 1 48 TRP HB2 H 3.766 -5.398 -6.423 1.00 . A A . 48 TRP HB2 1 1 5 4309 1 1 48 TRP HB3 H 2.333 -4.395 -6.216 1.00 . A A . 48 TRP HB3 1 1 5 4310 1 1 48 TRP HD1 H 4.722 -6.605 -4.131 1.00 . A A . 48 TRP HD1 1 1 5 4311 1 1 48 TRP HE1 H 4.674 -5.769 -1.696 1.00 . A A . 48 TRP HE1 1 1 5 4312 1 1 48 TRP HE3 H 1.060 -3.066 -4.557 1.00 . A A . 48 TRP HE3 1 1 5 4313 1 1 48 TRP HH2 H 1.504 -2.173 -0.405 1.00 . A A . 48 TRP HH2 1 1 5 4314 1 1 48 TRP HZ2 H 3.271 -3.864 -0.159 1.00 . A A . 48 TRP HZ2 1 1 5 4315 1 1 48 TRP HZ3 H 0.423 -1.780 -2.558 1.00 . A A . 48 TRP HZ3 1 1 5 4316 1 1 48 TRP N N 1.798 -6.705 -7.606 1.00 . A A . 48 TRP N 1 1 5 4317 1 1 48 TRP NE1 N 4.094 -5.416 -2.405 1.00 . A A . 48 TRP NE1 1 1 5 4318 1 1 48 TRP O O -0.323 -5.723 -6.113 1.00 . A A . 48 TRP O 1 1 5 4319 1 1 49 GLN C C -0.563 -6.335 -2.173 1.00 . A A . 49 GLN C 1 1 5 4320 1 1 49 GLN CA C -0.831 -6.777 -3.605 1.00 . A A . 49 GLN CA 1 1 5 4321 1 1 49 GLN CB C -1.586 -8.113 -3.602 1.00 . A A . 49 GLN CB 1 1 5 4322 1 1 49 GLN CD C -2.054 -9.185 -5.841 1.00 . A A . 49 GLN CD 1 1 5 4323 1 1 49 GLN CG C -1.110 -9.100 -4.658 1.00 . A A . 49 GLN CG 1 1 5 4324 1 1 49 GLN H H 1.172 -7.377 -3.937 1.00 . A A . 49 GLN H 1 1 5 4325 1 1 49 GLN HA H -1.438 -6.029 -4.093 1.00 . A A . 49 GLN HA 1 1 5 4326 1 1 49 GLN HB2 H -1.468 -8.578 -2.635 1.00 . A A . 49 GLN HB2 1 1 5 4327 1 1 49 GLN HB3 H -2.636 -7.921 -3.771 1.00 . A A . 49 GLN HB3 1 1 5 4328 1 1 49 GLN HE21 H -1.692 -7.287 -6.295 1.00 . A A . 49 GLN HE21 1 1 5 4329 1 1 49 GLN HE22 H -2.815 -8.108 -7.330 1.00 . A A . 49 GLN HE22 1 1 5 4330 1 1 49 GLN HG2 H -0.141 -8.788 -5.014 1.00 . A A . 49 GLN HG2 1 1 5 4331 1 1 49 GLN HG3 H -1.031 -10.079 -4.208 1.00 . A A . 49 GLN HG3 1 1 5 4332 1 1 49 GLN N N 0.421 -6.881 -4.337 1.00 . A A . 49 GLN N 1 1 5 4333 1 1 49 GLN NE2 N -2.200 -8.086 -6.560 1.00 . A A . 49 GLN NE2 1 1 5 4334 1 1 49 GLN O O 0.426 -6.751 -1.561 1.00 . A A . 49 GLN O 1 1 5 4335 1 1 49 GLN OE1 O -2.646 -10.232 -6.107 1.00 . A A . 49 GLN OE1 1 1 5 4336 1 1 50 CYS C C -1.488 -6.091 0.732 1.00 . A A . 50 CYS C 1 1 5 4337 1 1 50 CYS CA C -1.293 -4.969 -0.299 1.00 . A A . 50 CYS CA 1 1 5 4338 1 1 50 CYS CB C -2.321 -3.864 -0.070 1.00 . A A . 50 CYS CB 1 1 5 4339 1 1 50 CYS H H -2.178 -5.157 -2.211 1.00 . A A . 50 CYS H 1 1 5 4340 1 1 50 CYS HA H -0.301 -4.557 -0.193 1.00 . A A . 50 CYS HA 1 1 5 4341 1 1 50 CYS HB2 H -2.022 -3.278 0.786 1.00 . A A . 50 CYS HB2 1 1 5 4342 1 1 50 CYS HB3 H -2.359 -3.229 -0.942 1.00 . A A . 50 CYS HB3 1 1 5 4343 1 1 50 CYS N N -1.429 -5.478 -1.655 1.00 . A A . 50 CYS N 1 1 5 4344 1 1 50 CYS O O -1.972 -7.172 0.394 1.00 . A A . 50 CYS O 1 1 5 4345 1 1 50 CYS SG S -4.001 -4.483 0.241 1.00 . A A . 50 CYS SG 1 1 5 4346 1 1 51 PRO C C -2.763 -7.144 3.412 1.00 . A A . 51 PRO C 1 1 5 4347 1 1 51 PRO CA C -1.295 -6.836 3.085 1.00 . A A . 51 PRO CA 1 1 5 4348 1 1 51 PRO CB C -0.610 -6.180 4.287 1.00 . A A . 51 PRO CB 1 1 5 4349 1 1 51 PRO CD C -0.543 -4.590 2.509 1.00 . A A . 51 PRO CD 1 1 5 4350 1 1 51 PRO CG C -0.653 -4.721 4.002 1.00 . A A . 51 PRO CG 1 1 5 4351 1 1 51 PRO HA H -0.786 -7.756 2.843 1.00 . A A . 51 PRO HA 1 1 5 4352 1 1 51 PRO HB2 H -1.151 -6.422 5.191 1.00 . A A . 51 PRO HB2 1 1 5 4353 1 1 51 PRO HB3 H 0.409 -6.535 4.365 1.00 . A A . 51 PRO HB3 1 1 5 4354 1 1 51 PRO HD2 H -1.106 -3.734 2.163 1.00 . A A . 51 PRO HD2 1 1 5 4355 1 1 51 PRO HD3 H 0.492 -4.509 2.212 1.00 . A A . 51 PRO HD3 1 1 5 4356 1 1 51 PRO HG2 H -1.590 -4.309 4.349 1.00 . A A . 51 PRO HG2 1 1 5 4357 1 1 51 PRO HG3 H 0.177 -4.228 4.485 1.00 . A A . 51 PRO HG3 1 1 5 4358 1 1 51 PRO N N -1.138 -5.845 2.012 1.00 . A A . 51 PRO N 1 1 5 4359 1 1 51 PRO O O -3.050 -8.034 4.213 1.00 . A A . 51 PRO O 1 1 5 4360 1 1 52 ARG C C -5.614 -7.695 1.926 1.00 . A A . 52 ARG C 1 1 5 4361 1 1 52 ARG CA C -5.105 -6.705 2.968 1.00 . A A . 52 ARG CA 1 1 5 4362 1 1 52 ARG CB C -5.910 -5.409 2.903 1.00 . A A . 52 ARG CB 1 1 5 4363 1 1 52 ARG CD C -8.393 -5.310 3.265 1.00 . A A . 52 ARG CD 1 1 5 4364 1 1 52 ARG CG C -7.027 -5.338 3.931 1.00 . A A . 52 ARG CG 1 1 5 4365 1 1 52 ARG CZ C -9.314 -7.129 1.875 1.00 . A A . 52 ARG CZ 1 1 5 4366 1 1 52 ARG H H -3.411 -5.763 2.111 1.00 . A A . 52 ARG H 1 1 5 4367 1 1 52 ARG HA H -5.225 -7.143 3.949 1.00 . A A . 52 ARG HA 1 1 5 4368 1 1 52 ARG HB2 H -5.242 -4.576 3.070 1.00 . A A . 52 ARG HB2 1 1 5 4369 1 1 52 ARG HB3 H -6.347 -5.315 1.919 1.00 . A A . 52 ARG HB3 1 1 5 4370 1 1 52 ARG HD2 H -9.072 -4.748 3.889 1.00 . A A . 52 ARG HD2 1 1 5 4371 1 1 52 ARG HD3 H -8.300 -4.822 2.306 1.00 . A A . 52 ARG HD3 1 1 5 4372 1 1 52 ARG HE H -9.003 -7.240 3.859 1.00 . A A . 52 ARG HE 1 1 5 4373 1 1 52 ARG HG2 H -6.967 -6.202 4.575 1.00 . A A . 52 ARG HG2 1 1 5 4374 1 1 52 ARG HG3 H -6.904 -4.440 4.518 1.00 . A A . 52 ARG HG3 1 1 5 4375 1 1 52 ARG HH11 H -8.870 -5.428 0.860 1.00 . A A . 52 ARG HH11 1 1 5 4376 1 1 52 ARG HH12 H -9.501 -6.729 -0.107 1.00 . A A . 52 ARG HH12 1 1 5 4377 1 1 52 ARG HH21 H -9.831 -8.956 2.583 1.00 . A A . 52 ARG HH21 1 1 5 4378 1 1 52 ARG HH22 H -10.056 -8.729 0.876 1.00 . A A . 52 ARG HH22 1 1 5 4379 1 1 52 ARG N N -3.688 -6.444 2.767 1.00 . A A . 52 ARG N 1 1 5 4380 1 1 52 ARG NE N -8.932 -6.653 3.062 1.00 . A A . 52 ARG NE 1 1 5 4381 1 1 52 ARG NH1 N -9.225 -6.365 0.792 1.00 . A A . 52 ARG NH1 1 1 5 4382 1 1 52 ARG NH2 N -9.772 -8.367 1.769 1.00 . A A . 52 ARG NH2 1 1 5 4383 1 1 52 ARG O O -6.181 -8.734 2.273 1.00 . A A . 52 ARG O 1 1 5 4384 1 1 53 CYS C C -4.745 -9.485 -0.489 1.00 . A A . 53 CYS C 1 1 5 4385 1 1 53 CYS CA C -5.709 -8.305 -0.431 1.00 . A A . 53 CYS CA 1 1 5 4386 1 1 53 CYS CB C -5.704 -7.562 -1.774 1.00 . A A . 53 CYS CB 1 1 5 4387 1 1 53 CYS H H -4.825 -6.590 0.451 1.00 . A A . 53 CYS H 1 1 5 4388 1 1 53 CYS HA H -6.702 -8.673 -0.234 1.00 . A A . 53 CYS HA 1 1 5 4389 1 1 53 CYS HB2 H -4.685 -7.325 -2.043 1.00 . A A . 53 CYS HB2 1 1 5 4390 1 1 53 CYS HB3 H -6.127 -8.205 -2.532 1.00 . A A . 53 CYS HB3 1 1 5 4391 1 1 53 CYS N N -5.337 -7.404 0.655 1.00 . A A . 53 CYS N 1 1 5 4392 1 1 53 CYS O O -5.109 -10.614 -0.157 1.00 . A A . 53 CYS O 1 1 5 4393 1 1 53 CYS SG S -6.650 -6.004 -1.780 1.00 . A A . 53 CYS SG 1 1 5 4394 1 1 54 THR C C -2.844 -11.457 -1.603 1.00 . A A . 54 THR C 1 1 5 4395 1 1 54 THR CA C -2.412 -10.145 -0.936 1.00 . A A . 54 THR CA 1 1 5 4396 1 1 54 THR CB C -1.791 -10.424 0.449 1.00 . A A . 54 THR CB 1 1 5 4397 1 1 54 THR CG2 C -0.305 -10.102 0.437 1.00 . A A . 54 THR CG2 1 1 5 4398 1 1 54 THR H H -3.301 -8.235 -1.042 1.00 . A A . 54 THR H 1 1 5 4399 1 1 54 THR HA H -1.645 -9.699 -1.553 1.00 . A A . 54 THR HA 1 1 5 4400 1 1 54 THR HB H -1.915 -11.468 0.688 1.00 . A A . 54 THR HB 1 1 5 4401 1 1 54 THR HG1 H -2.590 -8.741 1.099 1.00 . A A . 54 THR HG1 1 1 5 4402 1 1 54 THR HG21 H 0.136 -10.457 -0.484 1.00 . A A . 54 THR HG21 1 1 5 4403 1 1 54 THR HG22 H 0.175 -10.584 1.275 1.00 . A A . 54 THR HG22 1 1 5 4404 1 1 54 THR HG23 H -0.171 -9.032 0.510 1.00 . A A . 54 THR HG23 1 1 5 4405 1 1 54 THR N N -3.502 -9.175 -0.850 1.00 . A A . 54 THR N 1 1 5 4406 1 1 54 THR O O -3.066 -11.499 -2.814 1.00 . A A . 54 THR O 1 1 5 4407 1 1 54 THR OG1 O -2.442 -9.632 1.451 1.00 . A A . 54 THR OG1 1 1 5 4408 1 1 55 CYS C C -4.650 -14.283 -0.749 1.00 . A A . 55 CYS C 1 1 5 4409 1 1 55 CYS CA C -3.330 -13.818 -1.354 1.00 . A A . 55 CYS CA 1 1 5 4410 1 1 55 CYS CB C -2.223 -14.835 -1.069 1.00 . A A . 55 CYS CB 1 1 5 4411 1 1 55 CYS H H -2.794 -12.435 0.139 1.00 . A A . 55 CYS H 1 1 5 4412 1 1 55 CYS HA H -3.450 -13.718 -2.423 1.00 . A A . 55 CYS HA 1 1 5 4413 1 1 55 CYS HB2 H -2.526 -15.464 -0.246 1.00 . A A . 55 CYS HB2 1 1 5 4414 1 1 55 CYS HB3 H -2.070 -15.446 -1.947 1.00 . A A . 55 CYS HB3 1 1 5 4415 1 1 55 CYS HG H -0.619 -13.897 0.684 1.00 . A A . 55 CYS HG 1 1 5 4416 1 1 55 CYS N N -2.958 -12.522 -0.821 1.00 . A A . 55 CYS N 1 1 5 4417 1 1 55 CYS O O -4.717 -14.621 0.435 1.00 . A A . 55 CYS O 1 1 5 4418 1 1 55 CYS SG S -0.635 -14.085 -0.632 1.00 . A A . 55 CYS SG 1 1 5 4419 1 1 56 PRO C C -7.230 -16.116 -0.951 1.00 . A A . 56 PRO C 1 1 5 4420 1 1 56 PRO CA C -7.069 -14.605 -1.068 1.00 . A A . 56 PRO CA 1 1 5 4421 1 1 56 PRO CB C -8.011 -14.046 -2.146 1.00 . A A . 56 PRO CB 1 1 5 4422 1 1 56 PRO CD C -5.766 -13.747 -2.914 1.00 . A A . 56 PRO CD 1 1 5 4423 1 1 56 PRO CG C -7.157 -13.198 -3.027 1.00 . A A . 56 PRO CG 1 1 5 4424 1 1 56 PRO HA H -7.297 -14.147 -0.117 1.00 . A A . 56 PRO HA 1 1 5 4425 1 1 56 PRO HB2 H -8.452 -14.864 -2.696 1.00 . A A . 56 PRO HB2 1 1 5 4426 1 1 56 PRO HB3 H -8.790 -13.463 -1.677 1.00 . A A . 56 PRO HB3 1 1 5 4427 1 1 56 PRO HD2 H -5.618 -14.556 -3.615 1.00 . A A . 56 PRO HD2 1 1 5 4428 1 1 56 PRO HD3 H -5.035 -12.969 -3.066 1.00 . A A . 56 PRO HD3 1 1 5 4429 1 1 56 PRO HG2 H -7.503 -13.266 -4.048 1.00 . A A . 56 PRO HG2 1 1 5 4430 1 1 56 PRO HG3 H -7.184 -12.173 -2.688 1.00 . A A . 56 PRO HG3 1 1 5 4431 1 1 56 PRO N N -5.734 -14.234 -1.533 1.00 . A A . 56 PRO N 1 1 5 4432 1 1 56 PRO O O -7.911 -16.745 -1.768 1.00 . A A . 56 PRO O 1 1 5 4433 1 1 57 ALA C C -8.084 -18.579 0.528 1.00 . A A . 57 ALA C 1 1 5 4434 1 1 57 ALA CA C -6.646 -18.135 0.288 1.00 . A A . 57 ALA CA 1 1 5 4435 1 1 57 ALA CB C -5.768 -18.517 1.469 1.00 . A A . 57 ALA CB 1 1 5 4436 1 1 57 ALA H H -6.036 -16.137 0.650 1.00 . A A . 57 ALA H 1 1 5 4437 1 1 57 ALA HA H -6.266 -18.633 -0.592 1.00 . A A . 57 ALA HA 1 1 5 4438 1 1 57 ALA HB1 H -4.736 -18.552 1.154 1.00 . A A . 57 ALA HB1 1 1 5 4439 1 1 57 ALA HB2 H -5.881 -17.785 2.255 1.00 . A A . 57 ALA HB2 1 1 5 4440 1 1 57 ALA HB3 H -6.065 -19.488 1.838 1.00 . A A . 57 ALA HB3 1 1 5 4441 1 1 57 ALA N N -6.584 -16.696 0.054 1.00 . A A . 57 ALA N 1 1 5 4442 1 1 57 ALA O O -8.517 -19.619 0.032 1.00 . A A . 57 ALA O 1 1 5 4443 1 1 58 LEU C C -11.030 -16.706 1.368 1.00 . A A . 58 LEU C 1 1 5 4444 1 1 58 LEU CA C -10.245 -18.005 1.487 1.00 . A A . 58 LEU CA 1 1 5 4445 1 1 58 LEU CB C -10.452 -18.624 2.871 1.00 . A A . 58 LEU CB 1 1 5 4446 1 1 58 LEU CD1 C -10.616 -20.944 3.790 1.00 . A A . 58 LEU CD1 1 1 5 4447 1 1 58 LEU CD2 C -12.693 -19.636 3.329 1.00 . A A . 58 LEU CD2 1 1 5 4448 1 1 58 LEU CG C -11.268 -19.915 2.884 1.00 . A A . 58 LEU CG 1 1 5 4449 1 1 58 LEU H H -8.430 -16.923 1.590 1.00 . A A . 58 LEU H 1 1 5 4450 1 1 58 LEU HA H -10.596 -18.695 0.734 1.00 . A A . 58 LEU HA 1 1 5 4451 1 1 58 LEU HB2 H -9.482 -18.830 3.299 1.00 . A A . 58 LEU HB2 1 1 5 4452 1 1 58 LEU HB3 H -10.956 -17.901 3.496 1.00 . A A . 58 LEU HB3 1 1 5 4453 1 1 58 LEU HD11 H -11.182 -21.863 3.758 1.00 . A A . 58 LEU HD11 1 1 5 4454 1 1 58 LEU HD12 H -9.605 -21.131 3.456 1.00 . A A . 58 LEU HD12 1 1 5 4455 1 1 58 LEU HD13 H -10.593 -20.569 4.802 1.00 . A A . 58 LEU HD13 1 1 5 4456 1 1 58 LEU HD21 H -12.918 -18.590 3.182 1.00 . A A . 58 LEU HD21 1 1 5 4457 1 1 58 LEU HD22 H -13.376 -20.235 2.746 1.00 . A A . 58 LEU HD22 1 1 5 4458 1 1 58 LEU HD23 H -12.797 -19.883 4.376 1.00 . A A . 58 LEU HD23 1 1 5 4459 1 1 58 LEU HG H -11.300 -20.324 1.885 1.00 . A A . 58 LEU HG 1 1 5 4460 1 1 58 LEU N N -8.833 -17.752 1.242 1.00 . A A . 58 LEU N 1 1 5 4461 1 1 58 LEU O O -12.171 -16.605 1.825 1.00 . A A . 58 LEU O 1 1 5 4462 1 1 59 LYS C C -11.271 -13.729 1.932 1.00 . A A . 59 LYS C 1 1 5 4463 1 1 59 LYS CA C -10.961 -14.378 0.587 1.00 . A A . 59 LYS CA 1 1 5 4464 1 1 59 LYS CB C -12.221 -14.445 -0.279 1.00 . A A . 59 LYS CB 1 1 5 4465 1 1 59 LYS CD C -13.669 -12.876 -1.602 1.00 . A A . 59 LYS CD 1 1 5 4466 1 1 59 LYS CE C -13.851 -11.488 -1.013 1.00 . A A . 59 LYS CE 1 1 5 4467 1 1 59 LYS CG C -12.261 -13.399 -1.379 1.00 . A A . 59 LYS CG 1 1 5 4468 1 1 59 LYS H H -9.473 -15.871 0.445 1.00 . A A . 59 LYS H 1 1 5 4469 1 1 59 LYS HA H -10.225 -13.771 0.078 1.00 . A A . 59 LYS HA 1 1 5 4470 1 1 59 LYS HB2 H -12.279 -15.422 -0.736 1.00 . A A . 59 LYS HB2 1 1 5 4471 1 1 59 LYS HB3 H -13.085 -14.303 0.354 1.00 . A A . 59 LYS HB3 1 1 5 4472 1 1 59 LYS HD2 H -13.863 -12.831 -2.663 1.00 . A A . 59 LYS HD2 1 1 5 4473 1 1 59 LYS HD3 H -14.371 -13.550 -1.134 1.00 . A A . 59 LYS HD3 1 1 5 4474 1 1 59 LYS HE2 H -12.939 -11.202 -0.513 1.00 . A A . 59 LYS HE2 1 1 5 4475 1 1 59 LYS HE3 H -14.053 -10.794 -1.816 1.00 . A A . 59 LYS HE3 1 1 5 4476 1 1 59 LYS HG2 H -11.622 -12.574 -1.104 1.00 . A A . 59 LYS HG2 1 1 5 4477 1 1 59 LYS HG3 H -11.905 -13.844 -2.296 1.00 . A A . 59 LYS HG3 1 1 5 4478 1 1 59 LYS HZ1 H -14.622 -11.169 0.906 1.00 . A A . 59 LYS HZ1 1 1 5 4479 1 1 59 LYS HZ2 H -15.434 -12.374 0.034 1.00 . A A . 59 LYS HZ2 1 1 5 4480 1 1 59 LYS HZ3 H -15.686 -10.737 -0.343 1.00 . A A . 59 LYS HZ3 1 1 5 4481 1 1 59 LYS N N -10.381 -15.708 0.768 1.00 . A A . 59 LYS N 1 1 5 4482 1 1 59 LYS NZ N -14.974 -11.440 -0.038 1.00 . A A . 59 LYS NZ 1 1 5 4483 1 1 59 LYS O O -12.365 -13.204 2.150 1.00 . A A . 59 LYS O 1 1 5 4484 1 1 60 GLY C C -9.982 -14.021 5.245 1.00 . A A . 60 GLY C 1 1 5 4485 1 1 60 GLY CA C -10.459 -13.128 4.122 1.00 . A A . 60 GLY CA 1 1 5 4486 1 1 60 GLY H H -9.427 -14.150 2.585 1.00 . A A . 60 GLY H 1 1 5 4487 1 1 60 GLY HA2 H -9.899 -12.204 4.147 1.00 . A A . 60 GLY HA2 1 1 5 4488 1 1 60 GLY HA3 H -11.504 -12.908 4.273 1.00 . A A . 60 GLY HA3 1 1 5 4489 1 1 60 GLY N N -10.290 -13.740 2.822 1.00 . A A . 60 GLY N 1 1 5 4490 1 1 60 GLY O O -9.327 -13.566 6.183 1.00 . A A . 60 GLY O 1 1 5 4491 1 1 61 LYS C C -8.486 -16.751 5.899 1.00 . A A . 61 LYS C 1 1 5 4492 1 1 61 LYS CA C -9.910 -16.267 6.154 1.00 . A A . 61 LYS CA 1 1 5 4493 1 1 61 LYS CB C -10.875 -17.452 6.163 1.00 . A A . 61 LYS CB 1 1 5 4494 1 1 61 LYS CD C -12.412 -18.704 7.705 1.00 . A A . 61 LYS CD 1 1 5 4495 1 1 61 LYS CE C -11.428 -19.281 8.710 1.00 . A A . 61 LYS CE 1 1 5 4496 1 1 61 LYS CG C -11.967 -17.337 7.213 1.00 . A A . 61 LYS CG 1 1 5 4497 1 1 61 LYS H H -10.826 -15.600 4.372 1.00 . A A . 61 LYS H 1 1 5 4498 1 1 61 LYS HA H -9.945 -15.776 7.117 1.00 . A A . 61 LYS HA 1 1 5 4499 1 1 61 LYS HB2 H -11.345 -17.529 5.194 1.00 . A A . 61 LYS HB2 1 1 5 4500 1 1 61 LYS HB3 H -10.316 -18.356 6.356 1.00 . A A . 61 LYS HB3 1 1 5 4501 1 1 61 LYS HD2 H -13.378 -18.608 8.178 1.00 . A A . 61 LYS HD2 1 1 5 4502 1 1 61 LYS HD3 H -12.486 -19.373 6.862 1.00 . A A . 61 LYS HD3 1 1 5 4503 1 1 61 LYS HE2 H -10.594 -18.604 8.807 1.00 . A A . 61 LYS HE2 1 1 5 4504 1 1 61 LYS HE3 H -11.923 -19.380 9.666 1.00 . A A . 61 LYS HE3 1 1 5 4505 1 1 61 LYS HG2 H -11.589 -16.771 8.050 1.00 . A A . 61 LYS HG2 1 1 5 4506 1 1 61 LYS HG3 H -12.815 -16.824 6.781 1.00 . A A . 61 LYS HG3 1 1 5 4507 1 1 61 LYS HZ1 H -10.800 -21.232 9.118 1.00 . A A . 61 LYS HZ1 1 1 5 4508 1 1 61 LYS HZ2 H -9.998 -20.514 7.812 1.00 . A A . 61 LYS HZ2 1 1 5 4509 1 1 61 LYS HZ3 H -11.592 -21.064 7.629 1.00 . A A . 61 LYS HZ3 1 1 5 4510 1 1 61 LYS N N -10.309 -15.299 5.146 1.00 . A A . 61 LYS N 1 1 5 4511 1 1 61 LYS NZ N -10.920 -20.613 8.289 1.00 . A A . 61 LYS NZ 1 1 5 4512 1 1 61 LYS O O -7.915 -16.398 4.845 1.00 . A A . 61 LYS O 1 1 5 4513 1 1 61 LYS OXT O -7.935 -17.469 6.759 1.00 . A A . 61 LYS OXT 1 1 5 4514 2 2 1 ZN ZN ZN -5.143 -4.319 -1.699 1.00 . B A . 62 ZN ZN 1 1 5 4515 3 2 1 ZN ZN ZN 4.013 3.965 3.681 1.00 . C A . 63 ZN ZN 1 1 6 4516 1 1 1 GLY C C -16.516 4.331 1.722 1.00 . A A . 1 GLY C 1 1 6 4517 1 1 1 GLY CA C -15.669 3.551 2.707 1.00 . A A . 1 GLY CA 1 1 6 4518 1 1 1 GLY H1 H -13.739 4.349 2.732 1.00 . A A . 1 GLY H1 1 1 6 4519 1 1 1 GLY H2 H -14.149 3.579 1.277 1.00 . A A . 1 GLY H2 1 1 6 4520 1 1 1 GLY H3 H -13.786 2.657 2.651 1.00 . A A . 1 GLY H3 1 1 6 4521 1 1 1 GLY HA2 H -16.033 2.534 2.754 1.00 . A A . 1 GLY HA2 1 1 6 4522 1 1 1 GLY HA3 H -15.761 4.002 3.685 1.00 . A A . 1 GLY HA3 1 1 6 4523 1 1 1 GLY N N -14.237 3.534 2.316 1.00 . A A . 1 GLY N 1 1 6 4524 1 1 1 GLY O O -16.153 4.449 0.551 1.00 . A A . 1 GLY O 1 1 6 4525 1 1 2 PRO C C -17.944 6.979 0.866 1.00 . A A . 2 PRO C 1 1 6 4526 1 1 2 PRO CA C -18.561 5.650 1.300 1.00 . A A . 2 PRO CA 1 1 6 4527 1 1 2 PRO CB C -19.794 5.890 2.176 1.00 . A A . 2 PRO CB 1 1 6 4528 1 1 2 PRO CD C -18.193 4.741 3.534 1.00 . A A . 2 PRO CD 1 1 6 4529 1 1 2 PRO CG C -19.311 5.743 3.578 1.00 . A A . 2 PRO CG 1 1 6 4530 1 1 2 PRO HA H -18.845 5.088 0.422 1.00 . A A . 2 PRO HA 1 1 6 4531 1 1 2 PRO HB2 H -20.179 6.882 1.992 1.00 . A A . 2 PRO HB2 1 1 6 4532 1 1 2 PRO HB3 H -20.552 5.157 1.943 1.00 . A A . 2 PRO HB3 1 1 6 4533 1 1 2 PRO HD2 H -17.437 4.987 4.265 1.00 . A A . 2 PRO HD2 1 1 6 4534 1 1 2 PRO HD3 H -18.572 3.743 3.706 1.00 . A A . 2 PRO HD3 1 1 6 4535 1 1 2 PRO HG2 H -18.948 6.693 3.944 1.00 . A A . 2 PRO HG2 1 1 6 4536 1 1 2 PRO HG3 H -20.111 5.382 4.206 1.00 . A A . 2 PRO HG3 1 1 6 4537 1 1 2 PRO N N -17.664 4.873 2.164 1.00 . A A . 2 PRO N 1 1 6 4538 1 1 2 PRO O O -18.319 7.550 -0.159 1.00 . A A . 2 PRO O 1 1 6 4539 1 1 3 LEU C C -14.807 8.287 0.826 1.00 . A A . 3 LEU C 1 1 6 4540 1 1 3 LEU CA C -16.221 8.638 1.264 1.00 . A A . 3 LEU CA 1 1 6 4541 1 1 3 LEU CB C -16.172 9.595 2.457 1.00 . A A . 3 LEU CB 1 1 6 4542 1 1 3 LEU CD1 C -17.354 10.795 4.305 1.00 . A A . 3 LEU CD1 1 1 6 4543 1 1 3 LEU CD2 C -18.239 10.922 1.972 1.00 . A A . 3 LEU CD2 1 1 6 4544 1 1 3 LEU CG C -17.530 10.048 2.993 1.00 . A A . 3 LEU CG 1 1 6 4545 1 1 3 LEU H H -16.643 6.894 2.377 1.00 . A A . 3 LEU H 1 1 6 4546 1 1 3 LEU HA H -16.737 9.116 0.444 1.00 . A A . 3 LEU HA 1 1 6 4547 1 1 3 LEU HB2 H -15.638 9.107 3.258 1.00 . A A . 3 LEU HB2 1 1 6 4548 1 1 3 LEU HB3 H -15.619 10.472 2.160 1.00 . A A . 3 LEU HB3 1 1 6 4549 1 1 3 LEU HD11 H -18.004 11.657 4.318 1.00 . A A . 3 LEU HD11 1 1 6 4550 1 1 3 LEU HD12 H -17.606 10.142 5.129 1.00 . A A . 3 LEU HD12 1 1 6 4551 1 1 3 LEU HD13 H -16.327 11.116 4.399 1.00 . A A . 3 LEU HD13 1 1 6 4552 1 1 3 LEU HD21 H -18.253 11.943 2.321 1.00 . A A . 3 LEU HD21 1 1 6 4553 1 1 3 LEU HD22 H -17.716 10.873 1.029 1.00 . A A . 3 LEU HD22 1 1 6 4554 1 1 3 LEU HD23 H -19.252 10.572 1.840 1.00 . A A . 3 LEU HD23 1 1 6 4555 1 1 3 LEU HG H -18.146 9.180 3.181 1.00 . A A . 3 LEU HG 1 1 6 4556 1 1 3 LEU N N -16.946 7.428 1.611 1.00 . A A . 3 LEU N 1 1 6 4557 1 1 3 LEU O O -14.449 7.110 0.743 1.00 . A A . 3 LEU O 1 1 6 4558 1 1 4 GLY C C -11.733 8.830 1.472 1.00 . A A . 4 GLY C 1 1 6 4559 1 1 4 GLY CA C -12.601 9.087 0.261 1.00 . A A . 4 GLY CA 1 1 6 4560 1 1 4 GLY H H -14.314 10.225 0.758 1.00 . A A . 4 GLY H 1 1 6 4561 1 1 4 GLY HA2 H -12.543 8.235 -0.400 1.00 . A A . 4 GLY HA2 1 1 6 4562 1 1 4 GLY HA3 H -12.230 9.959 -0.257 1.00 . A A . 4 GLY HA3 1 1 6 4563 1 1 4 GLY N N -13.986 9.306 0.622 1.00 . A A . 4 GLY N 1 1 6 4564 1 1 4 GLY O O -10.714 9.494 1.668 1.00 . A A . 4 GLY O 1 1 6 4565 1 1 5 SER C C -11.329 5.996 3.629 1.00 . A A . 5 SER C 1 1 6 4566 1 1 5 SER CA C -11.407 7.513 3.487 1.00 . A A . 5 SER CA 1 1 6 4567 1 1 5 SER CB C -12.072 8.131 4.719 1.00 . A A . 5 SER CB 1 1 6 4568 1 1 5 SER H H -12.962 7.376 2.062 1.00 . A A . 5 SER H 1 1 6 4569 1 1 5 SER HA H -10.407 7.906 3.391 1.00 . A A . 5 SER HA 1 1 6 4570 1 1 5 SER HB2 H -12.213 7.367 5.471 1.00 . A A . 5 SER HB2 1 1 6 4571 1 1 5 SER HB3 H -11.440 8.912 5.113 1.00 . A A . 5 SER HB3 1 1 6 4572 1 1 5 SER HG H -13.909 7.993 4.033 1.00 . A A . 5 SER HG 1 1 6 4573 1 1 5 SER N N -12.144 7.869 2.285 1.00 . A A . 5 SER N 1 1 6 4574 1 1 5 SER O O -12.310 5.289 3.362 1.00 . A A . 5 SER O 1 1 6 4575 1 1 5 SER OG O -13.338 8.689 4.392 1.00 . A A . 5 SER OG 1 1 6 4576 1 1 6 ASP C C -10.159 3.334 2.795 1.00 . A A . 6 ASP C 1 1 6 4577 1 1 6 ASP CA C -9.878 4.070 4.103 1.00 . A A . 6 ASP CA 1 1 6 4578 1 1 6 ASP CB C -10.708 3.457 5.239 1.00 . A A . 6 ASP CB 1 1 6 4579 1 1 6 ASP CG C -9.958 2.365 5.977 1.00 . A A . 6 ASP CG 1 1 6 4580 1 1 6 ASP H H -9.395 6.138 4.107 1.00 . A A . 6 ASP H 1 1 6 4581 1 1 6 ASP HA H -8.831 3.953 4.341 1.00 . A A . 6 ASP HA 1 1 6 4582 1 1 6 ASP HB2 H -10.966 4.231 5.947 1.00 . A A . 6 ASP HB2 1 1 6 4583 1 1 6 ASP HB3 H -11.614 3.033 4.829 1.00 . A A . 6 ASP HB3 1 1 6 4584 1 1 6 ASP N N -10.140 5.507 3.972 1.00 . A A . 6 ASP N 1 1 6 4585 1 1 6 ASP O O -10.587 2.180 2.793 1.00 . A A . 6 ASP O 1 1 6 4586 1 1 6 ASP OD1 O -9.826 1.247 5.434 1.00 . A A . 6 ASP OD1 1 1 6 4587 1 1 6 ASP OD2 O -9.485 2.621 7.103 1.00 . A A . 6 ASP OD2 1 1 6 4588 1 1 7 HIS C C -8.904 3.715 -0.515 1.00 . A A . 7 HIS C 1 1 6 4589 1 1 7 HIS CA C -10.104 3.414 0.374 1.00 . A A . 7 HIS CA 1 1 6 4590 1 1 7 HIS CB C -11.393 3.948 -0.258 1.00 . A A . 7 HIS CB 1 1 6 4591 1 1 7 HIS CD2 C -12.043 1.971 -1.780 1.00 . A A . 7 HIS CD2 1 1 6 4592 1 1 7 HIS CE1 C -14.055 1.673 -1.005 1.00 . A A . 7 HIS CE1 1 1 6 4593 1 1 7 HIS CG C -12.283 2.875 -0.801 1.00 . A A . 7 HIS CG 1 1 6 4594 1 1 7 HIS H H -9.550 4.926 1.747 1.00 . A A . 7 HIS H 1 1 6 4595 1 1 7 HIS HA H -10.190 2.344 0.500 1.00 . A A . 7 HIS HA 1 1 6 4596 1 1 7 HIS HB2 H -11.952 4.493 0.488 1.00 . A A . 7 HIS HB2 1 1 6 4597 1 1 7 HIS HB3 H -11.138 4.615 -1.069 1.00 . A A . 7 HIS HB3 1 1 6 4598 1 1 7 HIS HD2 H -11.134 1.865 -2.355 1.00 . A A . 7 HIS HD2 1 1 6 4599 1 1 7 HIS HE1 H -15.047 1.271 -0.860 1.00 . A A . 7 HIS HE1 1 1 6 4600 1 1 7 HIS HE2 H -13.248 0.355 -2.391 1.00 . A A . 7 HIS HE2 1 1 6 4601 1 1 7 HIS N N -9.903 4.006 1.685 1.00 . A A . 7 HIS N 1 1 6 4602 1 1 7 HIS ND1 N -13.554 2.684 -0.315 1.00 . A A . 7 HIS ND1 1 1 6 4603 1 1 7 HIS NE2 N -13.176 1.210 -1.902 1.00 . A A . 7 HIS NE2 1 1 6 4604 1 1 7 HIS O O -7.864 3.068 -0.393 1.00 . A A . 7 HIS O 1 1 6 4605 1 1 8 HIS C C -7.459 6.641 -1.591 1.00 . A A . 8 HIS C 1 1 6 4606 1 1 8 HIS CA C -7.879 5.263 -2.084 1.00 . A A . 8 HIS CA 1 1 6 4607 1 1 8 HIS CB C -8.245 5.325 -3.571 1.00 . A A . 8 HIS CB 1 1 6 4608 1 1 8 HIS CD2 C -6.096 4.789 -4.899 1.00 . A A . 8 HIS CD2 1 1 6 4609 1 1 8 HIS CE1 C -5.732 6.792 -5.676 1.00 . A A . 8 HIS CE1 1 1 6 4610 1 1 8 HIS CG C -7.075 5.619 -4.464 1.00 . A A . 8 HIS CG 1 1 6 4611 1 1 8 HIS H H -9.816 5.329 -1.250 1.00 . A A . 8 HIS H 1 1 6 4612 1 1 8 HIS HA H -7.058 4.575 -1.948 1.00 . A A . 8 HIS HA 1 1 6 4613 1 1 8 HIS HB2 H -8.661 4.375 -3.872 1.00 . A A . 8 HIS HB2 1 1 6 4614 1 1 8 HIS HB3 H -8.983 6.098 -3.720 1.00 . A A . 8 HIS HB3 1 1 6 4615 1 1 8 HIS HD2 H -5.998 3.736 -4.684 1.00 . A A . 8 HIS HD2 1 1 6 4616 1 1 8 HIS HE1 H -5.279 7.620 -6.204 1.00 . A A . 8 HIS HE1 1 1 6 4617 1 1 8 HIS HE2 H -4.351 5.271 -5.981 1.00 . A A . 8 HIS HE2 1 1 6 4618 1 1 8 HIS N N -9.002 4.786 -1.291 1.00 . A A . 8 HIS N 1 1 6 4619 1 1 8 HIS ND1 N -6.844 6.882 -4.959 1.00 . A A . 8 HIS ND1 1 1 6 4620 1 1 8 HIS NE2 N -5.247 5.545 -5.667 1.00 . A A . 8 HIS NE2 1 1 6 4621 1 1 8 HIS O O -8.300 7.441 -1.175 1.00 . A A . 8 HIS O 1 1 6 4622 1 1 9 MET C C -4.253 8.401 -1.765 1.00 . A A . 9 MET C 1 1 6 4623 1 1 9 MET CA C -5.626 8.172 -1.150 1.00 . A A . 9 MET CA 1 1 6 4624 1 1 9 MET CB C -5.538 8.203 0.382 1.00 . A A . 9 MET CB 1 1 6 4625 1 1 9 MET CE C -5.620 4.439 1.366 1.00 . A A . 9 MET CE 1 1 6 4626 1 1 9 MET CG C -4.759 7.039 0.975 1.00 . A A . 9 MET CG 1 1 6 4627 1 1 9 MET H H -5.543 6.210 -1.934 1.00 . A A . 9 MET H 1 1 6 4628 1 1 9 MET HA H -6.293 8.953 -1.482 1.00 . A A . 9 MET HA 1 1 6 4629 1 1 9 MET HB2 H -5.054 9.120 0.684 1.00 . A A . 9 MET HB2 1 1 6 4630 1 1 9 MET HB3 H -6.540 8.182 0.789 1.00 . A A . 9 MET HB3 1 1 6 4631 1 1 9 MET HE1 H -4.602 4.258 1.057 1.00 . A A . 9 MET HE1 1 1 6 4632 1 1 9 MET HE2 H -5.921 3.683 2.077 1.00 . A A . 9 MET HE2 1 1 6 4633 1 1 9 MET HE3 H -6.269 4.402 0.505 1.00 . A A . 9 MET HE3 1 1 6 4634 1 1 9 MET HG2 H -4.429 6.400 0.170 1.00 . A A . 9 MET HG2 1 1 6 4635 1 1 9 MET HG3 H -3.897 7.433 1.497 1.00 . A A . 9 MET HG3 1 1 6 4636 1 1 9 MET N N -6.164 6.899 -1.606 1.00 . A A . 9 MET N 1 1 6 4637 1 1 9 MET O O -3.669 7.486 -2.345 1.00 . A A . 9 MET O 1 1 6 4638 1 1 9 MET SD S -5.734 6.057 2.128 1.00 . A A . 9 MET SD 1 1 6 4639 1 1 10 GLU C C -1.341 9.826 -1.218 1.00 . A A . 10 GLU C 1 1 6 4640 1 1 10 GLU CA C -2.458 9.963 -2.250 1.00 . A A . 10 GLU CA 1 1 6 4641 1 1 10 GLU CB C -2.497 11.385 -2.810 1.00 . A A . 10 GLU CB 1 1 6 4642 1 1 10 GLU CD C -2.312 10.991 -5.290 1.00 . A A . 10 GLU CD 1 1 6 4643 1 1 10 GLU CG C -3.187 11.486 -4.161 1.00 . A A . 10 GLU CG 1 1 6 4644 1 1 10 GLU H H -4.269 10.324 -1.214 1.00 . A A . 10 GLU H 1 1 6 4645 1 1 10 GLU HA H -2.269 9.272 -3.059 1.00 . A A . 10 GLU HA 1 1 6 4646 1 1 10 GLU HB2 H -3.022 12.021 -2.113 1.00 . A A . 10 GLU HB2 1 1 6 4647 1 1 10 GLU HB3 H -1.484 11.745 -2.920 1.00 . A A . 10 GLU HB3 1 1 6 4648 1 1 10 GLU HG2 H -4.088 10.892 -4.138 1.00 . A A . 10 GLU HG2 1 1 6 4649 1 1 10 GLU HG3 H -3.439 12.519 -4.345 1.00 . A A . 10 GLU HG3 1 1 6 4650 1 1 10 GLU N N -3.748 9.621 -1.666 1.00 . A A . 10 GLU N 1 1 6 4651 1 1 10 GLU O O -0.350 10.558 -1.251 1.00 . A A . 10 GLU O 1 1 6 4652 1 1 10 GLU OE1 O -1.109 11.328 -5.303 1.00 . A A . 10 GLU OE1 1 1 6 4653 1 1 10 GLU OE2 O -2.818 10.271 -6.177 1.00 . A A . 10 GLU OE2 1 1 6 4654 1 1 11 PHE C C -0.710 7.163 1.224 1.00 . A A . 11 PHE C 1 1 6 4655 1 1 11 PHE CA C -0.494 8.567 0.687 1.00 . A A . 11 PHE CA 1 1 6 4656 1 1 11 PHE CB C -0.553 9.597 1.825 1.00 . A A . 11 PHE CB 1 1 6 4657 1 1 11 PHE CD1 C -2.929 10.371 2.125 1.00 . A A . 11 PHE CD1 1 1 6 4658 1 1 11 PHE CD2 C -1.993 8.920 3.768 1.00 . A A . 11 PHE CD2 1 1 6 4659 1 1 11 PHE CE1 C -4.118 10.408 2.831 1.00 . A A . 11 PHE CE1 1 1 6 4660 1 1 11 PHE CE2 C -3.179 8.952 4.477 1.00 . A A . 11 PHE CE2 1 1 6 4661 1 1 11 PHE CG C -1.853 9.626 2.584 1.00 . A A . 11 PHE CG 1 1 6 4662 1 1 11 PHE CZ C -4.242 9.697 4.009 1.00 . A A . 11 PHE CZ 1 1 6 4663 1 1 11 PHE H H -2.285 8.283 -0.386 1.00 . A A . 11 PHE H 1 1 6 4664 1 1 11 PHE HA H 0.481 8.610 0.223 1.00 . A A . 11 PHE HA 1 1 6 4665 1 1 11 PHE HB2 H 0.234 9.378 2.532 1.00 . A A . 11 PHE HB2 1 1 6 4666 1 1 11 PHE HB3 H -0.388 10.583 1.414 1.00 . A A . 11 PHE HB3 1 1 6 4667 1 1 11 PHE HD1 H -2.833 10.927 1.202 1.00 . A A . 11 PHE HD1 1 1 6 4668 1 1 11 PHE HD2 H -1.161 8.336 4.138 1.00 . A A . 11 PHE HD2 1 1 6 4669 1 1 11 PHE HE1 H -4.947 10.993 2.462 1.00 . A A . 11 PHE HE1 1 1 6 4670 1 1 11 PHE HE2 H -3.273 8.396 5.399 1.00 . A A . 11 PHE HE2 1 1 6 4671 1 1 11 PHE HZ H -5.169 9.725 4.563 1.00 . A A . 11 PHE HZ 1 1 6 4672 1 1 11 PHE N N -1.491 8.855 -0.331 1.00 . A A . 11 PHE N 1 1 6 4673 1 1 11 PHE O O -1.785 6.595 1.058 1.00 . A A . 11 PHE O 1 1 6 4674 1 1 12 CYS C C -0.503 5.350 3.770 1.00 . A A . 12 CYS C 1 1 6 4675 1 1 12 CYS CA C 0.185 5.270 2.411 1.00 . A A . 12 CYS CA 1 1 6 4676 1 1 12 CYS CB C 1.562 4.598 2.504 1.00 . A A . 12 CYS CB 1 1 6 4677 1 1 12 CYS H H 1.140 7.110 1.972 1.00 . A A . 12 CYS H 1 1 6 4678 1 1 12 CYS HA H -0.442 4.695 1.744 1.00 . A A . 12 CYS HA 1 1 6 4679 1 1 12 CYS HB2 H 1.530 3.662 1.969 1.00 . A A . 12 CYS HB2 1 1 6 4680 1 1 12 CYS HB3 H 2.297 5.242 2.043 1.00 . A A . 12 CYS HB3 1 1 6 4681 1 1 12 CYS HG H 3.086 5.124 4.461 1.00 . A A . 12 CYS HG 1 1 6 4682 1 1 12 CYS N N 0.305 6.602 1.853 1.00 . A A . 12 CYS N 1 1 6 4683 1 1 12 CYS O O -0.165 6.203 4.591 1.00 . A A . 12 CYS O 1 1 6 4684 1 1 12 CYS SG S 2.120 4.243 4.180 1.00 . A A . 12 CYS SG 1 1 6 4685 1 1 13 ARG C C -1.695 4.411 6.419 1.00 . A A . 13 ARG C 1 1 6 4686 1 1 13 ARG CA C -2.440 4.668 5.103 1.00 . A A . 13 ARG CA 1 1 6 4687 1 1 13 ARG CB C -3.612 3.687 4.970 1.00 . A A . 13 ARG CB 1 1 6 4688 1 1 13 ARG CD C -4.435 1.419 4.252 1.00 . A A . 13 ARG CD 1 1 6 4689 1 1 13 ARG CG C -3.239 2.357 4.327 1.00 . A A . 13 ARG CG 1 1 6 4690 1 1 13 ARG CZ C -6.210 0.952 5.905 1.00 . A A . 13 ARG CZ 1 1 6 4691 1 1 13 ARG H H -1.855 4.014 3.174 1.00 . A A . 13 ARG H 1 1 6 4692 1 1 13 ARG HA H -2.838 5.672 5.132 1.00 . A A . 13 ARG HA 1 1 6 4693 1 1 13 ARG HB2 H -4.009 3.484 5.953 1.00 . A A . 13 ARG HB2 1 1 6 4694 1 1 13 ARG HB3 H -4.382 4.148 4.370 1.00 . A A . 13 ARG HB3 1 1 6 4695 1 1 13 ARG HD2 H -5.231 1.913 3.715 1.00 . A A . 13 ARG HD2 1 1 6 4696 1 1 13 ARG HD3 H -4.143 0.525 3.721 1.00 . A A . 13 ARG HD3 1 1 6 4697 1 1 13 ARG HE H -4.236 0.881 6.278 1.00 . A A . 13 ARG HE 1 1 6 4698 1 1 13 ARG HG2 H -2.877 2.541 3.326 1.00 . A A . 13 ARG HG2 1 1 6 4699 1 1 13 ARG HG3 H -2.462 1.890 4.914 1.00 . A A . 13 ARG HG3 1 1 6 4700 1 1 13 ARG HH11 H -6.900 1.255 4.015 1.00 . A A . 13 ARG HH11 1 1 6 4701 1 1 13 ARG HH12 H -8.130 1.026 5.229 1.00 . A A . 13 ARG HH12 1 1 6 4702 1 1 13 ARG HH21 H -5.846 0.545 7.860 1.00 . A A . 13 ARG HH21 1 1 6 4703 1 1 13 ARG HH22 H -7.526 0.618 7.415 1.00 . A A . 13 ARG HH22 1 1 6 4704 1 1 13 ARG N N -1.569 4.574 3.927 1.00 . A A . 13 ARG N 1 1 6 4705 1 1 13 ARG NE N -4.920 1.046 5.578 1.00 . A A . 13 ARG NE 1 1 6 4706 1 1 13 ARG NH1 N -7.151 1.085 4.975 1.00 . A A . 13 ARG NH1 1 1 6 4707 1 1 13 ARG NH2 N -6.553 0.680 7.158 1.00 . A A . 13 ARG NH2 1 1 6 4708 1 1 13 ARG O O -2.184 4.752 7.497 1.00 . A A . 13 ARG O 1 1 6 4709 1 1 14 VAL C C 0.997 4.635 8.080 1.00 . A A . 14 VAL C 1 1 6 4710 1 1 14 VAL CA C 0.235 3.430 7.520 1.00 . A A . 14 VAL CA 1 1 6 4711 1 1 14 VAL CB C 1.220 2.277 7.225 1.00 . A A . 14 VAL CB 1 1 6 4712 1 1 14 VAL CG1 C 2.112 1.994 8.427 1.00 . A A . 14 VAL CG1 1 1 6 4713 1 1 14 VAL CG2 C 0.457 1.027 6.821 1.00 . A A . 14 VAL CG2 1 1 6 4714 1 1 14 VAL H H -0.208 3.501 5.453 1.00 . A A . 14 VAL H 1 1 6 4715 1 1 14 VAL HA H -0.463 3.088 8.271 1.00 . A A . 14 VAL HA 1 1 6 4716 1 1 14 VAL HB H 1.849 2.571 6.398 1.00 . A A . 14 VAL HB 1 1 6 4717 1 1 14 VAL HG11 H 1.716 1.154 8.977 1.00 . A A . 14 VAL HG11 1 1 6 4718 1 1 14 VAL HG12 H 3.111 1.762 8.086 1.00 . A A . 14 VAL HG12 1 1 6 4719 1 1 14 VAL HG13 H 2.141 2.864 9.066 1.00 . A A . 14 VAL HG13 1 1 6 4720 1 1 14 VAL HG21 H 0.535 0.288 7.605 1.00 . A A . 14 VAL HG21 1 1 6 4721 1 1 14 VAL HG22 H -0.582 1.274 6.660 1.00 . A A . 14 VAL HG22 1 1 6 4722 1 1 14 VAL HG23 H 0.878 0.629 5.908 1.00 . A A . 14 VAL HG23 1 1 6 4723 1 1 14 VAL N N -0.533 3.779 6.331 1.00 . A A . 14 VAL N 1 1 6 4724 1 1 14 VAL O O 0.735 5.072 9.198 1.00 . A A . 14 VAL O 1 1 6 4725 1 1 15 CYS C C 2.314 7.563 7.435 1.00 . A A . 15 CYS C 1 1 6 4726 1 1 15 CYS CA C 2.851 6.188 7.832 1.00 . A A . 15 CYS CA 1 1 6 4727 1 1 15 CYS CB C 4.283 5.996 7.316 1.00 . A A . 15 CYS CB 1 1 6 4728 1 1 15 CYS H H 2.203 4.685 6.493 1.00 . A A . 15 CYS H 1 1 6 4729 1 1 15 CYS HA H 2.861 6.126 8.910 1.00 . A A . 15 CYS HA 1 1 6 4730 1 1 15 CYS HB2 H 4.960 6.560 7.944 1.00 . A A . 15 CYS HB2 1 1 6 4731 1 1 15 CYS HB3 H 4.539 4.949 7.376 1.00 . A A . 15 CYS HB3 1 1 6 4732 1 1 15 CYS N N 1.993 5.114 7.340 1.00 . A A . 15 CYS N 1 1 6 4733 1 1 15 CYS O O 2.882 8.590 7.814 1.00 . A A . 15 CYS O 1 1 6 4734 1 1 15 CYS SG S 4.555 6.532 5.597 1.00 . A A . 15 CYS SG 1 1 6 4735 1 1 16 LYS C C 1.418 9.570 5.197 1.00 . A A . 16 LYS C 1 1 6 4736 1 1 16 LYS CA C 0.567 8.794 6.203 1.00 . A A . 16 LYS CA 1 1 6 4737 1 1 16 LYS CB C 0.199 9.690 7.389 1.00 . A A . 16 LYS CB 1 1 6 4738 1 1 16 LYS CD C -2.249 9.868 7.909 1.00 . A A . 16 LYS CD 1 1 6 4739 1 1 16 LYS CE C -3.245 9.731 9.048 1.00 . A A . 16 LYS CE 1 1 6 4740 1 1 16 LYS CG C -0.950 9.146 8.218 1.00 . A A . 16 LYS CG 1 1 6 4741 1 1 16 LYS H H 0.840 6.703 6.396 1.00 . A A . 16 LYS H 1 1 6 4742 1 1 16 LYS HA H -0.345 8.498 5.707 1.00 . A A . 16 LYS HA 1 1 6 4743 1 1 16 LYS HB2 H 1.063 9.792 8.030 1.00 . A A . 16 LYS HB2 1 1 6 4744 1 1 16 LYS HB3 H -0.080 10.665 7.018 1.00 . A A . 16 LYS HB3 1 1 6 4745 1 1 16 LYS HD2 H -2.040 10.917 7.752 1.00 . A A . 16 LYS HD2 1 1 6 4746 1 1 16 LYS HD3 H -2.682 9.448 7.012 1.00 . A A . 16 LYS HD3 1 1 6 4747 1 1 16 LYS HE2 H -2.875 8.995 9.746 1.00 . A A . 16 LYS HE2 1 1 6 4748 1 1 16 LYS HE3 H -3.334 10.687 9.547 1.00 . A A . 16 LYS HE3 1 1 6 4749 1 1 16 LYS HG2 H -1.073 8.096 7.998 1.00 . A A . 16 LYS HG2 1 1 6 4750 1 1 16 LYS HG3 H -0.719 9.272 9.264 1.00 . A A . 16 LYS HG3 1 1 6 4751 1 1 16 LYS HZ1 H -5.226 9.159 9.377 1.00 . A A . 16 LYS HZ1 1 1 6 4752 1 1 16 LYS HZ2 H -4.513 8.418 8.028 1.00 . A A . 16 LYS HZ2 1 1 6 4753 1 1 16 LYS HZ3 H -4.995 10.043 7.948 1.00 . A A . 16 LYS HZ3 1 1 6 4754 1 1 16 LYS N N 1.228 7.564 6.658 1.00 . A A . 16 LYS N 1 1 6 4755 1 1 16 LYS NZ N -4.587 9.309 8.568 1.00 . A A . 16 LYS NZ 1 1 6 4756 1 1 16 LYS O O 1.008 10.630 4.717 1.00 . A A . 16 LYS O 1 1 6 4757 1 1 17 ASP C C 2.986 9.402 2.467 1.00 . A A . 17 ASP C 1 1 6 4758 1 1 17 ASP CA C 3.456 9.677 3.885 1.00 . A A . 17 ASP CA 1 1 6 4759 1 1 17 ASP CB C 4.889 9.183 4.055 1.00 . A A . 17 ASP CB 1 1 6 4760 1 1 17 ASP CG C 5.900 10.310 4.032 1.00 . A A . 17 ASP CG 1 1 6 4761 1 1 17 ASP H H 2.853 8.184 5.258 1.00 . A A . 17 ASP H 1 1 6 4762 1 1 17 ASP HA H 3.423 10.738 4.064 1.00 . A A . 17 ASP HA 1 1 6 4763 1 1 17 ASP HB2 H 4.972 8.669 5.002 1.00 . A A . 17 ASP HB2 1 1 6 4764 1 1 17 ASP HB3 H 5.120 8.489 3.258 1.00 . A A . 17 ASP HB3 1 1 6 4765 1 1 17 ASP N N 2.577 9.032 4.851 1.00 . A A . 17 ASP N 1 1 6 4766 1 1 17 ASP O O 2.503 8.303 2.168 1.00 . A A . 17 ASP O 1 1 6 4767 1 1 17 ASP OD1 O 6.200 10.830 2.937 1.00 . A A . 17 ASP OD1 1 1 6 4768 1 1 17 ASP OD2 O 6.405 10.681 5.115 1.00 . A A . 17 ASP OD2 1 1 6 4769 1 1 18 GLY C C 3.834 10.077 -0.727 1.00 . A A . 18 GLY C 1 1 6 4770 1 1 18 GLY CA C 2.675 10.254 0.231 1.00 . A A . 18 GLY CA 1 1 6 4771 1 1 18 GLY H H 3.500 11.254 1.905 1.00 . A A . 18 GLY H 1 1 6 4772 1 1 18 GLY HA2 H 2.030 9.388 0.162 1.00 . A A . 18 GLY HA2 1 1 6 4773 1 1 18 GLY HA3 H 2.116 11.134 -0.053 1.00 . A A . 18 GLY HA3 1 1 6 4774 1 1 18 GLY N N 3.109 10.400 1.604 1.00 . A A . 18 GLY N 1 1 6 4775 1 1 18 GLY O O 4.712 9.241 -0.503 1.00 . A A . 18 GLY O 1 1 6 4776 1 1 19 GLY C C 4.494 9.686 -3.861 1.00 . A A . 19 GLY C 1 1 6 4777 1 1 19 GLY CA C 4.850 10.719 -2.818 1.00 . A A . 19 GLY CA 1 1 6 4778 1 1 19 GLY H H 3.070 11.456 -1.952 1.00 . A A . 19 GLY H 1 1 6 4779 1 1 19 GLY HA2 H 4.985 11.675 -3.301 1.00 . A A . 19 GLY HA2 1 1 6 4780 1 1 19 GLY HA3 H 5.775 10.430 -2.341 1.00 . A A . 19 GLY HA3 1 1 6 4781 1 1 19 GLY N N 3.817 10.837 -1.813 1.00 . A A . 19 GLY N 1 1 6 4782 1 1 19 GLY O O 3.322 9.540 -4.212 1.00 . A A . 19 GLY O 1 1 6 4783 1 1 20 GLU C C 5.188 6.521 -4.521 1.00 . A A . 20 GLU C 1 1 6 4784 1 1 20 GLU CA C 5.246 7.854 -5.256 1.00 . A A . 20 GLU CA 1 1 6 4785 1 1 20 GLU CB C 6.340 7.836 -6.322 1.00 . A A . 20 GLU CB 1 1 6 4786 1 1 20 GLU CD C 5.453 9.937 -7.412 1.00 . A A . 20 GLU CD 1 1 6 4787 1 1 20 GLU CG C 5.934 8.516 -7.622 1.00 . A A . 20 GLU CG 1 1 6 4788 1 1 20 GLU H H 6.386 9.056 -3.945 1.00 . A A . 20 GLU H 1 1 6 4789 1 1 20 GLU HA H 4.292 8.034 -5.731 1.00 . A A . 20 GLU HA 1 1 6 4790 1 1 20 GLU HB2 H 7.215 8.338 -5.934 1.00 . A A . 20 GLU HB2 1 1 6 4791 1 1 20 GLU HB3 H 6.594 6.809 -6.542 1.00 . A A . 20 GLU HB3 1 1 6 4792 1 1 20 GLU HG2 H 6.787 8.536 -8.284 1.00 . A A . 20 GLU HG2 1 1 6 4793 1 1 20 GLU HG3 H 5.139 7.946 -8.078 1.00 . A A . 20 GLU HG3 1 1 6 4794 1 1 20 GLU N N 5.480 8.927 -4.307 1.00 . A A . 20 GLU N 1 1 6 4795 1 1 20 GLU O O 6.193 6.055 -3.976 1.00 . A A . 20 GLU O 1 1 6 4796 1 1 20 GLU OE1 O 6.255 10.782 -6.961 1.00 . A A . 20 GLU OE1 1 1 6 4797 1 1 20 GLU OE2 O 4.269 10.215 -7.691 1.00 . A A . 20 GLU OE2 1 1 6 4798 1 1 21 LEU C C 3.642 3.569 -4.371 1.00 . A A . 21 LEU C 1 1 6 4799 1 1 21 LEU CA C 3.739 4.838 -3.534 1.00 . A A . 21 LEU CA 1 1 6 4800 1 1 21 LEU CB C 2.451 5.021 -2.735 1.00 . A A . 21 LEU CB 1 1 6 4801 1 1 21 LEU CD1 C 0.801 6.903 -2.573 1.00 . A A . 21 LEU CD1 1 1 6 4802 1 1 21 LEU CD2 C 2.417 6.490 -0.719 1.00 . A A . 21 LEU CD2 1 1 6 4803 1 1 21 LEU CG C 2.203 6.437 -2.218 1.00 . A A . 21 LEU CG 1 1 6 4804 1 1 21 LEU H H 3.206 6.506 -4.710 1.00 . A A . 21 LEU H 1 1 6 4805 1 1 21 LEU HA H 4.567 4.739 -2.848 1.00 . A A . 21 LEU HA 1 1 6 4806 1 1 21 LEU HB2 H 1.620 4.740 -3.365 1.00 . A A . 21 LEU HB2 1 1 6 4807 1 1 21 LEU HB3 H 2.481 4.353 -1.888 1.00 . A A . 21 LEU HB3 1 1 6 4808 1 1 21 LEU HD11 H 0.195 6.049 -2.839 1.00 . A A . 21 LEU HD11 1 1 6 4809 1 1 21 LEU HD12 H 0.362 7.403 -1.722 1.00 . A A . 21 LEU HD12 1 1 6 4810 1 1 21 LEU HD13 H 0.849 7.587 -3.408 1.00 . A A . 21 LEU HD13 1 1 6 4811 1 1 21 LEU HD21 H 1.466 6.386 -0.218 1.00 . A A . 21 LEU HD21 1 1 6 4812 1 1 21 LEU HD22 H 3.071 5.685 -0.418 1.00 . A A . 21 LEU HD22 1 1 6 4813 1 1 21 LEU HD23 H 2.863 7.436 -0.452 1.00 . A A . 21 LEU HD23 1 1 6 4814 1 1 21 LEU HG H 2.907 7.112 -2.682 1.00 . A A . 21 LEU HG 1 1 6 4815 1 1 21 LEU N N 3.977 6.013 -4.358 1.00 . A A . 21 LEU N 1 1 6 4816 1 1 21 LEU O O 3.492 3.623 -5.592 1.00 . A A . 21 LEU O 1 1 6 4817 1 1 22 LEU C C 2.092 0.597 -3.943 1.00 . A A . 22 LEU C 1 1 6 4818 1 1 22 LEU CA C 3.471 1.138 -4.303 1.00 . A A . 22 LEU CA 1 1 6 4819 1 1 22 LEU CB C 4.578 0.191 -3.819 1.00 . A A . 22 LEU CB 1 1 6 4820 1 1 22 LEU CD1 C 4.951 -1.400 -5.724 1.00 . A A . 22 LEU CD1 1 1 6 4821 1 1 22 LEU CD2 C 5.267 -2.173 -3.373 1.00 . A A . 22 LEU CD2 1 1 6 4822 1 1 22 LEU CG C 4.467 -1.260 -4.289 1.00 . A A . 22 LEU CG 1 1 6 4823 1 1 22 LEU H H 3.678 2.485 -2.699 1.00 . A A . 22 LEU H 1 1 6 4824 1 1 22 LEU HA H 3.541 1.260 -5.373 1.00 . A A . 22 LEU HA 1 1 6 4825 1 1 22 LEU HB2 H 5.526 0.583 -4.156 1.00 . A A . 22 LEU HB2 1 1 6 4826 1 1 22 LEU HB3 H 4.573 0.195 -2.739 1.00 . A A . 22 LEU HB3 1 1 6 4827 1 1 22 LEU HD11 H 5.079 -0.420 -6.159 1.00 . A A . 22 LEU HD11 1 1 6 4828 1 1 22 LEU HD12 H 5.900 -1.926 -5.735 1.00 . A A . 22 LEU HD12 1 1 6 4829 1 1 22 LEU HD13 H 4.226 -1.956 -6.298 1.00 . A A . 22 LEU HD13 1 1 6 4830 1 1 22 LEU HD21 H 4.918 -3.189 -3.482 1.00 . A A . 22 LEU HD21 1 1 6 4831 1 1 22 LEU HD22 H 6.314 -2.122 -3.639 1.00 . A A . 22 LEU HD22 1 1 6 4832 1 1 22 LEU HD23 H 5.140 -1.856 -2.347 1.00 . A A . 22 LEU HD23 1 1 6 4833 1 1 22 LEU HG H 3.433 -1.569 -4.252 1.00 . A A . 22 LEU HG 1 1 6 4834 1 1 22 LEU N N 3.641 2.438 -3.681 1.00 . A A . 22 LEU N 1 1 6 4835 1 1 22 LEU O O 1.796 0.370 -2.769 1.00 . A A . 22 LEU O 1 1 6 4836 1 1 23 CYS C C -0.604 -1.075 -5.210 1.00 . A A . 23 CYS C 1 1 6 4837 1 1 23 CYS CA C -0.205 0.283 -4.642 1.00 . A A . 23 CYS CA 1 1 6 4838 1 1 23 CYS CB C -1.107 1.373 -5.226 1.00 . A A . 23 CYS CB 1 1 6 4839 1 1 23 CYS H H 1.446 0.929 -5.803 1.00 . A A . 23 CYS H 1 1 6 4840 1 1 23 CYS HA H -0.335 0.261 -3.571 1.00 . A A . 23 CYS HA 1 1 6 4841 1 1 23 CYS HB2 H -1.576 0.998 -6.122 1.00 . A A . 23 CYS HB2 1 1 6 4842 1 1 23 CYS HB3 H -1.868 1.623 -4.503 1.00 . A A . 23 CYS HB3 1 1 6 4843 1 1 23 CYS HG H 0.795 2.569 -6.438 1.00 . A A . 23 CYS HG 1 1 6 4844 1 1 23 CYS N N 1.191 0.599 -4.912 1.00 . A A . 23 CYS N 1 1 6 4845 1 1 23 CYS O O -0.013 -1.557 -6.178 1.00 . A A . 23 CYS O 1 1 6 4846 1 1 23 CYS SG S -0.233 2.898 -5.660 1.00 . A A . 23 CYS SG 1 1 6 4847 1 1 24 CYS C C -2.761 -2.885 -6.405 1.00 . A A . 24 CYS C 1 1 6 4848 1 1 24 CYS CA C -2.138 -2.963 -5.014 1.00 . A A . 24 CYS CA 1 1 6 4849 1 1 24 CYS CB C -3.182 -3.407 -3.994 1.00 . A A . 24 CYS CB 1 1 6 4850 1 1 24 CYS H H -2.022 -1.238 -3.812 1.00 . A A . 24 CYS H 1 1 6 4851 1 1 24 CYS HA H -1.325 -3.673 -5.026 1.00 . A A . 24 CYS HA 1 1 6 4852 1 1 24 CYS HB2 H -2.707 -3.474 -3.028 1.00 . A A . 24 CYS HB2 1 1 6 4853 1 1 24 CYS HB3 H -3.956 -2.656 -3.944 1.00 . A A . 24 CYS HB3 1 1 6 4854 1 1 24 CYS N N -1.615 -1.675 -4.594 1.00 . A A . 24 CYS N 1 1 6 4855 1 1 24 CYS O O -3.116 -1.805 -6.891 1.00 . A A . 24 CYS O 1 1 6 4856 1 1 24 CYS SG S -3.994 -5.011 -4.300 1.00 . A A . 24 CYS SG 1 1 6 4857 1 1 25 ASP C C -4.993 -4.636 -8.193 1.00 . A A . 25 ASP C 1 1 6 4858 1 1 25 ASP CA C -3.561 -4.135 -8.323 1.00 . A A . 25 ASP CA 1 1 6 4859 1 1 25 ASP CB C -2.771 -5.072 -9.233 1.00 . A A . 25 ASP CB 1 1 6 4860 1 1 25 ASP CG C -3.105 -4.875 -10.697 1.00 . A A . 25 ASP CG 1 1 6 4861 1 1 25 ASP H H -2.653 -4.865 -6.559 1.00 . A A . 25 ASP H 1 1 6 4862 1 1 25 ASP HA H -3.576 -3.147 -8.757 1.00 . A A . 25 ASP HA 1 1 6 4863 1 1 25 ASP HB2 H -1.716 -4.892 -9.094 1.00 . A A . 25 ASP HB2 1 1 6 4864 1 1 25 ASP HB3 H -2.993 -6.094 -8.966 1.00 . A A . 25 ASP HB3 1 1 6 4865 1 1 25 ASP N N -2.933 -4.042 -7.016 1.00 . A A . 25 ASP N 1 1 6 4866 1 1 25 ASP O O -5.770 -4.583 -9.146 1.00 . A A . 25 ASP O 1 1 6 4867 1 1 25 ASP OD1 O -2.702 -3.843 -11.273 1.00 . A A . 25 ASP OD1 1 1 6 4868 1 1 25 ASP OD2 O -3.769 -5.751 -11.284 1.00 . A A . 25 ASP OD2 1 1 6 4869 1 1 26 THR C C -7.503 -4.610 -5.921 1.00 . A A . 26 THR C 1 1 6 4870 1 1 26 THR CA C -6.700 -5.595 -6.768 1.00 . A A . 26 THR CA 1 1 6 4871 1 1 26 THR CB C -6.691 -6.993 -6.103 1.00 . A A . 26 THR CB 1 1 6 4872 1 1 26 THR CG2 C -6.178 -8.043 -7.073 1.00 . A A . 26 THR CG2 1 1 6 4873 1 1 26 THR H H -4.704 -5.081 -6.261 1.00 . A A . 26 THR H 1 1 6 4874 1 1 26 THR HA H -7.184 -5.688 -7.730 1.00 . A A . 26 THR HA 1 1 6 4875 1 1 26 THR HB H -7.704 -7.249 -5.825 1.00 . A A . 26 THR HB 1 1 6 4876 1 1 26 THR HG1 H -5.146 -6.364 -5.029 1.00 . A A . 26 THR HG1 1 1 6 4877 1 1 26 THR HG21 H -6.995 -8.397 -7.685 1.00 . A A . 26 THR HG21 1 1 6 4878 1 1 26 THR HG22 H -5.757 -8.870 -6.520 1.00 . A A . 26 THR HG22 1 1 6 4879 1 1 26 THR HG23 H -5.417 -7.607 -7.705 1.00 . A A . 26 THR HG23 1 1 6 4880 1 1 26 THR N N -5.352 -5.101 -7.005 1.00 . A A . 26 THR N 1 1 6 4881 1 1 26 THR O O -8.668 -4.328 -6.214 1.00 . A A . 26 THR O 1 1 6 4882 1 1 26 THR OG1 O -5.868 -7.003 -4.928 1.00 . A A . 26 THR OG1 1 1 6 4883 1 1 27 CYS C C -6.789 -1.659 -4.293 1.00 . A A . 27 CYS C 1 1 6 4884 1 1 27 CYS CA C -7.483 -3.005 -4.100 1.00 . A A . 27 CYS CA 1 1 6 4885 1 1 27 CYS CB C -7.441 -3.429 -2.631 1.00 . A A . 27 CYS CB 1 1 6 4886 1 1 27 CYS H H -5.899 -4.222 -4.792 1.00 . A A . 27 CYS H 1 1 6 4887 1 1 27 CYS HA H -8.512 -2.913 -4.412 1.00 . A A . 27 CYS HA 1 1 6 4888 1 1 27 CYS HB2 H -6.648 -2.893 -2.131 1.00 . A A . 27 CYS HB2 1 1 6 4889 1 1 27 CYS HB3 H -8.384 -3.182 -2.168 1.00 . A A . 27 CYS HB3 1 1 6 4890 1 1 27 CYS N N -6.851 -4.017 -4.931 1.00 . A A . 27 CYS N 1 1 6 4891 1 1 27 CYS O O -5.631 -1.609 -4.701 1.00 . A A . 27 CYS O 1 1 6 4892 1 1 27 CYS SG S -7.150 -5.213 -2.382 1.00 . A A . 27 CYS SG 1 1 6 4893 1 1 28 PRO C C -6.182 1.321 -3.145 1.00 . A A . 28 PRO C 1 1 6 4894 1 1 28 PRO CA C -6.979 0.793 -4.340 1.00 . A A . 28 PRO CA 1 1 6 4895 1 1 28 PRO CB C -8.237 1.654 -4.565 1.00 . A A . 28 PRO CB 1 1 6 4896 1 1 28 PRO CD C -8.935 -0.499 -3.760 1.00 . A A . 28 PRO CD 1 1 6 4897 1 1 28 PRO CG C -9.402 0.714 -4.509 1.00 . A A . 28 PRO CG 1 1 6 4898 1 1 28 PRO HA H -6.358 0.820 -5.223 1.00 . A A . 28 PRO HA 1 1 6 4899 1 1 28 PRO HB2 H -8.301 2.402 -3.789 1.00 . A A . 28 PRO HB2 1 1 6 4900 1 1 28 PRO HB3 H -8.174 2.139 -5.528 1.00 . A A . 28 PRO HB3 1 1 6 4901 1 1 28 PRO HD2 H -9.074 -0.365 -2.695 1.00 . A A . 28 PRO HD2 1 1 6 4902 1 1 28 PRO HD3 H -9.451 -1.382 -4.105 1.00 . A A . 28 PRO HD3 1 1 6 4903 1 1 28 PRO HG2 H -10.223 1.183 -3.987 1.00 . A A . 28 PRO HG2 1 1 6 4904 1 1 28 PRO HG3 H -9.702 0.443 -5.512 1.00 . A A . 28 PRO HG3 1 1 6 4905 1 1 28 PRO N N -7.513 -0.550 -4.107 1.00 . A A . 28 PRO N 1 1 6 4906 1 1 28 PRO O O -6.244 2.507 -2.818 1.00 . A A . 28 PRO O 1 1 6 4907 1 1 29 SER C C -3.298 1.277 -1.658 1.00 . A A . 29 SER C 1 1 6 4908 1 1 29 SER CA C -4.702 0.805 -1.295 1.00 . A A . 29 SER CA 1 1 6 4909 1 1 29 SER CB C -4.621 -0.384 -0.343 1.00 . A A . 29 SER CB 1 1 6 4910 1 1 29 SER H H -5.468 -0.505 -2.759 1.00 . A A . 29 SER H 1 1 6 4911 1 1 29 SER HA H -5.225 1.611 -0.804 1.00 . A A . 29 SER HA 1 1 6 4912 1 1 29 SER HB2 H -3.600 -0.734 -0.292 1.00 . A A . 29 SER HB2 1 1 6 4913 1 1 29 SER HB3 H -4.947 -0.083 0.641 1.00 . A A . 29 SER HB3 1 1 6 4914 1 1 29 SER HG H -4.901 -2.243 -0.910 1.00 . A A . 29 SER HG 1 1 6 4915 1 1 29 SER N N -5.461 0.433 -2.476 1.00 . A A . 29 SER N 1 1 6 4916 1 1 29 SER O O -2.502 0.528 -2.226 1.00 . A A . 29 SER O 1 1 6 4917 1 1 29 SER OG O -5.446 -1.444 -0.794 1.00 . A A . 29 SER OG 1 1 6 4918 1 1 30 SER C C -0.762 2.728 -0.356 1.00 . A A . 30 SER C 1 1 6 4919 1 1 30 SER CA C -1.683 3.084 -1.518 1.00 . A A . 30 SER CA 1 1 6 4920 1 1 30 SER CB C -1.808 4.598 -1.660 1.00 . A A . 30 SER CB 1 1 6 4921 1 1 30 SER H H -3.676 3.058 -0.849 1.00 . A A . 30 SER H 1 1 6 4922 1 1 30 SER HA H -1.282 2.671 -2.431 1.00 . A A . 30 SER HA 1 1 6 4923 1 1 30 SER HB2 H -1.239 5.082 -0.879 1.00 . A A . 30 SER HB2 1 1 6 4924 1 1 30 SER HB3 H -1.433 4.903 -2.625 1.00 . A A . 30 SER HB3 1 1 6 4925 1 1 30 SER HG H -3.273 5.878 -1.932 1.00 . A A . 30 SER HG 1 1 6 4926 1 1 30 SER N N -2.998 2.515 -1.298 1.00 . A A . 30 SER N 1 1 6 4927 1 1 30 SER O O -1.102 2.948 0.811 1.00 . A A . 30 SER O 1 1 6 4928 1 1 30 SER OG O -3.168 4.997 -1.549 1.00 . A A . 30 SER OG 1 1 6 4929 1 1 31 TYR C C 2.677 1.909 0.091 1.00 . A A . 31 TYR C 1 1 6 4930 1 1 31 TYR CA C 1.223 1.554 0.373 1.00 . A A . 31 TYR CA 1 1 6 4931 1 1 31 TYR CB C 1.081 0.036 0.460 1.00 . A A . 31 TYR CB 1 1 6 4932 1 1 31 TYR CD1 C 0.767 -0.464 2.907 1.00 . A A . 31 TYR CD1 1 1 6 4933 1 1 31 TYR CD2 C -1.049 -0.904 1.431 1.00 . A A . 31 TYR CD2 1 1 6 4934 1 1 31 TYR CE1 C 0.020 -0.919 3.970 1.00 . A A . 31 TYR CE1 1 1 6 4935 1 1 31 TYR CE2 C -1.805 -1.365 2.493 1.00 . A A . 31 TYR CE2 1 1 6 4936 1 1 31 TYR CG C 0.248 -0.446 1.622 1.00 . A A . 31 TYR CG 1 1 6 4937 1 1 31 TYR CZ C -1.264 -1.371 3.762 1.00 . A A . 31 TYR CZ 1 1 6 4938 1 1 31 TYR H H 0.514 1.825 -1.598 1.00 . A A . 31 TYR H 1 1 6 4939 1 1 31 TYR HA H 0.927 1.991 1.313 1.00 . A A . 31 TYR HA 1 1 6 4940 1 1 31 TYR HB2 H 0.620 -0.326 -0.447 1.00 . A A . 31 TYR HB2 1 1 6 4941 1 1 31 TYR HB3 H 2.064 -0.404 0.553 1.00 . A A . 31 TYR HB3 1 1 6 4942 1 1 31 TYR HD1 H 1.776 -0.112 3.069 1.00 . A A . 31 TYR HD1 1 1 6 4943 1 1 31 TYR HD2 H -1.470 -0.894 0.435 1.00 . A A . 31 TYR HD2 1 1 6 4944 1 1 31 TYR HE1 H 0.446 -0.927 4.963 1.00 . A A . 31 TYR HE1 1 1 6 4945 1 1 31 TYR HE2 H -2.811 -1.719 2.327 1.00 . A A . 31 TYR HE2 1 1 6 4946 1 1 31 TYR HH H -1.420 -1.975 5.582 1.00 . A A . 31 TYR HH 1 1 6 4947 1 1 31 TYR N N 0.340 2.064 -0.661 1.00 . A A . 31 TYR N 1 1 6 4948 1 1 31 TYR O O 3.022 2.346 -1.004 1.00 . A A . 31 TYR O 1 1 6 4949 1 1 31 TYR OH O -2.006 -1.834 4.825 1.00 . A A . 31 TYR OH 1 1 6 4950 1 1 32 HIS C C 5.585 0.336 1.028 1.00 . A A . 32 HIS C 1 1 6 4951 1 1 32 HIS CA C 4.970 1.717 0.876 1.00 . A A . 32 HIS CA 1 1 6 4952 1 1 32 HIS CB C 5.571 2.660 1.915 1.00 . A A . 32 HIS CB 1 1 6 4953 1 1 32 HIS CD2 C 5.829 4.726 0.393 1.00 . A A . 32 HIS CD2 1 1 6 4954 1 1 32 HIS CE1 C 5.037 6.197 1.795 1.00 . A A . 32 HIS CE1 1 1 6 4955 1 1 32 HIS CG C 5.481 4.105 1.547 1.00 . A A . 32 HIS CG 1 1 6 4956 1 1 32 HIS H H 3.199 1.185 1.867 1.00 . A A . 32 HIS H 1 1 6 4957 1 1 32 HIS HA H 5.167 2.094 -0.116 1.00 . A A . 32 HIS HA 1 1 6 4958 1 1 32 HIS HB2 H 5.052 2.524 2.852 1.00 . A A . 32 HIS HB2 1 1 6 4959 1 1 32 HIS HB3 H 6.612 2.412 2.049 1.00 . A A . 32 HIS HB3 1 1 6 4960 1 1 32 HIS HD2 H 6.244 4.263 -0.489 1.00 . A A . 32 HIS HD2 1 1 6 4961 1 1 32 HIS HE1 H 4.694 7.127 2.214 1.00 . A A . 32 HIS HE1 1 1 6 4962 1 1 32 HIS HE2 H 5.901 6.791 -0.006 1.00 . A A . 32 HIS HE2 1 1 6 4963 1 1 32 HIS N N 3.535 1.605 1.053 1.00 . A A . 32 HIS N 1 1 6 4964 1 1 32 HIS ND1 N 4.986 5.040 2.420 1.00 . A A . 32 HIS ND1 1 1 6 4965 1 1 32 HIS NE2 N 5.545 6.061 0.556 1.00 . A A . 32 HIS NE2 1 1 6 4966 1 1 32 HIS O O 5.032 -0.504 1.734 1.00 . A A . 32 HIS O 1 1 6 4967 1 1 33 ILE C C 7.727 -1.618 1.828 1.00 . A A . 33 ILE C 1 1 6 4968 1 1 33 ILE CA C 7.366 -1.209 0.401 1.00 . A A . 33 ILE CA 1 1 6 4969 1 1 33 ILE CB C 8.657 -1.225 -0.449 1.00 . A A . 33 ILE CB 1 1 6 4970 1 1 33 ILE CD1 C 10.900 -0.217 0.180 1.00 . A A . 33 ILE CD1 1 1 6 4971 1 1 33 ILE CG1 C 9.468 0.050 -0.218 1.00 . A A . 33 ILE CG1 1 1 6 4972 1 1 33 ILE CG2 C 8.330 -1.392 -1.924 1.00 . A A . 33 ILE CG2 1 1 6 4973 1 1 33 ILE H H 7.076 0.804 -0.219 1.00 . A A . 33 ILE H 1 1 6 4974 1 1 33 ILE HA H 6.684 -1.941 -0.008 1.00 . A A . 33 ILE HA 1 1 6 4975 1 1 33 ILE HB H 9.249 -2.075 -0.143 1.00 . A A . 33 ILE HB 1 1 6 4976 1 1 33 ILE HD11 H 11.096 0.223 1.146 1.00 . A A . 33 ILE HD11 1 1 6 4977 1 1 33 ILE HD12 H 11.068 -1.288 0.228 1.00 . A A . 33 ILE HD12 1 1 6 4978 1 1 33 ILE HD13 H 11.563 0.214 -0.556 1.00 . A A . 33 ILE HD13 1 1 6 4979 1 1 33 ILE HG12 H 9.479 0.636 -1.125 1.00 . A A . 33 ILE HG12 1 1 6 4980 1 1 33 ILE HG21 H 7.668 -2.236 -2.053 1.00 . A A . 33 ILE HG21 1 1 6 4981 1 1 33 ILE HG22 H 7.849 -0.498 -2.291 1.00 . A A . 33 ILE HG22 1 1 6 4982 1 1 33 ILE HG23 H 9.243 -1.563 -2.479 1.00 . A A . 33 ILE HG23 1 1 6 4983 1 1 33 ILE N N 6.704 0.097 0.359 1.00 . A A . 33 ILE N 1 1 6 4984 1 1 33 ILE O O 7.941 -2.795 2.106 1.00 . A A . 33 ILE O 1 1 6 4985 1 1 34 HIS C C 7.275 -0.626 5.079 1.00 . A A . 34 HIS C 1 1 6 4986 1 1 34 HIS CA C 8.375 -0.885 4.050 1.00 . A A . 34 HIS CA 1 1 6 4987 1 1 34 HIS CB C 9.591 0.000 4.353 1.00 . A A . 34 HIS CB 1 1 6 4988 1 1 34 HIS CD2 C 9.115 2.490 4.845 1.00 . A A . 34 HIS CD2 1 1 6 4989 1 1 34 HIS CE1 C 9.175 3.202 2.791 1.00 . A A . 34 HIS CE1 1 1 6 4990 1 1 34 HIS CG C 9.382 1.449 4.021 1.00 . A A . 34 HIS CG 1 1 6 4991 1 1 34 HIS H H 7.833 0.293 2.383 1.00 . A A . 34 HIS H 1 1 6 4992 1 1 34 HIS HA H 8.672 -1.920 4.112 1.00 . A A . 34 HIS HA 1 1 6 4993 1 1 34 HIS HB2 H 9.823 -0.066 5.406 1.00 . A A . 34 HIS HB2 1 1 6 4994 1 1 34 HIS HB3 H 10.438 -0.353 3.781 1.00 . A A . 34 HIS HB3 1 1 6 4995 1 1 34 HIS HD2 H 9.028 2.455 5.920 1.00 . A A . 34 HIS HD2 1 1 6 4996 1 1 34 HIS HE1 H 9.134 3.856 1.934 1.00 . A A . 34 HIS HE1 1 1 6 4997 1 1 34 HIS HE2 H 8.524 4.433 4.323 1.00 . A A . 34 HIS HE2 1 1 6 4998 1 1 34 HIS N N 7.911 -0.634 2.693 1.00 . A A . 34 HIS N 1 1 6 4999 1 1 34 HIS ND1 N 9.420 1.906 2.725 1.00 . A A . 34 HIS ND1 1 1 6 5000 1 1 34 HIS NE2 N 8.983 3.603 4.054 1.00 . A A . 34 HIS NE2 1 1 6 5001 1 1 34 HIS O O 7.469 -0.853 6.272 1.00 . A A . 34 HIS O 1 1 6 5002 1 1 35 CYS C C 4.001 -0.962 5.570 1.00 . A A . 35 CYS C 1 1 6 5003 1 1 35 CYS CA C 5.024 0.169 5.518 1.00 . A A . 35 CYS CA 1 1 6 5004 1 1 35 CYS CB C 4.361 1.478 5.091 1.00 . A A . 35 CYS CB 1 1 6 5005 1 1 35 CYS H H 6.016 0.005 3.658 1.00 . A A . 35 CYS H 1 1 6 5006 1 1 35 CYS HA H 5.440 0.299 6.507 1.00 . A A . 35 CYS HA 1 1 6 5007 1 1 35 CYS HB2 H 4.055 1.399 4.058 1.00 . A A . 35 CYS HB2 1 1 6 5008 1 1 35 CYS HB3 H 3.491 1.653 5.707 1.00 . A A . 35 CYS HB3 1 1 6 5009 1 1 35 CYS N N 6.125 -0.148 4.620 1.00 . A A . 35 CYS N 1 1 6 5010 1 1 35 CYS O O 2.793 -0.726 5.568 1.00 . A A . 35 CYS O 1 1 6 5011 1 1 35 CYS SG S 5.446 2.934 5.234 1.00 . A A . 35 CYS SG 1 1 6 5012 1 1 36 LEU C C 4.412 -4.506 6.401 1.00 . A A . 36 LEU C 1 1 6 5013 1 1 36 LEU CA C 3.640 -3.351 5.784 1.00 . A A . 36 LEU CA 1 1 6 5014 1 1 36 LEU CB C 3.086 -3.771 4.417 1.00 . A A . 36 LEU CB 1 1 6 5015 1 1 36 LEU CD1 C 4.923 -4.160 2.758 1.00 . A A . 36 LEU CD1 1 1 6 5016 1 1 36 LEU CD2 C 2.859 -2.943 2.072 1.00 . A A . 36 LEU CD2 1 1 6 5017 1 1 36 LEU CG C 3.828 -3.210 3.206 1.00 . A A . 36 LEU CG 1 1 6 5018 1 1 36 LEU H H 5.468 -2.305 5.700 1.00 . A A . 36 LEU H 1 1 6 5019 1 1 36 LEU HA H 2.817 -3.094 6.434 1.00 . A A . 36 LEU HA 1 1 6 5020 1 1 36 LEU HB2 H 3.112 -4.849 4.360 1.00 . A A . 36 LEU HB2 1 1 6 5021 1 1 36 LEU HB3 H 2.056 -3.451 4.359 1.00 . A A . 36 LEU HB3 1 1 6 5022 1 1 36 LEU HD11 H 5.381 -4.614 3.624 1.00 . A A . 36 LEU HD11 1 1 6 5023 1 1 36 LEU HD12 H 4.498 -4.927 2.130 1.00 . A A . 36 LEU HD12 1 1 6 5024 1 1 36 LEU HD13 H 5.670 -3.611 2.203 1.00 . A A . 36 LEU HD13 1 1 6 5025 1 1 36 LEU HD21 H 2.953 -1.915 1.752 1.00 . A A . 36 LEU HD21 1 1 6 5026 1 1 36 LEU HD22 H 3.080 -3.600 1.244 1.00 . A A . 36 LEU HD22 1 1 6 5027 1 1 36 LEU HD23 H 1.850 -3.122 2.413 1.00 . A A . 36 LEU HD23 1 1 6 5028 1 1 36 LEU HG H 4.292 -2.272 3.480 1.00 . A A . 36 LEU HG 1 1 6 5029 1 1 36 LEU N N 4.496 -2.184 5.666 1.00 . A A . 36 LEU N 1 1 6 5030 1 1 36 LEU O O 5.598 -4.372 6.712 1.00 . A A . 36 LEU O 1 1 6 5031 1 1 37 ARG C C 5.498 -7.347 6.272 1.00 . A A . 37 ARG C 1 1 6 5032 1 1 37 ARG CA C 4.336 -6.831 7.140 1.00 . A A . 37 ARG CA 1 1 6 5033 1 1 37 ARG CB C 3.274 -7.921 7.334 1.00 . A A . 37 ARG CB 1 1 6 5034 1 1 37 ARG CD C 2.982 -10.276 8.150 1.00 . A A . 37 ARG CD 1 1 6 5035 1 1 37 ARG CG C 3.614 -8.920 8.424 1.00 . A A . 37 ARG CG 1 1 6 5036 1 1 37 ARG CZ C 3.678 -12.512 7.367 1.00 . A A . 37 ARG CZ 1 1 6 5037 1 1 37 ARG H H 2.782 -5.652 6.314 1.00 . A A . 37 ARG H 1 1 6 5038 1 1 37 ARG HA H 4.732 -6.560 8.108 1.00 . A A . 37 ARG HA 1 1 6 5039 1 1 37 ARG HB2 H 2.335 -7.450 7.587 1.00 . A A . 37 ARG HB2 1 1 6 5040 1 1 37 ARG HB3 H 3.155 -8.460 6.406 1.00 . A A . 37 ARG HB3 1 1 6 5041 1 1 37 ARG HD2 H 2.511 -10.628 9.056 1.00 . A A . 37 ARG HD2 1 1 6 5042 1 1 37 ARG HD3 H 2.237 -10.161 7.378 1.00 . A A . 37 ARG HD3 1 1 6 5043 1 1 37 ARG HE H 4.911 -10.965 7.680 1.00 . A A . 37 ARG HE 1 1 6 5044 1 1 37 ARG HG2 H 4.687 -9.037 8.471 1.00 . A A . 37 ARG HG2 1 1 6 5045 1 1 37 ARG HG3 H 3.248 -8.546 9.370 1.00 . A A . 37 ARG HG3 1 1 6 5046 1 1 37 ARG HH11 H 1.690 -12.344 7.757 1.00 . A A . 37 ARG HH11 1 1 6 5047 1 1 37 ARG HH12 H 2.214 -13.910 7.205 1.00 . A A . 37 ARG HH12 1 1 6 5048 1 1 37 ARG HH21 H 5.595 -12.999 6.907 1.00 . A A . 37 ARG HH21 1 1 6 5049 1 1 37 ARG HH22 H 4.428 -14.274 6.675 1.00 . A A . 37 ARG HH22 1 1 6 5050 1 1 37 ARG N N 3.731 -5.631 6.570 1.00 . A A . 37 ARG N 1 1 6 5051 1 1 37 ARG NE N 3.971 -11.260 7.716 1.00 . A A . 37 ARG NE 1 1 6 5052 1 1 37 ARG NH1 N 2.428 -12.954 7.441 1.00 . A A . 37 ARG NH1 1 1 6 5053 1 1 37 ARG NH2 N 4.643 -13.325 6.953 1.00 . A A . 37 ARG NH2 1 1 6 5054 1 1 37 ARG O O 6.621 -7.469 6.762 1.00 . A A . 37 ARG O 1 1 6 5055 1 1 38 PRO C C 7.175 -6.953 3.530 1.00 . A A . 38 PRO C 1 1 6 5056 1 1 38 PRO CA C 6.339 -8.106 4.086 1.00 . A A . 38 PRO CA 1 1 6 5057 1 1 38 PRO CB C 5.572 -8.803 2.967 1.00 . A A . 38 PRO CB 1 1 6 5058 1 1 38 PRO CD C 3.985 -7.525 4.254 1.00 . A A . 38 PRO CD 1 1 6 5059 1 1 38 PRO CG C 4.276 -8.070 2.877 1.00 . A A . 38 PRO CG 1 1 6 5060 1 1 38 PRO HA H 6.986 -8.817 4.581 1.00 . A A . 38 PRO HA 1 1 6 5061 1 1 38 PRO HB2 H 6.132 -8.730 2.046 1.00 . A A . 38 PRO HB2 1 1 6 5062 1 1 38 PRO HB3 H 5.421 -9.842 3.223 1.00 . A A . 38 PRO HB3 1 1 6 5063 1 1 38 PRO HD2 H 3.671 -6.495 4.189 1.00 . A A . 38 PRO HD2 1 1 6 5064 1 1 38 PRO HD3 H 3.224 -8.120 4.739 1.00 . A A . 38 PRO HD3 1 1 6 5065 1 1 38 PRO HG2 H 4.363 -7.259 2.168 1.00 . A A . 38 PRO HG2 1 1 6 5066 1 1 38 PRO HG3 H 3.495 -8.750 2.574 1.00 . A A . 38 PRO HG3 1 1 6 5067 1 1 38 PRO N N 5.274 -7.637 4.971 1.00 . A A . 38 PRO N 1 1 6 5068 1 1 38 PRO O O 7.045 -6.587 2.361 1.00 . A A . 38 PRO O 1 1 6 5069 1 1 39 ALA C C 9.799 -5.551 2.925 1.00 . A A . 39 ALA C 1 1 6 5070 1 1 39 ALA CA C 8.802 -5.203 4.022 1.00 . A A . 39 ALA CA 1 1 6 5071 1 1 39 ALA CB C 9.523 -4.637 5.236 1.00 . A A . 39 ALA CB 1 1 6 5072 1 1 39 ALA H H 8.011 -6.677 5.322 1.00 . A A . 39 ALA H 1 1 6 5073 1 1 39 ALA HA H 8.135 -4.441 3.648 1.00 . A A . 39 ALA HA 1 1 6 5074 1 1 39 ALA HB1 H 8.864 -3.964 5.765 1.00 . A A . 39 ALA HB1 1 1 6 5075 1 1 39 ALA HB2 H 9.818 -5.442 5.893 1.00 . A A . 39 ALA HB2 1 1 6 5076 1 1 39 ALA HB3 H 10.402 -4.098 4.911 1.00 . A A . 39 ALA HB3 1 1 6 5077 1 1 39 ALA N N 7.989 -6.355 4.395 1.00 . A A . 39 ALA N 1 1 6 5078 1 1 39 ALA O O 10.526 -6.541 3.016 1.00 . A A . 39 ALA O 1 1 6 5079 1 1 40 LEU C C 11.619 -3.779 0.560 1.00 . A A . 40 LEU C 1 1 6 5080 1 1 40 LEU CA C 10.673 -4.959 0.734 1.00 . A A . 40 LEU CA 1 1 6 5081 1 1 40 LEU CB C 9.833 -5.150 -0.532 1.00 . A A . 40 LEU CB 1 1 6 5082 1 1 40 LEU CD1 C 7.349 -4.982 -0.837 1.00 . A A . 40 LEU CD1 1 1 6 5083 1 1 40 LEU CD2 C 8.481 -7.207 -0.995 1.00 . A A . 40 LEU CD2 1 1 6 5084 1 1 40 LEU CG C 8.488 -5.846 -0.319 1.00 . A A . 40 LEU CG 1 1 6 5085 1 1 40 LEU H H 9.186 -3.977 1.873 1.00 . A A . 40 LEU H 1 1 6 5086 1 1 40 LEU HA H 11.250 -5.852 0.915 1.00 . A A . 40 LEU HA 1 1 6 5087 1 1 40 LEU HB2 H 9.646 -4.178 -0.961 1.00 . A A . 40 LEU HB2 1 1 6 5088 1 1 40 LEU HB3 H 10.408 -5.733 -1.236 1.00 . A A . 40 LEU HB3 1 1 6 5089 1 1 40 LEU HD11 H 7.496 -4.785 -1.889 1.00 . A A . 40 LEU HD11 1 1 6 5090 1 1 40 LEU HD12 H 6.411 -5.499 -0.695 1.00 . A A . 40 LEU HD12 1 1 6 5091 1 1 40 LEU HD13 H 7.330 -4.047 -0.296 1.00 . A A . 40 LEU HD13 1 1 6 5092 1 1 40 LEU HD21 H 8.043 -7.936 -0.331 1.00 . A A . 40 LEU HD21 1 1 6 5093 1 1 40 LEU HD22 H 7.901 -7.154 -1.905 1.00 . A A . 40 LEU HD22 1 1 6 5094 1 1 40 LEU HD23 H 9.494 -7.496 -1.231 1.00 . A A . 40 LEU HD23 1 1 6 5095 1 1 40 LEU HG H 8.333 -6.000 0.739 1.00 . A A . 40 LEU HG 1 1 6 5096 1 1 40 LEU N N 9.803 -4.743 1.879 1.00 . A A . 40 LEU N 1 1 6 5097 1 1 40 LEU O O 11.709 -2.922 1.437 1.00 . A A . 40 LEU O 1 1 6 5098 1 1 41 TYR C C 13.037 -2.040 -2.185 1.00 . A A . 41 TYR C 1 1 6 5099 1 1 41 TYR CA C 13.299 -2.685 -0.823 1.00 . A A . 41 TYR CA 1 1 6 5100 1 1 41 TYR CB C 14.728 -3.234 -0.767 1.00 . A A . 41 TYR CB 1 1 6 5101 1 1 41 TYR CD1 C 15.350 -2.931 1.662 1.00 . A A . 41 TYR CD1 1 1 6 5102 1 1 41 TYR CD2 C 15.248 -5.148 0.793 1.00 . A A . 41 TYR CD2 1 1 6 5103 1 1 41 TYR CE1 C 15.700 -3.430 2.902 1.00 . A A . 41 TYR CE1 1 1 6 5104 1 1 41 TYR CE2 C 15.596 -5.653 2.029 1.00 . A A . 41 TYR CE2 1 1 6 5105 1 1 41 TYR CG C 15.117 -3.781 0.587 1.00 . A A . 41 TYR CG 1 1 6 5106 1 1 41 TYR CZ C 15.823 -4.790 3.079 1.00 . A A . 41 TYR CZ 1 1 6 5107 1 1 41 TYR H H 12.262 -4.497 -1.186 1.00 . A A . 41 TYR H 1 1 6 5108 1 1 41 TYR HA H 13.184 -1.933 -0.056 1.00 . A A . 41 TYR HA 1 1 6 5109 1 1 41 TYR HB2 H 14.828 -4.033 -1.485 1.00 . A A . 41 TYR HB2 1 1 6 5110 1 1 41 TYR HB3 H 15.421 -2.442 -1.017 1.00 . A A . 41 TYR HB3 1 1 6 5111 1 1 41 TYR HD1 H 15.253 -1.865 1.518 1.00 . A A . 41 TYR HD1 1 1 6 5112 1 1 41 TYR HD2 H 15.068 -5.822 -0.032 1.00 . A A . 41 TYR HD2 1 1 6 5113 1 1 41 TYR HE1 H 15.878 -2.753 3.727 1.00 . A A . 41 TYR HE1 1 1 6 5114 1 1 41 TYR HE2 H 15.691 -6.721 2.170 1.00 . A A . 41 TYR HE2 1 1 6 5115 1 1 41 TYR HH H 15.386 -5.301 4.886 1.00 . A A . 41 TYR HH 1 1 6 5116 1 1 41 TYR N N 12.338 -3.751 -0.553 1.00 . A A . 41 TYR N 1 1 6 5117 1 1 41 TYR O O 13.939 -1.943 -3.015 1.00 . A A . 41 TYR O 1 1 6 5118 1 1 41 TYR OH O 16.168 -5.293 4.313 1.00 . A A . 41 TYR OH 1 1 6 5119 1 1 42 GLU C C 11.575 -1.910 -4.819 1.00 . A A . 42 GLU C 1 1 6 5120 1 1 42 GLU CA C 11.375 -0.966 -3.649 1.00 . A A . 42 GLU CA 1 1 6 5121 1 1 42 GLU CB C 12.151 0.335 -3.878 1.00 . A A . 42 GLU CB 1 1 6 5122 1 1 42 GLU CD C 12.512 2.126 -2.137 1.00 . A A . 42 GLU CD 1 1 6 5123 1 1 42 GLU CG C 11.561 1.530 -3.154 1.00 . A A . 42 GLU CG 1 1 6 5124 1 1 42 GLU H H 11.122 -1.750 -1.705 1.00 . A A . 42 GLU H 1 1 6 5125 1 1 42 GLU HA H 10.322 -0.737 -3.567 1.00 . A A . 42 GLU HA 1 1 6 5126 1 1 42 GLU HB2 H 13.168 0.201 -3.535 1.00 . A A . 42 GLU HB2 1 1 6 5127 1 1 42 GLU HB3 H 12.164 0.551 -4.936 1.00 . A A . 42 GLU HB3 1 1 6 5128 1 1 42 GLU HG2 H 11.315 2.290 -3.881 1.00 . A A . 42 GLU HG2 1 1 6 5129 1 1 42 GLU HG3 H 10.662 1.217 -2.644 1.00 . A A . 42 GLU HG3 1 1 6 5130 1 1 42 GLU N N 11.789 -1.615 -2.403 1.00 . A A . 42 GLU N 1 1 6 5131 1 1 42 GLU O O 12.270 -1.596 -5.786 1.00 . A A . 42 GLU O 1 1 6 5132 1 1 42 GLU OE1 O 13.619 1.571 -1.945 1.00 . A A . 42 GLU OE1 1 1 6 5133 1 1 42 GLU OE2 O 12.161 3.156 -1.527 1.00 . A A . 42 GLU OE2 1 1 6 5134 1 1 43 VAL C C 10.152 -4.423 -6.543 1.00 . A A . 43 VAL C 1 1 6 5135 1 1 43 VAL CA C 11.344 -4.171 -5.616 1.00 . A A . 43 VAL CA 1 1 6 5136 1 1 43 VAL CB C 11.794 -5.486 -4.941 1.00 . A A . 43 VAL CB 1 1 6 5137 1 1 43 VAL CG1 C 12.954 -6.104 -5.704 1.00 . A A . 43 VAL CG1 1 1 6 5138 1 1 43 VAL CG2 C 12.175 -5.244 -3.485 1.00 . A A . 43 VAL CG2 1 1 6 5139 1 1 43 VAL H H 10.638 -3.343 -3.813 1.00 . A A . 43 VAL H 1 1 6 5140 1 1 43 VAL HA H 12.139 -3.829 -6.208 1.00 . A A . 43 VAL HA 1 1 6 5141 1 1 43 VAL HB H 10.966 -6.179 -4.965 1.00 . A A . 43 VAL HB 1 1 6 5142 1 1 43 VAL HG11 H 13.481 -5.330 -6.242 1.00 . A A . 43 VAL HG11 1 1 6 5143 1 1 43 VAL HG12 H 13.628 -6.581 -5.007 1.00 . A A . 43 VAL HG12 1 1 6 5144 1 1 43 VAL HG13 H 12.578 -6.837 -6.402 1.00 . A A . 43 VAL HG13 1 1 6 5145 1 1 43 VAL HG21 H 13.244 -5.341 -3.371 1.00 . A A . 43 VAL HG21 1 1 6 5146 1 1 43 VAL HG22 H 11.869 -4.247 -3.187 1.00 . A A . 43 VAL HG22 1 1 6 5147 1 1 43 VAL HG23 H 11.678 -5.971 -2.860 1.00 . A A . 43 VAL HG23 1 1 6 5148 1 1 43 VAL N N 11.095 -3.126 -4.646 1.00 . A A . 43 VAL N 1 1 6 5149 1 1 43 VAL O O 10.266 -4.290 -7.763 1.00 . A A . 43 VAL O 1 1 6 5150 1 1 44 PRO C C 7.231 -3.796 -7.410 1.00 . A A . 44 PRO C 1 1 6 5151 1 1 44 PRO CA C 7.775 -5.053 -6.741 1.00 . A A . 44 PRO CA 1 1 6 5152 1 1 44 PRO CB C 6.796 -5.554 -5.678 1.00 . A A . 44 PRO CB 1 1 6 5153 1 1 44 PRO CD C 8.793 -4.946 -4.541 1.00 . A A . 44 PRO CD 1 1 6 5154 1 1 44 PRO CG C 7.301 -4.972 -4.405 1.00 . A A . 44 PRO CG 1 1 6 5155 1 1 44 PRO HA H 7.930 -5.819 -7.486 1.00 . A A . 44 PRO HA 1 1 6 5156 1 1 44 PRO HB2 H 5.799 -5.205 -5.907 1.00 . A A . 44 PRO HB2 1 1 6 5157 1 1 44 PRO HB3 H 6.811 -6.634 -5.652 1.00 . A A . 44 PRO HB3 1 1 6 5158 1 1 44 PRO HD2 H 9.231 -4.106 -4.016 1.00 . A A . 44 PRO HD2 1 1 6 5159 1 1 44 PRO HD3 H 9.228 -5.869 -4.199 1.00 . A A . 44 PRO HD3 1 1 6 5160 1 1 44 PRO HG2 H 6.918 -3.971 -4.283 1.00 . A A . 44 PRO HG2 1 1 6 5161 1 1 44 PRO HG3 H 7.009 -5.593 -3.572 1.00 . A A . 44 PRO HG3 1 1 6 5162 1 1 44 PRO N N 8.997 -4.787 -5.977 1.00 . A A . 44 PRO N 1 1 6 5163 1 1 44 PRO O O 7.522 -2.680 -6.974 1.00 . A A . 44 PRO O 1 1 6 5164 1 1 45 ASP C C 4.879 -3.398 -10.243 1.00 . A A . 45 ASP C 1 1 6 5165 1 1 45 ASP CA C 5.851 -2.872 -9.198 1.00 . A A . 45 ASP CA 1 1 6 5166 1 1 45 ASP CB C 6.945 -2.035 -9.872 1.00 . A A . 45 ASP CB 1 1 6 5167 1 1 45 ASP CG C 6.440 -1.238 -11.059 1.00 . A A . 45 ASP CG 1 1 6 5168 1 1 45 ASP H H 6.244 -4.909 -8.742 1.00 . A A . 45 ASP H 1 1 6 5169 1 1 45 ASP HA H 5.313 -2.252 -8.496 1.00 . A A . 45 ASP HA 1 1 6 5170 1 1 45 ASP HB2 H 7.355 -1.343 -9.151 1.00 . A A . 45 ASP HB2 1 1 6 5171 1 1 45 ASP HB3 H 7.730 -2.693 -10.214 1.00 . A A . 45 ASP HB3 1 1 6 5172 1 1 45 ASP N N 6.443 -3.984 -8.457 1.00 . A A . 45 ASP N 1 1 6 5173 1 1 45 ASP O O 5.227 -4.278 -11.032 1.00 . A A . 45 ASP O 1 1 6 5174 1 1 45 ASP OD1 O 5.715 -0.245 -10.849 1.00 . A A . 45 ASP OD1 1 1 6 5175 1 1 45 ASP OD2 O 6.786 -1.594 -12.206 1.00 . A A . 45 ASP OD2 1 1 6 5176 1 1 46 GLY C C 2.046 -4.740 -10.639 1.00 . A A . 46 GLY C 1 1 6 5177 1 1 46 GLY CA C 2.621 -3.415 -11.090 1.00 . A A . 46 GLY CA 1 1 6 5178 1 1 46 GLY H H 3.399 -2.292 -9.475 1.00 . A A . 46 GLY H 1 1 6 5179 1 1 46 GLY HA2 H 1.825 -2.686 -11.145 1.00 . A A . 46 GLY HA2 1 1 6 5180 1 1 46 GLY HA3 H 3.053 -3.539 -12.072 1.00 . A A . 46 GLY HA3 1 1 6 5181 1 1 46 GLY N N 3.640 -2.933 -10.181 1.00 . A A . 46 GLY N 1 1 6 5182 1 1 46 GLY O O 0.874 -4.824 -10.264 1.00 . A A . 46 GLY O 1 1 6 5183 1 1 47 GLU C C 2.602 -7.127 -8.581 1.00 . A A . 47 GLU C 1 1 6 5184 1 1 47 GLU CA C 2.500 -7.068 -10.101 1.00 . A A . 47 GLU CA 1 1 6 5185 1 1 47 GLU CB C 3.375 -8.160 -10.723 1.00 . A A . 47 GLU CB 1 1 6 5186 1 1 47 GLU CD C 4.801 -8.736 -12.712 1.00 . A A . 47 GLU CD 1 1 6 5187 1 1 47 GLU CG C 3.559 -8.023 -12.224 1.00 . A A . 47 GLU CG 1 1 6 5188 1 1 47 GLU H H 3.838 -5.599 -10.828 1.00 . A A . 47 GLU H 1 1 6 5189 1 1 47 GLU HA H 1.472 -7.232 -10.389 1.00 . A A . 47 GLU HA 1 1 6 5190 1 1 47 GLU HB2 H 4.351 -8.129 -10.261 1.00 . A A . 47 GLU HB2 1 1 6 5191 1 1 47 GLU HB3 H 2.925 -9.121 -10.524 1.00 . A A . 47 GLU HB3 1 1 6 5192 1 1 47 GLU HG2 H 2.699 -8.446 -12.720 1.00 . A A . 47 GLU HG2 1 1 6 5193 1 1 47 GLU HG3 H 3.641 -6.976 -12.471 1.00 . A A . 47 GLU HG3 1 1 6 5194 1 1 47 GLU N N 2.897 -5.754 -10.584 1.00 . A A . 47 GLU N 1 1 6 5195 1 1 47 GLU O O 3.400 -7.888 -8.027 1.00 . A A . 47 GLU O 1 1 6 5196 1 1 47 GLU OE1 O 4.783 -9.984 -12.791 1.00 . A A . 47 GLU OE1 1 1 6 5197 1 1 47 GLU OE2 O 5.803 -8.054 -13.013 1.00 . A A . 47 GLU OE2 1 1 6 5198 1 1 48 TRP C C 0.443 -6.086 -5.905 1.00 . A A . 48 TRP C 1 1 6 5199 1 1 48 TRP CA C 1.855 -6.233 -6.460 1.00 . A A . 48 TRP CA 1 1 6 5200 1 1 48 TRP CB C 2.739 -5.073 -5.989 1.00 . A A . 48 TRP CB 1 1 6 5201 1 1 48 TRP CD1 C 3.921 -5.926 -3.879 1.00 . A A . 48 TRP CD1 1 1 6 5202 1 1 48 TRP CD2 C 2.396 -4.335 -3.501 1.00 . A A . 48 TRP CD2 1 1 6 5203 1 1 48 TRP CE2 C 2.957 -4.716 -2.270 1.00 . A A . 48 TRP CE2 1 1 6 5204 1 1 48 TRP CE3 C 1.408 -3.348 -3.516 1.00 . A A . 48 TRP CE3 1 1 6 5205 1 1 48 TRP CG C 3.028 -5.117 -4.519 1.00 . A A . 48 TRP CG 1 1 6 5206 1 1 48 TRP CH2 C 1.594 -3.180 -1.111 1.00 . A A . 48 TRP CH2 1 1 6 5207 1 1 48 TRP CZ2 C 2.563 -4.143 -1.067 1.00 . A A . 48 TRP CZ2 1 1 6 5208 1 1 48 TRP CZ3 C 1.018 -2.781 -2.322 1.00 . A A . 48 TRP CZ3 1 1 6 5209 1 1 48 TRP H H 1.226 -5.691 -8.402 1.00 . A A . 48 TRP H 1 1 6 5210 1 1 48 TRP HA H 2.275 -7.162 -6.100 1.00 . A A . 48 TRP HA 1 1 6 5211 1 1 48 TRP HB2 H 3.681 -5.108 -6.516 1.00 . A A . 48 TRP HB2 1 1 6 5212 1 1 48 TRP HB3 H 2.243 -4.138 -6.206 1.00 . A A . 48 TRP HB3 1 1 6 5213 1 1 48 TRP HD1 H 4.559 -6.641 -4.377 1.00 . A A . 48 TRP HD1 1 1 6 5214 1 1 48 TRP HE1 H 4.441 -6.148 -1.851 1.00 . A A . 48 TRP HE1 1 1 6 5215 1 1 48 TRP HE3 H 0.952 -3.027 -4.441 1.00 . A A . 48 TRP HE3 1 1 6 5216 1 1 48 TRP HH2 H 1.255 -2.710 -0.201 1.00 . A A . 48 TRP HH2 1 1 6 5217 1 1 48 TRP HZ2 H 2.997 -4.440 -0.123 1.00 . A A . 48 TRP HZ2 1 1 6 5218 1 1 48 TRP HZ3 H 0.255 -2.019 -2.312 1.00 . A A . 48 TRP HZ3 1 1 6 5219 1 1 48 TRP N N 1.829 -6.291 -7.909 1.00 . A A . 48 TRP N 1 1 6 5220 1 1 48 TRP NE1 N 3.887 -5.689 -2.527 1.00 . A A . 48 TRP NE1 1 1 6 5221 1 1 48 TRP O O -0.481 -5.702 -6.625 1.00 . A A . 48 TRP O 1 1 6 5222 1 1 49 GLN C C -0.776 -6.216 -2.455 1.00 . A A . 49 GLN C 1 1 6 5223 1 1 49 GLN CA C -0.998 -6.323 -3.956 1.00 . A A . 49 GLN CA 1 1 6 5224 1 1 49 GLN CB C -1.857 -7.546 -4.276 1.00 . A A . 49 GLN CB 1 1 6 5225 1 1 49 GLN CD C -2.243 -10.014 -3.969 1.00 . A A . 49 GLN CD 1 1 6 5226 1 1 49 GLN CG C -1.331 -8.842 -3.683 1.00 . A A . 49 GLN CG 1 1 6 5227 1 1 49 GLN H H 1.062 -6.725 -4.123 1.00 . A A . 49 GLN H 1 1 6 5228 1 1 49 GLN HA H -1.500 -5.431 -4.306 1.00 . A A . 49 GLN HA 1 1 6 5229 1 1 49 GLN HB2 H -2.853 -7.379 -3.893 1.00 . A A . 49 GLN HB2 1 1 6 5230 1 1 49 GLN HB3 H -1.910 -7.662 -5.349 1.00 . A A . 49 GLN HB3 1 1 6 5231 1 1 49 GLN HE21 H -3.724 -9.134 -2.963 1.00 . A A . 49 GLN HE21 1 1 6 5232 1 1 49 GLN HE22 H -4.095 -10.674 -3.679 1.00 . A A . 49 GLN HE22 1 1 6 5233 1 1 49 GLN HG2 H -0.358 -9.049 -4.103 1.00 . A A . 49 GLN HG2 1 1 6 5234 1 1 49 GLN HG3 H -1.244 -8.725 -2.613 1.00 . A A . 49 GLN HG3 1 1 6 5235 1 1 49 GLN N N 0.283 -6.419 -4.634 1.00 . A A . 49 GLN N 1 1 6 5236 1 1 49 GLN NE2 N -3.473 -9.938 -3.485 1.00 . A A . 49 GLN NE2 1 1 6 5237 1 1 49 GLN O O 0.266 -6.652 -1.953 1.00 . A A . 49 GLN O 1 1 6 5238 1 1 49 GLN OE1 O -1.843 -10.980 -4.622 1.00 . A A . 49 GLN OE1 1 1 6 5239 1 1 50 CYS C C -1.389 -6.789 0.388 1.00 . A A . 50 CYS C 1 1 6 5240 1 1 50 CYS CA C -1.629 -5.445 -0.306 1.00 . A A . 50 CYS CA 1 1 6 5241 1 1 50 CYS CB C -2.905 -4.817 0.289 1.00 . A A . 50 CYS CB 1 1 6 5242 1 1 50 CYS H H -2.497 -5.224 -2.219 1.00 . A A . 50 CYS H 1 1 6 5243 1 1 50 CYS HA H -0.792 -4.794 -0.101 1.00 . A A . 50 CYS HA 1 1 6 5244 1 1 50 CYS HB2 H -3.475 -5.590 0.775 1.00 . A A . 50 CYS HB2 1 1 6 5245 1 1 50 CYS HB3 H -2.609 -4.086 1.027 1.00 . A A . 50 CYS HB3 1 1 6 5246 1 1 50 CYS N N -1.729 -5.604 -1.751 1.00 . A A . 50 CYS N 1 1 6 5247 1 1 50 CYS O O -1.818 -7.836 -0.091 1.00 . A A . 50 CYS O 1 1 6 5248 1 1 50 CYS SG S -4.025 -3.977 -0.874 1.00 . A A . 50 CYS SG 1 1 6 5249 1 1 51 PRO C C -2.047 -8.292 3.111 1.00 . A A . 51 PRO C 1 1 6 5250 1 1 51 PRO CA C -0.715 -7.952 2.436 1.00 . A A . 51 PRO CA 1 1 6 5251 1 1 51 PRO CB C 0.331 -7.536 3.469 1.00 . A A . 51 PRO CB 1 1 6 5252 1 1 51 PRO CD C -0.382 -5.546 2.319 1.00 . A A . 51 PRO CD 1 1 6 5253 1 1 51 PRO CG C 0.119 -6.069 3.643 1.00 . A A . 51 PRO CG 1 1 6 5254 1 1 51 PRO HA H -0.364 -8.801 1.869 1.00 . A A . 51 PRO HA 1 1 6 5255 1 1 51 PRO HB2 H 0.166 -8.074 4.391 1.00 . A A . 51 PRO HB2 1 1 6 5256 1 1 51 PRO HB3 H 1.320 -7.748 3.092 1.00 . A A . 51 PRO HB3 1 1 6 5257 1 1 51 PRO HD2 H -1.200 -4.859 2.472 1.00 . A A . 51 PRO HD2 1 1 6 5258 1 1 51 PRO HD3 H 0.419 -5.065 1.778 1.00 . A A . 51 PRO HD3 1 1 6 5259 1 1 51 PRO HG2 H -0.617 -5.897 4.414 1.00 . A A . 51 PRO HG2 1 1 6 5260 1 1 51 PRO HG3 H 1.053 -5.593 3.904 1.00 . A A . 51 PRO HG3 1 1 6 5261 1 1 51 PRO N N -0.839 -6.758 1.608 1.00 . A A . 51 PRO N 1 1 6 5262 1 1 51 PRO O O -2.087 -8.964 4.145 1.00 . A A . 51 PRO O 1 1 6 5263 1 1 52 ARG C C -5.363 -8.681 2.216 1.00 . A A . 52 ARG C 1 1 6 5264 1 1 52 ARG CA C -4.451 -7.883 3.139 1.00 . A A . 52 ARG CA 1 1 6 5265 1 1 52 ARG CB C -5.066 -6.508 3.410 1.00 . A A . 52 ARG CB 1 1 6 5266 1 1 52 ARG CD C -4.551 -4.070 3.759 1.00 . A A . 52 ARG CD 1 1 6 5267 1 1 52 ARG CG C -4.090 -5.501 3.994 1.00 . A A . 52 ARG CG 1 1 6 5268 1 1 52 ARG CZ C -5.626 -3.008 5.711 1.00 . A A . 52 ARG CZ 1 1 6 5269 1 1 52 ARG H H -3.008 -7.162 1.775 1.00 . A A . 52 ARG H 1 1 6 5270 1 1 52 ARG HA H -4.348 -8.413 4.075 1.00 . A A . 52 ARG HA 1 1 6 5271 1 1 52 ARG HB2 H -5.447 -6.109 2.482 1.00 . A A . 52 ARG HB2 1 1 6 5272 1 1 52 ARG HB3 H -5.886 -6.626 4.104 1.00 . A A . 52 ARG HB3 1 1 6 5273 1 1 52 ARG HD2 H -3.891 -3.605 3.042 1.00 . A A . 52 ARG HD2 1 1 6 5274 1 1 52 ARG HD3 H -5.556 -4.090 3.365 1.00 . A A . 52 ARG HD3 1 1 6 5275 1 1 52 ARG HE H -3.661 -2.966 5.311 1.00 . A A . 52 ARG HE 1 1 6 5276 1 1 52 ARG HG2 H -4.005 -5.671 5.057 1.00 . A A . 52 ARG HG2 1 1 6 5277 1 1 52 ARG HG3 H -3.124 -5.640 3.529 1.00 . A A . 52 ARG HG3 1 1 6 5278 1 1 52 ARG HH11 H -6.928 -3.845 4.394 1.00 . A A . 52 ARG HH11 1 1 6 5279 1 1 52 ARG HH12 H -7.649 -3.146 5.811 1.00 . A A . 52 ARG HH12 1 1 6 5280 1 1 52 ARG HH21 H -4.594 -2.084 7.196 1.00 . A A . 52 ARG HH21 1 1 6 5281 1 1 52 ARG HH22 H -6.325 -2.142 7.410 1.00 . A A . 52 ARG HH22 1 1 6 5282 1 1 52 ARG N N -3.123 -7.734 2.566 1.00 . A A . 52 ARG N 1 1 6 5283 1 1 52 ARG NE N -4.539 -3.286 4.991 1.00 . A A . 52 ARG NE 1 1 6 5284 1 1 52 ARG NH1 N -6.831 -3.362 5.273 1.00 . A A . 52 ARG NH1 1 1 6 5285 1 1 52 ARG NH2 N -5.506 -2.360 6.864 1.00 . A A . 52 ARG NH2 1 1 6 5286 1 1 52 ARG O O -6.224 -9.430 2.682 1.00 . A A . 52 ARG O 1 1 6 5287 1 1 53 CYS C C -5.518 -10.673 -0.195 1.00 . A A . 53 CYS C 1 1 6 5288 1 1 53 CYS CA C -5.996 -9.232 -0.066 1.00 . A A . 53 CYS CA 1 1 6 5289 1 1 53 CYS CB C -5.912 -8.519 -1.410 1.00 . A A . 53 CYS CB 1 1 6 5290 1 1 53 CYS H H -4.479 -7.918 0.580 1.00 . A A . 53 CYS H 1 1 6 5291 1 1 53 CYS HA H -7.019 -9.225 0.279 1.00 . A A . 53 CYS HA 1 1 6 5292 1 1 53 CYS HB2 H -5.988 -9.247 -2.202 1.00 . A A . 53 CYS HB2 1 1 6 5293 1 1 53 CYS HB3 H -6.727 -7.815 -1.490 1.00 . A A . 53 CYS HB3 1 1 6 5294 1 1 53 CYS N N -5.183 -8.523 0.907 1.00 . A A . 53 CYS N 1 1 6 5295 1 1 53 CYS O O -6.233 -11.549 -0.689 1.00 . A A . 53 CYS O 1 1 6 5296 1 1 53 CYS SG S -4.358 -7.599 -1.649 1.00 . A A . 53 CYS SG 1 1 6 5297 1 1 54 THR C C -4.156 -13.053 1.464 1.00 . A A . 54 THR C 1 1 6 5298 1 1 54 THR CA C -3.705 -12.221 0.262 1.00 . A A . 54 THR CA 1 1 6 5299 1 1 54 THR CB C -2.175 -12.089 0.264 1.00 . A A . 54 THR CB 1 1 6 5300 1 1 54 THR CG2 C -1.593 -12.498 -1.080 1.00 . A A . 54 THR CG2 1 1 6 5301 1 1 54 THR H H -3.808 -10.163 0.678 1.00 . A A . 54 THR H 1 1 6 5302 1 1 54 THR HA H -4.006 -12.719 -0.648 1.00 . A A . 54 THR HA 1 1 6 5303 1 1 54 THR HB H -1.770 -12.734 1.030 1.00 . A A . 54 THR HB 1 1 6 5304 1 1 54 THR HG1 H -1.974 -10.181 -0.235 1.00 . A A . 54 THR HG1 1 1 6 5305 1 1 54 THR HG21 H -2.202 -13.276 -1.515 1.00 . A A . 54 THR HG21 1 1 6 5306 1 1 54 THR HG22 H -0.586 -12.862 -0.942 1.00 . A A . 54 THR HG22 1 1 6 5307 1 1 54 THR HG23 H -1.579 -11.640 -1.739 1.00 . A A . 54 THR HG23 1 1 6 5308 1 1 54 THR N N -4.311 -10.906 0.286 1.00 . A A . 54 THR N 1 1 6 5309 1 1 54 THR O O -3.342 -13.486 2.280 1.00 . A A . 54 THR O 1 1 6 5310 1 1 54 THR OG1 O -1.815 -10.726 0.547 1.00 . A A . 54 THR OG1 1 1 6 5311 1 1 55 CYS C C -5.626 -15.446 2.676 1.00 . A A . 55 CYS C 1 1 6 5312 1 1 55 CYS CA C -6.037 -13.966 2.714 1.00 . A A . 55 CYS CA 1 1 6 5313 1 1 55 CYS CB C -7.562 -13.821 2.735 1.00 . A A . 55 CYS CB 1 1 6 5314 1 1 55 CYS H H -6.071 -12.813 0.937 1.00 . A A . 55 CYS H 1 1 6 5315 1 1 55 CYS HA H -5.642 -13.531 3.621 1.00 . A A . 55 CYS HA 1 1 6 5316 1 1 55 CYS HB2 H -8.008 -14.717 2.331 1.00 . A A . 55 CYS HB2 1 1 6 5317 1 1 55 CYS HB3 H -7.889 -13.692 3.757 1.00 . A A . 55 CYS HB3 1 1 6 5318 1 1 55 CYS HG H -8.461 -12.850 0.551 1.00 . A A . 55 CYS HG 1 1 6 5319 1 1 55 CYS N N -5.468 -13.224 1.595 1.00 . A A . 55 CYS N 1 1 6 5320 1 1 55 CYS O O -5.016 -15.936 3.624 1.00 . A A . 55 CYS O 1 1 6 5321 1 1 55 CYS SG S -8.180 -12.418 1.776 1.00 . A A . 55 CYS SG 1 1 6 5322 1 1 56 PRO C C -4.057 -17.741 0.983 1.00 . A A . 56 PRO C 1 1 6 5323 1 1 56 PRO CA C -5.501 -17.580 1.450 1.00 . A A . 56 PRO CA 1 1 6 5324 1 1 56 PRO CB C -6.472 -18.113 0.401 1.00 . A A . 56 PRO CB 1 1 6 5325 1 1 56 PRO CD C -6.562 -15.705 0.337 1.00 . A A . 56 PRO CD 1 1 6 5326 1 1 56 PRO CG C -6.735 -16.952 -0.497 1.00 . A A . 56 PRO CG 1 1 6 5327 1 1 56 PRO HA H -5.641 -18.111 2.380 1.00 . A A . 56 PRO HA 1 1 6 5328 1 1 56 PRO HB2 H -6.014 -18.931 -0.136 1.00 . A A . 56 PRO HB2 1 1 6 5329 1 1 56 PRO HB3 H -7.378 -18.451 0.881 1.00 . A A . 56 PRO HB3 1 1 6 5330 1 1 56 PRO HD2 H -5.949 -14.986 -0.184 1.00 . A A . 56 PRO HD2 1 1 6 5331 1 1 56 PRO HD3 H -7.525 -15.277 0.572 1.00 . A A . 56 PRO HD3 1 1 6 5332 1 1 56 PRO HG2 H -6.029 -16.953 -1.313 1.00 . A A . 56 PRO HG2 1 1 6 5333 1 1 56 PRO HG3 H -7.745 -17.006 -0.876 1.00 . A A . 56 PRO HG3 1 1 6 5334 1 1 56 PRO N N -5.888 -16.176 1.567 1.00 . A A . 56 PRO N 1 1 6 5335 1 1 56 PRO O O -3.749 -18.598 0.154 1.00 . A A . 56 PRO O 1 1 6 5336 1 1 57 ALA C C -0.913 -16.396 2.297 1.00 . A A . 57 ALA C 1 1 6 5337 1 1 57 ALA CA C -1.769 -16.940 1.163 1.00 . A A . 57 ALA CA 1 1 6 5338 1 1 57 ALA CB C -1.526 -16.137 -0.106 1.00 . A A . 57 ALA CB 1 1 6 5339 1 1 57 ALA H H -3.484 -16.251 2.185 1.00 . A A . 57 ALA H 1 1 6 5340 1 1 57 ALA HA H -1.493 -17.966 0.973 1.00 . A A . 57 ALA HA 1 1 6 5341 1 1 57 ALA HB1 H -1.204 -16.800 -0.895 1.00 . A A . 57 ALA HB1 1 1 6 5342 1 1 57 ALA HB2 H -2.441 -15.643 -0.400 1.00 . A A . 57 ALA HB2 1 1 6 5343 1 1 57 ALA HB3 H -0.761 -15.398 0.079 1.00 . A A . 57 ALA HB3 1 1 6 5344 1 1 57 ALA N N -3.177 -16.906 1.519 1.00 . A A . 57 ALA N 1 1 6 5345 1 1 57 ALA O O -1.377 -15.590 3.107 1.00 . A A . 57 ALA O 1 1 6 5346 1 1 58 LEU C C 2.070 -15.157 2.789 1.00 . A A . 58 LEU C 1 1 6 5347 1 1 58 LEU CA C 1.284 -16.342 3.335 1.00 . A A . 58 LEU CA 1 1 6 5348 1 1 58 LEU CB C 2.239 -17.467 3.741 1.00 . A A . 58 LEU CB 1 1 6 5349 1 1 58 LEU CD1 C 1.271 -19.765 4.019 1.00 . A A . 58 LEU CD1 1 1 6 5350 1 1 58 LEU CD2 C 2.666 -18.767 5.841 1.00 . A A . 58 LEU CD2 1 1 6 5351 1 1 58 LEU CG C 1.664 -18.481 4.734 1.00 . A A . 58 LEU CG 1 1 6 5352 1 1 58 LEU H H 0.656 -17.442 1.640 1.00 . A A . 58 LEU H 1 1 6 5353 1 1 58 LEU HA H 0.721 -16.022 4.199 1.00 . A A . 58 LEU HA 1 1 6 5354 1 1 58 LEU HB2 H 2.536 -17.999 2.849 1.00 . A A . 58 LEU HB2 1 1 6 5355 1 1 58 LEU HB3 H 3.119 -17.024 4.184 1.00 . A A . 58 LEU HB3 1 1 6 5356 1 1 58 LEU HD11 H 0.685 -19.525 3.144 1.00 . A A . 58 LEU HD11 1 1 6 5357 1 1 58 LEU HD12 H 2.161 -20.299 3.720 1.00 . A A . 58 LEU HD12 1 1 6 5358 1 1 58 LEU HD13 H 0.686 -20.383 4.685 1.00 . A A . 58 LEU HD13 1 1 6 5359 1 1 58 LEU HD21 H 3.550 -18.162 5.695 1.00 . A A . 58 LEU HD21 1 1 6 5360 1 1 58 LEU HD22 H 2.223 -18.530 6.798 1.00 . A A . 58 LEU HD22 1 1 6 5361 1 1 58 LEU HD23 H 2.939 -19.812 5.820 1.00 . A A . 58 LEU HD23 1 1 6 5362 1 1 58 LEU HG H 0.773 -18.067 5.186 1.00 . A A . 58 LEU HG 1 1 6 5363 1 1 58 LEU N N 0.343 -16.816 2.331 1.00 . A A . 58 LEU N 1 1 6 5364 1 1 58 LEU O O 2.783 -15.282 1.793 1.00 . A A . 58 LEU O 1 1 6 5365 1 1 59 LYS C C 3.836 -12.532 3.579 1.00 . A A . 59 LYS C 1 1 6 5366 1 1 59 LYS CA C 2.502 -12.777 2.887 1.00 . A A . 59 LYS CA 1 1 6 5367 1 1 59 LYS CB C 1.584 -11.571 3.079 1.00 . A A . 59 LYS CB 1 1 6 5368 1 1 59 LYS CD C 2.334 -10.713 0.831 1.00 . A A . 59 LYS CD 1 1 6 5369 1 1 59 LYS CE C 2.089 -11.379 -0.514 1.00 . A A . 59 LYS CE 1 1 6 5370 1 1 59 LYS CG C 1.157 -10.916 1.774 1.00 . A A . 59 LYS CG 1 1 6 5371 1 1 59 LYS H H 1.234 -13.932 4.130 1.00 . A A . 59 LYS H 1 1 6 5372 1 1 59 LYS HA H 2.684 -12.910 1.832 1.00 . A A . 59 LYS HA 1 1 6 5373 1 1 59 LYS HB2 H 0.698 -11.887 3.608 1.00 . A A . 59 LYS HB2 1 1 6 5374 1 1 59 LYS HB3 H 2.102 -10.832 3.674 1.00 . A A . 59 LYS HB3 1 1 6 5375 1 1 59 LYS HD2 H 2.480 -9.654 0.675 1.00 . A A . 59 LYS HD2 1 1 6 5376 1 1 59 LYS HD3 H 3.218 -11.139 1.278 1.00 . A A . 59 LYS HD3 1 1 6 5377 1 1 59 LYS HE2 H 2.105 -12.449 -0.377 1.00 . A A . 59 LYS HE2 1 1 6 5378 1 1 59 LYS HE3 H 1.119 -11.079 -0.881 1.00 . A A . 59 LYS HE3 1 1 6 5379 1 1 59 LYS HG2 H 0.426 -11.547 1.289 1.00 . A A . 59 LYS HG2 1 1 6 5380 1 1 59 LYS HG3 H 0.715 -9.956 1.995 1.00 . A A . 59 LYS HG3 1 1 6 5381 1 1 59 LYS HZ1 H 3.002 -10.009 -1.804 1.00 . A A . 59 LYS HZ1 1 1 6 5382 1 1 59 LYS HZ2 H 3.037 -11.613 -2.356 1.00 . A A . 59 LYS HZ2 1 1 6 5383 1 1 59 LYS HZ3 H 4.076 -11.126 -1.113 1.00 . A A . 59 LYS HZ3 1 1 6 5384 1 1 59 LYS N N 1.868 -13.990 3.379 1.00 . A A . 59 LYS N 1 1 6 5385 1 1 59 LYS NZ N 3.121 -11.006 -1.516 1.00 . A A . 59 LYS NZ 1 1 6 5386 1 1 59 LYS O O 4.035 -11.500 4.222 1.00 . A A . 59 LYS O 1 1 6 5387 1 1 60 GLY C C 6.893 -12.277 3.059 1.00 . A A . 60 GLY C 1 1 6 5388 1 1 60 GLY CA C 6.107 -13.258 3.898 1.00 . A A . 60 GLY CA 1 1 6 5389 1 1 60 GLY H H 4.578 -14.213 2.793 1.00 . A A . 60 GLY H 1 1 6 5390 1 1 60 GLY HA2 H 6.037 -12.885 4.909 1.00 . A A . 60 GLY HA2 1 1 6 5391 1 1 60 GLY HA3 H 6.621 -14.207 3.904 1.00 . A A . 60 GLY HA3 1 1 6 5392 1 1 60 GLY N N 4.774 -13.442 3.369 1.00 . A A . 60 GLY N 1 1 6 5393 1 1 60 GLY O O 7.627 -11.438 3.586 1.00 . A A . 60 GLY O 1 1 6 5394 1 1 61 LYS C C 6.276 -10.974 -0.223 1.00 . A A . 61 LYS C 1 1 6 5395 1 1 61 LYS CA C 7.289 -11.406 0.824 1.00 . A A . 61 LYS CA 1 1 6 5396 1 1 61 LYS CB C 8.500 -12.056 0.149 1.00 . A A . 61 LYS CB 1 1 6 5397 1 1 61 LYS CD C 10.237 -10.972 1.603 1.00 . A A . 61 LYS CD 1 1 6 5398 1 1 61 LYS CE C 10.085 -9.520 2.020 1.00 . A A . 61 LYS CE 1 1 6 5399 1 1 61 LYS CG C 9.752 -11.195 0.181 1.00 . A A . 61 LYS CG 1 1 6 5400 1 1 61 LYS H H 6.015 -12.982 1.412 1.00 . A A . 61 LYS H 1 1 6 5401 1 1 61 LYS HA H 7.615 -10.539 1.381 1.00 . A A . 61 LYS HA 1 1 6 5402 1 1 61 LYS HB2 H 8.717 -12.989 0.647 1.00 . A A . 61 LYS HB2 1 1 6 5403 1 1 61 LYS HB3 H 8.255 -12.259 -0.883 1.00 . A A . 61 LYS HB3 1 1 6 5404 1 1 61 LYS HD2 H 9.658 -11.589 2.272 1.00 . A A . 61 LYS HD2 1 1 6 5405 1 1 61 LYS HD3 H 11.279 -11.246 1.666 1.00 . A A . 61 LYS HD3 1 1 6 5406 1 1 61 LYS HE2 H 10.477 -8.891 1.235 1.00 . A A . 61 LYS HE2 1 1 6 5407 1 1 61 LYS HE3 H 9.036 -9.307 2.160 1.00 . A A . 61 LYS HE3 1 1 6 5408 1 1 61 LYS HG2 H 10.530 -11.687 -0.381 1.00 . A A . 61 LYS HG2 1 1 6 5409 1 1 61 LYS HG3 H 9.531 -10.238 -0.268 1.00 . A A . 61 LYS HG3 1 1 6 5410 1 1 61 LYS HZ1 H 11.143 -8.239 3.281 1.00 . A A . 61 LYS HZ1 1 1 6 5411 1 1 61 LYS HZ2 H 11.637 -9.858 3.380 1.00 . A A . 61 LYS HZ2 1 1 6 5412 1 1 61 LYS HZ3 H 10.182 -9.367 4.104 1.00 . A A . 61 LYS HZ3 1 1 6 5413 1 1 61 LYS N N 6.667 -12.330 1.756 1.00 . A A . 61 LYS N 1 1 6 5414 1 1 61 LYS NZ N 10.811 -9.225 3.284 1.00 . A A . 61 LYS NZ 1 1 6 5415 1 1 61 LYS O O 6.227 -9.774 -0.553 1.00 . A A . 61 LYS O 1 1 6 5416 1 1 61 LYS OXT O 5.510 -11.842 -0.694 1.00 . A A . 61 LYS OXT 1 1 6 5417 2 2 1 ZN ZN ZN -4.894 -5.497 -2.302 1.00 . B A . 62 ZN ZN 1 1 6 5418 3 2 1 ZN ZN ZN 4.311 4.704 4.283 1.00 . C A . 63 ZN ZN 1 1 7 5419 1 1 1 GLY C C -10.221 8.096 4.093 1.00 . A A . 1 GLY C 1 1 7 5420 1 1 1 GLY CA C -10.916 8.722 2.903 1.00 . A A . 1 GLY CA 1 1 7 5421 1 1 1 GLY H1 H -10.745 8.121 0.917 1.00 . A A . 1 GLY H1 1 1 7 5422 1 1 1 GLY H2 H -12.146 7.558 1.690 1.00 . A A . 1 GLY H2 1 1 7 5423 1 1 1 GLY H3 H -10.644 6.850 2.035 1.00 . A A . 1 GLY H3 1 1 7 5424 1 1 1 GLY HA2 H -10.315 9.539 2.534 1.00 . A A . 1 GLY HA2 1 1 7 5425 1 1 1 GLY HA3 H -11.874 9.107 3.220 1.00 . A A . 1 GLY HA3 1 1 7 5426 1 1 1 GLY N N -11.129 7.747 1.812 1.00 . A A . 1 GLY N 1 1 7 5427 1 1 1 GLY O O -10.191 6.871 4.221 1.00 . A A . 1 GLY O 1 1 7 5428 1 1 2 PRO C C -9.777 7.727 7.140 1.00 . A A . 2 PRO C 1 1 7 5429 1 1 2 PRO CA C -8.871 8.431 6.134 1.00 . A A . 2 PRO CA 1 1 7 5430 1 1 2 PRO CB C -8.286 9.706 6.755 1.00 . A A . 2 PRO CB 1 1 7 5431 1 1 2 PRO CD C -9.548 10.381 4.851 1.00 . A A . 2 PRO CD 1 1 7 5432 1 1 2 PRO CG C -8.350 10.733 5.679 1.00 . A A . 2 PRO CG 1 1 7 5433 1 1 2 PRO HA H -8.069 7.766 5.845 1.00 . A A . 2 PRO HA 1 1 7 5434 1 1 2 PRO HB2 H -8.881 9.994 7.609 1.00 . A A . 2 PRO HB2 1 1 7 5435 1 1 2 PRO HB3 H -7.268 9.523 7.065 1.00 . A A . 2 PRO HB3 1 1 7 5436 1 1 2 PRO HD2 H -10.437 10.839 5.259 1.00 . A A . 2 PRO HD2 1 1 7 5437 1 1 2 PRO HD3 H -9.402 10.685 3.825 1.00 . A A . 2 PRO HD3 1 1 7 5438 1 1 2 PRO HG2 H -8.471 11.715 6.115 1.00 . A A . 2 PRO HG2 1 1 7 5439 1 1 2 PRO HG3 H -7.452 10.695 5.078 1.00 . A A . 2 PRO HG3 1 1 7 5440 1 1 2 PRO N N -9.611 8.916 4.965 1.00 . A A . 2 PRO N 1 1 7 5441 1 1 2 PRO O O -9.357 6.789 7.820 1.00 . A A . 2 PRO O 1 1 7 5442 1 1 3 LEU C C -13.168 7.028 7.400 1.00 . A A . 3 LEU C 1 1 7 5443 1 1 3 LEU CA C -11.982 7.611 8.158 1.00 . A A . 3 LEU CA 1 1 7 5444 1 1 3 LEU CB C -12.466 8.672 9.152 1.00 . A A . 3 LEU CB 1 1 7 5445 1 1 3 LEU CD1 C -11.981 10.737 10.483 1.00 . A A . 3 LEU CD1 1 1 7 5446 1 1 3 LEU CD2 C -10.516 8.728 10.728 1.00 . A A . 3 LEU CD2 1 1 7 5447 1 1 3 LEU CG C -11.368 9.543 9.770 1.00 . A A . 3 LEU CG 1 1 7 5448 1 1 3 LEU H H -11.297 8.926 6.646 1.00 . A A . 3 LEU H 1 1 7 5449 1 1 3 LEU HA H -11.488 6.817 8.700 1.00 . A A . 3 LEU HA 1 1 7 5450 1 1 3 LEU HB2 H -13.165 9.318 8.643 1.00 . A A . 3 LEU HB2 1 1 7 5451 1 1 3 LEU HB3 H -12.986 8.169 9.954 1.00 . A A . 3 LEU HB3 1 1 7 5452 1 1 3 LEU HD11 H -12.985 10.898 10.119 1.00 . A A . 3 LEU HD11 1 1 7 5453 1 1 3 LEU HD12 H -12.011 10.543 11.544 1.00 . A A . 3 LEU HD12 1 1 7 5454 1 1 3 LEU HD13 H -11.384 11.618 10.295 1.00 . A A . 3 LEU HD13 1 1 7 5455 1 1 3 LEU HD21 H -10.691 9.063 11.739 1.00 . A A . 3 LEU HD21 1 1 7 5456 1 1 3 LEU HD22 H -10.779 7.684 10.645 1.00 . A A . 3 LEU HD22 1 1 7 5457 1 1 3 LEU HD23 H -9.472 8.857 10.481 1.00 . A A . 3 LEU HD23 1 1 7 5458 1 1 3 LEU HG H -10.727 9.916 8.984 1.00 . A A . 3 LEU HG 1 1 7 5459 1 1 3 LEU N N -11.019 8.184 7.227 1.00 . A A . 3 LEU N 1 1 7 5460 1 1 3 LEU O O -14.324 7.345 7.683 1.00 . A A . 3 LEU O 1 1 7 5461 1 1 4 GLY C C -14.236 6.575 4.399 1.00 . A A . 4 GLY C 1 1 7 5462 1 1 4 GLY CA C -13.911 5.665 5.561 1.00 . A A . 4 GLY CA 1 1 7 5463 1 1 4 GLY H H -11.927 6.056 6.174 1.00 . A A . 4 GLY H 1 1 7 5464 1 1 4 GLY HA2 H -13.583 4.709 5.178 1.00 . A A . 4 GLY HA2 1 1 7 5465 1 1 4 GLY HA3 H -14.800 5.522 6.155 1.00 . A A . 4 GLY HA3 1 1 7 5466 1 1 4 GLY N N -12.869 6.223 6.393 1.00 . A A . 4 GLY N 1 1 7 5467 1 1 4 GLY O O -13.448 7.462 4.080 1.00 . A A . 4 GLY O 1 1 7 5468 1 1 5 SER C C -14.897 7.062 1.475 1.00 . A A . 5 SER C 1 1 7 5469 1 1 5 SER CA C -15.853 7.191 2.665 1.00 . A A . 5 SER CA 1 1 7 5470 1 1 5 SER CB C -15.999 8.662 3.075 1.00 . A A . 5 SER CB 1 1 7 5471 1 1 5 SER H H -15.993 5.659 4.128 1.00 . A A . 5 SER H 1 1 7 5472 1 1 5 SER HA H -16.821 6.820 2.363 1.00 . A A . 5 SER HA 1 1 7 5473 1 1 5 SER HB2 H -15.031 9.139 3.041 1.00 . A A . 5 SER HB2 1 1 7 5474 1 1 5 SER HB3 H -16.671 9.157 2.391 1.00 . A A . 5 SER HB3 1 1 7 5475 1 1 5 SER HG H -17.072 8.007 4.588 1.00 . A A . 5 SER HG 1 1 7 5476 1 1 5 SER N N -15.404 6.377 3.797 1.00 . A A . 5 SER N 1 1 7 5477 1 1 5 SER O O -13.845 7.704 1.434 1.00 . A A . 5 SER O 1 1 7 5478 1 1 5 SER OG O -16.519 8.779 4.391 1.00 . A A . 5 SER OG 1 1 7 5479 1 1 6 ASP C C -13.234 5.036 -0.266 1.00 . A A . 6 ASP C 1 1 7 5480 1 1 6 ASP CA C -14.450 5.878 -0.638 1.00 . A A . 6 ASP CA 1 1 7 5481 1 1 6 ASP CB C -14.010 7.153 -1.370 1.00 . A A . 6 ASP CB 1 1 7 5482 1 1 6 ASP CG C -13.322 6.865 -2.690 1.00 . A A . 6 ASP CG 1 1 7 5483 1 1 6 ASP H H -16.094 5.670 0.681 1.00 . A A . 6 ASP H 1 1 7 5484 1 1 6 ASP HA H -15.067 5.295 -1.307 1.00 . A A . 6 ASP HA 1 1 7 5485 1 1 6 ASP HB2 H -14.879 7.762 -1.566 1.00 . A A . 6 ASP HB2 1 1 7 5486 1 1 6 ASP HB3 H -13.326 7.703 -0.740 1.00 . A A . 6 ASP HB3 1 1 7 5487 1 1 6 ASP N N -15.260 6.179 0.545 1.00 . A A . 6 ASP N 1 1 7 5488 1 1 6 ASP O O -12.388 5.444 0.530 1.00 . A A . 6 ASP O 1 1 7 5489 1 1 6 ASP OD1 O -13.255 5.687 -3.090 1.00 . A A . 6 ASP OD1 1 1 7 5490 1 1 6 ASP OD2 O -12.854 7.821 -3.344 1.00 . A A . 6 ASP OD2 1 1 7 5491 1 1 7 HIS C C -10.849 3.245 -1.427 1.00 . A A . 7 HIS C 1 1 7 5492 1 1 7 HIS CA C -12.072 2.917 -0.573 1.00 . A A . 7 HIS CA 1 1 7 5493 1 1 7 HIS CB C -12.510 1.465 -0.828 1.00 . A A . 7 HIS CB 1 1 7 5494 1 1 7 HIS CD2 C -13.824 1.397 -3.044 1.00 . A A . 7 HIS CD2 1 1 7 5495 1 1 7 HIS CE1 C -15.800 1.087 -2.184 1.00 . A A . 7 HIS CE1 1 1 7 5496 1 1 7 HIS CG C -13.722 1.336 -1.696 1.00 . A A . 7 HIS CG 1 1 7 5497 1 1 7 HIS H H -13.874 3.577 -1.462 1.00 . A A . 7 HIS H 1 1 7 5498 1 1 7 HIS HA H -11.806 3.021 0.467 1.00 . A A . 7 HIS HA 1 1 7 5499 1 1 7 HIS HB2 H -11.704 0.934 -1.309 1.00 . A A . 7 HIS HB2 1 1 7 5500 1 1 7 HIS HB3 H -12.728 0.994 0.120 1.00 . A A . 7 HIS HB3 1 1 7 5501 1 1 7 HIS HD2 H -13.018 1.537 -3.748 1.00 . A A . 7 HIS HD2 1 1 7 5502 1 1 7 HIS HE1 H -16.864 0.941 -2.096 1.00 . A A . 7 HIS HE1 1 1 7 5503 1 1 7 HIS HE2 H -15.527 1.095 -4.245 1.00 . A A . 7 HIS HE2 1 1 7 5504 1 1 7 HIS N N -13.163 3.847 -0.843 1.00 . A A . 7 HIS N 1 1 7 5505 1 1 7 HIS ND1 N -14.971 1.138 -1.157 1.00 . A A . 7 HIS ND1 1 1 7 5506 1 1 7 HIS NE2 N -15.150 1.238 -3.345 1.00 . A A . 7 HIS NE2 1 1 7 5507 1 1 7 HIS O O -9.780 2.660 -1.242 1.00 . A A . 7 HIS O 1 1 7 5508 1 1 8 HIS C C -8.954 5.523 -2.409 1.00 . A A . 8 HIS C 1 1 7 5509 1 1 8 HIS CA C -9.901 4.623 -3.194 1.00 . A A . 8 HIS CA 1 1 7 5510 1 1 8 HIS CB C -10.428 5.363 -4.428 1.00 . A A . 8 HIS CB 1 1 7 5511 1 1 8 HIS CD2 C -8.591 4.809 -6.152 1.00 . A A . 8 HIS CD2 1 1 7 5512 1 1 8 HIS CE1 C -9.892 3.991 -7.694 1.00 . A A . 8 HIS CE1 1 1 7 5513 1 1 8 HIS CG C -9.874 4.853 -5.722 1.00 . A A . 8 HIS CG 1 1 7 5514 1 1 8 HIS H H -11.877 4.643 -2.429 1.00 . A A . 8 HIS H 1 1 7 5515 1 1 8 HIS HA H -9.365 3.743 -3.512 1.00 . A A . 8 HIS HA 1 1 7 5516 1 1 8 HIS HB2 H -11.502 5.263 -4.466 1.00 . A A . 8 HIS HB2 1 1 7 5517 1 1 8 HIS HB3 H -10.172 6.409 -4.346 1.00 . A A . 8 HIS HB3 1 1 7 5518 1 1 8 HIS HD2 H -7.717 5.138 -5.612 1.00 . A A . 8 HIS HD2 1 1 7 5519 1 1 8 HIS HE1 H -10.229 3.551 -8.620 1.00 . A A . 8 HIS HE1 1 1 7 5520 1 1 8 HIS HE2 H -7.865 4.269 -8.053 1.00 . A A . 8 HIS HE2 1 1 7 5521 1 1 8 HIS N N -11.003 4.194 -2.344 1.00 . A A . 8 HIS N 1 1 7 5522 1 1 8 HIS ND1 N -10.692 4.337 -6.698 1.00 . A A . 8 HIS ND1 1 1 7 5523 1 1 8 HIS NE2 N -8.612 4.259 -7.407 1.00 . A A . 8 HIS NE2 1 1 7 5524 1 1 8 HIS O O -9.156 6.736 -2.325 1.00 . A A . 8 HIS O 1 1 7 5525 1 1 9 MET C C -5.909 6.255 -1.807 1.00 . A A . 9 MET C 1 1 7 5526 1 1 9 MET CA C -7.009 5.634 -0.957 1.00 . A A . 9 MET CA 1 1 7 5527 1 1 9 MET CB C -6.400 4.696 0.087 1.00 . A A . 9 MET CB 1 1 7 5528 1 1 9 MET CE C -7.113 4.637 4.085 1.00 . A A . 9 MET CE 1 1 7 5529 1 1 9 MET CG C -6.384 5.276 1.490 1.00 . A A . 9 MET CG 1 1 7 5530 1 1 9 MET H H -7.878 3.934 -1.869 1.00 . A A . 9 MET H 1 1 7 5531 1 1 9 MET HA H -7.545 6.424 -0.450 1.00 . A A . 9 MET HA 1 1 7 5532 1 1 9 MET HB2 H -6.971 3.779 0.108 1.00 . A A . 9 MET HB2 1 1 7 5533 1 1 9 MET HB3 H -5.382 4.471 -0.197 1.00 . A A . 9 MET HB3 1 1 7 5534 1 1 9 MET HE1 H -6.641 4.422 5.033 1.00 . A A . 9 MET HE1 1 1 7 5535 1 1 9 MET HE2 H -7.242 5.705 3.982 1.00 . A A . 9 MET HE2 1 1 7 5536 1 1 9 MET HE3 H -8.077 4.153 4.044 1.00 . A A . 9 MET HE3 1 1 7 5537 1 1 9 MET HG2 H -5.606 6.023 1.549 1.00 . A A . 9 MET HG2 1 1 7 5538 1 1 9 MET HG3 H -7.341 5.739 1.683 1.00 . A A . 9 MET HG3 1 1 7 5539 1 1 9 MET N N -7.960 4.910 -1.788 1.00 . A A . 9 MET N 1 1 7 5540 1 1 9 MET O O -5.458 5.660 -2.788 1.00 . A A . 9 MET O 1 1 7 5541 1 1 9 MET SD S -6.080 4.027 2.755 1.00 . A A . 9 MET SD 1 1 7 5542 1 1 10 GLU C C -3.252 8.431 -1.262 1.00 . A A . 10 GLU C 1 1 7 5543 1 1 10 GLU CA C -4.452 8.175 -2.168 1.00 . A A . 10 GLU CA 1 1 7 5544 1 1 10 GLU CB C -4.984 9.508 -2.715 1.00 . A A . 10 GLU CB 1 1 7 5545 1 1 10 GLU CD C -6.890 10.392 -1.303 1.00 . A A . 10 GLU CD 1 1 7 5546 1 1 10 GLU CG C -6.491 9.685 -2.583 1.00 . A A . 10 GLU CG 1 1 7 5547 1 1 10 GLU H H -5.906 7.891 -0.658 1.00 . A A . 10 GLU H 1 1 7 5548 1 1 10 GLU HA H -4.141 7.553 -2.995 1.00 . A A . 10 GLU HA 1 1 7 5549 1 1 10 GLU HB2 H -4.505 10.316 -2.181 1.00 . A A . 10 GLU HB2 1 1 7 5550 1 1 10 GLU HB3 H -4.726 9.582 -3.761 1.00 . A A . 10 GLU HB3 1 1 7 5551 1 1 10 GLU HG2 H -6.845 10.266 -3.422 1.00 . A A . 10 GLU HG2 1 1 7 5552 1 1 10 GLU HG3 H -6.958 8.710 -2.600 1.00 . A A . 10 GLU HG3 1 1 7 5553 1 1 10 GLU N N -5.494 7.461 -1.438 1.00 . A A . 10 GLU N 1 1 7 5554 1 1 10 GLU O O -2.491 9.382 -1.468 1.00 . A A . 10 GLU O 1 1 7 5555 1 1 10 GLU OE1 O -6.045 11.095 -0.711 1.00 . A A . 10 GLU OE1 1 1 7 5556 1 1 10 GLU OE2 O -8.056 10.249 -0.882 1.00 . A A . 10 GLU OE2 1 1 7 5557 1 1 11 PHE C C -1.832 6.440 1.506 1.00 . A A . 11 PHE C 1 1 7 5558 1 1 11 PHE CA C -2.021 7.736 0.722 1.00 . A A . 11 PHE CA 1 1 7 5559 1 1 11 PHE CB C -2.314 8.899 1.685 1.00 . A A . 11 PHE CB 1 1 7 5560 1 1 11 PHE CD1 C -4.762 8.637 2.202 1.00 . A A . 11 PHE CD1 1 1 7 5561 1 1 11 PHE CD2 C -3.197 8.401 3.984 1.00 . A A . 11 PHE CD2 1 1 7 5562 1 1 11 PHE CE1 C -5.801 8.399 3.081 1.00 . A A . 11 PHE CE1 1 1 7 5563 1 1 11 PHE CE2 C -4.233 8.160 4.866 1.00 . A A . 11 PHE CE2 1 1 7 5564 1 1 11 PHE CG C -3.448 8.639 2.642 1.00 . A A . 11 PHE CG 1 1 7 5565 1 1 11 PHE CZ C -5.537 8.159 4.414 1.00 . A A . 11 PHE CZ 1 1 7 5566 1 1 11 PHE H H -3.735 6.852 -0.139 1.00 . A A . 11 PHE H 1 1 7 5567 1 1 11 PHE HA H -1.113 7.950 0.178 1.00 . A A . 11 PHE HA 1 1 7 5568 1 1 11 PHE HB2 H -1.431 9.102 2.270 1.00 . A A . 11 PHE HB2 1 1 7 5569 1 1 11 PHE HB3 H -2.564 9.776 1.108 1.00 . A A . 11 PHE HB3 1 1 7 5570 1 1 11 PHE HD1 H -4.972 8.819 1.158 1.00 . A A . 11 PHE HD1 1 1 7 5571 1 1 11 PHE HD2 H -2.176 8.402 4.340 1.00 . A A . 11 PHE HD2 1 1 7 5572 1 1 11 PHE HE1 H -6.820 8.399 2.724 1.00 . A A . 11 PHE HE1 1 1 7 5573 1 1 11 PHE HE2 H -4.024 7.972 5.908 1.00 . A A . 11 PHE HE2 1 1 7 5574 1 1 11 PHE HZ H -6.350 7.972 5.101 1.00 . A A . 11 PHE HZ 1 1 7 5575 1 1 11 PHE N N -3.101 7.591 -0.245 1.00 . A A . 11 PHE N 1 1 7 5576 1 1 11 PHE O O -2.672 5.540 1.439 1.00 . A A . 11 PHE O 1 1 7 5577 1 1 12 CYS C C -1.462 5.095 4.228 1.00 . A A . 12 CYS C 1 1 7 5578 1 1 12 CYS CA C -0.461 5.192 3.086 1.00 . A A . 12 CYS CA 1 1 7 5579 1 1 12 CYS CB C 0.946 5.263 3.671 1.00 . A A . 12 CYS CB 1 1 7 5580 1 1 12 CYS H H -0.106 7.112 2.255 1.00 . A A . 12 CYS H 1 1 7 5581 1 1 12 CYS HA H -0.545 4.310 2.466 1.00 . A A . 12 CYS HA 1 1 7 5582 1 1 12 CYS HB2 H 1.161 6.282 3.946 1.00 . A A . 12 CYS HB2 1 1 7 5583 1 1 12 CYS HB3 H 0.991 4.641 4.555 1.00 . A A . 12 CYS HB3 1 1 7 5584 1 1 12 CYS HG H 3.266 5.577 2.676 1.00 . A A . 12 CYS HG 1 1 7 5585 1 1 12 CYS N N -0.739 6.359 2.254 1.00 . A A . 12 CYS N 1 1 7 5586 1 1 12 CYS O O -1.596 6.020 5.026 1.00 . A A . 12 CYS O 1 1 7 5587 1 1 12 CYS SG S 2.249 4.718 2.553 1.00 . A A . 12 CYS SG 1 1 7 5588 1 1 13 ARG C C -2.529 3.760 6.767 1.00 . A A . 13 ARG C 1 1 7 5589 1 1 13 ARG CA C -3.146 3.747 5.362 1.00 . A A . 13 ARG CA 1 1 7 5590 1 1 13 ARG CB C -3.872 2.420 5.133 1.00 . A A . 13 ARG CB 1 1 7 5591 1 1 13 ARG CD C -3.750 -0.020 5.711 1.00 . A A . 13 ARG CD 1 1 7 5592 1 1 13 ARG CG C -2.971 1.204 5.268 1.00 . A A . 13 ARG CG 1 1 7 5593 1 1 13 ARG CZ C -5.727 -0.740 4.431 1.00 . A A . 13 ARG CZ 1 1 7 5594 1 1 13 ARG H H -2.005 3.271 3.629 1.00 . A A . 13 ARG H 1 1 7 5595 1 1 13 ARG HA H -3.866 4.550 5.295 1.00 . A A . 13 ARG HA 1 1 7 5596 1 1 13 ARG HB2 H -4.670 2.331 5.856 1.00 . A A . 13 ARG HB2 1 1 7 5597 1 1 13 ARG HB3 H -4.295 2.420 4.141 1.00 . A A . 13 ARG HB3 1 1 7 5598 1 1 13 ARG HD2 H -3.071 -0.720 6.177 1.00 . A A . 13 ARG HD2 1 1 7 5599 1 1 13 ARG HD3 H -4.500 0.283 6.425 1.00 . A A . 13 ARG HD3 1 1 7 5600 1 1 13 ARG HE H -3.822 -1.091 3.901 1.00 . A A . 13 ARG HE 1 1 7 5601 1 1 13 ARG HG2 H -2.511 0.999 4.313 1.00 . A A . 13 ARG HG2 1 1 7 5602 1 1 13 ARG HG3 H -2.206 1.415 6.001 1.00 . A A . 13 ARG HG3 1 1 7 5603 1 1 13 ARG HH11 H -6.154 0.251 6.157 1.00 . A A . 13 ARG HH11 1 1 7 5604 1 1 13 ARG HH12 H -7.535 -0.258 5.223 1.00 . A A . 13 ARG HH12 1 1 7 5605 1 1 13 ARG HH21 H -5.626 -1.758 2.680 1.00 . A A . 13 ARG HH21 1 1 7 5606 1 1 13 ARG HH22 H -7.234 -1.410 3.245 1.00 . A A . 13 ARG HH22 1 1 7 5607 1 1 13 ARG N N -2.145 3.964 4.315 1.00 . A A . 13 ARG N 1 1 7 5608 1 1 13 ARG NE N -4.406 -0.676 4.587 1.00 . A A . 13 ARG NE 1 1 7 5609 1 1 13 ARG NH1 N -6.535 -0.207 5.342 1.00 . A A . 13 ARG NH1 1 1 7 5610 1 1 13 ARG NH2 N -6.235 -1.347 3.370 1.00 . A A . 13 ARG NH2 1 1 7 5611 1 1 13 ARG O O -3.248 3.821 7.765 1.00 . A A . 13 ARG O 1 1 7 5612 1 1 14 VAL C C 0.369 4.870 8.293 1.00 . A A . 14 VAL C 1 1 7 5613 1 1 14 VAL CA C -0.503 3.626 8.123 1.00 . A A . 14 VAL CA 1 1 7 5614 1 1 14 VAL CB C 0.400 2.375 8.243 1.00 . A A . 14 VAL CB 1 1 7 5615 1 1 14 VAL CG1 C 0.499 1.923 9.687 1.00 . A A . 14 VAL CG1 1 1 7 5616 1 1 14 VAL CG2 C -0.101 1.240 7.360 1.00 . A A . 14 VAL CG2 1 1 7 5617 1 1 14 VAL H H -0.687 3.606 6.015 1.00 . A A . 14 VAL H 1 1 7 5618 1 1 14 VAL HA H -1.239 3.597 8.913 1.00 . A A . 14 VAL HA 1 1 7 5619 1 1 14 VAL HB H 1.393 2.645 7.910 1.00 . A A . 14 VAL HB 1 1 7 5620 1 1 14 VAL HG11 H -0.493 1.853 10.110 1.00 . A A . 14 VAL HG11 1 1 7 5621 1 1 14 VAL HG12 H 0.976 0.955 9.727 1.00 . A A . 14 VAL HG12 1 1 7 5622 1 1 14 VAL HG13 H 1.082 2.636 10.251 1.00 . A A . 14 VAL HG13 1 1 7 5623 1 1 14 VAL HG21 H -1.162 1.352 7.196 1.00 . A A . 14 VAL HG21 1 1 7 5624 1 1 14 VAL HG22 H 0.414 1.268 6.408 1.00 . A A . 14 VAL HG22 1 1 7 5625 1 1 14 VAL HG23 H 0.090 0.295 7.846 1.00 . A A . 14 VAL HG23 1 1 7 5626 1 1 14 VAL N N -1.204 3.662 6.842 1.00 . A A . 14 VAL N 1 1 7 5627 1 1 14 VAL O O 0.128 5.712 9.155 1.00 . A A . 14 VAL O 1 1 7 5628 1 1 15 CYS C C 1.951 7.297 6.791 1.00 . A A . 15 CYS C 1 1 7 5629 1 1 15 CYS CA C 2.397 6.006 7.493 1.00 . A A . 15 CYS CA 1 1 7 5630 1 1 15 CYS CB C 3.674 5.401 6.924 1.00 . A A . 15 CYS CB 1 1 7 5631 1 1 15 CYS H H 1.558 4.194 6.852 1.00 . A A . 15 CYS H 1 1 7 5632 1 1 15 CYS HA H 2.584 6.245 8.527 1.00 . A A . 15 CYS HA 1 1 7 5633 1 1 15 CYS HB2 H 4.103 6.077 6.202 1.00 . A A . 15 CYS HB2 1 1 7 5634 1 1 15 CYS HB3 H 4.379 5.217 7.721 1.00 . A A . 15 CYS HB3 1 1 7 5635 1 1 15 CYS N N 1.406 4.936 7.477 1.00 . A A . 15 CYS N 1 1 7 5636 1 1 15 CYS O O 2.691 8.281 6.791 1.00 . A A . 15 CYS O 1 1 7 5637 1 1 15 CYS SG S 3.321 3.811 6.099 1.00 . A A . 15 CYS SG 1 1 7 5638 1 1 16 LYS C C 0.806 9.443 5.065 1.00 . A A . 16 LYS C 1 1 7 5639 1 1 16 LYS CA C -0.017 8.596 6.039 1.00 . A A . 16 LYS CA 1 1 7 5640 1 1 16 LYS CB C -0.359 9.435 7.271 1.00 . A A . 16 LYS CB 1 1 7 5641 1 1 16 LYS CD C -2.491 10.647 6.707 1.00 . A A . 16 LYS CD 1 1 7 5642 1 1 16 LYS CE C -2.057 12.027 7.165 1.00 . A A . 16 LYS CE 1 1 7 5643 1 1 16 LYS CG C -1.850 9.548 7.540 1.00 . A A . 16 LYS CG 1 1 7 5644 1 1 16 LYS H H 0.096 6.583 6.679 1.00 . A A . 16 LYS H 1 1 7 5645 1 1 16 LYS HA H -0.938 8.314 5.552 1.00 . A A . 16 LYS HA 1 1 7 5646 1 1 16 LYS HB2 H 0.108 8.988 8.138 1.00 . A A . 16 LYS HB2 1 1 7 5647 1 1 16 LYS HB3 H 0.036 10.430 7.136 1.00 . A A . 16 LYS HB3 1 1 7 5648 1 1 16 LYS HD2 H -2.202 10.516 5.675 1.00 . A A . 16 LYS HD2 1 1 7 5649 1 1 16 LYS HD3 H -3.565 10.571 6.795 1.00 . A A . 16 LYS HD3 1 1 7 5650 1 1 16 LYS HE2 H -2.929 12.570 7.497 1.00 . A A . 16 LYS HE2 1 1 7 5651 1 1 16 LYS HE3 H -1.365 11.920 7.986 1.00 . A A . 16 LYS HE3 1 1 7 5652 1 1 16 LYS HG2 H -2.321 8.608 7.297 1.00 . A A . 16 LYS HG2 1 1 7 5653 1 1 16 LYS HG3 H -2.000 9.768 8.586 1.00 . A A . 16 LYS HG3 1 1 7 5654 1 1 16 LYS HZ1 H -1.786 13.756 6.023 1.00 . A A . 16 LYS HZ1 1 1 7 5655 1 1 16 LYS HZ2 H -1.566 12.319 5.156 1.00 . A A . 16 LYS HZ2 1 1 7 5656 1 1 16 LYS HZ3 H -0.371 12.846 6.243 1.00 . A A . 16 LYS HZ3 1 1 7 5657 1 1 16 LYS N N 0.658 7.355 6.461 1.00 . A A . 16 LYS N 1 1 7 5658 1 1 16 LYS NZ N -1.401 12.789 6.072 1.00 . A A . 16 LYS NZ 1 1 7 5659 1 1 16 LYS O O 0.856 10.670 5.187 1.00 . A A . 16 LYS O 1 1 7 5660 1 1 17 ASP C C 1.820 9.371 1.773 1.00 . A A . 17 ASP C 1 1 7 5661 1 1 17 ASP CA C 2.336 9.503 3.196 1.00 . A A . 17 ASP CA 1 1 7 5662 1 1 17 ASP CB C 3.762 8.970 3.274 1.00 . A A . 17 ASP CB 1 1 7 5663 1 1 17 ASP CG C 3.824 7.479 3.052 1.00 . A A . 17 ASP CG 1 1 7 5664 1 1 17 ASP H H 1.451 7.816 4.117 1.00 . A A . 17 ASP H 1 1 7 5665 1 1 17 ASP HA H 2.337 10.547 3.471 1.00 . A A . 17 ASP HA 1 1 7 5666 1 1 17 ASP HB2 H 4.365 9.451 2.519 1.00 . A A . 17 ASP HB2 1 1 7 5667 1 1 17 ASP HB3 H 4.169 9.186 4.250 1.00 . A A . 17 ASP HB3 1 1 7 5668 1 1 17 ASP N N 1.480 8.795 4.137 1.00 . A A . 17 ASP N 1 1 7 5669 1 1 17 ASP O O 0.941 8.554 1.496 1.00 . A A . 17 ASP O 1 1 7 5670 1 1 17 ASP OD1 O 3.531 6.723 3.999 1.00 . A A . 17 ASP OD1 1 1 7 5671 1 1 17 ASP OD2 O 4.167 7.045 1.936 1.00 . A A . 17 ASP OD2 1 1 7 5672 1 1 18 GLY C C 3.244 10.146 -1.424 1.00 . A A . 18 GLY C 1 1 7 5673 1 1 18 GLY CA C 2.027 10.110 -0.522 1.00 . A A . 18 GLY CA 1 1 7 5674 1 1 18 GLY H H 3.122 10.760 1.162 1.00 . A A . 18 GLY H 1 1 7 5675 1 1 18 GLY HA2 H 1.473 9.200 -0.710 1.00 . A A . 18 GLY HA2 1 1 7 5676 1 1 18 GLY HA3 H 1.398 10.962 -0.748 1.00 . A A . 18 GLY HA3 1 1 7 5677 1 1 18 GLY N N 2.400 10.157 0.875 1.00 . A A . 18 GLY N 1 1 7 5678 1 1 18 GLY O O 4.278 9.564 -1.098 1.00 . A A . 18 GLY O 1 1 7 5679 1 1 19 GLY C C 4.317 9.758 -4.402 1.00 . A A . 19 GLY C 1 1 7 5680 1 1 19 GLY CA C 4.246 10.945 -3.463 1.00 . A A . 19 GLY CA 1 1 7 5681 1 1 19 GLY H H 2.278 11.286 -2.754 1.00 . A A . 19 GLY H 1 1 7 5682 1 1 19 GLY HA2 H 4.138 11.849 -4.046 1.00 . A A . 19 GLY HA2 1 1 7 5683 1 1 19 GLY HA3 H 5.164 10.999 -2.899 1.00 . A A . 19 GLY HA3 1 1 7 5684 1 1 19 GLY N N 3.132 10.843 -2.544 1.00 . A A . 19 GLY N 1 1 7 5685 1 1 19 GLY O O 3.358 9.475 -5.121 1.00 . A A . 19 GLY O 1 1 7 5686 1 1 20 GLU C C 5.190 6.598 -4.318 1.00 . A A . 20 GLU C 1 1 7 5687 1 1 20 GLU CA C 5.560 7.818 -5.150 1.00 . A A . 20 GLU CA 1 1 7 5688 1 1 20 GLU CB C 6.989 7.689 -5.682 1.00 . A A . 20 GLU CB 1 1 7 5689 1 1 20 GLU CD C 6.135 7.083 -7.981 1.00 . A A . 20 GLU CD 1 1 7 5690 1 1 20 GLU CG C 7.105 7.928 -7.180 1.00 . A A . 20 GLU CG 1 1 7 5691 1 1 20 GLU H H 6.124 9.256 -3.705 1.00 . A A . 20 GLU H 1 1 7 5692 1 1 20 GLU HA H 4.876 7.891 -5.983 1.00 . A A . 20 GLU HA 1 1 7 5693 1 1 20 GLU HB2 H 7.615 8.409 -5.177 1.00 . A A . 20 GLU HB2 1 1 7 5694 1 1 20 GLU HB3 H 7.354 6.695 -5.468 1.00 . A A . 20 GLU HB3 1 1 7 5695 1 1 20 GLU HG2 H 6.907 8.968 -7.383 1.00 . A A . 20 GLU HG2 1 1 7 5696 1 1 20 GLU HG3 H 8.111 7.687 -7.493 1.00 . A A . 20 GLU HG3 1 1 7 5697 1 1 20 GLU N N 5.416 9.022 -4.348 1.00 . A A . 20 GLU N 1 1 7 5698 1 1 20 GLU O O 5.981 6.127 -3.497 1.00 . A A . 20 GLU O 1 1 7 5699 1 1 20 GLU OE1 O 6.476 5.928 -8.311 1.00 . A A . 20 GLU OE1 1 1 7 5700 1 1 20 GLU OE2 O 5.030 7.574 -8.296 1.00 . A A . 20 GLU OE2 1 1 7 5701 1 1 21 LEU C C 3.336 3.774 -4.487 1.00 . A A . 21 LEU C 1 1 7 5702 1 1 21 LEU CA C 3.446 5.050 -3.668 1.00 . A A . 21 LEU CA 1 1 7 5703 1 1 21 LEU CB C 2.074 5.411 -3.096 1.00 . A A . 21 LEU CB 1 1 7 5704 1 1 21 LEU CD1 C 0.769 7.463 -2.500 1.00 . A A . 21 LEU CD1 1 1 7 5705 1 1 21 LEU CD2 C 2.134 6.301 -0.760 1.00 . A A . 21 LEU CD2 1 1 7 5706 1 1 21 LEU CG C 2.037 6.669 -2.230 1.00 . A A . 21 LEU CG 1 1 7 5707 1 1 21 LEU H H 3.359 6.592 -5.108 1.00 . A A . 21 LEU H 1 1 7 5708 1 1 21 LEU HA H 4.134 4.884 -2.853 1.00 . A A . 21 LEU HA 1 1 7 5709 1 1 21 LEU HB2 H 1.392 5.547 -3.922 1.00 . A A . 21 LEU HB2 1 1 7 5710 1 1 21 LEU HB3 H 1.729 4.580 -2.499 1.00 . A A . 21 LEU HB3 1 1 7 5711 1 1 21 LEU HD11 H 0.093 6.868 -3.099 1.00 . A A . 21 LEU HD11 1 1 7 5712 1 1 21 LEU HD12 H 0.295 7.711 -1.562 1.00 . A A . 21 LEU HD12 1 1 7 5713 1 1 21 LEU HD13 H 1.017 8.371 -3.030 1.00 . A A . 21 LEU HD13 1 1 7 5714 1 1 21 LEU HD21 H 3.121 5.917 -0.550 1.00 . A A . 21 LEU HD21 1 1 7 5715 1 1 21 LEU HD22 H 1.952 7.177 -0.155 1.00 . A A . 21 LEU HD22 1 1 7 5716 1 1 21 LEU HD23 H 1.398 5.545 -0.530 1.00 . A A . 21 LEU HD23 1 1 7 5717 1 1 21 LEU HG H 2.883 7.295 -2.478 1.00 . A A . 21 LEU HG 1 1 7 5718 1 1 21 LEU N N 3.958 6.147 -4.468 1.00 . A A . 21 LEU N 1 1 7 5719 1 1 21 LEU O O 2.851 3.788 -5.618 1.00 . A A . 21 LEU O 1 1 7 5720 1 1 22 LEU C C 2.015 0.907 -4.147 1.00 . A A . 22 LEU C 1 1 7 5721 1 1 22 LEU CA C 3.436 1.358 -4.456 1.00 . A A . 22 LEU CA 1 1 7 5722 1 1 22 LEU CB C 4.466 0.350 -3.936 1.00 . A A . 22 LEU CB 1 1 7 5723 1 1 22 LEU CD1 C 4.466 -1.714 -5.362 1.00 . A A . 22 LEU CD1 1 1 7 5724 1 1 22 LEU CD2 C 4.668 -1.909 -2.880 1.00 . A A . 22 LEU CD2 1 1 7 5725 1 1 22 LEU CG C 4.056 -1.119 -4.024 1.00 . A A . 22 LEU CG 1 1 7 5726 1 1 22 LEU H H 3.909 2.706 -2.904 1.00 . A A . 22 LEU H 1 1 7 5727 1 1 22 LEU HA H 3.545 1.461 -5.525 1.00 . A A . 22 LEU HA 1 1 7 5728 1 1 22 LEU HB2 H 5.380 0.480 -4.499 1.00 . A A . 22 LEU HB2 1 1 7 5729 1 1 22 LEU HB3 H 4.671 0.579 -2.901 1.00 . A A . 22 LEU HB3 1 1 7 5730 1 1 22 LEU HD11 H 4.043 -2.704 -5.459 1.00 . A A . 22 LEU HD11 1 1 7 5731 1 1 22 LEU HD12 H 4.102 -1.088 -6.163 1.00 . A A . 22 LEU HD12 1 1 7 5732 1 1 22 LEU HD13 H 5.543 -1.776 -5.415 1.00 . A A . 22 LEU HD13 1 1 7 5733 1 1 22 LEU HD21 H 5.715 -1.664 -2.790 1.00 . A A . 22 LEU HD21 1 1 7 5734 1 1 22 LEU HD22 H 4.160 -1.659 -1.959 1.00 . A A . 22 LEU HD22 1 1 7 5735 1 1 22 LEU HD23 H 4.559 -2.965 -3.075 1.00 . A A . 22 LEU HD23 1 1 7 5736 1 1 22 LEU HG H 2.983 -1.189 -3.943 1.00 . A A . 22 LEU HG 1 1 7 5737 1 1 22 LEU N N 3.653 2.658 -3.854 1.00 . A A . 22 LEU N 1 1 7 5738 1 1 22 LEU O O 1.663 0.681 -2.988 1.00 . A A . 22 LEU O 1 1 7 5739 1 1 23 CYS C C -0.619 -0.656 -5.574 1.00 . A A . 23 CYS C 1 1 7 5740 1 1 23 CYS CA C -0.249 0.701 -4.988 1.00 . A A . 23 CYS CA 1 1 7 5741 1 1 23 CYS CB C -1.061 1.811 -5.658 1.00 . A A . 23 CYS CB 1 1 7 5742 1 1 23 CYS H H 1.488 1.280 -6.033 1.00 . A A . 23 CYS H 1 1 7 5743 1 1 23 CYS HA H -0.462 0.697 -3.931 1.00 . A A . 23 CYS HA 1 1 7 5744 1 1 23 CYS HB2 H -1.148 1.597 -6.714 1.00 . A A . 23 CYS HB2 1 1 7 5745 1 1 23 CYS HB3 H -2.047 1.840 -5.220 1.00 . A A . 23 CYS HB3 1 1 7 5746 1 1 23 CYS HG H 0.950 3.378 -5.831 1.00 . A A . 23 CYS HG 1 1 7 5747 1 1 23 CYS N N 1.168 0.965 -5.159 1.00 . A A . 23 CYS N 1 1 7 5748 1 1 23 CYS O O -0.159 -1.014 -6.665 1.00 . A A . 23 CYS O 1 1 7 5749 1 1 23 CYS SG S -0.331 3.460 -5.489 1.00 . A A . 23 CYS SG 1 1 7 5750 1 1 24 CYS C C -2.656 -2.761 -6.463 1.00 . A A . 24 CYS C 1 1 7 5751 1 1 24 CYS CA C -1.756 -2.768 -5.229 1.00 . A A . 24 CYS CA 1 1 7 5752 1 1 24 CYS CB C -2.474 -3.414 -4.066 1.00 . A A . 24 CYS CB 1 1 7 5753 1 1 24 CYS H H -1.658 -1.137 -3.916 1.00 . A A . 24 CYS H 1 1 7 5754 1 1 24 CYS HA H -0.857 -3.324 -5.443 1.00 . A A . 24 CYS HA 1 1 7 5755 1 1 24 CYS HB2 H -3.387 -3.867 -4.419 1.00 . A A . 24 CYS HB2 1 1 7 5756 1 1 24 CYS HB3 H -1.838 -4.175 -3.637 1.00 . A A . 24 CYS HB3 1 1 7 5757 1 1 24 CYS N N -1.380 -1.437 -4.818 1.00 . A A . 24 CYS N 1 1 7 5758 1 1 24 CYS O O -3.376 -1.795 -6.721 1.00 . A A . 24 CYS O 1 1 7 5759 1 1 24 CYS SG S -2.904 -2.229 -2.745 1.00 . A A . 24 CYS SG 1 1 7 5760 1 1 25 ASP C C -4.798 -4.708 -7.961 1.00 . A A . 25 ASP C 1 1 7 5761 1 1 25 ASP CA C -3.503 -4.030 -8.359 1.00 . A A . 25 ASP CA 1 1 7 5762 1 1 25 ASP CB C -2.811 -4.875 -9.428 1.00 . A A . 25 ASP CB 1 1 7 5763 1 1 25 ASP CG C -3.329 -4.580 -10.823 1.00 . A A . 25 ASP CG 1 1 7 5764 1 1 25 ASP H H -2.063 -4.612 -6.912 1.00 . A A . 25 ASP H 1 1 7 5765 1 1 25 ASP HA H -3.722 -3.052 -8.760 1.00 . A A . 25 ASP HA 1 1 7 5766 1 1 25 ASP HB2 H -1.753 -4.683 -9.404 1.00 . A A . 25 ASP HB2 1 1 7 5767 1 1 25 ASP HB3 H -2.987 -5.921 -9.217 1.00 . A A . 25 ASP HB3 1 1 7 5768 1 1 25 ASP N N -2.646 -3.866 -7.190 1.00 . A A . 25 ASP N 1 1 7 5769 1 1 25 ASP O O -5.715 -4.858 -8.767 1.00 . A A . 25 ASP O 1 1 7 5770 1 1 25 ASP OD1 O -3.328 -3.400 -11.227 1.00 . A A . 25 ASP OD1 1 1 7 5771 1 1 25 ASP OD2 O -3.746 -5.528 -11.521 1.00 . A A . 25 ASP OD2 1 1 7 5772 1 1 26 THR C C -6.908 -5.172 -5.490 1.00 . A A . 26 THR C 1 1 7 5773 1 1 26 THR CA C -5.921 -6.025 -6.279 1.00 . A A . 26 THR CA 1 1 7 5774 1 1 26 THR CB C -5.403 -7.178 -5.414 1.00 . A A . 26 THR CB 1 1 7 5775 1 1 26 THR CG2 C -5.050 -8.372 -6.286 1.00 . A A . 26 THR CG2 1 1 7 5776 1 1 26 THR H H -3.999 -5.175 -6.201 1.00 . A A . 26 THR H 1 1 7 5777 1 1 26 THR HA H -6.426 -6.444 -7.138 1.00 . A A . 26 THR HA 1 1 7 5778 1 1 26 THR HB H -6.171 -7.470 -4.713 1.00 . A A . 26 THR HB 1 1 7 5779 1 1 26 THR HG1 H -4.498 -6.231 -3.917 1.00 . A A . 26 THR HG1 1 1 7 5780 1 1 26 THR HG21 H -4.613 -9.149 -5.676 1.00 . A A . 26 THR HG21 1 1 7 5781 1 1 26 THR HG22 H -4.340 -8.065 -7.045 1.00 . A A . 26 THR HG22 1 1 7 5782 1 1 26 THR HG23 H -5.945 -8.747 -6.761 1.00 . A A . 26 THR HG23 1 1 7 5783 1 1 26 THR N N -4.808 -5.234 -6.754 1.00 . A A . 26 THR N 1 1 7 5784 1 1 26 THR O O -8.076 -5.538 -5.327 1.00 . A A . 26 THR O 1 1 7 5785 1 1 26 THR OG1 O -4.233 -6.750 -4.696 1.00 . A A . 26 THR OG1 1 1 7 5786 1 1 27 CYS C C -6.686 -1.663 -4.462 1.00 . A A . 27 CYS C 1 1 7 5787 1 1 27 CYS CA C -7.271 -3.070 -4.330 1.00 . A A . 27 CYS CA 1 1 7 5788 1 1 27 CYS CB C -7.372 -3.501 -2.864 1.00 . A A . 27 CYS CB 1 1 7 5789 1 1 27 CYS H H -5.517 -3.755 -5.265 1.00 . A A . 27 CYS H 1 1 7 5790 1 1 27 CYS HA H -8.257 -3.081 -4.771 1.00 . A A . 27 CYS HA 1 1 7 5791 1 1 27 CYS HB2 H -8.409 -3.486 -2.566 1.00 . A A . 27 CYS HB2 1 1 7 5792 1 1 27 CYS HB3 H -6.991 -4.507 -2.769 1.00 . A A . 27 CYS HB3 1 1 7 5793 1 1 27 CYS N N -6.443 -4.008 -5.058 1.00 . A A . 27 CYS N 1 1 7 5794 1 1 27 CYS O O -5.541 -1.507 -4.886 1.00 . A A . 27 CYS O 1 1 7 5795 1 1 27 CYS SG S -6.454 -2.450 -1.705 1.00 . A A . 27 CYS SG 1 1 7 5796 1 1 28 PRO C C -6.423 1.378 -3.174 1.00 . A A . 28 PRO C 1 1 7 5797 1 1 28 PRO CA C -7.064 0.764 -4.424 1.00 . A A . 28 PRO CA 1 1 7 5798 1 1 28 PRO CB C -8.371 1.470 -4.765 1.00 . A A . 28 PRO CB 1 1 7 5799 1 1 28 PRO CD C -8.927 -0.696 -3.886 1.00 . A A . 28 PRO CD 1 1 7 5800 1 1 28 PRO CG C -9.405 0.731 -3.991 1.00 . A A . 28 PRO CG 1 1 7 5801 1 1 28 PRO HA H -6.380 0.851 -5.255 1.00 . A A . 28 PRO HA 1 1 7 5802 1 1 28 PRO HB2 H -8.312 2.505 -4.464 1.00 . A A . 28 PRO HB2 1 1 7 5803 1 1 28 PRO HB3 H -8.551 1.405 -5.828 1.00 . A A . 28 PRO HB3 1 1 7 5804 1 1 28 PRO HD2 H -9.059 -1.066 -2.881 1.00 . A A . 28 PRO HD2 1 1 7 5805 1 1 28 PRO HD3 H -9.457 -1.322 -4.590 1.00 . A A . 28 PRO HD3 1 1 7 5806 1 1 28 PRO HG2 H -9.502 1.166 -3.006 1.00 . A A . 28 PRO HG2 1 1 7 5807 1 1 28 PRO HG3 H -10.350 0.773 -4.512 1.00 . A A . 28 PRO HG3 1 1 7 5808 1 1 28 PRO N N -7.495 -0.617 -4.232 1.00 . A A . 28 PRO N 1 1 7 5809 1 1 28 PRO O O -6.856 2.427 -2.691 1.00 . A A . 28 PRO O 1 1 7 5810 1 1 29 SER C C -3.221 1.730 -1.980 1.00 . A A . 29 SER C 1 1 7 5811 1 1 29 SER CA C -4.619 1.293 -1.551 1.00 . A A . 29 SER CA 1 1 7 5812 1 1 29 SER CB C -4.539 0.252 -0.433 1.00 . A A . 29 SER CB 1 1 7 5813 1 1 29 SER H H -5.026 -0.056 -3.134 1.00 . A A . 29 SER H 1 1 7 5814 1 1 29 SER HA H -5.155 2.158 -1.188 1.00 . A A . 29 SER HA 1 1 7 5815 1 1 29 SER HB2 H -3.987 -0.608 -0.784 1.00 . A A . 29 SER HB2 1 1 7 5816 1 1 29 SER HB3 H -4.033 0.680 0.420 1.00 . A A . 29 SER HB3 1 1 7 5817 1 1 29 SER HG H -6.138 -0.875 -0.629 1.00 . A A . 29 SER HG 1 1 7 5818 1 1 29 SER N N -5.355 0.759 -2.689 1.00 . A A . 29 SER N 1 1 7 5819 1 1 29 SER O O -2.786 1.424 -3.091 1.00 . A A . 29 SER O 1 1 7 5820 1 1 29 SER OG O -5.838 -0.161 -0.037 1.00 . A A . 29 SER OG 1 1 7 5821 1 1 30 SER C C -0.281 2.874 -0.299 1.00 . A A . 30 SER C 1 1 7 5822 1 1 30 SER CA C -1.243 3.048 -1.469 1.00 . A A . 30 SER CA 1 1 7 5823 1 1 30 SER CB C -1.354 4.526 -1.850 1.00 . A A . 30 SER CB 1 1 7 5824 1 1 30 SER H H -2.987 2.796 -0.305 1.00 . A A . 30 SER H 1 1 7 5825 1 1 30 SER HA H -0.865 2.495 -2.311 1.00 . A A . 30 SER HA 1 1 7 5826 1 1 30 SER HB2 H -1.015 5.136 -1.026 1.00 . A A . 30 SER HB2 1 1 7 5827 1 1 30 SER HB3 H -0.739 4.720 -2.716 1.00 . A A . 30 SER HB3 1 1 7 5828 1 1 30 SER HG H -3.077 4.192 -2.718 1.00 . A A . 30 SER HG 1 1 7 5829 1 1 30 SER N N -2.560 2.520 -1.143 1.00 . A A . 30 SER N 1 1 7 5830 1 1 30 SER O O -0.682 2.968 0.867 1.00 . A A . 30 SER O 1 1 7 5831 1 1 30 SER OG O -2.696 4.873 -2.153 1.00 . A A . 30 SER OG 1 1 7 5832 1 1 31 TYR C C 3.339 2.806 -0.005 1.00 . A A . 31 TYR C 1 1 7 5833 1 1 31 TYR CA C 1.967 2.274 0.414 1.00 . A A . 31 TYR CA 1 1 7 5834 1 1 31 TYR CB C 2.085 0.770 0.687 1.00 . A A . 31 TYR CB 1 1 7 5835 1 1 31 TYR CD1 C 0.524 0.231 2.605 1.00 . A A . 31 TYR CD1 1 1 7 5836 1 1 31 TYR CD2 C -0.029 -0.581 0.432 1.00 . A A . 31 TYR CD2 1 1 7 5837 1 1 31 TYR CE1 C -0.615 -0.362 3.117 1.00 . A A . 31 TYR CE1 1 1 7 5838 1 1 31 TYR CE2 C -1.166 -1.175 0.939 1.00 . A A . 31 TYR CE2 1 1 7 5839 1 1 31 TYR CG C 0.835 0.131 1.252 1.00 . A A . 31 TYR CG 1 1 7 5840 1 1 31 TYR CZ C -1.455 -1.064 2.280 1.00 . A A . 31 TYR CZ 1 1 7 5841 1 1 31 TYR H H 1.205 2.392 -1.552 1.00 . A A . 31 TYR H 1 1 7 5842 1 1 31 TYR HA H 1.659 2.774 1.320 1.00 . A A . 31 TYR HA 1 1 7 5843 1 1 31 TYR HB2 H 2.323 0.263 -0.238 1.00 . A A . 31 TYR HB2 1 1 7 5844 1 1 31 TYR HB3 H 2.886 0.606 1.392 1.00 . A A . 31 TYR HB3 1 1 7 5845 1 1 31 TYR HD1 H 1.186 0.779 3.263 1.00 . A A . 31 TYR HD1 1 1 7 5846 1 1 31 TYR HD2 H 0.198 -0.667 -0.620 1.00 . A A . 31 TYR HD2 1 1 7 5847 1 1 31 TYR HE1 H -0.841 -0.271 4.169 1.00 . A A . 31 TYR HE1 1 1 7 5848 1 1 31 TYR HE2 H -1.824 -1.727 0.282 1.00 . A A . 31 TYR HE2 1 1 7 5849 1 1 31 TYR HH H -2.980 -2.236 2.099 1.00 . A A . 31 TYR HH 1 1 7 5850 1 1 31 TYR N N 0.965 2.530 -0.610 1.00 . A A . 31 TYR N 1 1 7 5851 1 1 31 TYR O O 3.544 3.189 -1.155 1.00 . A A . 31 TYR O 1 1 7 5852 1 1 31 TYR OH O -2.590 -1.657 2.786 1.00 . A A . 31 TYR OH 1 1 7 5853 1 1 32 HIS C C 6.188 1.564 -0.184 1.00 . A A . 32 HIS C 1 1 7 5854 1 1 32 HIS CA C 5.720 2.792 0.592 1.00 . A A . 32 HIS CA 1 1 7 5855 1 1 32 HIS CB C 6.540 2.868 1.902 1.00 . A A . 32 HIS CB 1 1 7 5856 1 1 32 HIS CD2 C 7.702 5.056 2.609 1.00 . A A . 32 HIS CD2 1 1 7 5857 1 1 32 HIS CE1 C 6.197 5.734 4.033 1.00 . A A . 32 HIS CE1 1 1 7 5858 1 1 32 HIS CG C 6.650 4.201 2.585 1.00 . A A . 32 HIS CG 1 1 7 5859 1 1 32 HIS H H 4.074 2.104 1.702 1.00 . A A . 32 HIS H 1 1 7 5860 1 1 32 HIS HA H 5.852 3.689 0.004 1.00 . A A . 32 HIS HA 1 1 7 5861 1 1 32 HIS HB2 H 6.103 2.187 2.615 1.00 . A A . 32 HIS HB2 1 1 7 5862 1 1 32 HIS HB3 H 7.547 2.536 1.687 1.00 . A A . 32 HIS HB3 1 1 7 5863 1 1 32 HIS HD2 H 8.598 4.993 2.010 1.00 . A A . 32 HIS HD2 1 1 7 5864 1 1 32 HIS HE1 H 5.688 6.323 4.782 1.00 . A A . 32 HIS HE1 1 1 7 5865 1 1 32 HIS HE2 H 8.060 6.666 3.923 1.00 . A A . 32 HIS HE2 1 1 7 5866 1 1 32 HIS N N 4.306 2.600 0.884 1.00 . A A . 32 HIS N 1 1 7 5867 1 1 32 HIS ND1 N 5.701 4.643 3.478 1.00 . A A . 32 HIS ND1 1 1 7 5868 1 1 32 HIS NE2 N 7.411 6.025 3.536 1.00 . A A . 32 HIS NE2 1 1 7 5869 1 1 32 HIS O O 5.540 1.136 -1.135 1.00 . A A . 32 HIS O 1 1 7 5870 1 1 33 ILE C C 7.762 -1.391 1.103 1.00 . A A . 33 ILE C 1 1 7 5871 1 1 33 ILE CA C 7.547 -0.453 -0.090 1.00 . A A . 33 ILE CA 1 1 7 5872 1 1 33 ILE CB C 8.827 -0.406 -0.959 1.00 . A A . 33 ILE CB 1 1 7 5873 1 1 33 ILE CD1 C 11.337 -0.006 -0.887 1.00 . A A . 33 ILE CD1 1 1 7 5874 1 1 33 ILE CG1 C 10.022 0.096 -0.146 1.00 . A A . 33 ILE CG1 1 1 7 5875 1 1 33 ILE CG2 C 8.605 0.488 -2.168 1.00 . A A . 33 ILE CG2 1 1 7 5876 1 1 33 ILE H H 7.571 1.204 1.201 1.00 . A A . 33 ILE H 1 1 7 5877 1 1 33 ILE HA H 6.737 -0.836 -0.693 1.00 . A A . 33 ILE HA 1 1 7 5878 1 1 33 ILE HB H 9.032 -1.406 -1.313 1.00 . A A . 33 ILE HB 1 1 7 5879 1 1 33 ILE HD11 H 11.149 -0.190 -1.936 1.00 . A A . 33 ILE HD11 1 1 7 5880 1 1 33 ILE HD12 H 11.886 0.919 -0.776 1.00 . A A . 33 ILE HD12 1 1 7 5881 1 1 33 ILE HD13 H 11.918 -0.819 -0.478 1.00 . A A . 33 ILE HD13 1 1 7 5882 1 1 33 ILE HG12 H 9.865 1.133 0.114 1.00 . A A . 33 ILE HG12 1 1 7 5883 1 1 33 ILE HG21 H 8.129 -0.079 -2.955 1.00 . A A . 33 ILE HG21 1 1 7 5884 1 1 33 ILE HG22 H 7.971 1.316 -1.885 1.00 . A A . 33 ILE HG22 1 1 7 5885 1 1 33 ILE HG23 H 9.555 0.863 -2.518 1.00 . A A . 33 ILE HG23 1 1 7 5886 1 1 33 ILE N N 7.166 0.868 0.381 1.00 . A A . 33 ILE N 1 1 7 5887 1 1 33 ILE O O 8.398 -2.433 0.974 1.00 . A A . 33 ILE O 1 1 7 5888 1 1 34 HIS C C 6.592 -1.374 4.657 1.00 . A A . 34 HIS C 1 1 7 5889 1 1 34 HIS CA C 7.541 -1.743 3.507 1.00 . A A . 34 HIS CA 1 1 7 5890 1 1 34 HIS CB C 8.991 -1.517 3.957 1.00 . A A . 34 HIS CB 1 1 7 5891 1 1 34 HIS CD2 C 9.611 0.303 5.681 1.00 . A A . 34 HIS CD2 1 1 7 5892 1 1 34 HIS CE1 C 9.531 2.009 4.330 1.00 . A A . 34 HIS CE1 1 1 7 5893 1 1 34 HIS CG C 9.277 -0.124 4.440 1.00 . A A . 34 HIS CG 1 1 7 5894 1 1 34 HIS H H 6.828 -0.120 2.348 1.00 . A A . 34 HIS H 1 1 7 5895 1 1 34 HIS HA H 7.412 -2.789 3.275 1.00 . A A . 34 HIS HA 1 1 7 5896 1 1 34 HIS HB2 H 9.218 -2.199 4.765 1.00 . A A . 34 HIS HB2 1 1 7 5897 1 1 34 HIS HB3 H 9.651 -1.721 3.125 1.00 . A A . 34 HIS HB3 1 1 7 5898 1 1 34 HIS HD2 H 9.734 -0.308 6.562 1.00 . A A . 34 HIS HD2 1 1 7 5899 1 1 34 HIS HE1 H 9.580 3.020 3.958 1.00 . A A . 34 HIS HE1 1 1 7 5900 1 1 34 HIS HE2 H 10.246 2.221 6.270 1.00 . A A . 34 HIS HE2 1 1 7 5901 1 1 34 HIS N N 7.285 -0.981 2.285 1.00 . A A . 34 HIS N 1 1 7 5902 1 1 34 HIS ND1 N 9.228 0.957 3.592 1.00 . A A . 34 HIS ND1 1 1 7 5903 1 1 34 HIS NE2 N 9.773 1.663 5.603 1.00 . A A . 34 HIS NE2 1 1 7 5904 1 1 34 HIS O O 6.902 -1.632 5.821 1.00 . A A . 34 HIS O 1 1 7 5905 1 1 35 CYS C C 3.834 -1.554 6.009 1.00 . A A . 35 CYS C 1 1 7 5906 1 1 35 CYS CA C 4.512 -0.340 5.386 1.00 . A A . 35 CYS CA 1 1 7 5907 1 1 35 CYS CB C 3.460 0.574 4.775 1.00 . A A . 35 CYS CB 1 1 7 5908 1 1 35 CYS H H 5.256 -0.537 3.414 1.00 . A A . 35 CYS H 1 1 7 5909 1 1 35 CYS HA H 5.054 0.197 6.147 1.00 . A A . 35 CYS HA 1 1 7 5910 1 1 35 CYS HB2 H 2.621 -0.020 4.441 1.00 . A A . 35 CYS HB2 1 1 7 5911 1 1 35 CYS HB3 H 3.124 1.285 5.516 1.00 . A A . 35 CYS HB3 1 1 7 5912 1 1 35 CYS N N 5.456 -0.752 4.348 1.00 . A A . 35 CYS N 1 1 7 5913 1 1 35 CYS O O 3.340 -1.502 7.138 1.00 . A A . 35 CYS O 1 1 7 5914 1 1 35 CYS SG S 4.081 1.510 3.349 1.00 . A A . 35 CYS SG 1 1 7 5915 1 1 36 LEU C C 4.191 -4.766 6.380 1.00 . A A . 36 LEU C 1 1 7 5916 1 1 36 LEU CA C 3.179 -3.865 5.683 1.00 . A A . 36 LEU CA 1 1 7 5917 1 1 36 LEU CB C 2.567 -4.595 4.486 1.00 . A A . 36 LEU CB 1 1 7 5918 1 1 36 LEU CD1 C 3.719 -4.841 2.270 1.00 . A A . 36 LEU CD1 1 1 7 5919 1 1 36 LEU CD2 C 1.520 -3.657 2.408 1.00 . A A . 36 LEU CD2 1 1 7 5920 1 1 36 LEU CG C 2.832 -3.949 3.121 1.00 . A A . 36 LEU CG 1 1 7 5921 1 1 36 LEU H H 4.231 -2.601 4.369 1.00 . A A . 36 LEU H 1 1 7 5922 1 1 36 LEU HA H 2.394 -3.610 6.381 1.00 . A A . 36 LEU HA 1 1 7 5923 1 1 36 LEU HB2 H 2.958 -5.602 4.468 1.00 . A A . 36 LEU HB2 1 1 7 5924 1 1 36 LEU HB3 H 1.498 -4.647 4.633 1.00 . A A . 36 LEU HB3 1 1 7 5925 1 1 36 LEU HD11 H 4.692 -4.383 2.167 1.00 . A A . 36 LEU HD11 1 1 7 5926 1 1 36 LEU HD12 H 3.823 -5.806 2.744 1.00 . A A . 36 LEU HD12 1 1 7 5927 1 1 36 LEU HD13 H 3.275 -4.964 1.294 1.00 . A A . 36 LEU HD13 1 1 7 5928 1 1 36 LEU HD21 H 1.159 -2.682 2.704 1.00 . A A . 36 LEU HD21 1 1 7 5929 1 1 36 LEU HD22 H 1.680 -3.672 1.340 1.00 . A A . 36 LEU HD22 1 1 7 5930 1 1 36 LEU HD23 H 0.791 -4.407 2.673 1.00 . A A . 36 LEU HD23 1 1 7 5931 1 1 36 LEU HG H 3.349 -3.013 3.268 1.00 . A A . 36 LEU HG 1 1 7 5932 1 1 36 LEU N N 3.806 -2.634 5.250 1.00 . A A . 36 LEU N 1 1 7 5933 1 1 36 LEU O O 5.355 -4.399 6.538 1.00 . A A . 36 LEU O 1 1 7 5934 1 1 37 ARG C C 5.757 -7.346 6.607 1.00 . A A . 37 ARG C 1 1 7 5935 1 1 37 ARG CA C 4.576 -6.911 7.484 1.00 . A A . 37 ARG CA 1 1 7 5936 1 1 37 ARG CB C 3.758 -8.128 7.925 1.00 . A A . 37 ARG CB 1 1 7 5937 1 1 37 ARG CD C 2.050 -8.883 9.594 1.00 . A A . 37 ARG CD 1 1 7 5938 1 1 37 ARG CG C 2.481 -7.768 8.661 1.00 . A A . 37 ARG CG 1 1 7 5939 1 1 37 ARG CZ C -0.058 -10.045 10.120 1.00 . A A . 37 ARG CZ 1 1 7 5940 1 1 37 ARG H H 2.784 -6.152 6.655 1.00 . A A . 37 ARG H 1 1 7 5941 1 1 37 ARG HA H 4.972 -6.426 8.365 1.00 . A A . 37 ARG HA 1 1 7 5942 1 1 37 ARG HB2 H 3.496 -8.708 7.053 1.00 . A A . 37 ARG HB2 1 1 7 5943 1 1 37 ARG HB3 H 4.364 -8.736 8.581 1.00 . A A . 37 ARG HB3 1 1 7 5944 1 1 37 ARG HD2 H 2.767 -9.688 9.527 1.00 . A A . 37 ARG HD2 1 1 7 5945 1 1 37 ARG HD3 H 2.029 -8.504 10.605 1.00 . A A . 37 ARG HD3 1 1 7 5946 1 1 37 ARG HE H 0.413 -9.277 8.327 1.00 . A A . 37 ARG HE 1 1 7 5947 1 1 37 ARG HG2 H 2.654 -6.872 9.239 1.00 . A A . 37 ARG HG2 1 1 7 5948 1 1 37 ARG HG3 H 1.700 -7.589 7.940 1.00 . A A . 37 ARG HG3 1 1 7 5949 1 1 37 ARG HH11 H 1.221 -9.851 11.678 1.00 . A A . 37 ARG HH11 1 1 7 5950 1 1 37 ARG HH12 H -0.245 -10.718 12.029 1.00 . A A . 37 ARG HH12 1 1 7 5951 1 1 37 ARG HH21 H -1.553 -10.365 8.784 1.00 . A A . 37 ARG HH21 1 1 7 5952 1 1 37 ARG HH22 H -1.839 -10.982 10.388 1.00 . A A . 37 ARG HH22 1 1 7 5953 1 1 37 ARG N N 3.728 -5.939 6.798 1.00 . A A . 37 ARG N 1 1 7 5954 1 1 37 ARG NE N 0.727 -9.404 9.255 1.00 . A A . 37 ARG NE 1 1 7 5955 1 1 37 ARG NH1 N 0.335 -10.212 11.375 1.00 . A A . 37 ARG NH1 1 1 7 5956 1 1 37 ARG NH2 N -1.241 -10.500 9.732 1.00 . A A . 37 ARG NH2 1 1 7 5957 1 1 37 ARG O O 6.906 -7.244 7.038 1.00 . A A . 37 ARG O 1 1 7 5958 1 1 38 PRO C C 7.257 -7.028 3.825 1.00 . A A . 38 PRO C 1 1 7 5959 1 1 38 PRO CA C 6.591 -8.238 4.470 1.00 . A A . 38 PRO CA 1 1 7 5960 1 1 38 PRO CB C 5.891 -9.099 3.404 1.00 . A A . 38 PRO CB 1 1 7 5961 1 1 38 PRO CD C 4.205 -8.036 4.737 1.00 . A A . 38 PRO CD 1 1 7 5962 1 1 38 PRO CG C 4.463 -9.207 3.835 1.00 . A A . 38 PRO CG 1 1 7 5963 1 1 38 PRO HA H 7.337 -8.826 4.983 1.00 . A A . 38 PRO HA 1 1 7 5964 1 1 38 PRO HB2 H 5.974 -8.614 2.443 1.00 . A A . 38 PRO HB2 1 1 7 5965 1 1 38 PRO HB3 H 6.362 -10.071 3.359 1.00 . A A . 38 PRO HB3 1 1 7 5966 1 1 38 PRO HD2 H 3.916 -7.170 4.162 1.00 . A A . 38 PRO HD2 1 1 7 5967 1 1 38 PRO HD3 H 3.452 -8.280 5.471 1.00 . A A . 38 PRO HD3 1 1 7 5968 1 1 38 PRO HG2 H 3.814 -9.165 2.973 1.00 . A A . 38 PRO HG2 1 1 7 5969 1 1 38 PRO HG3 H 4.312 -10.133 4.372 1.00 . A A . 38 PRO HG3 1 1 7 5970 1 1 38 PRO N N 5.514 -7.837 5.371 1.00 . A A . 38 PRO N 1 1 7 5971 1 1 38 PRO O O 6.812 -6.542 2.783 1.00 . A A . 38 PRO O 1 1 7 5972 1 1 39 ALA C C 9.805 -5.682 2.740 1.00 . A A . 39 ALA C 1 1 7 5973 1 1 39 ALA CA C 8.992 -5.342 3.981 1.00 . A A . 39 ALA CA 1 1 7 5974 1 1 39 ALA CB C 9.892 -4.763 5.060 1.00 . A A . 39 ALA CB 1 1 7 5975 1 1 39 ALA H H 8.574 -6.926 5.322 1.00 . A A . 39 ALA H 1 1 7 5976 1 1 39 ALA HA H 8.254 -4.595 3.722 1.00 . A A . 39 ALA HA 1 1 7 5977 1 1 39 ALA HB1 H 9.447 -4.932 6.030 1.00 . A A . 39 ALA HB1 1 1 7 5978 1 1 39 ALA HB2 H 10.860 -5.240 5.017 1.00 . A A . 39 ALA HB2 1 1 7 5979 1 1 39 ALA HB3 H 10.006 -3.702 4.897 1.00 . A A . 39 ALA HB3 1 1 7 5980 1 1 39 ALA N N 8.290 -6.514 4.475 1.00 . A A . 39 ALA N 1 1 7 5981 1 1 39 ALA O O 10.508 -6.694 2.701 1.00 . A A . 39 ALA O 1 1 7 5982 1 1 40 LEU C C 11.573 -4.085 0.352 1.00 . A A . 40 LEU C 1 1 7 5983 1 1 40 LEU CA C 10.424 -5.074 0.483 1.00 . A A . 40 LEU CA 1 1 7 5984 1 1 40 LEU CB C 9.486 -4.958 -0.720 1.00 . A A . 40 LEU CB 1 1 7 5985 1 1 40 LEU CD1 C 6.992 -5.201 -0.828 1.00 . A A . 40 LEU CD1 1 1 7 5986 1 1 40 LEU CD2 C 8.460 -6.925 -1.885 1.00 . A A . 40 LEU CD2 1 1 7 5987 1 1 40 LEU CG C 8.316 -5.945 -0.733 1.00 . A A . 40 LEU CG 1 1 7 5988 1 1 40 LEU H H 9.112 -4.060 1.796 1.00 . A A . 40 LEU H 1 1 7 5989 1 1 40 LEU HA H 10.829 -6.076 0.517 1.00 . A A . 40 LEU HA 1 1 7 5990 1 1 40 LEU HB2 H 9.086 -3.956 -0.739 1.00 . A A . 40 LEU HB2 1 1 7 5991 1 1 40 LEU HB3 H 10.067 -5.113 -1.617 1.00 . A A . 40 LEU HB3 1 1 7 5992 1 1 40 LEU HD11 H 6.274 -5.654 -0.161 1.00 . A A . 40 LEU HD11 1 1 7 5993 1 1 40 LEU HD12 H 7.138 -4.167 -0.550 1.00 . A A . 40 LEU HD12 1 1 7 5994 1 1 40 LEU HD13 H 6.623 -5.251 -1.842 1.00 . A A . 40 LEU HD13 1 1 7 5995 1 1 40 LEU HD21 H 9.337 -7.536 -1.731 1.00 . A A . 40 LEU HD21 1 1 7 5996 1 1 40 LEU HD22 H 7.585 -7.556 -1.934 1.00 . A A . 40 LEU HD22 1 1 7 5997 1 1 40 LEU HD23 H 8.561 -6.379 -2.812 1.00 . A A . 40 LEU HD23 1 1 7 5998 1 1 40 LEU HG H 8.317 -6.509 0.189 1.00 . A A . 40 LEU HG 1 1 7 5999 1 1 40 LEU N N 9.696 -4.849 1.720 1.00 . A A . 40 LEU N 1 1 7 6000 1 1 40 LEU O O 11.438 -2.909 0.692 1.00 . A A . 40 LEU O 1 1 7 6001 1 1 41 TYR C C 13.856 -3.151 -1.731 1.00 . A A . 41 TYR C 1 1 7 6002 1 1 41 TYR CA C 13.871 -3.708 -0.315 1.00 . A A . 41 TYR CA 1 1 7 6003 1 1 41 TYR CB C 15.167 -4.480 -0.057 1.00 . A A . 41 TYR CB 1 1 7 6004 1 1 41 TYR CD1 C 14.613 -4.329 2.410 1.00 . A A . 41 TYR CD1 1 1 7 6005 1 1 41 TYR CD2 C 16.241 -5.926 1.720 1.00 . A A . 41 TYR CD2 1 1 7 6006 1 1 41 TYR CE1 C 14.769 -4.728 3.723 1.00 . A A . 41 TYR CE1 1 1 7 6007 1 1 41 TYR CE2 C 16.404 -6.331 3.033 1.00 . A A . 41 TYR CE2 1 1 7 6008 1 1 41 TYR CG C 15.344 -4.919 1.386 1.00 . A A . 41 TYR CG 1 1 7 6009 1 1 41 TYR CZ C 15.666 -5.729 4.029 1.00 . A A . 41 TYR CZ 1 1 7 6010 1 1 41 TYR H H 12.770 -5.523 -0.349 1.00 . A A . 41 TYR H 1 1 7 6011 1 1 41 TYR HA H 13.800 -2.888 0.384 1.00 . A A . 41 TYR HA 1 1 7 6012 1 1 41 TYR HB2 H 15.176 -5.365 -0.674 1.00 . A A . 41 TYR HB2 1 1 7 6013 1 1 41 TYR HB3 H 16.008 -3.855 -0.320 1.00 . A A . 41 TYR HB3 1 1 7 6014 1 1 41 TYR HD1 H 13.910 -3.544 2.167 1.00 . A A . 41 TYR HD1 1 1 7 6015 1 1 41 TYR HD2 H 16.821 -6.396 0.937 1.00 . A A . 41 TYR HD2 1 1 7 6016 1 1 41 TYR HE1 H 14.191 -4.256 4.502 1.00 . A A . 41 TYR HE1 1 1 7 6017 1 1 41 TYR HE2 H 17.106 -7.115 3.272 1.00 . A A . 41 TYR HE2 1 1 7 6018 1 1 41 TYR HH H 16.083 -5.369 5.875 1.00 . A A . 41 TYR HH 1 1 7 6019 1 1 41 TYR N N 12.711 -4.565 -0.120 1.00 . A A . 41 TYR N 1 1 7 6020 1 1 41 TYR O O 14.249 -2.007 -1.974 1.00 . A A . 41 TYR O 1 1 7 6021 1 1 41 TYR OH O 15.818 -6.131 5.337 1.00 . A A . 41 TYR OH 1 1 7 6022 1 1 42 GLU C C 11.627 -3.421 -4.325 1.00 . A A . 42 GLU C 1 1 7 6023 1 1 42 GLU CA C 13.114 -3.512 -4.017 1.00 . A A . 42 GLU CA 1 1 7 6024 1 1 42 GLU CB C 13.794 -4.483 -4.989 1.00 . A A . 42 GLU CB 1 1 7 6025 1 1 42 GLU CD C 13.599 -6.884 -4.239 1.00 . A A . 42 GLU CD 1 1 7 6026 1 1 42 GLU CG C 14.481 -5.658 -4.311 1.00 . A A . 42 GLU CG 1 1 7 6027 1 1 42 GLU H H 12.932 -4.804 -2.362 1.00 . A A . 42 GLU H 1 1 7 6028 1 1 42 GLU HA H 13.554 -2.532 -4.126 1.00 . A A . 42 GLU HA 1 1 7 6029 1 1 42 GLU HB2 H 13.051 -4.873 -5.668 1.00 . A A . 42 GLU HB2 1 1 7 6030 1 1 42 GLU HB3 H 14.536 -3.940 -5.556 1.00 . A A . 42 GLU HB3 1 1 7 6031 1 1 42 GLU HG2 H 15.373 -5.907 -4.868 1.00 . A A . 42 GLU HG2 1 1 7 6032 1 1 42 GLU HG3 H 14.755 -5.369 -3.307 1.00 . A A . 42 GLU HG3 1 1 7 6033 1 1 42 GLU N N 13.299 -3.937 -2.640 1.00 . A A . 42 GLU N 1 1 7 6034 1 1 42 GLU O O 10.873 -4.347 -4.034 1.00 . A A . 42 GLU O 1 1 7 6035 1 1 42 GLU OE1 O 13.575 -7.660 -5.216 1.00 . A A . 42 GLU OE1 1 1 7 6036 1 1 42 GLU OE2 O 12.926 -7.082 -3.206 1.00 . A A . 42 GLU OE2 1 1 7 6037 1 1 43 VAL C C 9.246 -2.927 -6.149 1.00 . A A . 43 VAL C 1 1 7 6038 1 1 43 VAL CA C 9.785 -2.011 -5.045 1.00 . A A . 43 VAL CA 1 1 7 6039 1 1 43 VAL CB C 9.526 -0.526 -5.415 1.00 . A A . 43 VAL CB 1 1 7 6040 1 1 43 VAL CG1 C 10.536 -0.033 -6.442 1.00 . A A . 43 VAL CG1 1 1 7 6041 1 1 43 VAL CG2 C 8.103 -0.328 -5.922 1.00 . A A . 43 VAL CG2 1 1 7 6042 1 1 43 VAL H H 11.842 -1.526 -4.911 1.00 . A A . 43 VAL H 1 1 7 6043 1 1 43 VAL HA H 9.252 -2.224 -4.130 1.00 . A A . 43 VAL HA 1 1 7 6044 1 1 43 VAL HB H 9.648 0.066 -4.520 1.00 . A A . 43 VAL HB 1 1 7 6045 1 1 43 VAL HG11 H 10.273 0.967 -6.756 1.00 . A A . 43 VAL HG11 1 1 7 6046 1 1 43 VAL HG12 H 11.522 -0.024 -6.002 1.00 . A A . 43 VAL HG12 1 1 7 6047 1 1 43 VAL HG13 H 10.529 -0.691 -7.298 1.00 . A A . 43 VAL HG13 1 1 7 6048 1 1 43 VAL HG21 H 7.454 -1.066 -5.470 1.00 . A A . 43 VAL HG21 1 1 7 6049 1 1 43 VAL HG22 H 7.761 0.661 -5.657 1.00 . A A . 43 VAL HG22 1 1 7 6050 1 1 43 VAL HG23 H 8.084 -0.441 -6.996 1.00 . A A . 43 VAL HG23 1 1 7 6051 1 1 43 VAL N N 11.198 -2.260 -4.797 1.00 . A A . 43 VAL N 1 1 7 6052 1 1 43 VAL O O 9.735 -2.914 -7.283 1.00 . A A . 43 VAL O 1 1 7 6053 1 1 44 PRO C C 6.629 -4.011 -7.679 1.00 . A A . 44 PRO C 1 1 7 6054 1 1 44 PRO CA C 7.646 -4.702 -6.768 1.00 . A A . 44 PRO CA 1 1 7 6055 1 1 44 PRO CB C 6.960 -5.721 -5.858 1.00 . A A . 44 PRO CB 1 1 7 6056 1 1 44 PRO CD C 7.662 -3.891 -4.470 1.00 . A A . 44 PRO CD 1 1 7 6057 1 1 44 PRO CG C 6.603 -4.949 -4.633 1.00 . A A . 44 PRO CG 1 1 7 6058 1 1 44 PRO HA H 8.394 -5.194 -7.372 1.00 . A A . 44 PRO HA 1 1 7 6059 1 1 44 PRO HB2 H 6.082 -6.113 -6.349 1.00 . A A . 44 PRO HB2 1 1 7 6060 1 1 44 PRO HB3 H 7.643 -6.525 -5.631 1.00 . A A . 44 PRO HB3 1 1 7 6061 1 1 44 PRO HD2 H 7.221 -2.956 -4.157 1.00 . A A . 44 PRO HD2 1 1 7 6062 1 1 44 PRO HD3 H 8.406 -4.212 -3.758 1.00 . A A . 44 PRO HD3 1 1 7 6063 1 1 44 PRO HG2 H 5.634 -4.490 -4.760 1.00 . A A . 44 PRO HG2 1 1 7 6064 1 1 44 PRO HG3 H 6.597 -5.606 -3.775 1.00 . A A . 44 PRO HG3 1 1 7 6065 1 1 44 PRO N N 8.250 -3.765 -5.818 1.00 . A A . 44 PRO N 1 1 7 6066 1 1 44 PRO O O 5.439 -4.330 -7.657 1.00 . A A . 44 PRO O 1 1 7 6067 1 1 45 ASP C C 5.559 -3.117 -10.356 1.00 . A A . 45 ASP C 1 1 7 6068 1 1 45 ASP CA C 6.264 -2.241 -9.325 1.00 . A A . 45 ASP CA 1 1 7 6069 1 1 45 ASP CB C 7.109 -1.178 -10.029 1.00 . A A . 45 ASP CB 1 1 7 6070 1 1 45 ASP CG C 6.385 -0.522 -11.189 1.00 . A A . 45 ASP CG 1 1 7 6071 1 1 45 ASP H H 8.067 -2.822 -8.380 1.00 . A A . 45 ASP H 1 1 7 6072 1 1 45 ASP HA H 5.517 -1.750 -8.718 1.00 . A A . 45 ASP HA 1 1 7 6073 1 1 45 ASP HB2 H 7.375 -0.411 -9.318 1.00 . A A . 45 ASP HB2 1 1 7 6074 1 1 45 ASP HB3 H 8.012 -1.638 -10.408 1.00 . A A . 45 ASP HB3 1 1 7 6075 1 1 45 ASP N N 7.110 -3.036 -8.438 1.00 . A A . 45 ASP N 1 1 7 6076 1 1 45 ASP O O 6.200 -3.872 -11.093 1.00 . A A . 45 ASP O 1 1 7 6077 1 1 45 ASP OD1 O 5.281 0.024 -10.978 1.00 . A A . 45 ASP OD1 1 1 7 6078 1 1 45 ASP OD2 O 6.933 -0.523 -12.314 1.00 . A A . 45 ASP OD2 1 1 7 6079 1 1 46 GLY C C 2.105 -4.177 -10.784 1.00 . A A . 46 GLY C 1 1 7 6080 1 1 46 GLY CA C 3.465 -3.806 -11.331 1.00 . A A . 46 GLY CA 1 1 7 6081 1 1 46 GLY H H 3.778 -2.416 -9.766 1.00 . A A . 46 GLY H 1 1 7 6082 1 1 46 GLY HA2 H 3.336 -3.235 -12.239 1.00 . A A . 46 GLY HA2 1 1 7 6083 1 1 46 GLY HA3 H 4.007 -4.712 -11.563 1.00 . A A . 46 GLY HA3 1 1 7 6084 1 1 46 GLY N N 4.239 -3.026 -10.392 1.00 . A A . 46 GLY N 1 1 7 6085 1 1 46 GLY O O 1.508 -3.418 -10.016 1.00 . A A . 46 GLY O 1 1 7 6086 1 1 47 GLU C C 0.597 -6.518 -9.217 1.00 . A A . 47 GLU C 1 1 7 6087 1 1 47 GLU CA C 0.390 -5.886 -10.584 1.00 . A A . 47 GLU CA 1 1 7 6088 1 1 47 GLU CB C -0.216 -6.899 -11.554 1.00 . A A . 47 GLU CB 1 1 7 6089 1 1 47 GLU CD C 0.616 -7.629 -13.808 1.00 . A A . 47 GLU CD 1 1 7 6090 1 1 47 GLU CG C -0.031 -6.524 -13.013 1.00 . A A . 47 GLU CG 1 1 7 6091 1 1 47 GLU H H 2.221 -5.978 -11.642 1.00 . A A . 47 GLU H 1 1 7 6092 1 1 47 GLU HA H -0.284 -5.048 -10.483 1.00 . A A . 47 GLU HA 1 1 7 6093 1 1 47 GLU HB2 H 0.249 -7.859 -11.391 1.00 . A A . 47 GLU HB2 1 1 7 6094 1 1 47 GLU HB3 H -1.275 -6.981 -11.357 1.00 . A A . 47 GLU HB3 1 1 7 6095 1 1 47 GLU HG2 H -0.998 -6.311 -13.441 1.00 . A A . 47 GLU HG2 1 1 7 6096 1 1 47 GLU HG3 H 0.593 -5.644 -13.071 1.00 . A A . 47 GLU HG3 1 1 7 6097 1 1 47 GLU N N 1.655 -5.382 -11.099 1.00 . A A . 47 GLU N 1 1 7 6098 1 1 47 GLU O O 0.291 -7.691 -9.000 1.00 . A A . 47 GLU O 1 1 7 6099 1 1 47 GLU OE1 O -0.106 -8.559 -14.228 1.00 . A A . 47 GLU OE1 1 1 7 6100 1 1 47 GLU OE2 O 1.847 -7.584 -14.002 1.00 . A A . 47 GLU OE2 1 1 7 6101 1 1 48 TRP C C 0.120 -6.394 -6.199 1.00 . A A . 48 TRP C 1 1 7 6102 1 1 48 TRP CA C 1.426 -6.173 -6.958 1.00 . A A . 48 TRP CA 1 1 7 6103 1 1 48 TRP CB C 2.300 -5.123 -6.262 1.00 . A A . 48 TRP CB 1 1 7 6104 1 1 48 TRP CD1 C 3.229 -6.375 -4.230 1.00 . A A . 48 TRP CD1 1 1 7 6105 1 1 48 TRP CD2 C 2.031 -4.553 -3.728 1.00 . A A . 48 TRP CD2 1 1 7 6106 1 1 48 TRP CE2 C 2.483 -5.134 -2.531 1.00 . A A . 48 TRP CE2 1 1 7 6107 1 1 48 TRP CE3 C 1.253 -3.396 -3.664 1.00 . A A . 48 TRP CE3 1 1 7 6108 1 1 48 TRP CG C 2.520 -5.361 -4.803 1.00 . A A . 48 TRP CG 1 1 7 6109 1 1 48 TRP CH2 C 1.417 -3.460 -1.253 1.00 . A A . 48 TRP CH2 1 1 7 6110 1 1 48 TRP CZ2 C 2.183 -4.591 -1.286 1.00 . A A . 48 TRP CZ2 1 1 7 6111 1 1 48 TRP CZ3 C 0.956 -2.859 -2.428 1.00 . A A . 48 TRP CZ3 1 1 7 6112 1 1 48 TRP H H 1.376 -4.810 -8.565 1.00 . A A . 48 TRP H 1 1 7 6113 1 1 48 TRP HA H 1.967 -7.106 -7.014 1.00 . A A . 48 TRP HA 1 1 7 6114 1 1 48 TRP HB2 H 3.269 -5.104 -6.738 1.00 . A A . 48 TRP HB2 1 1 7 6115 1 1 48 TRP HB3 H 1.835 -4.155 -6.376 1.00 . A A . 48 TRP HB3 1 1 7 6116 1 1 48 TRP HD1 H 3.725 -7.157 -4.782 1.00 . A A . 48 TRP HD1 1 1 7 6117 1 1 48 TRP HE1 H 3.665 -6.845 -2.228 1.00 . A A . 48 TRP HE1 1 1 7 6118 1 1 48 TRP HE3 H 0.888 -2.917 -4.562 1.00 . A A . 48 TRP HE3 1 1 7 6119 1 1 48 TRP HH2 H 1.159 -3.009 -0.308 1.00 . A A . 48 TRP HH2 1 1 7 6120 1 1 48 TRP HZ2 H 2.528 -5.043 -0.367 1.00 . A A . 48 TRP HZ2 1 1 7 6121 1 1 48 TRP HZ3 H 0.353 -1.966 -2.361 1.00 . A A . 48 TRP HZ3 1 1 7 6122 1 1 48 TRP N N 1.149 -5.730 -8.312 1.00 . A A . 48 TRP N 1 1 7 6123 1 1 48 TRP NE1 N 3.219 -6.242 -2.862 1.00 . A A . 48 TRP NE1 1 1 7 6124 1 1 48 TRP O O -0.807 -5.596 -6.310 1.00 . A A . 48 TRP O 1 1 7 6125 1 1 49 GLN C C -0.978 -7.590 -3.274 1.00 . A A . 49 GLN C 1 1 7 6126 1 1 49 GLN CA C -1.188 -7.841 -4.760 1.00 . A A . 49 GLN CA 1 1 7 6127 1 1 49 GLN CB C -1.594 -9.301 -5.019 1.00 . A A . 49 GLN CB 1 1 7 6128 1 1 49 GLN CD C -3.406 -10.131 -3.449 1.00 . A A . 49 GLN CD 1 1 7 6129 1 1 49 GLN CG C -1.921 -10.106 -3.765 1.00 . A A . 49 GLN CG 1 1 7 6130 1 1 49 GLN H H 0.774 -8.143 -5.493 1.00 . A A . 49 GLN H 1 1 7 6131 1 1 49 GLN HA H -1.977 -7.190 -5.110 1.00 . A A . 49 GLN HA 1 1 7 6132 1 1 49 GLN HB2 H -2.466 -9.309 -5.656 1.00 . A A . 49 GLN HB2 1 1 7 6133 1 1 49 GLN HB3 H -0.784 -9.796 -5.534 1.00 . A A . 49 GLN HB3 1 1 7 6134 1 1 49 GLN HE21 H -3.275 -8.355 -2.571 1.00 . A A . 49 GLN HE21 1 1 7 6135 1 1 49 GLN HE22 H -4.852 -9.064 -2.593 1.00 . A A . 49 GLN HE22 1 1 7 6136 1 1 49 GLN HG2 H -1.583 -11.123 -3.908 1.00 . A A . 49 GLN HG2 1 1 7 6137 1 1 49 GLN HG3 H -1.398 -9.668 -2.928 1.00 . A A . 49 GLN HG3 1 1 7 6138 1 1 49 GLN N N 0.021 -7.511 -5.499 1.00 . A A . 49 GLN N 1 1 7 6139 1 1 49 GLN NE2 N -3.892 -9.082 -2.808 1.00 . A A . 49 GLN NE2 1 1 7 6140 1 1 49 GLN O O 0.115 -7.806 -2.746 1.00 . A A . 49 GLN O 1 1 7 6141 1 1 49 GLN OE1 O -4.104 -11.092 -3.764 1.00 . A A . 49 GLN OE1 1 1 7 6142 1 1 50 CYS C C -1.657 -7.908 -0.316 1.00 . A A . 50 CYS C 1 1 7 6143 1 1 50 CYS CA C -1.920 -6.709 -1.222 1.00 . A A . 50 CYS CA 1 1 7 6144 1 1 50 CYS CB C -3.212 -6.074 -0.757 1.00 . A A . 50 CYS CB 1 1 7 6145 1 1 50 CYS H H -2.812 -6.808 -3.127 1.00 . A A . 50 CYS H 1 1 7 6146 1 1 50 CYS HA H -1.119 -5.995 -1.102 1.00 . A A . 50 CYS HA 1 1 7 6147 1 1 50 CYS HB2 H -3.768 -6.786 -0.171 1.00 . A A . 50 CYS HB2 1 1 7 6148 1 1 50 CYS HB3 H -2.961 -5.222 -0.137 1.00 . A A . 50 CYS HB3 1 1 7 6149 1 1 50 CYS N N -2.002 -7.055 -2.625 1.00 . A A . 50 CYS N 1 1 7 6150 1 1 50 CYS O O -2.538 -8.745 -0.108 1.00 . A A . 50 CYS O 1 1 7 6151 1 1 50 CYS SG S -4.309 -5.460 -2.060 1.00 . A A . 50 CYS SG 1 1 7 6152 1 1 51 PRO C C -0.838 -8.177 2.840 1.00 . A A . 51 PRO C 1 1 7 6153 1 1 51 PRO CA C -0.300 -8.756 1.529 1.00 . A A . 51 PRO CA 1 1 7 6154 1 1 51 PRO CB C 1.227 -8.806 1.546 1.00 . A A . 51 PRO CB 1 1 7 6155 1 1 51 PRO CD C 0.464 -6.804 0.393 1.00 . A A . 51 PRO CD 1 1 7 6156 1 1 51 PRO CG C 1.673 -7.475 1.009 1.00 . A A . 51 PRO CG 1 1 7 6157 1 1 51 PRO HA H -0.710 -9.741 1.354 1.00 . A A . 51 PRO HA 1 1 7 6158 1 1 51 PRO HB2 H 1.573 -8.961 2.558 1.00 . A A . 51 PRO HB2 1 1 7 6159 1 1 51 PRO HB3 H 1.568 -9.615 0.918 1.00 . A A . 51 PRO HB3 1 1 7 6160 1 1 51 PRO HD2 H 0.165 -5.948 0.981 1.00 . A A . 51 PRO HD2 1 1 7 6161 1 1 51 PRO HD3 H 0.675 -6.510 -0.623 1.00 . A A . 51 PRO HD3 1 1 7 6162 1 1 51 PRO HG2 H 2.058 -6.870 1.817 1.00 . A A . 51 PRO HG2 1 1 7 6163 1 1 51 PRO HG3 H 2.439 -7.624 0.261 1.00 . A A . 51 PRO HG3 1 1 7 6164 1 1 51 PRO N N -0.557 -7.851 0.435 1.00 . A A . 51 PRO N 1 1 7 6165 1 1 51 PRO O O -0.359 -8.515 3.925 1.00 . A A . 51 PRO O 1 1 7 6166 1 1 52 ARG C C -3.649 -5.993 3.771 1.00 . A A . 52 ARG C 1 1 7 6167 1 1 52 ARG CA C -2.195 -6.454 3.894 1.00 . A A . 52 ARG CA 1 1 7 6168 1 1 52 ARG CB C -1.300 -5.247 4.172 1.00 . A A . 52 ARG CB 1 1 7 6169 1 1 52 ARG CD C -0.804 -6.069 6.493 1.00 . A A . 52 ARG CD 1 1 7 6170 1 1 52 ARG CG C -1.228 -4.880 5.646 1.00 . A A . 52 ARG CG 1 1 7 6171 1 1 52 ARG CZ C -1.858 -6.422 8.697 1.00 . A A . 52 ARG CZ 1 1 7 6172 1 1 52 ARG H H -1.985 -6.878 1.827 1.00 . A A . 52 ARG H 1 1 7 6173 1 1 52 ARG HA H -2.126 -7.128 4.735 1.00 . A A . 52 ARG HA 1 1 7 6174 1 1 52 ARG HB2 H -0.300 -5.465 3.827 1.00 . A A . 52 ARG HB2 1 1 7 6175 1 1 52 ARG HB3 H -1.681 -4.394 3.630 1.00 . A A . 52 ARG HB3 1 1 7 6176 1 1 52 ARG HD2 H -0.512 -6.876 5.839 1.00 . A A . 52 ARG HD2 1 1 7 6177 1 1 52 ARG HD3 H 0.041 -5.777 7.101 1.00 . A A . 52 ARG HD3 1 1 7 6178 1 1 52 ARG HE H -2.657 -6.962 6.943 1.00 . A A . 52 ARG HE 1 1 7 6179 1 1 52 ARG HG2 H -0.512 -4.084 5.776 1.00 . A A . 52 ARG HG2 1 1 7 6180 1 1 52 ARG HG3 H -2.203 -4.548 5.971 1.00 . A A . 52 ARG HG3 1 1 7 6181 1 1 52 ARG HH11 H -0.047 -5.498 8.775 1.00 . A A . 52 ARG HH11 1 1 7 6182 1 1 52 ARG HH12 H -0.823 -5.754 10.316 1.00 . A A . 52 ARG HH12 1 1 7 6183 1 1 52 ARG HH21 H -3.653 -7.326 8.948 1.00 . A A . 52 ARG HH21 1 1 7 6184 1 1 52 ARG HH22 H -2.866 -6.815 10.416 1.00 . A A . 52 ARG HH22 1 1 7 6185 1 1 52 ARG N N -1.723 -7.181 2.723 1.00 . A A . 52 ARG N 1 1 7 6186 1 1 52 ARG NE N -1.876 -6.535 7.369 1.00 . A A . 52 ARG NE 1 1 7 6187 1 1 52 ARG NH1 N -0.825 -5.850 9.308 1.00 . A A . 52 ARG NH1 1 1 7 6188 1 1 52 ARG NH2 N -2.871 -6.889 9.409 1.00 . A A . 52 ARG NH2 1 1 7 6189 1 1 52 ARG O O -4.417 -6.153 4.715 1.00 . A A . 52 ARG O 1 1 7 6190 1 1 53 CYS C C -6.329 -5.843 2.076 1.00 . A A . 53 CYS C 1 1 7 6191 1 1 53 CYS CA C -5.350 -4.784 2.547 1.00 . A A . 53 CYS CA 1 1 7 6192 1 1 53 CYS CB C -5.366 -3.614 1.572 1.00 . A A . 53 CYS CB 1 1 7 6193 1 1 53 CYS H H -3.369 -5.192 1.944 1.00 . A A . 53 CYS H 1 1 7 6194 1 1 53 CYS HA H -5.653 -4.436 3.521 1.00 . A A . 53 CYS HA 1 1 7 6195 1 1 53 CYS HB2 H -6.091 -3.829 0.803 1.00 . A A . 53 CYS HB2 1 1 7 6196 1 1 53 CYS HB3 H -5.662 -2.721 2.098 1.00 . A A . 53 CYS HB3 1 1 7 6197 1 1 53 CYS N N -4.011 -5.341 2.668 1.00 . A A . 53 CYS N 1 1 7 6198 1 1 53 CYS O O -7.521 -5.797 2.380 1.00 . A A . 53 CYS O 1 1 7 6199 1 1 53 CYS SG S -3.798 -3.260 0.720 1.00 . A A . 53 CYS SG 1 1 7 6200 1 1 54 THR C C -7.099 -8.802 1.669 1.00 . A A . 54 THR C 1 1 7 6201 1 1 54 THR CA C -6.626 -7.763 0.643 1.00 . A A . 54 THR CA 1 1 7 6202 1 1 54 THR CB C -5.820 -8.420 -0.496 1.00 . A A . 54 THR CB 1 1 7 6203 1 1 54 THR CG2 C -5.821 -9.934 -0.397 1.00 . A A . 54 THR CG2 1 1 7 6204 1 1 54 THR H H -4.881 -6.654 0.998 1.00 . A A . 54 THR H 1 1 7 6205 1 1 54 THR HA H -7.491 -7.287 0.209 1.00 . A A . 54 THR HA 1 1 7 6206 1 1 54 THR HB H -4.797 -8.079 -0.419 1.00 . A A . 54 THR HB 1 1 7 6207 1 1 54 THR HG1 H -5.997 -7.111 -1.965 1.00 . A A . 54 THR HG1 1 1 7 6208 1 1 54 THR HG21 H -6.776 -10.270 -0.026 1.00 . A A . 54 THR HG21 1 1 7 6209 1 1 54 THR HG22 H -5.041 -10.235 0.288 1.00 . A A . 54 THR HG22 1 1 7 6210 1 1 54 THR HG23 H -5.636 -10.363 -1.369 1.00 . A A . 54 THR HG23 1 1 7 6211 1 1 54 THR N N -5.820 -6.739 1.262 1.00 . A A . 54 THR N 1 1 7 6212 1 1 54 THR O O -8.136 -9.439 1.478 1.00 . A A . 54 THR O 1 1 7 6213 1 1 54 THR OG1 O -6.336 -8.001 -1.765 1.00 . A A . 54 THR OG1 1 1 7 6214 1 1 55 CYS C C -8.154 -9.526 4.409 1.00 . A A . 55 CYS C 1 1 7 6215 1 1 55 CYS CA C -6.757 -9.843 3.844 1.00 . A A . 55 CYS CA 1 1 7 6216 1 1 55 CYS CB C -5.697 -9.853 4.953 1.00 . A A . 55 CYS CB 1 1 7 6217 1 1 55 CYS H H -5.597 -8.340 2.907 1.00 . A A . 55 CYS H 1 1 7 6218 1 1 55 CYS HA H -6.794 -10.829 3.403 1.00 . A A . 55 CYS HA 1 1 7 6219 1 1 55 CYS HB2 H -5.975 -9.138 5.712 1.00 . A A . 55 CYS HB2 1 1 7 6220 1 1 55 CYS HB3 H -5.658 -10.839 5.393 1.00 . A A . 55 CYS HB3 1 1 7 6221 1 1 55 CYS HG H -3.777 -10.157 3.296 1.00 . A A . 55 CYS HG 1 1 7 6222 1 1 55 CYS N N -6.381 -8.913 2.784 1.00 . A A . 55 CYS N 1 1 7 6223 1 1 55 CYS O O -9.042 -10.376 4.357 1.00 . A A . 55 CYS O 1 1 7 6224 1 1 55 CYS SG S -4.032 -9.433 4.383 1.00 . A A . 55 CYS SG 1 1 7 6225 1 1 56 PRO C C -10.751 -7.777 4.331 1.00 . A A . 56 PRO C 1 1 7 6226 1 1 56 PRO CA C -9.718 -7.916 5.447 1.00 . A A . 56 PRO CA 1 1 7 6227 1 1 56 PRO CB C -9.479 -6.558 6.126 1.00 . A A . 56 PRO CB 1 1 7 6228 1 1 56 PRO CD C -7.431 -7.200 5.085 1.00 . A A . 56 PRO CD 1 1 7 6229 1 1 56 PRO CG C -7.998 -6.422 6.233 1.00 . A A . 56 PRO CG 1 1 7 6230 1 1 56 PRO HA H -10.073 -8.629 6.175 1.00 . A A . 56 PRO HA 1 1 7 6231 1 1 56 PRO HB2 H -9.903 -5.772 5.518 1.00 . A A . 56 PRO HB2 1 1 7 6232 1 1 56 PRO HB3 H -9.945 -6.555 7.100 1.00 . A A . 56 PRO HB3 1 1 7 6233 1 1 56 PRO HD2 H -7.392 -6.590 4.194 1.00 . A A . 56 PRO HD2 1 1 7 6234 1 1 56 PRO HD3 H -6.451 -7.580 5.330 1.00 . A A . 56 PRO HD3 1 1 7 6235 1 1 56 PRO HG2 H -7.720 -5.381 6.155 1.00 . A A . 56 PRO HG2 1 1 7 6236 1 1 56 PRO HG3 H -7.659 -6.833 7.172 1.00 . A A . 56 PRO HG3 1 1 7 6237 1 1 56 PRO N N -8.398 -8.298 4.930 1.00 . A A . 56 PRO N 1 1 7 6238 1 1 56 PRO O O -11.957 -7.904 4.561 1.00 . A A . 56 PRO O 1 1 7 6239 1 1 57 ALA C C -11.697 -8.776 1.560 1.00 . A A . 57 ALA C 1 1 7 6240 1 1 57 ALA CA C -11.153 -7.411 1.962 1.00 . A A . 57 ALA CA 1 1 7 6241 1 1 57 ALA CB C -10.417 -6.764 0.798 1.00 . A A . 57 ALA CB 1 1 7 6242 1 1 57 ALA H H -9.303 -7.459 2.989 1.00 . A A . 57 ALA H 1 1 7 6243 1 1 57 ALA HA H -11.980 -6.772 2.238 1.00 . A A . 57 ALA HA 1 1 7 6244 1 1 57 ALA HB1 H -9.578 -7.382 0.513 1.00 . A A . 57 ALA HB1 1 1 7 6245 1 1 57 ALA HB2 H -11.089 -6.662 -0.042 1.00 . A A . 57 ALA HB2 1 1 7 6246 1 1 57 ALA HB3 H -10.062 -5.789 1.094 1.00 . A A . 57 ALA HB3 1 1 7 6247 1 1 57 ALA N N -10.274 -7.533 3.116 1.00 . A A . 57 ALA N 1 1 7 6248 1 1 57 ALA O O -12.909 -8.990 1.516 1.00 . A A . 57 ALA O 1 1 7 6249 1 1 58 LEU C C -10.705 -12.031 2.095 1.00 . A A . 58 LEU C 1 1 7 6250 1 1 58 LEU CA C -11.172 -11.080 1.001 1.00 . A A . 58 LEU CA 1 1 7 6251 1 1 58 LEU CB C -10.571 -11.485 -0.348 1.00 . A A . 58 LEU CB 1 1 7 6252 1 1 58 LEU CD1 C -10.121 -10.955 -2.755 1.00 . A A . 58 LEU CD1 1 1 7 6253 1 1 58 LEU CD2 C -12.410 -10.606 -1.808 1.00 . A A . 58 LEU CD2 1 1 7 6254 1 1 58 LEU CG C -10.916 -10.564 -1.518 1.00 . A A . 58 LEU CG 1 1 7 6255 1 1 58 LEU H H -9.841 -9.502 1.450 1.00 . A A . 58 LEU H 1 1 7 6256 1 1 58 LEU HA H -12.249 -11.122 0.935 1.00 . A A . 58 LEU HA 1 1 7 6257 1 1 58 LEU HB2 H -9.496 -11.514 -0.245 1.00 . A A . 58 LEU HB2 1 1 7 6258 1 1 58 LEU HB3 H -10.920 -12.478 -0.587 1.00 . A A . 58 LEU HB3 1 1 7 6259 1 1 58 LEU HD11 H -10.107 -12.031 -2.847 1.00 . A A . 58 LEU HD11 1 1 7 6260 1 1 58 LEU HD12 H -10.585 -10.526 -3.630 1.00 . A A . 58 LEU HD12 1 1 7 6261 1 1 58 LEU HD13 H -9.110 -10.587 -2.667 1.00 . A A . 58 LEU HD13 1 1 7 6262 1 1 58 LEU HD21 H -12.589 -10.287 -2.825 1.00 . A A . 58 LEU HD21 1 1 7 6263 1 1 58 LEU HD22 H -12.773 -11.614 -1.678 1.00 . A A . 58 LEU HD22 1 1 7 6264 1 1 58 LEU HD23 H -12.931 -9.946 -1.128 1.00 . A A . 58 LEU HD23 1 1 7 6265 1 1 58 LEU HG H -10.654 -9.548 -1.261 1.00 . A A . 58 LEU HG 1 1 7 6266 1 1 58 LEU N N -10.794 -9.717 1.336 1.00 . A A . 58 LEU N 1 1 7 6267 1 1 58 LEU O O -11.345 -12.143 3.139 1.00 . A A . 58 LEU O 1 1 7 6268 1 1 59 LYS C C -7.463 -13.217 3.016 1.00 . A A . 59 LYS C 1 1 7 6269 1 1 59 LYS CA C -8.948 -13.513 2.890 1.00 . A A . 59 LYS CA 1 1 7 6270 1 1 59 LYS CB C -9.151 -14.985 2.515 1.00 . A A . 59 LYS CB 1 1 7 6271 1 1 59 LYS CD C -10.810 -15.276 4.384 1.00 . A A . 59 LYS CD 1 1 7 6272 1 1 59 LYS CE C -12.268 -14.896 4.579 1.00 . A A . 59 LYS CE 1 1 7 6273 1 1 59 LYS CG C -10.503 -15.544 2.920 1.00 . A A . 59 LYS CG 1 1 7 6274 1 1 59 LYS H H -9.044 -12.453 1.067 1.00 . A A . 59 LYS H 1 1 7 6275 1 1 59 LYS HA H -9.429 -13.317 3.837 1.00 . A A . 59 LYS HA 1 1 7 6276 1 1 59 LYS HB2 H -9.051 -15.089 1.444 1.00 . A A . 59 LYS HB2 1 1 7 6277 1 1 59 LYS HB3 H -8.385 -15.574 2.996 1.00 . A A . 59 LYS HB3 1 1 7 6278 1 1 59 LYS HD2 H -10.598 -16.166 4.958 1.00 . A A . 59 LYS HD2 1 1 7 6279 1 1 59 LYS HD3 H -10.186 -14.465 4.731 1.00 . A A . 59 LYS HD3 1 1 7 6280 1 1 59 LYS HE2 H -12.379 -13.839 4.391 1.00 . A A . 59 LYS HE2 1 1 7 6281 1 1 59 LYS HE3 H -12.869 -15.453 3.875 1.00 . A A . 59 LYS HE3 1 1 7 6282 1 1 59 LYS HG2 H -11.268 -15.083 2.314 1.00 . A A . 59 LYS HG2 1 1 7 6283 1 1 59 LYS HG3 H -10.505 -16.612 2.752 1.00 . A A . 59 LYS HG3 1 1 7 6284 1 1 59 LYS HZ1 H -13.779 -15.183 5.991 1.00 . A A . 59 LYS HZ1 1 1 7 6285 1 1 59 LYS HZ2 H -12.373 -14.477 6.624 1.00 . A A . 59 LYS HZ2 1 1 7 6286 1 1 59 LYS HZ3 H -12.400 -16.132 6.260 1.00 . A A . 59 LYS HZ3 1 1 7 6287 1 1 59 LYS N N -9.545 -12.639 1.892 1.00 . A A . 59 LYS N 1 1 7 6288 1 1 59 LYS NZ N -12.736 -15.192 5.958 1.00 . A A . 59 LYS NZ 1 1 7 6289 1 1 59 LYS O O -6.838 -12.727 2.073 1.00 . A A . 59 LYS O 1 1 7 6290 1 1 60 GLY C C -4.632 -14.435 3.913 1.00 . A A . 60 GLY C 1 1 7 6291 1 1 60 GLY CA C -5.488 -13.284 4.393 1.00 . A A . 60 GLY CA 1 1 7 6292 1 1 60 GLY H H -7.451 -13.905 4.894 1.00 . A A . 60 GLY H 1 1 7 6293 1 1 60 GLY HA2 H -5.196 -12.387 3.867 1.00 . A A . 60 GLY HA2 1 1 7 6294 1 1 60 GLY HA3 H -5.317 -13.140 5.450 1.00 . A A . 60 GLY HA3 1 1 7 6295 1 1 60 GLY N N -6.900 -13.517 4.174 1.00 . A A . 60 GLY N 1 1 7 6296 1 1 60 GLY O O -5.131 -15.374 3.289 1.00 . A A . 60 GLY O 1 1 7 6297 1 1 61 LYS C C -1.532 -15.762 5.055 1.00 . A A . 61 LYS C 1 1 7 6298 1 1 61 LYS CA C -2.423 -15.432 3.869 1.00 . A A . 61 LYS CA 1 1 7 6299 1 1 61 LYS CB C -1.569 -15.011 2.672 1.00 . A A . 61 LYS CB 1 1 7 6300 1 1 61 LYS CD C -1.613 -14.335 0.255 1.00 . A A . 61 LYS CD 1 1 7 6301 1 1 61 LYS CE C -0.950 -15.204 -0.799 1.00 . A A . 61 LYS CE 1 1 7 6302 1 1 61 LYS CG C -2.271 -15.177 1.335 1.00 . A A . 61 LYS CG 1 1 7 6303 1 1 61 LYS H H -3.025 -13.618 4.762 1.00 . A A . 61 LYS H 1 1 7 6304 1 1 61 LYS HA H -2.997 -16.308 3.606 1.00 . A A . 61 LYS HA 1 1 7 6305 1 1 61 LYS HB2 H -1.296 -13.973 2.785 1.00 . A A . 61 LYS HB2 1 1 7 6306 1 1 61 LYS HB3 H -0.672 -15.613 2.659 1.00 . A A . 61 LYS HB3 1 1 7 6307 1 1 61 LYS HD2 H -2.365 -13.721 -0.219 1.00 . A A . 61 LYS HD2 1 1 7 6308 1 1 61 LYS HD3 H -0.865 -13.703 0.712 1.00 . A A . 61 LYS HD3 1 1 7 6309 1 1 61 LYS HE2 H -1.207 -16.234 -0.610 1.00 . A A . 61 LYS HE2 1 1 7 6310 1 1 61 LYS HE3 H -1.321 -14.915 -1.773 1.00 . A A . 61 LYS HE3 1 1 7 6311 1 1 61 LYS HG2 H -2.229 -16.216 1.044 1.00 . A A . 61 LYS HG2 1 1 7 6312 1 1 61 LYS HG3 H -3.301 -14.870 1.442 1.00 . A A . 61 LYS HG3 1 1 7 6313 1 1 61 LYS HZ1 H 0.963 -15.776 -1.411 1.00 . A A . 61 LYS HZ1 1 1 7 6314 1 1 61 LYS HZ2 H 0.894 -15.205 0.183 1.00 . A A . 61 LYS HZ2 1 1 7 6315 1 1 61 LYS HZ3 H 0.803 -14.115 -1.114 1.00 . A A . 61 LYS HZ3 1 1 7 6316 1 1 61 LYS N N -3.352 -14.378 4.231 1.00 . A A . 61 LYS N 1 1 7 6317 1 1 61 LYS NZ N 0.528 -15.064 -0.783 1.00 . A A . 61 LYS NZ 1 1 7 6318 1 1 61 LYS O O -1.550 -14.994 6.038 1.00 . A A . 61 LYS O 1 1 7 6319 1 1 61 LYS OXT O -0.838 -16.794 5.012 1.00 . A A . 61 LYS OXT 1 1 7 6320 2 2 1 ZN ZN ZN -4.366 -3.322 -1.487 1.00 . B A . 62 ZN ZN 1 1 7 6321 3 2 1 ZN ZN ZN 3.897 3.779 3.855 1.00 . C A . 63 ZN ZN 1 1 8 6322 1 1 1 GLY C C -4.129 8.046 -6.973 1.00 . A A . 1 GLY C 1 1 8 6323 1 1 1 GLY CA C -4.382 6.559 -6.905 1.00 . A A . 1 GLY CA 1 1 8 6324 1 1 1 GLY H1 H -2.921 5.322 -7.728 1.00 . A A . 1 GLY H1 1 1 8 6325 1 1 1 GLY H2 H -3.196 5.058 -6.074 1.00 . A A . 1 GLY H2 1 1 8 6326 1 1 1 GLY H3 H -2.325 6.420 -6.583 1.00 . A A . 1 GLY H3 1 1 8 6327 1 1 1 GLY HA2 H -4.920 6.254 -7.792 1.00 . A A . 1 GLY HA2 1 1 8 6328 1 1 1 GLY HA3 H -4.988 6.346 -6.037 1.00 . A A . 1 GLY HA3 1 1 8 6329 1 1 1 GLY N N -3.121 5.786 -6.816 1.00 . A A . 1 GLY N 1 1 8 6330 1 1 1 GLY O O -3.252 8.553 -6.277 1.00 . A A . 1 GLY O 1 1 8 6331 1 1 2 PRO C C -4.961 11.014 -6.798 1.00 . A A . 2 PRO C 1 1 8 6332 1 1 2 PRO CA C -4.634 10.204 -8.052 1.00 . A A . 2 PRO CA 1 1 8 6333 1 1 2 PRO CB C -5.599 10.557 -9.190 1.00 . A A . 2 PRO CB 1 1 8 6334 1 1 2 PRO CD C -5.837 8.219 -8.790 1.00 . A A . 2 PRO CD 1 1 8 6335 1 1 2 PRO CG C -5.895 9.262 -9.867 1.00 . A A . 2 PRO CG 1 1 8 6336 1 1 2 PRO HA H -3.620 10.418 -8.358 1.00 . A A . 2 PRO HA 1 1 8 6337 1 1 2 PRO HB2 H -6.492 11.000 -8.779 1.00 . A A . 2 PRO HB2 1 1 8 6338 1 1 2 PRO HB3 H -5.122 11.253 -9.864 1.00 . A A . 2 PRO HB3 1 1 8 6339 1 1 2 PRO HD2 H -6.799 8.116 -8.310 1.00 . A A . 2 PRO HD2 1 1 8 6340 1 1 2 PRO HD3 H -5.511 7.272 -9.197 1.00 . A A . 2 PRO HD3 1 1 8 6341 1 1 2 PRO HG2 H -6.881 9.295 -10.307 1.00 . A A . 2 PRO HG2 1 1 8 6342 1 1 2 PRO HG3 H -5.152 9.061 -10.624 1.00 . A A . 2 PRO HG3 1 1 8 6343 1 1 2 PRO N N -4.836 8.765 -7.858 1.00 . A A . 2 PRO N 1 1 8 6344 1 1 2 PRO O O -4.098 11.705 -6.253 1.00 . A A . 2 PRO O 1 1 8 6345 1 1 3 LEU C C -7.168 10.668 -4.103 1.00 . A A . 3 LEU C 1 1 8 6346 1 1 3 LEU CA C -6.614 11.637 -5.139 1.00 . A A . 3 LEU CA 1 1 8 6347 1 1 3 LEU CB C -7.674 12.691 -5.479 1.00 . A A . 3 LEU CB 1 1 8 6348 1 1 3 LEU CD1 C -8.296 15.118 -5.524 1.00 . A A . 3 LEU CD1 1 1 8 6349 1 1 3 LEU CD2 C -6.056 14.435 -4.652 1.00 . A A . 3 LEU CD2 1 1 8 6350 1 1 3 LEU CG C -7.155 14.121 -5.660 1.00 . A A . 3 LEU CG 1 1 8 6351 1 1 3 LEU H H -6.851 10.353 -6.809 1.00 . A A . 3 LEU H 1 1 8 6352 1 1 3 LEU HA H -5.746 12.130 -4.726 1.00 . A A . 3 LEU HA 1 1 8 6353 1 1 3 LEU HB2 H -8.164 12.393 -6.395 1.00 . A A . 3 LEU HB2 1 1 8 6354 1 1 3 LEU HB3 H -8.408 12.699 -4.688 1.00 . A A . 3 LEU HB3 1 1 8 6355 1 1 3 LEU HD11 H -8.378 15.436 -4.495 1.00 . A A . 3 LEU HD11 1 1 8 6356 1 1 3 LEU HD12 H -8.103 15.976 -6.152 1.00 . A A . 3 LEU HD12 1 1 8 6357 1 1 3 LEU HD13 H -9.221 14.650 -5.830 1.00 . A A . 3 LEU HD13 1 1 8 6358 1 1 3 LEU HD21 H -6.351 14.085 -3.674 1.00 . A A . 3 LEU HD21 1 1 8 6359 1 1 3 LEU HD22 H -5.142 13.941 -4.949 1.00 . A A . 3 LEU HD22 1 1 8 6360 1 1 3 LEU HD23 H -5.893 15.503 -4.618 1.00 . A A . 3 LEU HD23 1 1 8 6361 1 1 3 LEU HG H -6.740 14.222 -6.653 1.00 . A A . 3 LEU HG 1 1 8 6362 1 1 3 LEU N N -6.198 10.922 -6.336 1.00 . A A . 3 LEU N 1 1 8 6363 1 1 3 LEU O O -7.727 9.627 -4.450 1.00 . A A . 3 LEU O 1 1 8 6364 1 1 4 GLY C C -9.019 10.757 -1.373 1.00 . A A . 4 GLY C 1 1 8 6365 1 1 4 GLY CA C -7.656 10.248 -1.781 1.00 . A A . 4 GLY CA 1 1 8 6366 1 1 4 GLY H H -6.697 11.934 -2.627 1.00 . A A . 4 GLY H 1 1 8 6367 1 1 4 GLY HA2 H -7.748 9.228 -2.125 1.00 . A A . 4 GLY HA2 1 1 8 6368 1 1 4 GLY HA3 H -7.000 10.275 -0.925 1.00 . A A . 4 GLY HA3 1 1 8 6369 1 1 4 GLY N N -7.087 11.054 -2.840 1.00 . A A . 4 GLY N 1 1 8 6370 1 1 4 GLY O O -9.164 11.389 -0.327 1.00 . A A . 4 GLY O 1 1 8 6371 1 1 5 SER C C -11.919 10.493 -0.713 1.00 . A A . 5 SER C 1 1 8 6372 1 1 5 SER CA C -11.351 11.049 -2.016 1.00 . A A . 5 SER CA 1 1 8 6373 1 1 5 SER CB C -12.234 10.652 -3.198 1.00 . A A . 5 SER CB 1 1 8 6374 1 1 5 SER H H -9.804 10.091 -3.086 1.00 . A A . 5 SER H 1 1 8 6375 1 1 5 SER HA H -11.310 12.126 -1.951 1.00 . A A . 5 SER HA 1 1 8 6376 1 1 5 SER HB2 H -13.121 10.155 -2.833 1.00 . A A . 5 SER HB2 1 1 8 6377 1 1 5 SER HB3 H -12.516 11.537 -3.749 1.00 . A A . 5 SER HB3 1 1 8 6378 1 1 5 SER HG H -11.174 10.274 -4.815 1.00 . A A . 5 SER HG 1 1 8 6379 1 1 5 SER N N -10.001 10.558 -2.243 1.00 . A A . 5 SER N 1 1 8 6380 1 1 5 SER O O -12.092 11.222 0.265 1.00 . A A . 5 SER O 1 1 8 6381 1 1 5 SER OG O -11.535 9.771 -4.067 1.00 . A A . 5 SER OG 1 1 8 6382 1 1 6 ASP C C -12.246 7.026 0.421 1.00 . A A . 6 ASP C 1 1 8 6383 1 1 6 ASP CA C -12.554 8.507 0.532 1.00 . A A . 6 ASP CA 1 1 8 6384 1 1 6 ASP CB C -14.053 8.720 0.759 1.00 . A A . 6 ASP CB 1 1 8 6385 1 1 6 ASP CG C -14.362 9.172 2.172 1.00 . A A . 6 ASP CG 1 1 8 6386 1 1 6 ASP H H -11.879 8.647 -1.466 1.00 . A A . 6 ASP H 1 1 8 6387 1 1 6 ASP HA H -12.005 8.918 1.368 1.00 . A A . 6 ASP HA 1 1 8 6388 1 1 6 ASP HB2 H -14.412 9.474 0.074 1.00 . A A . 6 ASP HB2 1 1 8 6389 1 1 6 ASP HB3 H -14.575 7.793 0.576 1.00 . A A . 6 ASP HB3 1 1 8 6390 1 1 6 ASP N N -12.107 9.184 -0.675 1.00 . A A . 6 ASP N 1 1 8 6391 1 1 6 ASP O O -11.313 6.528 1.054 1.00 . A A . 6 ASP O 1 1 8 6392 1 1 6 ASP OD1 O -13.928 8.497 3.125 1.00 . A A . 6 ASP OD1 1 1 8 6393 1 1 6 ASP OD2 O -15.037 10.212 2.337 1.00 . A A . 6 ASP OD2 1 1 8 6394 1 1 7 HIS C C -11.493 5.030 -2.017 1.00 . A A . 7 HIS C 1 1 8 6395 1 1 7 HIS CA C -12.530 5.019 -0.903 1.00 . A A . 7 HIS CA 1 1 8 6396 1 1 7 HIS CB C -13.771 4.233 -1.332 1.00 . A A . 7 HIS CB 1 1 8 6397 1 1 7 HIS CD2 C -12.524 1.984 -1.359 1.00 . A A . 7 HIS CD2 1 1 8 6398 1 1 7 HIS CE1 C -14.156 0.749 -0.620 1.00 . A A . 7 HIS CE1 1 1 8 6399 1 1 7 HIS CG C -13.615 2.758 -1.152 1.00 . A A . 7 HIS CG 1 1 8 6400 1 1 7 HIS H H -13.469 6.893 -1.154 1.00 . A A . 7 HIS H 1 1 8 6401 1 1 7 HIS HA H -12.099 4.550 -0.028 1.00 . A A . 7 HIS HA 1 1 8 6402 1 1 7 HIS HB2 H -14.617 4.554 -0.744 1.00 . A A . 7 HIS HB2 1 1 8 6403 1 1 7 HIS HB3 H -13.969 4.422 -2.374 1.00 . A A . 7 HIS HB3 1 1 8 6404 1 1 7 HIS HD2 H -11.559 2.318 -1.727 1.00 . A A . 7 HIS HD2 1 1 8 6405 1 1 7 HIS HE1 H -14.719 -0.107 -0.285 1.00 . A A . 7 HIS HE1 1 1 8 6406 1 1 7 HIS HE2 H -12.245 -0.027 -0.813 1.00 . A A . 7 HIS HE2 1 1 8 6407 1 1 7 HIS N N -12.872 6.386 -0.555 1.00 . A A . 7 HIS N 1 1 8 6408 1 1 7 HIS ND1 N -14.642 1.976 -0.689 1.00 . A A . 7 HIS ND1 1 1 8 6409 1 1 7 HIS NE2 N -12.874 0.702 -1.014 1.00 . A A . 7 HIS NE2 1 1 8 6410 1 1 7 HIS O O -11.756 4.600 -3.146 1.00 . A A . 7 HIS O 1 1 8 6411 1 1 8 HIS C C -8.111 6.463 -1.925 1.00 . A A . 8 HIS C 1 1 8 6412 1 1 8 HIS CA C -9.290 5.853 -2.663 1.00 . A A . 8 HIS CA 1 1 8 6413 1 1 8 HIS CB C -9.756 6.787 -3.776 1.00 . A A . 8 HIS CB 1 1 8 6414 1 1 8 HIS CD2 C -9.648 6.805 -6.346 1.00 . A A . 8 HIS CD2 1 1 8 6415 1 1 8 HIS CE1 C -7.791 5.689 -6.560 1.00 . A A . 8 HIS CE1 1 1 8 6416 1 1 8 HIS CG C -9.178 6.481 -5.120 1.00 . A A . 8 HIS CG 1 1 8 6417 1 1 8 HIS H H -10.268 6.025 -0.811 1.00 . A A . 8 HIS H 1 1 8 6418 1 1 8 HIS HA H -9.002 4.898 -3.079 1.00 . A A . 8 HIS HA 1 1 8 6419 1 1 8 HIS HB2 H -10.831 6.716 -3.860 1.00 . A A . 8 HIS HB2 1 1 8 6420 1 1 8 HIS HB3 H -9.490 7.796 -3.519 1.00 . A A . 8 HIS HB3 1 1 8 6421 1 1 8 HIS HD2 H -10.553 7.352 -6.568 1.00 . A A . 8 HIS HD2 1 1 8 6422 1 1 8 HIS HE1 H -6.947 5.185 -7.005 1.00 . A A . 8 HIS HE1 1 1 8 6423 1 1 8 HIS HE2 H -8.721 6.536 -8.215 1.00 . A A . 8 HIS HE2 1 1 8 6424 1 1 8 HIS N N -10.363 5.641 -1.710 1.00 . A A . 8 HIS N 1 1 8 6425 1 1 8 HIS ND1 N -8.006 5.777 -5.259 1.00 . A A . 8 HIS ND1 1 1 8 6426 1 1 8 HIS NE2 N -8.760 6.298 -7.258 1.00 . A A . 8 HIS NE2 1 1 8 6427 1 1 8 HIS O O -8.303 7.104 -0.889 1.00 . A A . 8 HIS O 1 1 8 6428 1 1 9 MET C C -4.639 7.145 -2.590 1.00 . A A . 9 MET C 1 1 8 6429 1 1 9 MET CA C -5.728 6.651 -1.652 1.00 . A A . 9 MET CA 1 1 8 6430 1 1 9 MET CB C -5.173 5.530 -0.769 1.00 . A A . 9 MET CB 1 1 8 6431 1 1 9 MET CE C -7.829 4.256 1.527 1.00 . A A . 9 MET CE 1 1 8 6432 1 1 9 MET CG C -5.584 5.643 0.688 1.00 . A A . 9 MET CG 1 1 8 6433 1 1 9 MET H H -6.791 5.615 -3.167 1.00 . A A . 9 MET H 1 1 8 6434 1 1 9 MET HA H -6.036 7.468 -1.019 1.00 . A A . 9 MET HA 1 1 8 6435 1 1 9 MET HB2 H -5.524 4.582 -1.149 1.00 . A A . 9 MET HB2 1 1 8 6436 1 1 9 MET HB3 H -4.096 5.552 -0.819 1.00 . A A . 9 MET HB3 1 1 8 6437 1 1 9 MET HE1 H -8.133 5.125 0.963 1.00 . A A . 9 MET HE1 1 1 8 6438 1 1 9 MET HE2 H -8.320 3.380 1.132 1.00 . A A . 9 MET HE2 1 1 8 6439 1 1 9 MET HE3 H -8.104 4.384 2.563 1.00 . A A . 9 MET HE3 1 1 8 6440 1 1 9 MET HG2 H -4.756 6.044 1.253 1.00 . A A . 9 MET HG2 1 1 8 6441 1 1 9 MET HG3 H -6.427 6.315 0.760 1.00 . A A . 9 MET HG3 1 1 8 6442 1 1 9 MET N N -6.901 6.186 -2.373 1.00 . A A . 9 MET N 1 1 8 6443 1 1 9 MET O O -4.409 6.575 -3.653 1.00 . A A . 9 MET O 1 1 8 6444 1 1 9 MET SD S -6.054 4.055 1.401 1.00 . A A . 9 MET SD 1 1 8 6445 1 1 10 GLU C C -1.546 8.631 -1.885 1.00 . A A . 10 GLU C 1 1 8 6446 1 1 10 GLU CA C -2.743 8.662 -2.829 1.00 . A A . 10 GLU CA 1 1 8 6447 1 1 10 GLU CB C -3.001 10.089 -3.320 1.00 . A A . 10 GLU CB 1 1 8 6448 1 1 10 GLU CD C -3.223 12.343 -2.199 1.00 . A A . 10 GLU CD 1 1 8 6449 1 1 10 GLU CG C -3.778 10.940 -2.328 1.00 . A A . 10 GLU CG 1 1 8 6450 1 1 10 GLU H H -4.111 8.503 -1.233 1.00 . A A . 10 GLU H 1 1 8 6451 1 1 10 GLU HA H -2.545 8.019 -3.675 1.00 . A A . 10 GLU HA 1 1 8 6452 1 1 10 GLU HB2 H -2.052 10.570 -3.508 1.00 . A A . 10 GLU HB2 1 1 8 6453 1 1 10 GLU HB3 H -3.563 10.046 -4.241 1.00 . A A . 10 GLU HB3 1 1 8 6454 1 1 10 GLU HG2 H -4.805 11.006 -2.656 1.00 . A A . 10 GLU HG2 1 1 8 6455 1 1 10 GLU HG3 H -3.740 10.465 -1.359 1.00 . A A . 10 GLU HG3 1 1 8 6456 1 1 10 GLU N N -3.908 8.145 -2.123 1.00 . A A . 10 GLU N 1 1 8 6457 1 1 10 GLU O O -0.609 9.423 -2.001 1.00 . A A . 10 GLU O 1 1 8 6458 1 1 10 GLU OE1 O -2.147 12.621 -2.762 1.00 . A A . 10 GLU OE1 1 1 8 6459 1 1 10 GLU OE2 O -3.856 13.175 -1.521 1.00 . A A . 10 GLU OE2 1 1 8 6460 1 1 11 PHE C C -0.791 6.223 0.768 1.00 . A A . 11 PHE C 1 1 8 6461 1 1 11 PHE CA C -0.631 7.584 0.129 1.00 . A A . 11 PHE CA 1 1 8 6462 1 1 11 PHE CB C -0.770 8.689 1.189 1.00 . A A . 11 PHE CB 1 1 8 6463 1 1 11 PHE CD1 C -2.603 8.062 2.787 1.00 . A A . 11 PHE CD1 1 1 8 6464 1 1 11 PHE CD2 C -3.029 9.787 1.197 1.00 . A A . 11 PHE CD2 1 1 8 6465 1 1 11 PHE CE1 C -3.880 8.207 3.291 1.00 . A A . 11 PHE CE1 1 1 8 6466 1 1 11 PHE CE2 C -4.307 9.935 1.698 1.00 . A A . 11 PHE CE2 1 1 8 6467 1 1 11 PHE CG C -2.163 8.849 1.736 1.00 . A A . 11 PHE CG 1 1 8 6468 1 1 11 PHE CZ C -4.733 9.142 2.745 1.00 . A A . 11 PHE CZ 1 1 8 6469 1 1 11 PHE H H -2.420 7.147 -0.887 1.00 . A A . 11 PHE H 1 1 8 6470 1 1 11 PHE HA H 0.350 7.638 -0.317 1.00 . A A . 11 PHE HA 1 1 8 6471 1 1 11 PHE HB2 H -0.117 8.465 2.018 1.00 . A A . 11 PHE HB2 1 1 8 6472 1 1 11 PHE HB3 H -0.476 9.633 0.752 1.00 . A A . 11 PHE HB3 1 1 8 6473 1 1 11 PHE HD1 H -1.934 7.332 3.215 1.00 . A A . 11 PHE HD1 1 1 8 6474 1 1 11 PHE HD2 H -2.696 10.406 0.378 1.00 . A A . 11 PHE HD2 1 1 8 6475 1 1 11 PHE HE1 H -4.210 7.588 4.111 1.00 . A A . 11 PHE HE1 1 1 8 6476 1 1 11 PHE HE2 H -4.974 10.670 1.270 1.00 . A A . 11 PHE HE2 1 1 8 6477 1 1 11 PHE HZ H -5.732 9.257 3.136 1.00 . A A . 11 PHE HZ 1 1 8 6478 1 1 11 PHE N N -1.636 7.735 -0.911 1.00 . A A . 11 PHE N 1 1 8 6479 1 1 11 PHE O O -1.839 5.587 0.644 1.00 . A A . 11 PHE O 1 1 8 6480 1 1 12 CYS C C -0.678 4.632 3.390 1.00 . A A . 12 CYS C 1 1 8 6481 1 1 12 CYS CA C 0.181 4.510 2.138 1.00 . A A . 12 CYS CA 1 1 8 6482 1 1 12 CYS CB C 1.597 4.030 2.467 1.00 . A A . 12 CYS CB 1 1 8 6483 1 1 12 CYS H H 1.033 6.351 1.556 1.00 . A A . 12 CYS H 1 1 8 6484 1 1 12 CYS HA H -0.284 3.801 1.467 1.00 . A A . 12 CYS HA 1 1 8 6485 1 1 12 CYS HB2 H 1.817 3.152 1.878 1.00 . A A . 12 CYS HB2 1 1 8 6486 1 1 12 CYS HB3 H 2.299 4.811 2.215 1.00 . A A . 12 CYS HB3 1 1 8 6487 1 1 12 CYS HG H 2.412 4.673 4.762 1.00 . A A . 12 CYS HG 1 1 8 6488 1 1 12 CYS N N 0.234 5.784 1.462 1.00 . A A . 12 CYS N 1 1 8 6489 1 1 12 CYS O O -0.379 5.427 4.276 1.00 . A A . 12 CYS O 1 1 8 6490 1 1 12 CYS SG S 1.849 3.603 4.196 1.00 . A A . 12 CYS SG 1 1 8 6491 1 1 13 ARG C C -2.246 3.634 5.827 1.00 . A A . 13 ARG C 1 1 8 6492 1 1 13 ARG CA C -2.806 4.062 4.469 1.00 . A A . 13 ARG CA 1 1 8 6493 1 1 13 ARG CB C -4.054 3.232 4.144 1.00 . A A . 13 ARG CB 1 1 8 6494 1 1 13 ARG CD C -4.591 0.773 3.993 1.00 . A A . 13 ARG CD 1 1 8 6495 1 1 13 ARG CG C -3.759 1.918 3.432 1.00 . A A . 13 ARG CG 1 1 8 6496 1 1 13 ARG CZ C -6.581 -0.034 2.771 1.00 . A A . 13 ARG CZ 1 1 8 6497 1 1 13 ARG H H -2.042 3.413 2.594 1.00 . A A . 13 ARG H 1 1 8 6498 1 1 13 ARG HA H -3.090 5.102 4.530 1.00 . A A . 13 ARG HA 1 1 8 6499 1 1 13 ARG HB2 H -4.569 3.008 5.066 1.00 . A A . 13 ARG HB2 1 1 8 6500 1 1 13 ARG HB3 H -4.704 3.819 3.513 1.00 . A A . 13 ARG HB3 1 1 8 6501 1 1 13 ARG HD2 H -4.175 -0.161 3.644 1.00 . A A . 13 ARG HD2 1 1 8 6502 1 1 13 ARG HD3 H -4.545 0.804 5.072 1.00 . A A . 13 ARG HD3 1 1 8 6503 1 1 13 ARG HE H -6.517 1.617 3.916 1.00 . A A . 13 ARG HE 1 1 8 6504 1 1 13 ARG HG2 H -3.988 2.032 2.384 1.00 . A A . 13 ARG HG2 1 1 8 6505 1 1 13 ARG HG3 H -2.711 1.682 3.550 1.00 . A A . 13 ARG HG3 1 1 8 6506 1 1 13 ARG HH11 H -4.947 -1.226 2.597 1.00 . A A . 13 ARG HH11 1 1 8 6507 1 1 13 ARG HH12 H -6.347 -1.757 1.716 1.00 . A A . 13 ARG HH12 1 1 8 6508 1 1 13 ARG HH21 H -8.377 0.901 2.790 1.00 . A A . 13 ARG HH21 1 1 8 6509 1 1 13 ARG HH22 H -8.300 -0.540 1.832 1.00 . A A . 13 ARG HH22 1 1 8 6510 1 1 13 ARG N N -1.813 3.938 3.392 1.00 . A A . 13 ARG N 1 1 8 6511 1 1 13 ARG NE N -5.989 0.852 3.576 1.00 . A A . 13 ARG NE 1 1 8 6512 1 1 13 ARG NH1 N -5.906 -1.087 2.328 1.00 . A A . 13 ARG NH1 1 1 8 6513 1 1 13 ARG NH2 N -7.853 0.121 2.437 1.00 . A A . 13 ARG NH2 1 1 8 6514 1 1 13 ARG O O -2.848 3.898 6.866 1.00 . A A . 13 ARG O 1 1 8 6515 1 1 14 VAL C C 0.068 3.649 7.878 1.00 . A A . 14 VAL C 1 1 8 6516 1 1 14 VAL CA C -0.474 2.491 7.039 1.00 . A A . 14 VAL CA 1 1 8 6517 1 1 14 VAL CB C 0.676 1.506 6.737 1.00 . A A . 14 VAL CB 1 1 8 6518 1 1 14 VAL CG1 C 1.204 0.884 8.021 1.00 . A A . 14 VAL CG1 1 1 8 6519 1 1 14 VAL CG2 C 0.211 0.425 5.775 1.00 . A A . 14 VAL CG2 1 1 8 6520 1 1 14 VAL H H -0.672 2.782 4.953 1.00 . A A . 14 VAL H 1 1 8 6521 1 1 14 VAL HA H -1.223 1.965 7.613 1.00 . A A . 14 VAL HA 1 1 8 6522 1 1 14 VAL HB H 1.480 2.055 6.268 1.00 . A A . 14 VAL HB 1 1 8 6523 1 1 14 VAL HG11 H 1.243 1.635 8.796 1.00 . A A . 14 VAL HG11 1 1 8 6524 1 1 14 VAL HG12 H 0.548 0.083 8.327 1.00 . A A . 14 VAL HG12 1 1 8 6525 1 1 14 VAL HG13 H 2.196 0.490 7.849 1.00 . A A . 14 VAL HG13 1 1 8 6526 1 1 14 VAL HG21 H 1.047 0.090 5.177 1.00 . A A . 14 VAL HG21 1 1 8 6527 1 1 14 VAL HG22 H -0.187 -0.406 6.337 1.00 . A A . 14 VAL HG22 1 1 8 6528 1 1 14 VAL HG23 H -0.556 0.823 5.130 1.00 . A A . 14 VAL HG23 1 1 8 6529 1 1 14 VAL N N -1.101 2.968 5.812 1.00 . A A . 14 VAL N 1 1 8 6530 1 1 14 VAL O O -0.033 3.633 9.105 1.00 . A A . 14 VAL O 1 1 8 6531 1 1 15 CYS C C 0.775 7.095 7.413 1.00 . A A . 15 CYS C 1 1 8 6532 1 1 15 CYS CA C 1.299 5.745 7.918 1.00 . A A . 15 CYS CA 1 1 8 6533 1 1 15 CYS CB C 2.821 5.661 7.762 1.00 . A A . 15 CYS CB 1 1 8 6534 1 1 15 CYS H H 0.741 4.578 6.245 1.00 . A A . 15 CYS H 1 1 8 6535 1 1 15 CYS HA H 1.051 5.651 8.965 1.00 . A A . 15 CYS HA 1 1 8 6536 1 1 15 CYS HB2 H 3.285 6.264 8.528 1.00 . A A . 15 CYS HB2 1 1 8 6537 1 1 15 CYS HB3 H 3.132 4.635 7.884 1.00 . A A . 15 CYS HB3 1 1 8 6538 1 1 15 CYS N N 0.678 4.628 7.216 1.00 . A A . 15 CYS N 1 1 8 6539 1 1 15 CYS O O 1.098 8.142 7.975 1.00 . A A . 15 CYS O 1 1 8 6540 1 1 15 CYS SG S 3.448 6.240 6.152 1.00 . A A . 15 CYS SG 1 1 8 6541 1 1 16 LYS C C 0.459 9.081 5.002 1.00 . A A . 16 LYS C 1 1 8 6542 1 1 16 LYS CA C -0.601 8.241 5.718 1.00 . A A . 16 LYS CA 1 1 8 6543 1 1 16 LYS CB C -1.360 9.092 6.747 1.00 . A A . 16 LYS CB 1 1 8 6544 1 1 16 LYS CD C -3.617 9.231 7.842 1.00 . A A . 16 LYS CD 1 1 8 6545 1 1 16 LYS CE C -4.934 9.965 7.655 1.00 . A A . 16 LYS CE 1 1 8 6546 1 1 16 LYS CG C -2.864 9.100 6.531 1.00 . A A . 16 LYS CG 1 1 8 6547 1 1 16 LYS H H -0.214 6.176 5.944 1.00 . A A . 16 LYS H 1 1 8 6548 1 1 16 LYS HA H -1.309 7.896 4.978 1.00 . A A . 16 LYS HA 1 1 8 6549 1 1 16 LYS HB2 H -1.162 8.705 7.736 1.00 . A A . 16 LYS HB2 1 1 8 6550 1 1 16 LYS HB3 H -1.005 10.110 6.691 1.00 . A A . 16 LYS HB3 1 1 8 6551 1 1 16 LYS HD2 H -3.819 8.244 8.231 1.00 . A A . 16 LYS HD2 1 1 8 6552 1 1 16 LYS HD3 H -3.004 9.779 8.543 1.00 . A A . 16 LYS HD3 1 1 8 6553 1 1 16 LYS HE2 H -4.743 11.027 7.674 1.00 . A A . 16 LYS HE2 1 1 8 6554 1 1 16 LYS HE3 H -5.353 9.691 6.698 1.00 . A A . 16 LYS HE3 1 1 8 6555 1 1 16 LYS HG2 H -3.122 9.934 5.896 1.00 . A A . 16 LYS HG2 1 1 8 6556 1 1 16 LYS HG3 H -3.153 8.177 6.051 1.00 . A A . 16 LYS HG3 1 1 8 6557 1 1 16 LYS HZ1 H -5.995 8.600 8.832 1.00 . A A . 16 LYS HZ1 1 1 8 6558 1 1 16 LYS HZ2 H -6.850 10.022 8.487 1.00 . A A . 16 LYS HZ2 1 1 8 6559 1 1 16 LYS HZ3 H -5.603 10.041 9.638 1.00 . A A . 16 LYS HZ3 1 1 8 6560 1 1 16 LYS N N -0.018 7.048 6.342 1.00 . A A . 16 LYS N 1 1 8 6561 1 1 16 LYS NZ N -5.912 9.634 8.726 1.00 . A A . 16 LYS NZ 1 1 8 6562 1 1 16 LYS O O 0.272 10.279 4.791 1.00 . A A . 16 LYS O 1 1 8 6563 1 1 17 ASP C C 2.657 8.743 2.421 1.00 . A A . 17 ASP C 1 1 8 6564 1 1 17 ASP CA C 2.630 9.132 3.891 1.00 . A A . 17 ASP CA 1 1 8 6565 1 1 17 ASP CB C 3.986 8.794 4.506 1.00 . A A . 17 ASP CB 1 1 8 6566 1 1 17 ASP CG C 4.962 9.952 4.460 1.00 . A A . 17 ASP CG 1 1 8 6567 1 1 17 ASP H H 1.650 7.491 4.806 1.00 . A A . 17 ASP H 1 1 8 6568 1 1 17 ASP HA H 2.459 10.193 3.971 1.00 . A A . 17 ASP HA 1 1 8 6569 1 1 17 ASP HB2 H 3.844 8.495 5.535 1.00 . A A . 17 ASP HB2 1 1 8 6570 1 1 17 ASP HB3 H 4.418 7.968 3.961 1.00 . A A . 17 ASP HB3 1 1 8 6571 1 1 17 ASP N N 1.554 8.443 4.605 1.00 . A A . 17 ASP N 1 1 8 6572 1 1 17 ASP O O 2.225 7.645 2.049 1.00 . A A . 17 ASP O 1 1 8 6573 1 1 17 ASP OD1 O 4.630 10.994 3.859 1.00 . A A . 17 ASP OD1 1 1 8 6574 1 1 17 ASP OD2 O 6.070 9.821 5.019 1.00 . A A . 17 ASP OD2 1 1 8 6575 1 1 18 GLY C C 4.960 8.945 -0.064 1.00 . A A . 18 GLY C 1 1 8 6576 1 1 18 GLY CA C 3.509 9.275 0.222 1.00 . A A . 18 GLY CA 1 1 8 6577 1 1 18 GLY H H 3.720 10.381 2.008 1.00 . A A . 18 GLY H 1 1 8 6578 1 1 18 GLY HA2 H 2.894 8.428 -0.050 1.00 . A A . 18 GLY HA2 1 1 8 6579 1 1 18 GLY HA3 H 3.218 10.129 -0.374 1.00 . A A . 18 GLY HA3 1 1 8 6580 1 1 18 GLY N N 3.297 9.583 1.621 1.00 . A A . 18 GLY N 1 1 8 6581 1 1 18 GLY O O 5.743 8.742 0.864 1.00 . A A . 18 GLY O 1 1 8 6582 1 1 19 GLY C C 6.741 7.295 -2.547 1.00 . A A . 19 GLY C 1 1 8 6583 1 1 19 GLY CA C 6.679 8.550 -1.707 1.00 . A A . 19 GLY CA 1 1 8 6584 1 1 19 GLY H H 4.646 9.047 -2.035 1.00 . A A . 19 GLY H 1 1 8 6585 1 1 19 GLY HA2 H 7.100 9.370 -2.270 1.00 . A A . 19 GLY HA2 1 1 8 6586 1 1 19 GLY HA3 H 7.263 8.402 -0.810 1.00 . A A . 19 GLY HA3 1 1 8 6587 1 1 19 GLY N N 5.318 8.881 -1.335 1.00 . A A . 19 GLY N 1 1 8 6588 1 1 19 GLY O O 6.134 7.234 -3.618 1.00 . A A . 19 GLY O 1 1 8 6589 1 1 20 GLU C C 6.197 4.220 -2.500 1.00 . A A . 20 GLU C 1 1 8 6590 1 1 20 GLU CA C 7.493 4.989 -2.719 1.00 . A A . 20 GLU CA 1 1 8 6591 1 1 20 GLU CB C 8.684 4.175 -2.202 1.00 . A A . 20 GLU CB 1 1 8 6592 1 1 20 GLU CD C 9.845 5.256 -0.232 1.00 . A A . 20 GLU CD 1 1 8 6593 1 1 20 GLU CG C 9.854 5.028 -1.730 1.00 . A A . 20 GLU CG 1 1 8 6594 1 1 20 GLU H H 7.843 6.373 -1.154 1.00 . A A . 20 GLU H 1 1 8 6595 1 1 20 GLU HA H 7.618 5.174 -3.774 1.00 . A A . 20 GLU HA 1 1 8 6596 1 1 20 GLU HB2 H 8.357 3.564 -1.374 1.00 . A A . 20 GLU HB2 1 1 8 6597 1 1 20 GLU HB3 H 9.035 3.531 -2.996 1.00 . A A . 20 GLU HB3 1 1 8 6598 1 1 20 GLU HG2 H 10.773 4.533 -1.998 1.00 . A A . 20 GLU HG2 1 1 8 6599 1 1 20 GLU HG3 H 9.804 5.987 -2.227 1.00 . A A . 20 GLU HG3 1 1 8 6600 1 1 20 GLU N N 7.417 6.276 -2.039 1.00 . A A . 20 GLU N 1 1 8 6601 1 1 20 GLU O O 6.040 3.517 -1.499 1.00 . A A . 20 GLU O 1 1 8 6602 1 1 20 GLU OE1 O 8.919 5.927 0.268 1.00 . A A . 20 GLU OE1 1 1 8 6603 1 1 20 GLU OE2 O 10.767 4.769 0.452 1.00 . A A . 20 GLU OE2 1 1 8 6604 1 1 21 LEU C C 3.574 2.812 -4.113 1.00 . A A . 21 LEU C 1 1 8 6605 1 1 21 LEU CA C 3.883 3.949 -3.153 1.00 . A A . 21 LEU CA 1 1 8 6606 1 1 21 LEU CB C 2.840 5.055 -3.309 1.00 . A A . 21 LEU CB 1 1 8 6607 1 1 21 LEU CD1 C 1.824 7.195 -2.510 1.00 . A A . 21 LEU CD1 1 1 8 6608 1 1 21 LEU CD2 C 2.739 5.560 -0.856 1.00 . A A . 21 LEU CD2 1 1 8 6609 1 1 21 LEU CG C 2.896 6.153 -2.247 1.00 . A A . 21 LEU CG 1 1 8 6610 1 1 21 LEU H H 5.370 5.137 -4.071 1.00 . A A . 21 LEU H 1 1 8 6611 1 1 21 LEU HA H 3.831 3.567 -2.144 1.00 . A A . 21 LEU HA 1 1 8 6612 1 1 21 LEU HB2 H 2.978 5.514 -4.277 1.00 . A A . 21 LEU HB2 1 1 8 6613 1 1 21 LEU HB3 H 1.859 4.607 -3.278 1.00 . A A . 21 LEU HB3 1 1 8 6614 1 1 21 LEU HD11 H 2.283 8.169 -2.590 1.00 . A A . 21 LEU HD11 1 1 8 6615 1 1 21 LEU HD12 H 1.314 6.961 -3.431 1.00 . A A . 21 LEU HD12 1 1 8 6616 1 1 21 LEU HD13 H 1.112 7.198 -1.696 1.00 . A A . 21 LEU HD13 1 1 8 6617 1 1 21 LEU HD21 H 2.322 6.304 -0.191 1.00 . A A . 21 LEU HD21 1 1 8 6618 1 1 21 LEU HD22 H 2.077 4.706 -0.900 1.00 . A A . 21 LEU HD22 1 1 8 6619 1 1 21 LEU HD23 H 3.703 5.249 -0.487 1.00 . A A . 21 LEU HD23 1 1 8 6620 1 1 21 LEU HG H 3.857 6.645 -2.297 1.00 . A A . 21 LEU HG 1 1 8 6621 1 1 21 LEU N N 5.217 4.484 -3.350 1.00 . A A . 21 LEU N 1 1 8 6622 1 1 21 LEU O O 3.245 3.040 -5.278 1.00 . A A . 21 LEU O 1 1 8 6623 1 1 22 LEU C C 1.518 0.494 -4.368 1.00 . A A . 22 LEU C 1 1 8 6624 1 1 22 LEU CA C 3.037 0.460 -4.302 1.00 . A A . 22 LEU CA 1 1 8 6625 1 1 22 LEU CB C 3.489 -0.826 -3.611 1.00 . A A . 22 LEU CB 1 1 8 6626 1 1 22 LEU CD1 C 5.266 -2.538 -3.231 1.00 . A A . 22 LEU CD1 1 1 8 6627 1 1 22 LEU CD2 C 4.490 -2.044 -5.554 1.00 . A A . 22 LEU CD2 1 1 8 6628 1 1 22 LEU CG C 4.753 -1.463 -4.175 1.00 . A A . 22 LEU CG 1 1 8 6629 1 1 22 LEU H H 3.645 1.530 -2.594 1.00 . A A . 22 LEU H 1 1 8 6630 1 1 22 LEU HA H 3.444 0.498 -5.302 1.00 . A A . 22 LEU HA 1 1 8 6631 1 1 22 LEU HB2 H 3.656 -0.608 -2.567 1.00 . A A . 22 LEU HB2 1 1 8 6632 1 1 22 LEU HB3 H 2.689 -1.549 -3.684 1.00 . A A . 22 LEU HB3 1 1 8 6633 1 1 22 LEU HD11 H 6.258 -2.276 -2.894 1.00 . A A . 22 LEU HD11 1 1 8 6634 1 1 22 LEU HD12 H 4.606 -2.617 -2.381 1.00 . A A . 22 LEU HD12 1 1 8 6635 1 1 22 LEU HD13 H 5.300 -3.486 -3.749 1.00 . A A . 22 LEU HD13 1 1 8 6636 1 1 22 LEU HD21 H 4.090 -1.276 -6.197 1.00 . A A . 22 LEU HD21 1 1 8 6637 1 1 22 LEU HD22 H 5.416 -2.416 -5.969 1.00 . A A . 22 LEU HD22 1 1 8 6638 1 1 22 LEU HD23 H 3.781 -2.855 -5.475 1.00 . A A . 22 LEU HD23 1 1 8 6639 1 1 22 LEU HG H 5.515 -0.708 -4.269 1.00 . A A . 22 LEU HG 1 1 8 6640 1 1 22 LEU N N 3.507 1.614 -3.565 1.00 . A A . 22 LEU N 1 1 8 6641 1 1 22 LEU O O 0.855 0.600 -3.338 1.00 . A A . 22 LEU O 1 1 8 6642 1 1 23 CYS C C -1.124 -0.757 -5.711 1.00 . A A . 23 CYS C 1 1 8 6643 1 1 23 CYS CA C -0.465 0.619 -5.740 1.00 . A A . 23 CYS CA 1 1 8 6644 1 1 23 CYS CB C -0.794 1.328 -7.054 1.00 . A A . 23 CYS CB 1 1 8 6645 1 1 23 CYS H H 1.553 0.514 -6.364 1.00 . A A . 23 CYS H 1 1 8 6646 1 1 23 CYS HA H -0.853 1.205 -4.921 1.00 . A A . 23 CYS HA 1 1 8 6647 1 1 23 CYS HB2 H 0.024 1.186 -7.744 1.00 . A A . 23 CYS HB2 1 1 8 6648 1 1 23 CYS HB3 H -1.690 0.895 -7.473 1.00 . A A . 23 CYS HB3 1 1 8 6649 1 1 23 CYS HG H 0.120 3.696 -6.763 1.00 . A A . 23 CYS HG 1 1 8 6650 1 1 23 CYS N N 0.973 0.515 -5.570 1.00 . A A . 23 CYS N 1 1 8 6651 1 1 23 CYS O O -0.710 -1.672 -6.432 1.00 . A A . 23 CYS O 1 1 8 6652 1 1 23 CYS SG S -1.065 3.108 -6.888 1.00 . A A . 23 CYS SG 1 1 8 6653 1 1 24 CYS C C -3.363 -2.637 -6.122 1.00 . A A . 24 CYS C 1 1 8 6654 1 1 24 CYS CA C -2.939 -2.094 -4.753 1.00 . A A . 24 CYS CA 1 1 8 6655 1 1 24 CYS CB C -4.182 -1.773 -3.938 1.00 . A A . 24 CYS CB 1 1 8 6656 1 1 24 CYS H H -2.384 -0.120 -4.300 1.00 . A A . 24 CYS H 1 1 8 6657 1 1 24 CYS HA H -2.356 -2.838 -4.236 1.00 . A A . 24 CYS HA 1 1 8 6658 1 1 24 CYS HB2 H -4.543 -0.799 -4.227 1.00 . A A . 24 CYS HB2 1 1 8 6659 1 1 24 CYS HB3 H -4.944 -2.509 -4.155 1.00 . A A . 24 CYS HB3 1 1 8 6660 1 1 24 CYS N N -2.148 -0.881 -4.873 1.00 . A A . 24 CYS N 1 1 8 6661 1 1 24 CYS O O -3.666 -1.875 -7.044 1.00 . A A . 24 CYS O 1 1 8 6662 1 1 24 CYS SG S -3.934 -1.750 -2.140 1.00 . A A . 24 CYS SG 1 1 8 6663 1 1 25 ASP C C -5.399 -4.603 -7.536 1.00 . A A . 25 ASP C 1 1 8 6664 1 1 25 ASP CA C -3.878 -4.599 -7.458 1.00 . A A . 25 ASP CA 1 1 8 6665 1 1 25 ASP CB C -3.363 -6.039 -7.522 1.00 . A A . 25 ASP CB 1 1 8 6666 1 1 25 ASP CG C -3.639 -6.701 -8.859 1.00 . A A . 25 ASP CG 1 1 8 6667 1 1 25 ASP H H -3.215 -4.502 -5.446 1.00 . A A . 25 ASP H 1 1 8 6668 1 1 25 ASP HA H -3.481 -4.041 -8.293 1.00 . A A . 25 ASP HA 1 1 8 6669 1 1 25 ASP HB2 H -2.298 -6.044 -7.354 1.00 . A A . 25 ASP HB2 1 1 8 6670 1 1 25 ASP HB3 H -3.846 -6.618 -6.748 1.00 . A A . 25 ASP HB3 1 1 8 6671 1 1 25 ASP N N -3.434 -3.953 -6.227 1.00 . A A . 25 ASP N 1 1 8 6672 1 1 25 ASP O O -5.986 -4.405 -8.601 1.00 . A A . 25 ASP O 1 1 8 6673 1 1 25 ASP OD1 O -3.192 -6.168 -9.900 1.00 . A A . 25 ASP OD1 1 1 8 6674 1 1 25 ASP OD2 O -4.300 -7.763 -8.879 1.00 . A A . 25 ASP OD2 1 1 8 6675 1 1 26 THR C C -8.131 -3.830 -5.759 1.00 . A A . 26 THR C 1 1 8 6676 1 1 26 THR CA C -7.465 -5.069 -6.345 1.00 . A A . 26 THR CA 1 1 8 6677 1 1 26 THR CB C -7.808 -6.284 -5.470 1.00 . A A . 26 THR CB 1 1 8 6678 1 1 26 THR CG2 C -7.752 -7.561 -6.290 1.00 . A A . 26 THR CG2 1 1 8 6679 1 1 26 THR H H -5.490 -5.134 -5.621 1.00 . A A . 26 THR H 1 1 8 6680 1 1 26 THR HA H -7.839 -5.245 -7.342 1.00 . A A . 26 THR HA 1 1 8 6681 1 1 26 THR HB H -8.806 -6.164 -5.075 1.00 . A A . 26 THR HB 1 1 8 6682 1 1 26 THR HG1 H -7.035 -5.646 -3.752 1.00 . A A . 26 THR HG1 1 1 8 6683 1 1 26 THR HG21 H -8.032 -8.401 -5.671 1.00 . A A . 26 THR HG21 1 1 8 6684 1 1 26 THR HG22 H -6.747 -7.704 -6.660 1.00 . A A . 26 THR HG22 1 1 8 6685 1 1 26 THR HG23 H -8.436 -7.483 -7.122 1.00 . A A . 26 THR HG23 1 1 8 6686 1 1 26 THR N N -6.022 -4.917 -6.413 1.00 . A A . 26 THR N 1 1 8 6687 1 1 26 THR O O -9.326 -3.594 -5.960 1.00 . A A . 26 THR O 1 1 8 6688 1 1 26 THR OG1 O -6.870 -6.370 -4.383 1.00 . A A . 26 THR OG1 1 1 8 6689 1 1 27 CYS C C -7.337 -0.689 -4.643 1.00 . A A . 27 CYS C 1 1 8 6690 1 1 27 CYS CA C -7.903 -2.026 -4.147 1.00 . A A . 27 CYS CA 1 1 8 6691 1 1 27 CYS CB C -7.536 -2.279 -2.686 1.00 . A A . 27 CYS CB 1 1 8 6692 1 1 27 CYS H H -6.478 -3.452 -4.722 1.00 . A A . 27 CYS H 1 1 8 6693 1 1 27 CYS HA H -8.978 -2.016 -4.247 1.00 . A A . 27 CYS HA 1 1 8 6694 1 1 27 CYS HB2 H -6.787 -1.565 -2.379 1.00 . A A . 27 CYS HB2 1 1 8 6695 1 1 27 CYS HB3 H -8.416 -2.162 -2.070 1.00 . A A . 27 CYS HB3 1 1 8 6696 1 1 27 CYS N N -7.382 -3.135 -4.921 1.00 . A A . 27 CYS N 1 1 8 6697 1 1 27 CYS O O -6.491 -0.666 -5.540 1.00 . A A . 27 CYS O 1 1 8 6698 1 1 27 CYS SG S -6.863 -3.956 -2.399 1.00 . A A . 27 CYS SG 1 1 8 6699 1 1 28 PRO C C -6.419 2.396 -3.675 1.00 . A A . 28 PRO C 1 1 8 6700 1 1 28 PRO CA C -7.458 1.771 -4.607 1.00 . A A . 28 PRO CA 1 1 8 6701 1 1 28 PRO CB C -8.767 2.551 -4.551 1.00 . A A . 28 PRO CB 1 1 8 6702 1 1 28 PRO CD C -9.028 0.535 -3.240 1.00 . A A . 28 PRO CD 1 1 8 6703 1 1 28 PRO CG C -9.505 1.964 -3.391 1.00 . A A . 28 PRO CG 1 1 8 6704 1 1 28 PRO HA H -7.081 1.751 -5.618 1.00 . A A . 28 PRO HA 1 1 8 6705 1 1 28 PRO HB2 H -8.558 3.601 -4.396 1.00 . A A . 28 PRO HB2 1 1 8 6706 1 1 28 PRO HB3 H -9.312 2.420 -5.474 1.00 . A A . 28 PRO HB3 1 1 8 6707 1 1 28 PRO HD2 H -8.721 0.348 -2.221 1.00 . A A . 28 PRO HD2 1 1 8 6708 1 1 28 PRO HD3 H -9.804 -0.154 -3.534 1.00 . A A . 28 PRO HD3 1 1 8 6709 1 1 28 PRO HG2 H -9.282 2.526 -2.498 1.00 . A A . 28 PRO HG2 1 1 8 6710 1 1 28 PRO HG3 H -10.567 1.983 -3.589 1.00 . A A . 28 PRO HG3 1 1 8 6711 1 1 28 PRO N N -7.876 0.445 -4.158 1.00 . A A . 28 PRO N 1 1 8 6712 1 1 28 PRO O O -6.183 3.608 -3.703 1.00 . A A . 28 PRO O 1 1 8 6713 1 1 29 SER C C -3.488 2.078 -2.329 1.00 . A A . 29 SER C 1 1 8 6714 1 1 29 SER CA C -4.919 2.053 -1.804 1.00 . A A . 29 SER CA 1 1 8 6715 1 1 29 SER CB C -5.000 1.164 -0.567 1.00 . A A . 29 SER CB 1 1 8 6716 1 1 29 SER H H -6.118 0.630 -2.799 1.00 . A A . 29 SER H 1 1 8 6717 1 1 29 SER HA H -5.208 3.057 -1.532 1.00 . A A . 29 SER HA 1 1 8 6718 1 1 29 SER HB2 H -4.009 0.824 -0.306 1.00 . A A . 29 SER HB2 1 1 8 6719 1 1 29 SER HB3 H -5.416 1.726 0.256 1.00 . A A . 29 SER HB3 1 1 8 6720 1 1 29 SER HG H -5.304 -0.628 -1.305 1.00 . A A . 29 SER HG 1 1 8 6721 1 1 29 SER N N -5.855 1.576 -2.805 1.00 . A A . 29 SER N 1 1 8 6722 1 1 29 SER O O -3.178 1.500 -3.378 1.00 . A A . 29 SER O 1 1 8 6723 1 1 29 SER OG O -5.820 0.035 -0.813 1.00 . A A . 29 SER OG 1 1 8 6724 1 1 30 SER C C -0.410 2.366 -0.650 1.00 . A A . 30 SER C 1 1 8 6725 1 1 30 SER CA C -1.199 2.778 -1.888 1.00 . A A . 30 SER CA 1 1 8 6726 1 1 30 SER CB C -0.802 4.186 -2.343 1.00 . A A . 30 SER CB 1 1 8 6727 1 1 30 SER H H -2.926 3.158 -0.751 1.00 . A A . 30 SER H 1 1 8 6728 1 1 30 SER HA H -1.005 2.074 -2.683 1.00 . A A . 30 SER HA 1 1 8 6729 1 1 30 SER HB2 H -0.193 4.649 -1.583 1.00 . A A . 30 SER HB2 1 1 8 6730 1 1 30 SER HB3 H -0.242 4.120 -3.264 1.00 . A A . 30 SER HB3 1 1 8 6731 1 1 30 SER HG H -2.457 4.637 -3.305 1.00 . A A . 30 SER HG 1 1 8 6732 1 1 30 SER N N -2.616 2.730 -1.576 1.00 . A A . 30 SER N 1 1 8 6733 1 1 30 SER O O -0.929 2.435 0.469 1.00 . A A . 30 SER O 1 1 8 6734 1 1 30 SER OG O -1.950 4.995 -2.561 1.00 . A A . 30 SER OG 1 1 8 6735 1 1 31 TYR C C 2.989 1.595 0.179 1.00 . A A . 31 TYR C 1 1 8 6736 1 1 31 TYR CA C 1.518 1.225 0.259 1.00 . A A . 31 TYR CA 1 1 8 6737 1 1 31 TYR CB C 1.375 -0.294 0.265 1.00 . A A . 31 TYR CB 1 1 8 6738 1 1 31 TYR CD1 C 0.024 -0.983 2.270 1.00 . A A . 31 TYR CD1 1 1 8 6739 1 1 31 TYR CD2 C -1.042 -1.003 0.142 1.00 . A A . 31 TYR CD2 1 1 8 6740 1 1 31 TYR CE1 C -1.143 -1.414 2.862 1.00 . A A . 31 TYR CE1 1 1 8 6741 1 1 31 TYR CE2 C -2.214 -1.431 0.728 1.00 . A A . 31 TYR CE2 1 1 8 6742 1 1 31 TYR CG C 0.096 -0.771 0.904 1.00 . A A . 31 TYR CG 1 1 8 6743 1 1 31 TYR CZ C -2.259 -1.638 2.087 1.00 . A A . 31 TYR CZ 1 1 8 6744 1 1 31 TYR H H 1.064 1.616 -1.771 1.00 . A A . 31 TYR H 1 1 8 6745 1 1 31 TYR HA H 1.108 1.619 1.175 1.00 . A A . 31 TYR HA 1 1 8 6746 1 1 31 TYR HB2 H 1.392 -0.655 -0.753 1.00 . A A . 31 TYR HB2 1 1 8 6747 1 1 31 TYR HB3 H 2.201 -0.726 0.809 1.00 . A A . 31 TYR HB3 1 1 8 6748 1 1 31 TYR HD1 H 0.902 -0.807 2.876 1.00 . A A . 31 TYR HD1 1 1 8 6749 1 1 31 TYR HD2 H -1.002 -0.841 -0.925 1.00 . A A . 31 TYR HD2 1 1 8 6750 1 1 31 TYR HE1 H -1.177 -1.577 3.929 1.00 . A A . 31 TYR HE1 1 1 8 6751 1 1 31 TYR HE2 H -3.090 -1.607 0.120 1.00 . A A . 31 TYR HE2 1 1 8 6752 1 1 31 TYR HH H -3.904 -2.651 2.061 1.00 . A A . 31 TYR HH 1 1 8 6753 1 1 31 TYR N N 0.763 1.786 -0.850 1.00 . A A . 31 TYR N 1 1 8 6754 1 1 31 TYR O O 3.527 1.799 -0.901 1.00 . A A . 31 TYR O 1 1 8 6755 1 1 31 TYR OH O -3.423 -2.065 2.680 1.00 . A A . 31 TYR OH 1 1 8 6756 1 1 32 HIS C C 5.772 0.381 1.429 1.00 . A A . 32 HIS C 1 1 8 6757 1 1 32 HIS CA C 5.100 1.739 1.362 1.00 . A A . 32 HIS CA 1 1 8 6758 1 1 32 HIS CB C 5.508 2.569 2.579 1.00 . A A . 32 HIS CB 1 1 8 6759 1 1 32 HIS CD2 C 6.090 4.767 1.355 1.00 . A A . 32 HIS CD2 1 1 8 6760 1 1 32 HIS CE1 C 5.059 6.113 2.722 1.00 . A A . 32 HIS CE1 1 1 8 6761 1 1 32 HIS CG C 5.510 4.045 2.345 1.00 . A A . 32 HIS CG 1 1 8 6762 1 1 32 HIS H H 3.196 1.269 2.132 1.00 . A A . 32 HIS H 1 1 8 6763 1 1 32 HIS HA H 5.405 2.246 0.457 1.00 . A A . 32 HIS HA 1 1 8 6764 1 1 32 HIS HB2 H 4.821 2.365 3.387 1.00 . A A . 32 HIS HB2 1 1 8 6765 1 1 32 HIS HB3 H 6.502 2.279 2.883 1.00 . A A . 32 HIS HB3 1 1 8 6766 1 1 32 HIS HD2 H 6.671 4.383 0.530 1.00 . A A . 32 HIS HD2 1 1 8 6767 1 1 32 HIS HE1 H 4.676 7.014 3.178 1.00 . A A . 32 HIS HE1 1 1 8 6768 1 1 32 HIS HE2 H 6.241 6.860 1.185 1.00 . A A . 32 HIS HE2 1 1 8 6769 1 1 32 HIS N N 3.659 1.551 1.319 1.00 . A A . 32 HIS N 1 1 8 6770 1 1 32 HIS ND1 N 4.867 4.903 3.195 1.00 . A A . 32 HIS ND1 1 1 8 6771 1 1 32 HIS NE2 N 5.798 6.085 1.602 1.00 . A A . 32 HIS NE2 1 1 8 6772 1 1 32 HIS O O 5.252 -0.536 2.064 1.00 . A A . 32 HIS O 1 1 8 6773 1 1 33 ILE C C 8.199 -1.364 2.173 1.00 . A A . 33 ILE C 1 1 8 6774 1 1 33 ILE CA C 7.652 -1.012 0.789 1.00 . A A . 33 ILE CA 1 1 8 6775 1 1 33 ILE CB C 8.814 -1.004 -0.228 1.00 . A A . 33 ILE CB 1 1 8 6776 1 1 33 ILE CD1 C 10.775 0.404 -1.043 1.00 . A A . 33 ILE CD1 1 1 8 6777 1 1 33 ILE CG1 C 9.431 0.392 -0.342 1.00 . A A . 33 ILE CG1 1 1 8 6778 1 1 33 ILE CG2 C 8.327 -1.484 -1.586 1.00 . A A . 33 ILE CG2 1 1 8 6779 1 1 33 ILE H H 7.297 1.024 0.315 1.00 . A A . 33 ILE H 1 1 8 6780 1 1 33 ILE HA H 6.955 -1.781 0.491 1.00 . A A . 33 ILE HA 1 1 8 6781 1 1 33 ILE HB H 9.567 -1.695 0.120 1.00 . A A . 33 ILE HB 1 1 8 6782 1 1 33 ILE HD11 H 11.044 1.421 -1.289 1.00 . A A . 33 ILE HD11 1 1 8 6783 1 1 33 ILE HD12 H 11.525 -0.018 -0.392 1.00 . A A . 33 ILE HD12 1 1 8 6784 1 1 33 ILE HD13 H 10.716 -0.181 -1.950 1.00 . A A . 33 ILE HD13 1 1 8 6785 1 1 33 ILE HG12 H 8.761 1.030 -0.901 1.00 . A A . 33 ILE HG12 1 1 8 6786 1 1 33 ILE HG21 H 7.410 -2.041 -1.462 1.00 . A A . 33 ILE HG21 1 1 8 6787 1 1 33 ILE HG22 H 8.147 -0.633 -2.224 1.00 . A A . 33 ILE HG22 1 1 8 6788 1 1 33 ILE HG23 H 9.077 -2.119 -2.033 1.00 . A A . 33 ILE HG23 1 1 8 6789 1 1 33 ILE N N 6.929 0.255 0.801 1.00 . A A . 33 ILE N 1 1 8 6790 1 1 33 ILE O O 8.665 -2.478 2.394 1.00 . A A . 33 ILE O 1 1 8 6791 1 1 34 HIS C C 7.543 -0.411 5.487 1.00 . A A . 34 HIS C 1 1 8 6792 1 1 34 HIS CA C 8.645 -0.623 4.451 1.00 . A A . 34 HIS CA 1 1 8 6793 1 1 34 HIS CB C 9.832 0.305 4.780 1.00 . A A . 34 HIS CB 1 1 8 6794 1 1 34 HIS CD2 C 9.696 2.235 3.062 1.00 . A A . 34 HIS CD2 1 1 8 6795 1 1 34 HIS CE1 C 11.617 1.880 2.101 1.00 . A A . 34 HIS CE1 1 1 8 6796 1 1 34 HIS CG C 10.299 1.170 3.646 1.00 . A A . 34 HIS CG 1 1 8 6797 1 1 34 HIS H H 7.773 0.465 2.857 1.00 . A A . 34 HIS H 1 1 8 6798 1 1 34 HIS HA H 8.979 -1.647 4.515 1.00 . A A . 34 HIS HA 1 1 8 6799 1 1 34 HIS HB2 H 9.550 0.959 5.591 1.00 . A A . 34 HIS HB2 1 1 8 6800 1 1 34 HIS HB3 H 10.669 -0.303 5.095 1.00 . A A . 34 HIS HB3 1 1 8 6801 1 1 34 HIS HD2 H 8.735 2.657 3.322 1.00 . A A . 34 HIS HD2 1 1 8 6802 1 1 34 HIS HE1 H 12.462 1.983 1.438 1.00 . A A . 34 HIS HE1 1 1 8 6803 1 1 34 HIS HE2 H 10.458 3.526 1.573 1.00 . A A . 34 HIS HE2 1 1 8 6804 1 1 34 HIS N N 8.142 -0.409 3.097 1.00 . A A . 34 HIS N 1 1 8 6805 1 1 34 HIS ND1 N 11.511 0.953 3.035 1.00 . A A . 34 HIS ND1 1 1 8 6806 1 1 34 HIS NE2 N 10.543 2.677 2.080 1.00 . A A . 34 HIS NE2 1 1 8 6807 1 1 34 HIS O O 7.800 -0.450 6.687 1.00 . A A . 34 HIS O 1 1 8 6808 1 1 35 CYS C C 4.356 -1.309 6.039 1.00 . A A . 35 CYS C 1 1 8 6809 1 1 35 CYS CA C 5.192 -0.036 5.939 1.00 . A A . 35 CYS CA 1 1 8 6810 1 1 35 CYS CB C 4.332 1.150 5.493 1.00 . A A . 35 CYS CB 1 1 8 6811 1 1 35 CYS H H 6.147 -0.240 4.061 1.00 . A A . 35 CYS H 1 1 8 6812 1 1 35 CYS HA H 5.603 0.180 6.915 1.00 . A A . 35 CYS HA 1 1 8 6813 1 1 35 CYS HB2 H 4.270 1.156 4.415 1.00 . A A . 35 CYS HB2 1 1 8 6814 1 1 35 CYS HB3 H 3.339 1.042 5.906 1.00 . A A . 35 CYS HB3 1 1 8 6815 1 1 35 CYS N N 6.311 -0.223 5.027 1.00 . A A . 35 CYS N 1 1 8 6816 1 1 35 CYS O O 3.341 -1.348 6.731 1.00 . A A . 35 CYS O 1 1 8 6817 1 1 35 CYS SG S 4.982 2.772 6.021 1.00 . A A . 35 CYS SG 1 1 8 6818 1 1 36 LEU C C 4.932 -4.573 6.433 1.00 . A A . 36 LEU C 1 1 8 6819 1 1 36 LEU CA C 4.177 -3.665 5.476 1.00 . A A . 36 LEU CA 1 1 8 6820 1 1 36 LEU CB C 4.119 -4.312 4.091 1.00 . A A . 36 LEU CB 1 1 8 6821 1 1 36 LEU CD1 C 4.259 -3.721 1.663 1.00 . A A . 36 LEU CD1 1 1 8 6822 1 1 36 LEU CD2 C 2.069 -3.595 2.856 1.00 . A A . 36 LEU CD2 1 1 8 6823 1 1 36 LEU CG C 3.572 -3.417 2.983 1.00 . A A . 36 LEU CG 1 1 8 6824 1 1 36 LEU H H 5.676 -2.291 4.918 1.00 . A A . 36 LEU H 1 1 8 6825 1 1 36 LEU HA H 3.172 -3.516 5.844 1.00 . A A . 36 LEU HA 1 1 8 6826 1 1 36 LEU HB2 H 5.120 -4.617 3.818 1.00 . A A . 36 LEU HB2 1 1 8 6827 1 1 36 LEU HB3 H 3.497 -5.194 4.153 1.00 . A A . 36 LEU HB3 1 1 8 6828 1 1 36 LEU HD11 H 3.537 -3.662 0.861 1.00 . A A . 36 LEU HD11 1 1 8 6829 1 1 36 LEU HD12 H 5.046 -3.001 1.494 1.00 . A A . 36 LEU HD12 1 1 8 6830 1 1 36 LEU HD13 H 4.680 -4.715 1.696 1.00 . A A . 36 LEU HD13 1 1 8 6831 1 1 36 LEU HD21 H 1.652 -2.759 2.313 1.00 . A A . 36 LEU HD21 1 1 8 6832 1 1 36 LEU HD22 H 1.859 -4.510 2.322 1.00 . A A . 36 LEU HD22 1 1 8 6833 1 1 36 LEU HD23 H 1.625 -3.643 3.839 1.00 . A A . 36 LEU HD23 1 1 8 6834 1 1 36 LEU HG H 3.771 -2.386 3.233 1.00 . A A . 36 LEU HG 1 1 8 6835 1 1 36 LEU N N 4.830 -2.367 5.400 1.00 . A A . 36 LEU N 1 1 8 6836 1 1 36 LEU O O 6.041 -4.244 6.862 1.00 . A A . 36 LEU O 1 1 8 6837 1 1 37 ARG C C 6.208 -7.360 6.783 1.00 . A A . 37 ARG C 1 1 8 6838 1 1 37 ARG CA C 5.035 -6.727 7.546 1.00 . A A . 37 ARG CA 1 1 8 6839 1 1 37 ARG CB C 4.048 -7.794 8.032 1.00 . A A . 37 ARG CB 1 1 8 6840 1 1 37 ARG CD C 3.629 -7.058 10.400 1.00 . A A . 37 ARG CD 1 1 8 6841 1 1 37 ARG CG C 3.021 -7.269 9.021 1.00 . A A . 37 ARG CG 1 1 8 6842 1 1 37 ARG CZ C 4.318 -4.769 11.019 1.00 . A A . 37 ARG CZ 1 1 8 6843 1 1 37 ARG H H 3.504 -5.967 6.291 1.00 . A A . 37 ARG H 1 1 8 6844 1 1 37 ARG HA H 5.434 -6.207 8.404 1.00 . A A . 37 ARG HA 1 1 8 6845 1 1 37 ARG HB2 H 3.522 -8.198 7.179 1.00 . A A . 37 ARG HB2 1 1 8 6846 1 1 37 ARG HB3 H 4.602 -8.589 8.509 1.00 . A A . 37 ARG HB3 1 1 8 6847 1 1 37 ARG HD2 H 3.197 -7.775 11.083 1.00 . A A . 37 ARG HD2 1 1 8 6848 1 1 37 ARG HD3 H 4.696 -7.220 10.338 1.00 . A A . 37 ARG HD3 1 1 8 6849 1 1 37 ARG HE H 2.453 -5.491 11.171 1.00 . A A . 37 ARG HE 1 1 8 6850 1 1 37 ARG HG2 H 2.639 -6.326 8.661 1.00 . A A . 37 ARG HG2 1 1 8 6851 1 1 37 ARG HG3 H 2.212 -7.981 9.098 1.00 . A A . 37 ARG HG3 1 1 8 6852 1 1 37 ARG HH11 H 5.849 -5.987 10.449 1.00 . A A . 37 ARG HH11 1 1 8 6853 1 1 37 ARG HH12 H 6.302 -4.348 10.825 1.00 . A A . 37 ARG HH12 1 1 8 6854 1 1 37 ARG HH21 H 3.034 -3.342 11.681 1.00 . A A . 37 ARG HH21 1 1 8 6855 1 1 37 ARG HH22 H 4.687 -2.830 11.513 1.00 . A A . 37 ARG HH22 1 1 8 6856 1 1 37 ARG N N 4.367 -5.739 6.710 1.00 . A A . 37 ARG N 1 1 8 6857 1 1 37 ARG NE N 3.381 -5.709 10.908 1.00 . A A . 37 ARG NE 1 1 8 6858 1 1 37 ARG NH1 N 5.589 -5.055 10.741 1.00 . A A . 37 ARG NH1 1 1 8 6859 1 1 37 ARG NH2 N 3.987 -3.553 11.441 1.00 . A A . 37 ARG NH2 1 1 8 6860 1 1 37 ARG O O 7.361 -7.198 7.186 1.00 . A A . 37 ARG O 1 1 8 6861 1 1 38 PRO C C 7.601 -7.369 3.882 1.00 . A A . 38 PRO C 1 1 8 6862 1 1 38 PRO CA C 7.033 -8.483 4.755 1.00 . A A . 38 PRO CA 1 1 8 6863 1 1 38 PRO CB C 6.341 -9.551 3.894 1.00 . A A . 38 PRO CB 1 1 8 6864 1 1 38 PRO CD C 4.669 -8.154 4.946 1.00 . A A . 38 PRO CD 1 1 8 6865 1 1 38 PRO CG C 4.869 -9.418 4.153 1.00 . A A . 38 PRO CG 1 1 8 6866 1 1 38 PRO HA H 7.828 -8.930 5.332 1.00 . A A . 38 PRO HA 1 1 8 6867 1 1 38 PRO HB2 H 6.573 -9.377 2.853 1.00 . A A . 38 PRO HB2 1 1 8 6868 1 1 38 PRO HB3 H 6.700 -10.529 4.183 1.00 . A A . 38 PRO HB3 1 1 8 6869 1 1 38 PRO HD2 H 4.453 -7.325 4.290 1.00 . A A . 38 PRO HD2 1 1 8 6870 1 1 38 PRO HD3 H 3.881 -8.284 5.672 1.00 . A A . 38 PRO HD3 1 1 8 6871 1 1 38 PRO HG2 H 4.340 -9.353 3.216 1.00 . A A . 38 PRO HG2 1 1 8 6872 1 1 38 PRO HG3 H 4.521 -10.270 4.718 1.00 . A A . 38 PRO HG3 1 1 8 6873 1 1 38 PRO N N 5.965 -7.980 5.604 1.00 . A A . 38 PRO N 1 1 8 6874 1 1 38 PRO O O 7.130 -7.136 2.765 1.00 . A A . 38 PRO O 1 1 8 6875 1 1 39 ALA C C 9.880 -5.779 2.578 1.00 . A A . 39 ALA C 1 1 8 6876 1 1 39 ALA CA C 9.040 -5.412 3.800 1.00 . A A . 39 ALA CA 1 1 8 6877 1 1 39 ALA CB C 9.862 -4.587 4.779 1.00 . A A . 39 ALA CB 1 1 8 6878 1 1 39 ALA H H 8.762 -6.776 5.392 1.00 . A A . 39 ALA H 1 1 8 6879 1 1 39 ALA HA H 8.204 -4.808 3.478 1.00 . A A . 39 ALA HA 1 1 8 6880 1 1 39 ALA HB1 H 9.200 -4.095 5.476 1.00 . A A . 39 ALA HB1 1 1 8 6881 1 1 39 ALA HB2 H 10.539 -5.233 5.320 1.00 . A A . 39 ALA HB2 1 1 8 6882 1 1 39 ALA HB3 H 10.430 -3.846 4.237 1.00 . A A . 39 ALA HB3 1 1 8 6883 1 1 39 ALA N N 8.507 -6.594 4.460 1.00 . A A . 39 ALA N 1 1 8 6884 1 1 39 ALA O O 10.567 -6.802 2.561 1.00 . A A . 39 ALA O 1 1 8 6885 1 1 40 LEU C C 11.778 -4.090 0.349 1.00 . A A . 40 LEU C 1 1 8 6886 1 1 40 LEU CA C 10.638 -5.097 0.376 1.00 . A A . 40 LEU CA 1 1 8 6887 1 1 40 LEU CB C 9.758 -4.930 -0.867 1.00 . A A . 40 LEU CB 1 1 8 6888 1 1 40 LEU CD1 C 7.260 -5.167 -0.801 1.00 . A A . 40 LEU CD1 1 1 8 6889 1 1 40 LEU CD2 C 8.615 -6.649 -2.291 1.00 . A A . 40 LEU CD2 1 1 8 6890 1 1 40 LEU CG C 8.581 -5.905 -0.966 1.00 . A A . 40 LEU CG 1 1 8 6891 1 1 40 LEU H H 9.327 -4.085 1.684 1.00 . A A . 40 LEU H 1 1 8 6892 1 1 40 LEU HA H 11.049 -6.097 0.391 1.00 . A A . 40 LEU HA 1 1 8 6893 1 1 40 LEU HB2 H 9.368 -3.922 -0.871 1.00 . A A . 40 LEU HB2 1 1 8 6894 1 1 40 LEU HB3 H 10.381 -5.059 -1.741 1.00 . A A . 40 LEU HB3 1 1 8 6895 1 1 40 LEU HD11 H 7.454 -4.138 -0.538 1.00 . A A . 40 LEU HD11 1 1 8 6896 1 1 40 LEU HD12 H 6.709 -5.204 -1.730 1.00 . A A . 40 LEU HD12 1 1 8 6897 1 1 40 LEU HD13 H 6.680 -5.635 -0.020 1.00 . A A . 40 LEU HD13 1 1 8 6898 1 1 40 LEU HD21 H 8.362 -7.687 -2.129 1.00 . A A . 40 LEU HD21 1 1 8 6899 1 1 40 LEU HD22 H 7.902 -6.207 -2.971 1.00 . A A . 40 LEU HD22 1 1 8 6900 1 1 40 LEU HD23 H 9.605 -6.582 -2.716 1.00 . A A . 40 LEU HD23 1 1 8 6901 1 1 40 LEU HG H 8.657 -6.631 -0.169 1.00 . A A . 40 LEU HG 1 1 8 6902 1 1 40 LEU N N 9.852 -4.909 1.582 1.00 . A A . 40 LEU N 1 1 8 6903 1 1 40 LEU O O 11.620 -2.956 0.798 1.00 . A A . 40 LEU O 1 1 8 6904 1 1 41 TYR C C 14.202 -2.997 -1.585 1.00 . A A . 41 TYR C 1 1 8 6905 1 1 41 TYR CA C 14.098 -3.644 -0.211 1.00 . A A . 41 TYR CA 1 1 8 6906 1 1 41 TYR CB C 15.367 -4.437 0.104 1.00 . A A . 41 TYR CB 1 1 8 6907 1 1 41 TYR CD1 C 14.772 -4.109 2.538 1.00 . A A . 41 TYR CD1 1 1 8 6908 1 1 41 TYR CD2 C 16.948 -4.924 2.014 1.00 . A A . 41 TYR CD2 1 1 8 6909 1 1 41 TYR CE1 C 15.071 -4.158 3.884 1.00 . A A . 41 TYR CE1 1 1 8 6910 1 1 41 TYR CE2 C 17.257 -4.975 3.360 1.00 . A A . 41 TYR CE2 1 1 8 6911 1 1 41 TYR CG C 15.702 -4.491 1.580 1.00 . A A . 41 TYR CG 1 1 8 6912 1 1 41 TYR CZ C 16.314 -4.591 4.292 1.00 . A A . 41 TYR CZ 1 1 8 6913 1 1 41 TYR H H 12.999 -5.436 -0.488 1.00 . A A . 41 TYR H 1 1 8 6914 1 1 41 TYR HA H 13.975 -2.867 0.531 1.00 . A A . 41 TYR HA 1 1 8 6915 1 1 41 TYR HB2 H 15.243 -5.452 -0.242 1.00 . A A . 41 TYR HB2 1 1 8 6916 1 1 41 TYR HB3 H 16.202 -3.986 -0.412 1.00 . A A . 41 TYR HB3 1 1 8 6917 1 1 41 TYR HD1 H 13.798 -3.771 2.218 1.00 . A A . 41 TYR HD1 1 1 8 6918 1 1 41 TYR HD2 H 17.683 -5.221 1.282 1.00 . A A . 41 TYR HD2 1 1 8 6919 1 1 41 TYR HE1 H 14.333 -3.860 4.613 1.00 . A A . 41 TYR HE1 1 1 8 6920 1 1 41 TYR HE2 H 18.235 -5.313 3.678 1.00 . A A . 41 TYR HE2 1 1 8 6921 1 1 41 TYR HH H 17.535 -4.362 5.773 1.00 . A A . 41 TYR HH 1 1 8 6922 1 1 41 TYR N N 12.930 -4.511 -0.149 1.00 . A A . 41 TYR N 1 1 8 6923 1 1 41 TYR O O 15.101 -2.197 -1.849 1.00 . A A . 41 TYR O 1 1 8 6924 1 1 41 TYR OH O 16.614 -4.644 5.634 1.00 . A A . 41 TYR OH 1 1 8 6925 1 1 42 GLU C C 11.689 -2.422 -4.079 1.00 . A A . 42 GLU C 1 1 8 6926 1 1 42 GLU CA C 13.145 -2.721 -3.754 1.00 . A A . 42 GLU CA 1 1 8 6927 1 1 42 GLU CB C 13.739 -3.664 -4.803 1.00 . A A . 42 GLU CB 1 1 8 6928 1 1 42 GLU CD C 15.119 -3.160 -6.851 1.00 . A A . 42 GLU CD 1 1 8 6929 1 1 42 GLU CG C 15.082 -3.204 -5.340 1.00 . A A . 42 GLU CG 1 1 8 6930 1 1 42 GLU H H 12.525 -3.913 -2.135 1.00 . A A . 42 GLU H 1 1 8 6931 1 1 42 GLU HA H 13.701 -1.796 -3.750 1.00 . A A . 42 GLU HA 1 1 8 6932 1 1 42 GLU HB2 H 13.867 -4.641 -4.360 1.00 . A A . 42 GLU HB2 1 1 8 6933 1 1 42 GLU HB3 H 13.051 -3.740 -5.633 1.00 . A A . 42 GLU HB3 1 1 8 6934 1 1 42 GLU HG2 H 15.288 -2.213 -4.961 1.00 . A A . 42 GLU HG2 1 1 8 6935 1 1 42 GLU HG3 H 15.844 -3.887 -4.993 1.00 . A A . 42 GLU HG3 1 1 8 6936 1 1 42 GLU N N 13.236 -3.308 -2.431 1.00 . A A . 42 GLU N 1 1 8 6937 1 1 42 GLU O O 10.784 -2.984 -3.457 1.00 . A A . 42 GLU O 1 1 8 6938 1 1 42 GLU OE1 O 14.039 -3.141 -7.481 1.00 . A A . 42 GLU OE1 1 1 8 6939 1 1 42 GLU OE2 O 16.231 -3.140 -7.416 1.00 . A A . 42 GLU OE2 1 1 8 6940 1 1 43 VAL C C 9.680 -1.889 -6.675 1.00 . A A . 43 VAL C 1 1 8 6941 1 1 43 VAL CA C 10.109 -1.159 -5.409 1.00 . A A . 43 VAL CA 1 1 8 6942 1 1 43 VAL CB C 9.969 0.363 -5.637 1.00 . A A . 43 VAL CB 1 1 8 6943 1 1 43 VAL CG1 C 8.504 0.772 -5.610 1.00 . A A . 43 VAL CG1 1 1 8 6944 1 1 43 VAL CG2 C 10.762 1.147 -4.602 1.00 . A A . 43 VAL CG2 1 1 8 6945 1 1 43 VAL H H 12.223 -1.123 -5.499 1.00 . A A . 43 VAL H 1 1 8 6946 1 1 43 VAL HA H 9.448 -1.441 -4.604 1.00 . A A . 43 VAL HA 1 1 8 6947 1 1 43 VAL HB H 10.365 0.598 -6.613 1.00 . A A . 43 VAL HB 1 1 8 6948 1 1 43 VAL HG11 H 7.884 -0.105 -5.720 1.00 . A A . 43 VAL HG11 1 1 8 6949 1 1 43 VAL HG12 H 8.283 1.255 -4.670 1.00 . A A . 43 VAL HG12 1 1 8 6950 1 1 43 VAL HG13 H 8.307 1.456 -6.422 1.00 . A A . 43 VAL HG13 1 1 8 6951 1 1 43 VAL HG21 H 10.091 1.773 -4.034 1.00 . A A . 43 VAL HG21 1 1 8 6952 1 1 43 VAL HG22 H 11.264 0.460 -3.935 1.00 . A A . 43 VAL HG22 1 1 8 6953 1 1 43 VAL HG23 H 11.494 1.764 -5.101 1.00 . A A . 43 VAL HG23 1 1 8 6954 1 1 43 VAL N N 11.462 -1.532 -5.028 1.00 . A A . 43 VAL N 1 1 8 6955 1 1 43 VAL O O 10.176 -1.600 -7.764 1.00 . A A . 43 VAL O 1 1 8 6956 1 1 44 PRO C C 7.354 -2.649 -8.598 1.00 . A A . 44 PRO C 1 1 8 6957 1 1 44 PRO CA C 8.177 -3.560 -7.689 1.00 . A A . 44 PRO CA 1 1 8 6958 1 1 44 PRO CB C 7.278 -4.627 -7.050 1.00 . A A . 44 PRO CB 1 1 8 6959 1 1 44 PRO CD C 8.098 -3.236 -5.288 1.00 . A A . 44 PRO CD 1 1 8 6960 1 1 44 PRO CG C 7.619 -4.623 -5.597 1.00 . A A . 44 PRO CG 1 1 8 6961 1 1 44 PRO HA H 8.954 -4.036 -8.266 1.00 . A A . 44 PRO HA 1 1 8 6962 1 1 44 PRO HB2 H 6.242 -4.368 -7.211 1.00 . A A . 44 PRO HB2 1 1 8 6963 1 1 44 PRO HB3 H 7.485 -5.587 -7.499 1.00 . A A . 44 PRO HB3 1 1 8 6964 1 1 44 PRO HD2 H 7.267 -2.592 -5.040 1.00 . A A . 44 PRO HD2 1 1 8 6965 1 1 44 PRO HD3 H 8.819 -3.253 -4.483 1.00 . A A . 44 PRO HD3 1 1 8 6966 1 1 44 PRO HG2 H 6.742 -4.856 -5.012 1.00 . A A . 44 PRO HG2 1 1 8 6967 1 1 44 PRO HG3 H 8.403 -5.341 -5.401 1.00 . A A . 44 PRO HG3 1 1 8 6968 1 1 44 PRO N N 8.728 -2.827 -6.547 1.00 . A A . 44 PRO N 1 1 8 6969 1 1 44 PRO O O 7.162 -1.466 -8.301 1.00 . A A . 44 PRO O 1 1 8 6970 1 1 45 ASP C C 4.594 -2.433 -10.233 1.00 . A A . 45 ASP C 1 1 8 6971 1 1 45 ASP CA C 6.062 -2.437 -10.642 1.00 . A A . 45 ASP CA 1 1 8 6972 1 1 45 ASP CB C 6.216 -3.022 -12.051 1.00 . A A . 45 ASP CB 1 1 8 6973 1 1 45 ASP CG C 6.531 -1.963 -13.084 1.00 . A A . 45 ASP CG 1 1 8 6974 1 1 45 ASP H H 7.012 -4.161 -9.859 1.00 . A A . 45 ASP H 1 1 8 6975 1 1 45 ASP HA H 6.428 -1.422 -10.641 1.00 . A A . 45 ASP HA 1 1 8 6976 1 1 45 ASP HB2 H 7.019 -3.745 -12.049 1.00 . A A . 45 ASP HB2 1 1 8 6977 1 1 45 ASP HB3 H 5.296 -3.512 -12.334 1.00 . A A . 45 ASP HB3 1 1 8 6978 1 1 45 ASP N N 6.857 -3.204 -9.691 1.00 . A A . 45 ASP N 1 1 8 6979 1 1 45 ASP O O 4.258 -2.775 -9.098 1.00 . A A . 45 ASP O 1 1 8 6980 1 1 45 ASP OD1 O 7.636 -1.381 -13.028 1.00 . A A . 45 ASP OD1 1 1 8 6981 1 1 45 ASP OD2 O 5.681 -1.707 -13.961 1.00 . A A . 45 ASP OD2 1 1 8 6982 1 1 46 GLY C C 1.742 -3.601 -10.991 1.00 . A A . 46 GLY C 1 1 8 6983 1 1 46 GLY CA C 2.285 -2.186 -10.928 1.00 . A A . 46 GLY CA 1 1 8 6984 1 1 46 GLY H H 4.037 -1.947 -12.093 1.00 . A A . 46 GLY H 1 1 8 6985 1 1 46 GLY HA2 H 2.093 -1.780 -9.945 1.00 . A A . 46 GLY HA2 1 1 8 6986 1 1 46 GLY HA3 H 1.775 -1.583 -11.663 1.00 . A A . 46 GLY HA3 1 1 8 6987 1 1 46 GLY N N 3.714 -2.141 -11.186 1.00 . A A . 46 GLY N 1 1 8 6988 1 1 46 GLY O O 0.609 -3.831 -11.418 1.00 . A A . 46 GLY O 1 1 8 6989 1 1 47 GLU C C 2.430 -6.523 -9.172 1.00 . A A . 47 GLU C 1 1 8 6990 1 1 47 GLU CA C 2.187 -5.951 -10.555 1.00 . A A . 47 GLU CA 1 1 8 6991 1 1 47 GLU CB C 2.999 -6.729 -11.589 1.00 . A A . 47 GLU CB 1 1 8 6992 1 1 47 GLU CD C 3.179 -7.238 -14.040 1.00 . A A . 47 GLU CD 1 1 8 6993 1 1 47 GLU CG C 2.868 -6.190 -12.999 1.00 . A A . 47 GLU CG 1 1 8 6994 1 1 47 GLU H H 3.448 -4.292 -10.233 1.00 . A A . 47 GLU H 1 1 8 6995 1 1 47 GLU HA H 1.137 -6.024 -10.794 1.00 . A A . 47 GLU HA 1 1 8 6996 1 1 47 GLU HB2 H 4.040 -6.694 -11.310 1.00 . A A . 47 GLU HB2 1 1 8 6997 1 1 47 GLU HB3 H 2.671 -7.759 -11.587 1.00 . A A . 47 GLU HB3 1 1 8 6998 1 1 47 GLU HG2 H 1.856 -5.843 -13.147 1.00 . A A . 47 GLU HG2 1 1 8 6999 1 1 47 GLU HG3 H 3.553 -5.366 -13.121 1.00 . A A . 47 GLU HG3 1 1 8 7000 1 1 47 GLU N N 2.562 -4.548 -10.571 1.00 . A A . 47 GLU N 1 1 8 7001 1 1 47 GLU O O 3.307 -7.365 -8.982 1.00 . A A . 47 GLU O 1 1 8 7002 1 1 47 GLU OE1 O 2.294 -8.063 -14.337 1.00 . A A . 47 GLU OE1 1 1 8 7003 1 1 47 GLU OE2 O 4.313 -7.244 -14.560 1.00 . A A . 47 GLU OE2 1 1 8 7004 1 1 48 TRP C C 0.620 -6.511 -6.084 1.00 . A A . 48 TRP C 1 1 8 7005 1 1 48 TRP CA C 1.951 -6.351 -6.808 1.00 . A A . 48 TRP CA 1 1 8 7006 1 1 48 TRP CB C 2.815 -5.287 -6.119 1.00 . A A . 48 TRP CB 1 1 8 7007 1 1 48 TRP CD1 C 3.671 -6.343 -3.950 1.00 . A A . 48 TRP CD1 1 1 8 7008 1 1 48 TRP CD2 C 2.225 -4.662 -3.643 1.00 . A A . 48 TRP CD2 1 1 8 7009 1 1 48 TRP CE2 C 2.619 -5.152 -2.384 1.00 . A A . 48 TRP CE2 1 1 8 7010 1 1 48 TRP CE3 C 1.320 -3.597 -3.700 1.00 . A A . 48 TRP CE3 1 1 8 7011 1 1 48 TRP CG C 2.910 -5.440 -4.632 1.00 . A A . 48 TRP CG 1 1 8 7012 1 1 48 TRP CH2 C 1.251 -3.575 -1.280 1.00 . A A . 48 TRP CH2 1 1 8 7013 1 1 48 TRP CZ2 C 2.135 -4.615 -1.194 1.00 . A A . 48 TRP CZ2 1 1 8 7014 1 1 48 TRP CZ3 C 0.842 -3.067 -2.518 1.00 . A A . 48 TRP CZ3 1 1 8 7015 1 1 48 TRP H H 1.100 -5.255 -8.401 1.00 . A A . 48 TRP H 1 1 8 7016 1 1 48 TRP HA H 2.475 -7.295 -6.795 1.00 . A A . 48 TRP HA 1 1 8 7017 1 1 48 TRP HB2 H 3.817 -5.337 -6.519 1.00 . A A . 48 TRP HB2 1 1 8 7018 1 1 48 TRP HB3 H 2.402 -4.311 -6.328 1.00 . A A . 48 TRP HB3 1 1 8 7019 1 1 48 TRP HD1 H 4.309 -7.077 -4.418 1.00 . A A . 48 TRP HD1 1 1 8 7020 1 1 48 TRP HE1 H 3.941 -6.712 -1.896 1.00 . A A . 48 TRP HE1 1 1 8 7021 1 1 48 TRP HE3 H 0.996 -3.188 -4.646 1.00 . A A . 48 TRP HE3 1 1 8 7022 1 1 48 TRP HH2 H 0.853 -3.128 -0.381 1.00 . A A . 48 TRP HH2 1 1 8 7023 1 1 48 TRP HZ2 H 2.439 -4.996 -0.232 1.00 . A A . 48 TRP HZ2 1 1 8 7024 1 1 48 TRP HZ3 H 0.139 -2.249 -2.543 1.00 . A A . 48 TRP HZ3 1 1 8 7025 1 1 48 TRP N N 1.736 -5.975 -8.193 1.00 . A A . 48 TRP N 1 1 8 7026 1 1 48 TRP NE1 N 3.500 -6.178 -2.597 1.00 . A A . 48 TRP NE1 1 1 8 7027 1 1 48 TRP O O -0.266 -5.662 -6.200 1.00 . A A . 48 TRP O 1 1 8 7028 1 1 49 GLN C C -0.413 -7.629 -3.060 1.00 . A A . 49 GLN C 1 1 8 7029 1 1 49 GLN CA C -0.706 -7.812 -4.539 1.00 . A A . 49 GLN CA 1 1 8 7030 1 1 49 GLN CB C -1.281 -9.198 -4.812 1.00 . A A . 49 GLN CB 1 1 8 7031 1 1 49 GLN CD C -3.779 -8.996 -5.204 1.00 . A A . 49 GLN CD 1 1 8 7032 1 1 49 GLN CG C -2.408 -9.179 -5.833 1.00 . A A . 49 GLN CG 1 1 8 7033 1 1 49 GLN H H 1.240 -8.217 -5.247 1.00 . A A . 49 GLN H 1 1 8 7034 1 1 49 GLN HA H -1.432 -7.071 -4.837 1.00 . A A . 49 GLN HA 1 1 8 7035 1 1 49 GLN HB2 H -0.493 -9.838 -5.183 1.00 . A A . 49 GLN HB2 1 1 8 7036 1 1 49 GLN HB3 H -1.665 -9.607 -3.889 1.00 . A A . 49 GLN HB3 1 1 8 7037 1 1 49 GLN HE21 H -3.243 -7.266 -4.373 1.00 . A A . 49 GLN HE21 1 1 8 7038 1 1 49 GLN HE22 H -4.862 -7.778 -4.058 1.00 . A A . 49 GLN HE22 1 1 8 7039 1 1 49 GLN HG2 H -2.235 -8.367 -6.524 1.00 . A A . 49 GLN HG2 1 1 8 7040 1 1 49 GLN HG3 H -2.399 -10.116 -6.375 1.00 . A A . 49 GLN HG3 1 1 8 7041 1 1 49 GLN N N 0.492 -7.584 -5.320 1.00 . A A . 49 GLN N 1 1 8 7042 1 1 49 GLN NE2 N -3.977 -7.901 -4.477 1.00 . A A . 49 GLN NE2 1 1 8 7043 1 1 49 GLN O O 0.606 -8.097 -2.546 1.00 . A A . 49 GLN O 1 1 8 7044 1 1 49 GLN OE1 O -4.661 -9.837 -5.372 1.00 . A A . 49 GLN OE1 1 1 8 7045 1 1 50 CYS C C -1.249 -7.560 -0.069 1.00 . A A . 50 CYS C 1 1 8 7046 1 1 50 CYS CA C -1.061 -6.412 -1.058 1.00 . A A . 50 CYS CA 1 1 8 7047 1 1 50 CYS CB C -2.082 -5.324 -0.797 1.00 . A A . 50 CYS CB 1 1 8 7048 1 1 50 CYS H H -1.991 -6.429 -2.927 1.00 . A A . 50 CYS H 1 1 8 7049 1 1 50 CYS HA H -0.071 -6.003 -0.954 1.00 . A A . 50 CYS HA 1 1 8 7050 1 1 50 CYS HB2 H -2.502 -5.448 0.190 1.00 . A A . 50 CYS HB2 1 1 8 7051 1 1 50 CYS HB3 H -1.602 -4.356 -0.871 1.00 . A A . 50 CYS HB3 1 1 8 7052 1 1 50 CYS N N -1.248 -6.831 -2.427 1.00 . A A . 50 CYS N 1 1 8 7053 1 1 50 CYS O O -2.237 -8.292 -0.130 1.00 . A A . 50 CYS O 1 1 8 7054 1 1 50 CYS SG S -3.445 -5.358 -2.005 1.00 . A A . 50 CYS SG 1 1 8 7055 1 1 51 PRO C C -1.347 -8.127 3.135 1.00 . A A . 51 PRO C 1 1 8 7056 1 1 51 PRO CA C -0.466 -8.636 1.993 1.00 . A A . 51 PRO CA 1 1 8 7057 1 1 51 PRO CB C 0.982 -8.792 2.448 1.00 . A A . 51 PRO CB 1 1 8 7058 1 1 51 PRO CD C 0.811 -6.781 1.111 1.00 . A A . 51 PRO CD 1 1 8 7059 1 1 51 PRO CG C 1.618 -7.464 2.191 1.00 . A A . 51 PRO CG 1 1 8 7060 1 1 51 PRO HA H -0.844 -9.582 1.634 1.00 . A A . 51 PRO HA 1 1 8 7061 1 1 51 PRO HB2 H 1.007 -9.046 3.498 1.00 . A A . 51 PRO HB2 1 1 8 7062 1 1 51 PRO HB3 H 1.459 -9.573 1.875 1.00 . A A . 51 PRO HB3 1 1 8 7063 1 1 51 PRO HD2 H 0.502 -5.799 1.437 1.00 . A A . 51 PRO HD2 1 1 8 7064 1 1 51 PRO HD3 H 1.389 -6.709 0.202 1.00 . A A . 51 PRO HD3 1 1 8 7065 1 1 51 PRO HG2 H 1.602 -6.872 3.095 1.00 . A A . 51 PRO HG2 1 1 8 7066 1 1 51 PRO HG3 H 2.636 -7.607 1.859 1.00 . A A . 51 PRO HG3 1 1 8 7067 1 1 51 PRO N N -0.357 -7.658 0.923 1.00 . A A . 51 PRO N 1 1 8 7068 1 1 51 PRO O O -1.375 -8.703 4.221 1.00 . A A . 51 PRO O 1 1 8 7069 1 1 52 ARG C C -4.373 -6.585 3.507 1.00 . A A . 52 ARG C 1 1 8 7070 1 1 52 ARG CA C -2.905 -6.407 3.882 1.00 . A A . 52 ARG CA 1 1 8 7071 1 1 52 ARG CB C -2.577 -4.919 4.014 1.00 . A A . 52 ARG CB 1 1 8 7072 1 1 52 ARG CD C -1.844 -3.189 5.674 1.00 . A A . 52 ARG CD 1 1 8 7073 1 1 52 ARG CG C -2.761 -4.373 5.420 1.00 . A A . 52 ARG CG 1 1 8 7074 1 1 52 ARG CZ C -1.027 -2.526 7.899 1.00 . A A . 52 ARG CZ 1 1 8 7075 1 1 52 ARG H H -1.966 -6.609 1.997 1.00 . A A . 52 ARG H 1 1 8 7076 1 1 52 ARG HA H -2.723 -6.894 4.827 1.00 . A A . 52 ARG HA 1 1 8 7077 1 1 52 ARG HB2 H -1.548 -4.763 3.722 1.00 . A A . 52 ARG HB2 1 1 8 7078 1 1 52 ARG HB3 H -3.217 -4.361 3.348 1.00 . A A . 52 ARG HB3 1 1 8 7079 1 1 52 ARG HD2 H -0.821 -3.513 5.559 1.00 . A A . 52 ARG HD2 1 1 8 7080 1 1 52 ARG HD3 H -2.059 -2.420 4.945 1.00 . A A . 52 ARG HD3 1 1 8 7081 1 1 52 ARG HE H -2.919 -2.307 7.260 1.00 . A A . 52 ARG HE 1 1 8 7082 1 1 52 ARG HG2 H -3.785 -4.057 5.544 1.00 . A A . 52 ARG HG2 1 1 8 7083 1 1 52 ARG HG3 H -2.532 -5.152 6.133 1.00 . A A . 52 ARG HG3 1 1 8 7084 1 1 52 ARG HH11 H 0.362 -3.390 6.706 1.00 . A A . 52 ARG HH11 1 1 8 7085 1 1 52 ARG HH12 H 0.942 -2.890 8.266 1.00 . A A . 52 ARG HH12 1 1 8 7086 1 1 52 ARG HH21 H -2.169 -1.636 9.321 1.00 . A A . 52 ARG HH21 1 1 8 7087 1 1 52 ARG HH22 H -0.511 -1.909 9.755 1.00 . A A . 52 ARG HH22 1 1 8 7088 1 1 52 ARG N N -2.043 -7.023 2.883 1.00 . A A . 52 ARG N 1 1 8 7089 1 1 52 ARG NE N -2.014 -2.630 7.013 1.00 . A A . 52 ARG NE 1 1 8 7090 1 1 52 ARG NH1 N 0.187 -2.971 7.597 1.00 . A A . 52 ARG NH1 1 1 8 7091 1 1 52 ARG NH2 N -1.252 -1.978 9.083 1.00 . A A . 52 ARG NH2 1 1 8 7092 1 1 52 ARG O O -5.079 -7.404 4.102 1.00 . A A . 52 ARG O 1 1 8 7093 1 1 53 CYS C C -6.412 -7.171 1.234 1.00 . A A . 53 CYS C 1 1 8 7094 1 1 53 CYS CA C -6.192 -5.901 2.043 1.00 . A A . 53 CYS CA 1 1 8 7095 1 1 53 CYS CB C -6.492 -4.675 1.195 1.00 . A A . 53 CYS CB 1 1 8 7096 1 1 53 CYS H H -4.212 -5.207 2.061 1.00 . A A . 53 CYS H 1 1 8 7097 1 1 53 CYS HA H -6.843 -5.909 2.903 1.00 . A A . 53 CYS HA 1 1 8 7098 1 1 53 CYS HB2 H -6.900 -4.995 0.247 1.00 . A A . 53 CYS HB2 1 1 8 7099 1 1 53 CYS HB3 H -7.210 -4.057 1.707 1.00 . A A . 53 CYS HB3 1 1 8 7100 1 1 53 CYS N N -4.820 -5.831 2.506 1.00 . A A . 53 CYS N 1 1 8 7101 1 1 53 CYS O O -7.513 -7.728 1.215 1.00 . A A . 53 CYS O 1 1 8 7102 1 1 53 CYS SG S -5.028 -3.654 0.844 1.00 . A A . 53 CYS SG 1 1 8 7103 1 1 54 THR C C -6.112 -8.853 -1.393 1.00 . A A . 54 THR C 1 1 8 7104 1 1 54 THR CA C -5.261 -8.904 -0.119 1.00 . A A . 54 THR CA 1 1 8 7105 1 1 54 THR CB C -5.606 -10.167 0.715 1.00 . A A . 54 THR CB 1 1 8 7106 1 1 54 THR CG2 C -4.350 -10.987 0.953 1.00 . A A . 54 THR CG2 1 1 8 7107 1 1 54 THR H H -4.482 -7.156 0.766 1.00 . A A . 54 THR H 1 1 8 7108 1 1 54 THR HA H -4.231 -9.012 -0.433 1.00 . A A . 54 THR HA 1 1 8 7109 1 1 54 THR HB H -6.308 -10.769 0.158 1.00 . A A . 54 THR HB 1 1 8 7110 1 1 54 THR HG1 H -6.753 -9.054 1.870 1.00 . A A . 54 THR HG1 1 1 8 7111 1 1 54 THR HG21 H -3.832 -11.134 0.017 1.00 . A A . 54 THR HG21 1 1 8 7112 1 1 54 THR HG22 H -4.618 -11.944 1.372 1.00 . A A . 54 THR HG22 1 1 8 7113 1 1 54 THR HG23 H -3.705 -10.457 1.640 1.00 . A A . 54 THR HG23 1 1 8 7114 1 1 54 THR N N -5.315 -7.658 0.654 1.00 . A A . 54 THR N 1 1 8 7115 1 1 54 THR O O -5.576 -8.982 -2.493 1.00 . A A . 54 THR O 1 1 8 7116 1 1 54 THR OG1 O -6.182 -9.824 1.983 1.00 . A A . 54 THR OG1 1 1 8 7117 1 1 55 CYS C C -9.595 -7.783 -2.072 1.00 . A A . 55 CYS C 1 1 8 7118 1 1 55 CYS CA C -8.306 -8.550 -2.407 1.00 . A A . 55 CYS CA 1 1 8 7119 1 1 55 CYS CB C -8.649 -9.946 -2.948 1.00 . A A . 55 CYS CB 1 1 8 7120 1 1 55 CYS H H -7.783 -8.508 -0.353 1.00 . A A . 55 CYS H 1 1 8 7121 1 1 55 CYS HA H -7.779 -8.006 -3.178 1.00 . A A . 55 CYS HA 1 1 8 7122 1 1 55 CYS HB2 H -8.745 -10.629 -2.118 1.00 . A A . 55 CYS HB2 1 1 8 7123 1 1 55 CYS HB3 H -9.591 -9.897 -3.474 1.00 . A A . 55 CYS HB3 1 1 8 7124 1 1 55 CYS HG H -6.314 -9.905 -3.966 1.00 . A A . 55 CYS HG 1 1 8 7125 1 1 55 CYS N N -7.414 -8.643 -1.253 1.00 . A A . 55 CYS N 1 1 8 7126 1 1 55 CYS O O -9.949 -6.837 -2.779 1.00 . A A . 55 CYS O 1 1 8 7127 1 1 55 CYS SG S -7.419 -10.633 -4.083 1.00 . A A . 55 CYS SG 1 1 8 7128 1 1 56 PRO C C -11.522 -6.388 0.213 1.00 . A A . 56 PRO C 1 1 8 7129 1 1 56 PRO CA C -11.650 -7.596 -0.716 1.00 . A A . 56 PRO CA 1 1 8 7130 1 1 56 PRO CB C -12.422 -8.728 -0.015 1.00 . A A . 56 PRO CB 1 1 8 7131 1 1 56 PRO CD C -10.113 -9.358 -0.172 1.00 . A A . 56 PRO CD 1 1 8 7132 1 1 56 PRO CG C -11.493 -9.899 0.044 1.00 . A A . 56 PRO CG 1 1 8 7133 1 1 56 PRO HA H -12.180 -7.302 -1.610 1.00 . A A . 56 PRO HA 1 1 8 7134 1 1 56 PRO HB2 H -12.707 -8.406 0.976 1.00 . A A . 56 PRO HB2 1 1 8 7135 1 1 56 PRO HB3 H -13.307 -8.962 -0.585 1.00 . A A . 56 PRO HB3 1 1 8 7136 1 1 56 PRO HD2 H -9.673 -9.051 0.765 1.00 . A A . 56 PRO HD2 1 1 8 7137 1 1 56 PRO HD3 H -9.489 -10.088 -0.666 1.00 . A A . 56 PRO HD3 1 1 8 7138 1 1 56 PRO HG2 H -11.561 -10.371 1.013 1.00 . A A . 56 PRO HG2 1 1 8 7139 1 1 56 PRO HG3 H -11.744 -10.606 -0.734 1.00 . A A . 56 PRO HG3 1 1 8 7140 1 1 56 PRO N N -10.362 -8.207 -1.041 1.00 . A A . 56 PRO N 1 1 8 7141 1 1 56 PRO O O -11.808 -6.477 1.408 1.00 . A A . 56 PRO O 1 1 8 7142 1 1 57 ALA C C -12.150 -3.042 0.002 1.00 . A A . 57 ALA C 1 1 8 7143 1 1 57 ALA CA C -11.051 -4.015 0.413 1.00 . A A . 57 ALA CA 1 1 8 7144 1 1 57 ALA CB C -9.680 -3.382 0.233 1.00 . A A . 57 ALA CB 1 1 8 7145 1 1 57 ALA H H -10.966 -5.230 -1.317 1.00 . A A . 57 ALA H 1 1 8 7146 1 1 57 ALA HA H -11.175 -4.258 1.459 1.00 . A A . 57 ALA HA 1 1 8 7147 1 1 57 ALA HB1 H -8.920 -4.147 0.293 1.00 . A A . 57 ALA HB1 1 1 8 7148 1 1 57 ALA HB2 H -9.631 -2.902 -0.732 1.00 . A A . 57 ALA HB2 1 1 8 7149 1 1 57 ALA HB3 H -9.516 -2.649 1.010 1.00 . A A . 57 ALA HB3 1 1 8 7150 1 1 57 ALA N N -11.151 -5.249 -0.353 1.00 . A A . 57 ALA N 1 1 8 7151 1 1 57 ALA O O -12.097 -1.853 0.320 1.00 . A A . 57 ALA O 1 1 8 7152 1 1 58 LEU C C -15.401 -2.820 -0.070 1.00 . A A . 58 LEU C 1 1 8 7153 1 1 58 LEU CA C -14.287 -2.747 -1.108 1.00 . A A . 58 LEU CA 1 1 8 7154 1 1 58 LEU CB C -14.804 -3.203 -2.474 1.00 . A A . 58 LEU CB 1 1 8 7155 1 1 58 LEU CD1 C -14.424 -2.785 -4.916 1.00 . A A . 58 LEU CD1 1 1 8 7156 1 1 58 LEU CD2 C -16.036 -1.363 -3.645 1.00 . A A . 58 LEU CD2 1 1 8 7157 1 1 58 LEU CG C -14.733 -2.143 -3.575 1.00 . A A . 58 LEU CG 1 1 8 7158 1 1 58 LEU H H -13.154 -4.520 -0.891 1.00 . A A . 58 LEU H 1 1 8 7159 1 1 58 LEU HA H -13.947 -1.724 -1.183 1.00 . A A . 58 LEU HA 1 1 8 7160 1 1 58 LEU HB2 H -14.224 -4.058 -2.788 1.00 . A A . 58 LEU HB2 1 1 8 7161 1 1 58 LEU HB3 H -15.834 -3.507 -2.364 1.00 . A A . 58 LEU HB3 1 1 8 7162 1 1 58 LEU HD11 H -15.346 -2.971 -5.446 1.00 . A A . 58 LEU HD11 1 1 8 7163 1 1 58 LEU HD12 H -13.801 -2.123 -5.499 1.00 . A A . 58 LEU HD12 1 1 8 7164 1 1 58 LEU HD13 H -13.907 -3.719 -4.757 1.00 . A A . 58 LEU HD13 1 1 8 7165 1 1 58 LEU HD21 H -16.625 -1.718 -4.479 1.00 . A A . 58 LEU HD21 1 1 8 7166 1 1 58 LEU HD22 H -16.588 -1.503 -2.728 1.00 . A A . 58 LEU HD22 1 1 8 7167 1 1 58 LEU HD23 H -15.820 -0.313 -3.779 1.00 . A A . 58 LEU HD23 1 1 8 7168 1 1 58 LEU HG H -13.939 -1.449 -3.348 1.00 . A A . 58 LEU HG 1 1 8 7169 1 1 58 LEU N N -13.157 -3.560 -0.687 1.00 . A A . 58 LEU N 1 1 8 7170 1 1 58 LEU O O -15.897 -1.796 0.398 1.00 . A A . 58 LEU O 1 1 8 7171 1 1 59 LYS C C -16.078 -4.613 2.683 1.00 . A A . 59 LYS C 1 1 8 7172 1 1 59 LYS CA C -16.745 -4.245 1.366 1.00 . A A . 59 LYS CA 1 1 8 7173 1 1 59 LYS CB C -17.724 -5.345 0.945 1.00 . A A . 59 LYS CB 1 1 8 7174 1 1 59 LYS CD C -18.971 -4.563 -1.087 1.00 . A A . 59 LYS CD 1 1 8 7175 1 1 59 LYS CE C -19.313 -3.125 -1.434 1.00 . A A . 59 LYS CE 1 1 8 7176 1 1 59 LYS CG C -19.042 -4.811 0.409 1.00 . A A . 59 LYS CG 1 1 8 7177 1 1 59 LYS H H -15.262 -4.817 -0.033 1.00 . A A . 59 LYS H 1 1 8 7178 1 1 59 LYS HA H -17.286 -3.320 1.496 1.00 . A A . 59 LYS HA 1 1 8 7179 1 1 59 LYS HB2 H -17.263 -5.945 0.173 1.00 . A A . 59 LYS HB2 1 1 8 7180 1 1 59 LYS HB3 H -17.932 -5.972 1.799 1.00 . A A . 59 LYS HB3 1 1 8 7181 1 1 59 LYS HD2 H -17.970 -4.774 -1.429 1.00 . A A . 59 LYS HD2 1 1 8 7182 1 1 59 LYS HD3 H -19.670 -5.219 -1.585 1.00 . A A . 59 LYS HD3 1 1 8 7183 1 1 59 LYS HE2 H -19.775 -2.662 -0.575 1.00 . A A . 59 LYS HE2 1 1 8 7184 1 1 59 LYS HE3 H -18.403 -2.602 -1.678 1.00 . A A . 59 LYS HE3 1 1 8 7185 1 1 59 LYS HG2 H -19.820 -5.533 0.609 1.00 . A A . 59 LYS HG2 1 1 8 7186 1 1 59 LYS HG3 H -19.273 -3.881 0.909 1.00 . A A . 59 LYS HG3 1 1 8 7187 1 1 59 LYS HZ1 H -21.165 -3.463 -2.339 1.00 . A A . 59 LYS HZ1 1 1 8 7188 1 1 59 LYS HZ2 H -19.848 -3.558 -3.403 1.00 . A A . 59 LYS HZ2 1 1 8 7189 1 1 59 LYS HZ3 H -20.390 -2.046 -2.859 1.00 . A A . 59 LYS HZ3 1 1 8 7190 1 1 59 LYS N N -15.738 -4.035 0.337 1.00 . A A . 59 LYS N 1 1 8 7191 1 1 59 LYS NZ N -20.244 -3.041 -2.587 1.00 . A A . 59 LYS NZ 1 1 8 7192 1 1 59 LYS O O -15.645 -5.752 2.877 1.00 . A A . 59 LYS O 1 1 8 7193 1 1 60 GLY C C -14.287 -2.765 5.155 1.00 . A A . 60 GLY C 1 1 8 7194 1 1 60 GLY CA C -15.278 -3.858 4.823 1.00 . A A . 60 GLY CA 1 1 8 7195 1 1 60 GLY H H -16.252 -2.729 3.323 1.00 . A A . 60 GLY H 1 1 8 7196 1 1 60 GLY HA2 H -16.022 -3.906 5.604 1.00 . A A . 60 GLY HA2 1 1 8 7197 1 1 60 GLY HA3 H -14.754 -4.802 4.780 1.00 . A A . 60 GLY HA3 1 1 8 7198 1 1 60 GLY N N -15.939 -3.631 3.556 1.00 . A A . 60 GLY N 1 1 8 7199 1 1 60 GLY O O -14.675 -1.623 5.412 1.00 . A A . 60 GLY O 1 1 8 7200 1 1 61 LYS C C -10.783 -2.354 4.417 1.00 . A A . 61 LYS C 1 1 8 7201 1 1 61 LYS CA C -11.956 -2.124 5.357 1.00 . A A . 61 LYS CA 1 1 8 7202 1 1 61 LYS CB C -11.489 -2.224 6.811 1.00 . A A . 61 LYS CB 1 1 8 7203 1 1 61 LYS CD C -12.148 -0.551 8.565 1.00 . A A . 61 LYS CD 1 1 8 7204 1 1 61 LYS CE C -12.993 0.666 8.230 1.00 . A A . 61 LYS CE 1 1 8 7205 1 1 61 LYS CG C -11.174 -0.878 7.447 1.00 . A A . 61 LYS CG 1 1 8 7206 1 1 61 LYS H H -12.756 -4.007 4.825 1.00 . A A . 61 LYS H 1 1 8 7207 1 1 61 LYS HA H -12.361 -1.139 5.180 1.00 . A A . 61 LYS HA 1 1 8 7208 1 1 61 LYS HB2 H -12.265 -2.700 7.394 1.00 . A A . 61 LYS HB2 1 1 8 7209 1 1 61 LYS HB3 H -10.598 -2.834 6.850 1.00 . A A . 61 LYS HB3 1 1 8 7210 1 1 61 LYS HD2 H -12.801 -1.398 8.723 1.00 . A A . 61 LYS HD2 1 1 8 7211 1 1 61 LYS HD3 H -11.590 -0.351 9.470 1.00 . A A . 61 LYS HD3 1 1 8 7212 1 1 61 LYS HE2 H -12.479 1.552 8.571 1.00 . A A . 61 LYS HE2 1 1 8 7213 1 1 61 LYS HE3 H -13.119 0.715 7.157 1.00 . A A . 61 LYS HE3 1 1 8 7214 1 1 61 LYS HG2 H -10.174 -0.908 7.851 1.00 . A A . 61 LYS HG2 1 1 8 7215 1 1 61 LYS HG3 H -11.236 -0.108 6.690 1.00 . A A . 61 LYS HG3 1 1 8 7216 1 1 61 LYS HZ1 H -14.454 1.409 9.527 1.00 . A A . 61 LYS HZ1 1 1 8 7217 1 1 61 LYS HZ2 H -14.434 -0.282 9.409 1.00 . A A . 61 LYS HZ2 1 1 8 7218 1 1 61 LYS HZ3 H -15.081 0.647 8.146 1.00 . A A . 61 LYS HZ3 1 1 8 7219 1 1 61 LYS N N -13.007 -3.094 5.094 1.00 . A A . 61 LYS N 1 1 8 7220 1 1 61 LYS NZ N -14.332 0.607 8.872 1.00 . A A . 61 LYS NZ 1 1 8 7221 1 1 61 LYS O O -10.108 -1.368 4.056 1.00 . A A . 61 LYS O 1 1 8 7222 1 1 61 LYS OXT O -10.557 -3.520 4.035 1.00 . A A . 61 LYS OXT 1 1 8 7223 2 2 1 ZN ZN ZN -4.812 -3.675 -1.417 1.00 . B A . 62 ZN ZN 1 1 8 7224 3 2 1 ZN ZN ZN 3.836 4.404 4.836 1.00 . C A . 63 ZN ZN 1 1 9 7225 1 1 1 GLY C C -9.748 8.823 7.701 1.00 . A A . 1 GLY C 1 1 9 7226 1 1 1 GLY CA C -8.989 9.804 8.571 1.00 . A A . 1 GLY CA 1 1 9 7227 1 1 1 GLY H1 H -7.671 11.369 8.175 1.00 . A A . 1 GLY H1 1 1 9 7228 1 1 1 GLY H2 H -9.300 11.761 7.927 1.00 . A A . 1 GLY H2 1 1 9 7229 1 1 1 GLY H3 H -8.481 10.787 6.804 1.00 . A A . 1 GLY H3 1 1 9 7230 1 1 1 GLY HA2 H -8.106 9.319 8.960 1.00 . A A . 1 GLY HA2 1 1 9 7231 1 1 1 GLY HA3 H -9.618 10.099 9.397 1.00 . A A . 1 GLY HA3 1 1 9 7232 1 1 1 GLY N N -8.583 11.013 7.817 1.00 . A A . 1 GLY N 1 1 9 7233 1 1 1 GLY O O -9.448 8.685 6.515 1.00 . A A . 1 GLY O 1 1 9 7234 1 1 2 PRO C C -12.406 7.725 6.470 1.00 . A A . 2 PRO C 1 1 9 7235 1 1 2 PRO CA C -11.487 7.097 7.518 1.00 . A A . 2 PRO CA 1 1 9 7236 1 1 2 PRO CB C -12.312 6.393 8.597 1.00 . A A . 2 PRO CB 1 1 9 7237 1 1 2 PRO CD C -11.106 8.143 9.688 1.00 . A A . 2 PRO CD 1 1 9 7238 1 1 2 PRO CG C -12.390 7.364 9.724 1.00 . A A . 2 PRO CG 1 1 9 7239 1 1 2 PRO HA H -10.835 6.380 7.037 1.00 . A A . 2 PRO HA 1 1 9 7240 1 1 2 PRO HB2 H -13.293 6.163 8.206 1.00 . A A . 2 PRO HB2 1 1 9 7241 1 1 2 PRO HB3 H -11.817 5.482 8.898 1.00 . A A . 2 PRO HB3 1 1 9 7242 1 1 2 PRO HD2 H -11.273 9.162 10.007 1.00 . A A . 2 PRO HD2 1 1 9 7243 1 1 2 PRO HD3 H -10.359 7.669 10.306 1.00 . A A . 2 PRO HD3 1 1 9 7244 1 1 2 PRO HG2 H -13.235 8.024 9.584 1.00 . A A . 2 PRO HG2 1 1 9 7245 1 1 2 PRO HG3 H -12.477 6.833 10.658 1.00 . A A . 2 PRO HG3 1 1 9 7246 1 1 2 PRO N N -10.719 8.094 8.266 1.00 . A A . 2 PRO N 1 1 9 7247 1 1 2 PRO O O -12.802 7.065 5.510 1.00 . A A . 2 PRO O 1 1 9 7248 1 1 3 LEU C C -12.842 10.028 4.428 1.00 . A A . 3 LEU C 1 1 9 7249 1 1 3 LEU CA C -13.596 9.703 5.708 1.00 . A A . 3 LEU CA 1 1 9 7250 1 1 3 LEU CB C -14.140 10.986 6.336 1.00 . A A . 3 LEU CB 1 1 9 7251 1 1 3 LEU CD1 C -15.314 12.130 8.231 1.00 . A A . 3 LEU CD1 1 1 9 7252 1 1 3 LEU CD2 C -16.161 9.937 7.379 1.00 . A A . 3 LEU CD2 1 1 9 7253 1 1 3 LEU CG C -14.928 10.789 7.631 1.00 . A A . 3 LEU CG 1 1 9 7254 1 1 3 LEU H H -12.363 9.489 7.420 1.00 . A A . 3 LEU H 1 1 9 7255 1 1 3 LEU HA H -14.424 9.050 5.471 1.00 . A A . 3 LEU HA 1 1 9 7256 1 1 3 LEU HB2 H -13.306 11.639 6.543 1.00 . A A . 3 LEU HB2 1 1 9 7257 1 1 3 LEU HB3 H -14.785 11.469 5.618 1.00 . A A . 3 LEU HB3 1 1 9 7258 1 1 3 LEU HD11 H -14.748 12.296 9.135 1.00 . A A . 3 LEU HD11 1 1 9 7259 1 1 3 LEU HD12 H -15.100 12.917 7.522 1.00 . A A . 3 LEU HD12 1 1 9 7260 1 1 3 LEU HD13 H -16.371 12.132 8.460 1.00 . A A . 3 LEU HD13 1 1 9 7261 1 1 3 LEU HD21 H -16.469 9.469 8.302 1.00 . A A . 3 LEU HD21 1 1 9 7262 1 1 3 LEU HD22 H -16.961 10.563 7.010 1.00 . A A . 3 LEU HD22 1 1 9 7263 1 1 3 LEU HD23 H -15.932 9.177 6.648 1.00 . A A . 3 LEU HD23 1 1 9 7264 1 1 3 LEU HG H -14.305 10.272 8.347 1.00 . A A . 3 LEU HG 1 1 9 7265 1 1 3 LEU N N -12.730 9.000 6.648 1.00 . A A . 3 LEU N 1 1 9 7266 1 1 3 LEU O O -11.685 10.451 4.469 1.00 . A A . 3 LEU O 1 1 9 7267 1 1 4 GLY C C -11.915 8.822 1.625 1.00 . A A . 4 GLY C 1 1 9 7268 1 1 4 GLY CA C -12.824 9.971 2.013 1.00 . A A . 4 GLY CA 1 1 9 7269 1 1 4 GLY H H -14.365 9.350 3.328 1.00 . A A . 4 GLY H 1 1 9 7270 1 1 4 GLY HA2 H -13.586 10.088 1.256 1.00 . A A . 4 GLY HA2 1 1 9 7271 1 1 4 GLY HA3 H -12.239 10.878 2.063 1.00 . A A . 4 GLY HA3 1 1 9 7272 1 1 4 GLY N N -13.466 9.750 3.295 1.00 . A A . 4 GLY N 1 1 9 7273 1 1 4 GLY O O -12.073 8.224 0.561 1.00 . A A . 4 GLY O 1 1 9 7274 1 1 5 SER C C -10.746 6.031 2.309 1.00 . A A . 5 SER C 1 1 9 7275 1 1 5 SER CA C -10.049 7.393 2.271 1.00 . A A . 5 SER CA 1 1 9 7276 1 1 5 SER CB C -8.924 7.452 3.304 1.00 . A A . 5 SER CB 1 1 9 7277 1 1 5 SER H H -10.930 8.980 3.356 1.00 . A A . 5 SER H 1 1 9 7278 1 1 5 SER HA H -9.625 7.535 1.288 1.00 . A A . 5 SER HA 1 1 9 7279 1 1 5 SER HB2 H -9.278 7.059 4.246 1.00 . A A . 5 SER HB2 1 1 9 7280 1 1 5 SER HB3 H -8.086 6.865 2.957 1.00 . A A . 5 SER HB3 1 1 9 7281 1 1 5 SER HG H -8.273 9.185 2.639 1.00 . A A . 5 SER HG 1 1 9 7282 1 1 5 SER N N -10.987 8.482 2.511 1.00 . A A . 5 SER N 1 1 9 7283 1 1 5 SER O O -10.146 5.007 1.975 1.00 . A A . 5 SER O 1 1 9 7284 1 1 5 SER OG O -8.496 8.793 3.499 1.00 . A A . 5 SER OG 1 1 9 7285 1 1 6 ASP C C -12.974 4.279 1.218 1.00 . A A . 6 ASP C 1 1 9 7286 1 1 6 ASP CA C -12.837 4.819 2.638 1.00 . A A . 6 ASP CA 1 1 9 7287 1 1 6 ASP CB C -14.220 5.096 3.236 1.00 . A A . 6 ASP CB 1 1 9 7288 1 1 6 ASP CG C -15.145 3.894 3.183 1.00 . A A . 6 ASP CG 1 1 9 7289 1 1 6 ASP H H -12.467 6.890 2.848 1.00 . A A . 6 ASP H 1 1 9 7290 1 1 6 ASP HA H -12.329 4.085 3.245 1.00 . A A . 6 ASP HA 1 1 9 7291 1 1 6 ASP HB2 H -14.105 5.386 4.268 1.00 . A A . 6 ASP HB2 1 1 9 7292 1 1 6 ASP HB3 H -14.683 5.906 2.689 1.00 . A A . 6 ASP HB3 1 1 9 7293 1 1 6 ASP N N -12.034 6.036 2.642 1.00 . A A . 6 ASP N 1 1 9 7294 1 1 6 ASP O O -12.940 3.072 0.993 1.00 . A A . 6 ASP O 1 1 9 7295 1 1 6 ASP OD1 O -14.689 2.767 3.466 1.00 . A A . 6 ASP OD1 1 1 9 7296 1 1 6 ASP OD2 O -16.342 4.076 2.871 1.00 . A A . 6 ASP OD2 1 1 9 7297 1 1 7 HIS C C -11.651 4.508 -1.639 1.00 . A A . 7 HIS C 1 1 9 7298 1 1 7 HIS CA C -13.061 4.814 -1.149 1.00 . A A . 7 HIS CA 1 1 9 7299 1 1 7 HIS CB C -13.676 5.938 -1.987 1.00 . A A . 7 HIS CB 1 1 9 7300 1 1 7 HIS CD2 C -14.200 4.454 -4.035 1.00 . A A . 7 HIS CD2 1 1 9 7301 1 1 7 HIS CE1 C -16.120 5.346 -4.539 1.00 . A A . 7 HIS CE1 1 1 9 7302 1 1 7 HIS CG C -14.477 5.448 -3.155 1.00 . A A . 7 HIS CG 1 1 9 7303 1 1 7 HIS H H -12.983 6.140 0.498 1.00 . A A . 7 HIS H 1 1 9 7304 1 1 7 HIS HA H -13.668 3.927 -1.245 1.00 . A A . 7 HIS HA 1 1 9 7305 1 1 7 HIS HB2 H -14.328 6.528 -1.361 1.00 . A A . 7 HIS HB2 1 1 9 7306 1 1 7 HIS HB3 H -12.885 6.569 -2.366 1.00 . A A . 7 HIS HB3 1 1 9 7307 1 1 7 HIS HD2 H -13.323 3.822 -4.044 1.00 . A A . 7 HIS HD2 1 1 9 7308 1 1 7 HIS HE1 H -17.053 5.548 -5.044 1.00 . A A . 7 HIS HE1 1 1 9 7309 1 1 7 HIS HE2 H -15.268 3.895 -5.760 1.00 . A A . 7 HIS HE2 1 1 9 7310 1 1 7 HIS N N -13.027 5.190 0.256 1.00 . A A . 7 HIS N 1 1 9 7311 1 1 7 HIS ND1 N -15.688 6.006 -3.477 1.00 . A A . 7 HIS ND1 1 1 9 7312 1 1 7 HIS NE2 N -15.251 4.397 -4.910 1.00 . A A . 7 HIS NE2 1 1 9 7313 1 1 7 HIS O O -11.346 3.375 -2.021 1.00 . A A . 7 HIS O 1 1 9 7314 1 1 8 HIS C C -8.562 6.443 -1.244 1.00 . A A . 8 HIS C 1 1 9 7315 1 1 8 HIS CA C -9.385 5.369 -1.938 1.00 . A A . 8 HIS CA 1 1 9 7316 1 1 8 HIS CB C -9.212 5.472 -3.461 1.00 . A A . 8 HIS CB 1 1 9 7317 1 1 8 HIS CD2 C -9.969 7.875 -4.035 1.00 . A A . 8 HIS CD2 1 1 9 7318 1 1 8 HIS CE1 C -11.643 7.337 -5.322 1.00 . A A . 8 HIS CE1 1 1 9 7319 1 1 8 HIS CG C -10.059 6.525 -4.113 1.00 . A A . 8 HIS CG 1 1 9 7320 1 1 8 HIS H H -11.085 6.366 -1.181 1.00 . A A . 8 HIS H 1 1 9 7321 1 1 8 HIS HA H -9.047 4.398 -1.606 1.00 . A A . 8 HIS HA 1 1 9 7322 1 1 8 HIS HB2 H -8.180 5.699 -3.683 1.00 . A A . 8 HIS HB2 1 1 9 7323 1 1 8 HIS HB3 H -9.465 4.519 -3.906 1.00 . A A . 8 HIS HB3 1 1 9 7324 1 1 8 HIS HD2 H -9.242 8.443 -3.476 1.00 . A A . 8 HIS HD2 1 1 9 7325 1 1 8 HIS HE1 H -12.497 7.419 -5.981 1.00 . A A . 8 HIS HE1 1 1 9 7326 1 1 8 HIS HE2 H -11.059 9.319 -5.115 1.00 . A A . 8 HIS HE2 1 1 9 7327 1 1 8 HIS N N -10.784 5.509 -1.555 1.00 . A A . 8 HIS N 1 1 9 7328 1 1 8 HIS ND1 N -11.116 6.192 -4.925 1.00 . A A . 8 HIS ND1 1 1 9 7329 1 1 8 HIS NE2 N -10.982 8.384 -4.808 1.00 . A A . 8 HIS NE2 1 1 9 7330 1 1 8 HIS O O -9.121 7.400 -0.706 1.00 . A A . 8 HIS O 1 1 9 7331 1 1 9 MET C C -5.060 7.408 -1.361 1.00 . A A . 9 MET C 1 1 9 7332 1 1 9 MET CA C -6.374 7.253 -0.596 1.00 . A A . 9 MET CA 1 1 9 7333 1 1 9 MET CB C -6.115 6.845 0.862 1.00 . A A . 9 MET CB 1 1 9 7334 1 1 9 MET CE C -6.895 3.857 2.215 1.00 . A A . 9 MET CE 1 1 9 7335 1 1 9 MET CG C -5.170 5.667 1.030 1.00 . A A . 9 MET CG 1 1 9 7336 1 1 9 MET H H -6.851 5.506 -1.690 1.00 . A A . 9 MET H 1 1 9 7337 1 1 9 MET HA H -6.886 8.204 -0.603 1.00 . A A . 9 MET HA 1 1 9 7338 1 1 9 MET HB2 H -5.694 7.690 1.387 1.00 . A A . 9 MET HB2 1 1 9 7339 1 1 9 MET HB3 H -7.059 6.588 1.320 1.00 . A A . 9 MET HB3 1 1 9 7340 1 1 9 MET HE1 H -7.353 2.878 2.213 1.00 . A A . 9 MET HE1 1 1 9 7341 1 1 9 MET HE2 H -6.236 3.944 3.065 1.00 . A A . 9 MET HE2 1 1 9 7342 1 1 9 MET HE3 H -7.664 4.614 2.277 1.00 . A A . 9 MET HE3 1 1 9 7343 1 1 9 MET HG2 H -4.347 5.788 0.344 1.00 . A A . 9 MET HG2 1 1 9 7344 1 1 9 MET HG3 H -4.794 5.668 2.043 1.00 . A A . 9 MET HG3 1 1 9 7345 1 1 9 MET N N -7.246 6.288 -1.245 1.00 . A A . 9 MET N 1 1 9 7346 1 1 9 MET O O -4.502 6.433 -1.874 1.00 . A A . 9 MET O 1 1 9 7347 1 1 9 MET SD S -5.958 4.079 0.705 1.00 . A A . 9 MET SD 1 1 9 7348 1 1 10 GLU C C -2.151 8.898 -1.258 1.00 . A A . 10 GLU C 1 1 9 7349 1 1 10 GLU CA C -3.365 8.977 -2.179 1.00 . A A . 10 GLU CA 1 1 9 7350 1 1 10 GLU CB C -3.455 10.384 -2.796 1.00 . A A . 10 GLU CB 1 1 9 7351 1 1 10 GLU CD C -4.867 11.520 -1.019 1.00 . A A . 10 GLU CD 1 1 9 7352 1 1 10 GLU CG C -4.746 11.131 -2.480 1.00 . A A . 10 GLU CG 1 1 9 7353 1 1 10 GLU H H -5.105 9.375 -1.036 1.00 . A A . 10 GLU H 1 1 9 7354 1 1 10 GLU HA H -3.245 8.253 -2.973 1.00 . A A . 10 GLU HA 1 1 9 7355 1 1 10 GLU HB2 H -2.628 10.975 -2.431 1.00 . A A . 10 GLU HB2 1 1 9 7356 1 1 10 GLU HB3 H -3.371 10.298 -3.870 1.00 . A A . 10 GLU HB3 1 1 9 7357 1 1 10 GLU HG2 H -4.783 12.029 -3.078 1.00 . A A . 10 GLU HG2 1 1 9 7358 1 1 10 GLU HG3 H -5.581 10.496 -2.737 1.00 . A A . 10 GLU HG3 1 1 9 7359 1 1 10 GLU N N -4.594 8.647 -1.454 1.00 . A A . 10 GLU N 1 1 9 7360 1 1 10 GLU O O -1.227 9.708 -1.350 1.00 . A A . 10 GLU O 1 1 9 7361 1 1 10 GLU OE1 O -4.014 12.284 -0.527 1.00 . A A . 10 GLU OE1 1 1 9 7362 1 1 10 GLU OE2 O -5.818 11.049 -0.357 1.00 . A A . 10 GLU OE2 1 1 9 7363 1 1 11 PHE C C -1.161 6.305 1.120 1.00 . A A . 11 PHE C 1 1 9 7364 1 1 11 PHE CA C -1.088 7.718 0.582 1.00 . A A . 11 PHE CA 1 1 9 7365 1 1 11 PHE CB C -1.155 8.740 1.727 1.00 . A A . 11 PHE CB 1 1 9 7366 1 1 11 PHE CD1 C -3.492 9.624 1.995 1.00 . A A . 11 PHE CD1 1 1 9 7367 1 1 11 PHE CD2 C -2.697 8.023 3.573 1.00 . A A . 11 PHE CD2 1 1 9 7368 1 1 11 PHE CE1 C -4.703 9.680 2.656 1.00 . A A . 11 PHE CE1 1 1 9 7369 1 1 11 PHE CE2 C -3.905 8.076 4.238 1.00 . A A . 11 PHE CE2 1 1 9 7370 1 1 11 PHE CG C -2.475 8.794 2.444 1.00 . A A . 11 PHE CG 1 1 9 7371 1 1 11 PHE CZ C -4.910 8.906 3.779 1.00 . A A . 11 PHE CZ 1 1 9 7372 1 1 11 PHE H H -2.932 7.307 -0.353 1.00 . A A . 11 PHE H 1 1 9 7373 1 1 11 PHE HA H -0.148 7.834 0.062 1.00 . A A . 11 PHE HA 1 1 9 7374 1 1 11 PHE HB2 H -0.398 8.497 2.455 1.00 . A A . 11 PHE HB2 1 1 9 7375 1 1 11 PHE HB3 H -0.955 9.723 1.325 1.00 . A A . 11 PHE HB3 1 1 9 7376 1 1 11 PHE HD1 H -3.331 10.231 1.116 1.00 . A A . 11 PHE HD1 1 1 9 7377 1 1 11 PHE HD2 H -1.913 7.374 3.935 1.00 . A A . 11 PHE HD2 1 1 9 7378 1 1 11 PHE HE1 H -5.488 10.329 2.295 1.00 . A A . 11 PHE HE1 1 1 9 7379 1 1 11 PHE HE2 H -4.066 7.471 5.118 1.00 . A A . 11 PHE HE2 1 1 9 7380 1 1 11 PHE HZ H -5.855 8.949 4.299 1.00 . A A . 11 PHE HZ 1 1 9 7381 1 1 11 PHE N N -2.168 7.923 -0.367 1.00 . A A . 11 PHE N 1 1 9 7382 1 1 11 PHE O O -2.150 5.606 0.913 1.00 . A A . 11 PHE O 1 1 9 7383 1 1 12 CYS C C -0.833 4.567 3.707 1.00 . A A . 12 CYS C 1 1 9 7384 1 1 12 CYS CA C -0.109 4.553 2.369 1.00 . A A . 12 CYS CA 1 1 9 7385 1 1 12 CYS CB C 1.328 4.040 2.495 1.00 . A A . 12 CYS CB 1 1 9 7386 1 1 12 CYS H H 0.637 6.487 1.961 1.00 . A A . 12 CYS H 1 1 9 7387 1 1 12 CYS HA H -0.652 3.906 1.694 1.00 . A A . 12 CYS HA 1 1 9 7388 1 1 12 CYS HB2 H 1.434 3.149 1.897 1.00 . A A . 12 CYS HB2 1 1 9 7389 1 1 12 CYS HB3 H 2.002 4.798 2.121 1.00 . A A . 12 CYS HB3 1 1 9 7390 1 1 12 CYS HG H 2.539 4.680 4.622 1.00 . A A . 12 CYS HG 1 1 9 7391 1 1 12 CYS N N -0.122 5.880 1.804 1.00 . A A . 12 CYS N 1 1 9 7392 1 1 12 CYS O O -0.541 5.398 4.567 1.00 . A A . 12 CYS O 1 1 9 7393 1 1 12 CYS SG S 1.841 3.634 4.173 1.00 . A A . 12 CYS SG 1 1 9 7394 1 1 13 ARG C C -2.048 3.511 6.268 1.00 . A A . 13 ARG C 1 1 9 7395 1 1 13 ARG CA C -2.784 3.788 4.959 1.00 . A A . 13 ARG CA 1 1 9 7396 1 1 13 ARG CB C -3.911 2.766 4.774 1.00 . A A . 13 ARG CB 1 1 9 7397 1 1 13 ARG CD C -4.361 0.302 4.596 1.00 . A A . 13 ARG CD 1 1 9 7398 1 1 13 ARG CG C -3.450 1.445 4.183 1.00 . A A . 13 ARG CG 1 1 9 7399 1 1 13 ARG CZ C -6.273 0.016 3.050 1.00 . A A . 13 ARG CZ 1 1 9 7400 1 1 13 ARG H H -2.148 3.237 3.015 1.00 . A A . 13 ARG H 1 1 9 7401 1 1 13 ARG HA H -3.222 4.773 5.015 1.00 . A A . 13 ARG HA 1 1 9 7402 1 1 13 ARG HB2 H -4.360 2.566 5.736 1.00 . A A . 13 ARG HB2 1 1 9 7403 1 1 13 ARG HB3 H -4.658 3.187 4.120 1.00 . A A . 13 ARG HB3 1 1 9 7404 1 1 13 ARG HD2 H -3.996 -0.612 4.151 1.00 . A A . 13 ARG HD2 1 1 9 7405 1 1 13 ARG HD3 H -4.337 0.211 5.673 1.00 . A A . 13 ARG HD3 1 1 9 7406 1 1 13 ARG HE H -6.313 1.074 4.756 1.00 . A A . 13 ARG HE 1 1 9 7407 1 1 13 ARG HG2 H -3.450 1.522 3.106 1.00 . A A . 13 ARG HG2 1 1 9 7408 1 1 13 ARG HG3 H -2.448 1.238 4.531 1.00 . A A . 13 ARG HG3 1 1 9 7409 1 1 13 ARG HH11 H -4.599 -0.989 2.500 1.00 . A A . 13 ARG HH11 1 1 9 7410 1 1 13 ARG HH12 H -5.950 -1.148 1.416 1.00 . A A . 13 ARG HH12 1 1 9 7411 1 1 13 ARG HH21 H -8.100 0.849 3.344 1.00 . A A . 13 ARG HH21 1 1 9 7412 1 1 13 ARG HH22 H -7.929 -0.087 1.879 1.00 . A A . 13 ARG HH22 1 1 9 7413 1 1 13 ARG N N -1.889 3.767 3.800 1.00 . A A . 13 ARG N 1 1 9 7414 1 1 13 ARG NE N -5.745 0.517 4.169 1.00 . A A . 13 ARG NE 1 1 9 7415 1 1 13 ARG NH1 N -5.550 -0.767 2.261 1.00 . A A . 13 ARG NH1 1 1 9 7416 1 1 13 ARG NH2 N -7.533 0.276 2.737 1.00 . A A . 13 ARG NH2 1 1 9 7417 1 1 13 ARG O O -2.495 3.924 7.333 1.00 . A A . 13 ARG O 1 1 9 7418 1 1 14 VAL C C 0.431 3.648 8.070 1.00 . A A . 14 VAL C 1 1 9 7419 1 1 14 VAL CA C -0.181 2.426 7.380 1.00 . A A . 14 VAL CA 1 1 9 7420 1 1 14 VAL CB C 0.930 1.414 7.045 1.00 . A A . 14 VAL CB 1 1 9 7421 1 1 14 VAL CG1 C 1.598 0.920 8.317 1.00 . A A . 14 VAL CG1 1 1 9 7422 1 1 14 VAL CG2 C 0.365 0.247 6.249 1.00 . A A . 14 VAL CG2 1 1 9 7423 1 1 14 VAL H H -0.633 2.480 5.316 1.00 . A A . 14 VAL H 1 1 9 7424 1 1 14 VAL HA H -0.865 1.951 8.068 1.00 . A A . 14 VAL HA 1 1 9 7425 1 1 14 VAL HB H 1.676 1.909 6.441 1.00 . A A . 14 VAL HB 1 1 9 7426 1 1 14 VAL HG11 H 2.079 1.747 8.815 1.00 . A A . 14 VAL HG11 1 1 9 7427 1 1 14 VAL HG12 H 0.853 0.491 8.970 1.00 . A A . 14 VAL HG12 1 1 9 7428 1 1 14 VAL HG13 H 2.336 0.168 8.068 1.00 . A A . 14 VAL HG13 1 1 9 7429 1 1 14 VAL HG21 H -0.695 0.391 6.101 1.00 . A A . 14 VAL HG21 1 1 9 7430 1 1 14 VAL HG22 H 0.858 0.191 5.290 1.00 . A A . 14 VAL HG22 1 1 9 7431 1 1 14 VAL HG23 H 0.531 -0.673 6.793 1.00 . A A . 14 VAL HG23 1 1 9 7432 1 1 14 VAL N N -0.936 2.795 6.189 1.00 . A A . 14 VAL N 1 1 9 7433 1 1 14 VAL O O -0.006 4.043 9.150 1.00 . A A . 14 VAL O 1 1 9 7434 1 1 15 CYS C C 1.509 6.659 7.789 1.00 . A A . 15 CYS C 1 1 9 7435 1 1 15 CYS CA C 2.196 5.326 8.086 1.00 . A A . 15 CYS CA 1 1 9 7436 1 1 15 CYS CB C 3.651 5.350 7.602 1.00 . A A . 15 CYS CB 1 1 9 7437 1 1 15 CYS H H 1.824 3.816 6.651 1.00 . A A . 15 CYS H 1 1 9 7438 1 1 15 CYS HA H 2.191 5.168 9.154 1.00 . A A . 15 CYS HA 1 1 9 7439 1 1 15 CYS HB2 H 4.245 5.918 8.301 1.00 . A A . 15 CYS HB2 1 1 9 7440 1 1 15 CYS HB3 H 4.025 4.336 7.567 1.00 . A A . 15 CYS HB3 1 1 9 7441 1 1 15 CYS N N 1.480 4.208 7.474 1.00 . A A . 15 CYS N 1 1 9 7442 1 1 15 CYS O O 1.891 7.698 8.334 1.00 . A A . 15 CYS O 1 1 9 7443 1 1 15 CYS SG S 3.894 6.085 5.955 1.00 . A A . 15 CYS SG 1 1 9 7444 1 1 16 LYS C C 0.484 8.724 5.615 1.00 . A A . 16 LYS C 1 1 9 7445 1 1 16 LYS CA C -0.300 7.780 6.529 1.00 . A A . 16 LYS CA 1 1 9 7446 1 1 16 LYS CB C -0.819 8.537 7.756 1.00 . A A . 16 LYS CB 1 1 9 7447 1 1 16 LYS CD C -3.079 7.446 7.912 1.00 . A A . 16 LYS CD 1 1 9 7448 1 1 16 LYS CE C -4.074 6.758 8.830 1.00 . A A . 16 LYS CE 1 1 9 7449 1 1 16 LYS CG C -1.766 7.720 8.623 1.00 . A A . 16 LYS CG 1 1 9 7450 1 1 16 LYS H H 0.252 5.735 6.545 1.00 . A A . 16 LYS H 1 1 9 7451 1 1 16 LYS HA H -1.151 7.413 5.973 1.00 . A A . 16 LYS HA 1 1 9 7452 1 1 16 LYS HB2 H 0.024 8.833 8.363 1.00 . A A . 16 LYS HB2 1 1 9 7453 1 1 16 LYS HB3 H -1.340 9.423 7.423 1.00 . A A . 16 LYS HB3 1 1 9 7454 1 1 16 LYS HD2 H -3.499 8.383 7.579 1.00 . A A . 16 LYS HD2 1 1 9 7455 1 1 16 LYS HD3 H -2.889 6.810 7.061 1.00 . A A . 16 LYS HD3 1 1 9 7456 1 1 16 LYS HE2 H -3.635 6.669 9.811 1.00 . A A . 16 LYS HE2 1 1 9 7457 1 1 16 LYS HE3 H -4.969 7.362 8.890 1.00 . A A . 16 LYS HE3 1 1 9 7458 1 1 16 LYS HG2 H -1.297 6.778 8.858 1.00 . A A . 16 LYS HG2 1 1 9 7459 1 1 16 LYS HG3 H -1.966 8.263 9.534 1.00 . A A . 16 LYS HG3 1 1 9 7460 1 1 16 LYS HZ1 H -5.128 4.955 8.985 1.00 . A A . 16 LYS HZ1 1 1 9 7461 1 1 16 LYS HZ2 H -3.590 4.802 8.286 1.00 . A A . 16 LYS HZ2 1 1 9 7462 1 1 16 LYS HZ3 H -4.862 5.469 7.391 1.00 . A A . 16 LYS HZ3 1 1 9 7463 1 1 16 LYS N N 0.494 6.606 6.923 1.00 . A A . 16 LYS N 1 1 9 7464 1 1 16 LYS NZ N -4.439 5.405 8.340 1.00 . A A . 16 LYS NZ 1 1 9 7465 1 1 16 LYS O O -0.040 9.747 5.169 1.00 . A A . 16 LYS O 1 1 9 7466 1 1 17 ASP C C 2.174 8.929 2.953 1.00 . A A . 17 ASP C 1 1 9 7467 1 1 17 ASP CA C 2.545 9.170 4.407 1.00 . A A . 17 ASP CA 1 1 9 7468 1 1 17 ASP CB C 4.024 8.856 4.606 1.00 . A A . 17 ASP CB 1 1 9 7469 1 1 17 ASP CG C 4.889 10.098 4.581 1.00 . A A . 17 ASP CG 1 1 9 7470 1 1 17 ASP H H 2.090 7.529 5.670 1.00 . A A . 17 ASP H 1 1 9 7471 1 1 17 ASP HA H 2.370 10.207 4.644 1.00 . A A . 17 ASP HA 1 1 9 7472 1 1 17 ASP HB2 H 4.156 8.358 5.556 1.00 . A A . 17 ASP HB2 1 1 9 7473 1 1 17 ASP HB3 H 4.351 8.197 3.815 1.00 . A A . 17 ASP HB3 1 1 9 7474 1 1 17 ASP N N 1.721 8.360 5.297 1.00 . A A . 17 ASP N 1 1 9 7475 1 1 17 ASP O O 1.773 7.821 2.578 1.00 . A A . 17 ASP O 1 1 9 7476 1 1 17 ASP OD1 O 4.521 11.071 3.891 1.00 . A A . 17 ASP OD1 1 1 9 7477 1 1 17 ASP OD2 O 5.945 10.107 5.247 1.00 . A A . 17 ASP OD2 1 1 9 7478 1 1 18 GLY C C 3.313 9.880 -0.121 1.00 . A A . 18 GLY C 1 1 9 7479 1 1 18 GLY CA C 2.061 9.851 0.725 1.00 . A A . 18 GLY CA 1 1 9 7480 1 1 18 GLY H H 2.725 10.793 2.495 1.00 . A A . 18 GLY H 1 1 9 7481 1 1 18 GLY HA2 H 1.534 8.924 0.540 1.00 . A A . 18 GLY HA2 1 1 9 7482 1 1 18 GLY HA3 H 1.428 10.679 0.435 1.00 . A A . 18 GLY HA3 1 1 9 7483 1 1 18 GLY N N 2.353 9.956 2.137 1.00 . A A . 18 GLY N 1 1 9 7484 1 1 18 GLY O O 4.171 9.001 -0.002 1.00 . A A . 18 GLY O 1 1 9 7485 1 1 19 GLY C C 4.504 9.987 -2.963 1.00 . A A . 19 GLY C 1 1 9 7486 1 1 19 GLY CA C 4.562 11.005 -1.844 1.00 . A A . 19 GLY CA 1 1 9 7487 1 1 19 GLY H H 2.709 11.574 -0.998 1.00 . A A . 19 GLY H 1 1 9 7488 1 1 19 GLY HA2 H 4.582 11.998 -2.269 1.00 . A A . 19 GLY HA2 1 1 9 7489 1 1 19 GLY HA3 H 5.463 10.847 -1.273 1.00 . A A . 19 GLY HA3 1 1 9 7490 1 1 19 GLY N N 3.422 10.894 -0.964 1.00 . A A . 19 GLY N 1 1 9 7491 1 1 19 GLY O O 3.445 9.773 -3.559 1.00 . A A . 19 GLY O 1 1 9 7492 1 1 20 GLU C C 5.363 6.913 -3.554 1.00 . A A . 20 GLU C 1 1 9 7493 1 1 20 GLU CA C 5.673 8.256 -4.198 1.00 . A A . 20 GLU CA 1 1 9 7494 1 1 20 GLU CB C 7.049 8.226 -4.863 1.00 . A A . 20 GLU CB 1 1 9 7495 1 1 20 GLU CD C 6.469 9.779 -6.769 1.00 . A A . 20 GLU CD 1 1 9 7496 1 1 20 GLU CG C 7.394 9.513 -5.599 1.00 . A A . 20 GLU CG 1 1 9 7497 1 1 20 GLU H H 6.408 9.489 -2.640 1.00 . A A . 20 GLU H 1 1 9 7498 1 1 20 GLU HA H 4.922 8.467 -4.946 1.00 . A A . 20 GLU HA 1 1 9 7499 1 1 20 GLU HB2 H 7.800 8.059 -4.105 1.00 . A A . 20 GLU HB2 1 1 9 7500 1 1 20 GLU HB3 H 7.076 7.414 -5.573 1.00 . A A . 20 GLU HB3 1 1 9 7501 1 1 20 GLU HG2 H 7.320 10.338 -4.905 1.00 . A A . 20 GLU HG2 1 1 9 7502 1 1 20 GLU HG3 H 8.407 9.444 -5.967 1.00 . A A . 20 GLU HG3 1 1 9 7503 1 1 20 GLU N N 5.613 9.309 -3.197 1.00 . A A . 20 GLU N 1 1 9 7504 1 1 20 GLU O O 5.984 6.532 -2.559 1.00 . A A . 20 GLU O 1 1 9 7505 1 1 20 GLU OE1 O 6.711 9.228 -7.861 1.00 . A A . 20 GLU OE1 1 1 9 7506 1 1 20 GLU OE2 O 5.485 10.529 -6.602 1.00 . A A . 20 GLU OE2 1 1 9 7507 1 1 21 LEU C C 3.717 3.906 -4.463 1.00 . A A . 21 LEU C 1 1 9 7508 1 1 21 LEU CA C 3.860 5.021 -3.437 1.00 . A A . 21 LEU CA 1 1 9 7509 1 1 21 LEU CB C 2.509 5.251 -2.752 1.00 . A A . 21 LEU CB 1 1 9 7510 1 1 21 LEU CD1 C 1.190 7.380 -2.618 1.00 . A A . 21 LEU CD1 1 1 9 7511 1 1 21 LEU CD2 C 2.181 6.381 -0.548 1.00 . A A . 21 LEU CD2 1 1 9 7512 1 1 21 LEU CG C 2.358 6.596 -2.041 1.00 . A A . 21 LEU CG 1 1 9 7513 1 1 21 LEU H H 3.819 6.639 -4.793 1.00 . A A . 21 LEU H 1 1 9 7514 1 1 21 LEU HA H 4.584 4.722 -2.694 1.00 . A A . 21 LEU HA 1 1 9 7515 1 1 21 LEU HB2 H 1.734 5.174 -3.501 1.00 . A A . 21 LEU HB2 1 1 9 7516 1 1 21 LEU HB3 H 2.361 4.467 -2.025 1.00 . A A . 21 LEU HB3 1 1 9 7517 1 1 21 LEU HD11 H 1.196 7.296 -3.694 1.00 . A A . 21 LEU HD11 1 1 9 7518 1 1 21 LEU HD12 H 0.263 6.984 -2.232 1.00 . A A . 21 LEU HD12 1 1 9 7519 1 1 21 LEU HD13 H 1.281 8.421 -2.337 1.00 . A A . 21 LEU HD13 1 1 9 7520 1 1 21 LEU HD21 H 1.137 6.209 -0.328 1.00 . A A . 21 LEU HD21 1 1 9 7521 1 1 21 LEU HD22 H 2.761 5.525 -0.237 1.00 . A A . 21 LEU HD22 1 1 9 7522 1 1 21 LEU HD23 H 2.521 7.258 -0.017 1.00 . A A . 21 LEU HD23 1 1 9 7523 1 1 21 LEU HG H 3.256 7.179 -2.191 1.00 . A A . 21 LEU HG 1 1 9 7524 1 1 21 LEU N N 4.327 6.253 -4.049 1.00 . A A . 21 LEU N 1 1 9 7525 1 1 21 LEU O O 3.609 4.161 -5.664 1.00 . A A . 21 LEU O 1 1 9 7526 1 1 22 LEU C C 1.821 1.131 -4.501 1.00 . A A . 22 LEU C 1 1 9 7527 1 1 22 LEU CA C 3.264 1.539 -4.779 1.00 . A A . 22 LEU CA 1 1 9 7528 1 1 22 LEU CB C 4.241 0.388 -4.479 1.00 . A A . 22 LEU CB 1 1 9 7529 1 1 22 LEU CD1 C 3.716 -1.767 -5.649 1.00 . A A . 22 LEU CD1 1 1 9 7530 1 1 22 LEU CD2 C 4.306 -1.775 -3.223 1.00 . A A . 22 LEU CD2 1 1 9 7531 1 1 22 LEU CG C 3.620 -1.004 -4.339 1.00 . A A . 22 LEU CG 1 1 9 7532 1 1 22 LEU H H 3.564 2.588 -2.981 1.00 . A A . 22 LEU H 1 1 9 7533 1 1 22 LEU HA H 3.358 1.828 -5.816 1.00 . A A . 22 LEU HA 1 1 9 7534 1 1 22 LEU HB2 H 4.970 0.350 -5.276 1.00 . A A . 22 LEU HB2 1 1 9 7535 1 1 22 LEU HB3 H 4.758 0.619 -3.558 1.00 . A A . 22 LEU HB3 1 1 9 7536 1 1 22 LEU HD11 H 4.330 -2.645 -5.510 1.00 . A A . 22 LEU HD11 1 1 9 7537 1 1 22 LEU HD12 H 2.728 -2.063 -5.967 1.00 . A A . 22 LEU HD12 1 1 9 7538 1 1 22 LEU HD13 H 4.159 -1.132 -6.401 1.00 . A A . 22 LEU HD13 1 1 9 7539 1 1 22 LEU HD21 H 3.783 -1.612 -2.295 1.00 . A A . 22 LEU HD21 1 1 9 7540 1 1 22 LEU HD22 H 4.298 -2.831 -3.459 1.00 . A A . 22 LEU HD22 1 1 9 7541 1 1 22 LEU HD23 H 5.327 -1.437 -3.126 1.00 . A A . 22 LEU HD23 1 1 9 7542 1 1 22 LEU HG H 2.574 -0.904 -4.084 1.00 . A A . 22 LEU HG 1 1 9 7543 1 1 22 LEU N N 3.577 2.692 -3.958 1.00 . A A . 22 LEU N 1 1 9 7544 1 1 22 LEU O O 1.442 0.929 -3.348 1.00 . A A . 22 LEU O 1 1 9 7545 1 1 23 CYS C C -0.835 -0.425 -5.561 1.00 . A A . 23 CYS C 1 1 9 7546 1 1 23 CYS CA C -0.443 1.029 -5.335 1.00 . A A . 23 CYS CA 1 1 9 7547 1 1 23 CYS CB C -1.220 1.932 -6.295 1.00 . A A . 23 CYS CB 1 1 9 7548 1 1 23 CYS H H 1.323 1.538 -6.385 1.00 . A A . 23 CYS H 1 1 9 7549 1 1 23 CYS HA H -0.690 1.303 -4.321 1.00 . A A . 23 CYS HA 1 1 9 7550 1 1 23 CYS HB2 H -1.210 1.491 -7.281 1.00 . A A . 23 CYS HB2 1 1 9 7551 1 1 23 CYS HB3 H -2.242 2.013 -5.954 1.00 . A A . 23 CYS HB3 1 1 9 7552 1 1 23 CYS HG H -1.020 4.139 -7.559 1.00 . A A . 23 CYS HG 1 1 9 7553 1 1 23 CYS N N 0.987 1.227 -5.514 1.00 . A A . 23 CYS N 1 1 9 7554 1 1 23 CYS O O -0.158 -1.152 -6.296 1.00 . A A . 23 CYS O 1 1 9 7555 1 1 23 CYS SG S -0.552 3.606 -6.435 1.00 . A A . 23 CYS SG 1 1 9 7556 1 1 24 CYS C C -2.643 -2.568 -6.529 1.00 . A A . 24 CYS C 1 1 9 7557 1 1 24 CYS CA C -2.462 -2.177 -5.067 1.00 . A A . 24 CYS CA 1 1 9 7558 1 1 24 CYS CB C -3.820 -2.257 -4.384 1.00 . A A . 24 CYS CB 1 1 9 7559 1 1 24 CYS H H -2.398 -0.210 -4.331 1.00 . A A . 24 CYS H 1 1 9 7560 1 1 24 CYS HA H -1.782 -2.867 -4.592 1.00 . A A . 24 CYS HA 1 1 9 7561 1 1 24 CYS HB2 H -4.503 -1.593 -4.890 1.00 . A A . 24 CYS HB2 1 1 9 7562 1 1 24 CYS HB3 H -4.191 -3.269 -4.464 1.00 . A A . 24 CYS HB3 1 1 9 7563 1 1 24 CYS N N -1.932 -0.834 -4.927 1.00 . A A . 24 CYS N 1 1 9 7564 1 1 24 CYS O O -2.906 -1.722 -7.390 1.00 . A A . 24 CYS O 1 1 9 7565 1 1 24 CYS SG S -3.829 -1.808 -2.624 1.00 . A A . 24 CYS SG 1 1 9 7566 1 1 25 ASP C C -4.553 -4.699 -8.098 1.00 . A A . 25 ASP C 1 1 9 7567 1 1 25 ASP CA C -3.069 -4.376 -8.076 1.00 . A A . 25 ASP CA 1 1 9 7568 1 1 25 ASP CB C -2.263 -5.628 -8.420 1.00 . A A . 25 ASP CB 1 1 9 7569 1 1 25 ASP CG C -2.092 -5.807 -9.914 1.00 . A A . 25 ASP CG 1 1 9 7570 1 1 25 ASP H H -2.621 -4.490 -6.013 1.00 . A A . 25 ASP H 1 1 9 7571 1 1 25 ASP HA H -2.865 -3.607 -8.808 1.00 . A A . 25 ASP HA 1 1 9 7572 1 1 25 ASP HB2 H -1.286 -5.556 -7.968 1.00 . A A . 25 ASP HB2 1 1 9 7573 1 1 25 ASP HB3 H -2.774 -6.495 -8.027 1.00 . A A . 25 ASP HB3 1 1 9 7574 1 1 25 ASP N N -2.705 -3.865 -6.765 1.00 . A A . 25 ASP N 1 1 9 7575 1 1 25 ASP O O -5.127 -5.000 -9.144 1.00 . A A . 25 ASP O 1 1 9 7576 1 1 25 ASP OD1 O -1.993 -4.789 -10.633 1.00 . A A . 25 ASP OD1 1 1 9 7577 1 1 25 ASP OD2 O -2.057 -6.968 -10.378 1.00 . A A . 25 ASP OD2 1 1 9 7578 1 1 26 THR C C -7.354 -3.789 -6.253 1.00 . A A . 26 THR C 1 1 9 7579 1 1 26 THR CA C -6.566 -4.985 -6.775 1.00 . A A . 26 THR CA 1 1 9 7580 1 1 26 THR CB C -6.746 -6.175 -5.810 1.00 . A A . 26 THR CB 1 1 9 7581 1 1 26 THR CG2 C -6.423 -7.488 -6.507 1.00 . A A . 26 THR CG2 1 1 9 7582 1 1 26 THR H H -4.644 -4.427 -6.124 1.00 . A A . 26 THR H 1 1 9 7583 1 1 26 THR HA H -6.951 -5.268 -7.744 1.00 . A A . 26 THR HA 1 1 9 7584 1 1 26 THR HB H -7.774 -6.202 -5.481 1.00 . A A . 26 THR HB 1 1 9 7585 1 1 26 THR HG1 H -6.332 -5.483 -3.993 1.00 . A A . 26 THR HG1 1 1 9 7586 1 1 26 THR HG21 H -5.823 -7.292 -7.384 1.00 . A A . 26 THR HG21 1 1 9 7587 1 1 26 THR HG22 H -7.341 -7.976 -6.798 1.00 . A A . 26 THR HG22 1 1 9 7588 1 1 26 THR HG23 H -5.876 -8.128 -5.830 1.00 . A A . 26 THR HG23 1 1 9 7589 1 1 26 THR N N -5.161 -4.658 -6.923 1.00 . A A . 26 THR N 1 1 9 7590 1 1 26 THR O O -8.236 -3.263 -6.933 1.00 . A A . 26 THR O 1 1 9 7591 1 1 26 THR OG1 O -5.884 -6.018 -4.668 1.00 . A A . 26 THR OG1 1 1 9 7592 1 1 27 CYS C C -7.232 -0.936 -4.835 1.00 . A A . 27 CYS C 1 1 9 7593 1 1 27 CYS CA C -7.737 -2.305 -4.365 1.00 . A A . 27 CYS CA 1 1 9 7594 1 1 27 CYS CB C -7.523 -2.489 -2.866 1.00 . A A . 27 CYS CB 1 1 9 7595 1 1 27 CYS H H -6.341 -3.860 -4.539 1.00 . A A . 27 CYS H 1 1 9 7596 1 1 27 CYS HA H -8.789 -2.392 -4.586 1.00 . A A . 27 CYS HA 1 1 9 7597 1 1 27 CYS HB2 H -6.884 -1.700 -2.501 1.00 . A A . 27 CYS HB2 1 1 9 7598 1 1 27 CYS HB3 H -8.476 -2.443 -2.360 1.00 . A A . 27 CYS HB3 1 1 9 7599 1 1 27 CYS N N -7.042 -3.385 -5.033 1.00 . A A . 27 CYS N 1 1 9 7600 1 1 27 CYS O O -6.218 -0.849 -5.527 1.00 . A A . 27 CYS O 1 1 9 7601 1 1 27 CYS SG S -6.741 -4.087 -2.451 1.00 . A A . 27 CYS SG 1 1 9 7602 1 1 28 PRO C C -6.742 2.210 -3.843 1.00 . A A . 28 PRO C 1 1 9 7603 1 1 28 PRO CA C -7.574 1.499 -4.911 1.00 . A A . 28 PRO CA 1 1 9 7604 1 1 28 PRO CB C -8.931 2.184 -5.096 1.00 . A A . 28 PRO CB 1 1 9 7605 1 1 28 PRO CD C -9.217 0.163 -3.762 1.00 . A A . 28 PRO CD 1 1 9 7606 1 1 28 PRO CG C -9.905 1.419 -4.243 1.00 . A A . 28 PRO CG 1 1 9 7607 1 1 28 PRO HA H -7.037 1.497 -5.846 1.00 . A A . 28 PRO HA 1 1 9 7608 1 1 28 PRO HB2 H -8.858 3.213 -4.776 1.00 . A A . 28 PRO HB2 1 1 9 7609 1 1 28 PRO HB3 H -9.211 2.149 -6.138 1.00 . A A . 28 PRO HB3 1 1 9 7610 1 1 28 PRO HD2 H -9.036 0.219 -2.699 1.00 . A A . 28 PRO HD2 1 1 9 7611 1 1 28 PRO HD3 H -9.808 -0.706 -4.000 1.00 . A A . 28 PRO HD3 1 1 9 7612 1 1 28 PRO HG2 H -10.200 2.026 -3.399 1.00 . A A . 28 PRO HG2 1 1 9 7613 1 1 28 PRO HG3 H -10.774 1.163 -4.833 1.00 . A A . 28 PRO HG3 1 1 9 7614 1 1 28 PRO N N -7.951 0.152 -4.508 1.00 . A A . 28 PRO N 1 1 9 7615 1 1 28 PRO O O -6.829 3.427 -3.672 1.00 . A A . 28 PRO O 1 1 9 7616 1 1 29 SER C C -3.715 2.189 -2.473 1.00 . A A . 29 SER C 1 1 9 7617 1 1 29 SER CA C -5.156 1.971 -2.017 1.00 . A A . 29 SER CA 1 1 9 7618 1 1 29 SER CB C -5.192 1.014 -0.824 1.00 . A A . 29 SER CB 1 1 9 7619 1 1 29 SER H H -5.979 0.465 -3.245 1.00 . A A . 29 SER H 1 1 9 7620 1 1 29 SER HA H -5.578 2.919 -1.721 1.00 . A A . 29 SER HA 1 1 9 7621 1 1 29 SER HB2 H -4.185 0.823 -0.485 1.00 . A A . 29 SER HB2 1 1 9 7622 1 1 29 SER HB3 H -5.764 1.462 -0.025 1.00 . A A . 29 SER HB3 1 1 9 7623 1 1 29 SER HG H -5.158 -0.742 -1.702 1.00 . A A . 29 SER HG 1 1 9 7624 1 1 29 SER N N -5.970 1.433 -3.095 1.00 . A A . 29 SER N 1 1 9 7625 1 1 29 SER O O -3.298 1.692 -3.522 1.00 . A A . 29 SER O 1 1 9 7626 1 1 29 SER OG O -5.795 -0.217 -1.187 1.00 . A A . 29 SER OG 1 1 9 7627 1 1 30 SER C C -0.690 2.669 -0.776 1.00 . A A . 30 SER C 1 1 9 7628 1 1 30 SER CA C -1.545 3.139 -1.948 1.00 . A A . 30 SER CA 1 1 9 7629 1 1 30 SER CB C -1.307 4.626 -2.226 1.00 . A A . 30 SER CB 1 1 9 7630 1 1 30 SER H H -3.326 3.243 -0.820 1.00 . A A . 30 SER H 1 1 9 7631 1 1 30 SER HA H -1.285 2.566 -2.826 1.00 . A A . 30 SER HA 1 1 9 7632 1 1 30 SER HB2 H -1.295 5.168 -1.292 1.00 . A A . 30 SER HB2 1 1 9 7633 1 1 30 SER HB3 H -0.356 4.747 -2.725 1.00 . A A . 30 SER HB3 1 1 9 7634 1 1 30 SER HG H -3.064 5.469 -2.505 1.00 . A A . 30 SER HG 1 1 9 7635 1 1 30 SER N N -2.950 2.903 -1.660 1.00 . A A . 30 SER N 1 1 9 7636 1 1 30 SER O O -1.156 2.648 0.367 1.00 . A A . 30 SER O 1 1 9 7637 1 1 30 SER OG O -2.329 5.163 -3.055 1.00 . A A . 30 SER OG 1 1 9 7638 1 1 31 TYR C C 2.803 2.012 -0.169 1.00 . A A . 31 TYR C 1 1 9 7639 1 1 31 TYR CA C 1.348 1.586 -0.030 1.00 . A A . 31 TYR CA 1 1 9 7640 1 1 31 TYR CB C 1.270 0.063 -0.092 1.00 . A A . 31 TYR CB 1 1 9 7641 1 1 31 TYR CD1 C 0.173 -0.772 2.014 1.00 . A A . 31 TYR CD1 1 1 9 7642 1 1 31 TYR CD2 C -1.093 -0.791 -0.003 1.00 . A A . 31 TYR CD2 1 1 9 7643 1 1 31 TYR CE1 C -0.903 -1.298 2.699 1.00 . A A . 31 TYR CE1 1 1 9 7644 1 1 31 TYR CE2 C -2.171 -1.313 0.674 1.00 . A A . 31 TYR CE2 1 1 9 7645 1 1 31 TYR CG C 0.096 -0.513 0.654 1.00 . A A . 31 TYR CG 1 1 9 7646 1 1 31 TYR CZ C -2.073 -1.563 2.023 1.00 . A A . 31 TYR CZ 1 1 9 7647 1 1 31 TYR H H 0.786 2.104 -2.005 1.00 . A A . 31 TYR H 1 1 9 7648 1 1 31 TYR HA H 0.976 1.917 0.929 1.00 . A A . 31 TYR HA 1 1 9 7649 1 1 31 TYR HB2 H 1.188 -0.245 -1.123 1.00 . A A . 31 TYR HB2 1 1 9 7650 1 1 31 TYR HB3 H 2.172 -0.353 0.333 1.00 . A A . 31 TYR HB3 1 1 9 7651 1 1 31 TYR HD1 H 1.096 -0.566 2.537 1.00 . A A . 31 TYR HD1 1 1 9 7652 1 1 31 TYR HD2 H -1.168 -0.590 -1.064 1.00 . A A . 31 TYR HD2 1 1 9 7653 1 1 31 TYR HE1 H -0.825 -1.492 3.758 1.00 . A A . 31 TYR HE1 1 1 9 7654 1 1 31 TYR HE2 H -3.087 -1.528 0.144 1.00 . A A . 31 TYR HE2 1 1 9 7655 1 1 31 TYR HH H -3.673 -2.638 2.083 1.00 . A A . 31 TYR HH 1 1 9 7656 1 1 31 TYR N N 0.505 2.174 -1.064 1.00 . A A . 31 TYR N 1 1 9 7657 1 1 31 TYR O O 3.237 2.452 -1.232 1.00 . A A . 31 TYR O 1 1 9 7658 1 1 31 TYR OH O -3.151 -2.080 2.697 1.00 . A A . 31 TYR OH 1 1 9 7659 1 1 32 HIS C C 5.646 0.504 0.971 1.00 . A A . 32 HIS C 1 1 9 7660 1 1 32 HIS CA C 5.017 1.878 0.826 1.00 . A A . 32 HIS CA 1 1 9 7661 1 1 32 HIS CB C 5.498 2.784 1.959 1.00 . A A . 32 HIS CB 1 1 9 7662 1 1 32 HIS CD2 C 5.586 5.031 0.680 1.00 . A A . 32 HIS CD2 1 1 9 7663 1 1 32 HIS CE1 C 4.591 6.244 2.201 1.00 . A A . 32 HIS CE1 1 1 9 7664 1 1 32 HIS CG C 5.259 4.245 1.736 1.00 . A A . 32 HIS CG 1 1 9 7665 1 1 32 HIS H H 3.188 1.243 1.624 1.00 . A A . 32 HIS H 1 1 9 7666 1 1 32 HIS HA H 5.293 2.304 -0.128 1.00 . A A . 32 HIS HA 1 1 9 7667 1 1 32 HIS HB2 H 4.989 2.503 2.868 1.00 . A A . 32 HIS HB2 1 1 9 7668 1 1 32 HIS HB3 H 6.559 2.636 2.092 1.00 . A A . 32 HIS HB3 1 1 9 7669 1 1 32 HIS HD2 H 6.083 4.722 -0.229 1.00 . A A . 32 HIS HD2 1 1 9 7670 1 1 32 HIS HE1 H 4.154 7.088 2.713 1.00 . A A . 32 HIS HE1 1 1 9 7671 1 1 32 HIS HE2 H 5.355 7.120 0.470 1.00 . A A . 32 HIS HE2 1 1 9 7672 1 1 32 HIS N N 3.577 1.721 0.866 1.00 . A A . 32 HIS N 1 1 9 7673 1 1 32 HIS ND1 N 4.634 5.016 2.683 1.00 . A A . 32 HIS ND1 1 1 9 7674 1 1 32 HIS NE2 N 5.158 6.302 0.983 1.00 . A A . 32 HIS NE2 1 1 9 7675 1 1 32 HIS O O 5.023 -0.400 1.527 1.00 . A A . 32 HIS O 1 1 9 7676 1 1 33 ILE C C 7.972 -1.346 1.878 1.00 . A A . 33 ILE C 1 1 9 7677 1 1 33 ILE CA C 7.507 -0.967 0.471 1.00 . A A . 33 ILE CA 1 1 9 7678 1 1 33 ILE CB C 8.715 -1.000 -0.489 1.00 . A A . 33 ILE CB 1 1 9 7679 1 1 33 ILE CD1 C 10.970 0.159 -0.776 1.00 . A A . 33 ILE CD1 1 1 9 7680 1 1 33 ILE CG1 C 9.511 0.307 -0.401 1.00 . A A . 33 ILE CG1 1 1 9 7681 1 1 33 ILE CG2 C 8.245 -1.247 -1.916 1.00 . A A . 33 ILE CG2 1 1 9 7682 1 1 33 ILE H H 7.281 1.081 -0.011 1.00 . A A . 33 ILE H 1 1 9 7683 1 1 33 ILE HA H 6.794 -1.704 0.134 1.00 . A A . 33 ILE HA 1 1 9 7684 1 1 33 ILE HB H 9.352 -1.822 -0.200 1.00 . A A . 33 ILE HB 1 1 9 7685 1 1 33 ILE HD11 H 11.547 0.928 -0.284 1.00 . A A . 33 ILE HD11 1 1 9 7686 1 1 33 ILE HD12 H 11.324 -0.813 -0.464 1.00 . A A . 33 ILE HD12 1 1 9 7687 1 1 33 ILE HD13 H 11.079 0.255 -1.846 1.00 . A A . 33 ILE HD13 1 1 9 7688 1 1 33 ILE HG12 H 9.070 1.035 -1.066 1.00 . A A . 33 ILE HG12 1 1 9 7689 1 1 33 ILE HG21 H 7.550 -2.074 -1.928 1.00 . A A . 33 ILE HG21 1 1 9 7690 1 1 33 ILE HG22 H 7.757 -0.361 -2.294 1.00 . A A . 33 ILE HG22 1 1 9 7691 1 1 33 ILE HG23 H 9.096 -1.485 -2.538 1.00 . A A . 33 ILE HG23 1 1 9 7692 1 1 33 ILE N N 6.846 0.333 0.447 1.00 . A A . 33 ILE N 1 1 9 7693 1 1 33 ILE O O 8.255 -2.511 2.150 1.00 . A A . 33 ILE O 1 1 9 7694 1 1 34 HIS C C 7.533 -0.494 5.153 1.00 . A A . 34 HIS C 1 1 9 7695 1 1 34 HIS CA C 8.631 -0.581 4.091 1.00 . A A . 34 HIS CA 1 1 9 7696 1 1 34 HIS CB C 9.736 0.433 4.403 1.00 . A A . 34 HIS CB 1 1 9 7697 1 1 34 HIS CD2 C 8.735 2.738 5.016 1.00 . A A . 34 HIS CD2 1 1 9 7698 1 1 34 HIS CE1 C 9.046 3.698 3.088 1.00 . A A . 34 HIS CE1 1 1 9 7699 1 1 34 HIS CG C 9.330 1.861 4.173 1.00 . A A . 34 HIS CG 1 1 9 7700 1 1 34 HIS H H 7.941 0.566 2.451 1.00 . A A . 34 HIS H 1 1 9 7701 1 1 34 HIS HA H 9.054 -1.574 4.114 1.00 . A A . 34 HIS HA 1 1 9 7702 1 1 34 HIS HB2 H 10.023 0.334 5.438 1.00 . A A . 34 HIS HB2 1 1 9 7703 1 1 34 HIS HB3 H 10.591 0.224 3.776 1.00 . A A . 34 HIS HB3 1 1 9 7704 1 1 34 HIS HD2 H 8.462 2.560 6.046 1.00 . A A . 34 HIS HD2 1 1 9 7705 1 1 34 HIS HE1 H 9.051 4.438 2.301 1.00 . A A . 34 HIS HE1 1 1 9 7706 1 1 34 HIS HE2 H 7.925 4.625 4.567 1.00 . A A . 34 HIS HE2 1 1 9 7707 1 1 34 HIS N N 8.111 -0.353 2.746 1.00 . A A . 34 HIS N 1 1 9 7708 1 1 34 HIS ND1 N 9.525 2.472 2.959 1.00 . A A . 34 HIS ND1 1 1 9 7709 1 1 34 HIS NE2 N 8.555 3.906 4.318 1.00 . A A . 34 HIS NE2 1 1 9 7710 1 1 34 HIS O O 7.807 -0.613 6.347 1.00 . A A . 34 HIS O 1 1 9 7711 1 1 35 CYS C C 4.342 -1.317 5.782 1.00 . A A . 35 CYS C 1 1 9 7712 1 1 35 CYS CA C 5.200 -0.056 5.661 1.00 . A A . 35 CYS CA 1 1 9 7713 1 1 35 CYS CB C 4.358 1.147 5.231 1.00 . A A . 35 CYS CB 1 1 9 7714 1 1 35 CYS H H 6.144 -0.122 3.767 1.00 . A A . 35 CYS H 1 1 9 7715 1 1 35 CYS HA H 5.631 0.156 6.629 1.00 . A A . 35 CYS HA 1 1 9 7716 1 1 35 CYS HB2 H 3.985 0.981 4.230 1.00 . A A . 35 CYS HB2 1 1 9 7717 1 1 35 CYS HB3 H 3.527 1.261 5.909 1.00 . A A . 35 CYS HB3 1 1 9 7718 1 1 35 CYS N N 6.304 -0.238 4.725 1.00 . A A . 35 CYS N 1 1 9 7719 1 1 35 CYS O O 3.249 -1.287 6.345 1.00 . A A . 35 CYS O 1 1 9 7720 1 1 35 CYS SG S 5.301 2.708 5.228 1.00 . A A . 35 CYS SG 1 1 9 7721 1 1 36 LEU C C 5.075 -4.644 6.364 1.00 . A A . 36 LEU C 1 1 9 7722 1 1 36 LEU CA C 4.225 -3.725 5.499 1.00 . A A . 36 LEU CA 1 1 9 7723 1 1 36 LEU CB C 3.987 -4.377 4.134 1.00 . A A . 36 LEU CB 1 1 9 7724 1 1 36 LEU CD1 C 4.526 -3.739 1.776 1.00 . A A . 36 LEU CD1 1 1 9 7725 1 1 36 LEU CD2 C 2.200 -3.470 2.640 1.00 . A A . 36 LEU CD2 1 1 9 7726 1 1 36 LEU CG C 3.676 -3.413 2.991 1.00 . A A . 36 LEU CG 1 1 9 7727 1 1 36 LEU H H 5.796 -2.413 4.977 1.00 . A A . 36 LEU H 1 1 9 7728 1 1 36 LEU HA H 3.275 -3.559 5.986 1.00 . A A . 36 LEU HA 1 1 9 7729 1 1 36 LEU HB2 H 4.872 -4.938 3.870 1.00 . A A . 36 LEU HB2 1 1 9 7730 1 1 36 LEU HB3 H 3.160 -5.065 4.229 1.00 . A A . 36 LEU HB3 1 1 9 7731 1 1 36 LEU HD11 H 5.355 -3.048 1.721 1.00 . A A . 36 LEU HD11 1 1 9 7732 1 1 36 LEU HD12 H 4.901 -4.747 1.859 1.00 . A A . 36 LEU HD12 1 1 9 7733 1 1 36 LEU HD13 H 3.926 -3.650 0.882 1.00 . A A . 36 LEU HD13 1 1 9 7734 1 1 36 LEU HD21 H 1.730 -4.273 3.191 1.00 . A A . 36 LEU HD21 1 1 9 7735 1 1 36 LEU HD22 H 1.729 -2.533 2.898 1.00 . A A . 36 LEU HD22 1 1 9 7736 1 1 36 LEU HD23 H 2.090 -3.650 1.581 1.00 . A A . 36 LEU HD23 1 1 9 7737 1 1 36 LEU HG H 3.909 -2.405 3.304 1.00 . A A . 36 LEU HG 1 1 9 7738 1 1 36 LEU N N 4.890 -2.439 5.345 1.00 . A A . 36 LEU N 1 1 9 7739 1 1 36 LEU O O 6.251 -4.361 6.602 1.00 . A A . 36 LEU O 1 1 9 7740 1 1 37 ARG C C 6.331 -7.423 6.596 1.00 . A A . 37 ARG C 1 1 9 7741 1 1 37 ARG CA C 5.264 -6.786 7.498 1.00 . A A . 37 ARG CA 1 1 9 7742 1 1 37 ARG CB C 4.341 -7.860 8.091 1.00 . A A . 37 ARG CB 1 1 9 7743 1 1 37 ARG CD C 5.532 -7.951 10.326 1.00 . A A . 37 ARG CD 1 1 9 7744 1 1 37 ARG CG C 4.198 -7.779 9.606 1.00 . A A . 37 ARG CG 1 1 9 7745 1 1 37 ARG CZ C 7.729 -8.759 9.539 1.00 . A A . 37 ARG CZ 1 1 9 7746 1 1 37 ARG H H 3.587 -5.979 6.474 1.00 . A A . 37 ARG H 1 1 9 7747 1 1 37 ARG HA H 5.766 -6.276 8.308 1.00 . A A . 37 ARG HA 1 1 9 7748 1 1 37 ARG HB2 H 3.358 -7.757 7.653 1.00 . A A . 37 ARG HB2 1 1 9 7749 1 1 37 ARG HB3 H 4.736 -8.835 7.841 1.00 . A A . 37 ARG HB3 1 1 9 7750 1 1 37 ARG HD2 H 6.030 -6.993 10.365 1.00 . A A . 37 ARG HD2 1 1 9 7751 1 1 37 ARG HD3 H 5.338 -8.293 11.332 1.00 . A A . 37 ARG HD3 1 1 9 7752 1 1 37 ARG HE H 5.987 -9.712 9.266 1.00 . A A . 37 ARG HE 1 1 9 7753 1 1 37 ARG HG2 H 3.789 -6.815 9.864 1.00 . A A . 37 ARG HG2 1 1 9 7754 1 1 37 ARG HG3 H 3.521 -8.556 9.934 1.00 . A A . 37 ARG HG3 1 1 9 7755 1 1 37 ARG HH11 H 7.796 -7.005 10.549 1.00 . A A . 37 ARG HH11 1 1 9 7756 1 1 37 ARG HH12 H 9.327 -7.571 9.949 1.00 . A A . 37 ARG HH12 1 1 9 7757 1 1 37 ARG HH21 H 7.983 -10.460 8.465 1.00 . A A . 37 ARG HH21 1 1 9 7758 1 1 37 ARG HH22 H 9.435 -9.553 8.780 1.00 . A A . 37 ARG HH22 1 1 9 7759 1 1 37 ARG N N 4.509 -5.781 6.756 1.00 . A A . 37 ARG N 1 1 9 7760 1 1 37 ARG NE N 6.411 -8.913 9.660 1.00 . A A . 37 ARG NE 1 1 9 7761 1 1 37 ARG NH1 N 8.329 -7.696 10.060 1.00 . A A . 37 ARG NH1 1 1 9 7762 1 1 37 ARG NH2 N 8.441 -9.663 8.879 1.00 . A A . 37 ARG NH2 1 1 9 7763 1 1 37 ARG O O 7.523 -7.280 6.871 1.00 . A A . 37 ARG O 1 1 9 7764 1 1 38 PRO C C 7.532 -7.397 3.668 1.00 . A A . 38 PRO C 1 1 9 7765 1 1 38 PRO CA C 6.905 -8.536 4.466 1.00 . A A . 38 PRO CA 1 1 9 7766 1 1 38 PRO CB C 6.063 -9.442 3.549 1.00 . A A . 38 PRO CB 1 1 9 7767 1 1 38 PRO CD C 4.576 -8.155 4.928 1.00 . A A . 38 PRO CD 1 1 9 7768 1 1 38 PRO CG C 4.665 -9.390 4.081 1.00 . A A . 38 PRO CG 1 1 9 7769 1 1 38 PRO HA H 7.684 -9.115 4.942 1.00 . A A . 38 PRO HA 1 1 9 7770 1 1 38 PRO HB2 H 6.107 -9.066 2.538 1.00 . A A . 38 PRO HB2 1 1 9 7771 1 1 38 PRO HB3 H 6.456 -10.448 3.578 1.00 . A A . 38 PRO HB3 1 1 9 7772 1 1 38 PRO HD2 H 4.299 -7.304 4.324 1.00 . A A . 38 PRO HD2 1 1 9 7773 1 1 38 PRO HD3 H 3.872 -8.295 5.735 1.00 . A A . 38 PRO HD3 1 1 9 7774 1 1 38 PRO HG2 H 3.963 -9.333 3.261 1.00 . A A . 38 PRO HG2 1 1 9 7775 1 1 38 PRO HG3 H 4.468 -10.267 4.678 1.00 . A A . 38 PRO HG3 1 1 9 7776 1 1 38 PRO N N 5.945 -8.021 5.439 1.00 . A A . 38 PRO N 1 1 9 7777 1 1 38 PRO O O 7.261 -7.235 2.474 1.00 . A A . 38 PRO O 1 1 9 7778 1 1 39 ALA C C 9.786 -5.656 2.662 1.00 . A A . 39 ALA C 1 1 9 7779 1 1 39 ALA CA C 8.830 -5.335 3.801 1.00 . A A . 39 ALA CA 1 1 9 7780 1 1 39 ALA CB C 9.538 -4.521 4.876 1.00 . A A . 39 ALA CB 1 1 9 7781 1 1 39 ALA H H 8.345 -6.692 5.346 1.00 . A A . 39 ALA H 1 1 9 7782 1 1 39 ALA HA H 8.016 -4.739 3.414 1.00 . A A . 39 ALA HA 1 1 9 7783 1 1 39 ALA HB1 H 9.156 -3.510 4.870 1.00 . A A . 39 ALA HB1 1 1 9 7784 1 1 39 ALA HB2 H 9.359 -4.968 5.842 1.00 . A A . 39 ALA HB2 1 1 9 7785 1 1 39 ALA HB3 H 10.601 -4.506 4.678 1.00 . A A . 39 ALA HB3 1 1 9 7786 1 1 39 ALA N N 8.260 -6.542 4.378 1.00 . A A . 39 ALA N 1 1 9 7787 1 1 39 ALA O O 10.464 -6.686 2.672 1.00 . A A . 39 ALA O 1 1 9 7788 1 1 40 LEU C C 11.694 -3.757 0.471 1.00 . A A . 40 LEU C 1 1 9 7789 1 1 40 LEU CA C 10.716 -4.920 0.548 1.00 . A A . 40 LEU CA 1 1 9 7790 1 1 40 LEU CB C 9.897 -4.996 -0.744 1.00 . A A . 40 LEU CB 1 1 9 7791 1 1 40 LEU CD1 C 7.420 -5.379 -0.770 1.00 . A A . 40 LEU CD1 1 1 9 7792 1 1 40 LEU CD2 C 8.944 -6.974 -1.945 1.00 . A A . 40 LEU CD2 1 1 9 7793 1 1 40 LEU CG C 8.786 -6.046 -0.751 1.00 . A A . 40 LEU CG 1 1 9 7794 1 1 40 LEU H H 9.298 -3.944 1.765 1.00 . A A . 40 LEU H 1 1 9 7795 1 1 40 LEU HA H 11.270 -5.839 0.672 1.00 . A A . 40 LEU HA 1 1 9 7796 1 1 40 LEU HB2 H 9.449 -4.029 -0.919 1.00 . A A . 40 LEU HB2 1 1 9 7797 1 1 40 LEU HB3 H 10.570 -5.214 -1.559 1.00 . A A . 40 LEU HB3 1 1 9 7798 1 1 40 LEU HD11 H 7.432 -4.515 -0.121 1.00 . A A . 40 LEU HD11 1 1 9 7799 1 1 40 LEU HD12 H 7.184 -5.070 -1.777 1.00 . A A . 40 LEU HD12 1 1 9 7800 1 1 40 LEU HD13 H 6.674 -6.079 -0.423 1.00 . A A . 40 LEU HD13 1 1 9 7801 1 1 40 LEU HD21 H 8.004 -7.465 -2.143 1.00 . A A . 40 LEU HD21 1 1 9 7802 1 1 40 LEU HD22 H 9.243 -6.401 -2.810 1.00 . A A . 40 LEU HD22 1 1 9 7803 1 1 40 LEU HD23 H 9.698 -7.716 -1.727 1.00 . A A . 40 LEU HD23 1 1 9 7804 1 1 40 LEU HG H 8.854 -6.642 0.148 1.00 . A A . 40 LEU HG 1 1 9 7805 1 1 40 LEU N N 9.843 -4.759 1.694 1.00 . A A . 40 LEU N 1 1 9 7806 1 1 40 LEU O O 11.426 -2.679 0.999 1.00 . A A . 40 LEU O 1 1 9 7807 1 1 41 TYR C C 13.701 -2.343 -1.772 1.00 . A A . 41 TYR C 1 1 9 7808 1 1 41 TYR CA C 13.812 -2.936 -0.375 1.00 . A A . 41 TYR CA 1 1 9 7809 1 1 41 TYR CB C 15.216 -3.497 -0.140 1.00 . A A . 41 TYR CB 1 1 9 7810 1 1 41 TYR CD1 C 15.616 -3.042 2.311 1.00 . A A . 41 TYR CD1 1 1 9 7811 1 1 41 TYR CD2 C 15.480 -5.310 1.591 1.00 . A A . 41 TYR CD2 1 1 9 7812 1 1 41 TYR CE1 C 15.820 -3.463 3.609 1.00 . A A . 41 TYR CE1 1 1 9 7813 1 1 41 TYR CE2 C 15.681 -5.738 2.890 1.00 . A A . 41 TYR CE2 1 1 9 7814 1 1 41 TYR CG C 15.446 -3.958 1.280 1.00 . A A . 41 TYR CG 1 1 9 7815 1 1 41 TYR CZ C 15.848 -4.810 3.894 1.00 . A A . 41 TYR CZ 1 1 9 7816 1 1 41 TYR H H 12.953 -4.858 -0.613 1.00 . A A . 41 TYR H 1 1 9 7817 1 1 41 TYR HA H 13.615 -2.160 0.350 1.00 . A A . 41 TYR HA 1 1 9 7818 1 1 41 TYR HB2 H 15.375 -4.341 -0.795 1.00 . A A . 41 TYR HB2 1 1 9 7819 1 1 41 TYR HB3 H 15.944 -2.732 -0.363 1.00 . A A . 41 TYR HB3 1 1 9 7820 1 1 41 TYR HD1 H 15.591 -1.984 2.086 1.00 . A A . 41 TYR HD1 1 1 9 7821 1 1 41 TYR HD2 H 15.349 -6.034 0.800 1.00 . A A . 41 TYR HD2 1 1 9 7822 1 1 41 TYR HE1 H 15.949 -2.736 4.396 1.00 . A A . 41 TYR HE1 1 1 9 7823 1 1 41 TYR HE2 H 15.704 -6.794 3.111 1.00 . A A . 41 TYR HE2 1 1 9 7824 1 1 41 TYR HH H 15.267 -5.740 5.477 1.00 . A A . 41 TYR HH 1 1 9 7825 1 1 41 TYR N N 12.811 -3.976 -0.198 1.00 . A A . 41 TYR N 1 1 9 7826 1 1 41 TYR O O 14.245 -1.275 -2.055 1.00 . A A . 41 TYR O 1 1 9 7827 1 1 41 TYR OH O 16.042 -5.233 5.189 1.00 . A A . 41 TYR OH 1 1 9 7828 1 1 42 GLU C C 11.118 -2.560 -4.197 1.00 . A A . 42 GLU C 1 1 9 7829 1 1 42 GLU CA C 12.614 -2.497 -3.937 1.00 . A A . 42 GLU CA 1 1 9 7830 1 1 42 GLU CB C 13.375 -3.306 -4.989 1.00 . A A . 42 GLU CB 1 1 9 7831 1 1 42 GLU CD C 13.826 -1.233 -6.355 1.00 . A A . 42 GLU CD 1 1 9 7832 1 1 42 GLU CG C 14.412 -2.486 -5.737 1.00 . A A . 42 GLU CG 1 1 9 7833 1 1 42 GLU H H 12.420 -3.783 -2.280 1.00 . A A . 42 GLU H 1 1 9 7834 1 1 42 GLU HA H 12.933 -1.467 -3.983 1.00 . A A . 42 GLU HA 1 1 9 7835 1 1 42 GLU HB2 H 13.876 -4.129 -4.503 1.00 . A A . 42 GLU HB2 1 1 9 7836 1 1 42 GLU HB3 H 12.670 -3.696 -5.708 1.00 . A A . 42 GLU HB3 1 1 9 7837 1 1 42 GLU HG2 H 15.191 -2.200 -5.048 1.00 . A A . 42 GLU HG2 1 1 9 7838 1 1 42 GLU HG3 H 14.835 -3.093 -6.525 1.00 . A A . 42 GLU HG3 1 1 9 7839 1 1 42 GLU N N 12.901 -2.992 -2.604 1.00 . A A . 42 GLU N 1 1 9 7840 1 1 42 GLU O O 10.375 -3.154 -3.416 1.00 . A A . 42 GLU O 1 1 9 7841 1 1 42 GLU OE1 O 12.816 -1.341 -7.082 1.00 . A A . 42 GLU OE1 1 1 9 7842 1 1 42 GLU OE2 O 14.375 -0.136 -6.125 1.00 . A A . 42 GLU OE2 1 1 9 7843 1 1 43 VAL C C 8.874 -2.965 -6.566 1.00 . A A . 43 VAL C 1 1 9 7844 1 1 43 VAL CA C 9.257 -1.870 -5.580 1.00 . A A . 43 VAL CA 1 1 9 7845 1 1 43 VAL CB C 8.850 -0.499 -6.161 1.00 . A A . 43 VAL CB 1 1 9 7846 1 1 43 VAL CG1 C 7.341 -0.323 -6.106 1.00 . A A . 43 VAL CG1 1 1 9 7847 1 1 43 VAL CG2 C 9.545 0.631 -5.415 1.00 . A A . 43 VAL CG2 1 1 9 7848 1 1 43 VAL H H 11.316 -1.457 -5.850 1.00 . A A . 43 VAL H 1 1 9 7849 1 1 43 VAL HA H 8.707 -2.022 -4.661 1.00 . A A . 43 VAL HA 1 1 9 7850 1 1 43 VAL HB H 9.157 -0.461 -7.196 1.00 . A A . 43 VAL HB 1 1 9 7851 1 1 43 VAL HG11 H 7.063 0.093 -5.149 1.00 . A A . 43 VAL HG11 1 1 9 7852 1 1 43 VAL HG12 H 7.026 0.344 -6.895 1.00 . A A . 43 VAL HG12 1 1 9 7853 1 1 43 VAL HG13 H 6.862 -1.283 -6.234 1.00 . A A . 43 VAL HG13 1 1 9 7854 1 1 43 VAL HG21 H 9.091 0.753 -4.443 1.00 . A A . 43 VAL HG21 1 1 9 7855 1 1 43 VAL HG22 H 10.590 0.393 -5.297 1.00 . A A . 43 VAL HG22 1 1 9 7856 1 1 43 VAL HG23 H 9.445 1.548 -5.978 1.00 . A A . 43 VAL HG23 1 1 9 7857 1 1 43 VAL N N 10.675 -1.921 -5.265 1.00 . A A . 43 VAL N 1 1 9 7858 1 1 43 VAL O O 9.433 -3.051 -7.662 1.00 . A A . 43 VAL O 1 1 9 7859 1 1 44 PRO C C 6.452 -4.439 -8.065 1.00 . A A . 44 PRO C 1 1 9 7860 1 1 44 PRO CA C 7.459 -4.926 -7.028 1.00 . A A . 44 PRO CA 1 1 9 7861 1 1 44 PRO CB C 6.789 -5.898 -6.039 1.00 . A A . 44 PRO CB 1 1 9 7862 1 1 44 PRO CD C 7.248 -3.838 -4.891 1.00 . A A . 44 PRO CD 1 1 9 7863 1 1 44 PRO CG C 6.976 -5.299 -4.680 1.00 . A A . 44 PRO CG 1 1 9 7864 1 1 44 PRO HA H 8.278 -5.423 -7.528 1.00 . A A . 44 PRO HA 1 1 9 7865 1 1 44 PRO HB2 H 5.741 -5.994 -6.284 1.00 . A A . 44 PRO HB2 1 1 9 7866 1 1 44 PRO HB3 H 7.264 -6.865 -6.111 1.00 . A A . 44 PRO HB3 1 1 9 7867 1 1 44 PRO HD2 H 6.323 -3.281 -4.937 1.00 . A A . 44 PRO HD2 1 1 9 7868 1 1 44 PRO HD3 H 7.890 -3.452 -4.114 1.00 . A A . 44 PRO HD3 1 1 9 7869 1 1 44 PRO HG2 H 6.078 -5.430 -4.094 1.00 . A A . 44 PRO HG2 1 1 9 7870 1 1 44 PRO HG3 H 7.816 -5.767 -4.187 1.00 . A A . 44 PRO HG3 1 1 9 7871 1 1 44 PRO N N 7.930 -3.833 -6.183 1.00 . A A . 44 PRO N 1 1 9 7872 1 1 44 PRO O O 5.244 -4.640 -7.918 1.00 . A A . 44 PRO O 1 1 9 7873 1 1 45 ASP C C 5.563 -4.302 -11.024 1.00 . A A . 45 ASP C 1 1 9 7874 1 1 45 ASP CA C 6.095 -3.192 -10.126 1.00 . A A . 45 ASP CA 1 1 9 7875 1 1 45 ASP CB C 6.857 -2.167 -10.972 1.00 . A A . 45 ASP CB 1 1 9 7876 1 1 45 ASP CG C 5.999 -1.586 -12.081 1.00 . A A . 45 ASP CG 1 1 9 7877 1 1 45 ASP H H 7.917 -3.580 -9.116 1.00 . A A . 45 ASP H 1 1 9 7878 1 1 45 ASP HA H 5.260 -2.701 -9.647 1.00 . A A . 45 ASP HA 1 1 9 7879 1 1 45 ASP HB2 H 7.189 -1.358 -10.337 1.00 . A A . 45 ASP HB2 1 1 9 7880 1 1 45 ASP HB3 H 7.716 -2.645 -11.418 1.00 . A A . 45 ASP HB3 1 1 9 7881 1 1 45 ASP N N 6.951 -3.745 -9.080 1.00 . A A . 45 ASP N 1 1 9 7882 1 1 45 ASP O O 6.333 -5.024 -11.657 1.00 . A A . 45 ASP O 1 1 9 7883 1 1 45 ASP OD1 O 4.835 -1.218 -11.811 1.00 . A A . 45 ASP OD1 1 1 9 7884 1 1 45 ASP OD2 O 6.479 -1.496 -13.231 1.00 . A A . 45 ASP OD2 1 1 9 7885 1 1 46 GLY C C 2.994 -6.573 -10.955 1.00 . A A . 46 GLY C 1 1 9 7886 1 1 46 GLY CA C 3.634 -5.511 -11.820 1.00 . A A . 46 GLY CA 1 1 9 7887 1 1 46 GLY H H 3.689 -3.894 -10.458 1.00 . A A . 46 GLY H 1 1 9 7888 1 1 46 GLY HA2 H 2.877 -5.072 -12.455 1.00 . A A . 46 GLY HA2 1 1 9 7889 1 1 46 GLY HA3 H 4.388 -5.972 -12.441 1.00 . A A . 46 GLY HA3 1 1 9 7890 1 1 46 GLY N N 4.249 -4.467 -11.030 1.00 . A A . 46 GLY N 1 1 9 7891 1 1 46 GLY O O 1.817 -6.474 -10.604 1.00 . A A . 46 GLY O 1 1 9 7892 1 1 47 GLU C C 3.433 -8.352 -8.284 1.00 . A A . 47 GLU C 1 1 9 7893 1 1 47 GLU CA C 3.280 -8.667 -9.764 1.00 . A A . 47 GLU CA 1 1 9 7894 1 1 47 GLU CB C 4.008 -9.965 -10.098 1.00 . A A . 47 GLU CB 1 1 9 7895 1 1 47 GLU CD C 1.875 -11.117 -10.765 1.00 . A A . 47 GLU CD 1 1 9 7896 1 1 47 GLU CG C 3.303 -10.792 -11.156 1.00 . A A . 47 GLU CG 1 1 9 7897 1 1 47 GLU H H 4.708 -7.594 -10.901 1.00 . A A . 47 GLU H 1 1 9 7898 1 1 47 GLU HA H 2.230 -8.794 -9.982 1.00 . A A . 47 GLU HA 1 1 9 7899 1 1 47 GLU HB2 H 5.001 -9.729 -10.457 1.00 . A A . 47 GLU HB2 1 1 9 7900 1 1 47 GLU HB3 H 4.091 -10.560 -9.202 1.00 . A A . 47 GLU HB3 1 1 9 7901 1 1 47 GLU HG2 H 3.294 -10.238 -12.084 1.00 . A A . 47 GLU HG2 1 1 9 7902 1 1 47 GLU HG3 H 3.844 -11.717 -11.294 1.00 . A A . 47 GLU HG3 1 1 9 7903 1 1 47 GLU N N 3.773 -7.580 -10.596 1.00 . A A . 47 GLU N 1 1 9 7904 1 1 47 GLU O O 4.529 -8.450 -7.725 1.00 . A A . 47 GLU O 1 1 9 7905 1 1 47 GLU OE1 O 1.663 -11.654 -9.657 1.00 . A A . 47 GLU OE1 1 1 9 7906 1 1 47 GLU OE2 O 0.955 -10.834 -11.559 1.00 . A A . 47 GLU OE2 1 1 9 7907 1 1 48 TRP C C 0.860 -7.747 -5.698 1.00 . A A . 48 TRP C 1 1 9 7908 1 1 48 TRP CA C 2.292 -7.767 -6.216 1.00 . A A . 48 TRP CA 1 1 9 7909 1 1 48 TRP CB C 2.974 -6.430 -5.894 1.00 . A A . 48 TRP CB 1 1 9 7910 1 1 48 TRP CD1 C 3.806 -6.722 -3.483 1.00 . A A . 48 TRP CD1 1 1 9 7911 1 1 48 TRP CD2 C 2.220 -5.155 -3.725 1.00 . A A . 48 TRP CD2 1 1 9 7912 1 1 48 TRP CE2 C 2.587 -5.219 -2.366 1.00 . A A . 48 TRP CE2 1 1 9 7913 1 1 48 TRP CE3 C 1.240 -4.237 -4.115 1.00 . A A . 48 TRP CE3 1 1 9 7914 1 1 48 TRP CG C 3.013 -6.125 -4.424 1.00 . A A . 48 TRP CG 1 1 9 7915 1 1 48 TRP CH2 C 1.050 -3.517 -1.809 1.00 . A A . 48 TRP CH2 1 1 9 7916 1 1 48 TRP CZ2 C 2.006 -4.407 -1.399 1.00 . A A . 48 TRP CZ2 1 1 9 7917 1 1 48 TRP CZ3 C 0.663 -3.431 -3.152 1.00 . A A . 48 TRP CZ3 1 1 9 7918 1 1 48 TRP H H 1.465 -8.032 -8.147 1.00 . A A . 48 TRP H 1 1 9 7919 1 1 48 TRP HA H 2.829 -8.563 -5.720 1.00 . A A . 48 TRP HA 1 1 9 7920 1 1 48 TRP HB2 H 3.990 -6.455 -6.258 1.00 . A A . 48 TRP HB2 1 1 9 7921 1 1 48 TRP HB3 H 2.438 -5.633 -6.387 1.00 . A A . 48 TRP HB3 1 1 9 7922 1 1 48 TRP HD1 H 4.521 -7.503 -3.698 1.00 . A A . 48 TRP HD1 1 1 9 7923 1 1 48 TRP HE1 H 3.995 -6.454 -1.400 1.00 . A A . 48 TRP HE1 1 1 9 7924 1 1 48 TRP HE3 H 0.930 -4.156 -5.146 1.00 . A A . 48 TRP HE3 1 1 9 7925 1 1 48 TRP HH2 H 0.571 -2.869 -1.089 1.00 . A A . 48 TRP HH2 1 1 9 7926 1 1 48 TRP HZ2 H 2.294 -4.460 -0.359 1.00 . A A . 48 TRP HZ2 1 1 9 7927 1 1 48 TRP HZ3 H -0.097 -2.718 -3.434 1.00 . A A . 48 TRP HZ3 1 1 9 7928 1 1 48 TRP N N 2.316 -8.037 -7.645 1.00 . A A . 48 TRP N 1 1 9 7929 1 1 48 TRP NE1 N 3.553 -6.187 -2.244 1.00 . A A . 48 TRP NE1 1 1 9 7930 1 1 48 TRP O O 0.009 -7.022 -6.222 1.00 . A A . 48 TRP O 1 1 9 7931 1 1 49 GLN C C -0.450 -8.027 -2.500 1.00 . A A . 49 GLN C 1 1 9 7932 1 1 49 GLN CA C -0.655 -8.449 -3.942 1.00 . A A . 49 GLN CA 1 1 9 7933 1 1 49 GLN CB C -1.345 -9.811 -4.000 1.00 . A A . 49 GLN CB 1 1 9 7934 1 1 49 GLN CD C -3.605 -9.634 -2.877 1.00 . A A . 49 GLN CD 1 1 9 7935 1 1 49 GLN CG C -2.851 -9.715 -4.190 1.00 . A A . 49 GLN CG 1 1 9 7936 1 1 49 GLN H H 1.365 -8.983 -4.218 1.00 . A A . 49 GLN H 1 1 9 7937 1 1 49 GLN HA H -1.276 -7.715 -4.435 1.00 . A A . 49 GLN HA 1 1 9 7938 1 1 49 GLN HB2 H -0.934 -10.377 -4.823 1.00 . A A . 49 GLN HB2 1 1 9 7939 1 1 49 GLN HB3 H -1.153 -10.338 -3.078 1.00 . A A . 49 GLN HB3 1 1 9 7940 1 1 49 GLN HE21 H -3.615 -7.648 -2.959 1.00 . A A . 49 GLN HE21 1 1 9 7941 1 1 49 GLN HE22 H -4.365 -8.352 -1.572 1.00 . A A . 49 GLN HE22 1 1 9 7942 1 1 49 GLN HG2 H -3.074 -8.831 -4.768 1.00 . A A . 49 GLN HG2 1 1 9 7943 1 1 49 GLN HG3 H -3.188 -10.589 -4.726 1.00 . A A . 49 GLN HG3 1 1 9 7944 1 1 49 GLN N N 0.626 -8.477 -4.620 1.00 . A A . 49 GLN N 1 1 9 7945 1 1 49 GLN NE2 N -3.894 -8.427 -2.427 1.00 . A A . 49 GLN NE2 1 1 9 7946 1 1 49 GLN O O 0.435 -8.540 -1.812 1.00 . A A . 49 GLN O 1 1 9 7947 1 1 49 GLN OE1 O -3.932 -10.652 -2.268 1.00 . A A . 49 GLN OE1 1 1 9 7948 1 1 50 CYS C C -1.417 -7.449 0.330 1.00 . A A . 50 CYS C 1 1 9 7949 1 1 50 CYS CA C -1.084 -6.447 -0.772 1.00 . A A . 50 CYS CA 1 1 9 7950 1 1 50 CYS CB C -2.037 -5.275 -0.713 1.00 . A A . 50 CYS CB 1 1 9 7951 1 1 50 CYS H H -1.853 -6.632 -2.708 1.00 . A A . 50 CYS H 1 1 9 7952 1 1 50 CYS HA H -0.074 -6.095 -0.646 1.00 . A A . 50 CYS HA 1 1 9 7953 1 1 50 CYS HB2 H -2.528 -5.258 0.249 1.00 . A A . 50 CYS HB2 1 1 9 7954 1 1 50 CYS HB3 H -1.485 -4.356 -0.856 1.00 . A A . 50 CYS HB3 1 1 9 7955 1 1 50 CYS N N -1.209 -7.032 -2.086 1.00 . A A . 50 CYS N 1 1 9 7956 1 1 50 CYS O O -2.472 -8.087 0.311 1.00 . A A . 50 CYS O 1 1 9 7957 1 1 50 CYS SG S -3.319 -5.358 -2.001 1.00 . A A . 50 CYS SG 1 1 9 7958 1 1 51 PRO C C -1.573 -7.747 3.579 1.00 . A A . 51 PRO C 1 1 9 7959 1 1 51 PRO CA C -0.764 -8.433 2.478 1.00 . A A . 51 PRO CA 1 1 9 7960 1 1 51 PRO CB C 0.661 -8.719 2.947 1.00 . A A . 51 PRO CB 1 1 9 7961 1 1 51 PRO CD C 0.724 -6.817 1.456 1.00 . A A . 51 PRO CD 1 1 9 7962 1 1 51 PRO CG C 1.427 -7.477 2.621 1.00 . A A . 51 PRO CG 1 1 9 7963 1 1 51 PRO HA H -1.247 -9.355 2.188 1.00 . A A . 51 PRO HA 1 1 9 7964 1 1 51 PRO HB2 H 0.659 -8.919 4.008 1.00 . A A . 51 PRO HB2 1 1 9 7965 1 1 51 PRO HB3 H 1.054 -9.572 2.414 1.00 . A A . 51 PRO HB3 1 1 9 7966 1 1 51 PRO HD2 H 0.541 -5.774 1.672 1.00 . A A . 51 PRO HD2 1 1 9 7967 1 1 51 PRO HD3 H 1.314 -6.916 0.558 1.00 . A A . 51 PRO HD3 1 1 9 7968 1 1 51 PRO HG2 H 1.431 -6.818 3.476 1.00 . A A . 51 PRO HG2 1 1 9 7969 1 1 51 PRO HG3 H 2.440 -7.738 2.347 1.00 . A A . 51 PRO HG3 1 1 9 7970 1 1 51 PRO N N -0.546 -7.558 1.337 1.00 . A A . 51 PRO N 1 1 9 7971 1 1 51 PRO O O -1.274 -7.893 4.766 1.00 . A A . 51 PRO O 1 1 9 7972 1 1 52 ARG C C -4.804 -6.059 3.656 1.00 . A A . 52 ARG C 1 1 9 7973 1 1 52 ARG CA C -3.361 -6.199 4.132 1.00 . A A . 52 ARG CA 1 1 9 7974 1 1 52 ARG CB C -2.762 -4.815 4.380 1.00 . A A . 52 ARG CB 1 1 9 7975 1 1 52 ARG CD C -2.535 -2.870 5.959 1.00 . A A . 52 ARG CD 1 1 9 7976 1 1 52 ARG CG C -3.266 -4.166 5.660 1.00 . A A . 52 ARG CG 1 1 9 7977 1 1 52 ARG CZ C -2.473 -2.292 8.369 1.00 . A A . 52 ARG CZ 1 1 9 7978 1 1 52 ARG H H -2.716 -6.828 2.218 1.00 . A A . 52 ARG H 1 1 9 7979 1 1 52 ARG HA H -3.359 -6.749 5.061 1.00 . A A . 52 ARG HA 1 1 9 7980 1 1 52 ARG HB2 H -1.687 -4.905 4.443 1.00 . A A . 52 ARG HB2 1 1 9 7981 1 1 52 ARG HB3 H -3.013 -4.171 3.552 1.00 . A A . 52 ARG HB3 1 1 9 7982 1 1 52 ARG HD2 H -1.756 -2.735 5.222 1.00 . A A . 52 ARG HD2 1 1 9 7983 1 1 52 ARG HD3 H -3.237 -2.055 5.889 1.00 . A A . 52 ARG HD3 1 1 9 7984 1 1 52 ARG HE H -1.060 -3.331 7.395 1.00 . A A . 52 ARG HE 1 1 9 7985 1 1 52 ARG HG2 H -4.319 -3.957 5.555 1.00 . A A . 52 ARG HG2 1 1 9 7986 1 1 52 ARG HG3 H -3.113 -4.851 6.482 1.00 . A A . 52 ARG HG3 1 1 9 7987 1 1 52 ARG HH11 H -4.166 -1.682 7.426 1.00 . A A . 52 ARG HH11 1 1 9 7988 1 1 52 ARG HH12 H -4.058 -1.255 9.109 1.00 . A A . 52 ARG HH12 1 1 9 7989 1 1 52 ARG HH21 H -0.949 -2.794 9.610 1.00 . A A . 52 ARG HH21 1 1 9 7990 1 1 52 ARG HH22 H -2.241 -1.887 10.344 1.00 . A A . 52 ARG HH22 1 1 9 7991 1 1 52 ARG N N -2.553 -6.943 3.178 1.00 . A A . 52 ARG N 1 1 9 7992 1 1 52 ARG NE N -1.932 -2.871 7.293 1.00 . A A . 52 ARG NE 1 1 9 7993 1 1 52 ARG NH1 N -3.658 -1.697 8.293 1.00 . A A . 52 ARG NH1 1 1 9 7994 1 1 52 ARG NH2 N -1.837 -2.327 9.530 1.00 . A A . 52 ARG NH2 1 1 9 7995 1 1 52 ARG O O -5.733 -6.430 4.376 1.00 . A A . 52 ARG O 1 1 9 7996 1 1 53 CYS C C -6.779 -6.366 1.051 1.00 . A A . 53 CYS C 1 1 9 7997 1 1 53 CYS CA C -6.332 -5.245 1.968 1.00 . A A . 53 CYS CA 1 1 9 7998 1 1 53 CYS CB C -6.382 -3.910 1.240 1.00 . A A . 53 CYS CB 1 1 9 7999 1 1 53 CYS H H -4.243 -5.191 1.943 1.00 . A A . 53 CYS H 1 1 9 8000 1 1 53 CYS HA H -7.001 -5.205 2.813 1.00 . A A . 53 CYS HA 1 1 9 8001 1 1 53 CYS HB2 H -7.009 -4.009 0.371 1.00 . A A . 53 CYS HB2 1 1 9 8002 1 1 53 CYS HB3 H -6.799 -3.168 1.900 1.00 . A A . 53 CYS HB3 1 1 9 8003 1 1 53 CYS N N -5.001 -5.487 2.475 1.00 . A A . 53 CYS N 1 1 9 8004 1 1 53 CYS O O -7.047 -6.156 -0.129 1.00 . A A . 53 CYS O 1 1 9 8005 1 1 53 CYS SG S -4.762 -3.303 0.683 1.00 . A A . 53 CYS SG 1 1 9 8006 1 1 54 THR C C -8.914 -8.350 0.461 1.00 . A A . 54 THR C 1 1 9 8007 1 1 54 THR CA C -7.483 -8.671 0.894 1.00 . A A . 54 THR CA 1 1 9 8008 1 1 54 THR CB C -7.438 -9.941 1.756 1.00 . A A . 54 THR CB 1 1 9 8009 1 1 54 THR CG2 C -6.265 -10.814 1.344 1.00 . A A . 54 THR CG2 1 1 9 8010 1 1 54 THR H H -6.747 -7.634 2.582 1.00 . A A . 54 THR H 1 1 9 8011 1 1 54 THR HA H -6.874 -8.828 0.015 1.00 . A A . 54 THR HA 1 1 9 8012 1 1 54 THR HB H -8.355 -10.496 1.618 1.00 . A A . 54 THR HB 1 1 9 8013 1 1 54 THR HG1 H -6.758 -10.246 3.594 1.00 . A A . 54 THR HG1 1 1 9 8014 1 1 54 THR HG21 H -6.484 -11.286 0.398 1.00 . A A . 54 THR HG21 1 1 9 8015 1 1 54 THR HG22 H -6.097 -11.572 2.095 1.00 . A A . 54 THR HG22 1 1 9 8016 1 1 54 THR HG23 H -5.379 -10.201 1.246 1.00 . A A . 54 THR HG23 1 1 9 8017 1 1 54 THR N N -6.939 -7.542 1.625 1.00 . A A . 54 THR N 1 1 9 8018 1 1 54 THR O O -9.318 -8.635 -0.669 1.00 . A A . 54 THR O 1 1 9 8019 1 1 54 THR OG1 O -7.299 -9.581 3.140 1.00 . A A . 54 THR OG1 1 1 9 8020 1 1 55 CYS C C -10.666 -5.374 1.238 1.00 . A A . 55 CYS C 1 1 9 8021 1 1 55 CYS CA C -10.789 -6.853 0.888 1.00 . A A . 55 CYS CA 1 1 9 8022 1 1 55 CYS CB C -11.985 -7.471 1.617 1.00 . A A . 55 CYS CB 1 1 9 8023 1 1 55 CYS H H -9.072 -7.173 2.051 1.00 . A A . 55 CYS H 1 1 9 8024 1 1 55 CYS HA H -10.918 -6.958 -0.180 1.00 . A A . 55 CYS HA 1 1 9 8025 1 1 55 CYS HB2 H -12.373 -6.753 2.324 1.00 . A A . 55 CYS HB2 1 1 9 8026 1 1 55 CYS HB3 H -12.753 -7.706 0.895 1.00 . A A . 55 CYS HB3 1 1 9 8027 1 1 55 CYS HG H -11.423 -9.961 1.643 1.00 . A A . 55 CYS HG 1 1 9 8028 1 1 55 CYS N N -9.549 -7.509 1.264 1.00 . A A . 55 CYS N 1 1 9 8029 1 1 55 CYS O O -10.380 -5.040 2.387 1.00 . A A . 55 CYS O 1 1 9 8030 1 1 55 CYS SG S -11.604 -8.986 2.529 1.00 . A A . 55 CYS SG 1 1 9 8031 1 1 56 PRO C C -11.395 -2.473 1.529 1.00 . A A . 56 PRO C 1 1 9 8032 1 1 56 PRO CA C -10.490 -3.043 0.443 1.00 . A A . 56 PRO CA 1 1 9 8033 1 1 56 PRO CB C -10.818 -2.414 -0.920 1.00 . A A . 56 PRO CB 1 1 9 8034 1 1 56 PRO CD C -10.874 -4.800 -1.183 1.00 . A A . 56 PRO CD 1 1 9 8035 1 1 56 PRO CG C -11.390 -3.513 -1.757 1.00 . A A . 56 PRO CG 1 1 9 8036 1 1 56 PRO HA H -9.461 -2.842 0.696 1.00 . A A . 56 PRO HA 1 1 9 8037 1 1 56 PRO HB2 H -11.533 -1.617 -0.782 1.00 . A A . 56 PRO HB2 1 1 9 8038 1 1 56 PRO HB3 H -9.914 -2.017 -1.358 1.00 . A A . 56 PRO HB3 1 1 9 8039 1 1 56 PRO HD2 H -11.596 -5.593 -1.324 1.00 . A A . 56 PRO HD2 1 1 9 8040 1 1 56 PRO HD3 H -9.927 -5.064 -1.630 1.00 . A A . 56 PRO HD3 1 1 9 8041 1 1 56 PRO HG2 H -12.468 -3.491 -1.709 1.00 . A A . 56 PRO HG2 1 1 9 8042 1 1 56 PRO HG3 H -11.058 -3.403 -2.780 1.00 . A A . 56 PRO HG3 1 1 9 8043 1 1 56 PRO N N -10.714 -4.480 0.237 1.00 . A A . 56 PRO N 1 1 9 8044 1 1 56 PRO O O -10.950 -1.725 2.400 1.00 . A A . 56 PRO O 1 1 9 8045 1 1 57 ALA C C -13.680 -3.769 3.581 1.00 . A A . 57 ALA C 1 1 9 8046 1 1 57 ALA CA C -13.553 -2.602 2.612 1.00 . A A . 57 ALA CA 1 1 9 8047 1 1 57 ALA CB C -14.908 -2.229 2.034 1.00 . A A . 57 ALA CB 1 1 9 8048 1 1 57 ALA H H -12.892 -3.625 0.893 1.00 . A A . 57 ALA H 1 1 9 8049 1 1 57 ALA HA H -13.160 -1.745 3.138 1.00 . A A . 57 ALA HA 1 1 9 8050 1 1 57 ALA HB1 H -15.572 -3.078 2.097 1.00 . A A . 57 ALA HB1 1 1 9 8051 1 1 57 ALA HB2 H -15.324 -1.405 2.595 1.00 . A A . 57 ALA HB2 1 1 9 8052 1 1 57 ALA HB3 H -14.792 -1.939 1.000 1.00 . A A . 57 ALA HB3 1 1 9 8053 1 1 57 ALA N N -12.629 -2.946 1.553 1.00 . A A . 57 ALA N 1 1 9 8054 1 1 57 ALA O O -14.560 -4.620 3.433 1.00 . A A . 57 ALA O 1 1 9 8055 1 1 58 LEU C C -13.893 -4.875 6.416 1.00 . A A . 58 LEU C 1 1 9 8056 1 1 58 LEU CA C -12.694 -4.944 5.476 1.00 . A A . 58 LEU CA 1 1 9 8057 1 1 58 LEU CB C -11.393 -4.897 6.287 1.00 . A A . 58 LEU CB 1 1 9 8058 1 1 58 LEU CD1 C -8.997 -4.188 6.103 1.00 . A A . 58 LEU CD1 1 1 9 8059 1 1 58 LEU CD2 C -9.685 -6.470 5.346 1.00 . A A . 58 LEU CD2 1 1 9 8060 1 1 58 LEU CG C -10.105 -5.013 5.468 1.00 . A A . 58 LEU CG 1 1 9 8061 1 1 58 LEU H H -12.029 -3.174 4.529 1.00 . A A . 58 LEU H 1 1 9 8062 1 1 58 LEU HA H -12.736 -5.872 4.928 1.00 . A A . 58 LEU HA 1 1 9 8063 1 1 58 LEU HB2 H -11.367 -3.963 6.828 1.00 . A A . 58 LEU HB2 1 1 9 8064 1 1 58 LEU HB3 H -11.410 -5.706 7.001 1.00 . A A . 58 LEU HB3 1 1 9 8065 1 1 58 LEU HD11 H -8.505 -3.600 5.341 1.00 . A A . 58 LEU HD11 1 1 9 8066 1 1 58 LEU HD12 H -9.421 -3.530 6.847 1.00 . A A . 58 LEU HD12 1 1 9 8067 1 1 58 LEU HD13 H -8.280 -4.846 6.570 1.00 . A A . 58 LEU HD13 1 1 9 8068 1 1 58 LEU HD21 H -8.759 -6.623 5.881 1.00 . A A . 58 LEU HD21 1 1 9 8069 1 1 58 LEU HD22 H -10.453 -7.102 5.767 1.00 . A A . 58 LEU HD22 1 1 9 8070 1 1 58 LEU HD23 H -9.544 -6.719 4.305 1.00 . A A . 58 LEU HD23 1 1 9 8071 1 1 58 LEU HG H -10.281 -4.629 4.474 1.00 . A A . 58 LEU HG 1 1 9 8072 1 1 58 LEU N N -12.738 -3.851 4.513 1.00 . A A . 58 LEU N 1 1 9 8073 1 1 58 LEU O O -13.902 -4.102 7.377 1.00 . A A . 58 LEU O 1 1 9 8074 1 1 59 LYS C C -16.438 -7.007 7.437 1.00 . A A . 59 LYS C 1 1 9 8075 1 1 59 LYS CA C -16.153 -5.620 6.872 1.00 . A A . 59 LYS CA 1 1 9 8076 1 1 59 LYS CB C -17.326 -5.142 6.009 1.00 . A A . 59 LYS CB 1 1 9 8077 1 1 59 LYS CD C -18.317 -3.291 4.618 1.00 . A A . 59 LYS CD 1 1 9 8078 1 1 59 LYS CE C -17.982 -3.510 3.153 1.00 . A A . 59 LYS CE 1 1 9 8079 1 1 59 LYS CG C -17.171 -3.708 5.523 1.00 . A A . 59 LYS CG 1 1 9 8080 1 1 59 LYS H H -14.883 -6.184 5.276 1.00 . A A . 59 LYS H 1 1 9 8081 1 1 59 LYS HA H -16.017 -4.932 7.693 1.00 . A A . 59 LYS HA 1 1 9 8082 1 1 59 LYS HB2 H -17.410 -5.786 5.144 1.00 . A A . 59 LYS HB2 1 1 9 8083 1 1 59 LYS HB3 H -18.235 -5.208 6.587 1.00 . A A . 59 LYS HB3 1 1 9 8084 1 1 59 LYS HD2 H -19.191 -3.874 4.868 1.00 . A A . 59 LYS HD2 1 1 9 8085 1 1 59 LYS HD3 H -18.525 -2.244 4.777 1.00 . A A . 59 LYS HD3 1 1 9 8086 1 1 59 LYS HE2 H -16.910 -3.465 3.033 1.00 . A A . 59 LYS HE2 1 1 9 8087 1 1 59 LYS HE3 H -18.334 -4.487 2.858 1.00 . A A . 59 LYS HE3 1 1 9 8088 1 1 59 LYS HG2 H -17.147 -3.050 6.379 1.00 . A A . 59 LYS HG2 1 1 9 8089 1 1 59 LYS HG3 H -16.245 -3.623 4.977 1.00 . A A . 59 LYS HG3 1 1 9 8090 1 1 59 LYS HZ1 H -19.643 -2.475 2.418 1.00 . A A . 59 LYS HZ1 1 1 9 8091 1 1 59 LYS HZ2 H -18.409 -2.701 1.273 1.00 . A A . 59 LYS HZ2 1 1 9 8092 1 1 59 LYS HZ3 H -18.230 -1.541 2.500 1.00 . A A . 59 LYS HZ3 1 1 9 8093 1 1 59 LYS N N -14.928 -5.632 6.092 1.00 . A A . 59 LYS N 1 1 9 8094 1 1 59 LYS NZ N -18.609 -2.485 2.277 1.00 . A A . 59 LYS NZ 1 1 9 8095 1 1 59 LYS O O -16.936 -7.144 8.556 1.00 . A A . 59 LYS O 1 1 9 8096 1 1 60 GLY C C -15.059 -10.260 6.949 1.00 . A A . 60 GLY C 1 1 9 8097 1 1 60 GLY CA C -16.291 -9.398 7.132 1.00 . A A . 60 GLY CA 1 1 9 8098 1 1 60 GLY H H -15.665 -7.871 5.803 1.00 . A A . 60 GLY H 1 1 9 8099 1 1 60 GLY HA2 H -16.554 -9.381 8.180 1.00 . A A . 60 GLY HA2 1 1 9 8100 1 1 60 GLY HA3 H -17.109 -9.831 6.575 1.00 . A A . 60 GLY HA3 1 1 9 8101 1 1 60 GLY N N -16.083 -8.036 6.680 1.00 . A A . 60 GLY N 1 1 9 8102 1 1 60 GLY O O -15.000 -11.087 6.040 1.00 . A A . 60 GLY O 1 1 9 8103 1 1 61 LYS C C -12.803 -11.877 8.860 1.00 . A A . 61 LYS C 1 1 9 8104 1 1 61 LYS CA C -12.844 -10.843 7.744 1.00 . A A . 61 LYS CA 1 1 9 8105 1 1 61 LYS CB C -11.625 -9.921 7.835 1.00 . A A . 61 LYS CB 1 1 9 8106 1 1 61 LYS CD C -10.306 -11.105 6.049 1.00 . A A . 61 LYS CD 1 1 9 8107 1 1 61 LYS CE C -9.882 -11.044 4.591 1.00 . A A . 61 LYS CE 1 1 9 8108 1 1 61 LYS CG C -10.875 -9.777 6.520 1.00 . A A . 61 LYS CG 1 1 9 8109 1 1 61 LYS H H -14.185 -9.407 8.533 1.00 . A A . 61 LYS H 1 1 9 8110 1 1 61 LYS HA H -12.829 -11.358 6.794 1.00 . A A . 61 LYS HA 1 1 9 8111 1 1 61 LYS HB2 H -11.952 -8.939 8.145 1.00 . A A . 61 LYS HB2 1 1 9 8112 1 1 61 LYS HB3 H -10.941 -10.314 8.573 1.00 . A A . 61 LYS HB3 1 1 9 8113 1 1 61 LYS HD2 H -9.446 -11.352 6.651 1.00 . A A . 61 LYS HD2 1 1 9 8114 1 1 61 LYS HD3 H -11.061 -11.870 6.164 1.00 . A A . 61 LYS HD3 1 1 9 8115 1 1 61 LYS HE2 H -10.202 -10.101 4.175 1.00 . A A . 61 LYS HE2 1 1 9 8116 1 1 61 LYS HE3 H -8.805 -11.111 4.540 1.00 . A A . 61 LYS HE3 1 1 9 8117 1 1 61 LYS HG2 H -11.556 -9.405 5.769 1.00 . A A . 61 LYS HG2 1 1 9 8118 1 1 61 LYS HG3 H -10.066 -9.076 6.654 1.00 . A A . 61 LYS HG3 1 1 9 8119 1 1 61 LYS HZ1 H -11.395 -11.861 3.399 1.00 . A A . 61 LYS HZ1 1 1 9 8120 1 1 61 LYS HZ2 H -10.610 -12.991 4.392 1.00 . A A . 61 LYS HZ2 1 1 9 8121 1 1 61 LYS HZ3 H -9.832 -12.403 3.004 1.00 . A A . 61 LYS HZ3 1 1 9 8122 1 1 61 LYS N N -14.075 -10.071 7.814 1.00 . A A . 61 LYS N 1 1 9 8123 1 1 61 LYS NZ N -10.471 -12.149 3.792 1.00 . A A . 61 LYS NZ 1 1 9 8124 1 1 61 LYS O O -11.898 -12.735 8.846 1.00 . A A . 61 LYS O 1 1 9 8125 1 1 61 LYS OXT O -13.693 -11.837 9.741 1.00 . A A . 61 LYS OXT 1 1 9 8126 2 2 1 ZN ZN ZN -4.665 -3.633 -1.587 1.00 . B A . 62 ZN ZN 1 1 9 8127 3 2 1 ZN ZN ZN 3.935 4.382 4.443 1.00 . C A . 63 ZN ZN 1 1 10 8128 1 1 1 GLY C C -7.531 14.775 0.336 1.00 . A A . 1 GLY C 1 1 10 8129 1 1 1 GLY CA C -6.520 15.503 -0.524 1.00 . A A . 1 GLY CA 1 1 10 8130 1 1 1 GLY H1 H -4.982 14.986 0.783 1.00 . A A . 1 GLY H1 1 1 10 8131 1 1 1 GLY H2 H -4.450 15.727 -0.648 1.00 . A A . 1 GLY H2 1 1 10 8132 1 1 1 GLY H3 H -4.975 14.112 -0.673 1.00 . A A . 1 GLY H3 1 1 10 8133 1 1 1 GLY HA2 H -6.591 16.563 -0.327 1.00 . A A . 1 GLY HA2 1 1 10 8134 1 1 1 GLY HA3 H -6.747 15.324 -1.565 1.00 . A A . 1 GLY HA3 1 1 10 8135 1 1 1 GLY N N -5.136 15.053 -0.248 1.00 . A A . 1 GLY N 1 1 10 8136 1 1 1 GLY O O -7.491 13.547 0.431 1.00 . A A . 1 GLY O 1 1 10 8137 1 1 2 PRO C C -10.335 13.912 1.210 1.00 . A A . 2 PRO C 1 1 10 8138 1 1 2 PRO CA C -9.435 14.925 1.912 1.00 . A A . 2 PRO CA 1 1 10 8139 1 1 2 PRO CB C -10.257 16.134 2.370 1.00 . A A . 2 PRO CB 1 1 10 8140 1 1 2 PRO CD C -8.503 16.981 0.992 1.00 . A A . 2 PRO CD 1 1 10 8141 1 1 2 PRO CG C -9.353 17.302 2.187 1.00 . A A . 2 PRO CG 1 1 10 8142 1 1 2 PRO HA H -8.973 14.458 2.769 1.00 . A A . 2 PRO HA 1 1 10 8143 1 1 2 PRO HB2 H -11.145 16.221 1.760 1.00 . A A . 2 PRO HB2 1 1 10 8144 1 1 2 PRO HB3 H -10.537 16.011 3.406 1.00 . A A . 2 PRO HB3 1 1 10 8145 1 1 2 PRO HD2 H -8.976 17.333 0.087 1.00 . A A . 2 PRO HD2 1 1 10 8146 1 1 2 PRO HD3 H -7.521 17.417 1.100 1.00 . A A . 2 PRO HD3 1 1 10 8147 1 1 2 PRO HG2 H -9.935 18.194 2.004 1.00 . A A . 2 PRO HG2 1 1 10 8148 1 1 2 PRO HG3 H -8.735 17.429 3.064 1.00 . A A . 2 PRO HG3 1 1 10 8149 1 1 2 PRO N N -8.430 15.510 1.011 1.00 . A A . 2 PRO N 1 1 10 8150 1 1 2 PRO O O -10.722 12.898 1.794 1.00 . A A . 2 PRO O 1 1 10 8151 1 1 3 LEU C C -10.658 12.554 -1.888 1.00 . A A . 3 LEU C 1 1 10 8152 1 1 3 LEU CA C -11.484 13.283 -0.834 1.00 . A A . 3 LEU CA 1 1 10 8153 1 1 3 LEU CB C -12.615 14.069 -1.502 1.00 . A A . 3 LEU CB 1 1 10 8154 1 1 3 LEU CD1 C -14.791 15.295 -1.292 1.00 . A A . 3 LEU CD1 1 1 10 8155 1 1 3 LEU CD2 C -14.556 13.003 -0.325 1.00 . A A . 3 LEU CD2 1 1 10 8156 1 1 3 LEU CG C -13.842 14.313 -0.622 1.00 . A A . 3 LEU CG 1 1 10 8157 1 1 3 LEU H H -10.279 14.987 -0.478 1.00 . A A . 3 LEU H 1 1 10 8158 1 1 3 LEU HA H -11.910 12.556 -0.159 1.00 . A A . 3 LEU HA 1 1 10 8159 1 1 3 LEU HB2 H -12.224 15.026 -1.813 1.00 . A A . 3 LEU HB2 1 1 10 8160 1 1 3 LEU HB3 H -12.932 13.527 -2.379 1.00 . A A . 3 LEU HB3 1 1 10 8161 1 1 3 LEU HD11 H -15.475 15.691 -0.557 1.00 . A A . 3 LEU HD11 1 1 10 8162 1 1 3 LEU HD12 H -14.224 16.104 -1.730 1.00 . A A . 3 LEU HD12 1 1 10 8163 1 1 3 LEU HD13 H -15.348 14.787 -2.065 1.00 . A A . 3 LEU HD13 1 1 10 8164 1 1 3 LEU HD21 H -15.042 12.646 -1.220 1.00 . A A . 3 LEU HD21 1 1 10 8165 1 1 3 LEU HD22 H -13.837 12.268 0.012 1.00 . A A . 3 LEU HD22 1 1 10 8166 1 1 3 LEU HD23 H -15.294 13.163 0.447 1.00 . A A . 3 LEU HD23 1 1 10 8167 1 1 3 LEU HG H -13.526 14.743 0.317 1.00 . A A . 3 LEU HG 1 1 10 8168 1 1 3 LEU N N -10.641 14.176 -0.053 1.00 . A A . 3 LEU N 1 1 10 8169 1 1 3 LEU O O -11.187 12.092 -2.900 1.00 . A A . 3 LEU O 1 1 10 8170 1 1 4 GLY C C -8.291 10.328 -2.274 1.00 . A A . 4 GLY C 1 1 10 8171 1 1 4 GLY CA C -8.465 11.801 -2.578 1.00 . A A . 4 GLY CA 1 1 10 8172 1 1 4 GLY H H -8.995 12.845 -0.815 1.00 . A A . 4 GLY H 1 1 10 8173 1 1 4 GLY HA2 H -8.865 11.909 -3.575 1.00 . A A . 4 GLY HA2 1 1 10 8174 1 1 4 GLY HA3 H -7.499 12.282 -2.534 1.00 . A A . 4 GLY HA3 1 1 10 8175 1 1 4 GLY N N -9.356 12.458 -1.642 1.00 . A A . 4 GLY N 1 1 10 8176 1 1 4 GLY O O -7.380 9.680 -2.791 1.00 . A A . 4 GLY O 1 1 10 8177 1 1 5 SER C C -10.427 7.713 -1.349 1.00 . A A . 5 SER C 1 1 10 8178 1 1 5 SER CA C -9.101 8.402 -1.043 1.00 . A A . 5 SER CA 1 1 10 8179 1 1 5 SER CB C -8.767 8.284 0.446 1.00 . A A . 5 SER CB 1 1 10 8180 1 1 5 SER H H -9.853 10.373 -1.035 1.00 . A A . 5 SER H 1 1 10 8181 1 1 5 SER HA H -8.319 7.930 -1.618 1.00 . A A . 5 SER HA 1 1 10 8182 1 1 5 SER HB2 H -9.646 7.961 0.986 1.00 . A A . 5 SER HB2 1 1 10 8183 1 1 5 SER HB3 H -7.975 7.561 0.580 1.00 . A A . 5 SER HB3 1 1 10 8184 1 1 5 SER HG H -7.640 9.897 0.409 1.00 . A A . 5 SER HG 1 1 10 8185 1 1 5 SER N N -9.159 9.802 -1.425 1.00 . A A . 5 SER N 1 1 10 8186 1 1 5 SER O O -11.068 7.138 -0.464 1.00 . A A . 5 SER O 1 1 10 8187 1 1 5 SER OG O -8.342 9.534 0.971 1.00 . A A . 5 SER OG 1 1 10 8188 1 1 6 ASP C C -11.899 6.192 -4.120 1.00 . A A . 6 ASP C 1 1 10 8189 1 1 6 ASP CA C -12.116 7.215 -3.015 1.00 . A A . 6 ASP CA 1 1 10 8190 1 1 6 ASP CB C -13.075 8.302 -3.485 1.00 . A A . 6 ASP CB 1 1 10 8191 1 1 6 ASP CG C -14.514 7.981 -3.150 1.00 . A A . 6 ASP CG 1 1 10 8192 1 1 6 ASP H H -10.296 8.275 -3.261 1.00 . A A . 6 ASP H 1 1 10 8193 1 1 6 ASP HA H -12.545 6.715 -2.160 1.00 . A A . 6 ASP HA 1 1 10 8194 1 1 6 ASP HB2 H -12.814 9.236 -3.008 1.00 . A A . 6 ASP HB2 1 1 10 8195 1 1 6 ASP HB3 H -12.987 8.414 -4.555 1.00 . A A . 6 ASP HB3 1 1 10 8196 1 1 6 ASP N N -10.850 7.801 -2.598 1.00 . A A . 6 ASP N 1 1 10 8197 1 1 6 ASP O O -12.107 4.997 -3.916 1.00 . A A . 6 ASP O 1 1 10 8198 1 1 6 ASP OD1 O -14.754 7.201 -2.204 1.00 . A A . 6 ASP OD1 1 1 10 8199 1 1 6 ASP OD2 O -15.416 8.521 -3.822 1.00 . A A . 6 ASP OD2 1 1 10 8200 1 1 7 HIS C C -9.768 4.962 -5.936 1.00 . A A . 7 HIS C 1 1 10 8201 1 1 7 HIS CA C -10.994 5.762 -6.338 1.00 . A A . 7 HIS CA 1 1 10 8202 1 1 7 HIS CB C -10.697 6.572 -7.604 1.00 . A A . 7 HIS CB 1 1 10 8203 1 1 7 HIS CD2 C -10.118 4.742 -9.333 1.00 . A A . 7 HIS CD2 1 1 10 8204 1 1 7 HIS CE1 C -11.632 5.262 -10.810 1.00 . A A . 7 HIS CE1 1 1 10 8205 1 1 7 HIS CG C -10.840 5.794 -8.879 1.00 . A A . 7 HIS CG 1 1 10 8206 1 1 7 HIS H H -11.132 7.602 -5.307 1.00 . A A . 7 HIS H 1 1 10 8207 1 1 7 HIS HA H -11.817 5.086 -6.526 1.00 . A A . 7 HIS HA 1 1 10 8208 1 1 7 HIS HB2 H -11.374 7.410 -7.651 1.00 . A A . 7 HIS HB2 1 1 10 8209 1 1 7 HIS HB3 H -9.682 6.940 -7.554 1.00 . A A . 7 HIS HB3 1 1 10 8210 1 1 7 HIS HD2 H -9.298 4.253 -8.828 1.00 . A A . 7 HIS HD2 1 1 10 8211 1 1 7 HIS HE1 H -12.231 5.249 -11.708 1.00 . A A . 7 HIS HE1 1 1 10 8212 1 1 7 HIS HE2 H -10.202 3.814 -11.218 1.00 . A A . 7 HIS HE2 1 1 10 8213 1 1 7 HIS N N -11.365 6.653 -5.245 1.00 . A A . 7 HIS N 1 1 10 8214 1 1 7 HIS ND1 N -11.796 6.119 -9.814 1.00 . A A . 7 HIS ND1 1 1 10 8215 1 1 7 HIS NE2 N -10.628 4.412 -10.562 1.00 . A A . 7 HIS NE2 1 1 10 8216 1 1 7 HIS O O -9.683 3.753 -6.165 1.00 . A A . 7 HIS O 1 1 10 8217 1 1 8 HIS C C -7.285 5.722 -3.428 1.00 . A A . 8 HIS C 1 1 10 8218 1 1 8 HIS CA C -7.660 5.026 -4.732 1.00 . A A . 8 HIS CA 1 1 10 8219 1 1 8 HIS CB C -6.520 5.111 -5.754 1.00 . A A . 8 HIS CB 1 1 10 8220 1 1 8 HIS CD2 C -4.869 3.351 -4.848 1.00 . A A . 8 HIS CD2 1 1 10 8221 1 1 8 HIS CE1 C -4.815 2.081 -6.616 1.00 . A A . 8 HIS CE1 1 1 10 8222 1 1 8 HIS CG C -5.671 3.880 -5.802 1.00 . A A . 8 HIS CG 1 1 10 8223 1 1 8 HIS H H -9.028 6.592 -5.066 1.00 . A A . 8 HIS H 1 1 10 8224 1 1 8 HIS HA H -7.880 3.988 -4.527 1.00 . A A . 8 HIS HA 1 1 10 8225 1 1 8 HIS HB2 H -6.940 5.261 -6.737 1.00 . A A . 8 HIS HB2 1 1 10 8226 1 1 8 HIS HB3 H -5.884 5.948 -5.507 1.00 . A A . 8 HIS HB3 1 1 10 8227 1 1 8 HIS HD2 H -4.687 3.752 -3.862 1.00 . A A . 8 HIS HD2 1 1 10 8228 1 1 8 HIS HE1 H -4.570 1.269 -7.283 1.00 . A A . 8 HIS HE1 1 1 10 8229 1 1 8 HIS HE2 H -3.790 1.546 -4.884 1.00 . A A . 8 HIS HE2 1 1 10 8230 1 1 8 HIS N N -8.858 5.643 -5.264 1.00 . A A . 8 HIS N 1 1 10 8231 1 1 8 HIS ND1 N -5.632 3.075 -6.918 1.00 . A A . 8 HIS ND1 1 1 10 8232 1 1 8 HIS NE2 N -4.331 2.209 -5.374 1.00 . A A . 8 HIS NE2 1 1 10 8233 1 1 8 HIS O O -8.141 5.915 -2.564 1.00 . A A . 8 HIS O 1 1 10 8234 1 1 9 MET C C -4.220 7.552 -2.442 1.00 . A A . 9 MET C 1 1 10 8235 1 1 9 MET CA C -5.622 7.007 -2.198 1.00 . A A . 9 MET CA 1 1 10 8236 1 1 9 MET CB C -5.666 6.190 -0.893 1.00 . A A . 9 MET CB 1 1 10 8237 1 1 9 MET CE C -4.761 4.623 1.896 1.00 . A A . 9 MET CE 1 1 10 8238 1 1 9 MET CG C -4.702 5.015 -0.849 1.00 . A A . 9 MET CG 1 1 10 8239 1 1 9 MET H H -5.444 6.107 -4.101 1.00 . A A . 9 MET H 1 1 10 8240 1 1 9 MET HA H -6.304 7.842 -2.110 1.00 . A A . 9 MET HA 1 1 10 8241 1 1 9 MET HB2 H -5.433 6.845 -0.067 1.00 . A A . 9 MET HB2 1 1 10 8242 1 1 9 MET HB3 H -6.668 5.808 -0.760 1.00 . A A . 9 MET HB3 1 1 10 8243 1 1 9 MET HE1 H -5.254 5.583 1.912 1.00 . A A . 9 MET HE1 1 1 10 8244 1 1 9 MET HE2 H -5.093 4.032 2.737 1.00 . A A . 9 MET HE2 1 1 10 8245 1 1 9 MET HE3 H -3.693 4.765 1.955 1.00 . A A . 9 MET HE3 1 1 10 8246 1 1 9 MET HG2 H -4.677 4.551 -1.823 1.00 . A A . 9 MET HG2 1 1 10 8247 1 1 9 MET HG3 H -3.718 5.389 -0.606 1.00 . A A . 9 MET HG3 1 1 10 8248 1 1 9 MET N N -6.054 6.211 -3.341 1.00 . A A . 9 MET N 1 1 10 8249 1 1 9 MET O O -3.328 6.823 -2.882 1.00 . A A . 9 MET O 1 1 10 8250 1 1 9 MET SD S -5.164 3.771 0.375 1.00 . A A . 9 MET SD 1 1 10 8251 1 1 10 GLU C C -1.922 9.493 -1.162 1.00 . A A . 10 GLU C 1 1 10 8252 1 1 10 GLU CA C -2.756 9.496 -2.438 1.00 . A A . 10 GLU CA 1 1 10 8253 1 1 10 GLU CB C -2.955 10.930 -2.937 1.00 . A A . 10 GLU CB 1 1 10 8254 1 1 10 GLU CD C -4.823 12.571 -2.543 1.00 . A A . 10 GLU CD 1 1 10 8255 1 1 10 GLU CG C -4.403 11.290 -3.224 1.00 . A A . 10 GLU CG 1 1 10 8256 1 1 10 GLU H H -4.801 9.382 -1.894 1.00 . A A . 10 GLU H 1 1 10 8257 1 1 10 GLU HA H -2.231 8.931 -3.194 1.00 . A A . 10 GLU HA 1 1 10 8258 1 1 10 GLU HB2 H -2.580 11.611 -2.188 1.00 . A A . 10 GLU HB2 1 1 10 8259 1 1 10 GLU HB3 H -2.387 11.062 -3.847 1.00 . A A . 10 GLU HB3 1 1 10 8260 1 1 10 GLU HG2 H -4.527 11.409 -4.289 1.00 . A A . 10 GLU HG2 1 1 10 8261 1 1 10 GLU HG3 H -5.038 10.488 -2.875 1.00 . A A . 10 GLU HG3 1 1 10 8262 1 1 10 GLU N N -4.042 8.844 -2.208 1.00 . A A . 10 GLU N 1 1 10 8263 1 1 10 GLU O O -1.198 10.445 -0.864 1.00 . A A . 10 GLU O 1 1 10 8264 1 1 10 GLU OE1 O -4.716 12.653 -1.302 1.00 . A A . 10 GLU OE1 1 1 10 8265 1 1 10 GLU OE2 O -5.263 13.503 -3.246 1.00 . A A . 10 GLU OE2 1 1 10 8266 1 1 11 PHE C C -1.287 6.751 1.186 1.00 . A A . 11 PHE C 1 1 10 8267 1 1 11 PHE CA C -1.284 8.221 0.812 1.00 . A A . 11 PHE CA 1 1 10 8268 1 1 11 PHE CB C -1.874 9.075 1.946 1.00 . A A . 11 PHE CB 1 1 10 8269 1 1 11 PHE CD1 C -4.325 8.640 1.617 1.00 . A A . 11 PHE CD1 1 1 10 8270 1 1 11 PHE CD2 C -3.366 8.151 3.741 1.00 . A A . 11 PHE CD2 1 1 10 8271 1 1 11 PHE CE1 C -5.557 8.220 2.072 1.00 . A A . 11 PHE CE1 1 1 10 8272 1 1 11 PHE CE2 C -4.598 7.731 4.204 1.00 . A A . 11 PHE CE2 1 1 10 8273 1 1 11 PHE CG C -3.215 8.610 2.444 1.00 . A A . 11 PHE CG 1 1 10 8274 1 1 11 PHE CZ C -5.696 7.766 3.367 1.00 . A A . 11 PHE CZ 1 1 10 8275 1 1 11 PHE H H -2.600 7.671 -0.738 1.00 . A A . 11 PHE H 1 1 10 8276 1 1 11 PHE HA H -0.261 8.527 0.635 1.00 . A A . 11 PHE HA 1 1 10 8277 1 1 11 PHE HB2 H -1.191 9.065 2.782 1.00 . A A . 11 PHE HB2 1 1 10 8278 1 1 11 PHE HB3 H -1.986 10.090 1.595 1.00 . A A . 11 PHE HB3 1 1 10 8279 1 1 11 PHE HD1 H -4.220 8.995 0.602 1.00 . A A . 11 PHE HD1 1 1 10 8280 1 1 11 PHE HD2 H -2.507 8.125 4.398 1.00 . A A . 11 PHE HD2 1 1 10 8281 1 1 11 PHE HE1 H -6.413 8.249 1.416 1.00 . A A . 11 PHE HE1 1 1 10 8282 1 1 11 PHE HE2 H -4.703 7.374 5.217 1.00 . A A . 11 PHE HE2 1 1 10 8283 1 1 11 PHE HZ H -6.662 7.440 3.727 1.00 . A A . 11 PHE HZ 1 1 10 8284 1 1 11 PHE N N -2.027 8.402 -0.423 1.00 . A A . 11 PHE N 1 1 10 8285 1 1 11 PHE O O -2.010 5.956 0.589 1.00 . A A . 11 PHE O 1 1 10 8286 1 1 12 CYS C C -1.076 4.649 3.684 1.00 . A A . 12 CYS C 1 1 10 8287 1 1 12 CYS CA C -0.238 4.987 2.455 1.00 . A A . 12 CYS CA 1 1 10 8288 1 1 12 CYS CB C 1.241 4.711 2.689 1.00 . A A . 12 CYS CB 1 1 10 8289 1 1 12 CYS H H 0.207 7.051 2.460 1.00 . A A . 12 CYS H 1 1 10 8290 1 1 12 CYS HA H -0.579 4.385 1.628 1.00 . A A . 12 CYS HA 1 1 10 8291 1 1 12 CYS HB2 H 1.572 3.938 2.013 1.00 . A A . 12 CYS HB2 1 1 10 8292 1 1 12 CYS HB3 H 1.794 5.618 2.486 1.00 . A A . 12 CYS HB3 1 1 10 8293 1 1 12 CYS HG H 2.508 5.126 4.830 1.00 . A A . 12 CYS HG 1 1 10 8294 1 1 12 CYS N N -0.404 6.379 2.087 1.00 . A A . 12 CYS N 1 1 10 8295 1 1 12 CYS O O -1.515 5.543 4.401 1.00 . A A . 12 CYS O 1 1 10 8296 1 1 12 CYS SG S 1.671 4.202 4.354 1.00 . A A . 12 CYS SG 1 1 10 8297 1 1 13 ARG C C -1.652 2.973 6.283 1.00 . A A . 13 ARG C 1 1 10 8298 1 1 13 ARG CA C -2.318 2.955 4.905 1.00 . A A . 13 ARG CA 1 1 10 8299 1 1 13 ARG CB C -2.869 1.559 4.609 1.00 . A A . 13 ARG CB 1 1 10 8300 1 1 13 ARG CD C -4.897 0.696 3.394 1.00 . A A . 13 ARG CD 1 1 10 8301 1 1 13 ARG CG C -3.585 1.455 3.269 1.00 . A A . 13 ARG CG 1 1 10 8302 1 1 13 ARG CZ C -5.330 -1.220 4.890 1.00 . A A . 13 ARG CZ 1 1 10 8303 1 1 13 ARG H H -1.131 2.723 3.163 1.00 . A A . 13 ARG H 1 1 10 8304 1 1 13 ARG HA H -3.142 3.655 4.922 1.00 . A A . 13 ARG HA 1 1 10 8305 1 1 13 ARG HB2 H -2.049 0.855 4.611 1.00 . A A . 13 ARG HB2 1 1 10 8306 1 1 13 ARG HB3 H -3.566 1.288 5.387 1.00 . A A . 13 ARG HB3 1 1 10 8307 1 1 13 ARG HD2 H -5.529 1.212 4.101 1.00 . A A . 13 ARG HD2 1 1 10 8308 1 1 13 ARG HD3 H -5.380 0.674 2.428 1.00 . A A . 13 ARG HD3 1 1 10 8309 1 1 13 ARG HE H -4.028 -1.221 3.365 1.00 . A A . 13 ARG HE 1 1 10 8310 1 1 13 ARG HG2 H -3.793 2.451 2.904 1.00 . A A . 13 ARG HG2 1 1 10 8311 1 1 13 ARG HG3 H -2.946 0.939 2.567 1.00 . A A . 13 ARG HG3 1 1 10 8312 1 1 13 ARG HH11 H -6.443 0.428 5.307 1.00 . A A . 13 ARG HH11 1 1 10 8313 1 1 13 ARG HH12 H -6.707 -0.937 6.351 1.00 . A A . 13 ARG HH12 1 1 10 8314 1 1 13 ARG HH21 H -4.377 -2.999 4.736 1.00 . A A . 13 ARG HH21 1 1 10 8315 1 1 13 ARG HH22 H -5.525 -2.887 6.036 1.00 . A A . 13 ARG HH22 1 1 10 8316 1 1 13 ARG N N -1.410 3.375 3.842 1.00 . A A . 13 ARG N 1 1 10 8317 1 1 13 ARG NE N -4.694 -0.676 3.854 1.00 . A A . 13 ARG NE 1 1 10 8318 1 1 13 ARG NH1 N -6.231 -0.521 5.568 1.00 . A A . 13 ARG NH1 1 1 10 8319 1 1 13 ARG NH2 N -5.056 -2.469 5.246 1.00 . A A . 13 ARG NH2 1 1 10 8320 1 1 13 ARG O O -2.285 3.334 7.271 1.00 . A A . 13 ARG O 1 1 10 8321 1 1 14 VAL C C 0.904 3.883 7.965 1.00 . A A . 14 VAL C 1 1 10 8322 1 1 14 VAL CA C 0.319 2.511 7.631 1.00 . A A . 14 VAL CA 1 1 10 8323 1 1 14 VAL CB C 1.440 1.452 7.625 1.00 . A A . 14 VAL CB 1 1 10 8324 1 1 14 VAL CG1 C 2.084 1.336 8.998 1.00 . A A . 14 VAL CG1 1 1 10 8325 1 1 14 VAL CG2 C 0.893 0.105 7.174 1.00 . A A . 14 VAL CG2 1 1 10 8326 1 1 14 VAL H H 0.055 2.251 5.541 1.00 . A A . 14 VAL H 1 1 10 8327 1 1 14 VAL HA H -0.394 2.243 8.399 1.00 . A A . 14 VAL HA 1 1 10 8328 1 1 14 VAL HB H 2.198 1.763 6.921 1.00 . A A . 14 VAL HB 1 1 10 8329 1 1 14 VAL HG11 H 2.227 0.294 9.241 1.00 . A A . 14 VAL HG11 1 1 10 8330 1 1 14 VAL HG12 H 3.041 1.836 8.990 1.00 . A A . 14 VAL HG12 1 1 10 8331 1 1 14 VAL HG13 H 1.444 1.793 9.736 1.00 . A A . 14 VAL HG13 1 1 10 8332 1 1 14 VAL HG21 H 1.212 -0.660 7.864 1.00 . A A . 14 VAL HG21 1 1 10 8333 1 1 14 VAL HG22 H -0.186 0.143 7.152 1.00 . A A . 14 VAL HG22 1 1 10 8334 1 1 14 VAL HG23 H 1.267 -0.123 6.186 1.00 . A A . 14 VAL HG23 1 1 10 8335 1 1 14 VAL N N -0.395 2.551 6.354 1.00 . A A . 14 VAL N 1 1 10 8336 1 1 14 VAL O O 0.249 4.701 8.611 1.00 . A A . 14 VAL O 1 1 10 8337 1 1 15 CYS C C 2.029 6.444 6.496 1.00 . A A . 15 CYS C 1 1 10 8338 1 1 15 CYS CA C 2.643 5.510 7.517 1.00 . A A . 15 CYS CA 1 1 10 8339 1 1 15 CYS CB C 4.168 5.449 7.372 1.00 . A A . 15 CYS CB 1 1 10 8340 1 1 15 CYS H H 2.480 3.553 6.790 1.00 . A A . 15 CYS H 1 1 10 8341 1 1 15 CYS HA H 2.404 5.878 8.503 1.00 . A A . 15 CYS HA 1 1 10 8342 1 1 15 CYS HB2 H 4.502 6.334 6.855 1.00 . A A . 15 CYS HB2 1 1 10 8343 1 1 15 CYS HB3 H 4.607 5.438 8.360 1.00 . A A . 15 CYS HB3 1 1 10 8344 1 1 15 CYS N N 2.066 4.188 7.397 1.00 . A A . 15 CYS N 1 1 10 8345 1 1 15 CYS O O 2.560 6.551 5.395 1.00 . A A . 15 CYS O 1 1 10 8346 1 1 15 CYS SG S 4.832 4.001 6.461 1.00 . A A . 15 CYS SG 1 1 10 8347 1 1 16 LYS C C 0.567 8.830 5.274 1.00 . A A . 16 LYS C 1 1 10 8348 1 1 16 LYS CA C -0.103 7.626 5.918 1.00 . A A . 16 LYS CA 1 1 10 8349 1 1 16 LYS CB C -1.340 8.086 6.699 1.00 . A A . 16 LYS CB 1 1 10 8350 1 1 16 LYS CD C -3.468 7.192 7.688 1.00 . A A . 16 LYS CD 1 1 10 8351 1 1 16 LYS CE C -4.224 5.896 7.445 1.00 . A A . 16 LYS CE 1 1 10 8352 1 1 16 LYS CG C -1.968 6.996 7.549 1.00 . A A . 16 LYS CG 1 1 10 8353 1 1 16 LYS H H 0.394 6.499 7.601 1.00 . A A . 16 LYS H 1 1 10 8354 1 1 16 LYS HA H -0.423 6.954 5.143 1.00 . A A . 16 LYS HA 1 1 10 8355 1 1 16 LYS HB2 H -1.058 8.900 7.349 1.00 . A A . 16 LYS HB2 1 1 10 8356 1 1 16 LYS HB3 H -2.083 8.438 5.998 1.00 . A A . 16 LYS HB3 1 1 10 8357 1 1 16 LYS HD2 H -3.683 7.541 8.688 1.00 . A A . 16 LYS HD2 1 1 10 8358 1 1 16 LYS HD3 H -3.794 7.930 6.969 1.00 . A A . 16 LYS HD3 1 1 10 8359 1 1 16 LYS HE2 H -4.332 5.751 6.381 1.00 . A A . 16 LYS HE2 1 1 10 8360 1 1 16 LYS HE3 H -3.652 5.080 7.861 1.00 . A A . 16 LYS HE3 1 1 10 8361 1 1 16 LYS HG2 H -1.780 6.039 7.085 1.00 . A A . 16 LYS HG2 1 1 10 8362 1 1 16 LYS HG3 H -1.518 7.017 8.529 1.00 . A A . 16 LYS HG3 1 1 10 8363 1 1 16 LYS HZ1 H -5.918 4.926 8.188 1.00 . A A . 16 LYS HZ1 1 1 10 8364 1 1 16 LYS HZ2 H -6.246 6.427 7.468 1.00 . A A . 16 LYS HZ2 1 1 10 8365 1 1 16 LYS HZ3 H -5.536 6.364 9.006 1.00 . A A . 16 LYS HZ3 1 1 10 8366 1 1 16 LYS N N 0.790 6.864 6.802 1.00 . A A . 16 LYS N 1 1 10 8367 1 1 16 LYS NZ N -5.573 5.905 8.070 1.00 . A A . 16 LYS NZ 1 1 10 8368 1 1 16 LYS O O 0.230 9.983 5.544 1.00 . A A . 16 LYS O 1 1 10 8369 1 1 17 ASP C C 2.184 9.354 2.272 1.00 . A A . 17 ASP C 1 1 10 8370 1 1 17 ASP CA C 2.333 9.526 3.774 1.00 . A A . 17 ASP CA 1 1 10 8371 1 1 17 ASP CB C 3.797 9.350 4.172 1.00 . A A . 17 ASP CB 1 1 10 8372 1 1 17 ASP CG C 4.602 10.631 4.066 1.00 . A A . 17 ASP CG 1 1 10 8373 1 1 17 ASP H H 1.792 7.578 4.383 1.00 . A A . 17 ASP H 1 1 10 8374 1 1 17 ASP HA H 1.990 10.507 4.065 1.00 . A A . 17 ASP HA 1 1 10 8375 1 1 17 ASP HB2 H 3.840 8.998 5.193 1.00 . A A . 17 ASP HB2 1 1 10 8376 1 1 17 ASP HB3 H 4.246 8.607 3.528 1.00 . A A . 17 ASP HB3 1 1 10 8377 1 1 17 ASP N N 1.534 8.531 4.456 1.00 . A A . 17 ASP N 1 1 10 8378 1 1 17 ASP O O 1.724 8.306 1.814 1.00 . A A . 17 ASP O 1 1 10 8379 1 1 17 ASP OD1 O 4.899 11.065 2.935 1.00 . A A . 17 ASP OD1 1 1 10 8380 1 1 17 ASP OD2 O 4.959 11.205 5.115 1.00 . A A . 17 ASP OD2 1 1 10 8381 1 1 18 GLY C C 3.933 9.806 -0.476 1.00 . A A . 18 GLY C 1 1 10 8382 1 1 18 GLY CA C 2.598 10.255 0.078 1.00 . A A . 18 GLY CA 1 1 10 8383 1 1 18 GLY H H 3.044 11.123 1.948 1.00 . A A . 18 GLY H 1 1 10 8384 1 1 18 GLY HA2 H 1.837 9.545 -0.216 1.00 . A A . 18 GLY HA2 1 1 10 8385 1 1 18 GLY HA3 H 2.356 11.226 -0.332 1.00 . A A . 18 GLY HA3 1 1 10 8386 1 1 18 GLY N N 2.627 10.345 1.520 1.00 . A A . 18 GLY N 1 1 10 8387 1 1 18 GLY O O 4.419 8.726 -0.134 1.00 . A A . 18 GLY O 1 1 10 8388 1 1 19 GLY C C 5.806 9.286 -2.865 1.00 . A A . 19 GLY C 1 1 10 8389 1 1 19 GLY CA C 5.870 10.363 -1.807 1.00 . A A . 19 GLY CA 1 1 10 8390 1 1 19 GLY H H 4.153 11.544 -1.441 1.00 . A A . 19 GLY H 1 1 10 8391 1 1 19 GLY HA2 H 6.287 11.259 -2.244 1.00 . A A . 19 GLY HA2 1 1 10 8392 1 1 19 GLY HA3 H 6.515 10.030 -1.007 1.00 . A A . 19 GLY HA3 1 1 10 8393 1 1 19 GLY N N 4.563 10.669 -1.261 1.00 . A A . 19 GLY N 1 1 10 8394 1 1 19 GLY O O 4.938 9.324 -3.742 1.00 . A A . 19 GLY O 1 1 10 8395 1 1 20 GLU C C 5.736 6.079 -3.155 1.00 . A A . 20 GLU C 1 1 10 8396 1 1 20 GLU CA C 6.665 7.166 -3.671 1.00 . A A . 20 GLU CA 1 1 10 8397 1 1 20 GLU CB C 8.075 6.609 -3.856 1.00 . A A . 20 GLU CB 1 1 10 8398 1 1 20 GLU CD C 8.665 8.054 -5.833 1.00 . A A . 20 GLU CD 1 1 10 8399 1 1 20 GLU CG C 8.549 6.645 -5.297 1.00 . A A . 20 GLU CG 1 1 10 8400 1 1 20 GLU H H 7.299 8.288 -1.991 1.00 . A A . 20 GLU H 1 1 10 8401 1 1 20 GLU HA H 6.296 7.517 -4.623 1.00 . A A . 20 GLU HA 1 1 10 8402 1 1 20 GLU HB2 H 8.761 7.188 -3.258 1.00 . A A . 20 GLU HB2 1 1 10 8403 1 1 20 GLU HB3 H 8.093 5.583 -3.519 1.00 . A A . 20 GLU HB3 1 1 10 8404 1 1 20 GLU HG2 H 9.520 6.174 -5.355 1.00 . A A . 20 GLU HG2 1 1 10 8405 1 1 20 GLU HG3 H 7.847 6.098 -5.909 1.00 . A A . 20 GLU HG3 1 1 10 8406 1 1 20 GLU N N 6.673 8.293 -2.750 1.00 . A A . 20 GLU N 1 1 10 8407 1 1 20 GLU O O 6.034 5.413 -2.160 1.00 . A A . 20 GLU O 1 1 10 8408 1 1 20 GLU OE1 O 9.610 8.767 -5.442 1.00 . A A . 20 GLU OE1 1 1 10 8409 1 1 20 GLU OE2 O 7.813 8.457 -6.654 1.00 . A A . 20 GLU OE2 1 1 10 8410 1 1 21 LEU C C 3.365 3.898 -4.272 1.00 . A A . 21 LEU C 1 1 10 8411 1 1 21 LEU CA C 3.551 5.056 -3.305 1.00 . A A . 21 LEU CA 1 1 10 8412 1 1 21 LEU CB C 2.222 5.785 -3.116 1.00 . A A . 21 LEU CB 1 1 10 8413 1 1 21 LEU CD1 C 1.052 7.753 -2.113 1.00 . A A . 21 LEU CD1 1 1 10 8414 1 1 21 LEU CD2 C 2.005 5.981 -0.631 1.00 . A A . 21 LEU CD2 1 1 10 8415 1 1 21 LEU CG C 2.174 6.748 -1.931 1.00 . A A . 21 LEU CG 1 1 10 8416 1 1 21 LEU H H 4.359 6.594 -4.506 1.00 . A A . 21 LEU H 1 1 10 8417 1 1 21 LEU HA H 3.870 4.664 -2.352 1.00 . A A . 21 LEU HA 1 1 10 8418 1 1 21 LEU HB2 H 2.011 6.344 -4.017 1.00 . A A . 21 LEU HB2 1 1 10 8419 1 1 21 LEU HB3 H 1.446 5.046 -2.982 1.00 . A A . 21 LEU HB3 1 1 10 8420 1 1 21 LEU HD11 H 0.582 7.946 -1.160 1.00 . A A . 21 LEU HD11 1 1 10 8421 1 1 21 LEU HD12 H 1.454 8.673 -2.511 1.00 . A A . 21 LEU HD12 1 1 10 8422 1 1 21 LEU HD13 H 0.320 7.353 -2.801 1.00 . A A . 21 LEU HD13 1 1 10 8423 1 1 21 LEU HD21 H 1.017 6.158 -0.232 1.00 . A A . 21 LEU HD21 1 1 10 8424 1 1 21 LEU HD22 H 2.134 4.926 -0.816 1.00 . A A . 21 LEU HD22 1 1 10 8425 1 1 21 LEU HD23 H 2.745 6.312 0.083 1.00 . A A . 21 LEU HD23 1 1 10 8426 1 1 21 LEU HG H 3.105 7.294 -1.881 1.00 . A A . 21 LEU HG 1 1 10 8427 1 1 21 LEU N N 4.568 5.980 -3.766 1.00 . A A . 21 LEU N 1 1 10 8428 1 1 21 LEU O O 2.740 4.048 -5.325 1.00 . A A . 21 LEU O 1 1 10 8429 1 1 22 LEU C C 1.919 1.186 -4.291 1.00 . A A . 22 LEU C 1 1 10 8430 1 1 22 LEU CA C 3.391 1.494 -4.523 1.00 . A A . 22 LEU CA 1 1 10 8431 1 1 22 LEU CB C 4.279 0.333 -4.051 1.00 . A A . 22 LEU CB 1 1 10 8432 1 1 22 LEU CD1 C 3.721 -1.806 -5.238 1.00 . A A . 22 LEU CD1 1 1 10 8433 1 1 22 LEU CD2 C 4.146 -1.815 -2.772 1.00 . A A . 22 LEU CD2 1 1 10 8434 1 1 22 LEU CG C 3.580 -1.023 -3.941 1.00 . A A . 22 LEU CG 1 1 10 8435 1 1 22 LEU H H 4.042 2.644 -2.883 1.00 . A A . 22 LEU H 1 1 10 8436 1 1 22 LEU HA H 3.555 1.667 -5.576 1.00 . A A . 22 LEU HA 1 1 10 8437 1 1 22 LEU HB2 H 5.102 0.233 -4.745 1.00 . A A . 22 LEU HB2 1 1 10 8438 1 1 22 LEU HB3 H 4.679 0.587 -3.080 1.00 . A A . 22 LEU HB3 1 1 10 8439 1 1 22 LEU HD11 H 4.378 -1.274 -5.910 1.00 . A A . 22 LEU HD11 1 1 10 8440 1 1 22 LEU HD12 H 4.133 -2.781 -5.029 1.00 . A A . 22 LEU HD12 1 1 10 8441 1 1 22 LEU HD13 H 2.750 -1.917 -5.702 1.00 . A A . 22 LEU HD13 1 1 10 8442 1 1 22 LEU HD21 H 4.221 -1.174 -1.905 1.00 . A A . 22 LEU HD21 1 1 10 8443 1 1 22 LEU HD22 H 3.492 -2.646 -2.550 1.00 . A A . 22 LEU HD22 1 1 10 8444 1 1 22 LEU HD23 H 5.126 -2.186 -3.030 1.00 . A A . 22 LEU HD23 1 1 10 8445 1 1 22 LEU HG H 2.526 -0.865 -3.761 1.00 . A A . 22 LEU HG 1 1 10 8446 1 1 22 LEU N N 3.718 2.711 -3.808 1.00 . A A . 22 LEU N 1 1 10 8447 1 1 22 LEU O O 1.459 1.148 -3.150 1.00 . A A . 22 LEU O 1 1 10 8448 1 1 23 CYS C C -0.688 -0.470 -5.576 1.00 . A A . 23 CYS C 1 1 10 8449 1 1 23 CYS CA C -0.277 0.960 -5.255 1.00 . A A . 23 CYS CA 1 1 10 8450 1 1 23 CYS CB C -0.984 1.940 -6.194 1.00 . A A . 23 CYS CB 1 1 10 8451 1 1 23 CYS H H 1.564 1.240 -6.251 1.00 . A A . 23 CYS H 1 1 10 8452 1 1 23 CYS HA H -0.561 1.181 -4.237 1.00 . A A . 23 CYS HA 1 1 10 8453 1 1 23 CYS HB2 H -1.183 1.448 -7.134 1.00 . A A . 23 CYS HB2 1 1 10 8454 1 1 23 CYS HB3 H -1.918 2.245 -5.747 1.00 . A A . 23 CYS HB3 1 1 10 8455 1 1 23 CYS HG H 1.094 3.383 -5.839 1.00 . A A . 23 CYS HG 1 1 10 8456 1 1 23 CYS N N 1.159 1.122 -5.362 1.00 . A A . 23 CYS N 1 1 10 8457 1 1 23 CYS O O -0.071 -1.124 -6.420 1.00 . A A . 23 CYS O 1 1 10 8458 1 1 23 CYS SG S -0.028 3.436 -6.550 1.00 . A A . 23 CYS SG 1 1 10 8459 1 1 24 CYS C C -2.619 -2.533 -6.533 1.00 . A A . 24 CYS C 1 1 10 8460 1 1 24 CYS CA C -2.212 -2.295 -5.077 1.00 . A A . 24 CYS CA 1 1 10 8461 1 1 24 CYS CB C -3.415 -2.517 -4.176 1.00 . A A . 24 CYS CB 1 1 10 8462 1 1 24 CYS H H -2.120 -0.396 -4.178 1.00 . A A . 24 CYS H 1 1 10 8463 1 1 24 CYS HA H -1.435 -2.993 -4.807 1.00 . A A . 24 CYS HA 1 1 10 8464 1 1 24 CYS HB2 H -4.246 -1.940 -4.555 1.00 . A A . 24 CYS HB2 1 1 10 8465 1 1 24 CYS HB3 H -3.676 -3.565 -4.196 1.00 . A A . 24 CYS HB3 1 1 10 8466 1 1 24 CYS N N -1.707 -0.953 -4.878 1.00 . A A . 24 CYS N 1 1 10 8467 1 1 24 CYS O O -2.947 -1.593 -7.265 1.00 . A A . 24 CYS O 1 1 10 8468 1 1 24 CYS SG S -3.173 -2.043 -2.432 1.00 . A A . 24 CYS SG 1 1 10 8469 1 1 25 ASP C C -4.470 -4.004 -8.537 1.00 . A A . 25 ASP C 1 1 10 8470 1 1 25 ASP CA C -2.970 -4.168 -8.302 1.00 . A A . 25 ASP CA 1 1 10 8471 1 1 25 ASP CB C -2.555 -5.613 -8.588 1.00 . A A . 25 ASP CB 1 1 10 8472 1 1 25 ASP CG C -2.854 -6.040 -10.012 1.00 . A A . 25 ASP CG 1 1 10 8473 1 1 25 ASP H H -2.334 -4.495 -6.306 1.00 . A A . 25 ASP H 1 1 10 8474 1 1 25 ASP HA H -2.441 -3.512 -8.976 1.00 . A A . 25 ASP HA 1 1 10 8475 1 1 25 ASP HB2 H -1.496 -5.717 -8.418 1.00 . A A . 25 ASP HB2 1 1 10 8476 1 1 25 ASP HB3 H -3.087 -6.272 -7.917 1.00 . A A . 25 ASP HB3 1 1 10 8477 1 1 25 ASP N N -2.606 -3.794 -6.939 1.00 . A A . 25 ASP N 1 1 10 8478 1 1 25 ASP O O -4.908 -3.040 -9.165 1.00 . A A . 25 ASP O 1 1 10 8479 1 1 25 ASP OD1 O -2.292 -5.441 -10.952 1.00 . A A . 25 ASP OD1 1 1 10 8480 1 1 25 ASP OD2 O -3.644 -6.987 -10.195 1.00 . A A . 25 ASP OD2 1 1 10 8481 1 1 26 THR C C -7.402 -4.410 -6.973 1.00 . A A . 26 THR C 1 1 10 8482 1 1 26 THR CA C -6.693 -4.936 -8.222 1.00 . A A . 26 THR CA 1 1 10 8483 1 1 26 THR CB C -7.210 -6.352 -8.569 1.00 . A A . 26 THR CB 1 1 10 8484 1 1 26 THR CG2 C -6.922 -7.331 -7.442 1.00 . A A . 26 THR CG2 1 1 10 8485 1 1 26 THR H H -4.837 -5.697 -7.548 1.00 . A A . 26 THR H 1 1 10 8486 1 1 26 THR HA H -6.915 -4.282 -9.053 1.00 . A A . 26 THR HA 1 1 10 8487 1 1 26 THR HB H -6.695 -6.695 -9.457 1.00 . A A . 26 THR HB 1 1 10 8488 1 1 26 THR HG1 H -9.056 -5.773 -8.167 1.00 . A A . 26 THR HG1 1 1 10 8489 1 1 26 THR HG21 H -5.852 -7.427 -7.314 1.00 . A A . 26 THR HG21 1 1 10 8490 1 1 26 THR HG22 H -7.343 -8.295 -7.686 1.00 . A A . 26 THR HG22 1 1 10 8491 1 1 26 THR HG23 H -7.362 -6.965 -6.526 1.00 . A A . 26 THR HG23 1 1 10 8492 1 1 26 THR N N -5.248 -4.950 -8.034 1.00 . A A . 26 THR N 1 1 10 8493 1 1 26 THR O O -8.595 -4.641 -6.770 1.00 . A A . 26 THR O 1 1 10 8494 1 1 26 THR OG1 O -8.619 -6.323 -8.836 1.00 . A A . 26 THR OG1 1 1 10 8495 1 1 27 CYS C C -6.858 -1.673 -4.823 1.00 . A A . 27 CYS C 1 1 10 8496 1 1 27 CYS CA C -7.188 -3.164 -4.905 1.00 . A A . 27 CYS CA 1 1 10 8497 1 1 27 CYS CB C -6.613 -3.977 -3.738 1.00 . A A . 27 CYS CB 1 1 10 8498 1 1 27 CYS H H -5.714 -3.550 -6.355 1.00 . A A . 27 CYS H 1 1 10 8499 1 1 27 CYS HA H -8.261 -3.281 -4.927 1.00 . A A . 27 CYS HA 1 1 10 8500 1 1 27 CYS HB2 H -7.175 -4.893 -3.655 1.00 . A A . 27 CYS HB2 1 1 10 8501 1 1 27 CYS HB3 H -5.588 -4.221 -3.968 1.00 . A A . 27 CYS HB3 1 1 10 8502 1 1 27 CYS N N -6.657 -3.706 -6.139 1.00 . A A . 27 CYS N 1 1 10 8503 1 1 27 CYS O O -5.917 -1.206 -5.469 1.00 . A A . 27 CYS O 1 1 10 8504 1 1 27 CYS SG S -6.632 -3.196 -2.094 1.00 . A A . 27 CYS SG 1 1 10 8505 1 1 28 PRO C C -6.878 1.133 -3.043 1.00 . A A . 28 PRO C 1 1 10 8506 1 1 28 PRO CA C -7.648 0.578 -4.242 1.00 . A A . 28 PRO CA 1 1 10 8507 1 1 28 PRO CB C -9.110 1.015 -4.194 1.00 . A A . 28 PRO CB 1 1 10 8508 1 1 28 PRO CD C -9.029 -1.327 -3.639 1.00 . A A . 28 PRO CD 1 1 10 8509 1 1 28 PRO CG C -9.796 -0.049 -3.402 1.00 . A A . 28 PRO CG 1 1 10 8510 1 1 28 PRO HA H -7.194 0.932 -5.154 1.00 . A A . 28 PRO HA 1 1 10 8511 1 1 28 PRO HB2 H -9.186 1.980 -3.713 1.00 . A A . 28 PRO HB2 1 1 10 8512 1 1 28 PRO HB3 H -9.503 1.075 -5.199 1.00 . A A . 28 PRO HB3 1 1 10 8513 1 1 28 PRO HD2 H -8.859 -1.843 -2.706 1.00 . A A . 28 PRO HD2 1 1 10 8514 1 1 28 PRO HD3 H -9.564 -1.965 -4.327 1.00 . A A . 28 PRO HD3 1 1 10 8515 1 1 28 PRO HG2 H -9.778 0.209 -2.353 1.00 . A A . 28 PRO HG2 1 1 10 8516 1 1 28 PRO HG3 H -10.816 -0.156 -3.742 1.00 . A A . 28 PRO HG3 1 1 10 8517 1 1 28 PRO N N -7.754 -0.878 -4.228 1.00 . A A . 28 PRO N 1 1 10 8518 1 1 28 PRO O O -7.358 2.029 -2.346 1.00 . A A . 28 PRO O 1 1 10 8519 1 1 29 SER C C -3.438 1.379 -2.156 1.00 . A A . 29 SER C 1 1 10 8520 1 1 29 SER CA C -4.864 1.074 -1.699 1.00 . A A . 29 SER CA 1 1 10 8521 1 1 29 SER CB C -4.863 0.021 -0.592 1.00 . A A . 29 SER CB 1 1 10 8522 1 1 29 SER H H -5.337 -0.094 -3.400 1.00 . A A . 29 SER H 1 1 10 8523 1 1 29 SER HA H -5.306 1.982 -1.319 1.00 . A A . 29 SER HA 1 1 10 8524 1 1 29 SER HB2 H -4.105 -0.718 -0.800 1.00 . A A . 29 SER HB2 1 1 10 8525 1 1 29 SER HB3 H -4.654 0.494 0.357 1.00 . A A . 29 SER HB3 1 1 10 8526 1 1 29 SER HG H -6.300 -1.094 -1.345 1.00 . A A . 29 SER HG 1 1 10 8527 1 1 29 SER N N -5.682 0.613 -2.810 1.00 . A A . 29 SER N 1 1 10 8528 1 1 29 SER O O -3.032 1.001 -3.260 1.00 . A A . 29 SER O 1 1 10 8529 1 1 29 SER OG O -6.124 -0.630 -0.513 1.00 . A A . 29 SER OG 1 1 10 8530 1 1 30 SER C C -0.456 2.376 -0.428 1.00 . A A . 30 SER C 1 1 10 8531 1 1 30 SER CA C -1.345 2.510 -1.655 1.00 . A A . 30 SER CA 1 1 10 8532 1 1 30 SER CB C -1.303 3.944 -2.185 1.00 . A A . 30 SER CB 1 1 10 8533 1 1 30 SER H H -3.106 2.438 -0.496 1.00 . A A . 30 SER H 1 1 10 8534 1 1 30 SER HA H -0.982 1.840 -2.422 1.00 . A A . 30 SER HA 1 1 10 8535 1 1 30 SER HB2 H -1.267 4.631 -1.353 1.00 . A A . 30 SER HB2 1 1 10 8536 1 1 30 SER HB3 H -0.422 4.075 -2.797 1.00 . A A . 30 SER HB3 1 1 10 8537 1 1 30 SER HG H -2.575 5.188 -3.016 1.00 . A A . 30 SER HG 1 1 10 8538 1 1 30 SER N N -2.710 2.124 -1.334 1.00 . A A . 30 SER N 1 1 10 8539 1 1 30 SER O O -0.903 2.570 0.710 1.00 . A A . 30 SER O 1 1 10 8540 1 1 30 SER OG O -2.451 4.233 -2.967 1.00 . A A . 30 SER OG 1 1 10 8541 1 1 31 TYR C C 3.102 2.362 0.021 1.00 . A A . 31 TYR C 1 1 10 8542 1 1 31 TYR CA C 1.747 1.792 0.414 1.00 . A A . 31 TYR CA 1 1 10 8543 1 1 31 TYR CB C 1.909 0.299 0.727 1.00 . A A . 31 TYR CB 1 1 10 8544 1 1 31 TYR CD1 C 0.455 -0.352 2.684 1.00 . A A . 31 TYR CD1 1 1 10 8545 1 1 31 TYR CD2 C -0.241 -1.001 0.498 1.00 . A A . 31 TYR CD2 1 1 10 8546 1 1 31 TYR CE1 C -0.659 -0.963 3.222 1.00 . A A . 31 TYR CE1 1 1 10 8547 1 1 31 TYR CE2 C -1.355 -1.617 1.030 1.00 . A A . 31 TYR CE2 1 1 10 8548 1 1 31 TYR CG C 0.683 -0.359 1.314 1.00 . A A . 31 TYR CG 1 1 10 8549 1 1 31 TYR CZ C -1.559 -1.594 2.390 1.00 . A A . 31 TYR CZ 1 1 10 8550 1 1 31 TYR H H 1.071 1.810 -1.587 1.00 . A A . 31 TYR H 1 1 10 8551 1 1 31 TYR HA H 1.385 2.305 1.293 1.00 . A A . 31 TYR HA 1 1 10 8552 1 1 31 TYR HB2 H 2.156 -0.225 -0.184 1.00 . A A . 31 TYR HB2 1 1 10 8553 1 1 31 TYR HB3 H 2.719 0.176 1.432 1.00 . A A . 31 TYR HB3 1 1 10 8554 1 1 31 TYR HD1 H 1.164 0.140 3.331 1.00 . A A . 31 TYR HD1 1 1 10 8555 1 1 31 TYR HD2 H -0.078 -1.015 -0.569 1.00 . A A . 31 TYR HD2 1 1 10 8556 1 1 31 TYR HE1 H -0.822 -0.944 4.290 1.00 . A A . 31 TYR HE1 1 1 10 8557 1 1 31 TYR HE2 H -2.064 -2.109 0.380 1.00 . A A . 31 TYR HE2 1 1 10 8558 1 1 31 TYR HH H -3.206 -2.585 2.195 1.00 . A A . 31 TYR HH 1 1 10 8559 1 1 31 TYR N N 0.788 1.991 -0.658 1.00 . A A . 31 TYR N 1 1 10 8560 1 1 31 TYR O O 3.316 2.732 -1.127 1.00 . A A . 31 TYR O 1 1 10 8561 1 1 31 TYR OH O -2.668 -2.212 2.922 1.00 . A A . 31 TYR OH 1 1 10 8562 1 1 32 HIS C C 6.130 1.205 0.372 1.00 . A A . 32 HIS C 1 1 10 8563 1 1 32 HIS CA C 5.439 2.535 0.624 1.00 . A A . 32 HIS CA 1 1 10 8564 1 1 32 HIS CB C 6.109 3.261 1.800 1.00 . A A . 32 HIS CB 1 1 10 8565 1 1 32 HIS CD2 C 6.023 5.792 1.326 1.00 . A A . 32 HIS CD2 1 1 10 8566 1 1 32 HIS CE1 C 4.636 6.335 2.919 1.00 . A A . 32 HIS CE1 1 1 10 8567 1 1 32 HIS CG C 5.658 4.674 1.999 1.00 . A A . 32 HIS CG 1 1 10 8568 1 1 32 HIS H H 3.847 1.790 1.775 1.00 . A A . 32 HIS H 1 1 10 8569 1 1 32 HIS HA H 5.485 3.145 -0.267 1.00 . A A . 32 HIS HA 1 1 10 8570 1 1 32 HIS HB2 H 5.901 2.720 2.709 1.00 . A A . 32 HIS HB2 1 1 10 8571 1 1 32 HIS HB3 H 7.175 3.272 1.636 1.00 . A A . 32 HIS HB3 1 1 10 8572 1 1 32 HIS HD2 H 6.698 5.846 0.485 1.00 . A A . 32 HIS HD2 1 1 10 8573 1 1 32 HIS HE1 H 4.010 6.921 3.576 1.00 . A A . 32 HIS HE1 1 1 10 8574 1 1 32 HIS HE2 H 5.287 7.754 1.538 1.00 . A A . 32 HIS HE2 1 1 10 8575 1 1 32 HIS N N 4.051 2.249 0.927 1.00 . A A . 32 HIS N 1 1 10 8576 1 1 32 HIS ND1 N 4.781 5.027 3.002 1.00 . A A . 32 HIS ND1 1 1 10 8577 1 1 32 HIS NE2 N 5.370 6.845 1.916 1.00 . A A . 32 HIS NE2 1 1 10 8578 1 1 32 HIS O O 5.490 0.256 -0.082 1.00 . A A . 32 HIS O 1 1 10 8579 1 1 33 ILE C C 8.471 -0.626 2.195 1.00 . A A . 33 ILE C 1 1 10 8580 1 1 33 ILE CA C 8.018 -0.225 0.795 1.00 . A A . 33 ILE CA 1 1 10 8581 1 1 33 ILE CB C 9.221 -0.231 -0.170 1.00 . A A . 33 ILE CB 1 1 10 8582 1 1 33 ILE CD1 C 11.625 0.566 -0.364 1.00 . A A . 33 ILE CD1 1 1 10 8583 1 1 33 ILE CG1 C 10.263 0.808 0.246 1.00 . A A . 33 ILE CG1 1 1 10 8584 1 1 33 ILE CG2 C 8.753 0.023 -1.595 1.00 . A A . 33 ILE CG2 1 1 10 8585 1 1 33 ILE H H 7.796 1.818 1.286 1.00 . A A . 33 ILE H 1 1 10 8586 1 1 33 ILE HA H 7.298 -0.951 0.441 1.00 . A A . 33 ILE HA 1 1 10 8587 1 1 33 ILE HB H 9.671 -1.211 -0.137 1.00 . A A . 33 ILE HB 1 1 10 8588 1 1 33 ILE HD11 H 12.115 1.510 -0.543 1.00 . A A . 33 ILE HD11 1 1 10 8589 1 1 33 ILE HD12 H 12.222 -0.028 0.313 1.00 . A A . 33 ILE HD12 1 1 10 8590 1 1 33 ILE HD13 H 11.509 0.036 -1.300 1.00 . A A . 33 ILE HD13 1 1 10 8591 1 1 33 ILE HG12 H 9.932 1.788 -0.065 1.00 . A A . 33 ILE HG12 1 1 10 8592 1 1 33 ILE HG21 H 8.251 0.980 -1.642 1.00 . A A . 33 ILE HG21 1 1 10 8593 1 1 33 ILE HG22 H 9.605 0.030 -2.259 1.00 . A A . 33 ILE HG22 1 1 10 8594 1 1 33 ILE HG23 H 8.070 -0.758 -1.895 1.00 . A A . 33 ILE HG23 1 1 10 8595 1 1 33 ILE N N 7.359 1.067 0.830 1.00 . A A . 33 ILE N 1 1 10 8596 1 1 33 ILE O O 9.255 -1.557 2.365 1.00 . A A . 33 ILE O 1 1 10 8597 1 1 34 HIS C C 7.213 0.019 5.551 1.00 . A A . 34 HIS C 1 1 10 8598 1 1 34 HIS CA C 8.384 -0.153 4.582 1.00 . A A . 34 HIS CA 1 1 10 8599 1 1 34 HIS CB C 9.525 0.794 4.972 1.00 . A A . 34 HIS CB 1 1 10 8600 1 1 34 HIS CD2 C 10.806 -0.640 6.688 1.00 . A A . 34 HIS CD2 1 1 10 8601 1 1 34 HIS CE1 C 12.750 -0.584 5.712 1.00 . A A . 34 HIS CE1 1 1 10 8602 1 1 34 HIS CG C 10.713 0.092 5.552 1.00 . A A . 34 HIS CG 1 1 10 8603 1 1 34 HIS H H 7.357 0.827 3.008 1.00 . A A . 34 HIS H 1 1 10 8604 1 1 34 HIS HA H 8.737 -1.170 4.645 1.00 . A A . 34 HIS HA 1 1 10 8605 1 1 34 HIS HB2 H 9.852 1.334 4.095 1.00 . A A . 34 HIS HB2 1 1 10 8606 1 1 34 HIS HB3 H 9.164 1.496 5.708 1.00 . A A . 34 HIS HB3 1 1 10 8607 1 1 34 HIS HD2 H 10.011 -0.849 7.387 1.00 . A A . 34 HIS HD2 1 1 10 8608 1 1 34 HIS HE1 H 13.800 -0.751 5.507 1.00 . A A . 34 HIS HE1 1 1 10 8609 1 1 34 HIS HE2 H 12.429 -1.789 7.375 1.00 . A A . 34 HIS HE2 1 1 10 8610 1 1 34 HIS N N 7.979 0.096 3.201 1.00 . A A . 34 HIS N 1 1 10 8611 1 1 34 HIS ND1 N 11.943 0.125 4.939 1.00 . A A . 34 HIS ND1 1 1 10 8612 1 1 34 HIS NE2 N 12.104 -1.068 6.782 1.00 . A A . 34 HIS NE2 1 1 10 8613 1 1 34 HIS O O 7.411 0.286 6.739 1.00 . A A . 34 HIS O 1 1 10 8614 1 1 35 CYS C C 4.403 -1.306 6.496 1.00 . A A . 35 CYS C 1 1 10 8615 1 1 35 CYS CA C 4.804 0.029 5.875 1.00 . A A . 35 CYS CA 1 1 10 8616 1 1 35 CYS CB C 3.655 0.564 5.030 1.00 . A A . 35 CYS CB 1 1 10 8617 1 1 35 CYS H H 5.890 -0.304 4.090 1.00 . A A . 35 CYS H 1 1 10 8618 1 1 35 CYS HA H 5.026 0.733 6.661 1.00 . A A . 35 CYS HA 1 1 10 8619 1 1 35 CYS HB2 H 3.106 -0.266 4.608 1.00 . A A . 35 CYS HB2 1 1 10 8620 1 1 35 CYS HB3 H 2.995 1.147 5.656 1.00 . A A . 35 CYS HB3 1 1 10 8621 1 1 35 CYS N N 5.994 -0.115 5.044 1.00 . A A . 35 CYS N 1 1 10 8622 1 1 35 CYS O O 4.241 -1.421 7.712 1.00 . A A . 35 CYS O 1 1 10 8623 1 1 35 CYS SG S 4.197 1.619 3.659 1.00 . A A . 35 CYS SG 1 1 10 8624 1 1 36 LEU C C 4.866 -4.433 6.593 1.00 . A A . 36 LEU C 1 1 10 8625 1 1 36 LEU CA C 3.704 -3.594 6.076 1.00 . A A . 36 LEU CA 1 1 10 8626 1 1 36 LEU CB C 3.003 -4.333 4.929 1.00 . A A . 36 LEU CB 1 1 10 8627 1 1 36 LEU CD1 C 4.242 -4.184 2.755 1.00 . A A . 36 LEU CD1 1 1 10 8628 1 1 36 LEU CD2 C 1.769 -3.851 2.807 1.00 . A A . 36 LEU CD2 1 1 10 8629 1 1 36 LEU CG C 3.071 -3.649 3.563 1.00 . A A . 36 LEU CG 1 1 10 8630 1 1 36 LEU H H 4.269 -2.110 4.682 1.00 . A A . 36 LEU H 1 1 10 8631 1 1 36 LEU HA H 2.998 -3.443 6.878 1.00 . A A . 36 LEU HA 1 1 10 8632 1 1 36 LEU HB2 H 3.449 -5.314 4.838 1.00 . A A . 36 LEU HB2 1 1 10 8633 1 1 36 LEU HB3 H 1.963 -4.454 5.192 1.00 . A A . 36 LEU HB3 1 1 10 8634 1 1 36 LEU HD11 H 4.658 -5.049 3.250 1.00 . A A . 36 LEU HD11 1 1 10 8635 1 1 36 LEU HD12 H 3.900 -4.464 1.769 1.00 . A A . 36 LEU HD12 1 1 10 8636 1 1 36 LEU HD13 H 4.999 -3.419 2.669 1.00 . A A . 36 LEU HD13 1 1 10 8637 1 1 36 LEU HD21 H 1.901 -3.544 1.778 1.00 . A A . 36 LEU HD21 1 1 10 8638 1 1 36 LEU HD22 H 1.491 -4.894 2.840 1.00 . A A . 36 LEU HD22 1 1 10 8639 1 1 36 LEU HD23 H 0.993 -3.256 3.264 1.00 . A A . 36 LEU HD23 1 1 10 8640 1 1 36 LEU HG H 3.219 -2.588 3.704 1.00 . A A . 36 LEU HG 1 1 10 8641 1 1 36 LEU N N 4.166 -2.284 5.638 1.00 . A A . 36 LEU N 1 1 10 8642 1 1 36 LEU O O 6.026 -4.163 6.278 1.00 . A A . 36 LEU O 1 1 10 8643 1 1 37 ARG C C 6.375 -7.026 6.793 1.00 . A A . 37 ARG C 1 1 10 8644 1 1 37 ARG CA C 5.545 -6.380 7.910 1.00 . A A . 37 ARG CA 1 1 10 8645 1 1 37 ARG CB C 4.892 -7.452 8.786 1.00 . A A . 37 ARG CB 1 1 10 8646 1 1 37 ARG CD C 6.694 -7.767 10.509 1.00 . A A . 37 ARG CD 1 1 10 8647 1 1 37 ARG CG C 5.258 -7.340 10.256 1.00 . A A . 37 ARG CG 1 1 10 8648 1 1 37 ARG CZ C 8.797 -6.508 10.230 1.00 . A A . 37 ARG CZ 1 1 10 8649 1 1 37 ARG H H 3.594 -5.629 7.569 1.00 . A A . 37 ARG H 1 1 10 8650 1 1 37 ARG HA H 6.210 -5.794 8.526 1.00 . A A . 37 ARG HA 1 1 10 8651 1 1 37 ARG HB2 H 3.819 -7.368 8.696 1.00 . A A . 37 ARG HB2 1 1 10 8652 1 1 37 ARG HB3 H 5.199 -8.425 8.434 1.00 . A A . 37 ARG HB3 1 1 10 8653 1 1 37 ARG HD2 H 6.719 -8.410 11.376 1.00 . A A . 37 ARG HD2 1 1 10 8654 1 1 37 ARG HD3 H 7.049 -8.312 9.646 1.00 . A A . 37 ARG HD3 1 1 10 8655 1 1 37 ARG HE H 7.232 -5.896 11.316 1.00 . A A . 37 ARG HE 1 1 10 8656 1 1 37 ARG HG2 H 5.136 -6.314 10.571 1.00 . A A . 37 ARG HG2 1 1 10 8657 1 1 37 ARG HG3 H 4.598 -7.974 10.830 1.00 . A A . 37 ARG HG3 1 1 10 8658 1 1 37 ARG HH11 H 8.739 -8.267 9.213 1.00 . A A . 37 ARG HH11 1 1 10 8659 1 1 37 ARG HH12 H 10.217 -7.354 9.051 1.00 . A A . 37 ARG HH12 1 1 10 8660 1 1 37 ARG HH21 H 9.147 -4.712 11.094 1.00 . A A . 37 ARG HH21 1 1 10 8661 1 1 37 ARG HH22 H 10.457 -5.346 10.137 1.00 . A A . 37 ARG HH22 1 1 10 8662 1 1 37 ARG N N 4.538 -5.467 7.368 1.00 . A A . 37 ARG N 1 1 10 8663 1 1 37 ARG NE N 7.574 -6.624 10.741 1.00 . A A . 37 ARG NE 1 1 10 8664 1 1 37 ARG NH1 N 9.290 -7.451 9.438 1.00 . A A . 37 ARG NH1 1 1 10 8665 1 1 37 ARG NH2 N 9.524 -5.436 10.505 1.00 . A A . 37 ARG NH2 1 1 10 8666 1 1 37 ARG O O 7.602 -6.935 6.816 1.00 . A A . 37 ARG O 1 1 10 8667 1 1 38 PRO C C 6.970 -7.022 3.704 1.00 . A A . 38 PRO C 1 1 10 8668 1 1 38 PRO CA C 6.468 -8.154 4.602 1.00 . A A . 38 PRO CA 1 1 10 8669 1 1 38 PRO CB C 5.425 -9.003 3.879 1.00 . A A . 38 PRO CB 1 1 10 8670 1 1 38 PRO CD C 4.275 -7.783 5.591 1.00 . A A . 38 PRO CD 1 1 10 8671 1 1 38 PRO CG C 4.123 -8.367 4.210 1.00 . A A . 38 PRO CG 1 1 10 8672 1 1 38 PRO HA H 7.300 -8.773 4.907 1.00 . A A . 38 PRO HA 1 1 10 8673 1 1 38 PRO HB2 H 5.618 -8.983 2.816 1.00 . A A . 38 PRO HB2 1 1 10 8674 1 1 38 PRO HB3 H 5.471 -10.020 4.240 1.00 . A A . 38 PRO HB3 1 1 10 8675 1 1 38 PRO HD2 H 3.778 -6.825 5.651 1.00 . A A . 38 PRO HD2 1 1 10 8676 1 1 38 PRO HD3 H 3.876 -8.460 6.333 1.00 . A A . 38 PRO HD3 1 1 10 8677 1 1 38 PRO HG2 H 3.905 -7.588 3.496 1.00 . A A . 38 PRO HG2 1 1 10 8678 1 1 38 PRO HG3 H 3.342 -9.111 4.204 1.00 . A A . 38 PRO HG3 1 1 10 8679 1 1 38 PRO N N 5.737 -7.624 5.755 1.00 . A A . 38 PRO N 1 1 10 8680 1 1 38 PRO O O 6.468 -6.812 2.596 1.00 . A A . 38 PRO O 1 1 10 8681 1 1 39 ALA C C 9.066 -5.338 2.303 1.00 . A A . 39 ALA C 1 1 10 8682 1 1 39 ALA CA C 8.359 -5.015 3.610 1.00 . A A . 39 ALA CA 1 1 10 8683 1 1 39 ALA CB C 9.286 -4.249 4.547 1.00 . A A . 39 ALA CB 1 1 10 8684 1 1 39 ALA H H 8.133 -6.392 5.194 1.00 . A A . 39 ALA H 1 1 10 8685 1 1 39 ALA HA H 7.508 -4.386 3.396 1.00 . A A . 39 ALA HA 1 1 10 8686 1 1 39 ALA HB1 H 10.264 -4.163 4.095 1.00 . A A . 39 ALA HB1 1 1 10 8687 1 1 39 ALA HB2 H 8.884 -3.262 4.724 1.00 . A A . 39 ALA HB2 1 1 10 8688 1 1 39 ALA HB3 H 9.368 -4.777 5.484 1.00 . A A . 39 ALA HB3 1 1 10 8689 1 1 39 ALA N N 7.866 -6.217 4.264 1.00 . A A . 39 ALA N 1 1 10 8690 1 1 39 ALA O O 9.499 -6.473 2.067 1.00 . A A . 39 ALA O 1 1 10 8691 1 1 40 LEU C C 11.128 -3.816 0.140 1.00 . A A . 40 LEU C 1 1 10 8692 1 1 40 LEU CA C 9.766 -4.487 0.148 1.00 . A A . 40 LEU CA 1 1 10 8693 1 1 40 LEU CB C 8.874 -3.874 -0.934 1.00 . A A . 40 LEU CB 1 1 10 8694 1 1 40 LEU CD1 C 7.882 -6.164 -1.270 1.00 . A A . 40 LEU CD1 1 1 10 8695 1 1 40 LEU CD2 C 6.473 -4.319 -0.331 1.00 . A A . 40 LEU CD2 1 1 10 8696 1 1 40 LEU CG C 7.609 -4.666 -1.281 1.00 . A A . 40 LEU CG 1 1 10 8697 1 1 40 LEU H H 8.781 -3.464 1.696 1.00 . A A . 40 LEU H 1 1 10 8698 1 1 40 LEU HA H 9.890 -5.542 -0.047 1.00 . A A . 40 LEU HA 1 1 10 8699 1 1 40 LEU HB2 H 8.575 -2.890 -0.604 1.00 . A A . 40 LEU HB2 1 1 10 8700 1 1 40 LEU HB3 H 9.460 -3.768 -1.833 1.00 . A A . 40 LEU HB3 1 1 10 8701 1 1 40 LEU HD11 H 7.524 -6.602 -2.189 1.00 . A A . 40 LEU HD11 1 1 10 8702 1 1 40 LEU HD12 H 8.945 -6.335 -1.177 1.00 . A A . 40 LEU HD12 1 1 10 8703 1 1 40 LEU HD13 H 7.370 -6.617 -0.433 1.00 . A A . 40 LEU HD13 1 1 10 8704 1 1 40 LEU HD21 H 6.798 -4.471 0.689 1.00 . A A . 40 LEU HD21 1 1 10 8705 1 1 40 LEU HD22 H 6.190 -3.287 -0.470 1.00 . A A . 40 LEU HD22 1 1 10 8706 1 1 40 LEU HD23 H 5.626 -4.957 -0.535 1.00 . A A . 40 LEU HD23 1 1 10 8707 1 1 40 LEU HG H 7.296 -4.397 -2.278 1.00 . A A . 40 LEU HG 1 1 10 8708 1 1 40 LEU N N 9.147 -4.338 1.446 1.00 . A A . 40 LEU N 1 1 10 8709 1 1 40 LEU O O 11.248 -2.635 0.461 1.00 . A A . 40 LEU O 1 1 10 8710 1 1 41 TYR C C 13.626 -3.266 -1.687 1.00 . A A . 41 TYR C 1 1 10 8711 1 1 41 TYR CA C 13.485 -4.014 -0.370 1.00 . A A . 41 TYR CA 1 1 10 8712 1 1 41 TYR CB C 14.520 -5.135 -0.267 1.00 . A A . 41 TYR CB 1 1 10 8713 1 1 41 TYR CD1 C 15.139 -5.504 2.150 1.00 . A A . 41 TYR CD1 1 1 10 8714 1 1 41 TYR CD2 C 13.649 -7.054 1.125 1.00 . A A . 41 TYR CD2 1 1 10 8715 1 1 41 TYR CE1 C 15.061 -6.206 3.335 1.00 . A A . 41 TYR CE1 1 1 10 8716 1 1 41 TYR CE2 C 13.565 -7.763 2.307 1.00 . A A . 41 TYR CE2 1 1 10 8717 1 1 41 TYR CG C 14.435 -5.914 1.027 1.00 . A A . 41 TYR CG 1 1 10 8718 1 1 41 TYR CZ C 14.272 -7.335 3.409 1.00 . A A . 41 TYR CZ 1 1 10 8719 1 1 41 TYR H H 11.968 -5.475 -0.569 1.00 . A A . 41 TYR H 1 1 10 8720 1 1 41 TYR HA H 13.629 -3.320 0.447 1.00 . A A . 41 TYR HA 1 1 10 8721 1 1 41 TYR HB2 H 14.371 -5.829 -1.081 1.00 . A A . 41 TYR HB2 1 1 10 8722 1 1 41 TYR HB3 H 15.510 -4.712 -0.335 1.00 . A A . 41 TYR HB3 1 1 10 8723 1 1 41 TYR HD1 H 15.756 -4.619 2.088 1.00 . A A . 41 TYR HD1 1 1 10 8724 1 1 41 TYR HD2 H 13.098 -7.390 0.258 1.00 . A A . 41 TYR HD2 1 1 10 8725 1 1 41 TYR HE1 H 15.619 -5.872 4.198 1.00 . A A . 41 TYR HE1 1 1 10 8726 1 1 41 TYR HE2 H 12.948 -8.648 2.364 1.00 . A A . 41 TYR HE2 1 1 10 8727 1 1 41 TYR HH H 15.078 -8.353 4.827 1.00 . A A . 41 TYR HH 1 1 10 8728 1 1 41 TYR N N 12.140 -4.557 -0.267 1.00 . A A . 41 TYR N 1 1 10 8729 1 1 41 TYR O O 14.367 -2.288 -1.791 1.00 . A A . 41 TYR O 1 1 10 8730 1 1 41 TYR OH O 14.193 -8.037 4.588 1.00 . A A . 41 TYR OH 1 1 10 8731 1 1 42 GLU C C 11.228 -2.761 -4.258 1.00 . A A . 42 GLU C 1 1 10 8732 1 1 42 GLU CA C 12.698 -2.966 -3.914 1.00 . A A . 42 GLU CA 1 1 10 8733 1 1 42 GLU CB C 13.393 -3.771 -5.010 1.00 . A A . 42 GLU CB 1 1 10 8734 1 1 42 GLU CD C 14.209 -6.149 -4.791 1.00 . A A . 42 GLU CD 1 1 10 8735 1 1 42 GLU CG C 13.018 -5.242 -5.008 1.00 . A A . 42 GLU CG 1 1 10 8736 1 1 42 GLU H H 12.156 -4.377 -2.446 1.00 . A A . 42 GLU H 1 1 10 8737 1 1 42 GLU HA H 13.178 -2.003 -3.816 1.00 . A A . 42 GLU HA 1 1 10 8738 1 1 42 GLU HB2 H 13.129 -3.353 -5.970 1.00 . A A . 42 GLU HB2 1 1 10 8739 1 1 42 GLU HB3 H 14.463 -3.693 -4.875 1.00 . A A . 42 GLU HB3 1 1 10 8740 1 1 42 GLU HG2 H 12.303 -5.415 -4.217 1.00 . A A . 42 GLU HG2 1 1 10 8741 1 1 42 GLU HG3 H 12.566 -5.486 -5.960 1.00 . A A . 42 GLU HG3 1 1 10 8742 1 1 42 GLU N N 12.794 -3.653 -2.640 1.00 . A A . 42 GLU N 1 1 10 8743 1 1 42 GLU O O 10.372 -3.515 -3.796 1.00 . A A . 42 GLU O 1 1 10 8744 1 1 42 GLU OE1 O 14.908 -5.994 -3.765 1.00 . A A . 42 GLU OE1 1 1 10 8745 1 1 42 GLU OE2 O 14.452 -7.028 -5.645 1.00 . A A . 42 GLU OE2 1 1 10 8746 1 1 43 VAL C C 8.988 -2.395 -6.362 1.00 . A A . 43 VAL C 1 1 10 8747 1 1 43 VAL CA C 9.542 -1.402 -5.344 1.00 . A A . 43 VAL CA 1 1 10 8748 1 1 43 VAL CB C 9.391 0.032 -5.893 1.00 . A A . 43 VAL CB 1 1 10 8749 1 1 43 VAL CG1 C 7.937 0.478 -5.826 1.00 . A A . 43 VAL CG1 1 1 10 8750 1 1 43 VAL CG2 C 10.286 0.995 -5.126 1.00 . A A . 43 VAL CG2 1 1 10 8751 1 1 43 VAL H H 11.642 -1.117 -5.312 1.00 . A A . 43 VAL H 1 1 10 8752 1 1 43 VAL HA H 8.959 -1.476 -4.438 1.00 . A A . 43 VAL HA 1 1 10 8753 1 1 43 VAL HB H 9.698 0.035 -6.929 1.00 . A A . 43 VAL HB 1 1 10 8754 1 1 43 VAL HG11 H 7.492 0.399 -6.806 1.00 . A A . 43 VAL HG11 1 1 10 8755 1 1 43 VAL HG12 H 7.399 -0.154 -5.135 1.00 . A A . 43 VAL HG12 1 1 10 8756 1 1 43 VAL HG13 H 7.889 1.503 -5.490 1.00 . A A . 43 VAL HG13 1 1 10 8757 1 1 43 VAL HG21 H 11.298 0.919 -5.497 1.00 . A A . 43 VAL HG21 1 1 10 8758 1 1 43 VAL HG22 H 9.929 2.005 -5.262 1.00 . A A . 43 VAL HG22 1 1 10 8759 1 1 43 VAL HG23 H 10.268 0.746 -4.076 1.00 . A A . 43 VAL HG23 1 1 10 8760 1 1 43 VAL N N 10.927 -1.713 -5.009 1.00 . A A . 43 VAL N 1 1 10 8761 1 1 43 VAL O O 9.550 -2.566 -7.448 1.00 . A A . 43 VAL O 1 1 10 8762 1 1 44 PRO C C 6.542 -3.489 -8.026 1.00 . A A . 44 PRO C 1 1 10 8763 1 1 44 PRO CA C 7.289 -4.117 -6.855 1.00 . A A . 44 PRO CA 1 1 10 8764 1 1 44 PRO CB C 6.304 -4.844 -5.925 1.00 . A A . 44 PRO CB 1 1 10 8765 1 1 44 PRO CD C 7.241 -3.024 -4.692 1.00 . A A . 44 PRO CD 1 1 10 8766 1 1 44 PRO CG C 6.645 -4.392 -4.544 1.00 . A A . 44 PRO CG 1 1 10 8767 1 1 44 PRO HA H 8.020 -4.817 -7.231 1.00 . A A . 44 PRO HA 1 1 10 8768 1 1 44 PRO HB2 H 5.292 -4.571 -6.189 1.00 . A A . 44 PRO HB2 1 1 10 8769 1 1 44 PRO HB3 H 6.428 -5.911 -6.031 1.00 . A A . 44 PRO HB3 1 1 10 8770 1 1 44 PRO HD2 H 6.466 -2.272 -4.702 1.00 . A A . 44 PRO HD2 1 1 10 8771 1 1 44 PRO HD3 H 7.953 -2.829 -3.902 1.00 . A A . 44 PRO HD3 1 1 10 8772 1 1 44 PRO HG2 H 5.750 -4.347 -3.940 1.00 . A A . 44 PRO HG2 1 1 10 8773 1 1 44 PRO HG3 H 7.364 -5.068 -4.102 1.00 . A A . 44 PRO HG3 1 1 10 8774 1 1 44 PRO N N 7.911 -3.108 -5.995 1.00 . A A . 44 PRO N 1 1 10 8775 1 1 44 PRO O O 5.972 -2.404 -7.904 1.00 . A A . 44 PRO O 1 1 10 8776 1 1 45 ASP C C 5.446 -4.838 -11.234 1.00 . A A . 45 ASP C 1 1 10 8777 1 1 45 ASP CA C 5.909 -3.674 -10.365 1.00 . A A . 45 ASP CA 1 1 10 8778 1 1 45 ASP CB C 6.866 -2.770 -11.148 1.00 . A A . 45 ASP CB 1 1 10 8779 1 1 45 ASP CG C 6.351 -2.417 -12.529 1.00 . A A . 45 ASP CG 1 1 10 8780 1 1 45 ASP H H 7.050 -5.026 -9.201 1.00 . A A . 45 ASP H 1 1 10 8781 1 1 45 ASP HA H 5.046 -3.099 -10.064 1.00 . A A . 45 ASP HA 1 1 10 8782 1 1 45 ASP HB2 H 7.013 -1.853 -10.597 1.00 . A A . 45 ASP HB2 1 1 10 8783 1 1 45 ASP HB3 H 7.817 -3.273 -11.258 1.00 . A A . 45 ASP HB3 1 1 10 8784 1 1 45 ASP N N 6.562 -4.169 -9.162 1.00 . A A . 45 ASP N 1 1 10 8785 1 1 45 ASP O O 6.204 -5.774 -11.489 1.00 . A A . 45 ASP O 1 1 10 8786 1 1 45 ASP OD1 O 5.234 -1.865 -12.635 1.00 . A A . 45 ASP OD1 1 1 10 8787 1 1 45 ASP OD2 O 7.069 -2.671 -13.517 1.00 . A A . 45 ASP OD2 1 1 10 8788 1 1 46 GLY C C 2.365 -6.441 -11.891 1.00 . A A . 46 GLY C 1 1 10 8789 1 1 46 GLY CA C 3.644 -5.865 -12.462 1.00 . A A . 46 GLY CA 1 1 10 8790 1 1 46 GLY H H 3.614 -4.048 -11.379 1.00 . A A . 46 GLY H 1 1 10 8791 1 1 46 GLY HA2 H 3.444 -5.477 -13.451 1.00 . A A . 46 GLY HA2 1 1 10 8792 1 1 46 GLY HA3 H 4.378 -6.654 -12.538 1.00 . A A . 46 GLY HA3 1 1 10 8793 1 1 46 GLY N N 4.187 -4.801 -11.644 1.00 . A A . 46 GLY N 1 1 10 8794 1 1 46 GLY O O 1.271 -5.971 -12.204 1.00 . A A . 46 GLY O 1 1 10 8795 1 1 47 GLU C C 1.538 -8.252 -8.947 1.00 . A A . 47 GLU C 1 1 10 8796 1 1 47 GLU CA C 1.344 -8.121 -10.454 1.00 . A A . 47 GLU CA 1 1 10 8797 1 1 47 GLU CB C 1.108 -9.509 -11.068 1.00 . A A . 47 GLU CB 1 1 10 8798 1 1 47 GLU CD C 2.899 -10.263 -12.674 1.00 . A A . 47 GLU CD 1 1 10 8799 1 1 47 GLU CG C 1.535 -9.629 -12.521 1.00 . A A . 47 GLU CG 1 1 10 8800 1 1 47 GLU H H 3.400 -7.802 -10.856 1.00 . A A . 47 GLU H 1 1 10 8801 1 1 47 GLU HA H 0.480 -7.502 -10.640 1.00 . A A . 47 GLU HA 1 1 10 8802 1 1 47 GLU HB2 H 1.659 -10.241 -10.495 1.00 . A A . 47 GLU HB2 1 1 10 8803 1 1 47 GLU HB3 H 0.055 -9.740 -11.007 1.00 . A A . 47 GLU HB3 1 1 10 8804 1 1 47 GLU HG2 H 0.813 -10.234 -13.047 1.00 . A A . 47 GLU HG2 1 1 10 8805 1 1 47 GLU HG3 H 1.562 -8.640 -12.957 1.00 . A A . 47 GLU HG3 1 1 10 8806 1 1 47 GLU N N 2.499 -7.468 -11.062 1.00 . A A . 47 GLU N 1 1 10 8807 1 1 47 GLU O O 1.899 -9.318 -8.446 1.00 . A A . 47 GLU O 1 1 10 8808 1 1 47 GLU OE1 O 3.025 -11.478 -12.425 1.00 . A A . 47 GLU OE1 1 1 10 8809 1 1 47 GLU OE2 O 3.851 -9.546 -13.042 1.00 . A A . 47 GLU OE2 1 1 10 8810 1 1 48 TRP C C 0.123 -7.138 -6.090 1.00 . A A . 48 TRP C 1 1 10 8811 1 1 48 TRP CA C 1.481 -7.155 -6.788 1.00 . A A . 48 TRP CA 1 1 10 8812 1 1 48 TRP CB C 2.317 -5.944 -6.356 1.00 . A A . 48 TRP CB 1 1 10 8813 1 1 48 TRP CD1 C 3.446 -6.568 -4.139 1.00 . A A . 48 TRP CD1 1 1 10 8814 1 1 48 TRP CD2 C 1.839 -5.019 -3.947 1.00 . A A . 48 TRP CD2 1 1 10 8815 1 1 48 TRP CE2 C 2.369 -5.273 -2.669 1.00 . A A . 48 TRP CE2 1 1 10 8816 1 1 48 TRP CE3 C 0.810 -4.080 -4.074 1.00 . A A . 48 TRP CE3 1 1 10 8817 1 1 48 TRP CG C 2.538 -5.860 -4.874 1.00 . A A . 48 TRP CG 1 1 10 8818 1 1 48 TRP CH2 C 0.904 -3.702 -1.682 1.00 . A A . 48 TRP CH2 1 1 10 8819 1 1 48 TRP CZ2 C 1.912 -4.616 -1.528 1.00 . A A . 48 TRP CZ2 1 1 10 8820 1 1 48 TRP CZ3 C 0.356 -3.429 -2.940 1.00 . A A . 48 TRP CZ3 1 1 10 8821 1 1 48 TRP H H 1.040 -6.333 -8.690 1.00 . A A . 48 TRP H 1 1 10 8822 1 1 48 TRP HA H 2.002 -8.058 -6.510 1.00 . A A . 48 TRP HA 1 1 10 8823 1 1 48 TRP HB2 H 3.285 -5.997 -6.832 1.00 . A A . 48 TRP HB2 1 1 10 8824 1 1 48 TRP HB3 H 1.817 -5.039 -6.670 1.00 . A A . 48 TRP HB3 1 1 10 8825 1 1 48 TRP HD1 H 4.131 -7.293 -4.553 1.00 . A A . 48 TRP HD1 1 1 10 8826 1 1 48 TRP HE1 H 3.897 -6.594 -2.080 1.00 . A A . 48 TRP HE1 1 1 10 8827 1 1 48 TRP HE3 H 0.374 -3.857 -5.036 1.00 . A A . 48 TRP HE3 1 1 10 8828 1 1 48 TRP HH2 H 0.519 -3.170 -0.823 1.00 . A A . 48 TRP HH2 1 1 10 8829 1 1 48 TRP HZ2 H 2.325 -4.814 -0.550 1.00 . A A . 48 TRP HZ2 1 1 10 8830 1 1 48 TRP HZ3 H -0.439 -2.701 -3.020 1.00 . A A . 48 TRP HZ3 1 1 10 8831 1 1 48 TRP N N 1.317 -7.162 -8.232 1.00 . A A . 48 TRP N 1 1 10 8832 1 1 48 TRP NE1 N 3.351 -6.221 -2.812 1.00 . A A . 48 TRP NE1 1 1 10 8833 1 1 48 TRP O O -0.589 -6.135 -6.119 1.00 . A A . 48 TRP O 1 1 10 8834 1 1 49 GLN C C -1.034 -8.119 -3.143 1.00 . A A . 49 GLN C 1 1 10 8835 1 1 49 GLN CA C -1.405 -8.295 -4.607 1.00 . A A . 49 GLN CA 1 1 10 8836 1 1 49 GLN CB C -2.147 -9.618 -4.825 1.00 . A A . 49 GLN CB 1 1 10 8837 1 1 49 GLN CD C -4.066 -8.003 -5.235 1.00 . A A . 49 GLN CD 1 1 10 8838 1 1 49 GLN CG C -3.644 -9.455 -5.083 1.00 . A A . 49 GLN CG 1 1 10 8839 1 1 49 GLN H H 0.432 -8.985 -5.387 1.00 . A A . 49 GLN H 1 1 10 8840 1 1 49 GLN HA H -2.045 -7.478 -4.904 1.00 . A A . 49 GLN HA 1 1 10 8841 1 1 49 GLN HB2 H -1.712 -10.123 -5.675 1.00 . A A . 49 GLN HB2 1 1 10 8842 1 1 49 GLN HB3 H -2.021 -10.236 -3.948 1.00 . A A . 49 GLN HB3 1 1 10 8843 1 1 49 GLN HE21 H -4.797 -7.998 -3.385 1.00 . A A . 49 GLN HE21 1 1 10 8844 1 1 49 GLN HE22 H -4.921 -6.504 -4.251 1.00 . A A . 49 GLN HE22 1 1 10 8845 1 1 49 GLN HG2 H -3.897 -9.980 -5.991 1.00 . A A . 49 GLN HG2 1 1 10 8846 1 1 49 GLN HG3 H -4.189 -9.889 -4.255 1.00 . A A . 49 GLN HG3 1 1 10 8847 1 1 49 GLN N N -0.200 -8.232 -5.413 1.00 . A A . 49 GLN N 1 1 10 8848 1 1 49 GLN NE2 N -4.658 -7.446 -4.190 1.00 . A A . 49 GLN NE2 1 1 10 8849 1 1 49 GLN O O 0.016 -8.593 -2.703 1.00 . A A . 49 GLN O 1 1 10 8850 1 1 49 GLN OE1 O -3.870 -7.390 -6.287 1.00 . A A . 49 GLN OE1 1 1 10 8851 1 1 50 CYS C C -1.727 -7.983 -0.079 1.00 . A A . 50 CYS C 1 1 10 8852 1 1 50 CYS CA C -1.453 -6.894 -1.106 1.00 . A A . 50 CYS CA 1 1 10 8853 1 1 50 CYS CB C -2.263 -5.663 -0.760 1.00 . A A . 50 CYS CB 1 1 10 8854 1 1 50 CYS H H -2.548 -6.846 -2.895 1.00 . A A . 50 CYS H 1 1 10 8855 1 1 50 CYS HA H -0.405 -6.642 -1.087 1.00 . A A . 50 CYS HA 1 1 10 8856 1 1 50 CYS HB2 H -2.526 -5.692 0.287 1.00 . A A . 50 CYS HB2 1 1 10 8857 1 1 50 CYS HB3 H -1.670 -4.780 -0.956 1.00 . A A . 50 CYS HB3 1 1 10 8858 1 1 50 CYS N N -1.796 -7.298 -2.449 1.00 . A A . 50 CYS N 1 1 10 8859 1 1 50 CYS O O -2.725 -8.698 -0.157 1.00 . A A . 50 CYS O 1 1 10 8860 1 1 50 CYS SG S -3.802 -5.519 -1.719 1.00 . A A . 50 CYS SG 1 1 10 8861 1 1 51 PRO C C -1.582 -8.316 3.274 1.00 . A A . 51 PRO C 1 1 10 8862 1 1 51 PRO CA C -1.020 -9.010 2.031 1.00 . A A . 51 PRO CA 1 1 10 8863 1 1 51 PRO CB C 0.423 -9.438 2.271 1.00 . A A . 51 PRO CB 1 1 10 8864 1 1 51 PRO CD C 0.383 -7.322 1.074 1.00 . A A . 51 PRO CD 1 1 10 8865 1 1 51 PRO CG C 1.248 -8.229 1.924 1.00 . A A . 51 PRO CG 1 1 10 8866 1 1 51 PRO HA H -1.627 -9.864 1.768 1.00 . A A . 51 PRO HA 1 1 10 8867 1 1 51 PRO HB2 H 0.549 -9.720 3.307 1.00 . A A . 51 PRO HB2 1 1 10 8868 1 1 51 PRO HB3 H 0.665 -10.275 1.633 1.00 . A A . 51 PRO HB3 1 1 10 8869 1 1 51 PRO HD2 H 0.204 -6.385 1.581 1.00 . A A . 51 PRO HD2 1 1 10 8870 1 1 51 PRO HD3 H 0.846 -7.150 0.112 1.00 . A A . 51 PRO HD3 1 1 10 8871 1 1 51 PRO HG2 H 1.542 -7.718 2.829 1.00 . A A . 51 PRO HG2 1 1 10 8872 1 1 51 PRO HG3 H 2.124 -8.534 1.370 1.00 . A A . 51 PRO HG3 1 1 10 8873 1 1 51 PRO N N -0.861 -8.084 0.929 1.00 . A A . 51 PRO N 1 1 10 8874 1 1 51 PRO O O -1.229 -8.667 4.402 1.00 . A A . 51 PRO O 1 1 10 8875 1 1 52 ARG C C -4.222 -5.948 4.053 1.00 . A A . 52 ARG C 1 1 10 8876 1 1 52 ARG CA C -2.770 -6.405 4.185 1.00 . A A . 52 ARG CA 1 1 10 8877 1 1 52 ARG CB C -1.859 -5.191 4.349 1.00 . A A . 52 ARG CB 1 1 10 8878 1 1 52 ARG CD C -0.108 -5.788 6.048 1.00 . A A . 52 ARG CD 1 1 10 8879 1 1 52 ARG CG C -1.375 -4.993 5.775 1.00 . A A . 52 ARG CG 1 1 10 8880 1 1 52 ARG CZ C -0.079 -7.514 7.824 1.00 . A A . 52 ARG CZ 1 1 10 8881 1 1 52 ARG H H -2.485 -6.921 2.149 1.00 . A A . 52 ARG H 1 1 10 8882 1 1 52 ARG HA H -2.688 -7.009 5.076 1.00 . A A . 52 ARG HA 1 1 10 8883 1 1 52 ARG HB2 H -0.996 -5.315 3.710 1.00 . A A . 52 ARG HB2 1 1 10 8884 1 1 52 ARG HB3 H -2.397 -4.304 4.046 1.00 . A A . 52 ARG HB3 1 1 10 8885 1 1 52 ARG HD2 H 0.442 -5.889 5.126 1.00 . A A . 52 ARG HD2 1 1 10 8886 1 1 52 ARG HD3 H 0.490 -5.244 6.764 1.00 . A A . 52 ARG HD3 1 1 10 8887 1 1 52 ARG HE H -0.817 -7.772 5.974 1.00 . A A . 52 ARG HE 1 1 10 8888 1 1 52 ARG HG2 H -1.173 -3.944 5.933 1.00 . A A . 52 ARG HG2 1 1 10 8889 1 1 52 ARG HG3 H -2.149 -5.320 6.455 1.00 . A A . 52 ARG HG3 1 1 10 8890 1 1 52 ARG HH11 H 0.671 -5.711 8.401 1.00 . A A . 52 ARG HH11 1 1 10 8891 1 1 52 ARG HH12 H 0.720 -6.962 9.612 1.00 . A A . 52 ARG HH12 1 1 10 8892 1 1 52 ARG HH21 H -0.756 -9.413 7.562 1.00 . A A . 52 ARG HH21 1 1 10 8893 1 1 52 ARG HH22 H -0.111 -9.061 9.142 1.00 . A A . 52 ARG HH22 1 1 10 8894 1 1 52 ARG N N -2.322 -7.225 3.066 1.00 . A A . 52 ARG N 1 1 10 8895 1 1 52 ARG NE N -0.386 -7.123 6.583 1.00 . A A . 52 ARG NE 1 1 10 8896 1 1 52 ARG NH1 N 0.481 -6.662 8.678 1.00 . A A . 52 ARG NH1 1 1 10 8897 1 1 52 ARG NH2 N -0.332 -8.760 8.206 1.00 . A A . 52 ARG NH2 1 1 10 8898 1 1 52 ARG O O -5.008 -6.149 4.975 1.00 . A A . 52 ARG O 1 1 10 8899 1 1 53 CYS C C -6.967 -5.724 2.877 1.00 . A A . 53 CYS C 1 1 10 8900 1 1 53 CYS CA C -5.886 -4.644 2.851 1.00 . A A . 53 CYS CA 1 1 10 8901 1 1 53 CYS CB C -6.005 -3.824 1.570 1.00 . A A . 53 CYS CB 1 1 10 8902 1 1 53 CYS H H -3.868 -4.995 2.313 1.00 . A A . 53 CYS H 1 1 10 8903 1 1 53 CYS HA H -6.038 -3.988 3.696 1.00 . A A . 53 CYS HA 1 1 10 8904 1 1 53 CYS HB2 H -6.405 -4.453 0.791 1.00 . A A . 53 CYS HB2 1 1 10 8905 1 1 53 CYS HB3 H -6.686 -3.003 1.744 1.00 . A A . 53 CYS HB3 1 1 10 8906 1 1 53 CYS N N -4.551 -5.220 2.981 1.00 . A A . 53 CYS N 1 1 10 8907 1 1 53 CYS O O -8.012 -5.543 3.501 1.00 . A A . 53 CYS O 1 1 10 8908 1 1 53 CYS SG S -4.443 -3.122 0.947 1.00 . A A . 53 CYS SG 1 1 10 8909 1 1 54 THR C C -9.023 -7.500 1.687 1.00 . A A . 54 THR C 1 1 10 8910 1 1 54 THR CA C -7.635 -7.968 2.117 1.00 . A A . 54 THR CA 1 1 10 8911 1 1 54 THR CB C -7.737 -8.773 3.440 1.00 . A A . 54 THR CB 1 1 10 8912 1 1 54 THR CG2 C -6.800 -9.969 3.409 1.00 . A A . 54 THR CG2 1 1 10 8913 1 1 54 THR H H -5.845 -6.904 1.721 1.00 . A A . 54 THR H 1 1 10 8914 1 1 54 THR HA H -7.258 -8.636 1.354 1.00 . A A . 54 THR HA 1 1 10 8915 1 1 54 THR HB H -8.749 -9.135 3.541 1.00 . A A . 54 THR HB 1 1 10 8916 1 1 54 THR HG1 H -7.611 -7.030 4.365 1.00 . A A . 54 THR HG1 1 1 10 8917 1 1 54 THR HG21 H -7.125 -10.664 2.649 1.00 . A A . 54 THR HG21 1 1 10 8918 1 1 54 THR HG22 H -6.810 -10.459 4.371 1.00 . A A . 54 THR HG22 1 1 10 8919 1 1 54 THR HG23 H -5.797 -9.636 3.187 1.00 . A A . 54 THR HG23 1 1 10 8920 1 1 54 THR N N -6.699 -6.842 2.206 1.00 . A A . 54 THR N 1 1 10 8921 1 1 54 THR O O -10.012 -7.691 2.398 1.00 . A A . 54 THR O 1 1 10 8922 1 1 54 THR OG1 O -7.417 -7.954 4.575 1.00 . A A . 54 THR OG1 1 1 10 8923 1 1 55 CYS C C -11.271 -7.488 -0.401 1.00 . A A . 55 CYS C 1 1 10 8924 1 1 55 CYS CA C -10.326 -6.351 -0.021 1.00 . A A . 55 CYS CA 1 1 10 8925 1 1 55 CYS CB C -10.019 -5.493 -1.248 1.00 . A A . 55 CYS CB 1 1 10 8926 1 1 55 CYS H H -8.252 -6.747 0.008 1.00 . A A . 55 CYS H 1 1 10 8927 1 1 55 CYS HA H -10.794 -5.737 0.733 1.00 . A A . 55 CYS HA 1 1 10 8928 1 1 55 CYS HB2 H -10.833 -5.579 -1.952 1.00 . A A . 55 CYS HB2 1 1 10 8929 1 1 55 CYS HB3 H -9.919 -4.463 -0.942 1.00 . A A . 55 CYS HB3 1 1 10 8930 1 1 55 CYS HG H -7.731 -4.882 -2.197 1.00 . A A . 55 CYS HG 1 1 10 8931 1 1 55 CYS N N -9.079 -6.870 0.523 1.00 . A A . 55 CYS N 1 1 10 8932 1 1 55 CYS O O -10.842 -8.630 -0.568 1.00 . A A . 55 CYS O 1 1 10 8933 1 1 55 CYS SG S -8.499 -5.968 -2.098 1.00 . A A . 55 CYS SG 1 1 10 8934 1 1 56 PRO C C -13.461 -8.690 -2.335 1.00 . A A . 56 PRO C 1 1 10 8935 1 1 56 PRO CA C -13.589 -8.203 -0.892 1.00 . A A . 56 PRO CA 1 1 10 8936 1 1 56 PRO CB C -14.923 -7.470 -0.694 1.00 . A A . 56 PRO CB 1 1 10 8937 1 1 56 PRO CD C -13.191 -5.883 -0.309 1.00 . A A . 56 PRO CD 1 1 10 8938 1 1 56 PRO CG C -14.588 -6.248 0.089 1.00 . A A . 56 PRO CG 1 1 10 8939 1 1 56 PRO HA H -13.541 -9.051 -0.225 1.00 . A A . 56 PRO HA 1 1 10 8940 1 1 56 PRO HB2 H -15.343 -7.217 -1.657 1.00 . A A . 56 PRO HB2 1 1 10 8941 1 1 56 PRO HB3 H -15.608 -8.108 -0.155 1.00 . A A . 56 PRO HB3 1 1 10 8942 1 1 56 PRO HD2 H -13.199 -5.289 -1.212 1.00 . A A . 56 PRO HD2 1 1 10 8943 1 1 56 PRO HD3 H -12.691 -5.358 0.490 1.00 . A A . 56 PRO HD3 1 1 10 8944 1 1 56 PRO HG2 H -15.272 -5.451 -0.164 1.00 . A A . 56 PRO HG2 1 1 10 8945 1 1 56 PRO HG3 H -14.633 -6.462 1.146 1.00 . A A . 56 PRO HG3 1 1 10 8946 1 1 56 PRO N N -12.577 -7.196 -0.542 1.00 . A A . 56 PRO N 1 1 10 8947 1 1 56 PRO O O -14.283 -9.471 -2.815 1.00 . A A . 56 PRO O 1 1 10 8948 1 1 57 ALA C C -11.375 -10.087 -4.279 1.00 . A A . 57 ALA C 1 1 10 8949 1 1 57 ALA CA C -12.092 -8.745 -4.344 1.00 . A A . 57 ALA CA 1 1 10 8950 1 1 57 ALA CB C -11.252 -7.719 -5.091 1.00 . A A . 57 ALA CB 1 1 10 8951 1 1 57 ALA H H -11.740 -7.705 -2.544 1.00 . A A . 57 ALA H 1 1 10 8952 1 1 57 ALA HA H -13.030 -8.870 -4.870 1.00 . A A . 57 ALA HA 1 1 10 8953 1 1 57 ALA HB1 H -10.884 -6.982 -4.394 1.00 . A A . 57 ALA HB1 1 1 10 8954 1 1 57 ALA HB2 H -10.418 -8.212 -5.568 1.00 . A A . 57 ALA HB2 1 1 10 8955 1 1 57 ALA HB3 H -11.859 -7.234 -5.841 1.00 . A A . 57 ALA HB3 1 1 10 8956 1 1 57 ALA N N -12.387 -8.281 -3.000 1.00 . A A . 57 ALA N 1 1 10 8957 1 1 57 ALA O O -10.166 -10.179 -4.515 1.00 . A A . 57 ALA O 1 1 10 8958 1 1 58 LEU C C -12.590 -13.482 -4.012 1.00 . A A . 58 LEU C 1 1 10 8959 1 1 58 LEU CA C -11.552 -12.429 -3.656 1.00 . A A . 58 LEU CA 1 1 10 8960 1 1 58 LEU CB C -11.096 -12.613 -2.205 1.00 . A A . 58 LEU CB 1 1 10 8961 1 1 58 LEU CD1 C -8.955 -11.659 -1.329 1.00 . A A . 58 LEU CD1 1 1 10 8962 1 1 58 LEU CD2 C -9.360 -14.124 -1.224 1.00 . A A . 58 LEU CD2 1 1 10 8963 1 1 58 LEU CG C -9.600 -12.850 -2.020 1.00 . A A . 58 LEU CG 1 1 10 8964 1 1 58 LEU H H -13.046 -10.939 -3.605 1.00 . A A . 58 LEU H 1 1 10 8965 1 1 58 LEU HA H -10.703 -12.536 -4.313 1.00 . A A . 58 LEU HA 1 1 10 8966 1 1 58 LEU HB2 H -11.371 -11.727 -1.650 1.00 . A A . 58 LEU HB2 1 1 10 8967 1 1 58 LEU HB3 H -11.627 -13.456 -1.787 1.00 . A A . 58 LEU HB3 1 1 10 8968 1 1 58 LEU HD11 H -9.405 -10.748 -1.692 1.00 . A A . 58 LEU HD11 1 1 10 8969 1 1 58 LEU HD12 H -9.107 -11.736 -0.262 1.00 . A A . 58 LEU HD12 1 1 10 8970 1 1 58 LEU HD13 H -7.895 -11.646 -1.542 1.00 . A A . 58 LEU HD13 1 1 10 8971 1 1 58 LEU HD21 H -8.486 -14.629 -1.608 1.00 . A A . 58 LEU HD21 1 1 10 8972 1 1 58 LEU HD22 H -9.203 -13.875 -0.184 1.00 . A A . 58 LEU HD22 1 1 10 8973 1 1 58 LEU HD23 H -10.219 -14.772 -1.313 1.00 . A A . 58 LEU HD23 1 1 10 8974 1 1 58 LEU HG H -9.135 -12.967 -2.989 1.00 . A A . 58 LEU HG 1 1 10 8975 1 1 58 LEU N N -12.107 -11.102 -3.847 1.00 . A A . 58 LEU N 1 1 10 8976 1 1 58 LEU O O -12.941 -14.329 -3.191 1.00 . A A . 58 LEU O 1 1 10 8977 1 1 59 LYS C C -13.585 -15.713 -5.837 1.00 . A A . 59 LYS C 1 1 10 8978 1 1 59 LYS CA C -14.147 -14.306 -5.689 1.00 . A A . 59 LYS CA 1 1 10 8979 1 1 59 LYS CB C -14.726 -13.831 -7.018 1.00 . A A . 59 LYS CB 1 1 10 8980 1 1 59 LYS CD C -16.702 -12.530 -7.856 1.00 . A A . 59 LYS CD 1 1 10 8981 1 1 59 LYS CE C -17.481 -11.230 -7.766 1.00 . A A . 59 LYS CE 1 1 10 8982 1 1 59 LYS CG C -15.517 -12.539 -6.908 1.00 . A A . 59 LYS CG 1 1 10 8983 1 1 59 LYS H H -12.825 -12.658 -5.821 1.00 . A A . 59 LYS H 1 1 10 8984 1 1 59 LYS HA H -14.934 -14.322 -4.950 1.00 . A A . 59 LYS HA 1 1 10 8985 1 1 59 LYS HB2 H -13.915 -13.671 -7.714 1.00 . A A . 59 LYS HB2 1 1 10 8986 1 1 59 LYS HB3 H -15.380 -14.595 -7.409 1.00 . A A . 59 LYS HB3 1 1 10 8987 1 1 59 LYS HD2 H -16.343 -12.654 -8.866 1.00 . A A . 59 LYS HD2 1 1 10 8988 1 1 59 LYS HD3 H -17.358 -13.351 -7.603 1.00 . A A . 59 LYS HD3 1 1 10 8989 1 1 59 LYS HE2 H -18.142 -11.277 -6.914 1.00 . A A . 59 LYS HE2 1 1 10 8990 1 1 59 LYS HE3 H -16.782 -10.416 -7.637 1.00 . A A . 59 LYS HE3 1 1 10 8991 1 1 59 LYS HG2 H -15.878 -12.435 -5.896 1.00 . A A . 59 LYS HG2 1 1 10 8992 1 1 59 LYS HG3 H -14.869 -11.709 -7.148 1.00 . A A . 59 LYS HG3 1 1 10 8993 1 1 59 LYS HZ1 H -17.672 -10.644 -9.762 1.00 . A A . 59 LYS HZ1 1 1 10 8994 1 1 59 LYS HZ2 H -19.020 -10.271 -8.801 1.00 . A A . 59 LYS HZ2 1 1 10 8995 1 1 59 LYS HZ3 H -18.750 -11.871 -9.297 1.00 . A A . 59 LYS HZ3 1 1 10 8996 1 1 59 LYS N N -13.119 -13.385 -5.226 1.00 . A A . 59 LYS N 1 1 10 8997 1 1 59 LYS NZ N -18.287 -10.987 -8.990 1.00 . A A . 59 LYS NZ 1 1 10 8998 1 1 59 LYS O O -14.281 -16.701 -5.599 1.00 . A A . 59 LYS O 1 1 10 8999 1 1 60 GLY C C -10.432 -17.167 -5.417 1.00 . A A . 60 GLY C 1 1 10 9000 1 1 60 GLY CA C -11.662 -17.084 -6.293 1.00 . A A . 60 GLY CA 1 1 10 9001 1 1 60 GLY H H -11.792 -14.973 -6.318 1.00 . A A . 60 GLY H 1 1 10 9002 1 1 60 GLY HA2 H -12.359 -17.856 -5.999 1.00 . A A . 60 GLY HA2 1 1 10 9003 1 1 60 GLY HA3 H -11.372 -17.245 -7.320 1.00 . A A . 60 GLY HA3 1 1 10 9004 1 1 60 GLY N N -12.312 -15.797 -6.181 1.00 . A A . 60 GLY N 1 1 10 9005 1 1 60 GLY O O -10.430 -17.853 -4.396 1.00 . A A . 60 GLY O 1 1 10 9006 1 1 61 LYS C C -7.676 -14.936 -4.937 1.00 . A A . 61 LYS C 1 1 10 9007 1 1 61 LYS CA C -8.174 -16.369 -5.020 1.00 . A A . 61 LYS CA 1 1 10 9008 1 1 61 LYS CB C -7.109 -17.258 -5.666 1.00 . A A . 61 LYS CB 1 1 10 9009 1 1 61 LYS CD C -5.541 -16.589 -7.512 1.00 . A A . 61 LYS CD 1 1 10 9010 1 1 61 LYS CE C -4.794 -17.675 -8.264 1.00 . A A . 61 LYS CE 1 1 10 9011 1 1 61 LYS CG C -6.950 -17.030 -7.162 1.00 . A A . 61 LYS CG 1 1 10 9012 1 1 61 LYS H H -9.489 -15.862 -6.593 1.00 . A A . 61 LYS H 1 1 10 9013 1 1 61 LYS HA H -8.382 -16.729 -4.024 1.00 . A A . 61 LYS HA 1 1 10 9014 1 1 61 LYS HB2 H -6.159 -17.062 -5.192 1.00 . A A . 61 LYS HB2 1 1 10 9015 1 1 61 LYS HB3 H -7.374 -18.293 -5.508 1.00 . A A . 61 LYS HB3 1 1 10 9016 1 1 61 LYS HD2 H -5.595 -15.705 -8.132 1.00 . A A . 61 LYS HD2 1 1 10 9017 1 1 61 LYS HD3 H -5.009 -16.361 -6.600 1.00 . A A . 61 LYS HD3 1 1 10 9018 1 1 61 LYS HE2 H -3.752 -17.640 -7.981 1.00 . A A . 61 LYS HE2 1 1 10 9019 1 1 61 LYS HE3 H -5.207 -18.635 -7.991 1.00 . A A . 61 LYS HE3 1 1 10 9020 1 1 61 LYS HG2 H -7.168 -17.950 -7.682 1.00 . A A . 61 LYS HG2 1 1 10 9021 1 1 61 LYS HG3 H -7.645 -16.265 -7.473 1.00 . A A . 61 LYS HG3 1 1 10 9022 1 1 61 LYS HZ1 H -3.953 -17.495 -10.165 1.00 . A A . 61 LYS HZ1 1 1 10 9023 1 1 61 LYS HZ2 H -5.383 -16.609 -9.964 1.00 . A A . 61 LYS HZ2 1 1 10 9024 1 1 61 LYS HZ3 H -5.450 -18.291 -10.151 1.00 . A A . 61 LYS HZ3 1 1 10 9025 1 1 61 LYS N N -9.407 -16.421 -5.787 1.00 . A A . 61 LYS N 1 1 10 9026 1 1 61 LYS NZ N -4.901 -17.506 -9.737 1.00 . A A . 61 LYS NZ 1 1 10 9027 1 1 61 LYS O O -8.358 -14.042 -5.481 1.00 . A A . 61 LYS O 1 1 10 9028 1 1 61 LYS OXT O -6.599 -14.707 -4.354 1.00 . A A . 61 LYS OXT 1 1 10 9029 2 2 1 ZN ZN ZN -4.504 -3.444 -1.318 1.00 . B A . 62 ZN ZN 1 1 10 9030 3 2 1 ZN ZN ZN 3.884 3.795 4.332 1.00 . C A . 63 ZN ZN 1 1 11 9031 1 1 1 GLY C C -9.778 1.484 11.602 1.00 . A A . 1 GLY C 1 1 11 9032 1 1 1 GLY CA C -8.468 1.147 12.278 1.00 . A A . 1 GLY CA 1 1 11 9033 1 1 1 GLY H1 H -7.702 -0.192 13.676 1.00 . A A . 1 GLY H1 1 1 11 9034 1 1 1 GLY H2 H -8.680 -0.916 12.490 1.00 . A A . 1 GLY H2 1 1 11 9035 1 1 1 GLY H3 H -9.388 -0.016 13.744 1.00 . A A . 1 GLY H3 1 1 11 9036 1 1 1 GLY HA2 H -8.179 1.971 12.911 1.00 . A A . 1 GLY HA2 1 1 11 9037 1 1 1 GLY HA3 H -7.708 1.002 11.521 1.00 . A A . 1 GLY HA3 1 1 11 9038 1 1 1 GLY N N -8.566 -0.079 13.103 1.00 . A A . 1 GLY N 1 1 11 9039 1 1 1 GLY O O -10.201 0.781 10.685 1.00 . A A . 1 GLY O 1 1 11 9040 1 1 2 PRO C C -11.642 3.326 10.020 1.00 . A A . 2 PRO C 1 1 11 9041 1 1 2 PRO CA C -11.757 2.950 11.492 1.00 . A A . 2 PRO CA 1 1 11 9042 1 1 2 PRO CB C -12.150 4.175 12.325 1.00 . A A . 2 PRO CB 1 1 11 9043 1 1 2 PRO CD C -10.061 3.404 13.176 1.00 . A A . 2 PRO CD 1 1 11 9044 1 1 2 PRO CG C -11.346 4.067 13.573 1.00 . A A . 2 PRO CG 1 1 11 9045 1 1 2 PRO HA H -12.503 2.177 11.608 1.00 . A A . 2 PRO HA 1 1 11 9046 1 1 2 PRO HB2 H -11.910 5.076 11.779 1.00 . A A . 2 PRO HB2 1 1 11 9047 1 1 2 PRO HB3 H -13.208 4.148 12.536 1.00 . A A . 2 PRO HB3 1 1 11 9048 1 1 2 PRO HD2 H -9.335 4.139 12.857 1.00 . A A . 2 PRO HD2 1 1 11 9049 1 1 2 PRO HD3 H -9.671 2.815 13.992 1.00 . A A . 2 PRO HD3 1 1 11 9050 1 1 2 PRO HG2 H -11.153 5.052 13.973 1.00 . A A . 2 PRO HG2 1 1 11 9051 1 1 2 PRO HG3 H -11.871 3.463 14.296 1.00 . A A . 2 PRO HG3 1 1 11 9052 1 1 2 PRO N N -10.468 2.540 12.058 1.00 . A A . 2 PRO N 1 1 11 9053 1 1 2 PRO O O -10.691 3.997 9.610 1.00 . A A . 2 PRO O 1 1 11 9054 1 1 3 LEU C C -13.531 4.221 7.446 1.00 . A A . 3 LEU C 1 1 11 9055 1 1 3 LEU CA C -12.564 3.100 7.795 1.00 . A A . 3 LEU CA 1 1 11 9056 1 1 3 LEU CB C -12.932 1.833 7.027 1.00 . A A . 3 LEU CB 1 1 11 9057 1 1 3 LEU CD1 C -11.843 -0.400 7.358 1.00 . A A . 3 LEU CD1 1 1 11 9058 1 1 3 LEU CD2 C -11.688 0.749 5.145 1.00 . A A . 3 LEU CD2 1 1 11 9059 1 1 3 LEU CG C -11.748 0.942 6.651 1.00 . A A . 3 LEU CG 1 1 11 9060 1 1 3 LEU H H -13.277 2.262 9.604 1.00 . A A . 3 LEU H 1 1 11 9061 1 1 3 LEU HA H -11.566 3.400 7.521 1.00 . A A . 3 LEU HA 1 1 11 9062 1 1 3 LEU HB2 H -13.612 1.253 7.634 1.00 . A A . 3 LEU HB2 1 1 11 9063 1 1 3 LEU HB3 H -13.440 2.123 6.120 1.00 . A A . 3 LEU HB3 1 1 11 9064 1 1 3 LEU HD11 H -12.861 -0.763 7.308 1.00 . A A . 3 LEU HD11 1 1 11 9065 1 1 3 LEU HD12 H -11.187 -1.110 6.876 1.00 . A A . 3 LEU HD12 1 1 11 9066 1 1 3 LEU HD13 H -11.553 -0.285 8.392 1.00 . A A . 3 LEU HD13 1 1 11 9067 1 1 3 LEU HD21 H -12.188 1.572 4.655 1.00 . A A . 3 LEU HD21 1 1 11 9068 1 1 3 LEU HD22 H -10.656 0.715 4.827 1.00 . A A . 3 LEU HD22 1 1 11 9069 1 1 3 LEU HD23 H -12.177 -0.177 4.880 1.00 . A A . 3 LEU HD23 1 1 11 9070 1 1 3 LEU HG H -10.831 1.420 6.964 1.00 . A A . 3 LEU HG 1 1 11 9071 1 1 3 LEU N N -12.575 2.843 9.224 1.00 . A A . 3 LEU N 1 1 11 9072 1 1 3 LEU O O -14.740 4.112 7.673 1.00 . A A . 3 LEU O 1 1 11 9073 1 1 4 GLY C C -14.414 6.179 5.092 1.00 . A A . 4 GLY C 1 1 11 9074 1 1 4 GLY CA C -13.830 6.402 6.469 1.00 . A A . 4 GLY CA 1 1 11 9075 1 1 4 GLY H H -12.034 5.307 6.687 1.00 . A A . 4 GLY H 1 1 11 9076 1 1 4 GLY HA2 H -14.634 6.520 7.179 1.00 . A A . 4 GLY HA2 1 1 11 9077 1 1 4 GLY HA3 H -13.233 7.302 6.455 1.00 . A A . 4 GLY HA3 1 1 11 9078 1 1 4 GLY N N -12.998 5.291 6.876 1.00 . A A . 4 GLY N 1 1 11 9079 1 1 4 GLY O O -14.141 5.158 4.456 1.00 . A A . 4 GLY O 1 1 11 9080 1 1 5 SER C C -14.808 7.441 2.197 1.00 . A A . 5 SER C 1 1 11 9081 1 1 5 SER CA C -15.797 7.030 3.289 1.00 . A A . 5 SER CA 1 1 11 9082 1 1 5 SER CB C -17.056 7.894 3.229 1.00 . A A . 5 SER CB 1 1 11 9083 1 1 5 SER H H -15.351 7.943 5.149 1.00 . A A . 5 SER H 1 1 11 9084 1 1 5 SER HA H -16.074 5.999 3.135 1.00 . A A . 5 SER HA 1 1 11 9085 1 1 5 SER HB2 H -16.801 8.872 2.848 1.00 . A A . 5 SER HB2 1 1 11 9086 1 1 5 SER HB3 H -17.779 7.429 2.575 1.00 . A A . 5 SER HB3 1 1 11 9087 1 1 5 SER HG H -17.142 8.719 5.013 1.00 . A A . 5 SER HG 1 1 11 9088 1 1 5 SER N N -15.190 7.134 4.609 1.00 . A A . 5 SER N 1 1 11 9089 1 1 5 SER O O -15.119 8.257 1.328 1.00 . A A . 5 SER O 1 1 11 9090 1 1 5 SER OG O -17.630 8.039 4.520 1.00 . A A . 5 SER OG 1 1 11 9091 1 1 6 ASP C C -12.597 6.050 0.177 1.00 . A A . 6 ASP C 1 1 11 9092 1 1 6 ASP CA C -12.593 7.128 1.246 1.00 . A A . 6 ASP CA 1 1 11 9093 1 1 6 ASP CB C -11.214 7.207 1.903 1.00 . A A . 6 ASP CB 1 1 11 9094 1 1 6 ASP CG C -10.693 8.629 1.986 1.00 . A A . 6 ASP CG 1 1 11 9095 1 1 6 ASP H H -13.444 6.183 2.936 1.00 . A A . 6 ASP H 1 1 11 9096 1 1 6 ASP HA H -12.821 8.079 0.787 1.00 . A A . 6 ASP HA 1 1 11 9097 1 1 6 ASP HB2 H -11.274 6.806 2.905 1.00 . A A . 6 ASP HB2 1 1 11 9098 1 1 6 ASP HB3 H -10.513 6.619 1.327 1.00 . A A . 6 ASP HB3 1 1 11 9099 1 1 6 ASP N N -13.622 6.849 2.237 1.00 . A A . 6 ASP N 1 1 11 9100 1 1 6 ASP O O -12.303 4.887 0.455 1.00 . A A . 6 ASP O 1 1 11 9101 1 1 6 ASP OD1 O -10.440 9.239 0.927 1.00 . A A . 6 ASP OD1 1 1 11 9102 1 1 6 ASP OD2 O -10.547 9.147 3.113 1.00 . A A . 6 ASP OD2 1 1 11 9103 1 1 7 HIS C C -11.794 5.333 -2.877 1.00 . A A . 7 HIS C 1 1 11 9104 1 1 7 HIS CA C -13.115 5.482 -2.132 1.00 . A A . 7 HIS CA 1 1 11 9105 1 1 7 HIS CB C -14.225 5.909 -3.108 1.00 . A A . 7 HIS CB 1 1 11 9106 1 1 7 HIS CD2 C -14.150 8.434 -3.657 1.00 . A A . 7 HIS CD2 1 1 11 9107 1 1 7 HIS CE1 C -15.714 9.068 -2.282 1.00 . A A . 7 HIS CE1 1 1 11 9108 1 1 7 HIS CG C -14.631 7.351 -3.002 1.00 . A A . 7 HIS CG 1 1 11 9109 1 1 7 HIS H H -13.250 7.366 -1.171 1.00 . A A . 7 HIS H 1 1 11 9110 1 1 7 HIS HA H -13.377 4.524 -1.709 1.00 . A A . 7 HIS HA 1 1 11 9111 1 1 7 HIS HB2 H -13.887 5.739 -4.117 1.00 . A A . 7 HIS HB2 1 1 11 9112 1 1 7 HIS HB3 H -15.103 5.304 -2.925 1.00 . A A . 7 HIS HB3 1 1 11 9113 1 1 7 HIS HD2 H -13.374 8.442 -4.410 1.00 . A A . 7 HIS HD2 1 1 11 9114 1 1 7 HIS HE1 H -16.407 9.692 -1.738 1.00 . A A . 7 HIS HE1 1 1 11 9115 1 1 7 HIS HE2 H -14.568 10.462 -3.305 1.00 . A A . 7 HIS HE2 1 1 11 9116 1 1 7 HIS N N -12.993 6.427 -1.027 1.00 . A A . 7 HIS N 1 1 11 9117 1 1 7 HIS ND1 N -15.620 7.755 -2.138 1.00 . A A . 7 HIS ND1 1 1 11 9118 1 1 7 HIS NE2 N -14.842 9.523 -3.192 1.00 . A A . 7 HIS NE2 1 1 11 9119 1 1 7 HIS O O -11.629 4.416 -3.682 1.00 . A A . 7 HIS O 1 1 11 9120 1 1 8 HIS C C -8.480 6.726 -2.206 1.00 . A A . 8 HIS C 1 1 11 9121 1 1 8 HIS CA C -9.513 6.139 -3.159 1.00 . A A . 8 HIS CA 1 1 11 9122 1 1 8 HIS CB C -9.484 6.893 -4.492 1.00 . A A . 8 HIS CB 1 1 11 9123 1 1 8 HIS CD2 C -7.142 6.492 -5.503 1.00 . A A . 8 HIS CD2 1 1 11 9124 1 1 8 HIS CE1 C -7.769 5.244 -7.172 1.00 . A A . 8 HIS CE1 1 1 11 9125 1 1 8 HIS CG C -8.489 6.345 -5.470 1.00 . A A . 8 HIS CG 1 1 11 9126 1 1 8 HIS H H -11.024 6.886 -1.883 1.00 . A A . 8 HIS H 1 1 11 9127 1 1 8 HIS HA H -9.276 5.099 -3.336 1.00 . A A . 8 HIS HA 1 1 11 9128 1 1 8 HIS HB2 H -10.460 6.840 -4.949 1.00 . A A . 8 HIS HB2 1 1 11 9129 1 1 8 HIS HB3 H -9.235 7.927 -4.306 1.00 . A A . 8 HIS HB3 1 1 11 9130 1 1 8 HIS HD2 H -6.537 7.055 -4.808 1.00 . A A . 8 HIS HD2 1 1 11 9131 1 1 8 HIS HE1 H -7.735 4.627 -8.056 1.00 . A A . 8 HIS HE1 1 1 11 9132 1 1 8 HIS HE2 H -5.793 5.854 -6.986 1.00 . A A . 8 HIS HE2 1 1 11 9133 1 1 8 HIS N N -10.841 6.202 -2.563 1.00 . A A . 8 HIS N 1 1 11 9134 1 1 8 HIS ND1 N -8.879 5.557 -6.525 1.00 . A A . 8 HIS ND1 1 1 11 9135 1 1 8 HIS NE2 N -6.693 5.789 -6.589 1.00 . A A . 8 HIS NE2 1 1 11 9136 1 1 8 HIS O O -8.747 7.719 -1.528 1.00 . A A . 8 HIS O 1 1 11 9137 1 1 9 MET C C -4.952 6.745 -2.040 1.00 . A A . 9 MET C 1 1 11 9138 1 1 9 MET CA C -6.249 6.557 -1.264 1.00 . A A . 9 MET CA 1 1 11 9139 1 1 9 MET CB C -6.031 5.561 -0.126 1.00 . A A . 9 MET CB 1 1 11 9140 1 1 9 MET CE C -7.779 6.134 3.266 1.00 . A A . 9 MET CE 1 1 11 9141 1 1 9 MET CG C -5.909 6.226 1.230 1.00 . A A . 9 MET CG 1 1 11 9142 1 1 9 MET H H -7.163 5.303 -2.698 1.00 . A A . 9 MET H 1 1 11 9143 1 1 9 MET HA H -6.547 7.507 -0.849 1.00 . A A . 9 MET HA 1 1 11 9144 1 1 9 MET HB2 H -6.864 4.875 -0.095 1.00 . A A . 9 MET HB2 1 1 11 9145 1 1 9 MET HB3 H -5.124 5.006 -0.315 1.00 . A A . 9 MET HB3 1 1 11 9146 1 1 9 MET HE1 H -7.378 7.019 3.739 1.00 . A A . 9 MET HE1 1 1 11 9147 1 1 9 MET HE2 H -8.452 6.423 2.473 1.00 . A A . 9 MET HE2 1 1 11 9148 1 1 9 MET HE3 H -8.317 5.548 3.996 1.00 . A A . 9 MET HE3 1 1 11 9149 1 1 9 MET HG2 H -4.877 6.503 1.388 1.00 . A A . 9 MET HG2 1 1 11 9150 1 1 9 MET HG3 H -6.523 7.114 1.227 1.00 . A A . 9 MET HG3 1 1 11 9151 1 1 9 MET N N -7.313 6.100 -2.141 1.00 . A A . 9 MET N 1 1 11 9152 1 1 9 MET O O -4.341 5.778 -2.495 1.00 . A A . 9 MET O 1 1 11 9153 1 1 9 MET SD S -6.437 5.160 2.585 1.00 . A A . 9 MET SD 1 1 11 9154 1 1 10 GLU C C -2.097 8.154 -1.942 1.00 . A A . 10 GLU C 1 1 11 9155 1 1 10 GLU CA C -3.293 8.318 -2.870 1.00 . A A . 10 GLU CA 1 1 11 9156 1 1 10 GLU CB C -3.348 9.750 -3.402 1.00 . A A . 10 GLU CB 1 1 11 9157 1 1 10 GLU CD C -5.135 11.423 -4.037 1.00 . A A . 10 GLU CD 1 1 11 9158 1 1 10 GLU CG C -4.576 10.033 -4.252 1.00 . A A . 10 GLU CG 1 1 11 9159 1 1 10 GLU H H -5.052 8.721 -1.760 1.00 . A A . 10 GLU H 1 1 11 9160 1 1 10 GLU HA H -3.189 7.635 -3.701 1.00 . A A . 10 GLU HA 1 1 11 9161 1 1 10 GLU HB2 H -3.352 10.433 -2.565 1.00 . A A . 10 GLU HB2 1 1 11 9162 1 1 10 GLU HB3 H -2.470 9.935 -4.001 1.00 . A A . 10 GLU HB3 1 1 11 9163 1 1 10 GLU HG2 H -4.306 9.929 -5.292 1.00 . A A . 10 GLU HG2 1 1 11 9164 1 1 10 GLU HG3 H -5.341 9.312 -4.006 1.00 . A A . 10 GLU HG3 1 1 11 9165 1 1 10 GLU N N -4.528 7.992 -2.169 1.00 . A A . 10 GLU N 1 1 11 9166 1 1 10 GLU O O -0.976 7.926 -2.391 1.00 . A A . 10 GLU O 1 1 11 9167 1 1 10 GLU OE1 O -5.087 11.921 -2.891 1.00 . A A . 10 GLU OE1 1 1 11 9168 1 1 10 GLU OE2 O -5.626 12.023 -5.014 1.00 . A A . 10 GLU OE2 1 1 11 9169 1 1 11 PHE C C -1.437 6.566 0.899 1.00 . A A . 11 PHE C 1 1 11 9170 1 1 11 PHE CA C -1.330 7.981 0.351 1.00 . A A . 11 PHE CA 1 1 11 9171 1 1 11 PHE CB C -1.437 9.010 1.486 1.00 . A A . 11 PHE CB 1 1 11 9172 1 1 11 PHE CD1 C -3.862 9.635 1.724 1.00 . A A . 11 PHE CD1 1 1 11 9173 1 1 11 PHE CD2 C -2.856 8.334 3.451 1.00 . A A . 11 PHE CD2 1 1 11 9174 1 1 11 PHE CE1 C -5.059 9.626 2.413 1.00 . A A . 11 PHE CE1 1 1 11 9175 1 1 11 PHE CE2 C -4.053 8.321 4.142 1.00 . A A . 11 PHE CE2 1 1 11 9176 1 1 11 PHE CG C -2.746 8.988 2.233 1.00 . A A . 11 PHE CG 1 1 11 9177 1 1 11 PHE CZ C -5.155 8.968 3.622 1.00 . A A . 11 PHE CZ 1 1 11 9178 1 1 11 PHE H H -3.289 8.321 -0.358 1.00 . A A . 11 PHE H 1 1 11 9179 1 1 11 PHE HA H -0.372 8.091 -0.135 1.00 . A A . 11 PHE HA 1 1 11 9180 1 1 11 PHE HB2 H -0.650 8.825 2.200 1.00 . A A . 11 PHE HB2 1 1 11 9181 1 1 11 PHE HB3 H -1.308 10.001 1.071 1.00 . A A . 11 PHE HB3 1 1 11 9182 1 1 11 PHE HD1 H -3.790 10.147 0.775 1.00 . A A . 11 PHE HD1 1 1 11 9183 1 1 11 PHE HD2 H -1.994 7.829 3.861 1.00 . A A . 11 PHE HD2 1 1 11 9184 1 1 11 PHE HE1 H -5.920 10.134 2.004 1.00 . A A . 11 PHE HE1 1 1 11 9185 1 1 11 PHE HE2 H -4.126 7.804 5.087 1.00 . A A . 11 PHE HE2 1 1 11 9186 1 1 11 PHE HZ H -6.091 8.961 4.162 1.00 . A A . 11 PHE HZ 1 1 11 9187 1 1 11 PHE N N -2.362 8.200 -0.648 1.00 . A A . 11 PHE N 1 1 11 9188 1 1 11 PHE O O -2.459 5.899 0.721 1.00 . A A . 11 PHE O 1 1 11 9189 1 1 12 CYS C C -1.212 4.586 3.249 1.00 . A A . 12 CYS C 1 1 11 9190 1 1 12 CYS CA C -0.338 4.719 2.008 1.00 . A A . 12 CYS CA 1 1 11 9191 1 1 12 CYS CB C 1.096 4.274 2.287 1.00 . A A . 12 CYS CB 1 1 11 9192 1 1 12 CYS H H 0.449 6.632 1.563 1.00 . A A . 12 CYS H 1 1 11 9193 1 1 12 CYS HA H -0.753 4.086 1.237 1.00 . A A . 12 CYS HA 1 1 11 9194 1 1 12 CYS HB2 H 1.170 3.211 2.114 1.00 . A A . 12 CYS HB2 1 1 11 9195 1 1 12 CYS HB3 H 1.758 4.787 1.606 1.00 . A A . 12 CYS HB3 1 1 11 9196 1 1 12 CYS HG H 2.925 5.061 3.878 1.00 . A A . 12 CYS HG 1 1 11 9197 1 1 12 CYS N N -0.361 6.080 1.501 1.00 . A A . 12 CYS N 1 1 11 9198 1 1 12 CYS O O -1.362 5.534 4.012 1.00 . A A . 12 CYS O 1 1 11 9199 1 1 12 CYS SG S 1.686 4.590 3.961 1.00 . A A . 12 CYS SG 1 1 11 9200 1 1 13 ARG C C -2.165 3.189 5.817 1.00 . A A . 13 ARG C 1 1 11 9201 1 1 13 ARG CA C -2.844 3.244 4.448 1.00 . A A . 13 ARG CA 1 1 11 9202 1 1 13 ARG CB C -3.638 1.958 4.209 1.00 . A A . 13 ARG CB 1 1 11 9203 1 1 13 ARG CD C -5.814 1.388 3.070 1.00 . A A . 13 ARG CD 1 1 11 9204 1 1 13 ARG CG C -4.411 1.953 2.899 1.00 . A A . 13 ARG CG 1 1 11 9205 1 1 13 ARG CZ C -5.717 -1.080 2.992 1.00 . A A . 13 ARG CZ 1 1 11 9206 1 1 13 ARG H H -1.792 2.768 2.675 1.00 . A A . 13 ARG H 1 1 11 9207 1 1 13 ARG HA H -3.527 4.079 4.437 1.00 . A A . 13 ARG HA 1 1 11 9208 1 1 13 ARG HB2 H -2.953 1.121 4.200 1.00 . A A . 13 ARG HB2 1 1 11 9209 1 1 13 ARG HB3 H -4.341 1.826 5.020 1.00 . A A . 13 ARG HB3 1 1 11 9210 1 1 13 ARG HD2 H -6.385 2.058 3.695 1.00 . A A . 13 ARG HD2 1 1 11 9211 1 1 13 ARG HD3 H -6.278 1.323 2.097 1.00 . A A . 13 ARG HD3 1 1 11 9212 1 1 13 ARG HE H -5.848 0.022 4.666 1.00 . A A . 13 ARG HE 1 1 11 9213 1 1 13 ARG HG2 H -4.487 2.968 2.534 1.00 . A A . 13 ARG HG2 1 1 11 9214 1 1 13 ARG HG3 H -3.875 1.351 2.179 1.00 . A A . 13 ARG HG3 1 1 11 9215 1 1 13 ARG HH11 H -5.781 -0.204 1.156 1.00 . A A . 13 ARG HH11 1 1 11 9216 1 1 13 ARG HH12 H -5.619 -1.937 1.158 1.00 . A A . 13 ARG HH12 1 1 11 9217 1 1 13 ARG HH21 H -5.665 -2.275 4.633 1.00 . A A . 13 ARG HH21 1 1 11 9218 1 1 13 ARG HH22 H -5.563 -3.097 3.103 1.00 . A A . 13 ARG HH22 1 1 11 9219 1 1 13 ARG N N -1.879 3.449 3.375 1.00 . A A . 13 ARG N 1 1 11 9220 1 1 13 ARG NE N -5.805 0.061 3.681 1.00 . A A . 13 ARG NE 1 1 11 9221 1 1 13 ARG NH1 N -5.712 -1.069 1.664 1.00 . A A . 13 ARG NH1 1 1 11 9222 1 1 13 ARG NH2 N -5.649 -2.241 3.629 1.00 . A A . 13 ARG NH2 1 1 11 9223 1 1 13 ARG O O -2.612 3.838 6.759 1.00 . A A . 13 ARG O 1 1 11 9224 1 1 14 VAL C C 0.276 3.360 7.710 1.00 . A A . 14 VAL C 1 1 11 9225 1 1 14 VAL CA C -0.484 2.123 7.226 1.00 . A A . 14 VAL CA 1 1 11 9226 1 1 14 VAL CB C 0.475 0.916 7.166 1.00 . A A . 14 VAL CB 1 1 11 9227 1 1 14 VAL CG1 C 0.737 0.377 8.564 1.00 . A A . 14 VAL CG1 1 1 11 9228 1 1 14 VAL CG2 C -0.094 -0.177 6.273 1.00 . A A . 14 VAL CG2 1 1 11 9229 1 1 14 VAL H H -0.865 1.820 5.165 1.00 . A A . 14 VAL H 1 1 11 9230 1 1 14 VAL HA H -1.259 1.897 7.944 1.00 . A A . 14 VAL HA 1 1 11 9231 1 1 14 VAL HB H 1.414 1.245 6.747 1.00 . A A . 14 VAL HB 1 1 11 9232 1 1 14 VAL HG11 H 1.450 -0.434 8.510 1.00 . A A . 14 VAL HG11 1 1 11 9233 1 1 14 VAL HG12 H 1.138 1.164 9.186 1.00 . A A . 14 VAL HG12 1 1 11 9234 1 1 14 VAL HG13 H -0.187 0.016 8.991 1.00 . A A . 14 VAL HG13 1 1 11 9235 1 1 14 VAL HG21 H -1.119 0.057 6.027 1.00 . A A . 14 VAL HG21 1 1 11 9236 1 1 14 VAL HG22 H 0.488 -0.238 5.364 1.00 . A A . 14 VAL HG22 1 1 11 9237 1 1 14 VAL HG23 H -0.054 -1.122 6.791 1.00 . A A . 14 VAL HG23 1 1 11 9238 1 1 14 VAL N N -1.137 2.353 5.937 1.00 . A A . 14 VAL N 1 1 11 9239 1 1 14 VAL O O -0.194 4.075 8.593 1.00 . A A . 14 VAL O 1 1 11 9240 1 1 15 CYS C C 1.831 6.078 6.791 1.00 . A A . 15 CYS C 1 1 11 9241 1 1 15 CYS CA C 2.221 4.794 7.518 1.00 . A A . 15 CYS CA 1 1 11 9242 1 1 15 CYS CB C 3.726 4.508 7.422 1.00 . A A . 15 CYS CB 1 1 11 9243 1 1 15 CYS H H 1.760 3.048 6.411 1.00 . A A . 15 CYS H 1 1 11 9244 1 1 15 CYS HA H 1.996 4.952 8.564 1.00 . A A . 15 CYS HA 1 1 11 9245 1 1 15 CYS HB2 H 4.218 5.389 7.049 1.00 . A A . 15 CYS HB2 1 1 11 9246 1 1 15 CYS HB3 H 4.098 4.297 8.415 1.00 . A A . 15 CYS HB3 1 1 11 9247 1 1 15 CYS N N 1.433 3.633 7.120 1.00 . A A . 15 CYS N 1 1 11 9248 1 1 15 CYS O O 2.635 7.001 6.713 1.00 . A A . 15 CYS O 1 1 11 9249 1 1 15 CYS SG S 4.225 3.115 6.344 1.00 . A A . 15 CYS SG 1 1 11 9250 1 1 16 LYS C C 0.887 8.335 5.195 1.00 . A A . 16 LYS C 1 1 11 9251 1 1 16 LYS CA C -0.097 7.370 5.856 1.00 . A A . 16 LYS CA 1 1 11 9252 1 1 16 LYS CB C -0.888 8.105 6.939 1.00 . A A . 16 LYS CB 1 1 11 9253 1 1 16 LYS CD C -2.314 7.606 8.947 1.00 . A A . 16 LYS CD 1 1 11 9254 1 1 16 LYS CE C -2.994 8.950 9.149 1.00 . A A . 16 LYS CE 1 1 11 9255 1 1 16 LYS CG C -2.069 7.316 7.474 1.00 . A A . 16 LYS CG 1 1 11 9256 1 1 16 LYS H H -0.044 5.413 6.665 1.00 . A A . 16 LYS H 1 1 11 9257 1 1 16 LYS HA H -0.793 7.032 5.104 1.00 . A A . 16 LYS HA 1 1 11 9258 1 1 16 LYS HB2 H -0.227 8.326 7.764 1.00 . A A . 16 LYS HB2 1 1 11 9259 1 1 16 LYS HB3 H -1.259 9.033 6.529 1.00 . A A . 16 LYS HB3 1 1 11 9260 1 1 16 LYS HD2 H -2.947 6.831 9.354 1.00 . A A . 16 LYS HD2 1 1 11 9261 1 1 16 LYS HD3 H -1.367 7.609 9.465 1.00 . A A . 16 LYS HD3 1 1 11 9262 1 1 16 LYS HE2 H -2.235 9.706 9.293 1.00 . A A . 16 LYS HE2 1 1 11 9263 1 1 16 LYS HE3 H -3.570 9.184 8.264 1.00 . A A . 16 LYS HE3 1 1 11 9264 1 1 16 LYS HG2 H -2.952 7.584 6.913 1.00 . A A . 16 LYS HG2 1 1 11 9265 1 1 16 LYS HG3 H -1.870 6.261 7.353 1.00 . A A . 16 LYS HG3 1 1 11 9266 1 1 16 LYS HZ1 H -3.402 8.552 11.159 1.00 . A A . 16 LYS HZ1 1 1 11 9267 1 1 16 LYS HZ2 H -4.740 8.357 10.135 1.00 . A A . 16 LYS HZ2 1 1 11 9268 1 1 16 LYS HZ3 H -4.208 9.914 10.549 1.00 . A A . 16 LYS HZ3 1 1 11 9269 1 1 16 LYS N N 0.540 6.165 6.433 1.00 . A A . 16 LYS N 1 1 11 9270 1 1 16 LYS NZ N -3.897 8.944 10.329 1.00 . A A . 16 LYS NZ 1 1 11 9271 1 1 16 LYS O O 1.014 9.488 5.606 1.00 . A A . 16 LYS O 1 1 11 9272 1 1 17 ASP C C 2.801 8.223 2.089 1.00 . A A . 17 ASP C 1 1 11 9273 1 1 17 ASP CA C 2.629 8.654 3.541 1.00 . A A . 17 ASP CA 1 1 11 9274 1 1 17 ASP CB C 3.957 8.525 4.293 1.00 . A A . 17 ASP CB 1 1 11 9275 1 1 17 ASP CG C 5.020 9.472 3.779 1.00 . A A . 17 ASP CG 1 1 11 9276 1 1 17 ASP H H 1.493 6.908 3.940 1.00 . A A . 17 ASP H 1 1 11 9277 1 1 17 ASP HA H 2.305 9.684 3.568 1.00 . A A . 17 ASP HA 1 1 11 9278 1 1 17 ASP HB2 H 3.790 8.736 5.337 1.00 . A A . 17 ASP HB2 1 1 11 9279 1 1 17 ASP HB3 H 4.323 7.514 4.192 1.00 . A A . 17 ASP HB3 1 1 11 9280 1 1 17 ASP N N 1.610 7.846 4.202 1.00 . A A . 17 ASP N 1 1 11 9281 1 1 17 ASP O O 2.446 7.098 1.727 1.00 . A A . 17 ASP O 1 1 11 9282 1 1 17 ASP OD1 O 4.933 10.684 4.057 1.00 . A A . 17 ASP OD1 1 1 11 9283 1 1 17 ASP OD2 O 5.948 9.005 3.093 1.00 . A A . 17 ASP OD2 1 1 11 9284 1 1 18 GLY C C 5.031 8.684 -0.461 1.00 . A A . 18 GLY C 1 1 11 9285 1 1 18 GLY CA C 3.559 8.805 -0.130 1.00 . A A . 18 GLY CA 1 1 11 9286 1 1 18 GLY H H 3.611 9.988 1.620 1.00 . A A . 18 GLY H 1 1 11 9287 1 1 18 GLY HA2 H 3.068 7.870 -0.364 1.00 . A A . 18 GLY HA2 1 1 11 9288 1 1 18 GLY HA3 H 3.127 9.590 -0.736 1.00 . A A . 18 GLY HA3 1 1 11 9289 1 1 18 GLY N N 3.338 9.115 1.267 1.00 . A A . 18 GLY N 1 1 11 9290 1 1 18 GLY O O 5.778 8.011 0.250 1.00 . A A . 18 GLY O 1 1 11 9291 1 1 19 GLY C C 7.131 7.957 -2.674 1.00 . A A . 19 GLY C 1 1 11 9292 1 1 19 GLY CA C 6.831 9.262 -1.973 1.00 . A A . 19 GLY CA 1 1 11 9293 1 1 19 GLY H H 4.796 9.846 -2.074 1.00 . A A . 19 GLY H 1 1 11 9294 1 1 19 GLY HA2 H 7.029 10.080 -2.652 1.00 . A A . 19 GLY HA2 1 1 11 9295 1 1 19 GLY HA3 H 7.475 9.356 -1.110 1.00 . A A . 19 GLY HA3 1 1 11 9296 1 1 19 GLY N N 5.445 9.330 -1.545 1.00 . A A . 19 GLY N 1 1 11 9297 1 1 19 GLY O O 6.963 7.846 -3.888 1.00 . A A . 19 GLY O 1 1 11 9298 1 1 20 GLU C C 6.132 4.975 -2.515 1.00 . A A . 20 GLU C 1 1 11 9299 1 1 20 GLU CA C 7.521 5.578 -2.411 1.00 . A A . 20 GLU CA 1 1 11 9300 1 1 20 GLU CB C 8.403 4.723 -1.497 1.00 . A A . 20 GLU CB 1 1 11 9301 1 1 20 GLU CD C 10.652 4.396 -2.576 1.00 . A A . 20 GLU CD 1 1 11 9302 1 1 20 GLU CG C 9.315 3.771 -2.250 1.00 . A A . 20 GLU CG 1 1 11 9303 1 1 20 GLU H H 7.372 7.059 -0.915 1.00 . A A . 20 GLU H 1 1 11 9304 1 1 20 GLU HA H 7.962 5.633 -3.395 1.00 . A A . 20 GLU HA 1 1 11 9305 1 1 20 GLU HB2 H 9.021 5.376 -0.897 1.00 . A A . 20 GLU HB2 1 1 11 9306 1 1 20 GLU HB3 H 7.771 4.140 -0.844 1.00 . A A . 20 GLU HB3 1 1 11 9307 1 1 20 GLU HG2 H 9.482 2.894 -1.644 1.00 . A A . 20 GLU HG2 1 1 11 9308 1 1 20 GLU HG3 H 8.834 3.484 -3.173 1.00 . A A . 20 GLU HG3 1 1 11 9309 1 1 20 GLU N N 7.400 6.927 -1.886 1.00 . A A . 20 GLU N 1 1 11 9310 1 1 20 GLU O O 5.568 4.546 -1.510 1.00 . A A . 20 GLU O 1 1 11 9311 1 1 20 GLU OE1 O 11.575 4.304 -1.741 1.00 . A A . 20 GLU OE1 1 1 11 9312 1 1 20 GLU OE2 O 10.788 4.988 -3.667 1.00 . A A . 20 GLU OE2 1 1 11 9313 1 1 21 LEU C C 3.858 3.660 -4.717 1.00 . A A . 21 LEU C 1 1 11 9314 1 1 21 LEU CA C 4.089 4.850 -3.797 1.00 . A A . 21 LEU CA 1 1 11 9315 1 1 21 LEU CB C 3.315 6.070 -4.312 1.00 . A A . 21 LEU CB 1 1 11 9316 1 1 21 LEU CD1 C 2.332 6.045 -1.990 1.00 . A A . 21 LEU CD1 1 1 11 9317 1 1 21 LEU CD2 C 2.118 8.080 -3.426 1.00 . A A . 21 LEU CD2 1 1 11 9318 1 1 21 LEU CG C 2.174 6.561 -3.413 1.00 . A A . 21 LEU CG 1 1 11 9319 1 1 21 LEU H H 5.942 5.683 -4.373 1.00 . A A . 21 LEU H 1 1 11 9320 1 1 21 LEU HA H 3.719 4.596 -2.815 1.00 . A A . 21 LEU HA 1 1 11 9321 1 1 21 LEU HB2 H 4.015 6.882 -4.441 1.00 . A A . 21 LEU HB2 1 1 11 9322 1 1 21 LEU HB3 H 2.898 5.821 -5.277 1.00 . A A . 21 LEU HB3 1 1 11 9323 1 1 21 LEU HD11 H 1.607 6.528 -1.349 1.00 . A A . 21 LEU HD11 1 1 11 9324 1 1 21 LEU HD12 H 2.172 4.977 -1.973 1.00 . A A . 21 LEU HD12 1 1 11 9325 1 1 21 LEU HD13 H 3.327 6.266 -1.635 1.00 . A A . 21 LEU HD13 1 1 11 9326 1 1 21 LEU HD21 H 2.621 8.451 -4.306 1.00 . A A . 21 LEU HD21 1 1 11 9327 1 1 21 LEU HD22 H 1.087 8.402 -3.437 1.00 . A A . 21 LEU HD22 1 1 11 9328 1 1 21 LEU HD23 H 2.606 8.465 -2.542 1.00 . A A . 21 LEU HD23 1 1 11 9329 1 1 21 LEU HG H 1.237 6.191 -3.799 1.00 . A A . 21 LEU HG 1 1 11 9330 1 1 21 LEU N N 5.497 5.175 -3.660 1.00 . A A . 21 LEU N 1 1 11 9331 1 1 21 LEU O O 3.644 3.820 -5.921 1.00 . A A . 21 LEU O 1 1 11 9332 1 1 22 LEU C C 1.744 1.324 -4.900 1.00 . A A . 22 LEU C 1 1 11 9333 1 1 22 LEU CA C 3.263 1.308 -4.806 1.00 . A A . 22 LEU CA 1 1 11 9334 1 1 22 LEU CB C 3.719 0.048 -4.070 1.00 . A A . 22 LEU CB 1 1 11 9335 1 1 22 LEU CD1 C 5.425 -1.768 -3.872 1.00 . A A . 22 LEU CD1 1 1 11 9336 1 1 22 LEU CD2 C 4.018 -1.608 -5.933 1.00 . A A . 22 LEU CD2 1 1 11 9337 1 1 22 LEU CG C 4.718 -0.825 -4.829 1.00 . A A . 22 LEU CG 1 1 11 9338 1 1 22 LEU H H 3.742 2.482 -3.121 1.00 . A A . 22 LEU H 1 1 11 9339 1 1 22 LEU HA H 3.683 1.320 -5.800 1.00 . A A . 22 LEU HA 1 1 11 9340 1 1 22 LEU HB2 H 4.170 0.345 -3.136 1.00 . A A . 22 LEU HB2 1 1 11 9341 1 1 22 LEU HB3 H 2.847 -0.551 -3.854 1.00 . A A . 22 LEU HB3 1 1 11 9342 1 1 22 LEU HD11 H 6.314 -1.292 -3.489 1.00 . A A . 22 LEU HD11 1 1 11 9343 1 1 22 LEU HD12 H 4.764 -2.009 -3.051 1.00 . A A . 22 LEU HD12 1 1 11 9344 1 1 22 LEU HD13 H 5.695 -2.675 -4.393 1.00 . A A . 22 LEU HD13 1 1 11 9345 1 1 22 LEU HD21 H 3.510 -2.459 -5.503 1.00 . A A . 22 LEU HD21 1 1 11 9346 1 1 22 LEU HD22 H 3.298 -0.969 -6.424 1.00 . A A . 22 LEU HD22 1 1 11 9347 1 1 22 LEU HD23 H 4.747 -1.948 -6.650 1.00 . A A . 22 LEU HD23 1 1 11 9348 1 1 22 LEU HG H 5.461 -0.194 -5.288 1.00 . A A . 22 LEU HG 1 1 11 9349 1 1 22 LEU N N 3.705 2.500 -4.105 1.00 . A A . 22 LEU N 1 1 11 9350 1 1 22 LEU O O 1.074 1.976 -4.095 1.00 . A A . 22 LEU O 1 1 11 9351 1 1 23 CYS C C -0.841 -0.667 -5.584 1.00 . A A . 23 CYS C 1 1 11 9352 1 1 23 CYS CA C -0.234 0.630 -6.100 1.00 . A A . 23 CYS CA 1 1 11 9353 1 1 23 CYS CB C -0.553 0.797 -7.586 1.00 . A A . 23 CYS CB 1 1 11 9354 1 1 23 CYS H H 1.783 0.167 -6.521 1.00 . A A . 23 CYS H 1 1 11 9355 1 1 23 CYS HA H -0.661 1.459 -5.555 1.00 . A A . 23 CYS HA 1 1 11 9356 1 1 23 CYS HB2 H -1.026 -0.102 -7.949 1.00 . A A . 23 CYS HB2 1 1 11 9357 1 1 23 CYS HB3 H -1.229 1.631 -7.710 1.00 . A A . 23 CYS HB3 1 1 11 9358 1 1 23 CYS HG H 0.716 2.272 -9.227 1.00 . A A . 23 CYS HG 1 1 11 9359 1 1 23 CYS N N 1.204 0.649 -5.895 1.00 . A A . 23 CYS N 1 1 11 9360 1 1 23 CYS O O -0.373 -1.753 -5.929 1.00 . A A . 23 CYS O 1 1 11 9361 1 1 23 CYS SG S 0.899 1.107 -8.618 1.00 . A A . 23 CYS SG 1 1 11 9362 1 1 24 CYS C C -3.064 -2.611 -5.401 1.00 . A A . 24 CYS C 1 1 11 9363 1 1 24 CYS CA C -2.644 -1.674 -4.271 1.00 . A A . 24 CYS CA 1 1 11 9364 1 1 24 CYS CB C -3.882 -1.164 -3.546 1.00 . A A . 24 CYS CB 1 1 11 9365 1 1 24 CYS H H -2.205 0.359 -4.549 1.00 . A A . 24 CYS H 1 1 11 9366 1 1 24 CYS HA H -2.014 -2.209 -3.577 1.00 . A A . 24 CYS HA 1 1 11 9367 1 1 24 CYS HB2 H -4.031 -0.129 -3.803 1.00 . A A . 24 CYS HB2 1 1 11 9368 1 1 24 CYS HB3 H -4.739 -1.736 -3.871 1.00 . A A . 24 CYS HB3 1 1 11 9369 1 1 24 CYS N N -1.899 -0.537 -4.786 1.00 . A A . 24 CYS N 1 1 11 9370 1 1 24 CYS O O -3.303 -2.171 -6.533 1.00 . A A . 24 CYS O 1 1 11 9371 1 1 24 CYS SG S -3.803 -1.272 -1.736 1.00 . A A . 24 CYS SG 1 1 11 9372 1 1 25 ASP C C -4.875 -4.736 -6.616 1.00 . A A . 25 ASP C 1 1 11 9373 1 1 25 ASP CA C -3.447 -4.901 -6.109 1.00 . A A . 25 ASP CA 1 1 11 9374 1 1 25 ASP CB C -3.250 -6.309 -5.560 1.00 . A A . 25 ASP CB 1 1 11 9375 1 1 25 ASP CG C -3.512 -7.367 -6.607 1.00 . A A . 25 ASP CG 1 1 11 9376 1 1 25 ASP H H -2.883 -4.194 -4.188 1.00 . A A . 25 ASP H 1 1 11 9377 1 1 25 ASP HA H -2.773 -4.758 -6.941 1.00 . A A . 25 ASP HA 1 1 11 9378 1 1 25 ASP HB2 H -2.236 -6.418 -5.209 1.00 . A A . 25 ASP HB2 1 1 11 9379 1 1 25 ASP HB3 H -3.932 -6.467 -4.737 1.00 . A A . 25 ASP HB3 1 1 11 9380 1 1 25 ASP N N -3.116 -3.901 -5.103 1.00 . A A . 25 ASP N 1 1 11 9381 1 1 25 ASP O O -5.091 -4.401 -7.780 1.00 . A A . 25 ASP O 1 1 11 9382 1 1 25 ASP OD1 O -2.723 -7.469 -7.571 1.00 . A A . 25 ASP OD1 1 1 11 9383 1 1 25 ASP OD2 O -4.515 -8.096 -6.477 1.00 . A A . 25 ASP OD2 1 1 11 9384 1 1 26 THR C C -7.961 -3.812 -5.406 1.00 . A A . 26 THR C 1 1 11 9385 1 1 26 THR CA C -7.243 -4.928 -6.167 1.00 . A A . 26 THR CA 1 1 11 9386 1 1 26 THR CB C -7.964 -6.280 -5.958 1.00 . A A . 26 THR CB 1 1 11 9387 1 1 26 THR CG2 C -7.863 -6.745 -4.512 1.00 . A A . 26 THR CG2 1 1 11 9388 1 1 26 THR H H -5.625 -5.316 -4.856 1.00 . A A . 26 THR H 1 1 11 9389 1 1 26 THR HA H -7.268 -4.696 -7.223 1.00 . A A . 26 THR HA 1 1 11 9390 1 1 26 THR HB H -7.485 -7.019 -6.584 1.00 . A A . 26 THR HB 1 1 11 9391 1 1 26 THR HG1 H -9.638 -5.270 -6.208 1.00 . A A . 26 THR HG1 1 1 11 9392 1 1 26 THR HG21 H -8.697 -7.392 -4.282 1.00 . A A . 26 THR HG21 1 1 11 9393 1 1 26 THR HG22 H -7.881 -5.886 -3.856 1.00 . A A . 26 THR HG22 1 1 11 9394 1 1 26 THR HG23 H -6.937 -7.287 -4.373 1.00 . A A . 26 THR HG23 1 1 11 9395 1 1 26 THR N N -5.849 -5.013 -5.766 1.00 . A A . 26 THR N 1 1 11 9396 1 1 26 THR O O -9.159 -3.574 -5.590 1.00 . A A . 26 THR O 1 1 11 9397 1 1 26 THR OG1 O -9.340 -6.180 -6.338 1.00 . A A . 26 THR OG1 1 1 11 9398 1 1 27 CYS C C -7.366 -0.701 -4.334 1.00 . A A . 27 CYS C 1 1 11 9399 1 1 27 CYS CA C -7.749 -2.063 -3.740 1.00 . A A . 27 CYS CA 1 1 11 9400 1 1 27 CYS CB C -7.206 -2.226 -2.324 1.00 . A A . 27 CYS CB 1 1 11 9401 1 1 27 CYS H H -6.278 -3.391 -4.429 1.00 . A A . 27 CYS H 1 1 11 9402 1 1 27 CYS HA H -8.825 -2.153 -3.723 1.00 . A A . 27 CYS HA 1 1 11 9403 1 1 27 CYS HB2 H -6.484 -1.446 -2.125 1.00 . A A . 27 CYS HB2 1 1 11 9404 1 1 27 CYS HB3 H -8.018 -2.154 -1.619 1.00 . A A . 27 CYS HB3 1 1 11 9405 1 1 27 CYS N N -7.216 -3.139 -4.548 1.00 . A A . 27 CYS N 1 1 11 9406 1 1 27 CYS O O -6.553 -0.630 -5.259 1.00 . A A . 27 CYS O 1 1 11 9407 1 1 27 CYS SG S -6.383 -3.834 -2.066 1.00 . A A . 27 CYS SG 1 1 11 9408 1 1 28 PRO C C -6.825 2.538 -3.596 1.00 . A A . 28 PRO C 1 1 11 9409 1 1 28 PRO CA C -7.798 1.717 -4.438 1.00 . A A . 28 PRO CA 1 1 11 9410 1 1 28 PRO CB C -9.194 2.321 -4.371 1.00 . A A . 28 PRO CB 1 1 11 9411 1 1 28 PRO CD C -9.118 0.395 -2.909 1.00 . A A . 28 PRO CD 1 1 11 9412 1 1 28 PRO CG C -9.801 1.724 -3.141 1.00 . A A . 28 PRO CG 1 1 11 9413 1 1 28 PRO HA H -7.461 1.683 -5.463 1.00 . A A . 28 PRO HA 1 1 11 9414 1 1 28 PRO HB2 H -9.118 3.397 -4.295 1.00 . A A . 28 PRO HB2 1 1 11 9415 1 1 28 PRO HB3 H -9.752 2.053 -5.257 1.00 . A A . 28 PRO HB3 1 1 11 9416 1 1 28 PRO HD2 H -8.729 0.344 -1.903 1.00 . A A . 28 PRO HD2 1 1 11 9417 1 1 28 PRO HD3 H -9.806 -0.418 -3.090 1.00 . A A . 28 PRO HD3 1 1 11 9418 1 1 28 PRO HG2 H -9.635 2.379 -2.298 1.00 . A A . 28 PRO HG2 1 1 11 9419 1 1 28 PRO HG3 H -10.859 1.577 -3.294 1.00 . A A . 28 PRO HG3 1 1 11 9420 1 1 28 PRO N N -8.022 0.385 -3.894 1.00 . A A . 28 PRO N 1 1 11 9421 1 1 28 PRO O O -6.917 3.768 -3.543 1.00 . A A . 28 PRO O 1 1 11 9422 1 1 29 SER C C -3.604 2.569 -2.640 1.00 . A A . 29 SER C 1 1 11 9423 1 1 29 SER CA C -4.993 2.533 -2.018 1.00 . A A . 29 SER CA 1 1 11 9424 1 1 29 SER CB C -4.935 1.825 -0.662 1.00 . A A . 29 SER CB 1 1 11 9425 1 1 29 SER H H -5.933 0.879 -2.934 1.00 . A A . 29 SER H 1 1 11 9426 1 1 29 SER HA H -5.335 3.546 -1.871 1.00 . A A . 29 SER HA 1 1 11 9427 1 1 29 SER HB2 H -3.909 1.575 -0.431 1.00 . A A . 29 SER HB2 1 1 11 9428 1 1 29 SER HB3 H -5.324 2.480 0.103 1.00 . A A . 29 SER HB3 1 1 11 9429 1 1 29 SER HG H -5.190 -0.060 -1.139 1.00 . A A . 29 SER HG 1 1 11 9430 1 1 29 SER N N -5.937 1.860 -2.891 1.00 . A A . 29 SER N 1 1 11 9431 1 1 29 SER O O -3.348 1.946 -3.670 1.00 . A A . 29 SER O 1 1 11 9432 1 1 29 SER OG O -5.698 0.632 -0.674 1.00 . A A . 29 SER OG 1 1 11 9433 1 1 30 SER C C -0.465 2.888 -1.142 1.00 . A A . 30 SER C 1 1 11 9434 1 1 30 SER CA C -1.307 3.261 -2.353 1.00 . A A . 30 SER CA 1 1 11 9435 1 1 30 SER CB C -0.924 4.638 -2.892 1.00 . A A . 30 SER CB 1 1 11 9436 1 1 30 SER H H -2.955 3.670 -1.121 1.00 . A A . 30 SER H 1 1 11 9437 1 1 30 SER HA H -1.165 2.520 -3.124 1.00 . A A . 30 SER HA 1 1 11 9438 1 1 30 SER HB2 H -0.763 5.315 -2.067 1.00 . A A . 30 SER HB2 1 1 11 9439 1 1 30 SER HB3 H -0.015 4.554 -3.470 1.00 . A A . 30 SER HB3 1 1 11 9440 1 1 30 SER HG H -2.774 5.235 -3.219 1.00 . A A . 30 SER HG 1 1 11 9441 1 1 30 SER N N -2.698 3.241 -1.962 1.00 . A A . 30 SER N 1 1 11 9442 1 1 30 SER O O -0.973 2.891 -0.020 1.00 . A A . 30 SER O 1 1 11 9443 1 1 30 SER OG O -1.951 5.164 -3.727 1.00 . A A . 30 SER OG 1 1 11 9444 1 1 31 TYR C C 3.029 2.340 -0.458 1.00 . A A . 31 TYR C 1 1 11 9445 1 1 31 TYR CA C 1.577 1.924 -0.280 1.00 . A A . 31 TYR CA 1 1 11 9446 1 1 31 TYR CB C 1.497 0.397 -0.218 1.00 . A A . 31 TYR CB 1 1 11 9447 1 1 31 TYR CD1 C -0.919 -0.223 0.160 1.00 . A A . 31 TYR CD1 1 1 11 9448 1 1 31 TYR CD2 C 0.620 -0.567 1.944 1.00 . A A . 31 TYR CD2 1 1 11 9449 1 1 31 TYR CE1 C -1.942 -0.721 0.942 1.00 . A A . 31 TYR CE1 1 1 11 9450 1 1 31 TYR CE2 C -0.397 -1.071 2.730 1.00 . A A . 31 TYR CE2 1 1 11 9451 1 1 31 TYR CG C 0.378 -0.136 0.648 1.00 . A A . 31 TYR CG 1 1 11 9452 1 1 31 TYR CZ C -1.676 -1.146 2.223 1.00 . A A . 31 TYR CZ 1 1 11 9453 1 1 31 TYR H H 1.066 2.331 -2.298 1.00 . A A . 31 TYR H 1 1 11 9454 1 1 31 TYR HA H 1.203 2.335 0.645 1.00 . A A . 31 TYR HA 1 1 11 9455 1 1 31 TYR HB2 H 1.347 0.012 -1.215 1.00 . A A . 31 TYR HB2 1 1 11 9456 1 1 31 TYR HB3 H 2.428 0.014 0.172 1.00 . A A . 31 TYR HB3 1 1 11 9457 1 1 31 TYR HD1 H -1.125 0.111 -0.848 1.00 . A A . 31 TYR HD1 1 1 11 9458 1 1 31 TYR HD2 H 1.622 -0.505 2.340 1.00 . A A . 31 TYR HD2 1 1 11 9459 1 1 31 TYR HE1 H -2.947 -0.777 0.543 1.00 . A A . 31 TYR HE1 1 1 11 9460 1 1 31 TYR HE2 H -0.189 -1.400 3.736 1.00 . A A . 31 TYR HE2 1 1 11 9461 1 1 31 TYR HH H -3.226 -2.260 2.466 1.00 . A A . 31 TYR HH 1 1 11 9462 1 1 31 TYR N N 0.750 2.425 -1.369 1.00 . A A . 31 TYR N 1 1 11 9463 1 1 31 TYR O O 3.430 2.743 -1.538 1.00 . A A . 31 TYR O 1 1 11 9464 1 1 31 TYR OH O -2.689 -1.653 3.000 1.00 . A A . 31 TYR OH 1 1 11 9465 1 1 32 HIS C C 5.815 0.818 -0.002 1.00 . A A . 32 HIS C 1 1 11 9466 1 1 32 HIS CA C 5.277 2.167 0.442 1.00 . A A . 32 HIS CA 1 1 11 9467 1 1 32 HIS CB C 5.902 2.508 1.804 1.00 . A A . 32 HIS CB 1 1 11 9468 1 1 32 HIS CD2 C 6.701 4.960 1.744 1.00 . A A . 32 HIS CD2 1 1 11 9469 1 1 32 HIS CE1 C 5.360 5.728 3.280 1.00 . A A . 32 HIS CE1 1 1 11 9470 1 1 32 HIS CG C 5.898 3.957 2.176 1.00 . A A . 32 HIS CG 1 1 11 9471 1 1 32 HIS H H 3.459 1.579 1.331 1.00 . A A . 32 HIS H 1 1 11 9472 1 1 32 HIS HA H 5.523 2.926 -0.285 1.00 . A A . 32 HIS HA 1 1 11 9473 1 1 32 HIS HB2 H 5.364 1.976 2.573 1.00 . A A . 32 HIS HB2 1 1 11 9474 1 1 32 HIS HB3 H 6.930 2.172 1.804 1.00 . A A . 32 HIS HB3 1 1 11 9475 1 1 32 HIS HD2 H 7.468 4.892 0.987 1.00 . A A . 32 HIS HD2 1 1 11 9476 1 1 32 HIS HE1 H 4.874 6.399 3.976 1.00 . A A . 32 HIS HE1 1 1 11 9477 1 1 32 HIS HE2 H 6.578 7.014 2.198 1.00 . A A . 32 HIS HE2 1 1 11 9478 1 1 32 HIS N N 3.832 2.052 0.548 1.00 . A A . 32 HIS N 1 1 11 9479 1 1 32 HIS ND1 N 5.055 4.453 3.143 1.00 . A A . 32 HIS ND1 1 1 11 9480 1 1 32 HIS NE2 N 6.354 6.087 2.452 1.00 . A A . 32 HIS NE2 1 1 11 9481 1 1 32 HIS O O 5.051 -0.042 -0.437 1.00 . A A . 32 HIS O 1 1 11 9482 1 1 33 ILE C C 7.847 -1.375 1.622 1.00 . A A . 33 ILE C 1 1 11 9483 1 1 33 ILE CA C 7.571 -0.803 0.235 1.00 . A A . 33 ILE CA 1 1 11 9484 1 1 33 ILE CB C 8.858 -0.841 -0.622 1.00 . A A . 33 ILE CB 1 1 11 9485 1 1 33 ILE CD1 C 11.193 0.156 -0.871 1.00 . A A . 33 ILE CD1 1 1 11 9486 1 1 33 ILE CG1 C 9.903 0.137 -0.077 1.00 . A A . 33 ILE CG1 1 1 11 9487 1 1 33 ILE CG2 C 8.528 -0.507 -2.068 1.00 . A A . 33 ILE CG2 1 1 11 9488 1 1 33 ILE H H 7.565 1.204 0.864 1.00 . A A . 33 ILE H 1 1 11 9489 1 1 33 ILE HA H 6.819 -1.410 -0.250 1.00 . A A . 33 ILE HA 1 1 11 9490 1 1 33 ILE HB H 9.259 -1.843 -0.590 1.00 . A A . 33 ILE HB 1 1 11 9491 1 1 33 ILE HD11 H 10.983 -0.076 -1.906 1.00 . A A . 33 ILE HD11 1 1 11 9492 1 1 33 ILE HD12 H 11.640 1.136 -0.805 1.00 . A A . 33 ILE HD12 1 1 11 9493 1 1 33 ILE HD13 H 11.874 -0.579 -0.469 1.00 . A A . 33 ILE HD13 1 1 11 9494 1 1 33 ILE HG12 H 9.493 1.135 -0.092 1.00 . A A . 33 ILE HG12 1 1 11 9495 1 1 33 ILE HG21 H 7.981 0.424 -2.103 1.00 . A A . 33 ILE HG21 1 1 11 9496 1 1 33 ILE HG22 H 9.444 -0.409 -2.632 1.00 . A A . 33 ILE HG22 1 1 11 9497 1 1 33 ILE HG23 H 7.924 -1.296 -2.492 1.00 . A A . 33 ILE HG23 1 1 11 9498 1 1 33 ILE N N 7.049 0.539 0.363 1.00 . A A . 33 ILE N 1 1 11 9499 1 1 33 ILE O O 8.545 -2.378 1.765 1.00 . A A . 33 ILE O 1 1 11 9500 1 1 34 HIS C C 6.494 -0.680 4.993 1.00 . A A . 34 HIS C 1 1 11 9501 1 1 34 HIS CA C 7.630 -1.054 4.035 1.00 . A A . 34 HIS CA 1 1 11 9502 1 1 34 HIS CB C 8.936 -0.396 4.504 1.00 . A A . 34 HIS CB 1 1 11 9503 1 1 34 HIS CD2 C 8.673 2.154 4.822 1.00 . A A . 34 HIS CD2 1 1 11 9504 1 1 34 HIS CE1 C 9.574 2.767 2.937 1.00 . A A . 34 HIS CE1 1 1 11 9505 1 1 34 HIS CG C 9.058 1.053 4.134 1.00 . A A . 34 HIS CG 1 1 11 9506 1 1 34 HIS H H 6.843 0.139 2.468 1.00 . A A . 34 HIS H 1 1 11 9507 1 1 34 HIS HA H 7.758 -2.126 4.063 1.00 . A A . 34 HIS HA 1 1 11 9508 1 1 34 HIS HB2 H 8.998 -0.469 5.579 1.00 . A A . 34 HIS HB2 1 1 11 9509 1 1 34 HIS HB3 H 9.771 -0.923 4.065 1.00 . A A . 34 HIS HB3 1 1 11 9510 1 1 34 HIS HD2 H 8.200 2.178 5.791 1.00 . A A . 34 HIS HD2 1 1 11 9511 1 1 34 HIS HE1 H 9.945 3.387 2.132 1.00 . A A . 34 HIS HE1 1 1 11 9512 1 1 34 HIS HE2 H 9.007 4.182 4.351 1.00 . A A . 34 HIS HE2 1 1 11 9513 1 1 34 HIS N N 7.345 -0.681 2.648 1.00 . A A . 34 HIS N 1 1 11 9514 1 1 34 HIS ND1 N 9.625 1.447 2.946 1.00 . A A . 34 HIS ND1 1 1 11 9515 1 1 34 HIS NE2 N 9.005 3.240 4.053 1.00 . A A . 34 HIS NE2 1 1 11 9516 1 1 34 HIS O O 6.712 -0.573 6.202 1.00 . A A . 34 HIS O 1 1 11 9517 1 1 35 CYS C C 3.695 -1.601 6.040 1.00 . A A . 35 CYS C 1 1 11 9518 1 1 35 CYS CA C 4.124 -0.311 5.352 1.00 . A A . 35 CYS CA 1 1 11 9519 1 1 35 CYS CB C 2.939 0.242 4.560 1.00 . A A . 35 CYS CB 1 1 11 9520 1 1 35 CYS H H 5.125 -0.699 3.524 1.00 . A A . 35 CYS H 1 1 11 9521 1 1 35 CYS HA H 4.421 0.408 6.100 1.00 . A A . 35 CYS HA 1 1 11 9522 1 1 35 CYS HB2 H 2.392 -0.583 4.125 1.00 . A A . 35 CYS HB2 1 1 11 9523 1 1 35 CYS HB3 H 2.288 0.777 5.235 1.00 . A A . 35 CYS HB3 1 1 11 9524 1 1 35 CYS N N 5.270 -0.559 4.483 1.00 . A A . 35 CYS N 1 1 11 9525 1 1 35 CYS O O 3.086 -1.579 7.110 1.00 . A A . 35 CYS O 1 1 11 9526 1 1 35 CYS SG S 3.379 1.372 3.211 1.00 . A A . 35 CYS SG 1 1 11 9527 1 1 36 LEU C C 4.589 -4.791 6.471 1.00 . A A . 36 LEU C 1 1 11 9528 1 1 36 LEU CA C 3.466 -4.011 5.801 1.00 . A A . 36 LEU CA 1 1 11 9529 1 1 36 LEU CB C 2.924 -4.799 4.605 1.00 . A A . 36 LEU CB 1 1 11 9530 1 1 36 LEU CD1 C 4.212 -4.899 2.454 1.00 . A A . 36 LEU CD1 1 1 11 9531 1 1 36 LEU CD2 C 1.851 -4.077 2.459 1.00 . A A . 36 LEU CD2 1 1 11 9532 1 1 36 LEU CG C 3.153 -4.145 3.239 1.00 . A A . 36 LEU CG 1 1 11 9533 1 1 36 LEU H H 4.369 -2.636 4.486 1.00 . A A . 36 LEU H 1 1 11 9534 1 1 36 LEU HA H 2.669 -3.858 6.513 1.00 . A A . 36 LEU HA 1 1 11 9535 1 1 36 LEU HB2 H 3.394 -5.771 4.600 1.00 . A A . 36 LEU HB2 1 1 11 9536 1 1 36 LEU HB3 H 1.860 -4.932 4.740 1.00 . A A . 36 LEU HB3 1 1 11 9537 1 1 36 LEU HD11 H 3.818 -5.166 1.484 1.00 . A A . 36 LEU HD11 1 1 11 9538 1 1 36 LEU HD12 H 5.084 -4.274 2.329 1.00 . A A . 36 LEU HD12 1 1 11 9539 1 1 36 LEU HD13 H 4.485 -5.795 2.991 1.00 . A A . 36 LEU HD13 1 1 11 9540 1 1 36 LEU HD21 H 1.432 -3.086 2.543 1.00 . A A . 36 LEU HD21 1 1 11 9541 1 1 36 LEU HD22 H 2.042 -4.300 1.419 1.00 . A A . 36 LEU HD22 1 1 11 9542 1 1 36 LEU HD23 H 1.153 -4.799 2.858 1.00 . A A . 36 LEU HD23 1 1 11 9543 1 1 36 LEU HG H 3.507 -3.135 3.385 1.00 . A A . 36 LEU HG 1 1 11 9544 1 1 36 LEU N N 3.926 -2.707 5.354 1.00 . A A . 36 LEU N 1 1 11 9545 1 1 36 LEU O O 5.754 -4.390 6.424 1.00 . A A . 36 LEU O 1 1 11 9546 1 1 37 ARG C C 6.109 -7.488 6.636 1.00 . A A . 37 ARG C 1 1 11 9547 1 1 37 ARG CA C 5.206 -6.813 7.683 1.00 . A A . 37 ARG CA 1 1 11 9548 1 1 37 ARG CB C 4.492 -7.856 8.553 1.00 . A A . 37 ARG CB 1 1 11 9549 1 1 37 ARG CD C 6.055 -7.533 10.498 1.00 . A A . 37 ARG CD 1 1 11 9550 1 1 37 ARG CG C 5.397 -8.537 9.567 1.00 . A A . 37 ARG CG 1 1 11 9551 1 1 37 ARG CZ C 8.041 -6.127 10.099 1.00 . A A . 37 ARG CZ 1 1 11 9552 1 1 37 ARG H H 3.292 -6.212 7.007 1.00 . A A . 37 ARG H 1 1 11 9553 1 1 37 ARG HA H 5.826 -6.200 8.321 1.00 . A A . 37 ARG HA 1 1 11 9554 1 1 37 ARG HB2 H 3.691 -7.371 9.090 1.00 . A A . 37 ARG HB2 1 1 11 9555 1 1 37 ARG HB3 H 4.073 -8.615 7.909 1.00 . A A . 37 ARG HB3 1 1 11 9556 1 1 37 ARG HD2 H 5.532 -6.592 10.422 1.00 . A A . 37 ARG HD2 1 1 11 9557 1 1 37 ARG HD3 H 5.988 -7.903 11.512 1.00 . A A . 37 ARG HD3 1 1 11 9558 1 1 37 ARG HE H 7.998 -8.125 9.951 1.00 . A A . 37 ARG HE 1 1 11 9559 1 1 37 ARG HG2 H 4.808 -9.224 10.156 1.00 . A A . 37 ARG HG2 1 1 11 9560 1 1 37 ARG HG3 H 6.165 -9.082 9.038 1.00 . A A . 37 ARG HG3 1 1 11 9561 1 1 37 ARG HH11 H 6.389 -5.091 10.661 1.00 . A A . 37 ARG HH11 1 1 11 9562 1 1 37 ARG HH12 H 7.793 -4.124 10.323 1.00 . A A . 37 ARG HH12 1 1 11 9563 1 1 37 ARG HH21 H 9.844 -6.866 9.548 1.00 . A A . 37 ARG HH21 1 1 11 9564 1 1 37 ARG HH22 H 9.766 -5.136 9.702 1.00 . A A . 37 ARG HH22 1 1 11 9565 1 1 37 ARG N N 4.234 -5.933 7.045 1.00 . A A . 37 ARG N 1 1 11 9566 1 1 37 ARG NE N 7.459 -7.321 10.161 1.00 . A A . 37 ARG NE 1 1 11 9567 1 1 37 ARG NH1 N 7.356 -5.028 10.386 1.00 . A A . 37 ARG NH1 1 1 11 9568 1 1 37 ARG NH2 N 9.319 -6.037 9.756 1.00 . A A . 37 ARG NH2 1 1 11 9569 1 1 37 ARG O O 7.331 -7.361 6.710 1.00 . A A . 37 ARG O 1 1 11 9570 1 1 38 PRO C C 6.792 -7.684 3.529 1.00 . A A . 38 PRO C 1 1 11 9571 1 1 38 PRO CA C 6.328 -8.751 4.522 1.00 . A A . 38 PRO CA 1 1 11 9572 1 1 38 PRO CB C 5.353 -9.731 3.843 1.00 . A A . 38 PRO CB 1 1 11 9573 1 1 38 PRO CD C 4.108 -8.379 5.371 1.00 . A A . 38 PRO CD 1 1 11 9574 1 1 38 PRO CG C 4.103 -9.699 4.661 1.00 . A A . 38 PRO CG 1 1 11 9575 1 1 38 PRO HA H 7.184 -9.290 4.903 1.00 . A A . 38 PRO HA 1 1 11 9576 1 1 38 PRO HB2 H 5.166 -9.408 2.830 1.00 . A A . 38 PRO HB2 1 1 11 9577 1 1 38 PRO HB3 H 5.788 -10.721 3.830 1.00 . A A . 38 PRO HB3 1 1 11 9578 1 1 38 PRO HD2 H 3.691 -7.606 4.742 1.00 . A A . 38 PRO HD2 1 1 11 9579 1 1 38 PRO HD3 H 3.570 -8.447 6.304 1.00 . A A . 38 PRO HD3 1 1 11 9580 1 1 38 PRO HG2 H 3.240 -9.776 4.017 1.00 . A A . 38 PRO HG2 1 1 11 9581 1 1 38 PRO HG3 H 4.112 -10.509 5.376 1.00 . A A . 38 PRO HG3 1 1 11 9582 1 1 38 PRO N N 5.539 -8.158 5.604 1.00 . A A . 38 PRO N 1 1 11 9583 1 1 38 PRO O O 6.390 -7.674 2.360 1.00 . A A . 38 PRO O 1 1 11 9584 1 1 39 ALA C C 9.177 -5.940 2.375 1.00 . A A . 39 ALA C 1 1 11 9585 1 1 39 ALA CA C 7.995 -5.581 3.263 1.00 . A A . 39 ALA CA 1 1 11 9586 1 1 39 ALA CB C 8.361 -4.436 4.193 1.00 . A A . 39 ALA CB 1 1 11 9587 1 1 39 ALA H H 7.764 -6.755 5.001 1.00 . A A . 39 ALA H 1 1 11 9588 1 1 39 ALA HA H 7.176 -5.259 2.638 1.00 . A A . 39 ALA HA 1 1 11 9589 1 1 39 ALA HB1 H 7.481 -4.118 4.734 1.00 . A A . 39 ALA HB1 1 1 11 9590 1 1 39 ALA HB2 H 9.113 -4.767 4.893 1.00 . A A . 39 ALA HB2 1 1 11 9591 1 1 39 ALA HB3 H 8.746 -3.610 3.612 1.00 . A A . 39 ALA HB3 1 1 11 9592 1 1 39 ALA N N 7.550 -6.724 4.042 1.00 . A A . 39 ALA N 1 1 11 9593 1 1 39 ALA O O 9.684 -7.065 2.415 1.00 . A A . 39 ALA O 1 1 11 9594 1 1 40 LEU C C 11.714 -3.962 0.862 1.00 . A A . 40 LEU C 1 1 11 9595 1 1 40 LEU CA C 10.764 -5.144 0.713 1.00 . A A . 40 LEU CA 1 1 11 9596 1 1 40 LEU CB C 10.305 -5.266 -0.745 1.00 . A A . 40 LEU CB 1 1 11 9597 1 1 40 LEU CD1 C 8.015 -4.919 -1.708 1.00 . A A . 40 LEU CD1 1 1 11 9598 1 1 40 LEU CD2 C 9.023 -7.211 -1.681 1.00 . A A . 40 LEU CD2 1 1 11 9599 1 1 40 LEU CG C 8.918 -5.880 -0.949 1.00 . A A . 40 LEU CG 1 1 11 9600 1 1 40 LEU H H 9.189 -4.083 1.640 1.00 . A A . 40 LEU H 1 1 11 9601 1 1 40 LEU HA H 11.277 -6.049 1.006 1.00 . A A . 40 LEU HA 1 1 11 9602 1 1 40 LEU HB2 H 10.303 -4.279 -1.183 1.00 . A A . 40 LEU HB2 1 1 11 9603 1 1 40 LEU HB3 H 11.023 -5.875 -1.278 1.00 . A A . 40 LEU HB3 1 1 11 9604 1 1 40 LEU HD11 H 7.164 -5.457 -2.101 1.00 . A A . 40 LEU HD11 1 1 11 9605 1 1 40 LEU HD12 H 7.673 -4.141 -1.041 1.00 . A A . 40 LEU HD12 1 1 11 9606 1 1 40 LEU HD13 H 8.566 -4.476 -2.522 1.00 . A A . 40 LEU HD13 1 1 11 9607 1 1 40 LEU HD21 H 8.069 -7.719 -1.642 1.00 . A A . 40 LEU HD21 1 1 11 9608 1 1 40 LEU HD22 H 9.294 -7.036 -2.710 1.00 . A A . 40 LEU HD22 1 1 11 9609 1 1 40 LEU HD23 H 9.777 -7.824 -1.208 1.00 . A A . 40 LEU HD23 1 1 11 9610 1 1 40 LEU HG H 8.468 -6.064 0.017 1.00 . A A . 40 LEU HG 1 1 11 9611 1 1 40 LEU N N 9.623 -4.968 1.595 1.00 . A A . 40 LEU N 1 1 11 9612 1 1 40 LEU O O 11.355 -2.937 1.442 1.00 . A A . 40 LEU O 1 1 11 9613 1 1 41 TYR C C 13.932 -2.317 -1.022 1.00 . A A . 41 TYR C 1 1 11 9614 1 1 41 TYR CA C 13.871 -2.997 0.335 1.00 . A A . 41 TYR CA 1 1 11 9615 1 1 41 TYR CB C 15.250 -3.522 0.740 1.00 . A A . 41 TYR CB 1 1 11 9616 1 1 41 TYR CD1 C 14.515 -3.536 3.155 1.00 . A A . 41 TYR CD1 1 1 11 9617 1 1 41 TYR CD2 C 16.059 -5.204 2.441 1.00 . A A . 41 TYR CD2 1 1 11 9618 1 1 41 TYR CE1 C 14.531 -4.060 4.432 1.00 . A A . 41 TYR CE1 1 1 11 9619 1 1 41 TYR CE2 C 16.079 -5.735 3.717 1.00 . A A . 41 TYR CE2 1 1 11 9620 1 1 41 TYR CG C 15.279 -4.097 2.139 1.00 . A A . 41 TYR CG 1 1 11 9621 1 1 41 TYR CZ C 15.315 -5.158 4.708 1.00 . A A . 41 TYR CZ 1 1 11 9622 1 1 41 TYR H H 13.118 -4.904 -0.198 1.00 . A A . 41 TYR H 1 1 11 9623 1 1 41 TYR HA H 13.537 -2.277 1.070 1.00 . A A . 41 TYR HA 1 1 11 9624 1 1 41 TYR HB2 H 15.548 -4.302 0.054 1.00 . A A . 41 TYR HB2 1 1 11 9625 1 1 41 TYR HB3 H 15.966 -2.714 0.695 1.00 . A A . 41 TYR HB3 1 1 11 9626 1 1 41 TYR HD1 H 13.898 -2.677 2.937 1.00 . A A . 41 TYR HD1 1 1 11 9627 1 1 41 TYR HD2 H 16.662 -5.650 1.664 1.00 . A A . 41 TYR HD2 1 1 11 9628 1 1 41 TYR HE1 H 13.936 -3.605 5.210 1.00 . A A . 41 TYR HE1 1 1 11 9629 1 1 41 TYR HE2 H 16.692 -6.597 3.933 1.00 . A A . 41 TYR HE2 1 1 11 9630 1 1 41 TYR HH H 15.143 -4.970 6.617 1.00 . A A . 41 TYR HH 1 1 11 9631 1 1 41 TYR N N 12.903 -4.083 0.300 1.00 . A A . 41 TYR N 1 1 11 9632 1 1 41 TYR O O 14.389 -1.181 -1.148 1.00 . A A . 41 TYR O 1 1 11 9633 1 1 41 TYR OH O 15.333 -5.681 5.983 1.00 . A A . 41 TYR OH 1 1 11 9634 1 1 42 GLU C C 11.795 -2.410 -3.755 1.00 . A A . 42 GLU C 1 1 11 9635 1 1 42 GLU CA C 13.259 -2.442 -3.355 1.00 . A A . 42 GLU CA 1 1 11 9636 1 1 42 GLU CB C 14.046 -3.291 -4.351 1.00 . A A . 42 GLU CB 1 1 11 9637 1 1 42 GLU CD C 16.305 -4.071 -5.137 1.00 . A A . 42 GLU CD 1 1 11 9638 1 1 42 GLU CG C 15.545 -3.066 -4.301 1.00 . A A . 42 GLU CG 1 1 11 9639 1 1 42 GLU H H 12.963 -3.859 -1.829 1.00 . A A . 42 GLU H 1 1 11 9640 1 1 42 GLU HA H 13.649 -1.434 -3.346 1.00 . A A . 42 GLU HA 1 1 11 9641 1 1 42 GLU HB2 H 13.855 -4.332 -4.144 1.00 . A A . 42 GLU HB2 1 1 11 9642 1 1 42 GLU HB3 H 13.705 -3.065 -5.350 1.00 . A A . 42 GLU HB3 1 1 11 9643 1 1 42 GLU HG2 H 15.761 -2.073 -4.671 1.00 . A A . 42 GLU HG2 1 1 11 9644 1 1 42 GLU HG3 H 15.873 -3.148 -3.276 1.00 . A A . 42 GLU HG3 1 1 11 9645 1 1 42 GLU N N 13.376 -2.990 -2.018 1.00 . A A . 42 GLU N 1 1 11 9646 1 1 42 GLU O O 10.961 -3.036 -3.101 1.00 . A A . 42 GLU O 1 1 11 9647 1 1 42 GLU OE1 O 16.520 -5.206 -4.666 1.00 . A A . 42 GLU OE1 1 1 11 9648 1 1 42 GLU OE2 O 16.682 -3.731 -6.277 1.00 . A A . 42 GLU OE2 1 1 11 9649 1 1 43 VAL C C 9.959 -2.707 -6.503 1.00 . A A . 43 VAL C 1 1 11 9650 1 1 43 VAL CA C 10.129 -1.709 -5.354 1.00 . A A . 43 VAL CA 1 1 11 9651 1 1 43 VAL CB C 9.716 -0.279 -5.796 1.00 . A A . 43 VAL CB 1 1 11 9652 1 1 43 VAL CG1 C 10.637 0.257 -6.884 1.00 . A A . 43 VAL CG1 1 1 11 9653 1 1 43 VAL CG2 C 8.261 -0.249 -6.246 1.00 . A A . 43 VAL CG2 1 1 11 9654 1 1 43 VAL H H 12.210 -1.327 -5.385 1.00 . A A . 43 VAL H 1 1 11 9655 1 1 43 VAL HA H 9.479 -2.008 -4.543 1.00 . A A . 43 VAL HA 1 1 11 9656 1 1 43 VAL HB H 9.809 0.372 -4.938 1.00 . A A . 43 VAL HB 1 1 11 9657 1 1 43 VAL HG11 H 10.057 0.497 -7.764 1.00 . A A . 43 VAL HG11 1 1 11 9658 1 1 43 VAL HG12 H 11.134 1.146 -6.527 1.00 . A A . 43 VAL HG12 1 1 11 9659 1 1 43 VAL HG13 H 11.374 -0.493 -7.132 1.00 . A A . 43 VAL HG13 1 1 11 9660 1 1 43 VAL HG21 H 8.158 0.419 -7.089 1.00 . A A . 43 VAL HG21 1 1 11 9661 1 1 43 VAL HG22 H 7.953 -1.243 -6.532 1.00 . A A . 43 VAL HG22 1 1 11 9662 1 1 43 VAL HG23 H 7.642 0.099 -5.432 1.00 . A A . 43 VAL HG23 1 1 11 9663 1 1 43 VAL N N 11.491 -1.746 -4.855 1.00 . A A . 43 VAL N 1 1 11 9664 1 1 43 VAL O O 10.752 -2.724 -7.449 1.00 . A A . 43 VAL O 1 1 11 9665 1 1 44 PRO C C 8.342 -4.117 -8.713 1.00 . A A . 44 PRO C 1 1 11 9666 1 1 44 PRO CA C 8.768 -4.686 -7.364 1.00 . A A . 44 PRO CA 1 1 11 9667 1 1 44 PRO CB C 7.639 -5.532 -6.760 1.00 . A A . 44 PRO CB 1 1 11 9668 1 1 44 PRO CD C 8.108 -3.778 -5.208 1.00 . A A . 44 PRO CD 1 1 11 9669 1 1 44 PRO CG C 7.010 -4.660 -5.729 1.00 . A A . 44 PRO CG 1 1 11 9670 1 1 44 PRO HA H 9.649 -5.299 -7.498 1.00 . A A . 44 PRO HA 1 1 11 9671 1 1 44 PRO HB2 H 6.934 -5.801 -7.533 1.00 . A A . 44 PRO HB2 1 1 11 9672 1 1 44 PRO HB3 H 8.053 -6.426 -6.319 1.00 . A A . 44 PRO HB3 1 1 11 9673 1 1 44 PRO HD2 H 7.712 -2.821 -4.903 1.00 . A A . 44 PRO HD2 1 1 11 9674 1 1 44 PRO HD3 H 8.621 -4.257 -4.388 1.00 . A A . 44 PRO HD3 1 1 11 9675 1 1 44 PRO HG2 H 6.231 -4.062 -6.179 1.00 . A A . 44 PRO HG2 1 1 11 9676 1 1 44 PRO HG3 H 6.605 -5.267 -4.931 1.00 . A A . 44 PRO HG3 1 1 11 9677 1 1 44 PRO N N 8.998 -3.634 -6.370 1.00 . A A . 44 PRO N 1 1 11 9678 1 1 44 PRO O O 7.783 -3.022 -8.791 1.00 . A A . 44 PRO O 1 1 11 9679 1 1 45 ASP C C 7.172 -5.311 -11.697 1.00 . A A . 45 ASP C 1 1 11 9680 1 1 45 ASP CA C 8.276 -4.438 -11.117 1.00 . A A . 45 ASP CA 1 1 11 9681 1 1 45 ASP CB C 9.524 -4.508 -12.000 1.00 . A A . 45 ASP CB 1 1 11 9682 1 1 45 ASP CG C 9.225 -4.282 -13.467 1.00 . A A . 45 ASP CG 1 1 11 9683 1 1 45 ASP H H 9.038 -5.743 -9.639 1.00 . A A . 45 ASP H 1 1 11 9684 1 1 45 ASP HA H 7.930 -3.418 -11.070 1.00 . A A . 45 ASP HA 1 1 11 9685 1 1 45 ASP HB2 H 10.227 -3.754 -11.676 1.00 . A A . 45 ASP HB2 1 1 11 9686 1 1 45 ASP HB3 H 9.976 -5.483 -11.889 1.00 . A A . 45 ASP HB3 1 1 11 9687 1 1 45 ASP N N 8.606 -4.868 -9.768 1.00 . A A . 45 ASP N 1 1 11 9688 1 1 45 ASP O O 7.351 -6.513 -11.880 1.00 . A A . 45 ASP O 1 1 11 9689 1 1 45 ASP OD1 O 8.686 -3.208 -13.811 1.00 . A A . 45 ASP OD1 1 1 11 9690 1 1 45 ASP OD2 O 9.546 -5.169 -14.287 1.00 . A A . 45 ASP OD2 1 1 11 9691 1 1 46 GLY C C 3.790 -5.653 -11.496 1.00 . A A . 46 GLY C 1 1 11 9692 1 1 46 GLY CA C 4.906 -5.452 -12.500 1.00 . A A . 46 GLY CA 1 1 11 9693 1 1 46 GLY H H 5.923 -3.750 -11.756 1.00 . A A . 46 GLY H 1 1 11 9694 1 1 46 GLY HA2 H 4.517 -4.911 -13.351 1.00 . A A . 46 GLY HA2 1 1 11 9695 1 1 46 GLY HA3 H 5.258 -6.417 -12.831 1.00 . A A . 46 GLY HA3 1 1 11 9696 1 1 46 GLY N N 6.021 -4.710 -11.950 1.00 . A A . 46 GLY N 1 1 11 9697 1 1 46 GLY O O 3.151 -4.691 -11.068 1.00 . A A . 46 GLY O 1 1 11 9698 1 1 47 GLU C C 2.948 -7.097 -8.752 1.00 . A A . 47 GLU C 1 1 11 9699 1 1 47 GLU CA C 2.487 -7.243 -10.196 1.00 . A A . 47 GLU CA 1 1 11 9700 1 1 47 GLU CB C 2.014 -8.676 -10.439 1.00 . A A . 47 GLU CB 1 1 11 9701 1 1 47 GLU CD C -0.227 -9.575 -11.155 1.00 . A A . 47 GLU CD 1 1 11 9702 1 1 47 GLU CG C 1.005 -8.801 -11.564 1.00 . A A . 47 GLU CG 1 1 11 9703 1 1 47 GLU H H 4.104 -7.625 -11.509 1.00 . A A . 47 GLU H 1 1 11 9704 1 1 47 GLU HA H 1.663 -6.568 -10.369 1.00 . A A . 47 GLU HA 1 1 11 9705 1 1 47 GLU HB2 H 2.869 -9.292 -10.683 1.00 . A A . 47 GLU HB2 1 1 11 9706 1 1 47 GLU HB3 H 1.560 -9.050 -9.533 1.00 . A A . 47 GLU HB3 1 1 11 9707 1 1 47 GLU HG2 H 0.703 -7.810 -11.870 1.00 . A A . 47 GLU HG2 1 1 11 9708 1 1 47 GLU HG3 H 1.474 -9.308 -12.396 1.00 . A A . 47 GLU HG3 1 1 11 9709 1 1 47 GLU N N 3.554 -6.902 -11.128 1.00 . A A . 47 GLU N 1 1 11 9710 1 1 47 GLU O O 4.112 -7.357 -8.429 1.00 . A A . 47 GLU O 1 1 11 9711 1 1 47 GLU OE1 O -1.017 -9.057 -10.339 1.00 . A A . 47 GLU OE1 1 1 11 9712 1 1 47 GLU OE2 O -0.419 -10.703 -11.654 1.00 . A A . 47 GLU OE2 1 1 11 9713 1 1 48 TRP C C 0.966 -6.835 -5.675 1.00 . A A . 48 TRP C 1 1 11 9714 1 1 48 TRP CA C 2.268 -6.685 -6.453 1.00 . A A . 48 TRP CA 1 1 11 9715 1 1 48 TRP CB C 2.945 -5.356 -6.088 1.00 . A A . 48 TRP CB 1 1 11 9716 1 1 48 TRP CD1 C 4.063 -5.953 -3.857 1.00 . A A . 48 TRP CD1 1 1 11 9717 1 1 48 TRP CD2 C 2.571 -4.285 -3.714 1.00 . A A . 48 TRP CD2 1 1 11 9718 1 1 48 TRP CE2 C 3.108 -4.521 -2.435 1.00 . A A . 48 TRP CE2 1 1 11 9719 1 1 48 TRP CE3 C 1.613 -3.275 -3.863 1.00 . A A . 48 TRP CE3 1 1 11 9720 1 1 48 TRP CG C 3.199 -5.213 -4.614 1.00 . A A . 48 TRP CG 1 1 11 9721 1 1 48 TRP CH2 C 1.780 -2.814 -1.491 1.00 . A A . 48 TRP CH2 1 1 11 9722 1 1 48 TRP CZ2 C 2.719 -3.791 -1.314 1.00 . A A . 48 TRP CZ2 1 1 11 9723 1 1 48 TRP CZ3 C 1.228 -2.553 -2.750 1.00 . A A . 48 TRP CZ3 1 1 11 9724 1 1 48 TRP H H 1.084 -6.644 -8.201 1.00 . A A . 48 TRP H 1 1 11 9725 1 1 48 TRP HA H 2.927 -7.500 -6.192 1.00 . A A . 48 TRP HA 1 1 11 9726 1 1 48 TRP HB2 H 3.896 -5.288 -6.599 1.00 . A A . 48 TRP HB2 1 1 11 9727 1 1 48 TRP HB3 H 2.314 -4.538 -6.402 1.00 . A A . 48 TRP HB3 1 1 11 9728 1 1 48 TRP HD1 H 4.688 -6.743 -4.246 1.00 . A A . 48 TRP HD1 1 1 11 9729 1 1 48 TRP HE1 H 4.546 -5.921 -1.806 1.00 . A A . 48 TRP HE1 1 1 11 9730 1 1 48 TRP HE3 H 1.176 -3.051 -4.826 1.00 . A A . 48 TRP HE3 1 1 11 9731 1 1 48 TRP HH2 H 1.447 -2.224 -0.647 1.00 . A A . 48 TRP HH2 1 1 11 9732 1 1 48 TRP HZ2 H 3.135 -3.980 -0.336 1.00 . A A . 48 TRP HZ2 1 1 11 9733 1 1 48 TRP HZ3 H 0.487 -1.773 -2.845 1.00 . A A . 48 TRP HZ3 1 1 11 9734 1 1 48 TRP N N 2.007 -6.767 -7.880 1.00 . A A . 48 TRP N 1 1 11 9735 1 1 48 TRP NE1 N 4.015 -5.542 -2.547 1.00 . A A . 48 TRP NE1 1 1 11 9736 1 1 48 TRP O O 0.155 -5.910 -5.616 1.00 . A A . 48 TRP O 1 1 11 9737 1 1 49 GLN C C -0.121 -7.779 -2.840 1.00 . A A . 49 GLN C 1 1 11 9738 1 1 49 GLN CA C -0.399 -8.249 -4.260 1.00 . A A . 49 GLN CA 1 1 11 9739 1 1 49 GLN CB C -0.748 -9.739 -4.274 1.00 . A A . 49 GLN CB 1 1 11 9740 1 1 49 GLN CD C -3.032 -9.688 -3.203 1.00 . A A . 49 GLN CD 1 1 11 9741 1 1 49 GLN CG C -2.231 -10.022 -4.446 1.00 . A A . 49 GLN CG 1 1 11 9742 1 1 49 GLN H H 1.453 -8.701 -5.169 1.00 . A A . 49 GLN H 1 1 11 9743 1 1 49 GLN HA H -1.224 -7.681 -4.666 1.00 . A A . 49 GLN HA 1 1 11 9744 1 1 49 GLN HB2 H -0.216 -10.213 -5.086 1.00 . A A . 49 GLN HB2 1 1 11 9745 1 1 49 GLN HB3 H -0.426 -10.179 -3.342 1.00 . A A . 49 GLN HB3 1 1 11 9746 1 1 49 GLN HE21 H -4.307 -8.607 -4.276 1.00 . A A . 49 GLN HE21 1 1 11 9747 1 1 49 GLN HE22 H -4.619 -8.674 -2.577 1.00 . A A . 49 GLN HE22 1 1 11 9748 1 1 49 GLN HG2 H -2.607 -9.432 -5.268 1.00 . A A . 49 GLN HG2 1 1 11 9749 1 1 49 GLN HG3 H -2.360 -11.073 -4.669 1.00 . A A . 49 GLN HG3 1 1 11 9750 1 1 49 GLN N N 0.773 -7.999 -5.080 1.00 . A A . 49 GLN N 1 1 11 9751 1 1 49 GLN NE2 N -4.093 -8.917 -3.369 1.00 . A A . 49 GLN NE2 1 1 11 9752 1 1 49 GLN O O 0.770 -8.309 -2.176 1.00 . A A . 49 GLN O 1 1 11 9753 1 1 49 GLN OE1 O -2.691 -10.117 -2.101 1.00 . A A . 49 GLN OE1 1 1 11 9754 1 1 50 CYS C C -0.847 -7.018 0.012 1.00 . A A . 50 CYS C 1 1 11 9755 1 1 50 CYS CA C -0.535 -6.076 -1.156 1.00 . A A . 50 CYS CA 1 1 11 9756 1 1 50 CYS CB C -1.372 -4.803 -1.063 1.00 . A A . 50 CYS CB 1 1 11 9757 1 1 50 CYS H H -1.423 -6.280 -3.051 1.00 . A A . 50 CYS H 1 1 11 9758 1 1 50 CYS HA H 0.510 -5.811 -1.119 1.00 . A A . 50 CYS HA 1 1 11 9759 1 1 50 CYS HB2 H -1.737 -4.687 -0.054 1.00 . A A . 50 CYS HB2 1 1 11 9760 1 1 50 CYS HB3 H -0.757 -3.952 -1.321 1.00 . A A . 50 CYS HB3 1 1 11 9761 1 1 50 CYS N N -0.790 -6.708 -2.437 1.00 . A A . 50 CYS N 1 1 11 9762 1 1 50 CYS O O -2.002 -7.370 0.250 1.00 . A A . 50 CYS O 1 1 11 9763 1 1 50 CYS SG S -2.813 -4.798 -2.177 1.00 . A A . 50 CYS SG 1 1 11 9764 1 1 51 PRO C C -0.495 -7.606 3.138 1.00 . A A . 51 PRO C 1 1 11 9765 1 1 51 PRO CA C 0.031 -8.337 1.904 1.00 . A A . 51 PRO CA 1 1 11 9766 1 1 51 PRO CB C 1.445 -8.860 2.140 1.00 . A A . 51 PRO CB 1 1 11 9767 1 1 51 PRO CD C 1.607 -7.096 0.516 1.00 . A A . 51 PRO CD 1 1 11 9768 1 1 51 PRO CG C 2.343 -7.782 1.636 1.00 . A A . 51 PRO CG 1 1 11 9769 1 1 51 PRO HA H -0.629 -9.161 1.672 1.00 . A A . 51 PRO HA 1 1 11 9770 1 1 51 PRO HB2 H 1.593 -9.036 3.196 1.00 . A A . 51 PRO HB2 1 1 11 9771 1 1 51 PRO HB3 H 1.587 -9.780 1.593 1.00 . A A . 51 PRO HB3 1 1 11 9772 1 1 51 PRO HD2 H 1.753 -6.028 0.569 1.00 . A A . 51 PRO HD2 1 1 11 9773 1 1 51 PRO HD3 H 1.940 -7.476 -0.439 1.00 . A A . 51 PRO HD3 1 1 11 9774 1 1 51 PRO HG2 H 2.552 -7.079 2.428 1.00 . A A . 51 PRO HG2 1 1 11 9775 1 1 51 PRO HG3 H 3.263 -8.213 1.267 1.00 . A A . 51 PRO HG3 1 1 11 9776 1 1 51 PRO N N 0.192 -7.442 0.755 1.00 . A A . 51 PRO N 1 1 11 9777 1 1 51 PRO O O 0.082 -7.682 4.228 1.00 . A A . 51 PRO O 1 1 11 9778 1 1 52 ARG C C -3.755 -6.248 3.818 1.00 . A A . 52 ARG C 1 1 11 9779 1 1 52 ARG CA C -2.250 -6.159 4.007 1.00 . A A . 52 ARG CA 1 1 11 9780 1 1 52 ARG CB C -1.802 -4.699 3.982 1.00 . A A . 52 ARG CB 1 1 11 9781 1 1 52 ARG CD C -1.802 -4.017 6.384 1.00 . A A . 52 ARG CD 1 1 11 9782 1 1 52 ARG CG C -0.946 -4.308 5.169 1.00 . A A . 52 ARG CG 1 1 11 9783 1 1 52 ARG CZ C -2.562 -5.853 7.846 1.00 . A A . 52 ARG CZ 1 1 11 9784 1 1 52 ARG H H -1.997 -6.882 2.050 1.00 . A A . 52 ARG H 1 1 11 9785 1 1 52 ARG HA H -1.979 -6.605 4.954 1.00 . A A . 52 ARG HA 1 1 11 9786 1 1 52 ARG HB2 H -1.234 -4.523 3.082 1.00 . A A . 52 ARG HB2 1 1 11 9787 1 1 52 ARG HB3 H -2.678 -4.066 3.974 1.00 . A A . 52 ARG HB3 1 1 11 9788 1 1 52 ARG HD2 H -1.541 -3.045 6.763 1.00 . A A . 52 ARG HD2 1 1 11 9789 1 1 52 ARG HD3 H -2.841 -4.017 6.084 1.00 . A A . 52 ARG HD3 1 1 11 9790 1 1 52 ARG HE H -0.724 -5.054 7.866 1.00 . A A . 52 ARG HE 1 1 11 9791 1 1 52 ARG HG2 H -0.273 -5.119 5.400 1.00 . A A . 52 ARG HG2 1 1 11 9792 1 1 52 ARG HG3 H -0.380 -3.424 4.916 1.00 . A A . 52 ARG HG3 1 1 11 9793 1 1 52 ARG HH11 H -3.999 -5.083 6.639 1.00 . A A . 52 ARG HH11 1 1 11 9794 1 1 52 ARG HH12 H -4.501 -6.416 7.639 1.00 . A A . 52 ARG HH12 1 1 11 9795 1 1 52 ARG HH21 H -1.390 -6.800 9.216 1.00 . A A . 52 ARG HH21 1 1 11 9796 1 1 52 ARG HH22 H -3.023 -7.391 9.083 1.00 . A A . 52 ARG HH22 1 1 11 9797 1 1 52 ARG N N -1.596 -6.897 2.948 1.00 . A A . 52 ARG N 1 1 11 9798 1 1 52 ARG NE N -1.615 -5.010 7.440 1.00 . A A . 52 ARG NE 1 1 11 9799 1 1 52 ARG NH1 N -3.782 -5.778 7.335 1.00 . A A . 52 ARG NH1 1 1 11 9800 1 1 52 ARG NH2 N -2.305 -6.750 8.792 1.00 . A A . 52 ARG NH2 1 1 11 9801 1 1 52 ARG O O -4.467 -6.840 4.630 1.00 . A A . 52 ARG O 1 1 11 9802 1 1 53 CYS C C -5.894 -7.148 1.599 1.00 . A A . 53 CYS C 1 1 11 9803 1 1 53 CYS CA C -5.602 -5.820 2.299 1.00 . A A . 53 CYS CA 1 1 11 9804 1 1 53 CYS CB C -5.882 -4.648 1.376 1.00 . A A . 53 CYS CB 1 1 11 9805 1 1 53 CYS H H -3.580 -5.328 2.055 1.00 . A A . 53 CYS H 1 1 11 9806 1 1 53 CYS HA H -6.210 -5.737 3.187 1.00 . A A . 53 CYS HA 1 1 11 9807 1 1 53 CYS HB2 H -6.262 -5.021 0.438 1.00 . A A . 53 CYS HB2 1 1 11 9808 1 1 53 CYS HB3 H -6.614 -3.999 1.830 1.00 . A A . 53 CYS HB3 1 1 11 9809 1 1 53 CYS N N -4.211 -5.748 2.683 1.00 . A A . 53 CYS N 1 1 11 9810 1 1 53 CYS O O -6.483 -7.183 0.516 1.00 . A A . 53 CYS O 1 1 11 9811 1 1 53 CYS SG S -4.388 -3.658 1.025 1.00 . A A . 53 CYS SG 1 1 11 9812 1 1 54 THR C C -6.896 -10.139 1.811 1.00 . A A . 54 THR C 1 1 11 9813 1 1 54 THR CA C -5.503 -9.547 1.599 1.00 . A A . 54 THR CA 1 1 11 9814 1 1 54 THR CB C -4.449 -10.490 2.205 1.00 . A A . 54 THR CB 1 1 11 9815 1 1 54 THR CG2 C -3.437 -10.912 1.153 1.00 . A A . 54 THR CG2 1 1 11 9816 1 1 54 THR H H -4.872 -8.119 3.009 1.00 . A A . 54 THR H 1 1 11 9817 1 1 54 THR HA H -5.312 -9.464 0.540 1.00 . A A . 54 THR HA 1 1 11 9818 1 1 54 THR HB H -4.947 -11.372 2.582 1.00 . A A . 54 THR HB 1 1 11 9819 1 1 54 THR HG1 H -2.849 -10.130 3.322 1.00 . A A . 54 THR HG1 1 1 11 9820 1 1 54 THR HG21 H -3.826 -11.753 0.597 1.00 . A A . 54 THR HG21 1 1 11 9821 1 1 54 THR HG22 H -2.513 -11.197 1.636 1.00 . A A . 54 THR HG22 1 1 11 9822 1 1 54 THR HG23 H -3.252 -10.088 0.480 1.00 . A A . 54 THR HG23 1 1 11 9823 1 1 54 THR N N -5.392 -8.224 2.184 1.00 . A A . 54 THR N 1 1 11 9824 1 1 54 THR O O -7.086 -11.028 2.640 1.00 . A A . 54 THR O 1 1 11 9825 1 1 54 THR OG1 O -3.774 -9.830 3.289 1.00 . A A . 54 THR OG1 1 1 11 9826 1 1 55 CYS C C -9.514 -10.997 -0.126 1.00 . A A . 55 CYS C 1 1 11 9827 1 1 55 CYS CA C -9.220 -10.159 1.114 1.00 . A A . 55 CYS CA 1 1 11 9828 1 1 55 CYS CB C -10.225 -9.010 1.225 1.00 . A A . 55 CYS CB 1 1 11 9829 1 1 55 CYS H H -7.645 -8.940 0.404 1.00 . A A . 55 CYS H 1 1 11 9830 1 1 55 CYS HA H -9.299 -10.789 1.989 1.00 . A A . 55 CYS HA 1 1 11 9831 1 1 55 CYS HB2 H -10.780 -8.939 0.304 1.00 . A A . 55 CYS HB2 1 1 11 9832 1 1 55 CYS HB3 H -10.909 -9.216 2.038 1.00 . A A . 55 CYS HB3 1 1 11 9833 1 1 55 CYS HG H -8.962 -6.955 0.393 1.00 . A A . 55 CYS HG 1 1 11 9834 1 1 55 CYS N N -7.861 -9.648 1.050 1.00 . A A . 55 CYS N 1 1 11 9835 1 1 55 CYS O O -9.636 -10.461 -1.228 1.00 . A A . 55 CYS O 1 1 11 9836 1 1 55 CYS SG S -9.475 -7.396 1.539 1.00 . A A . 55 CYS SG 1 1 11 9837 1 1 56 PRO C C -11.049 -13.011 -1.830 1.00 . A A . 56 PRO C 1 1 11 9838 1 1 56 PRO CA C -9.737 -13.256 -1.094 1.00 . A A . 56 PRO CA 1 1 11 9839 1 1 56 PRO CB C -9.753 -14.635 -0.428 1.00 . A A . 56 PRO CB 1 1 11 9840 1 1 56 PRO CD C -9.316 -13.045 1.296 1.00 . A A . 56 PRO CD 1 1 11 9841 1 1 56 PRO CG C -9.018 -14.448 0.852 1.00 . A A . 56 PRO CG 1 1 11 9842 1 1 56 PRO HA H -8.920 -13.204 -1.799 1.00 . A A . 56 PRO HA 1 1 11 9843 1 1 56 PRO HB2 H -10.774 -14.943 -0.258 1.00 . A A . 56 PRO HB2 1 1 11 9844 1 1 56 PRO HB3 H -9.255 -15.350 -1.066 1.00 . A A . 56 PRO HB3 1 1 11 9845 1 1 56 PRO HD2 H -10.202 -13.023 1.911 1.00 . A A . 56 PRO HD2 1 1 11 9846 1 1 56 PRO HD3 H -8.473 -12.630 1.828 1.00 . A A . 56 PRO HD3 1 1 11 9847 1 1 56 PRO HG2 H -9.372 -15.156 1.586 1.00 . A A . 56 PRO HG2 1 1 11 9848 1 1 56 PRO HG3 H -7.957 -14.572 0.689 1.00 . A A . 56 PRO HG3 1 1 11 9849 1 1 56 PRO N N -9.539 -12.330 0.027 1.00 . A A . 56 PRO N 1 1 11 9850 1 1 56 PRO O O -12.104 -12.855 -1.207 1.00 . A A . 56 PRO O 1 1 11 9851 1 1 57 ALA C C -12.808 -11.400 -3.692 1.00 . A A . 57 ALA C 1 1 11 9852 1 1 57 ALA CA C -12.122 -12.727 -4.017 1.00 . A A . 57 ALA CA 1 1 11 9853 1 1 57 ALA CB C -13.108 -13.885 -3.914 1.00 . A A . 57 ALA CB 1 1 11 9854 1 1 57 ALA H H -10.079 -13.062 -3.575 1.00 . A A . 57 ALA H 1 1 11 9855 1 1 57 ALA HA H -11.767 -12.688 -5.037 1.00 . A A . 57 ALA HA 1 1 11 9856 1 1 57 ALA HB1 H -13.013 -14.352 -2.943 1.00 . A A . 57 ALA HB1 1 1 11 9857 1 1 57 ALA HB2 H -14.113 -13.514 -4.038 1.00 . A A . 57 ALA HB2 1 1 11 9858 1 1 57 ALA HB3 H -12.893 -14.611 -4.684 1.00 . A A . 57 ALA HB3 1 1 11 9859 1 1 57 ALA N N -10.962 -12.957 -3.158 1.00 . A A . 57 ALA N 1 1 11 9860 1 1 57 ALA O O -14.014 -11.354 -3.441 1.00 . A A . 57 ALA O 1 1 11 9861 1 1 58 LEU C C -13.415 -8.518 -4.665 1.00 . A A . 58 LEU C 1 1 11 9862 1 1 58 LEU CA C -12.586 -8.989 -3.476 1.00 . A A . 58 LEU CA 1 1 11 9863 1 1 58 LEU CB C -11.461 -7.990 -3.194 1.00 . A A . 58 LEU CB 1 1 11 9864 1 1 58 LEU CD1 C -11.859 -6.611 -1.137 1.00 . A A . 58 LEU CD1 1 1 11 9865 1 1 58 LEU CD2 C -11.090 -5.510 -3.241 1.00 . A A . 58 LEU CD2 1 1 11 9866 1 1 58 LEU CG C -11.926 -6.635 -2.654 1.00 . A A . 58 LEU CG 1 1 11 9867 1 1 58 LEU H H -11.085 -10.414 -3.954 1.00 . A A . 58 LEU H 1 1 11 9868 1 1 58 LEU HA H -13.226 -9.052 -2.609 1.00 . A A . 58 LEU HA 1 1 11 9869 1 1 58 LEU HB2 H -10.787 -8.431 -2.473 1.00 . A A . 58 LEU HB2 1 1 11 9870 1 1 58 LEU HB3 H -10.918 -7.819 -4.112 1.00 . A A . 58 LEU HB3 1 1 11 9871 1 1 58 LEU HD11 H -11.597 -5.618 -0.805 1.00 . A A . 58 LEU HD11 1 1 11 9872 1 1 58 LEU HD12 H -12.821 -6.884 -0.730 1.00 . A A . 58 LEU HD12 1 1 11 9873 1 1 58 LEU HD13 H -11.113 -7.315 -0.797 1.00 . A A . 58 LEU HD13 1 1 11 9874 1 1 58 LEU HD21 H -11.158 -5.533 -4.318 1.00 . A A . 58 LEU HD21 1 1 11 9875 1 1 58 LEU HD22 H -11.457 -4.563 -2.875 1.00 . A A . 58 LEU HD22 1 1 11 9876 1 1 58 LEU HD23 H -10.060 -5.635 -2.943 1.00 . A A . 58 LEU HD23 1 1 11 9877 1 1 58 LEU HG H -12.954 -6.475 -2.945 1.00 . A A . 58 LEU HG 1 1 11 9878 1 1 58 LEU N N -12.041 -10.318 -3.729 1.00 . A A . 58 LEU N 1 1 11 9879 1 1 58 LEU O O -14.340 -7.716 -4.514 1.00 . A A . 58 LEU O 1 1 11 9880 1 1 59 LYS C C -13.629 -7.232 -7.405 1.00 . A A . 59 LYS C 1 1 11 9881 1 1 59 LYS CA C -13.766 -8.716 -7.084 1.00 . A A . 59 LYS CA 1 1 11 9882 1 1 59 LYS CB C -15.240 -9.123 -7.014 1.00 . A A . 59 LYS CB 1 1 11 9883 1 1 59 LYS CD C -16.983 -10.782 -7.748 1.00 . A A . 59 LYS CD 1 1 11 9884 1 1 59 LYS CE C -17.264 -12.251 -8.009 1.00 . A A . 59 LYS CE 1 1 11 9885 1 1 59 LYS CG C -15.502 -10.533 -7.522 1.00 . A A . 59 LYS CG 1 1 11 9886 1 1 59 LYS H H -12.326 -9.674 -5.874 1.00 . A A . 59 LYS H 1 1 11 9887 1 1 59 LYS HA H -13.288 -9.279 -7.872 1.00 . A A . 59 LYS HA 1 1 11 9888 1 1 59 LYS HB2 H -15.568 -9.067 -5.987 1.00 . A A . 59 LYS HB2 1 1 11 9889 1 1 59 LYS HB3 H -15.822 -8.435 -7.608 1.00 . A A . 59 LYS HB3 1 1 11 9890 1 1 59 LYS HD2 H -17.531 -10.471 -6.872 1.00 . A A . 59 LYS HD2 1 1 11 9891 1 1 59 LYS HD3 H -17.309 -10.204 -8.602 1.00 . A A . 59 LYS HD3 1 1 11 9892 1 1 59 LYS HE2 H -18.077 -12.326 -8.714 1.00 . A A . 59 LYS HE2 1 1 11 9893 1 1 59 LYS HE3 H -16.378 -12.703 -8.432 1.00 . A A . 59 LYS HE3 1 1 11 9894 1 1 59 LYS HG2 H -14.978 -10.672 -8.456 1.00 . A A . 59 LYS HG2 1 1 11 9895 1 1 59 LYS HG3 H -15.135 -11.240 -6.793 1.00 . A A . 59 LYS HG3 1 1 11 9896 1 1 59 LYS HZ1 H -17.246 -13.951 -6.788 1.00 . A A . 59 LYS HZ1 1 1 11 9897 1 1 59 LYS HZ2 H -18.668 -13.032 -6.669 1.00 . A A . 59 LYS HZ2 1 1 11 9898 1 1 59 LYS HZ3 H -17.241 -12.489 -5.927 1.00 . A A . 59 LYS HZ3 1 1 11 9899 1 1 59 LYS N N -13.076 -9.044 -5.842 1.00 . A A . 59 LYS N 1 1 11 9900 1 1 59 LYS NZ N -17.630 -12.979 -6.763 1.00 . A A . 59 LYS NZ 1 1 11 9901 1 1 59 LYS O O -14.620 -6.524 -7.593 1.00 . A A . 59 LYS O 1 1 11 9902 1 1 60 GLY C C -11.406 -5.255 -9.132 1.00 . A A . 60 GLY C 1 1 11 9903 1 1 60 GLY CA C -12.121 -5.389 -7.806 1.00 . A A . 60 GLY CA 1 1 11 9904 1 1 60 GLY H H -11.638 -7.396 -7.333 1.00 . A A . 60 GLY H 1 1 11 9905 1 1 60 GLY HA2 H -13.056 -4.852 -7.852 1.00 . A A . 60 GLY HA2 1 1 11 9906 1 1 60 GLY HA3 H -11.504 -4.957 -7.032 1.00 . A A . 60 GLY HA3 1 1 11 9907 1 1 60 GLY N N -12.387 -6.775 -7.479 1.00 . A A . 60 GLY N 1 1 11 9908 1 1 60 GLY O O -10.788 -4.228 -9.418 1.00 . A A . 60 GLY O 1 1 11 9909 1 1 61 LYS C C -11.871 -6.852 -12.284 1.00 . A A . 61 LYS C 1 1 11 9910 1 1 61 LYS CA C -10.892 -6.298 -11.264 1.00 . A A . 61 LYS CA 1 1 11 9911 1 1 61 LYS CB C -9.611 -7.136 -11.254 1.00 . A A . 61 LYS CB 1 1 11 9912 1 1 61 LYS CD C -7.339 -6.496 -12.119 1.00 . A A . 61 LYS CD 1 1 11 9913 1 1 61 LYS CE C -6.030 -5.791 -11.798 1.00 . A A . 61 LYS CE 1 1 11 9914 1 1 61 LYS CG C -8.353 -6.322 -11.000 1.00 . A A . 61 LYS CG 1 1 11 9915 1 1 61 LYS H H -12.044 -7.065 -9.674 1.00 . A A . 61 LYS H 1 1 11 9916 1 1 61 LYS HA H -10.651 -5.279 -11.525 1.00 . A A . 61 LYS HA 1 1 11 9917 1 1 61 LYS HB2 H -9.691 -7.886 -10.479 1.00 . A A . 61 LYS HB2 1 1 11 9918 1 1 61 LYS HB3 H -9.509 -7.629 -12.209 1.00 . A A . 61 LYS HB3 1 1 11 9919 1 1 61 LYS HD2 H -7.146 -7.549 -12.253 1.00 . A A . 61 LYS HD2 1 1 11 9920 1 1 61 LYS HD3 H -7.746 -6.081 -13.029 1.00 . A A . 61 LYS HD3 1 1 11 9921 1 1 61 LYS HE2 H -6.169 -5.185 -10.914 1.00 . A A . 61 LYS HE2 1 1 11 9922 1 1 61 LYS HE3 H -5.271 -6.536 -11.606 1.00 . A A . 61 LYS HE3 1 1 11 9923 1 1 61 LYS HG2 H -8.620 -5.277 -10.930 1.00 . A A . 61 LYS HG2 1 1 11 9924 1 1 61 LYS HG3 H -7.908 -6.644 -10.069 1.00 . A A . 61 LYS HG3 1 1 11 9925 1 1 61 LYS HZ1 H -5.915 -5.309 -13.827 1.00 . A A . 61 LYS HZ1 1 1 11 9926 1 1 61 LYS HZ2 H -4.542 -4.864 -12.936 1.00 . A A . 61 LYS HZ2 1 1 11 9927 1 1 61 LYS HZ3 H -5.969 -3.958 -12.799 1.00 . A A . 61 LYS HZ3 1 1 11 9928 1 1 61 LYS N N -11.507 -6.292 -9.948 1.00 . A A . 61 LYS N 1 1 11 9929 1 1 61 LYS NZ N -5.584 -4.921 -12.916 1.00 . A A . 61 LYS NZ 1 1 11 9930 1 1 61 LYS O O -11.708 -6.563 -13.486 1.00 . A A . 61 LYS O 1 1 11 9931 1 1 61 LYS OXT O -12.805 -7.572 -11.874 1.00 . A A . 61 LYS OXT 1 1 11 9932 2 2 1 ZN ZN ZN -4.328 -3.391 -1.236 1.00 . B A . 62 ZN ZN 1 1 11 9933 3 2 1 ZN ZN ZN 3.624 3.453 4.142 1.00 . C A . 63 ZN ZN 1 1 12 9934 1 1 1 GLY C C -23.233 5.643 -2.234 1.00 . A A . 1 GLY C 1 1 12 9935 1 1 1 GLY CA C -23.535 4.167 -2.101 1.00 . A A . 1 GLY CA 1 1 12 9936 1 1 1 GLY H1 H -25.554 3.837 -2.483 1.00 . A A . 1 GLY H1 1 1 12 9937 1 1 1 GLY H2 H -24.517 2.756 -3.276 1.00 . A A . 1 GLY H2 1 1 12 9938 1 1 1 GLY H3 H -24.672 4.351 -3.837 1.00 . A A . 1 GLY H3 1 1 12 9939 1 1 1 GLY HA2 H -23.801 3.955 -1.077 1.00 . A A . 1 GLY HA2 1 1 12 9940 1 1 1 GLY HA3 H -22.651 3.605 -2.359 1.00 . A A . 1 GLY HA3 1 1 12 9941 1 1 1 GLY N N -24.646 3.749 -2.984 1.00 . A A . 1 GLY N 1 1 12 9942 1 1 1 GLY O O -24.145 6.467 -2.214 1.00 . A A . 1 GLY O 1 1 12 9943 1 1 2 PRO C C -21.746 7.942 -3.930 1.00 . A A . 2 PRO C 1 1 12 9944 1 1 2 PRO CA C -21.542 7.408 -2.517 1.00 . A A . 2 PRO CA 1 1 12 9945 1 1 2 PRO CB C -20.055 7.355 -2.182 1.00 . A A . 2 PRO CB 1 1 12 9946 1 1 2 PRO CD C -20.803 5.089 -2.429 1.00 . A A . 2 PRO CD 1 1 12 9947 1 1 2 PRO CG C -19.619 6.001 -2.626 1.00 . A A . 2 PRO CG 1 1 12 9948 1 1 2 PRO HA H -22.052 8.045 -1.810 1.00 . A A . 2 PRO HA 1 1 12 9949 1 1 2 PRO HB2 H -19.536 8.136 -2.718 1.00 . A A . 2 PRO HB2 1 1 12 9950 1 1 2 PRO HB3 H -19.917 7.486 -1.119 1.00 . A A . 2 PRO HB3 1 1 12 9951 1 1 2 PRO HD2 H -20.894 4.406 -3.259 1.00 . A A . 2 PRO HD2 1 1 12 9952 1 1 2 PRO HD3 H -20.707 4.546 -1.501 1.00 . A A . 2 PRO HD3 1 1 12 9953 1 1 2 PRO HG2 H -19.336 6.030 -3.668 1.00 . A A . 2 PRO HG2 1 1 12 9954 1 1 2 PRO HG3 H -18.787 5.669 -2.021 1.00 . A A . 2 PRO HG3 1 1 12 9955 1 1 2 PRO N N -21.954 6.011 -2.381 1.00 . A A . 2 PRO N 1 1 12 9956 1 1 2 PRO O O -22.049 7.186 -4.856 1.00 . A A . 2 PRO O 1 1 12 9957 1 1 3 LEU C C -20.340 9.556 -6.220 1.00 . A A . 3 LEU C 1 1 12 9958 1 1 3 LEU CA C -21.598 9.854 -5.415 1.00 . A A . 3 LEU CA 1 1 12 9959 1 1 3 LEU CB C -21.790 11.366 -5.273 1.00 . A A . 3 LEU CB 1 1 12 9960 1 1 3 LEU CD1 C -23.287 13.364 -5.417 1.00 . A A . 3 LEU CD1 1 1 12 9961 1 1 3 LEU CD2 C -23.168 11.751 -7.327 1.00 . A A . 3 LEU CD2 1 1 12 9962 1 1 3 LEU CG C -23.111 11.908 -5.816 1.00 . A A . 3 LEU CG 1 1 12 9963 1 1 3 LEU H H -21.211 9.773 -3.334 1.00 . A A . 3 LEU H 1 1 12 9964 1 1 3 LEU HA H -22.451 9.434 -5.927 1.00 . A A . 3 LEU HA 1 1 12 9965 1 1 3 LEU HB2 H -21.726 11.619 -4.224 1.00 . A A . 3 LEU HB2 1 1 12 9966 1 1 3 LEU HB3 H -20.982 11.859 -5.794 1.00 . A A . 3 LEU HB3 1 1 12 9967 1 1 3 LEU HD11 H -23.100 13.473 -4.359 1.00 . A A . 3 LEU HD11 1 1 12 9968 1 1 3 LEU HD12 H -22.590 13.977 -5.970 1.00 . A A . 3 LEU HD12 1 1 12 9969 1 1 3 LEU HD13 H -24.296 13.679 -5.638 1.00 . A A . 3 LEU HD13 1 1 12 9970 1 1 3 LEU HD21 H -24.139 12.058 -7.687 1.00 . A A . 3 LEU HD21 1 1 12 9971 1 1 3 LEU HD22 H -22.404 12.365 -7.780 1.00 . A A . 3 LEU HD22 1 1 12 9972 1 1 3 LEU HD23 H -22.999 10.715 -7.587 1.00 . A A . 3 LEU HD23 1 1 12 9973 1 1 3 LEU HG H -23.928 11.345 -5.389 1.00 . A A . 3 LEU HG 1 1 12 9974 1 1 3 LEU N N -21.508 9.232 -4.104 1.00 . A A . 3 LEU N 1 1 12 9975 1 1 3 LEU O O -19.350 10.286 -6.139 1.00 . A A . 3 LEU O 1 1 12 9976 1 1 4 GLY C C -18.150 7.346 -6.690 1.00 . A A . 4 GLY C 1 1 12 9977 1 1 4 GLY CA C -19.166 7.983 -7.613 1.00 . A A . 4 GLY CA 1 1 12 9978 1 1 4 GLY H H -21.124 7.829 -6.837 1.00 . A A . 4 GLY H 1 1 12 9979 1 1 4 GLY HA2 H -19.459 7.264 -8.364 1.00 . A A . 4 GLY HA2 1 1 12 9980 1 1 4 GLY HA3 H -18.713 8.835 -8.097 1.00 . A A . 4 GLY HA3 1 1 12 9981 1 1 4 GLY N N -20.343 8.417 -6.894 1.00 . A A . 4 GLY N 1 1 12 9982 1 1 4 GLY O O -18.300 6.189 -6.293 1.00 . A A . 4 GLY O 1 1 12 9983 1 1 5 SER C C -16.009 8.558 -4.181 1.00 . A A . 5 SER C 1 1 12 9984 1 1 5 SER CA C -16.128 7.636 -5.391 1.00 . A A . 5 SER CA 1 1 12 9985 1 1 5 SER CB C -14.785 7.535 -6.110 1.00 . A A . 5 SER CB 1 1 12 9986 1 1 5 SER H H -17.096 9.042 -6.639 1.00 . A A . 5 SER H 1 1 12 9987 1 1 5 SER HA H -16.421 6.654 -5.052 1.00 . A A . 5 SER HA 1 1 12 9988 1 1 5 SER HB2 H -14.581 8.463 -6.621 1.00 . A A . 5 SER HB2 1 1 12 9989 1 1 5 SER HB3 H -14.005 7.339 -5.388 1.00 . A A . 5 SER HB3 1 1 12 9990 1 1 5 SER HG H -15.308 6.764 -7.840 1.00 . A A . 5 SER HG 1 1 12 9991 1 1 5 SER N N -17.146 8.114 -6.307 1.00 . A A . 5 SER N 1 1 12 9992 1 1 5 SER O O -15.973 9.783 -4.317 1.00 . A A . 5 SER O 1 1 12 9993 1 1 5 SER OG O -14.799 6.485 -7.062 1.00 . A A . 5 SER OG 1 1 12 9994 1 1 6 ASP C C -14.536 8.252 -1.020 1.00 . A A . 6 ASP C 1 1 12 9995 1 1 6 ASP CA C -15.772 8.716 -1.774 1.00 . A A . 6 ASP CA 1 1 12 9996 1 1 6 ASP CB C -17.010 8.559 -0.889 1.00 . A A . 6 ASP CB 1 1 12 9997 1 1 6 ASP CG C -16.934 9.405 0.365 1.00 . A A . 6 ASP CG 1 1 12 9998 1 1 6 ASP H H -15.930 6.973 -2.965 1.00 . A A . 6 ASP H 1 1 12 9999 1 1 6 ASP HA H -15.654 9.757 -2.035 1.00 . A A . 6 ASP HA 1 1 12 10000 1 1 6 ASP HB2 H -17.885 8.855 -1.447 1.00 . A A . 6 ASP HB2 1 1 12 10001 1 1 6 ASP HB3 H -17.110 7.524 -0.596 1.00 . A A . 6 ASP HB3 1 1 12 10002 1 1 6 ASP N N -15.923 7.960 -3.005 1.00 . A A . 6 ASP N 1 1 12 10003 1 1 6 ASP O O -14.362 7.054 -0.797 1.00 . A A . 6 ASP O 1 1 12 10004 1 1 6 ASP OD1 O -16.895 10.647 0.246 1.00 . A A . 6 ASP OD1 1 1 12 10005 1 1 6 ASP OD2 O -16.916 8.832 1.475 1.00 . A A . 6 ASP OD2 1 1 12 10006 1 1 7 HIS C C -11.558 7.962 -0.699 1.00 . A A . 7 HIS C 1 1 12 10007 1 1 7 HIS CA C -12.447 8.926 0.079 1.00 . A A . 7 HIS CA 1 1 12 10008 1 1 7 HIS CB C -12.738 8.369 1.478 1.00 . A A . 7 HIS CB 1 1 12 10009 1 1 7 HIS CD2 C -10.326 8.913 2.214 1.00 . A A . 7 HIS CD2 1 1 12 10010 1 1 7 HIS CE1 C -10.634 8.737 4.359 1.00 . A A . 7 HIS CE1 1 1 12 10011 1 1 7 HIS CG C -11.618 8.586 2.452 1.00 . A A . 7 HIS CG 1 1 12 10012 1 1 7 HIS H H -13.904 10.140 -0.861 1.00 . A A . 7 HIS H 1 1 12 10013 1 1 7 HIS HA H -11.918 9.863 0.186 1.00 . A A . 7 HIS HA 1 1 12 10014 1 1 7 HIS HB2 H -13.620 8.848 1.874 1.00 . A A . 7 HIS HB2 1 1 12 10015 1 1 7 HIS HB3 H -12.915 7.307 1.404 1.00 . A A . 7 HIS HB3 1 1 12 10016 1 1 7 HIS HD2 H -9.866 9.063 1.248 1.00 . A A . 7 HIS HD2 1 1 12 10017 1 1 7 HIS HE1 H -10.448 8.733 5.422 1.00 . A A . 7 HIS HE1 1 1 12 10018 1 1 7 HIS HE2 H -8.851 9.482 3.600 1.00 . A A . 7 HIS HE2 1 1 12 10019 1 1 7 HIS N N -13.687 9.206 -0.646 1.00 . A A . 7 HIS N 1 1 12 10020 1 1 7 HIS ND1 N -11.808 8.476 3.808 1.00 . A A . 7 HIS ND1 1 1 12 10021 1 1 7 HIS NE2 N -9.706 9.009 3.433 1.00 . A A . 7 HIS NE2 1 1 12 10022 1 1 7 HIS O O -11.555 6.757 -0.444 1.00 . A A . 7 HIS O 1 1 12 10023 1 1 8 HIS C C -8.526 7.537 -1.502 1.00 . A A . 8 HIS C 1 1 12 10024 1 1 8 HIS CA C -9.790 7.714 -2.326 1.00 . A A . 8 HIS CA 1 1 12 10025 1 1 8 HIS CB C -9.460 8.374 -3.663 1.00 . A A . 8 HIS CB 1 1 12 10026 1 1 8 HIS CD2 C -8.658 7.628 -6.000 1.00 . A A . 8 HIS CD2 1 1 12 10027 1 1 8 HIS CE1 C -8.617 5.487 -5.612 1.00 . A A . 8 HIS CE1 1 1 12 10028 1 1 8 HIS CG C -9.044 7.399 -4.723 1.00 . A A . 8 HIS CG 1 1 12 10029 1 1 8 HIS H H -10.743 9.490 -1.690 1.00 . A A . 8 HIS H 1 1 12 10030 1 1 8 HIS HA H -10.229 6.744 -2.507 1.00 . A A . 8 HIS HA 1 1 12 10031 1 1 8 HIS HB2 H -10.332 8.903 -4.019 1.00 . A A . 8 HIS HB2 1 1 12 10032 1 1 8 HIS HB3 H -8.652 9.077 -3.517 1.00 . A A . 8 HIS HB3 1 1 12 10033 1 1 8 HIS HD2 H -8.581 8.587 -6.490 1.00 . A A . 8 HIS HD2 1 1 12 10034 1 1 8 HIS HE1 H -8.494 4.422 -5.753 1.00 . A A . 8 HIS HE1 1 1 12 10035 1 1 8 HIS HE2 H -8.297 6.226 -7.525 1.00 . A A . 8 HIS HE2 1 1 12 10036 1 1 8 HIS N N -10.750 8.510 -1.587 1.00 . A A . 8 HIS N 1 1 12 10037 1 1 8 HIS ND1 N -9.016 6.047 -4.484 1.00 . A A . 8 HIS ND1 1 1 12 10038 1 1 8 HIS NE2 N -8.388 6.406 -6.561 1.00 . A A . 8 HIS NE2 1 1 12 10039 1 1 8 HIS O O -8.061 8.475 -0.851 1.00 . A A . 8 HIS O 1 1 12 10040 1 1 9 MET C C -5.545 6.171 -1.535 1.00 . A A . 9 MET C 1 1 12 10041 1 1 9 MET CA C -6.818 6.022 -0.709 1.00 . A A . 9 MET CA 1 1 12 10042 1 1 9 MET CB C -6.916 4.609 -0.128 1.00 . A A . 9 MET CB 1 1 12 10043 1 1 9 MET CE C -8.961 5.272 2.252 1.00 . A A . 9 MET CE 1 1 12 10044 1 1 9 MET CG C -6.452 4.518 1.317 1.00 . A A . 9 MET CG 1 1 12 10045 1 1 9 MET H H -8.417 5.620 -2.032 1.00 . A A . 9 MET H 1 1 12 10046 1 1 9 MET HA H -6.780 6.730 0.106 1.00 . A A . 9 MET HA 1 1 12 10047 1 1 9 MET HB2 H -7.944 4.284 -0.175 1.00 . A A . 9 MET HB2 1 1 12 10048 1 1 9 MET HB3 H -6.308 3.943 -0.722 1.00 . A A . 9 MET HB3 1 1 12 10049 1 1 9 MET HE1 H -9.085 5.499 1.204 1.00 . A A . 9 MET HE1 1 1 12 10050 1 1 9 MET HE2 H -9.906 4.953 2.666 1.00 . A A . 9 MET HE2 1 1 12 10051 1 1 9 MET HE3 H -8.620 6.155 2.775 1.00 . A A . 9 MET HE3 1 1 12 10052 1 1 9 MET HG2 H -5.626 3.824 1.375 1.00 . A A . 9 MET HG2 1 1 12 10053 1 1 9 MET HG3 H -6.120 5.496 1.631 1.00 . A A . 9 MET HG3 1 1 12 10054 1 1 9 MET N N -7.996 6.329 -1.500 1.00 . A A . 9 MET N 1 1 12 10055 1 1 9 MET O O -4.746 5.236 -1.640 1.00 . A A . 9 MET O 1 1 12 10056 1 1 9 MET SD S -7.753 3.961 2.439 1.00 . A A . 9 MET SD 1 1 12 10057 1 1 10 GLU C C -2.945 8.016 -1.712 1.00 . A A . 10 GLU C 1 1 12 10058 1 1 10 GLU CA C -4.055 7.702 -2.710 1.00 . A A . 10 GLU CA 1 1 12 10059 1 1 10 GLU CB C -4.254 8.884 -3.666 1.00 . A A . 10 GLU CB 1 1 12 10060 1 1 10 GLU CD C -5.799 10.143 -5.209 1.00 . A A . 10 GLU CD 1 1 12 10061 1 1 10 GLU CG C -5.664 9.007 -4.217 1.00 . A A . 10 GLU CG 1 1 12 10062 1 1 10 GLU H H -5.912 8.121 -1.783 1.00 . A A . 10 GLU H 1 1 12 10063 1 1 10 GLU HA H -3.772 6.829 -3.282 1.00 . A A . 10 GLU HA 1 1 12 10064 1 1 10 GLU HB2 H -4.014 9.798 -3.145 1.00 . A A . 10 GLU HB2 1 1 12 10065 1 1 10 GLU HB3 H -3.578 8.770 -4.500 1.00 . A A . 10 GLU HB3 1 1 12 10066 1 1 10 GLU HG2 H -5.926 8.084 -4.713 1.00 . A A . 10 GLU HG2 1 1 12 10067 1 1 10 GLU HG3 H -6.346 9.180 -3.399 1.00 . A A . 10 GLU HG3 1 1 12 10068 1 1 10 GLU N N -5.292 7.390 -2.000 1.00 . A A . 10 GLU N 1 1 12 10069 1 1 10 GLU O O -2.162 8.952 -1.896 1.00 . A A . 10 GLU O 1 1 12 10070 1 1 10 GLU OE1 O -5.439 9.956 -6.389 1.00 . A A . 10 GLU OE1 1 1 12 10071 1 1 10 GLU OE2 O -6.267 11.234 -4.817 1.00 . A A . 10 GLU OE2 1 1 12 10072 1 1 11 PHE C C -1.794 6.102 1.188 1.00 . A A . 11 PHE C 1 1 12 10073 1 1 11 PHE CA C -1.936 7.409 0.418 1.00 . A A . 11 PHE CA 1 1 12 10074 1 1 11 PHE CB C -2.357 8.548 1.361 1.00 . A A . 11 PHE CB 1 1 12 10075 1 1 11 PHE CD1 C -4.860 8.344 1.503 1.00 . A A . 11 PHE CD1 1 1 12 10076 1 1 11 PHE CD2 C -3.582 7.955 3.476 1.00 . A A . 11 PHE CD2 1 1 12 10077 1 1 11 PHE CE1 C -6.023 8.093 2.203 1.00 . A A . 11 PHE CE1 1 1 12 10078 1 1 11 PHE CE2 C -4.743 7.702 4.183 1.00 . A A . 11 PHE CE2 1 1 12 10079 1 1 11 PHE CG C -3.626 8.277 2.128 1.00 . A A . 11 PHE CG 1 1 12 10080 1 1 11 PHE CZ C -5.966 7.773 3.545 1.00 . A A . 11 PHE CZ 1 1 12 10081 1 1 11 PHE H H -3.570 6.519 -0.563 1.00 . A A . 11 PHE H 1 1 12 10082 1 1 11 PHE HA H -0.988 7.653 -0.036 1.00 . A A . 11 PHE HA 1 1 12 10083 1 1 11 PHE HB2 H -1.568 8.720 2.079 1.00 . A A . 11 PHE HB2 1 1 12 10084 1 1 11 PHE HB3 H -2.505 9.448 0.780 1.00 . A A . 11 PHE HB3 1 1 12 10085 1 1 11 PHE HD1 H -4.908 8.594 0.453 1.00 . A A . 11 PHE HD1 1 1 12 10086 1 1 11 PHE HD2 H -2.626 7.898 3.976 1.00 . A A . 11 PHE HD2 1 1 12 10087 1 1 11 PHE HE1 H -6.977 8.151 1.703 1.00 . A A . 11 PHE HE1 1 1 12 10088 1 1 11 PHE HE2 H -4.694 7.448 5.232 1.00 . A A . 11 PHE HE2 1 1 12 10089 1 1 11 PHE HZ H -6.874 7.576 4.096 1.00 . A A . 11 PHE HZ 1 1 12 10090 1 1 11 PHE N N -2.910 7.239 -0.642 1.00 . A A . 11 PHE N 1 1 12 10091 1 1 11 PHE O O -2.598 5.183 1.006 1.00 . A A . 11 PHE O 1 1 12 10092 1 1 12 CYS C C -1.567 4.503 3.767 1.00 . A A . 12 CYS C 1 1 12 10093 1 1 12 CYS CA C -0.471 4.782 2.749 1.00 . A A . 12 CYS CA 1 1 12 10094 1 1 12 CYS CB C 0.863 4.900 3.470 1.00 . A A . 12 CYS CB 1 1 12 10095 1 1 12 CYS H H -0.109 6.749 2.045 1.00 . A A . 12 CYS H 1 1 12 10096 1 1 12 CYS HA H -0.424 3.960 2.053 1.00 . A A . 12 CYS HA 1 1 12 10097 1 1 12 CYS HB2 H 0.923 5.868 3.945 1.00 . A A . 12 CYS HB2 1 1 12 10098 1 1 12 CYS HB3 H 0.926 4.130 4.225 1.00 . A A . 12 CYS HB3 1 1 12 10099 1 1 12 CYS HG H 3.191 5.649 2.765 1.00 . A A . 12 CYS HG 1 1 12 10100 1 1 12 CYS N N -0.743 5.999 1.992 1.00 . A A . 12 CYS N 1 1 12 10101 1 1 12 CYS O O -2.059 5.414 4.428 1.00 . A A . 12 CYS O 1 1 12 10102 1 1 12 CYS SG S 2.296 4.730 2.396 1.00 . A A . 12 CYS SG 1 1 12 10103 1 1 13 ARG C C -2.408 2.913 6.312 1.00 . A A . 13 ARG C 1 1 12 10104 1 1 13 ARG CA C -2.944 2.847 4.880 1.00 . A A . 13 ARG CA 1 1 12 10105 1 1 13 ARG CB C -3.454 1.439 4.576 1.00 . A A . 13 ARG CB 1 1 12 10106 1 1 13 ARG CD C -5.455 0.026 3.979 1.00 . A A . 13 ARG CD 1 1 12 10107 1 1 13 ARG CG C -4.853 1.421 3.984 1.00 . A A . 13 ARG CG 1 1 12 10108 1 1 13 ARG CZ C -7.309 0.147 2.354 1.00 . A A . 13 ARG CZ 1 1 12 10109 1 1 13 ARG H H -1.501 2.553 3.351 1.00 . A A . 13 ARG H 1 1 12 10110 1 1 13 ARG HA H -3.765 3.542 4.789 1.00 . A A . 13 ARG HA 1 1 12 10111 1 1 13 ARG HB2 H -2.782 0.966 3.875 1.00 . A A . 13 ARG HB2 1 1 12 10112 1 1 13 ARG HB3 H -3.465 0.864 5.493 1.00 . A A . 13 ARG HB3 1 1 12 10113 1 1 13 ARG HD2 H -4.670 -0.695 4.157 1.00 . A A . 13 ARG HD2 1 1 12 10114 1 1 13 ARG HD3 H -6.193 -0.040 4.764 1.00 . A A . 13 ARG HD3 1 1 12 10115 1 1 13 ARG HE H -5.558 -0.787 2.039 1.00 . A A . 13 ARG HE 1 1 12 10116 1 1 13 ARG HG2 H -5.488 2.073 4.565 1.00 . A A . 13 ARG HG2 1 1 12 10117 1 1 13 ARG HG3 H -4.804 1.781 2.968 1.00 . A A . 13 ARG HG3 1 1 12 10118 1 1 13 ARG HH11 H -7.794 0.851 4.199 1.00 . A A . 13 ARG HH11 1 1 12 10119 1 1 13 ARG HH12 H -9.008 1.061 2.971 1.00 . A A . 13 ARG HH12 1 1 12 10120 1 1 13 ARG HH21 H -7.163 -0.488 0.435 1.00 . A A . 13 ARG HH21 1 1 12 10121 1 1 13 ARG HH22 H -8.666 0.284 0.856 1.00 . A A . 13 ARG HH22 1 1 12 10122 1 1 13 ARG N N -1.922 3.239 3.915 1.00 . A A . 13 ARG N 1 1 12 10123 1 1 13 ARG NE N -6.092 -0.275 2.698 1.00 . A A . 13 ARG NE 1 1 12 10124 1 1 13 ARG NH1 N -8.102 0.729 3.246 1.00 . A A . 13 ARG NH1 1 1 12 10125 1 1 13 ARG NH2 N -7.747 -0.037 1.118 1.00 . A A . 13 ARG NH2 1 1 12 10126 1 1 13 ARG O O -3.177 3.067 7.260 1.00 . A A . 13 ARG O 1 1 12 10127 1 1 14 VAL C C 0.224 4.150 8.043 1.00 . A A . 14 VAL C 1 1 12 10128 1 1 14 VAL CA C -0.466 2.810 7.788 1.00 . A A . 14 VAL CA 1 1 12 10129 1 1 14 VAL CB C 0.582 1.684 7.931 1.00 . A A . 14 VAL CB 1 1 12 10130 1 1 14 VAL CG1 C 0.661 1.210 9.372 1.00 . A A . 14 VAL CG1 1 1 12 10131 1 1 14 VAL CG2 C 0.282 0.522 6.989 1.00 . A A . 14 VAL CG2 1 1 12 10132 1 1 14 VAL H H -0.531 2.667 5.674 1.00 . A A . 14 VAL H 1 1 12 10133 1 1 14 VAL HA H -1.235 2.660 8.530 1.00 . A A . 14 VAL HA 1 1 12 10134 1 1 14 VAL HB H 1.547 2.091 7.663 1.00 . A A . 14 VAL HB 1 1 12 10135 1 1 14 VAL HG11 H 1.323 1.858 9.928 1.00 . A A . 14 VAL HG11 1 1 12 10136 1 1 14 VAL HG12 H -0.324 1.238 9.815 1.00 . A A . 14 VAL HG12 1 1 12 10137 1 1 14 VAL HG13 H 1.037 0.199 9.397 1.00 . A A . 14 VAL HG13 1 1 12 10138 1 1 14 VAL HG21 H -0.552 -0.049 7.372 1.00 . A A . 14 VAL HG21 1 1 12 10139 1 1 14 VAL HG22 H 0.037 0.905 6.010 1.00 . A A . 14 VAL HG22 1 1 12 10140 1 1 14 VAL HG23 H 1.151 -0.117 6.917 1.00 . A A . 14 VAL HG23 1 1 12 10141 1 1 14 VAL N N -1.093 2.790 6.464 1.00 . A A . 14 VAL N 1 1 12 10142 1 1 14 VAL O O -0.201 4.940 8.884 1.00 . A A . 14 VAL O 1 1 12 10143 1 1 15 CYS C C 1.439 6.819 6.664 1.00 . A A . 15 CYS C 1 1 12 10144 1 1 15 CYS CA C 2.078 5.607 7.347 1.00 . A A . 15 CYS CA 1 1 12 10145 1 1 15 CYS CB C 3.450 5.240 6.786 1.00 . A A . 15 CYS CB 1 1 12 10146 1 1 15 CYS H H 1.565 3.691 6.652 1.00 . A A . 15 CYS H 1 1 12 10147 1 1 15 CYS HA H 2.206 5.846 8.389 1.00 . A A . 15 CYS HA 1 1 12 10148 1 1 15 CYS HB2 H 3.763 5.993 6.081 1.00 . A A . 15 CYS HB2 1 1 12 10149 1 1 15 CYS HB3 H 4.166 5.172 7.591 1.00 . A A . 15 CYS HB3 1 1 12 10150 1 1 15 CYS N N 1.275 4.390 7.278 1.00 . A A . 15 CYS N 1 1 12 10151 1 1 15 CYS O O 1.896 7.944 6.863 1.00 . A A . 15 CYS O 1 1 12 10152 1 1 15 CYS SG S 3.397 3.626 5.932 1.00 . A A . 15 CYS SG 1 1 12 10153 1 1 16 LYS C C 0.129 8.734 4.772 1.00 . A A . 16 LYS C 1 1 12 10154 1 1 16 LYS CA C -0.616 7.677 5.587 1.00 . A A . 16 LYS CA 1 1 12 10155 1 1 16 LYS CB C -1.350 8.342 6.754 1.00 . A A . 16 LYS CB 1 1 12 10156 1 1 16 LYS CD C -2.525 7.546 8.820 1.00 . A A . 16 LYS CD 1 1 12 10157 1 1 16 LYS CE C -3.193 6.310 9.395 1.00 . A A . 16 LYS CE 1 1 12 10158 1 1 16 LYS CG C -2.498 7.511 7.304 1.00 . A A . 16 LYS CG 1 1 12 10159 1 1 16 LYS H H -0.115 5.698 6.140 1.00 . A A . 16 LYS H 1 1 12 10160 1 1 16 LYS HA H -1.351 7.218 4.945 1.00 . A A . 16 LYS HA 1 1 12 10161 1 1 16 LYS HB2 H -0.645 8.516 7.554 1.00 . A A . 16 LYS HB2 1 1 12 10162 1 1 16 LYS HB3 H -1.746 9.290 6.423 1.00 . A A . 16 LYS HB3 1 1 12 10163 1 1 16 LYS HD2 H -1.512 7.599 9.187 1.00 . A A . 16 LYS HD2 1 1 12 10164 1 1 16 LYS HD3 H -3.073 8.422 9.141 1.00 . A A . 16 LYS HD3 1 1 12 10165 1 1 16 LYS HE2 H -3.572 5.710 8.581 1.00 . A A . 16 LYS HE2 1 1 12 10166 1 1 16 LYS HE3 H -2.457 5.743 9.948 1.00 . A A . 16 LYS HE3 1 1 12 10167 1 1 16 LYS HG2 H -3.430 7.907 6.927 1.00 . A A . 16 LYS HG2 1 1 12 10168 1 1 16 LYS HG3 H -2.379 6.489 6.977 1.00 . A A . 16 LYS HG3 1 1 12 10169 1 1 16 LYS HZ1 H -5.207 6.723 9.760 1.00 . A A . 16 LYS HZ1 1 1 12 10170 1 1 16 LYS HZ2 H -4.136 7.581 10.761 1.00 . A A . 16 LYS HZ2 1 1 12 10171 1 1 16 LYS HZ3 H -4.425 5.933 11.041 1.00 . A A . 16 LYS HZ3 1 1 12 10172 1 1 16 LYS N N 0.256 6.600 6.087 1.00 . A A . 16 LYS N 1 1 12 10173 1 1 16 LYS NZ N -4.316 6.661 10.302 1.00 . A A . 16 LYS NZ 1 1 12 10174 1 1 16 LYS O O -0.301 9.885 4.696 1.00 . A A . 16 LYS O 1 1 12 10175 1 1 17 ASP C C 1.645 9.206 1.921 1.00 . A A . 17 ASP C 1 1 12 10176 1 1 17 ASP CA C 2.036 9.276 3.388 1.00 . A A . 17 ASP CA 1 1 12 10177 1 1 17 ASP CB C 3.523 8.966 3.542 1.00 . A A . 17 ASP CB 1 1 12 10178 1 1 17 ASP CG C 3.862 7.563 3.106 1.00 . A A . 17 ASP CG 1 1 12 10179 1 1 17 ASP H H 1.556 7.428 4.288 1.00 . A A . 17 ASP H 1 1 12 10180 1 1 17 ASP HA H 1.844 10.273 3.753 1.00 . A A . 17 ASP HA 1 1 12 10181 1 1 17 ASP HB2 H 4.091 9.650 2.936 1.00 . A A . 17 ASP HB2 1 1 12 10182 1 1 17 ASP HB3 H 3.806 9.082 4.578 1.00 . A A . 17 ASP HB3 1 1 12 10183 1 1 17 ASP N N 1.240 8.350 4.172 1.00 . A A . 17 ASP N 1 1 12 10184 1 1 17 ASP O O 1.048 8.223 1.473 1.00 . A A . 17 ASP O 1 1 12 10185 1 1 17 ASP OD1 O 3.591 6.616 3.874 1.00 . A A . 17 ASP OD1 1 1 12 10186 1 1 17 ASP OD2 O 4.398 7.394 1.994 1.00 . A A . 17 ASP OD2 1 1 12 10187 1 1 18 GLY C C 2.858 10.553 -1.082 1.00 . A A . 18 GLY C 1 1 12 10188 1 1 18 GLY CA C 1.641 10.307 -0.220 1.00 . A A . 18 GLY CA 1 1 12 10189 1 1 18 GLY H H 2.447 11.006 1.601 1.00 . A A . 18 GLY H 1 1 12 10190 1 1 18 GLY HA2 H 1.190 9.368 -0.511 1.00 . A A . 18 GLY HA2 1 1 12 10191 1 1 18 GLY HA3 H 0.929 11.105 -0.380 1.00 . A A . 18 GLY HA3 1 1 12 10192 1 1 18 GLY N N 1.974 10.252 1.184 1.00 . A A . 18 GLY N 1 1 12 10193 1 1 18 GLY O O 2.775 11.240 -2.102 1.00 . A A . 18 GLY O 1 1 12 10194 1 1 19 GLY C C 5.312 9.121 -2.554 1.00 . A A . 19 GLY C 1 1 12 10195 1 1 19 GLY CA C 5.210 10.137 -1.438 1.00 . A A . 19 GLY CA 1 1 12 10196 1 1 19 GLY H H 3.981 9.440 0.138 1.00 . A A . 19 GLY H 1 1 12 10197 1 1 19 GLY HA2 H 5.238 11.130 -1.861 1.00 . A A . 19 GLY HA2 1 1 12 10198 1 1 19 GLY HA3 H 6.053 10.012 -0.772 1.00 . A A . 19 GLY HA3 1 1 12 10199 1 1 19 GLY N N 3.984 9.983 -0.677 1.00 . A A . 19 GLY N 1 1 12 10200 1 1 19 GLY O O 4.466 9.088 -3.448 1.00 . A A . 19 GLY O 1 1 12 10201 1 1 20 GLU C C 5.343 6.126 -3.177 1.00 . A A . 20 GLU C 1 1 12 10202 1 1 20 GLU CA C 6.445 7.149 -3.409 1.00 . A A . 20 GLU CA 1 1 12 10203 1 1 20 GLU CB C 7.818 6.493 -3.253 1.00 . A A . 20 GLU CB 1 1 12 10204 1 1 20 GLU CD C 8.761 8.407 -4.599 1.00 . A A . 20 GLU CD 1 1 12 10205 1 1 20 GLU CG C 8.831 6.927 -4.298 1.00 . A A . 20 GLU CG 1 1 12 10206 1 1 20 GLU H H 6.895 8.282 -1.681 1.00 . A A . 20 GLU H 1 1 12 10207 1 1 20 GLU HA H 6.351 7.556 -4.405 1.00 . A A . 20 GLU HA 1 1 12 10208 1 1 20 GLU HB2 H 8.212 6.740 -2.278 1.00 . A A . 20 GLU HB2 1 1 12 10209 1 1 20 GLU HB3 H 7.699 5.421 -3.322 1.00 . A A . 20 GLU HB3 1 1 12 10210 1 1 20 GLU HG2 H 9.823 6.694 -3.940 1.00 . A A . 20 GLU HG2 1 1 12 10211 1 1 20 GLU HG3 H 8.644 6.381 -5.210 1.00 . A A . 20 GLU HG3 1 1 12 10212 1 1 20 GLU N N 6.294 8.240 -2.454 1.00 . A A . 20 GLU N 1 1 12 10213 1 1 20 GLU O O 5.294 5.489 -2.122 1.00 . A A . 20 GLU O 1 1 12 10214 1 1 20 GLU OE1 O 9.161 9.217 -3.734 1.00 . A A . 20 GLU OE1 1 1 12 10215 1 1 20 GLU OE2 O 8.314 8.773 -5.708 1.00 . A A . 20 GLU OE2 1 1 12 10216 1 1 21 LEU C C 3.128 4.077 -4.728 1.00 . A A . 21 LEU C 1 1 12 10217 1 1 21 LEU CA C 3.166 5.318 -3.847 1.00 . A A . 21 LEU CA 1 1 12 10218 1 1 21 LEU CB C 1.921 6.176 -4.088 1.00 . A A . 21 LEU CB 1 1 12 10219 1 1 21 LEU CD1 C 1.988 6.376 -1.561 1.00 . A A . 21 LEU CD1 1 1 12 10220 1 1 21 LEU CD2 C 0.953 8.181 -2.942 1.00 . A A . 21 LEU CD2 1 1 12 10221 1 1 21 LEU CG C 1.204 6.690 -2.829 1.00 . A A . 21 LEU CG 1 1 12 10222 1 1 21 LEU H H 4.395 6.735 -4.825 1.00 . A A . 21 LEU H 1 1 12 10223 1 1 21 LEU HA H 3.169 5.002 -2.816 1.00 . A A . 21 LEU HA 1 1 12 10224 1 1 21 LEU HB2 H 2.212 7.030 -4.682 1.00 . A A . 21 LEU HB2 1 1 12 10225 1 1 21 LEU HB3 H 1.216 5.590 -4.660 1.00 . A A . 21 LEU HB3 1 1 12 10226 1 1 21 LEU HD11 H 1.376 5.785 -0.894 1.00 . A A . 21 LEU HD11 1 1 12 10227 1 1 21 LEU HD12 H 2.879 5.821 -1.815 1.00 . A A . 21 LEU HD12 1 1 12 10228 1 1 21 LEU HD13 H 2.265 7.298 -1.073 1.00 . A A . 21 LEU HD13 1 1 12 10229 1 1 21 LEU HD21 H 0.638 8.564 -1.983 1.00 . A A . 21 LEU HD21 1 1 12 10230 1 1 21 LEU HD22 H 1.861 8.678 -3.248 1.00 . A A . 21 LEU HD22 1 1 12 10231 1 1 21 LEU HD23 H 0.179 8.363 -3.674 1.00 . A A . 21 LEU HD23 1 1 12 10232 1 1 21 LEU HG H 0.246 6.198 -2.752 1.00 . A A . 21 LEU HG 1 1 12 10233 1 1 21 LEU N N 4.364 6.110 -4.068 1.00 . A A . 21 LEU N 1 1 12 10234 1 1 21 LEU O O 2.772 4.137 -5.903 1.00 . A A . 21 LEU O 1 1 12 10235 1 1 22 LEU C C 1.937 1.008 -4.320 1.00 . A A . 22 LEU C 1 1 12 10236 1 1 22 LEU CA C 3.256 1.646 -4.752 1.00 . A A . 22 LEU CA 1 1 12 10237 1 1 22 LEU CB C 4.455 0.764 -4.380 1.00 . A A . 22 LEU CB 1 1 12 10238 1 1 22 LEU CD1 C 4.602 -1.089 -6.066 1.00 . A A . 22 LEU CD1 1 1 12 10239 1 1 22 LEU CD2 C 5.176 -1.520 -3.674 1.00 . A A . 22 LEU CD2 1 1 12 10240 1 1 22 LEU CG C 4.285 -0.737 -4.622 1.00 . A A . 22 LEU CG 1 1 12 10241 1 1 22 LEU H H 3.574 2.966 -3.136 1.00 . A A . 22 LEU H 1 1 12 10242 1 1 22 LEU HA H 3.241 1.804 -5.819 1.00 . A A . 22 LEU HA 1 1 12 10243 1 1 22 LEU HB2 H 5.311 1.099 -4.948 1.00 . A A . 22 LEU HB2 1 1 12 10244 1 1 22 LEU HB3 H 4.667 0.912 -3.330 1.00 . A A . 22 LEU HB3 1 1 12 10245 1 1 22 LEU HD11 H 5.602 -0.761 -6.306 1.00 . A A . 22 LEU HD11 1 1 12 10246 1 1 22 LEU HD12 H 4.531 -2.157 -6.198 1.00 . A A . 22 LEU HD12 1 1 12 10247 1 1 22 LEU HD13 H 3.895 -0.596 -6.719 1.00 . A A . 22 LEU HD13 1 1 12 10248 1 1 22 LEU HD21 H 4.619 -1.774 -2.785 1.00 . A A . 22 LEU HD21 1 1 12 10249 1 1 22 LEU HD22 H 5.512 -2.423 -4.160 1.00 . A A . 22 LEU HD22 1 1 12 10250 1 1 22 LEU HD23 H 6.031 -0.918 -3.404 1.00 . A A . 22 LEU HD23 1 1 12 10251 1 1 22 LEU HG H 3.260 -1.015 -4.426 1.00 . A A . 22 LEU HG 1 1 12 10252 1 1 22 LEU N N 3.382 2.940 -4.104 1.00 . A A . 22 LEU N 1 1 12 10253 1 1 22 LEU O O 1.658 0.910 -3.127 1.00 . A A . 22 LEU O 1 1 12 10254 1 1 23 CYS C C -0.653 -0.987 -5.419 1.00 . A A . 23 CYS C 1 1 12 10255 1 1 23 CYS CA C -0.330 0.433 -4.960 1.00 . A A . 23 CYS CA 1 1 12 10256 1 1 23 CYS CB C -1.288 1.420 -5.631 1.00 . A A . 23 CYS CB 1 1 12 10257 1 1 23 CYS H H 1.263 1.075 -6.197 1.00 . A A . 23 CYS H 1 1 12 10258 1 1 23 CYS HA H -0.457 0.493 -3.892 1.00 . A A . 23 CYS HA 1 1 12 10259 1 1 23 CYS HB2 H -1.539 1.052 -6.614 1.00 . A A . 23 CYS HB2 1 1 12 10260 1 1 23 CYS HB3 H -2.189 1.494 -5.040 1.00 . A A . 23 CYS HB3 1 1 12 10261 1 1 23 CYS HG H -1.329 3.906 -5.057 1.00 . A A . 23 CYS HG 1 1 12 10262 1 1 23 CYS N N 1.042 0.812 -5.275 1.00 . A A . 23 CYS N 1 1 12 10263 1 1 23 CYS O O -0.150 -1.444 -6.452 1.00 . A A . 23 CYS O 1 1 12 10264 1 1 23 CYS SG S -0.619 3.092 -5.828 1.00 . A A . 23 CYS SG 1 1 12 10265 1 1 24 CYS C C -2.989 -2.865 -6.271 1.00 . A A . 24 CYS C 1 1 12 10266 1 1 24 CYS CA C -2.027 -2.969 -5.088 1.00 . A A . 24 CYS CA 1 1 12 10267 1 1 24 CYS CB C -2.727 -3.638 -3.903 1.00 . A A . 24 CYS CB 1 1 12 10268 1 1 24 CYS H H -1.960 -1.221 -3.911 1.00 . A A . 24 CYS H 1 1 12 10269 1 1 24 CYS HA H -1.172 -3.563 -5.377 1.00 . A A . 24 CYS HA 1 1 12 10270 1 1 24 CYS HB2 H -3.725 -3.921 -4.196 1.00 . A A . 24 CYS HB2 1 1 12 10271 1 1 24 CYS HB3 H -2.175 -4.521 -3.621 1.00 . A A . 24 CYS HB3 1 1 12 10272 1 1 24 CYS N N -1.558 -1.651 -4.700 1.00 . A A . 24 CYS N 1 1 12 10273 1 1 24 CYS O O -3.444 -1.774 -6.619 1.00 . A A . 24 CYS O 1 1 12 10274 1 1 24 CYS SG S -2.860 -2.574 -2.426 1.00 . A A . 24 CYS SG 1 1 12 10275 1 1 25 ASP C C -5.623 -4.349 -7.568 1.00 . A A . 25 ASP C 1 1 12 10276 1 1 25 ASP CA C -4.210 -4.017 -8.024 1.00 . A A . 25 ASP CA 1 1 12 10277 1 1 25 ASP CB C -3.757 -5.039 -9.067 1.00 . A A . 25 ASP CB 1 1 12 10278 1 1 25 ASP CG C -4.038 -4.577 -10.485 1.00 . A A . 25 ASP CG 1 1 12 10279 1 1 25 ASP H H -2.894 -4.835 -6.576 1.00 . A A . 25 ASP H 1 1 12 10280 1 1 25 ASP HA H -4.209 -3.035 -8.470 1.00 . A A . 25 ASP HA 1 1 12 10281 1 1 25 ASP HB2 H -2.697 -5.206 -8.963 1.00 . A A . 25 ASP HB2 1 1 12 10282 1 1 25 ASP HB3 H -4.281 -5.969 -8.902 1.00 . A A . 25 ASP HB3 1 1 12 10283 1 1 25 ASP N N -3.293 -3.997 -6.888 1.00 . A A . 25 ASP N 1 1 12 10284 1 1 25 ASP O O -6.601 -4.035 -8.247 1.00 . A A . 25 ASP O 1 1 12 10285 1 1 25 ASP OD1 O -3.925 -3.363 -10.752 1.00 . A A . 25 ASP OD1 1 1 12 10286 1 1 25 ASP OD2 O -4.356 -5.425 -11.345 1.00 . A A . 25 ASP OD2 1 1 12 10287 1 1 26 THR C C -7.707 -4.312 -5.176 1.00 . A A . 26 THR C 1 1 12 10288 1 1 26 THR CA C -7.003 -5.446 -5.907 1.00 . A A . 26 THR CA 1 1 12 10289 1 1 26 THR CB C -6.824 -6.626 -4.939 1.00 . A A . 26 THR CB 1 1 12 10290 1 1 26 THR CG2 C -6.584 -7.917 -5.709 1.00 . A A . 26 THR CG2 1 1 12 10291 1 1 26 THR H H -4.904 -5.263 -5.947 1.00 . A A . 26 THR H 1 1 12 10292 1 1 26 THR HA H -7.617 -5.771 -6.733 1.00 . A A . 26 THR HA 1 1 12 10293 1 1 26 THR HB H -7.722 -6.733 -4.349 1.00 . A A . 26 THR HB 1 1 12 10294 1 1 26 THR HG1 H -5.938 -5.637 -3.468 1.00 . A A . 26 THR HG1 1 1 12 10295 1 1 26 THR HG21 H -5.958 -8.574 -5.123 1.00 . A A . 26 THR HG21 1 1 12 10296 1 1 26 THR HG22 H -6.093 -7.691 -6.646 1.00 . A A . 26 THR HG22 1 1 12 10297 1 1 26 THR HG23 H -7.528 -8.400 -5.905 1.00 . A A . 26 THR HG23 1 1 12 10298 1 1 26 THR N N -5.720 -5.018 -6.432 1.00 . A A . 26 THR N 1 1 12 10299 1 1 26 THR O O -8.934 -4.215 -5.189 1.00 . A A . 26 THR O 1 1 12 10300 1 1 26 THR OG1 O -5.714 -6.368 -4.067 1.00 . A A . 26 THR OG1 1 1 12 10301 1 1 27 CYS C C -6.982 -1.069 -4.138 1.00 . A A . 27 CYS C 1 1 12 10302 1 1 27 CYS CA C -7.478 -2.435 -3.666 1.00 . A A . 27 CYS CA 1 1 12 10303 1 1 27 CYS CB C -7.086 -2.679 -2.211 1.00 . A A . 27 CYS CB 1 1 12 10304 1 1 27 CYS H H -5.961 -3.651 -4.476 1.00 . A A . 27 CYS H 1 1 12 10305 1 1 27 CYS HA H -8.555 -2.469 -3.754 1.00 . A A . 27 CYS HA 1 1 12 10306 1 1 27 CYS HB2 H -6.463 -1.863 -1.869 1.00 . A A . 27 CYS HB2 1 1 12 10307 1 1 27 CYS HB3 H -7.978 -2.724 -1.604 1.00 . A A . 27 CYS HB3 1 1 12 10308 1 1 27 CYS N N -6.928 -3.499 -4.482 1.00 . A A . 27 CYS N 1 1 12 10309 1 1 27 CYS O O -5.881 -0.951 -4.672 1.00 . A A . 27 CYS O 1 1 12 10310 1 1 27 CYS SG S -6.164 -4.232 -1.957 1.00 . A A . 27 CYS SG 1 1 12 10311 1 1 28 PRO C C -6.596 2.066 -3.343 1.00 . A A . 28 PRO C 1 1 12 10312 1 1 28 PRO CA C -7.458 1.338 -4.380 1.00 . A A . 28 PRO CA 1 1 12 10313 1 1 28 PRO CB C -8.828 2.007 -4.511 1.00 . A A . 28 PRO CB 1 1 12 10314 1 1 28 PRO CD C -9.158 -0.090 -3.385 1.00 . A A . 28 PRO CD 1 1 12 10315 1 1 28 PRO CG C -9.671 1.325 -3.489 1.00 . A A . 28 PRO CG 1 1 12 10316 1 1 28 PRO HA H -6.956 1.347 -5.336 1.00 . A A . 28 PRO HA 1 1 12 10317 1 1 28 PRO HB2 H -8.738 3.065 -4.310 1.00 . A A . 28 PRO HB2 1 1 12 10318 1 1 28 PRO HB3 H -9.215 1.855 -5.507 1.00 . A A . 28 PRO HB3 1 1 12 10319 1 1 28 PRO HD2 H -9.116 -0.397 -2.350 1.00 . A A . 28 PRO HD2 1 1 12 10320 1 1 28 PRO HD3 H -9.789 -0.762 -3.952 1.00 . A A . 28 PRO HD3 1 1 12 10321 1 1 28 PRO HG2 H -9.572 1.829 -2.541 1.00 . A A . 28 PRO HG2 1 1 12 10322 1 1 28 PRO HG3 H -10.704 1.325 -3.806 1.00 . A A . 28 PRO HG3 1 1 12 10323 1 1 28 PRO N N -7.804 -0.023 -3.967 1.00 . A A . 28 PRO N 1 1 12 10324 1 1 28 PRO O O -6.718 3.276 -3.155 1.00 . A A . 28 PRO O 1 1 12 10325 1 1 29 SER C C -3.424 2.032 -2.233 1.00 . A A . 29 SER C 1 1 12 10326 1 1 29 SER CA C -4.835 1.889 -1.682 1.00 . A A . 29 SER CA 1 1 12 10327 1 1 29 SER CB C -4.823 0.996 -0.443 1.00 . A A . 29 SER CB 1 1 12 10328 1 1 29 SER H H -5.651 0.364 -2.891 1.00 . A A . 29 SER H 1 1 12 10329 1 1 29 SER HA H -5.212 2.864 -1.415 1.00 . A A . 29 SER HA 1 1 12 10330 1 1 29 SER HB2 H -3.813 0.662 -0.251 1.00 . A A . 29 SER HB2 1 1 12 10331 1 1 29 SER HB3 H -5.185 1.555 0.407 1.00 . A A . 29 SER HB3 1 1 12 10332 1 1 29 SER HG H -5.207 -0.920 -0.270 1.00 . A A . 29 SER HG 1 1 12 10333 1 1 29 SER N N -5.718 1.323 -2.686 1.00 . A A . 29 SER N 1 1 12 10334 1 1 29 SER O O -3.090 1.438 -3.256 1.00 . A A . 29 SER O 1 1 12 10335 1 1 29 SER OG O -5.652 -0.138 -0.633 1.00 . A A . 29 SER OG 1 1 12 10336 1 1 30 SER C C -0.286 2.898 -0.769 1.00 . A A . 30 SER C 1 1 12 10337 1 1 30 SER CA C -1.223 3.024 -1.966 1.00 . A A . 30 SER CA 1 1 12 10338 1 1 30 SER CB C -1.073 4.395 -2.621 1.00 . A A . 30 SER CB 1 1 12 10339 1 1 30 SER H H -2.927 3.272 -0.745 1.00 . A A . 30 SER H 1 1 12 10340 1 1 30 SER HA H -0.975 2.259 -2.684 1.00 . A A . 30 SER HA 1 1 12 10341 1 1 30 SER HB2 H -0.897 5.139 -1.857 1.00 . A A . 30 SER HB2 1 1 12 10342 1 1 30 SER HB3 H -0.237 4.375 -3.303 1.00 . A A . 30 SER HB3 1 1 12 10343 1 1 30 SER HG H -3.020 4.468 -2.846 1.00 . A A . 30 SER HG 1 1 12 10344 1 1 30 SER N N -2.602 2.822 -1.553 1.00 . A A . 30 SER N 1 1 12 10345 1 1 30 SER O O -0.720 3.035 0.376 1.00 . A A . 30 SER O 1 1 12 10346 1 1 30 SER OG O -2.243 4.750 -3.341 1.00 . A A . 30 SER OG 1 1 12 10347 1 1 31 TYR C C 3.315 2.703 -0.309 1.00 . A A . 31 TYR C 1 1 12 10348 1 1 31 TYR CA C 1.902 2.228 0.050 1.00 . A A . 31 TYR CA 1 1 12 10349 1 1 31 TYR CB C 1.945 0.718 0.336 1.00 . A A . 31 TYR CB 1 1 12 10350 1 1 31 TYR CD1 C -0.364 -0.306 0.287 1.00 . A A . 31 TYR CD1 1 1 12 10351 1 1 31 TYR CD2 C 0.642 0.081 2.413 1.00 . A A . 31 TYR CD2 1 1 12 10352 1 1 31 TYR CE1 C -1.483 -0.828 0.907 1.00 . A A . 31 TYR CE1 1 1 12 10353 1 1 31 TYR CE2 C -0.472 -0.442 3.039 1.00 . A A . 31 TYR CE2 1 1 12 10354 1 1 31 TYR CG C 0.715 0.162 1.026 1.00 . A A . 31 TYR CG 1 1 12 10355 1 1 31 TYR CZ C -1.531 -0.896 2.283 1.00 . A A . 31 TYR CZ 1 1 12 10356 1 1 31 TYR H H 1.210 2.281 -1.949 1.00 . A A . 31 TYR H 1 1 12 10357 1 1 31 TYR HA H 1.568 2.748 0.936 1.00 . A A . 31 TYR HA 1 1 12 10358 1 1 31 TYR HB2 H 2.059 0.191 -0.599 1.00 . A A . 31 TYR HB2 1 1 12 10359 1 1 31 TYR HB3 H 2.798 0.507 0.962 1.00 . A A . 31 TYR HB3 1 1 12 10360 1 1 31 TYR HD1 H -0.321 -0.254 -0.792 1.00 . A A . 31 TYR HD1 1 1 12 10361 1 1 31 TYR HD2 H 1.472 0.439 3.005 1.00 . A A . 31 TYR HD2 1 1 12 10362 1 1 31 TYR HE1 H -2.312 -1.184 0.314 1.00 . A A . 31 TYR HE1 1 1 12 10363 1 1 31 TYR HE2 H -0.506 -0.503 4.117 1.00 . A A . 31 TYR HE2 1 1 12 10364 1 1 31 TYR HH H -3.251 -1.775 2.245 1.00 . A A . 31 TYR HH 1 1 12 10365 1 1 31 TYR N N 0.955 2.501 -1.023 1.00 . A A . 31 TYR N 1 1 12 10366 1 1 31 TYR O O 3.586 3.081 -1.446 1.00 . A A . 31 TYR O 1 1 12 10367 1 1 31 TYR OH O -2.642 -1.412 2.910 1.00 . A A . 31 TYR OH 1 1 12 10368 1 1 32 HIS C C 6.065 1.192 -0.322 1.00 . A A . 32 HIS C 1 1 12 10369 1 1 32 HIS CA C 5.669 2.498 0.362 1.00 . A A . 32 HIS CA 1 1 12 10370 1 1 32 HIS CB C 6.444 2.572 1.702 1.00 . A A . 32 HIS CB 1 1 12 10371 1 1 32 HIS CD2 C 7.725 4.730 2.295 1.00 . A A . 32 HIS CD2 1 1 12 10372 1 1 32 HIS CE1 C 6.268 5.538 3.707 1.00 . A A . 32 HIS CE1 1 1 12 10373 1 1 32 HIS CG C 6.636 3.923 2.326 1.00 . A A . 32 HIS CG 1 1 12 10374 1 1 32 HIS H H 3.941 1.913 1.400 1.00 . A A . 32 HIS H 1 1 12 10375 1 1 32 HIS HA H 5.894 3.346 -0.265 1.00 . A A . 32 HIS HA 1 1 12 10376 1 1 32 HIS HB2 H 5.924 1.967 2.426 1.00 . A A . 32 HIS HB2 1 1 12 10377 1 1 32 HIS HB3 H 7.425 2.148 1.550 1.00 . A A . 32 HIS HB3 1 1 12 10378 1 1 32 HIS HD2 H 8.609 4.601 1.686 1.00 . A A . 32 HIS HD2 1 1 12 10379 1 1 32 HIS HE1 H 5.798 6.174 4.442 1.00 . A A . 32 HIS HE1 1 1 12 10380 1 1 32 HIS HE2 H 8.152 6.414 3.492 1.00 . A A . 32 HIS HE2 1 1 12 10381 1 1 32 HIS N N 4.234 2.418 0.607 1.00 . A A . 32 HIS N 1 1 12 10382 1 1 32 HIS ND1 N 5.722 4.445 3.210 1.00 . A A . 32 HIS ND1 1 1 12 10383 1 1 32 HIS NE2 N 7.488 5.753 3.180 1.00 . A A . 32 HIS NE2 1 1 12 10384 1 1 32 HIS O O 5.213 0.501 -0.880 1.00 . A A . 32 HIS O 1 1 12 10385 1 1 33 ILE C C 7.894 -1.425 0.967 1.00 . A A . 33 ILE C 1 1 12 10386 1 1 33 ILE CA C 7.628 -0.648 -0.323 1.00 . A A . 33 ILE CA 1 1 12 10387 1 1 33 ILE CB C 8.876 -0.700 -1.233 1.00 . A A . 33 ILE CB 1 1 12 10388 1 1 33 ILE CD1 C 11.405 -0.489 -1.010 1.00 . A A . 33 ILE CD1 1 1 12 10389 1 1 33 ILE CG1 C 10.050 0.040 -0.587 1.00 . A A . 33 ILE CG1 1 1 12 10390 1 1 33 ILE CG2 C 8.557 -0.099 -2.593 1.00 . A A . 33 ILE CG2 1 1 12 10391 1 1 33 ILE H H 7.835 1.227 0.590 1.00 . A A . 33 ILE H 1 1 12 10392 1 1 33 ILE HA H 6.801 -1.108 -0.847 1.00 . A A . 33 ILE HA 1 1 12 10393 1 1 33 ILE HB H 9.147 -1.736 -1.379 1.00 . A A . 33 ILE HB 1 1 12 10394 1 1 33 ILE HD11 H 11.900 -0.938 -0.161 1.00 . A A . 33 ILE HD11 1 1 12 10395 1 1 33 ILE HD12 H 11.275 -1.230 -1.785 1.00 . A A . 33 ILE HD12 1 1 12 10396 1 1 33 ILE HD13 H 12.007 0.325 -1.387 1.00 . A A . 33 ILE HD13 1 1 12 10397 1 1 33 ILE HG12 H 10.003 1.084 -0.859 1.00 . A A . 33 ILE HG12 1 1 12 10398 1 1 33 ILE HG21 H 7.899 -0.762 -3.136 1.00 . A A . 33 ILE HG21 1 1 12 10399 1 1 33 ILE HG22 H 8.070 0.855 -2.455 1.00 . A A . 33 ILE HG22 1 1 12 10400 1 1 33 ILE HG23 H 9.471 0.038 -3.152 1.00 . A A . 33 ILE HG23 1 1 12 10401 1 1 33 ILE N N 7.255 0.713 -0.001 1.00 . A A . 33 ILE N 1 1 12 10402 1 1 33 ILE O O 8.521 -2.483 0.947 1.00 . A A . 33 ILE O 1 1 12 10403 1 1 34 HIS C C 6.868 -0.997 4.537 1.00 . A A . 34 HIS C 1 1 12 10404 1 1 34 HIS CA C 7.817 -1.438 3.410 1.00 . A A . 34 HIS CA 1 1 12 10405 1 1 34 HIS CB C 9.266 -1.095 3.804 1.00 . A A . 34 HIS CB 1 1 12 10406 1 1 34 HIS CD2 C 9.510 1.344 4.647 1.00 . A A . 34 HIS CD2 1 1 12 10407 1 1 34 HIS CE1 C 10.314 2.187 2.806 1.00 . A A . 34 HIS CE1 1 1 12 10408 1 1 34 HIS CG C 9.607 0.367 3.711 1.00 . A A . 34 HIS CG 1 1 12 10409 1 1 34 HIS H H 7.062 0.036 2.075 1.00 . A A . 34 HIS H 1 1 12 10410 1 1 34 HIS HA H 7.739 -2.509 3.300 1.00 . A A . 34 HIS HA 1 1 12 10411 1 1 34 HIS HB2 H 9.435 -1.408 4.825 1.00 . A A . 34 HIS HB2 1 1 12 10412 1 1 34 HIS HB3 H 9.941 -1.634 3.155 1.00 . A A . 34 HIS HB3 1 1 12 10413 1 1 34 HIS HD2 H 9.144 1.238 5.658 1.00 . A A . 34 HIS HD2 1 1 12 10414 1 1 34 HIS HE1 H 10.711 2.893 2.092 1.00 . A A . 34 HIS HE1 1 1 12 10415 1 1 34 HIS HE2 H 10.211 3.332 4.537 1.00 . A A . 34 HIS HE2 1 1 12 10416 1 1 34 HIS N N 7.495 -0.843 2.109 1.00 . A A . 34 HIS N 1 1 12 10417 1 1 34 HIS ND1 N 10.114 0.906 2.554 1.00 . A A . 34 HIS ND1 1 1 12 10418 1 1 34 HIS NE2 N 9.964 2.500 4.061 1.00 . A A . 34 HIS NE2 1 1 12 10419 1 1 34 HIS O O 7.243 -1.055 5.710 1.00 . A A . 34 HIS O 1 1 12 10420 1 1 35 CYS C C 4.181 -1.398 6.005 1.00 . A A . 35 CYS C 1 1 12 10421 1 1 35 CYS CA C 4.688 -0.189 5.236 1.00 . A A . 35 CYS CA 1 1 12 10422 1 1 35 CYS CB C 3.504 0.528 4.603 1.00 . A A . 35 CYS CB 1 1 12 10423 1 1 35 CYS H H 5.379 -0.556 3.265 1.00 . A A . 35 CYS H 1 1 12 10424 1 1 35 CYS HA H 5.185 0.481 5.919 1.00 . A A . 35 CYS HA 1 1 12 10425 1 1 35 CYS HB2 H 2.743 -0.196 4.355 1.00 . A A . 35 CYS HB2 1 1 12 10426 1 1 35 CYS HB3 H 3.103 1.239 5.309 1.00 . A A . 35 CYS HB3 1 1 12 10427 1 1 35 CYS N N 5.647 -0.584 4.206 1.00 . A A . 35 CYS N 1 1 12 10428 1 1 35 CYS O O 4.015 -1.353 7.225 1.00 . A A . 35 CYS O 1 1 12 10429 1 1 35 CYS SG S 3.926 1.426 3.088 1.00 . A A . 35 CYS SG 1 1 12 10430 1 1 36 LEU C C 4.405 -4.550 6.397 1.00 . A A . 36 LEU C 1 1 12 10431 1 1 36 LEU CA C 3.307 -3.656 5.836 1.00 . A A . 36 LEU CA 1 1 12 10432 1 1 36 LEU CB C 2.487 -4.423 4.791 1.00 . A A . 36 LEU CB 1 1 12 10433 1 1 36 LEU CD1 C 3.326 -5.181 2.551 1.00 . A A . 36 LEU CD1 1 1 12 10434 1 1 36 LEU CD2 C 1.422 -3.576 2.685 1.00 . A A . 36 LEU CD2 1 1 12 10435 1 1 36 LEU CG C 2.724 -4.024 3.329 1.00 . A A . 36 LEU CG 1 1 12 10436 1 1 36 LEU H H 3.989 -2.386 4.299 1.00 . A A . 36 LEU H 1 1 12 10437 1 1 36 LEU HA H 2.654 -3.363 6.644 1.00 . A A . 36 LEU HA 1 1 12 10438 1 1 36 LEU HB2 H 2.713 -5.474 4.892 1.00 . A A . 36 LEU HB2 1 1 12 10439 1 1 36 LEU HB3 H 1.440 -4.278 5.012 1.00 . A A . 36 LEU HB3 1 1 12 10440 1 1 36 LEU HD11 H 4.388 -5.228 2.739 1.00 . A A . 36 LEU HD11 1 1 12 10441 1 1 36 LEU HD12 H 2.862 -6.105 2.863 1.00 . A A . 36 LEU HD12 1 1 12 10442 1 1 36 LEU HD13 H 3.154 -5.031 1.495 1.00 . A A . 36 LEU HD13 1 1 12 10443 1 1 36 LEU HD21 H 1.216 -2.552 2.962 1.00 . A A . 36 LEU HD21 1 1 12 10444 1 1 36 LEU HD22 H 1.511 -3.649 1.611 1.00 . A A . 36 LEU HD22 1 1 12 10445 1 1 36 LEU HD23 H 0.617 -4.212 3.023 1.00 . A A . 36 LEU HD23 1 1 12 10446 1 1 36 LEU HG H 3.417 -3.201 3.291 1.00 . A A . 36 LEU HG 1 1 12 10447 1 1 36 LEU N N 3.870 -2.446 5.263 1.00 . A A . 36 LEU N 1 1 12 10448 1 1 36 LEU O O 5.594 -4.307 6.168 1.00 . A A . 36 LEU O 1 1 12 10449 1 1 37 ARG C C 5.915 -7.105 6.751 1.00 . A A . 37 ARG C 1 1 12 10450 1 1 37 ARG CA C 4.918 -6.514 7.764 1.00 . A A . 37 ARG CA 1 1 12 10451 1 1 37 ARG CB C 4.139 -7.627 8.477 1.00 . A A . 37 ARG CB 1 1 12 10452 1 1 37 ARG CD C 5.676 -7.862 10.452 1.00 . A A . 37 ARG CD 1 1 12 10453 1 1 37 ARG CG C 5.016 -8.570 9.279 1.00 . A A . 37 ARG CG 1 1 12 10454 1 1 37 ARG CZ C 8.003 -8.326 11.159 1.00 . A A . 37 ARG CZ 1 1 12 10455 1 1 37 ARG H H 3.027 -5.678 7.302 1.00 . A A . 37 ARG H 1 1 12 10456 1 1 37 ARG HA H 5.482 -5.965 8.505 1.00 . A A . 37 ARG HA 1 1 12 10457 1 1 37 ARG HB2 H 3.423 -7.176 9.149 1.00 . A A . 37 ARG HB2 1 1 12 10458 1 1 37 ARG HB3 H 3.606 -8.207 7.737 1.00 . A A . 37 ARG HB3 1 1 12 10459 1 1 37 ARG HD2 H 6.115 -6.941 10.100 1.00 . A A . 37 ARG HD2 1 1 12 10460 1 1 37 ARG HD3 H 4.922 -7.640 11.194 1.00 . A A . 37 ARG HD3 1 1 12 10461 1 1 37 ARG HE H 6.446 -9.574 11.406 1.00 . A A . 37 ARG HE 1 1 12 10462 1 1 37 ARG HG2 H 4.408 -9.378 9.657 1.00 . A A . 37 ARG HG2 1 1 12 10463 1 1 37 ARG HG3 H 5.785 -8.967 8.632 1.00 . A A . 37 ARG HG3 1 1 12 10464 1 1 37 ARG HH11 H 7.743 -6.488 10.325 1.00 . A A . 37 ARG HH11 1 1 12 10465 1 1 37 ARG HH12 H 9.370 -6.870 10.815 1.00 . A A . 37 ARG HH12 1 1 12 10466 1 1 37 ARG HH21 H 8.604 -10.059 12.029 1.00 . A A . 37 ARG HH21 1 1 12 10467 1 1 37 ARG HH22 H 9.854 -8.879 11.766 1.00 . A A . 37 ARG HH22 1 1 12 10468 1 1 37 ARG N N 3.994 -5.570 7.142 1.00 . A A . 37 ARG N 1 1 12 10469 1 1 37 ARG NE N 6.720 -8.686 11.063 1.00 . A A . 37 ARG NE 1 1 12 10470 1 1 37 ARG NH1 N 8.403 -7.135 10.731 1.00 . A A . 37 ARG NH1 1 1 12 10471 1 1 37 ARG NH2 N 8.889 -9.153 11.693 1.00 . A A . 37 ARG NH2 1 1 12 10472 1 1 37 ARG O O 7.124 -7.036 6.977 1.00 . A A . 37 ARG O 1 1 12 10473 1 1 38 PRO C C 7.010 -7.126 3.773 1.00 . A A . 38 PRO C 1 1 12 10474 1 1 38 PRO CA C 6.341 -8.233 4.591 1.00 . A A . 38 PRO CA 1 1 12 10475 1 1 38 PRO CB C 5.414 -9.076 3.701 1.00 . A A . 38 PRO CB 1 1 12 10476 1 1 38 PRO CD C 4.041 -7.866 5.239 1.00 . A A . 38 PRO CD 1 1 12 10477 1 1 38 PRO CG C 4.093 -9.104 4.398 1.00 . A A . 38 PRO CG 1 1 12 10478 1 1 38 PRO HA H 7.101 -8.863 5.028 1.00 . A A . 38 PRO HA 1 1 12 10479 1 1 38 PRO HB2 H 5.335 -8.614 2.727 1.00 . A A . 38 PRO HB2 1 1 12 10480 1 1 38 PRO HB3 H 5.823 -10.071 3.596 1.00 . A A . 38 PRO HB3 1 1 12 10481 1 1 38 PRO HD2 H 3.680 -7.028 4.660 1.00 . A A . 38 PRO HD2 1 1 12 10482 1 1 38 PRO HD3 H 3.423 -8.024 6.109 1.00 . A A . 38 PRO HD3 1 1 12 10483 1 1 38 PRO HG2 H 3.294 -9.097 3.671 1.00 . A A . 38 PRO HG2 1 1 12 10484 1 1 38 PRO HG3 H 4.025 -9.984 5.021 1.00 . A A . 38 PRO HG3 1 1 12 10485 1 1 38 PRO N N 5.448 -7.683 5.617 1.00 . A A . 38 PRO N 1 1 12 10486 1 1 38 PRO O O 6.667 -6.897 2.611 1.00 . A A . 38 PRO O 1 1 12 10487 1 1 39 ALA C C 9.534 -5.697 2.717 1.00 . A A . 39 ALA C 1 1 12 10488 1 1 39 ALA CA C 8.568 -5.253 3.809 1.00 . A A . 39 ALA CA 1 1 12 10489 1 1 39 ALA CB C 9.305 -4.449 4.867 1.00 . A A . 39 ALA CB 1 1 12 10490 1 1 39 ALA H H 8.068 -6.582 5.371 1.00 . A A . 39 ALA H 1 1 12 10491 1 1 39 ALA HA H 7.812 -4.618 3.371 1.00 . A A . 39 ALA HA 1 1 12 10492 1 1 39 ALA HB1 H 9.452 -3.438 4.514 1.00 . A A . 39 ALA HB1 1 1 12 10493 1 1 39 ALA HB2 H 8.721 -4.429 5.776 1.00 . A A . 39 ALA HB2 1 1 12 10494 1 1 39 ALA HB3 H 10.264 -4.904 5.064 1.00 . A A . 39 ALA HB3 1 1 12 10495 1 1 39 ALA N N 7.899 -6.389 4.424 1.00 . A A . 39 ALA N 1 1 12 10496 1 1 39 ALA O O 10.236 -6.702 2.861 1.00 . A A . 39 ALA O 1 1 12 10497 1 1 40 LEU C C 11.739 -4.389 0.645 1.00 . A A . 40 LEU C 1 1 12 10498 1 1 40 LEU CA C 10.467 -5.215 0.528 1.00 . A A . 40 LEU CA 1 1 12 10499 1 1 40 LEU CB C 9.778 -4.910 -0.807 1.00 . A A . 40 LEU CB 1 1 12 10500 1 1 40 LEU CD1 C 8.988 -7.298 -0.720 1.00 . A A . 40 LEU CD1 1 1 12 10501 1 1 40 LEU CD2 C 7.325 -5.427 -0.737 1.00 . A A . 40 LEU CD2 1 1 12 10502 1 1 40 LEU CG C 8.685 -5.896 -1.231 1.00 . A A . 40 LEU CG 1 1 12 10503 1 1 40 LEU H H 9.011 -4.126 1.599 1.00 . A A . 40 LEU H 1 1 12 10504 1 1 40 LEU HA H 10.723 -6.264 0.563 1.00 . A A . 40 LEU HA 1 1 12 10505 1 1 40 LEU HB2 H 9.338 -3.925 -0.742 1.00 . A A . 40 LEU HB2 1 1 12 10506 1 1 40 LEU HB3 H 10.533 -4.895 -1.578 1.00 . A A . 40 LEU HB3 1 1 12 10507 1 1 40 LEU HD11 H 9.980 -7.589 -1.037 1.00 . A A . 40 LEU HD11 1 1 12 10508 1 1 40 LEU HD12 H 8.939 -7.305 0.359 1.00 . A A . 40 LEU HD12 1 1 12 10509 1 1 40 LEU HD13 H 8.264 -7.992 -1.119 1.00 . A A . 40 LEU HD13 1 1 12 10510 1 1 40 LEU HD21 H 7.390 -5.176 0.312 1.00 . A A . 40 LEU HD21 1 1 12 10511 1 1 40 LEU HD22 H 7.018 -4.556 -1.298 1.00 . A A . 40 LEU HD22 1 1 12 10512 1 1 40 LEU HD23 H 6.602 -6.217 -0.874 1.00 . A A . 40 LEU HD23 1 1 12 10513 1 1 40 LEU HG H 8.652 -5.936 -2.308 1.00 . A A . 40 LEU HG 1 1 12 10514 1 1 40 LEU N N 9.578 -4.929 1.640 1.00 . A A . 40 LEU N 1 1 12 10515 1 1 40 LEU O O 11.736 -3.306 1.235 1.00 . A A . 40 LEU O 1 1 12 10516 1 1 41 TYR C C 14.370 -3.663 -1.374 1.00 . A A . 41 TYR C 1 1 12 10517 1 1 41 TYR CA C 14.073 -4.159 0.033 1.00 . A A . 41 TYR CA 1 1 12 10518 1 1 41 TYR CB C 15.202 -5.055 0.543 1.00 . A A . 41 TYR CB 1 1 12 10519 1 1 41 TYR CD1 C 15.349 -4.639 3.032 1.00 . A A . 41 TYR CD1 1 1 12 10520 1 1 41 TYR CD2 C 14.465 -6.726 2.292 1.00 . A A . 41 TYR CD2 1 1 12 10521 1 1 41 TYR CE1 C 15.157 -5.020 4.345 1.00 . A A . 41 TYR CE1 1 1 12 10522 1 1 41 TYR CE2 C 14.265 -7.110 3.603 1.00 . A A . 41 TYR CE2 1 1 12 10523 1 1 41 TYR CG C 15.010 -5.485 1.983 1.00 . A A . 41 TYR CG 1 1 12 10524 1 1 41 TYR CZ C 14.611 -6.254 4.626 1.00 . A A . 41 TYR CZ 1 1 12 10525 1 1 41 TYR H H 12.735 -5.726 -0.453 1.00 . A A . 41 TYR H 1 1 12 10526 1 1 41 TYR HA H 13.974 -3.305 0.689 1.00 . A A . 41 TYR HA 1 1 12 10527 1 1 41 TYR HB2 H 15.251 -5.943 -0.069 1.00 . A A . 41 TYR HB2 1 1 12 10528 1 1 41 TYR HB3 H 16.139 -4.520 0.476 1.00 . A A . 41 TYR HB3 1 1 12 10529 1 1 41 TYR HD1 H 15.776 -3.673 2.810 1.00 . A A . 41 TYR HD1 1 1 12 10530 1 1 41 TYR HD2 H 14.195 -7.396 1.489 1.00 . A A . 41 TYR HD2 1 1 12 10531 1 1 41 TYR HE1 H 15.425 -4.348 5.148 1.00 . A A . 41 TYR HE1 1 1 12 10532 1 1 41 TYR HE2 H 13.842 -8.079 3.825 1.00 . A A . 41 TYR HE2 1 1 12 10533 1 1 41 TYR HH H 13.604 -6.190 6.270 1.00 . A A . 41 TYR HH 1 1 12 10534 1 1 41 TYR N N 12.808 -4.877 0.041 1.00 . A A . 41 TYR N 1 1 12 10535 1 1 41 TYR O O 15.487 -3.250 -1.688 1.00 . A A . 41 TYR O 1 1 12 10536 1 1 41 TYR OH O 14.406 -6.628 5.935 1.00 . A A . 41 TYR OH 1 1 12 10537 1 1 42 GLU C C 12.029 -2.721 -4.002 1.00 . A A . 42 GLU C 1 1 12 10538 1 1 42 GLU CA C 13.409 -3.192 -3.563 1.00 . A A . 42 GLU CA 1 1 12 10539 1 1 42 GLU CB C 13.911 -4.293 -4.501 1.00 . A A . 42 GLU CB 1 1 12 10540 1 1 42 GLU CD C 15.414 -2.517 -5.495 1.00 . A A . 42 GLU CD 1 1 12 10541 1 1 42 GLU CG C 15.250 -3.984 -5.150 1.00 . A A . 42 GLU CG 1 1 12 10542 1 1 42 GLU H H 12.467 -3.982 -1.857 1.00 . A A . 42 GLU H 1 1 12 10543 1 1 42 GLU HA H 14.094 -2.357 -3.588 1.00 . A A . 42 GLU HA 1 1 12 10544 1 1 42 GLU HB2 H 14.011 -5.212 -3.940 1.00 . A A . 42 GLU HB2 1 1 12 10545 1 1 42 GLU HB3 H 13.182 -4.442 -5.285 1.00 . A A . 42 GLU HB3 1 1 12 10546 1 1 42 GLU HG2 H 16.038 -4.266 -4.468 1.00 . A A . 42 GLU HG2 1 1 12 10547 1 1 42 GLU HG3 H 15.337 -4.562 -6.058 1.00 . A A . 42 GLU HG3 1 1 12 10548 1 1 42 GLU N N 13.335 -3.676 -2.198 1.00 . A A . 42 GLU N 1 1 12 10549 1 1 42 GLU O O 11.032 -3.031 -3.350 1.00 . A A . 42 GLU O 1 1 12 10550 1 1 42 GLU OE1 O 14.529 -1.958 -6.178 1.00 . A A . 42 GLU OE1 1 1 12 10551 1 1 42 GLU OE2 O 16.425 -1.914 -5.077 1.00 . A A . 42 GLU OE2 1 1 12 10552 1 1 43 VAL C C 10.163 -2.421 -6.691 1.00 . A A . 43 VAL C 1 1 12 10553 1 1 43 VAL CA C 10.701 -1.489 -5.609 1.00 . A A . 43 VAL CA 1 1 12 10554 1 1 43 VAL CB C 10.833 -0.063 -6.182 1.00 . A A . 43 VAL CB 1 1 12 10555 1 1 43 VAL CG1 C 9.469 0.485 -6.575 1.00 . A A . 43 VAL CG1 1 1 12 10556 1 1 43 VAL CG2 C 11.511 0.860 -5.180 1.00 . A A . 43 VAL CG2 1 1 12 10557 1 1 43 VAL H H 12.803 -1.773 -5.579 1.00 . A A . 43 VAL H 1 1 12 10558 1 1 43 VAL HA H 9.997 -1.464 -4.789 1.00 . A A . 43 VAL HA 1 1 12 10559 1 1 43 VAL HB H 11.447 -0.108 -7.069 1.00 . A A . 43 VAL HB 1 1 12 10560 1 1 43 VAL HG11 H 9.147 1.207 -5.840 1.00 . A A . 43 VAL HG11 1 1 12 10561 1 1 43 VAL HG12 H 9.540 0.964 -7.541 1.00 . A A . 43 VAL HG12 1 1 12 10562 1 1 43 VAL HG13 H 8.755 -0.322 -6.626 1.00 . A A . 43 VAL HG13 1 1 12 10563 1 1 43 VAL HG21 H 11.773 0.299 -4.296 1.00 . A A . 43 VAL HG21 1 1 12 10564 1 1 43 VAL HG22 H 12.406 1.274 -5.622 1.00 . A A . 43 VAL HG22 1 1 12 10565 1 1 43 VAL HG23 H 10.837 1.660 -4.914 1.00 . A A . 43 VAL HG23 1 1 12 10566 1 1 43 VAL N N 11.971 -1.982 -5.095 1.00 . A A . 43 VAL N 1 1 12 10567 1 1 43 VAL O O 10.750 -2.533 -7.768 1.00 . A A . 43 VAL O 1 1 12 10568 1 1 44 PRO C C 7.769 -3.398 -8.485 1.00 . A A . 44 PRO C 1 1 12 10569 1 1 44 PRO CA C 8.469 -4.100 -7.328 1.00 . A A . 44 PRO CA 1 1 12 10570 1 1 44 PRO CB C 7.447 -4.863 -6.470 1.00 . A A . 44 PRO CB 1 1 12 10571 1 1 44 PRO CD C 8.349 -3.113 -5.117 1.00 . A A . 44 PRO CD 1 1 12 10572 1 1 44 PRO CG C 7.747 -4.485 -5.058 1.00 . A A . 44 PRO CG 1 1 12 10573 1 1 44 PRO HA H 9.205 -4.790 -7.716 1.00 . A A . 44 PRO HA 1 1 12 10574 1 1 44 PRO HB2 H 6.446 -4.566 -6.754 1.00 . A A . 44 PRO HB2 1 1 12 10575 1 1 44 PRO HB3 H 7.566 -5.925 -6.626 1.00 . A A . 44 PRO HB3 1 1 12 10576 1 1 44 PRO HD2 H 7.575 -2.358 -5.122 1.00 . A A . 44 PRO HD2 1 1 12 10577 1 1 44 PRO HD3 H 9.028 -2.961 -4.291 1.00 . A A . 44 PRO HD3 1 1 12 10578 1 1 44 PRO HG2 H 6.835 -4.472 -4.478 1.00 . A A . 44 PRO HG2 1 1 12 10579 1 1 44 PRO HG3 H 8.450 -5.186 -4.632 1.00 . A A . 44 PRO HG3 1 1 12 10580 1 1 44 PRO N N 9.070 -3.144 -6.395 1.00 . A A . 44 PRO N 1 1 12 10581 1 1 44 PRO O O 6.613 -2.985 -8.368 1.00 . A A . 44 PRO O 1 1 12 10582 1 1 45 ASP C C 7.292 -3.534 -11.699 1.00 . A A . 45 ASP C 1 1 12 10583 1 1 45 ASP CA C 7.955 -2.543 -10.754 1.00 . A A . 45 ASP CA 1 1 12 10584 1 1 45 ASP CB C 9.068 -1.788 -11.485 1.00 . A A . 45 ASP CB 1 1 12 10585 1 1 45 ASP CG C 8.547 -0.621 -12.300 1.00 . A A . 45 ASP CG 1 1 12 10586 1 1 45 ASP H H 9.417 -3.554 -9.603 1.00 . A A . 45 ASP H 1 1 12 10587 1 1 45 ASP HA H 7.213 -1.834 -10.414 1.00 . A A . 45 ASP HA 1 1 12 10588 1 1 45 ASP HB2 H 9.773 -1.407 -10.761 1.00 . A A . 45 ASP HB2 1 1 12 10589 1 1 45 ASP HB3 H 9.577 -2.469 -12.152 1.00 . A A . 45 ASP HB3 1 1 12 10590 1 1 45 ASP N N 8.490 -3.227 -9.584 1.00 . A A . 45 ASP N 1 1 12 10591 1 1 45 ASP O O 7.969 -4.294 -12.398 1.00 . A A . 45 ASP O 1 1 12 10592 1 1 45 ASP OD1 O 7.701 -0.837 -13.192 1.00 . A A . 45 ASP OD1 1 1 12 10593 1 1 45 ASP OD2 O 8.988 0.521 -12.055 1.00 . A A . 45 ASP OD2 1 1 12 10594 1 1 46 GLY C C 3.929 -4.893 -11.949 1.00 . A A . 46 GLY C 1 1 12 10595 1 1 46 GLY CA C 5.234 -4.440 -12.564 1.00 . A A . 46 GLY CA 1 1 12 10596 1 1 46 GLY H H 5.478 -2.929 -11.102 1.00 . A A . 46 GLY H 1 1 12 10597 1 1 46 GLY HA2 H 5.026 -3.940 -13.499 1.00 . A A . 46 GLY HA2 1 1 12 10598 1 1 46 GLY HA3 H 5.846 -5.309 -12.762 1.00 . A A . 46 GLY HA3 1 1 12 10599 1 1 46 GLY N N 5.968 -3.540 -11.702 1.00 . A A . 46 GLY N 1 1 12 10600 1 1 46 GLY O O 2.858 -4.409 -12.321 1.00 . A A . 46 GLY O 1 1 12 10601 1 1 47 GLU C C 3.061 -6.554 -8.877 1.00 . A A . 47 GLU C 1 1 12 10602 1 1 47 GLU CA C 2.827 -6.375 -10.371 1.00 . A A . 47 GLU CA 1 1 12 10603 1 1 47 GLU CB C 2.452 -7.715 -11.005 1.00 . A A . 47 GLU CB 1 1 12 10604 1 1 47 GLU CD C 0.271 -8.294 -12.124 1.00 . A A . 47 GLU CD 1 1 12 10605 1 1 47 GLU CG C 1.599 -7.584 -12.254 1.00 . A A . 47 GLU CG 1 1 12 10606 1 1 47 GLU H H 4.902 -6.177 -10.763 1.00 . A A . 47 GLU H 1 1 12 10607 1 1 47 GLU HA H 2.018 -5.676 -10.519 1.00 . A A . 47 GLU HA 1 1 12 10608 1 1 47 GLU HB2 H 3.356 -8.242 -11.267 1.00 . A A . 47 GLU HB2 1 1 12 10609 1 1 47 GLU HB3 H 1.902 -8.300 -10.280 1.00 . A A . 47 GLU HB3 1 1 12 10610 1 1 47 GLU HG2 H 1.414 -6.538 -12.441 1.00 . A A . 47 GLU HG2 1 1 12 10611 1 1 47 GLU HG3 H 2.140 -8.008 -13.088 1.00 . A A . 47 GLU HG3 1 1 12 10612 1 1 47 GLU N N 4.013 -5.830 -11.018 1.00 . A A . 47 GLU N 1 1 12 10613 1 1 47 GLU O O 3.832 -7.419 -8.455 1.00 . A A . 47 GLU O 1 1 12 10614 1 1 47 GLU OE1 O 0.250 -9.436 -11.614 1.00 . A A . 47 GLU OE1 1 1 12 10615 1 1 47 GLU OE2 O -0.759 -7.719 -12.531 1.00 . A A . 47 GLU OE2 1 1 12 10616 1 1 48 TRP C C 1.128 -6.039 -5.990 1.00 . A A . 48 TRP C 1 1 12 10617 1 1 48 TRP CA C 2.495 -5.843 -6.634 1.00 . A A . 48 TRP CA 1 1 12 10618 1 1 48 TRP CB C 3.166 -4.586 -6.073 1.00 . A A . 48 TRP CB 1 1 12 10619 1 1 48 TRP CD1 C 4.426 -5.337 -3.968 1.00 . A A . 48 TRP CD1 1 1 12 10620 1 1 48 TRP CD2 C 2.663 -4.017 -3.564 1.00 . A A . 48 TRP CD2 1 1 12 10621 1 1 48 TRP CE2 C 3.263 -4.354 -2.337 1.00 . A A . 48 TRP CE2 1 1 12 10622 1 1 48 TRP CE3 C 1.537 -3.191 -3.558 1.00 . A A . 48 TRP CE3 1 1 12 10623 1 1 48 TRP CG C 3.423 -4.655 -4.596 1.00 . A A . 48 TRP CG 1 1 12 10624 1 1 48 TRP CH2 C 1.668 -3.090 -1.141 1.00 . A A . 48 TRP CH2 1 1 12 10625 1 1 48 TRP CZ2 C 2.772 -3.897 -1.118 1.00 . A A . 48 TRP CZ2 1 1 12 10626 1 1 48 TRP CZ3 C 1.049 -2.738 -2.348 1.00 . A A . 48 TRP CZ3 1 1 12 10627 1 1 48 TRP H H 1.754 -5.099 -8.467 1.00 . A A . 48 TRP H 1 1 12 10628 1 1 48 TRP HA H 3.112 -6.700 -6.407 1.00 . A A . 48 TRP HA 1 1 12 10629 1 1 48 TRP HB2 H 4.113 -4.439 -6.571 1.00 . A A . 48 TRP HB2 1 1 12 10630 1 1 48 TRP HB3 H 2.529 -3.735 -6.264 1.00 . A A . 48 TRP HB3 1 1 12 10631 1 1 48 TRP HD1 H 5.173 -5.926 -4.478 1.00 . A A . 48 TRP HD1 1 1 12 10632 1 1 48 TRP HE1 H 4.943 -5.549 -1.944 1.00 . A A . 48 TRP HE1 1 1 12 10633 1 1 48 TRP HE3 H 1.047 -2.908 -4.480 1.00 . A A . 48 TRP HE3 1 1 12 10634 1 1 48 TRP HH2 H 1.253 -2.715 -0.218 1.00 . A A . 48 TRP HH2 1 1 12 10635 1 1 48 TRP HZ2 H 3.241 -4.156 -0.182 1.00 . A A . 48 TRP HZ2 1 1 12 10636 1 1 48 TRP HZ3 H 0.177 -2.101 -2.325 1.00 . A A . 48 TRP HZ3 1 1 12 10637 1 1 48 TRP N N 2.377 -5.754 -8.077 1.00 . A A . 48 TRP N 1 1 12 10638 1 1 48 TRP NE1 N 4.336 -5.159 -2.609 1.00 . A A . 48 TRP NE1 1 1 12 10639 1 1 48 TRP O O 0.125 -5.477 -6.443 1.00 . A A . 48 TRP O 1 1 12 10640 1 1 49 GLN C C 0.174 -7.102 -2.696 1.00 . A A . 49 GLN C 1 1 12 10641 1 1 49 GLN CA C -0.120 -7.089 -4.194 1.00 . A A . 49 GLN CA 1 1 12 10642 1 1 49 GLN CB C -0.727 -8.428 -4.639 1.00 . A A . 49 GLN CB 1 1 12 10643 1 1 49 GLN CD C -3.056 -8.621 -3.677 1.00 . A A . 49 GLN CD 1 1 12 10644 1 1 49 GLN CG C -1.619 -9.088 -3.597 1.00 . A A . 49 GLN CG 1 1 12 10645 1 1 49 GLN H H 1.937 -7.242 -4.622 1.00 . A A . 49 GLN H 1 1 12 10646 1 1 49 GLN HA H -0.817 -6.293 -4.410 1.00 . A A . 49 GLN HA 1 1 12 10647 1 1 49 GLN HB2 H -1.315 -8.264 -5.529 1.00 . A A . 49 GLN HB2 1 1 12 10648 1 1 49 GLN HB3 H 0.078 -9.109 -4.873 1.00 . A A . 49 GLN HB3 1 1 12 10649 1 1 49 GLN HE21 H -2.862 -7.623 -1.966 1.00 . A A . 49 GLN HE21 1 1 12 10650 1 1 49 GLN HE22 H -4.413 -7.526 -2.734 1.00 . A A . 49 GLN HE22 1 1 12 10651 1 1 49 GLN HG2 H -1.595 -10.157 -3.749 1.00 . A A . 49 GLN HG2 1 1 12 10652 1 1 49 GLN HG3 H -1.235 -8.858 -2.614 1.00 . A A . 49 GLN HG3 1 1 12 10653 1 1 49 GLN N N 1.100 -6.829 -4.931 1.00 . A A . 49 GLN N 1 1 12 10654 1 1 49 GLN NE2 N -3.487 -7.848 -2.694 1.00 . A A . 49 GLN NE2 1 1 12 10655 1 1 49 GLN O O 1.139 -7.728 -2.251 1.00 . A A . 49 GLN O 1 1 12 10656 1 1 49 GLN OE1 O -3.776 -8.960 -4.612 1.00 . A A . 49 GLN OE1 1 1 12 10657 1 1 50 CYS C C -0.884 -7.707 0.131 1.00 . A A . 50 CYS C 1 1 12 10658 1 1 50 CYS CA C -0.514 -6.353 -0.485 1.00 . A A . 50 CYS CA 1 1 12 10659 1 1 50 CYS CB C -1.443 -5.264 0.058 1.00 . A A . 50 CYS CB 1 1 12 10660 1 1 50 CYS H H -1.401 -5.926 -2.347 1.00 . A A . 50 CYS H 1 1 12 10661 1 1 50 CYS HA H 0.510 -6.111 -0.247 1.00 . A A . 50 CYS HA 1 1 12 10662 1 1 50 CYS HB2 H -1.311 -5.181 1.128 1.00 . A A . 50 CYS HB2 1 1 12 10663 1 1 50 CYS HB3 H -1.197 -4.322 -0.407 1.00 . A A . 50 CYS HB3 1 1 12 10664 1 1 50 CYS N N -0.656 -6.407 -1.930 1.00 . A A . 50 CYS N 1 1 12 10665 1 1 50 CYS O O -1.532 -8.529 -0.523 1.00 . A A . 50 CYS O 1 1 12 10666 1 1 50 CYS SG S -3.203 -5.600 -0.265 1.00 . A A . 50 CYS SG 1 1 12 10667 1 1 51 PRO C C -2.557 -9.193 2.132 1.00 . A A . 51 PRO C 1 1 12 10668 1 1 51 PRO CA C -1.035 -9.123 2.135 1.00 . A A . 51 PRO CA 1 1 12 10669 1 1 51 PRO CB C -0.508 -8.936 3.567 1.00 . A A . 51 PRO CB 1 1 12 10670 1 1 51 PRO CD C 0.112 -6.986 2.318 1.00 . A A . 51 PRO CD 1 1 12 10671 1 1 51 PRO CG C 0.509 -7.847 3.481 1.00 . A A . 51 PRO CG 1 1 12 10672 1 1 51 PRO HA H -0.626 -10.023 1.705 1.00 . A A . 51 PRO HA 1 1 12 10673 1 1 51 PRO HB2 H -1.325 -8.660 4.219 1.00 . A A . 51 PRO HB2 1 1 12 10674 1 1 51 PRO HB3 H -0.067 -9.860 3.911 1.00 . A A . 51 PRO HB3 1 1 12 10675 1 1 51 PRO HD2 H -0.553 -6.198 2.642 1.00 . A A . 51 PRO HD2 1 1 12 10676 1 1 51 PRO HD3 H 0.986 -6.572 1.839 1.00 . A A . 51 PRO HD3 1 1 12 10677 1 1 51 PRO HG2 H 0.503 -7.267 4.392 1.00 . A A . 51 PRO HG2 1 1 12 10678 1 1 51 PRO HG3 H 1.487 -8.274 3.314 1.00 . A A . 51 PRO HG3 1 1 12 10679 1 1 51 PRO N N -0.583 -7.923 1.426 1.00 . A A . 51 PRO N 1 1 12 10680 1 1 51 PRO O O -3.153 -10.168 1.677 1.00 . A A . 51 PRO O 1 1 12 10681 1 1 52 ARG C C -4.888 -6.451 2.930 1.00 . A A . 52 ARG C 1 1 12 10682 1 1 52 ARG CA C -4.592 -7.857 2.436 1.00 . A A . 52 ARG CA 1 1 12 10683 1 1 52 ARG CB C -5.338 -8.879 3.292 1.00 . A A . 52 ARG CB 1 1 12 10684 1 1 52 ARG CD C -6.795 -10.874 2.946 1.00 . A A . 52 ARG CD 1 1 12 10685 1 1 52 ARG CG C -6.595 -9.407 2.636 1.00 . A A . 52 ARG CG 1 1 12 10686 1 1 52 ARG CZ C -7.609 -11.520 5.187 1.00 . A A . 52 ARG CZ 1 1 12 10687 1 1 52 ARG H H -2.593 -7.303 2.716 1.00 . A A . 52 ARG H 1 1 12 10688 1 1 52 ARG HA H -4.910 -7.948 1.407 1.00 . A A . 52 ARG HA 1 1 12 10689 1 1 52 ARG HB2 H -4.682 -9.714 3.491 1.00 . A A . 52 ARG HB2 1 1 12 10690 1 1 52 ARG HB3 H -5.614 -8.417 4.230 1.00 . A A . 52 ARG HB3 1 1 12 10691 1 1 52 ARG HD2 H -7.074 -11.384 2.038 1.00 . A A . 52 ARG HD2 1 1 12 10692 1 1 52 ARG HD3 H -5.867 -11.282 3.316 1.00 . A A . 52 ARG HD3 1 1 12 10693 1 1 52 ARG HE H -8.765 -10.844 3.698 1.00 . A A . 52 ARG HE 1 1 12 10694 1 1 52 ARG HG2 H -7.445 -8.852 3.004 1.00 . A A . 52 ARG HG2 1 1 12 10695 1 1 52 ARG HG3 H -6.512 -9.281 1.567 1.00 . A A . 52 ARG HG3 1 1 12 10696 1 1 52 ARG HH11 H -5.622 -11.821 4.894 1.00 . A A . 52 ARG HH11 1 1 12 10697 1 1 52 ARG HH12 H -6.206 -12.208 6.487 1.00 . A A . 52 ARG HH12 1 1 12 10698 1 1 52 ARG HH21 H -9.542 -11.353 5.776 1.00 . A A . 52 ARG HH21 1 1 12 10699 1 1 52 ARG HH22 H -8.444 -11.943 6.994 1.00 . A A . 52 ARG HH22 1 1 12 10700 1 1 52 ARG N N -3.155 -8.064 2.491 1.00 . A A . 52 ARG N 1 1 12 10701 1 1 52 ARG NE N -7.838 -11.077 3.953 1.00 . A A . 52 ARG NE 1 1 12 10702 1 1 52 ARG NH1 N -6.383 -11.881 5.551 1.00 . A A . 52 ARG NH1 1 1 12 10703 1 1 52 ARG NH2 N -8.613 -11.617 6.052 1.00 . A A . 52 ARG NH2 1 1 12 10704 1 1 52 ARG O O -5.832 -6.235 3.692 1.00 . A A . 52 ARG O 1 1 12 10705 1 1 53 CYS C C -4.259 -4.047 4.479 1.00 . A A . 53 CYS C 1 1 12 10706 1 1 53 CYS CA C -4.092 -4.132 2.960 1.00 . A A . 53 CYS CA 1 1 12 10707 1 1 53 CYS CB C -5.220 -3.413 2.225 1.00 . A A . 53 CYS CB 1 1 12 10708 1 1 53 CYS H H -3.332 -5.767 1.875 1.00 . A A . 53 CYS H 1 1 12 10709 1 1 53 CYS HA H -3.156 -3.664 2.697 1.00 . A A . 53 CYS HA 1 1 12 10710 1 1 53 CYS HB2 H -5.877 -4.153 1.795 1.00 . A A . 53 CYS HB2 1 1 12 10711 1 1 53 CYS HB3 H -5.773 -2.806 2.926 1.00 . A A . 53 CYS HB3 1 1 12 10712 1 1 53 CYS N N -4.026 -5.516 2.524 1.00 . A A . 53 CYS N 1 1 12 10713 1 1 53 CYS O O -5.215 -3.459 4.988 1.00 . A A . 53 CYS O 1 1 12 10714 1 1 53 CYS SG S -4.648 -2.328 0.871 1.00 . A A . 53 CYS SG 1 1 12 10715 1 1 54 THR C C -2.370 -3.907 7.292 1.00 . A A . 54 THR C 1 1 12 10716 1 1 54 THR CA C -3.430 -4.797 6.635 1.00 . A A . 54 THR CA 1 1 12 10717 1 1 54 THR CB C -3.286 -6.262 7.121 1.00 . A A . 54 THR CB 1 1 12 10718 1 1 54 THR CG2 C -2.023 -6.910 6.569 1.00 . A A . 54 THR CG2 1 1 12 10719 1 1 54 THR H H -2.659 -5.213 4.718 1.00 . A A . 54 THR H 1 1 12 10720 1 1 54 THR HA H -4.408 -4.444 6.934 1.00 . A A . 54 THR HA 1 1 12 10721 1 1 54 THR HB H -4.137 -6.821 6.760 1.00 . A A . 54 THR HB 1 1 12 10722 1 1 54 THR HG1 H -4.134 -6.021 8.893 1.00 . A A . 54 THR HG1 1 1 12 10723 1 1 54 THR HG21 H -1.904 -6.638 5.532 1.00 . A A . 54 THR HG21 1 1 12 10724 1 1 54 THR HG22 H -2.104 -7.984 6.653 1.00 . A A . 54 THR HG22 1 1 12 10725 1 1 54 THR HG23 H -1.168 -6.568 7.131 1.00 . A A . 54 THR HG23 1 1 12 10726 1 1 54 THR N N -3.360 -4.719 5.187 1.00 . A A . 54 THR N 1 1 12 10727 1 1 54 THR O O -1.165 -4.068 7.073 1.00 . A A . 54 THR O 1 1 12 10728 1 1 54 THR OG1 O -3.276 -6.321 8.554 1.00 . A A . 54 THR OG1 1 1 12 10729 1 1 55 CYS C C -1.532 -2.593 10.157 1.00 . A A . 55 CYS C 1 1 12 10730 1 1 55 CYS CA C -1.948 -2.035 8.788 1.00 . A A . 55 CYS CA 1 1 12 10731 1 1 55 CYS CB C -2.614 -0.665 8.950 1.00 . A A . 55 CYS CB 1 1 12 10732 1 1 55 CYS H H -3.805 -2.859 8.198 1.00 . A A . 55 CYS H 1 1 12 10733 1 1 55 CYS HA H -1.060 -1.916 8.186 1.00 . A A . 55 CYS HA 1 1 12 10734 1 1 55 CYS HB2 H -3.132 -0.636 9.895 1.00 . A A . 55 CYS HB2 1 1 12 10735 1 1 55 CYS HB3 H -1.851 0.101 8.938 1.00 . A A . 55 CYS HB3 1 1 12 10736 1 1 55 CYS HG H -4.751 -1.212 7.669 1.00 . A A . 55 CYS HG 1 1 12 10737 1 1 55 CYS N N -2.834 -2.952 8.084 1.00 . A A . 55 CYS N 1 1 12 10738 1 1 55 CYS O O -0.341 -2.625 10.473 1.00 . A A . 55 CYS O 1 1 12 10739 1 1 55 CYS SG S -3.813 -0.271 7.655 1.00 . A A . 55 CYS SG 1 1 12 10740 1 1 56 PRO C C -1.837 -5.029 12.315 1.00 . A A . 56 PRO C 1 1 12 10741 1 1 56 PRO CA C -2.180 -3.540 12.339 1.00 . A A . 56 PRO CA 1 1 12 10742 1 1 56 PRO CB C -3.470 -3.294 13.140 1.00 . A A . 56 PRO CB 1 1 12 10743 1 1 56 PRO CD C -3.938 -3.012 10.792 1.00 . A A . 56 PRO CD 1 1 12 10744 1 1 56 PRO CG C -4.473 -2.747 12.171 1.00 . A A . 56 PRO CG 1 1 12 10745 1 1 56 PRO HA H -1.364 -2.995 12.793 1.00 . A A . 56 PRO HA 1 1 12 10746 1 1 56 PRO HB2 H -3.808 -4.227 13.568 1.00 . A A . 56 PRO HB2 1 1 12 10747 1 1 56 PRO HB3 H -3.266 -2.589 13.932 1.00 . A A . 56 PRO HB3 1 1 12 10748 1 1 56 PRO HD2 H -4.280 -3.970 10.426 1.00 . A A . 56 PRO HD2 1 1 12 10749 1 1 56 PRO HD3 H -4.221 -2.221 10.113 1.00 . A A . 56 PRO HD3 1 1 12 10750 1 1 56 PRO HG2 H -5.421 -3.249 12.302 1.00 . A A . 56 PRO HG2 1 1 12 10751 1 1 56 PRO HG3 H -4.589 -1.685 12.328 1.00 . A A . 56 PRO HG3 1 1 12 10752 1 1 56 PRO N N -2.489 -3.023 11.011 1.00 . A A . 56 PRO N 1 1 12 10753 1 1 56 PRO O O -2.693 -5.882 12.566 1.00 . A A . 56 PRO O 1 1 12 10754 1 1 57 ALA C C 0.570 -7.047 13.361 1.00 . A A . 57 ALA C 1 1 12 10755 1 1 57 ALA CA C -0.112 -6.710 12.041 1.00 . A A . 57 ALA CA 1 1 12 10756 1 1 57 ALA CB C 0.836 -6.947 10.874 1.00 . A A . 57 ALA CB 1 1 12 10757 1 1 57 ALA H H 0.067 -4.607 11.896 1.00 . A A . 57 ALA H 1 1 12 10758 1 1 57 ALA HA H -0.972 -7.353 11.916 1.00 . A A . 57 ALA HA 1 1 12 10759 1 1 57 ALA HB1 H 1.490 -6.095 10.761 1.00 . A A . 57 ALA HB1 1 1 12 10760 1 1 57 ALA HB2 H 1.427 -7.832 11.064 1.00 . A A . 57 ALA HB2 1 1 12 10761 1 1 57 ALA HB3 H 0.264 -7.085 9.968 1.00 . A A . 57 ALA HB3 1 1 12 10762 1 1 57 ALA N N -0.578 -5.332 12.050 1.00 . A A . 57 ALA N 1 1 12 10763 1 1 57 ALA O O 0.919 -6.147 14.129 1.00 . A A . 57 ALA O 1 1 12 10764 1 1 58 LEU C C 0.482 -8.458 16.080 1.00 . A A . 58 LEU C 1 1 12 10765 1 1 58 LEU CA C 1.338 -8.824 14.866 1.00 . A A . 58 LEU CA 1 1 12 10766 1 1 58 LEU CB C 2.762 -8.264 15.025 1.00 . A A . 58 LEU CB 1 1 12 10767 1 1 58 LEU CD1 C 5.231 -8.565 14.699 1.00 . A A . 58 LEU CD1 1 1 12 10768 1 1 58 LEU CD2 C 3.916 -10.276 15.972 1.00 . A A . 58 LEU CD2 1 1 12 10769 1 1 58 LEU CG C 3.890 -9.276 14.826 1.00 . A A . 58 LEU CG 1 1 12 10770 1 1 58 LEU H H 0.375 -8.997 12.986 1.00 . A A . 58 LEU H 1 1 12 10771 1 1 58 LEU HA H 1.395 -9.901 14.799 1.00 . A A . 58 LEU HA 1 1 12 10772 1 1 58 LEU HB2 H 2.892 -7.465 14.309 1.00 . A A . 58 LEU HB2 1 1 12 10773 1 1 58 LEU HB3 H 2.854 -7.849 16.018 1.00 . A A . 58 LEU HB3 1 1 12 10774 1 1 58 LEU HD11 H 5.139 -7.745 14.003 1.00 . A A . 58 LEU HD11 1 1 12 10775 1 1 58 LEU HD12 H 5.530 -8.186 15.664 1.00 . A A . 58 LEU HD12 1 1 12 10776 1 1 58 LEU HD13 H 5.977 -9.260 14.340 1.00 . A A . 58 LEU HD13 1 1 12 10777 1 1 58 LEU HD21 H 3.695 -9.769 16.900 1.00 . A A . 58 LEU HD21 1 1 12 10778 1 1 58 LEU HD22 H 3.178 -11.043 15.796 1.00 . A A . 58 LEU HD22 1 1 12 10779 1 1 58 LEU HD23 H 4.895 -10.727 16.034 1.00 . A A . 58 LEU HD23 1 1 12 10780 1 1 58 LEU HG H 3.716 -9.821 13.909 1.00 . A A . 58 LEU HG 1 1 12 10781 1 1 58 LEU N N 0.721 -8.340 13.629 1.00 . A A . 58 LEU N 1 1 12 10782 1 1 58 LEU O O -0.512 -9.126 16.372 1.00 . A A . 58 LEU O 1 1 12 10783 1 1 59 LYS C C -0.471 -5.530 17.673 1.00 . A A . 59 LYS C 1 1 12 10784 1 1 59 LYS CA C 0.101 -6.922 17.924 1.00 . A A . 59 LYS CA 1 1 12 10785 1 1 59 LYS CB C 0.992 -6.909 19.168 1.00 . A A . 59 LYS CB 1 1 12 10786 1 1 59 LYS CD C -0.623 -7.399 21.034 1.00 . A A . 59 LYS CD 1 1 12 10787 1 1 59 LYS CE C -0.287 -6.130 21.800 1.00 . A A . 59 LYS CE 1 1 12 10788 1 1 59 LYS CG C 0.569 -7.907 20.235 1.00 . A A . 59 LYS CG 1 1 12 10789 1 1 59 LYS H H 1.639 -6.873 16.472 1.00 . A A . 59 LYS H 1 1 12 10790 1 1 59 LYS HA H -0.715 -7.610 18.084 1.00 . A A . 59 LYS HA 1 1 12 10791 1 1 59 LYS HB2 H 2.008 -7.137 18.876 1.00 . A A . 59 LYS HB2 1 1 12 10792 1 1 59 LYS HB3 H 0.969 -5.919 19.602 1.00 . A A . 59 LYS HB3 1 1 12 10793 1 1 59 LYS HD2 H -1.435 -7.191 20.356 1.00 . A A . 59 LYS HD2 1 1 12 10794 1 1 59 LYS HD3 H -0.928 -8.162 21.738 1.00 . A A . 59 LYS HD3 1 1 12 10795 1 1 59 LYS HE2 H 0.249 -6.396 22.699 1.00 . A A . 59 LYS HE2 1 1 12 10796 1 1 59 LYS HE3 H 0.339 -5.507 21.181 1.00 . A A . 59 LYS HE3 1 1 12 10797 1 1 59 LYS HG2 H 0.299 -8.836 19.759 1.00 . A A . 59 LYS HG2 1 1 12 10798 1 1 59 LYS HG3 H 1.397 -8.073 20.910 1.00 . A A . 59 LYS HG3 1 1 12 10799 1 1 59 LYS HZ1 H -2.018 -5.061 21.319 1.00 . A A . 59 LYS HZ1 1 1 12 10800 1 1 59 LYS HZ2 H -1.246 -4.526 22.733 1.00 . A A . 59 LYS HZ2 1 1 12 10801 1 1 59 LYS HZ3 H -2.141 -5.964 22.749 1.00 . A A . 59 LYS HZ3 1 1 12 10802 1 1 59 LYS N N 0.852 -7.384 16.765 1.00 . A A . 59 LYS N 1 1 12 10803 1 1 59 LYS NZ N -1.506 -5.369 22.175 1.00 . A A . 59 LYS NZ 1 1 12 10804 1 1 59 LYS O O -1.031 -4.901 18.571 1.00 . A A . 59 LYS O 1 1 12 10805 1 1 60 GLY C C 0.244 -2.870 15.501 1.00 . A A . 60 GLY C 1 1 12 10806 1 1 60 GLY CA C -0.833 -3.751 16.091 1.00 . A A . 60 GLY CA 1 1 12 10807 1 1 60 GLY H H 0.136 -5.603 15.768 1.00 . A A . 60 GLY H 1 1 12 10808 1 1 60 GLY HA2 H -1.629 -3.865 15.369 1.00 . A A . 60 GLY HA2 1 1 12 10809 1 1 60 GLY HA3 H -1.227 -3.275 16.975 1.00 . A A . 60 GLY HA3 1 1 12 10810 1 1 60 GLY N N -0.327 -5.058 16.445 1.00 . A A . 60 GLY N 1 1 12 10811 1 1 60 GLY O O 1.395 -3.292 15.377 1.00 . A A . 60 GLY O 1 1 12 10812 1 1 61 LYS C C 0.462 0.729 15.142 1.00 . A A . 61 LYS C 1 1 12 10813 1 1 61 LYS CA C 0.838 -0.666 14.667 1.00 . A A . 61 LYS CA 1 1 12 10814 1 1 61 LYS CB C 0.883 -0.710 13.138 1.00 . A A . 61 LYS CB 1 1 12 10815 1 1 61 LYS CD C 3.108 -0.876 11.980 1.00 . A A . 61 LYS CD 1 1 12 10816 1 1 61 LYS CE C 3.877 -0.226 10.842 1.00 . A A . 61 LYS CE 1 1 12 10817 1 1 61 LYS CG C 2.052 0.060 12.545 1.00 . A A . 61 LYS CG 1 1 12 10818 1 1 61 LYS H H -1.034 -1.342 15.361 1.00 . A A . 61 LYS H 1 1 12 10819 1 1 61 LYS HA H 1.813 -0.916 15.058 1.00 . A A . 61 LYS HA 1 1 12 10820 1 1 61 LYS HB2 H 0.961 -1.740 12.822 1.00 . A A . 61 LYS HB2 1 1 12 10821 1 1 61 LYS HB3 H -0.032 -0.291 12.747 1.00 . A A . 61 LYS HB3 1 1 12 10822 1 1 61 LYS HD2 H 3.800 -1.136 12.767 1.00 . A A . 61 LYS HD2 1 1 12 10823 1 1 61 LYS HD3 H 2.624 -1.767 11.613 1.00 . A A . 61 LYS HD3 1 1 12 10824 1 1 61 LYS HE2 H 4.102 -0.978 10.100 1.00 . A A . 61 LYS HE2 1 1 12 10825 1 1 61 LYS HE3 H 3.259 0.542 10.397 1.00 . A A . 61 LYS HE3 1 1 12 10826 1 1 61 LYS HG2 H 1.686 0.695 11.752 1.00 . A A . 61 LYS HG2 1 1 12 10827 1 1 61 LYS HG3 H 2.497 0.668 13.319 1.00 . A A . 61 LYS HG3 1 1 12 10828 1 1 61 LYS HZ1 H 5.209 1.379 10.987 1.00 . A A . 61 LYS HZ1 1 1 12 10829 1 1 61 LYS HZ2 H 5.963 -0.137 10.924 1.00 . A A . 61 LYS HZ2 1 1 12 10830 1 1 61 LYS HZ3 H 5.200 0.370 12.352 1.00 . A A . 61 LYS HZ3 1 1 12 10831 1 1 61 LYS N N -0.113 -1.635 15.184 1.00 . A A . 61 LYS N 1 1 12 10832 1 1 61 LYS NZ N 5.149 0.388 11.309 1.00 . A A . 61 LYS NZ 1 1 12 10833 1 1 61 LYS O O 1.366 1.561 15.330 1.00 . A A . 61 LYS O 1 1 12 10834 1 1 61 LYS OXT O -0.746 0.976 15.353 1.00 . A A . 61 LYS OXT 1 1 12 10835 2 2 1 ZN ZN ZN -4.190 -3.668 -0.947 1.00 . B A . 62 ZN ZN 1 1 12 10836 3 2 1 ZN ZN ZN 3.901 3.679 3.637 1.00 . C A . 63 ZN ZN 1 1 13 10837 1 1 1 GLY C C -14.714 2.535 -1.645 1.00 . A A . 1 GLY C 1 1 13 10838 1 1 1 GLY CA C -14.959 2.648 -3.135 1.00 . A A . 1 GLY CA 1 1 13 10839 1 1 1 GLY H1 H -15.939 1.622 -4.667 1.00 . A A . 1 GLY H1 1 1 13 10840 1 1 1 GLY H2 H -16.629 1.399 -3.135 1.00 . A A . 1 GLY H2 1 1 13 10841 1 1 1 GLY H3 H -15.182 0.611 -3.532 1.00 . A A . 1 GLY H3 1 1 13 10842 1 1 1 GLY HA2 H -14.006 2.695 -3.642 1.00 . A A . 1 GLY HA2 1 1 13 10843 1 1 1 GLY HA3 H -15.510 3.556 -3.334 1.00 . A A . 1 GLY HA3 1 1 13 10844 1 1 1 GLY N N -15.729 1.492 -3.655 1.00 . A A . 1 GLY N 1 1 13 10845 1 1 1 GLY O O -15.644 2.668 -0.848 1.00 . A A . 1 GLY O 1 1 13 10846 1 1 2 PRO C C -13.162 3.230 1.021 1.00 . A A . 2 PRO C 1 1 13 10847 1 1 2 PRO CA C -13.152 1.960 0.176 1.00 . A A . 2 PRO CA 1 1 13 10848 1 1 2 PRO CB C -11.740 1.371 0.127 1.00 . A A . 2 PRO CB 1 1 13 10849 1 1 2 PRO CD C -12.343 1.909 -2.115 1.00 . A A . 2 PRO CD 1 1 13 10850 1 1 2 PRO CG C -11.540 0.950 -1.289 1.00 . A A . 2 PRO CG 1 1 13 10851 1 1 2 PRO HA H -13.826 1.240 0.614 1.00 . A A . 2 PRO HA 1 1 13 10852 1 1 2 PRO HB2 H -11.024 2.123 0.421 1.00 . A A . 2 PRO HB2 1 1 13 10853 1 1 2 PRO HB3 H -11.679 0.526 0.800 1.00 . A A . 2 PRO HB3 1 1 13 10854 1 1 2 PRO HD2 H -11.773 2.803 -2.327 1.00 . A A . 2 PRO HD2 1 1 13 10855 1 1 2 PRO HD3 H -12.673 1.439 -3.029 1.00 . A A . 2 PRO HD3 1 1 13 10856 1 1 2 PRO HG2 H -10.494 1.015 -1.550 1.00 . A A . 2 PRO HG2 1 1 13 10857 1 1 2 PRO HG3 H -11.902 -0.057 -1.428 1.00 . A A . 2 PRO HG3 1 1 13 10858 1 1 2 PRO N N -13.482 2.205 -1.234 1.00 . A A . 2 PRO N 1 1 13 10859 1 1 2 PRO O O -13.201 3.164 2.249 1.00 . A A . 2 PRO O 1 1 13 10860 1 1 3 LEU C C -14.514 6.332 0.923 1.00 . A A . 3 LEU C 1 1 13 10861 1 1 3 LEU CA C -13.158 5.654 1.077 1.00 . A A . 3 LEU CA 1 1 13 10862 1 1 3 LEU CB C -12.050 6.577 0.563 1.00 . A A . 3 LEU CB 1 1 13 10863 1 1 3 LEU CD1 C -9.619 7.087 0.256 1.00 . A A . 3 LEU CD1 1 1 13 10864 1 1 3 LEU CD2 C -10.343 5.572 2.106 1.00 . A A . 3 LEU CD2 1 1 13 10865 1 1 3 LEU CG C -10.625 6.031 0.683 1.00 . A A . 3 LEU CG 1 1 13 10866 1 1 3 LEU H H -13.115 4.380 -0.613 1.00 . A A . 3 LEU H 1 1 13 10867 1 1 3 LEU HA H -12.988 5.450 2.124 1.00 . A A . 3 LEU HA 1 1 13 10868 1 1 3 LEU HB2 H -12.243 6.787 -0.478 1.00 . A A . 3 LEU HB2 1 1 13 10869 1 1 3 LEU HB3 H -12.102 7.505 1.112 1.00 . A A . 3 LEU HB3 1 1 13 10870 1 1 3 LEU HD11 H -10.028 7.662 -0.562 1.00 . A A . 3 LEU HD11 1 1 13 10871 1 1 3 LEU HD12 H -9.411 7.742 1.088 1.00 . A A . 3 LEU HD12 1 1 13 10872 1 1 3 LEU HD13 H -8.706 6.608 -0.062 1.00 . A A . 3 LEU HD13 1 1 13 10873 1 1 3 LEU HD21 H -9.293 5.338 2.207 1.00 . A A . 3 LEU HD21 1 1 13 10874 1 1 3 LEU HD22 H -10.604 6.360 2.798 1.00 . A A . 3 LEU HD22 1 1 13 10875 1 1 3 LEU HD23 H -10.930 4.692 2.324 1.00 . A A . 3 LEU HD23 1 1 13 10876 1 1 3 LEU HG H -10.513 5.180 0.027 1.00 . A A . 3 LEU HG 1 1 13 10877 1 1 3 LEU N N -13.138 4.383 0.368 1.00 . A A . 3 LEU N 1 1 13 10878 1 1 3 LEU O O -14.668 7.514 1.240 1.00 . A A . 3 LEU O 1 1 13 10879 1 1 4 GLY C C -16.903 7.133 -0.870 1.00 . A A . 4 GLY C 1 1 13 10880 1 1 4 GLY CA C -16.829 6.114 0.251 1.00 . A A . 4 GLY CA 1 1 13 10881 1 1 4 GLY H H -15.309 4.642 0.202 1.00 . A A . 4 GLY H 1 1 13 10882 1 1 4 GLY HA2 H -17.504 5.299 0.029 1.00 . A A . 4 GLY HA2 1 1 13 10883 1 1 4 GLY HA3 H -17.142 6.584 1.171 1.00 . A A . 4 GLY HA3 1 1 13 10884 1 1 4 GLY N N -15.493 5.578 0.431 1.00 . A A . 4 GLY N 1 1 13 10885 1 1 4 GLY O O -17.139 6.783 -2.026 1.00 . A A . 4 GLY O 1 1 13 10886 1 1 5 SER C C -15.480 9.409 -2.423 1.00 . A A . 5 SER C 1 1 13 10887 1 1 5 SER CA C -16.694 9.472 -1.503 1.00 . A A . 5 SER CA 1 1 13 10888 1 1 5 SER CB C -16.720 10.801 -0.763 1.00 . A A . 5 SER CB 1 1 13 10889 1 1 5 SER H H -16.457 8.601 0.404 1.00 . A A . 5 SER H 1 1 13 10890 1 1 5 SER HA H -17.593 9.374 -2.092 1.00 . A A . 5 SER HA 1 1 13 10891 1 1 5 SER HB2 H -15.945 11.445 -1.151 1.00 . A A . 5 SER HB2 1 1 13 10892 1 1 5 SER HB3 H -17.683 11.270 -0.900 1.00 . A A . 5 SER HB3 1 1 13 10893 1 1 5 SER HG H -17.330 10.758 1.106 1.00 . A A . 5 SER HG 1 1 13 10894 1 1 5 SER N N -16.668 8.389 -0.532 1.00 . A A . 5 SER N 1 1 13 10895 1 1 5 SER O O -15.551 9.797 -3.590 1.00 . A A . 5 SER O 1 1 13 10896 1 1 5 SER OG O -16.501 10.600 0.627 1.00 . A A . 5 SER OG 1 1 13 10897 1 1 6 ASP C C -12.904 7.268 -2.985 1.00 . A A . 6 ASP C 1 1 13 10898 1 1 6 ASP CA C -13.157 8.737 -2.674 1.00 . A A . 6 ASP CA 1 1 13 10899 1 1 6 ASP CB C -11.965 9.330 -1.917 1.00 . A A . 6 ASP CB 1 1 13 10900 1 1 6 ASP CG C -10.953 9.991 -2.835 1.00 . A A . 6 ASP CG 1 1 13 10901 1 1 6 ASP H H -14.401 8.561 -0.974 1.00 . A A . 6 ASP H 1 1 13 10902 1 1 6 ASP HA H -13.286 9.273 -3.604 1.00 . A A . 6 ASP HA 1 1 13 10903 1 1 6 ASP HB2 H -12.324 10.072 -1.222 1.00 . A A . 6 ASP HB2 1 1 13 10904 1 1 6 ASP HB3 H -11.467 8.543 -1.371 1.00 . A A . 6 ASP HB3 1 1 13 10905 1 1 6 ASP N N -14.380 8.886 -1.898 1.00 . A A . 6 ASP N 1 1 13 10906 1 1 6 ASP O O -13.488 6.380 -2.358 1.00 . A A . 6 ASP O 1 1 13 10907 1 1 6 ASP OD1 O -10.977 9.719 -4.055 1.00 . A A . 6 ASP OD1 1 1 13 10908 1 1 6 ASP OD2 O -10.126 10.788 -2.341 1.00 . A A . 6 ASP OD2 1 1 13 10909 1 1 7 HIS C C -10.329 5.272 -3.920 1.00 . A A . 7 HIS C 1 1 13 10910 1 1 7 HIS CA C -11.734 5.656 -4.366 1.00 . A A . 7 HIS CA 1 1 13 10911 1 1 7 HIS CB C -11.861 5.507 -5.885 1.00 . A A . 7 HIS CB 1 1 13 10912 1 1 7 HIS CD2 C -11.137 3.521 -7.364 1.00 . A A . 7 HIS CD2 1 1 13 10913 1 1 7 HIS CE1 C -12.373 2.000 -6.417 1.00 . A A . 7 HIS CE1 1 1 13 10914 1 1 7 HIS CG C -11.847 4.085 -6.357 1.00 . A A . 7 HIS CG 1 1 13 10915 1 1 7 HIS H H -11.614 7.769 -4.420 1.00 . A A . 7 HIS H 1 1 13 10916 1 1 7 HIS HA H -12.444 4.996 -3.889 1.00 . A A . 7 HIS HA 1 1 13 10917 1 1 7 HIS HB2 H -12.790 5.955 -6.207 1.00 . A A . 7 HIS HB2 1 1 13 10918 1 1 7 HIS HB3 H -11.038 6.023 -6.356 1.00 . A A . 7 HIS HB3 1 1 13 10919 1 1 7 HIS HD2 H -10.435 4.018 -8.017 1.00 . A A . 7 HIS HD2 1 1 13 10920 1 1 7 HIS HE1 H -12.829 1.048 -6.189 1.00 . A A . 7 HIS HE1 1 1 13 10921 1 1 7 HIS HE2 H -11.280 1.563 -8.128 1.00 . A A . 7 HIS HE2 1 1 13 10922 1 1 7 HIS N N -12.049 7.015 -3.961 1.00 . A A . 7 HIS N 1 1 13 10923 1 1 7 HIS ND1 N -12.624 3.122 -5.762 1.00 . A A . 7 HIS ND1 1 1 13 10924 1 1 7 HIS NE2 N -11.479 2.194 -7.395 1.00 . A A . 7 HIS NE2 1 1 13 10925 1 1 7 HIS O O -10.151 4.382 -3.085 1.00 . A A . 7 HIS O 1 1 13 10926 1 1 8 HIS C C -7.464 6.565 -3.020 1.00 . A A . 8 HIS C 1 1 13 10927 1 1 8 HIS CA C -7.948 5.665 -4.148 1.00 . A A . 8 HIS CA 1 1 13 10928 1 1 8 HIS CB C -7.060 5.848 -5.381 1.00 . A A . 8 HIS CB 1 1 13 10929 1 1 8 HIS CD2 C -5.908 3.817 -6.477 1.00 . A A . 8 HIS CD2 1 1 13 10930 1 1 8 HIS CE1 C -4.272 3.623 -5.053 1.00 . A A . 8 HIS CE1 1 1 13 10931 1 1 8 HIS CG C -6.021 4.780 -5.532 1.00 . A A . 8 HIS CG 1 1 13 10932 1 1 8 HIS H H -9.540 6.666 -5.119 1.00 . A A . 8 HIS H 1 1 13 10933 1 1 8 HIS HA H -7.889 4.638 -3.821 1.00 . A A . 8 HIS HA 1 1 13 10934 1 1 8 HIS HB2 H -7.678 5.838 -6.265 1.00 . A A . 8 HIS HB2 1 1 13 10935 1 1 8 HIS HB3 H -6.553 6.799 -5.311 1.00 . A A . 8 HIS HB3 1 1 13 10936 1 1 8 HIS HD2 H -6.567 3.654 -7.318 1.00 . A A . 8 HIS HD2 1 1 13 10937 1 1 8 HIS HE1 H -3.389 3.254 -4.554 1.00 . A A . 8 HIS HE1 1 1 13 10938 1 1 8 HIS HE2 H -4.560 2.202 -6.540 1.00 . A A . 8 HIS HE2 1 1 13 10939 1 1 8 HIS N N -9.335 5.949 -4.476 1.00 . A A . 8 HIS N 1 1 13 10940 1 1 8 HIS ND1 N -4.985 4.655 -4.638 1.00 . A A . 8 HIS ND1 1 1 13 10941 1 1 8 HIS NE2 N -4.793 3.086 -6.164 1.00 . A A . 8 HIS NE2 1 1 13 10942 1 1 8 HIS O O -8.154 7.500 -2.616 1.00 . A A . 8 HIS O 1 1 13 10943 1 1 9 MET C C -4.384 7.775 -2.014 1.00 . A A . 9 MET C 1 1 13 10944 1 1 9 MET CA C -5.649 7.105 -1.500 1.00 . A A . 9 MET CA 1 1 13 10945 1 1 9 MET CB C -5.314 6.227 -0.291 1.00 . A A . 9 MET CB 1 1 13 10946 1 1 9 MET CE C -6.995 4.184 1.514 1.00 . A A . 9 MET CE 1 1 13 10947 1 1 9 MET CG C -5.950 6.695 1.005 1.00 . A A . 9 MET CG 1 1 13 10948 1 1 9 MET H H -5.727 5.586 -2.968 1.00 . A A . 9 MET H 1 1 13 10949 1 1 9 MET HA H -6.357 7.863 -1.204 1.00 . A A . 9 MET HA 1 1 13 10950 1 1 9 MET HB2 H -5.654 5.221 -0.486 1.00 . A A . 9 MET HB2 1 1 13 10951 1 1 9 MET HB3 H -4.243 6.216 -0.156 1.00 . A A . 9 MET HB3 1 1 13 10952 1 1 9 MET HE1 H -7.121 3.350 2.188 1.00 . A A . 9 MET HE1 1 1 13 10953 1 1 9 MET HE2 H -7.958 4.620 1.295 1.00 . A A . 9 MET HE2 1 1 13 10954 1 1 9 MET HE3 H -6.539 3.840 0.598 1.00 . A A . 9 MET HE3 1 1 13 10955 1 1 9 MET HG2 H -5.401 7.551 1.370 1.00 . A A . 9 MET HG2 1 1 13 10956 1 1 9 MET HG3 H -6.972 6.980 0.806 1.00 . A A . 9 MET HG3 1 1 13 10957 1 1 9 MET N N -6.253 6.308 -2.554 1.00 . A A . 9 MET N 1 1 13 10958 1 1 9 MET O O -3.666 7.211 -2.842 1.00 . A A . 9 MET O 1 1 13 10959 1 1 9 MET SD S -5.942 5.417 2.277 1.00 . A A . 9 MET SD 1 1 13 10960 1 1 10 GLU C C -1.855 9.649 -0.910 1.00 . A A . 10 GLU C 1 1 13 10961 1 1 10 GLU CA C -2.944 9.722 -1.974 1.00 . A A . 10 GLU CA 1 1 13 10962 1 1 10 GLU CB C -3.310 11.179 -2.266 1.00 . A A . 10 GLU CB 1 1 13 10963 1 1 10 GLU CD C -3.966 11.475 -4.686 1.00 . A A . 10 GLU CD 1 1 13 10964 1 1 10 GLU CG C -4.449 11.321 -3.262 1.00 . A A . 10 GLU CG 1 1 13 10965 1 1 10 GLU H H -4.749 9.397 -0.910 1.00 . A A . 10 GLU H 1 1 13 10966 1 1 10 GLU HA H -2.576 9.262 -2.880 1.00 . A A . 10 GLU HA 1 1 13 10967 1 1 10 GLU HB2 H -3.604 11.659 -1.344 1.00 . A A . 10 GLU HB2 1 1 13 10968 1 1 10 GLU HB3 H -2.445 11.685 -2.667 1.00 . A A . 10 GLU HB3 1 1 13 10969 1 1 10 GLU HG2 H -5.073 10.441 -3.202 1.00 . A A . 10 GLU HG2 1 1 13 10970 1 1 10 GLU HG3 H -5.032 12.190 -2.999 1.00 . A A . 10 GLU HG3 1 1 13 10971 1 1 10 GLU N N -4.120 8.980 -1.545 1.00 . A A . 10 GLU N 1 1 13 10972 1 1 10 GLU O O -1.004 10.532 -0.809 1.00 . A A . 10 GLU O 1 1 13 10973 1 1 10 GLU OE1 O -3.122 10.669 -5.131 1.00 . A A . 10 GLU OE1 1 1 13 10974 1 1 10 GLU OE2 O -4.435 12.399 -5.376 1.00 . A A . 10 GLU OE2 1 1 13 10975 1 1 11 PHE C C -1.001 6.932 1.425 1.00 . A A . 11 PHE C 1 1 13 10976 1 1 11 PHE CA C -0.930 8.374 0.955 1.00 . A A . 11 PHE CA 1 1 13 10977 1 1 11 PHE CB C -1.186 9.335 2.126 1.00 . A A . 11 PHE CB 1 1 13 10978 1 1 11 PHE CD1 C -3.662 9.739 2.274 1.00 . A A . 11 PHE CD1 1 1 13 10979 1 1 11 PHE CD2 C -2.627 8.413 3.964 1.00 . A A . 11 PHE CD2 1 1 13 10980 1 1 11 PHE CE1 C -4.885 9.580 2.895 1.00 . A A . 11 PHE CE1 1 1 13 10981 1 1 11 PHE CE2 C -3.848 8.249 4.588 1.00 . A A . 11 PHE CE2 1 1 13 10982 1 1 11 PHE CG C -2.520 9.158 2.799 1.00 . A A . 11 PHE CG 1 1 13 10983 1 1 11 PHE CZ C -4.978 8.832 4.053 1.00 . A A . 11 PHE CZ 1 1 13 10984 1 1 11 PHE H H -2.599 7.919 -0.255 1.00 . A A . 11 PHE H 1 1 13 10985 1 1 11 PHE HA H 0.061 8.553 0.561 1.00 . A A . 11 PHE HA 1 1 13 10986 1 1 11 PHE HB2 H -0.422 9.187 2.874 1.00 . A A . 11 PHE HB2 1 1 13 10987 1 1 11 PHE HB3 H -1.130 10.351 1.763 1.00 . A A . 11 PHE HB3 1 1 13 10988 1 1 11 PHE HD1 H -3.591 10.319 1.365 1.00 . A A . 11 PHE HD1 1 1 13 10989 1 1 11 PHE HD2 H -1.741 7.957 4.384 1.00 . A A . 11 PHE HD2 1 1 13 10990 1 1 11 PHE HE1 H -5.769 10.039 2.474 1.00 . A A . 11 PHE HE1 1 1 13 10991 1 1 11 PHE HE2 H -3.917 7.664 5.493 1.00 . A A . 11 PHE HE2 1 1 13 10992 1 1 11 PHE HZ H -5.934 8.707 4.539 1.00 . A A . 11 PHE HZ 1 1 13 10993 1 1 11 PHE N N -1.896 8.587 -0.117 1.00 . A A . 11 PHE N 1 1 13 10994 1 1 11 PHE O O -2.029 6.272 1.275 1.00 . A A . 11 PHE O 1 1 13 10995 1 1 12 CYS C C -0.580 5.049 3.854 1.00 . A A . 12 CYS C 1 1 13 10996 1 1 12 CYS CA C 0.133 5.097 2.506 1.00 . A A . 12 CYS CA 1 1 13 10997 1 1 12 CYS CB C 1.591 4.628 2.620 1.00 . A A . 12 CYS CB 1 1 13 10998 1 1 12 CYS H H 0.873 7.033 2.102 1.00 . A A . 12 CYS H 1 1 13 10999 1 1 12 CYS HA H -0.391 4.457 1.811 1.00 . A A . 12 CYS HA 1 1 13 11000 1 1 12 CYS HB2 H 1.752 3.812 1.932 1.00 . A A . 12 CYS HB2 1 1 13 11001 1 1 12 CYS HB3 H 2.243 5.449 2.357 1.00 . A A . 12 CYS HB3 1 1 13 11002 1 1 12 CYS HG H 2.820 5.025 4.792 1.00 . A A . 12 CYS HG 1 1 13 11003 1 1 12 CYS N N 0.089 6.448 1.990 1.00 . A A . 12 CYS N 1 1 13 11004 1 1 12 CYS O O -0.249 5.816 4.755 1.00 . A A . 12 CYS O 1 1 13 11005 1 1 12 CYS SG S 2.066 4.058 4.262 1.00 . A A . 12 CYS SG 1 1 13 11006 1 1 13 ARG C C -1.752 3.802 6.381 1.00 . A A . 13 ARG C 1 1 13 11007 1 1 13 ARG CA C -2.506 4.250 5.128 1.00 . A A . 13 ARG CA 1 1 13 11008 1 1 13 ARG CB C -3.733 3.354 4.918 1.00 . A A . 13 ARG CB 1 1 13 11009 1 1 13 ARG CD C -4.721 1.998 3.054 1.00 . A A . 13 ARG CD 1 1 13 11010 1 1 13 ARG CG C -3.515 2.193 3.959 1.00 . A A . 13 ARG CG 1 1 13 11011 1 1 13 ARG CZ C -6.204 0.022 2.932 1.00 . A A . 13 ARG CZ 1 1 13 11012 1 1 13 ARG H H -1.935 3.770 3.136 1.00 . A A . 13 ARG H 1 1 13 11013 1 1 13 ARG HA H -2.846 5.263 5.285 1.00 . A A . 13 ARG HA 1 1 13 11014 1 1 13 ARG HB2 H -4.028 2.946 5.873 1.00 . A A . 13 ARG HB2 1 1 13 11015 1 1 13 ARG HB3 H -4.542 3.960 4.534 1.00 . A A . 13 ARG HB3 1 1 13 11016 1 1 13 ARG HD2 H -5.585 2.439 3.530 1.00 . A A . 13 ARG HD2 1 1 13 11017 1 1 13 ARG HD3 H -4.533 2.503 2.118 1.00 . A A . 13 ARG HD3 1 1 13 11018 1 1 13 ARG HE H -4.266 0.038 2.426 1.00 . A A . 13 ARG HE 1 1 13 11019 1 1 13 ARG HG2 H -2.645 2.397 3.349 1.00 . A A . 13 ARG HG2 1 1 13 11020 1 1 13 ARG HG3 H -3.354 1.292 4.528 1.00 . A A . 13 ARG HG3 1 1 13 11021 1 1 13 ARG HH11 H -7.031 1.633 3.857 1.00 . A A . 13 ARG HH11 1 1 13 11022 1 1 13 ARG HH12 H -8.102 0.279 3.611 1.00 . A A . 13 ARG HH12 1 1 13 11023 1 1 13 ARG HH21 H -5.668 -1.760 2.097 1.00 . A A . 13 ARG HH21 1 1 13 11024 1 1 13 ARG HH22 H -7.321 -1.650 2.635 1.00 . A A . 13 ARG HH22 1 1 13 11025 1 1 13 ARG N N -1.647 4.260 3.937 1.00 . A A . 13 ARG N 1 1 13 11026 1 1 13 ARG NE N -5.003 0.587 2.781 1.00 . A A . 13 ARG NE 1 1 13 11027 1 1 13 ARG NH1 N -7.189 0.697 3.514 1.00 . A A . 13 ARG NH1 1 1 13 11028 1 1 13 ARG NH2 N -6.415 -1.226 2.526 1.00 . A A . 13 ARG NH2 1 1 13 11029 1 1 13 ARG O O -2.202 4.034 7.500 1.00 . A A . 13 ARG O 1 1 13 11030 1 1 14 VAL C C 0.780 3.816 8.132 1.00 . A A . 14 VAL C 1 1 13 11031 1 1 14 VAL CA C 0.187 2.668 7.309 1.00 . A A . 14 VAL CA 1 1 13 11032 1 1 14 VAL CB C 1.330 1.749 6.824 1.00 . A A . 14 VAL CB 1 1 13 11033 1 1 14 VAL CG1 C 2.228 1.332 7.979 1.00 . A A . 14 VAL CG1 1 1 13 11034 1 1 14 VAL CG2 C 0.770 0.522 6.126 1.00 . A A . 14 VAL CG2 1 1 13 11035 1 1 14 VAL H H -0.300 2.999 5.277 1.00 . A A . 14 VAL H 1 1 13 11036 1 1 14 VAL HA H -0.464 2.087 7.945 1.00 . A A . 14 VAL HA 1 1 13 11037 1 1 14 VAL HB H 1.929 2.298 6.112 1.00 . A A . 14 VAL HB 1 1 13 11038 1 1 14 VAL HG11 H 2.773 0.442 7.707 1.00 . A A . 14 VAL HG11 1 1 13 11039 1 1 14 VAL HG12 H 2.924 2.128 8.198 1.00 . A A . 14 VAL HG12 1 1 13 11040 1 1 14 VAL HG13 H 1.623 1.132 8.851 1.00 . A A . 14 VAL HG13 1 1 13 11041 1 1 14 VAL HG21 H 1.448 -0.307 6.258 1.00 . A A . 14 VAL HG21 1 1 13 11042 1 1 14 VAL HG22 H -0.192 0.273 6.551 1.00 . A A . 14 VAL HG22 1 1 13 11043 1 1 14 VAL HG23 H 0.655 0.730 5.073 1.00 . A A . 14 VAL HG23 1 1 13 11044 1 1 14 VAL N N -0.608 3.161 6.189 1.00 . A A . 14 VAL N 1 1 13 11045 1 1 14 VAL O O 0.784 3.764 9.361 1.00 . A A . 14 VAL O 1 1 13 11046 1 1 15 CYS C C 1.460 7.274 7.792 1.00 . A A . 15 CYS C 1 1 13 11047 1 1 15 CYS CA C 2.032 5.898 8.150 1.00 . A A . 15 CYS CA 1 1 13 11048 1 1 15 CYS CB C 3.528 5.840 7.826 1.00 . A A . 15 CYS CB 1 1 13 11049 1 1 15 CYS H H 1.339 4.797 6.479 1.00 . A A . 15 CYS H 1 1 13 11050 1 1 15 CYS HA H 1.902 5.739 9.210 1.00 . A A . 15 CYS HA 1 1 13 11051 1 1 15 CYS HB2 H 4.069 6.397 8.576 1.00 . A A . 15 CYS HB2 1 1 13 11052 1 1 15 CYS HB3 H 3.851 4.809 7.853 1.00 . A A . 15 CYS HB3 1 1 13 11053 1 1 15 CYS N N 1.340 4.818 7.454 1.00 . A A . 15 CYS N 1 1 13 11054 1 1 15 CYS O O 1.949 8.300 8.273 1.00 . A A . 15 CYS O 1 1 13 11055 1 1 15 CYS SG S 3.988 6.522 6.197 1.00 . A A . 15 CYS SG 1 1 13 11056 1 1 16 LYS C C 0.698 9.306 5.485 1.00 . A A . 16 LYS C 1 1 13 11057 1 1 16 LYS CA C -0.194 8.506 6.439 1.00 . A A . 16 LYS CA 1 1 13 11058 1 1 16 LYS CB C -0.634 9.385 7.613 1.00 . A A . 16 LYS CB 1 1 13 11059 1 1 16 LYS CD C -3.024 10.149 7.588 1.00 . A A . 16 LYS CD 1 1 13 11060 1 1 16 LYS CE C -2.986 11.400 8.449 1.00 . A A . 16 LYS CE 1 1 13 11061 1 1 16 LYS CG C -2.047 9.099 8.086 1.00 . A A . 16 LYS CG 1 1 13 11062 1 1 16 LYS H H 0.147 6.422 6.551 1.00 . A A . 16 LYS H 1 1 13 11063 1 1 16 LYS HA H -1.075 8.205 5.894 1.00 . A A . 16 LYS HA 1 1 13 11064 1 1 16 LYS HB2 H 0.041 9.222 8.442 1.00 . A A . 16 LYS HB2 1 1 13 11065 1 1 16 LYS HB3 H -0.578 10.421 7.314 1.00 . A A . 16 LYS HB3 1 1 13 11066 1 1 16 LYS HD2 H -2.765 10.414 6.573 1.00 . A A . 16 LYS HD2 1 1 13 11067 1 1 16 LYS HD3 H -4.021 9.736 7.610 1.00 . A A . 16 LYS HD3 1 1 13 11068 1 1 16 LYS HE2 H -3.989 11.627 8.777 1.00 . A A . 16 LYS HE2 1 1 13 11069 1 1 16 LYS HE3 H -2.360 11.212 9.308 1.00 . A A . 16 LYS HE3 1 1 13 11070 1 1 16 LYS HG2 H -2.352 8.132 7.714 1.00 . A A . 16 LYS HG2 1 1 13 11071 1 1 16 LYS HG3 H -2.060 9.092 9.166 1.00 . A A . 16 LYS HG3 1 1 13 11072 1 1 16 LYS HZ1 H -2.361 12.340 6.688 1.00 . A A . 16 LYS HZ1 1 1 13 11073 1 1 16 LYS HZ2 H -1.499 12.819 8.064 1.00 . A A . 16 LYS HZ2 1 1 13 11074 1 1 16 LYS HZ3 H -3.080 13.390 7.810 1.00 . A A . 16 LYS HZ3 1 1 13 11075 1 1 16 LYS N N 0.459 7.279 6.910 1.00 . A A . 16 LYS N 1 1 13 11076 1 1 16 LYS NZ N -2.445 12.567 7.703 1.00 . A A . 16 LYS NZ 1 1 13 11077 1 1 16 LYS O O 0.273 10.322 4.939 1.00 . A A . 16 LYS O 1 1 13 11078 1 1 17 ASP C C 2.651 9.093 2.945 1.00 . A A . 17 ASP C 1 1 13 11079 1 1 17 ASP CA C 2.868 9.524 4.393 1.00 . A A . 17 ASP CA 1 1 13 11080 1 1 17 ASP CB C 4.308 9.206 4.798 1.00 . A A . 17 ASP CB 1 1 13 11081 1 1 17 ASP CG C 5.192 10.435 4.893 1.00 . A A . 17 ASP CG 1 1 13 11082 1 1 17 ASP H H 2.222 8.043 5.766 1.00 . A A . 17 ASP H 1 1 13 11083 1 1 17 ASP HA H 2.700 10.586 4.474 1.00 . A A . 17 ASP HA 1 1 13 11084 1 1 17 ASP HB2 H 4.300 8.713 5.759 1.00 . A A . 17 ASP HB2 1 1 13 11085 1 1 17 ASP HB3 H 4.734 8.534 4.065 1.00 . A A . 17 ASP HB3 1 1 13 11086 1 1 17 ASP N N 1.928 8.846 5.285 1.00 . A A . 17 ASP N 1 1 13 11087 1 1 17 ASP O O 2.319 7.932 2.677 1.00 . A A . 17 ASP O 1 1 13 11088 1 1 17 ASP OD1 O 4.742 11.532 4.504 1.00 . A A . 17 ASP OD1 1 1 13 11089 1 1 17 ASP OD2 O 6.348 10.307 5.355 1.00 . A A . 17 ASP OD2 1 1 13 11090 1 1 18 GLY C C 4.146 9.637 -0.057 1.00 . A A . 18 GLY C 1 1 13 11091 1 1 18 GLY CA C 2.787 9.694 0.610 1.00 . A A . 18 GLY CA 1 1 13 11092 1 1 18 GLY H H 3.196 10.906 2.299 1.00 . A A . 18 GLY H 1 1 13 11093 1 1 18 GLY HA2 H 2.300 8.734 0.500 1.00 . A A . 18 GLY HA2 1 1 13 11094 1 1 18 GLY HA3 H 2.188 10.452 0.124 1.00 . A A . 18 GLY HA3 1 1 13 11095 1 1 18 GLY N N 2.895 10.009 2.020 1.00 . A A . 18 GLY N 1 1 13 11096 1 1 18 GLY O O 5.151 9.363 0.598 1.00 . A A . 18 GLY O 1 1 13 11097 1 1 19 GLY C C 5.589 8.727 -2.964 1.00 . A A . 19 GLY C 1 1 13 11098 1 1 19 GLY CA C 5.449 9.934 -2.063 1.00 . A A . 19 GLY CA 1 1 13 11099 1 1 19 GLY H H 3.357 10.173 -1.819 1.00 . A A . 19 GLY H 1 1 13 11100 1 1 19 GLY HA2 H 5.513 10.829 -2.663 1.00 . A A . 19 GLY HA2 1 1 13 11101 1 1 19 GLY HA3 H 6.259 9.931 -1.349 1.00 . A A . 19 GLY HA3 1 1 13 11102 1 1 19 GLY N N 4.190 9.936 -1.345 1.00 . A A . 19 GLY N 1 1 13 11103 1 1 19 GLY O O 4.817 8.558 -3.912 1.00 . A A . 19 GLY O 1 1 13 11104 1 1 20 GLU C C 5.662 5.591 -2.935 1.00 . A A . 20 GLU C 1 1 13 11105 1 1 20 GLU CA C 6.706 6.607 -3.367 1.00 . A A . 20 GLU CA 1 1 13 11106 1 1 20 GLU CB C 8.108 6.043 -3.145 1.00 . A A . 20 GLU CB 1 1 13 11107 1 1 20 GLU CD C 10.209 6.947 -2.097 1.00 . A A . 20 GLU CD 1 1 13 11108 1 1 20 GLU CG C 9.202 7.090 -3.215 1.00 . A A . 20 GLU CG 1 1 13 11109 1 1 20 GLU H H 7.059 8.009 -1.817 1.00 . A A . 20 GLU H 1 1 13 11110 1 1 20 GLU HA H 6.573 6.824 -4.416 1.00 . A A . 20 GLU HA 1 1 13 11111 1 1 20 GLU HB2 H 8.146 5.577 -2.171 1.00 . A A . 20 GLU HB2 1 1 13 11112 1 1 20 GLU HB3 H 8.305 5.296 -3.900 1.00 . A A . 20 GLU HB3 1 1 13 11113 1 1 20 GLU HG2 H 9.717 6.994 -4.160 1.00 . A A . 20 GLU HG2 1 1 13 11114 1 1 20 GLU HG3 H 8.751 8.068 -3.149 1.00 . A A . 20 GLU HG3 1 1 13 11115 1 1 20 GLU N N 6.521 7.848 -2.625 1.00 . A A . 20 GLU N 1 1 13 11116 1 1 20 GLU O O 5.867 4.835 -1.985 1.00 . A A . 20 GLU O 1 1 13 11117 1 1 20 GLU OE1 O 10.900 5.906 -2.040 1.00 . A A . 20 GLU OE1 1 1 13 11118 1 1 20 GLU OE2 O 10.321 7.879 -1.272 1.00 . A A . 20 GLU OE2 1 1 13 11119 1 1 21 LEU C C 3.204 3.637 -3.981 1.00 . A A . 21 LEU C 1 1 13 11120 1 1 21 LEU CA C 3.364 4.876 -3.112 1.00 . A A . 21 LEU CA 1 1 13 11121 1 1 21 LEU CB C 2.082 5.709 -3.145 1.00 . A A . 21 LEU CB 1 1 13 11122 1 1 21 LEU CD1 C 2.634 6.078 -0.705 1.00 . A A . 21 LEU CD1 1 1 13 11123 1 1 21 LEU CD2 C 1.068 7.624 -1.890 1.00 . A A . 21 LEU CD2 1 1 13 11124 1 1 21 LEU CG C 1.564 6.192 -1.783 1.00 . A A . 21 LEU CG 1 1 13 11125 1 1 21 LEU H H 4.354 6.383 -4.209 1.00 . A A . 21 LEU H 1 1 13 11126 1 1 21 LEU HA H 3.549 4.561 -2.097 1.00 . A A . 21 LEU HA 1 1 13 11127 1 1 21 LEU HB2 H 2.262 6.575 -3.764 1.00 . A A . 21 LEU HB2 1 1 13 11128 1 1 21 LEU HB3 H 1.307 5.117 -3.606 1.00 . A A . 21 LEU HB3 1 1 13 11129 1 1 21 LEU HD11 H 3.096 5.102 -0.755 1.00 . A A . 21 LEU HD11 1 1 13 11130 1 1 21 LEU HD12 H 3.383 6.838 -0.862 1.00 . A A . 21 LEU HD12 1 1 13 11131 1 1 21 LEU HD13 H 2.181 6.213 0.266 1.00 . A A . 21 LEU HD13 1 1 13 11132 1 1 21 LEU HD21 H 1.596 8.241 -1.180 1.00 . A A . 21 LEU HD21 1 1 13 11133 1 1 21 LEU HD22 H 1.246 7.992 -2.890 1.00 . A A . 21 LEU HD22 1 1 13 11134 1 1 21 LEU HD23 H 0.009 7.656 -1.679 1.00 . A A . 21 LEU HD23 1 1 13 11135 1 1 21 LEU HG H 0.729 5.575 -1.485 1.00 . A A . 21 LEU HG 1 1 13 11136 1 1 21 LEU N N 4.490 5.684 -3.533 1.00 . A A . 21 LEU N 1 1 13 11137 1 1 21 LEU O O 2.584 3.688 -5.046 1.00 . A A . 21 LEU O 1 1 13 11138 1 1 22 LEU C C 1.917 0.800 -3.718 1.00 . A A . 22 LEU C 1 1 13 11139 1 1 22 LEU CA C 3.333 1.227 -4.066 1.00 . A A . 22 LEU CA 1 1 13 11140 1 1 22 LEU CB C 4.337 0.163 -3.613 1.00 . A A . 22 LEU CB 1 1 13 11141 1 1 22 LEU CD1 C 4.161 -1.753 -5.223 1.00 . A A . 22 LEU CD1 1 1 13 11142 1 1 22 LEU CD2 C 4.541 -2.201 -2.791 1.00 . A A . 22 LEU CD2 1 1 13 11143 1 1 22 LEU CG C 3.874 -1.285 -3.806 1.00 . A A . 22 LEU CG 1 1 13 11144 1 1 22 LEU H H 3.954 2.515 -2.515 1.00 . A A . 22 LEU H 1 1 13 11145 1 1 22 LEU HA H 3.408 1.359 -5.136 1.00 . A A . 22 LEU HA 1 1 13 11146 1 1 22 LEU HB2 H 5.253 0.306 -4.168 1.00 . A A . 22 LEU HB2 1 1 13 11147 1 1 22 LEU HB3 H 4.543 0.315 -2.564 1.00 . A A . 22 LEU HB3 1 1 13 11148 1 1 22 LEU HD11 H 4.858 -1.076 -5.694 1.00 . A A . 22 LEU HD11 1 1 13 11149 1 1 22 LEU HD12 H 4.588 -2.746 -5.194 1.00 . A A . 22 LEU HD12 1 1 13 11150 1 1 22 LEU HD13 H 3.241 -1.774 -5.788 1.00 . A A . 22 LEU HD13 1 1 13 11151 1 1 22 LEU HD21 H 3.968 -3.111 -2.697 1.00 . A A . 22 LEU HD21 1 1 13 11152 1 1 22 LEU HD22 H 5.541 -2.437 -3.122 1.00 . A A . 22 LEU HD22 1 1 13 11153 1 1 22 LEU HD23 H 4.585 -1.705 -1.833 1.00 . A A . 22 LEU HD23 1 1 13 11154 1 1 22 LEU HG H 2.806 -1.335 -3.649 1.00 . A A . 22 LEU HG 1 1 13 11155 1 1 22 LEU N N 3.605 2.503 -3.435 1.00 . A A . 22 LEU N 1 1 13 11156 1 1 22 LEU O O 1.583 0.614 -2.549 1.00 . A A . 22 LEU O 1 1 13 11157 1 1 23 CYS C C -0.649 -0.941 -5.096 1.00 . A A . 23 CYS C 1 1 13 11158 1 1 23 CYS CA C -0.331 0.420 -4.501 1.00 . A A . 23 CYS CA 1 1 13 11159 1 1 23 CYS CB C -1.229 1.490 -5.126 1.00 . A A . 23 CYS CB 1 1 13 11160 1 1 23 CYS H H 1.374 0.958 -5.627 1.00 . A A . 23 CYS H 1 1 13 11161 1 1 23 CYS HA H -0.505 0.390 -3.436 1.00 . A A . 23 CYS HA 1 1 13 11162 1 1 23 CYS HB2 H -1.496 1.187 -6.128 1.00 . A A . 23 CYS HB2 1 1 13 11163 1 1 23 CYS HB3 H -2.126 1.584 -4.533 1.00 . A A . 23 CYS HB3 1 1 13 11164 1 1 23 CYS HG H 0.846 2.976 -5.085 1.00 . A A . 23 CYS HG 1 1 13 11165 1 1 23 CYS N N 1.064 0.751 -4.717 1.00 . A A . 23 CYS N 1 1 13 11166 1 1 23 CYS O O -0.038 -1.343 -6.089 1.00 . A A . 23 CYS O 1 1 13 11167 1 1 23 CYS SG S -0.466 3.128 -5.233 1.00 . A A . 23 CYS SG 1 1 13 11168 1 1 24 CYS C C -2.588 -2.847 -6.397 1.00 . A A . 24 CYS C 1 1 13 11169 1 1 24 CYS CA C -2.010 -2.946 -4.981 1.00 . A A . 24 CYS CA 1 1 13 11170 1 1 24 CYS CB C -3.037 -3.517 -4.014 1.00 . A A . 24 CYS CB 1 1 13 11171 1 1 24 CYS H H -2.024 -1.291 -3.676 1.00 . A A . 24 CYS H 1 1 13 11172 1 1 24 CYS HA H -1.146 -3.590 -4.999 1.00 . A A . 24 CYS HA 1 1 13 11173 1 1 24 CYS HB2 H -4.012 -3.487 -4.477 1.00 . A A . 24 CYS HB2 1 1 13 11174 1 1 24 CYS HB3 H -2.780 -4.541 -3.785 1.00 . A A . 24 CYS HB3 1 1 13 11175 1 1 24 CYS N N -1.596 -1.646 -4.493 1.00 . A A . 24 CYS N 1 1 13 11176 1 1 24 CYS O O -2.891 -1.753 -6.881 1.00 . A A . 24 CYS O 1 1 13 11177 1 1 24 CYS SG S -3.133 -2.599 -2.434 1.00 . A A . 24 CYS SG 1 1 13 11178 1 1 25 ASP C C -4.525 -3.576 -8.630 1.00 . A A . 25 ASP C 1 1 13 11179 1 1 25 ASP CA C -3.064 -3.983 -8.494 1.00 . A A . 25 ASP CA 1 1 13 11180 1 1 25 ASP CB C -2.868 -5.365 -9.121 1.00 . A A . 25 ASP CB 1 1 13 11181 1 1 25 ASP CG C -3.332 -5.407 -10.564 1.00 . A A . 25 ASP CG 1 1 13 11182 1 1 25 ASP H H -2.279 -4.798 -6.699 1.00 . A A . 25 ASP H 1 1 13 11183 1 1 25 ASP HA H -2.456 -3.269 -9.029 1.00 . A A . 25 ASP HA 1 1 13 11184 1 1 25 ASP HB2 H -1.824 -5.626 -9.088 1.00 . A A . 25 ASP HB2 1 1 13 11185 1 1 25 ASP HB3 H -3.434 -6.092 -8.558 1.00 . A A . 25 ASP HB3 1 1 13 11186 1 1 25 ASP N N -2.632 -3.974 -7.099 1.00 . A A . 25 ASP N 1 1 13 11187 1 1 25 ASP O O -4.834 -2.469 -9.066 1.00 . A A . 25 ASP O 1 1 13 11188 1 1 25 ASP OD1 O -2.800 -4.634 -11.393 1.00 . A A . 25 ASP OD1 1 1 13 11189 1 1 25 ASP OD2 O -4.248 -6.195 -10.870 1.00 . A A . 25 ASP OD2 1 1 13 11190 1 1 26 THR C C -7.482 -3.819 -7.225 1.00 . A A . 26 THR C 1 1 13 11191 1 1 26 THR CA C -6.841 -4.301 -8.528 1.00 . A A . 26 THR CA 1 1 13 11192 1 1 26 THR CB C -7.516 -5.599 -9.025 1.00 . A A . 26 THR CB 1 1 13 11193 1 1 26 THR CG2 C -7.372 -6.713 -7.994 1.00 . A A . 26 THR CG2 1 1 13 11194 1 1 26 THR H H -5.096 -5.399 -8.075 1.00 . A A . 26 THR H 1 1 13 11195 1 1 26 THR HA H -6.967 -3.539 -9.285 1.00 . A A . 26 THR HA 1 1 13 11196 1 1 26 THR HB H -7.018 -5.914 -9.932 1.00 . A A . 26 THR HB 1 1 13 11197 1 1 26 THR HG1 H -9.036 -4.439 -9.554 1.00 . A A . 26 THR HG1 1 1 13 11198 1 1 26 THR HG21 H -7.937 -6.460 -7.109 1.00 . A A . 26 THR HG21 1 1 13 11199 1 1 26 THR HG22 H -6.327 -6.826 -7.736 1.00 . A A . 26 THR HG22 1 1 13 11200 1 1 26 THR HG23 H -7.743 -7.638 -8.408 1.00 . A A . 26 THR HG23 1 1 13 11201 1 1 26 THR N N -5.413 -4.514 -8.347 1.00 . A A . 26 THR N 1 1 13 11202 1 1 26 THR O O -8.689 -3.578 -7.153 1.00 . A A . 26 THR O 1 1 13 11203 1 1 26 THR OG1 O -8.902 -5.374 -9.322 1.00 . A A . 26 THR OG1 1 1 13 11204 1 1 27 CYS C C -6.530 -1.582 -4.860 1.00 . A A . 27 CYS C 1 1 13 11205 1 1 27 CYS CA C -7.086 -2.999 -4.983 1.00 . A A . 27 CYS CA 1 1 13 11206 1 1 27 CYS CB C -6.657 -3.912 -3.836 1.00 . A A . 27 CYS CB 1 1 13 11207 1 1 27 CYS H H -5.682 -3.674 -6.390 1.00 . A A . 27 CYS H 1 1 13 11208 1 1 27 CYS HA H -8.166 -2.945 -5.010 1.00 . A A . 27 CYS HA 1 1 13 11209 1 1 27 CYS HB2 H -7.301 -4.772 -3.832 1.00 . A A . 27 CYS HB2 1 1 13 11210 1 1 27 CYS HB3 H -5.645 -4.233 -4.015 1.00 . A A . 27 CYS HB3 1 1 13 11211 1 1 27 CYS N N -6.643 -3.565 -6.237 1.00 . A A . 27 CYS N 1 1 13 11212 1 1 27 CYS O O -5.435 -1.294 -5.335 1.00 . A A . 27 CYS O 1 1 13 11213 1 1 27 CYS SG S -6.714 -3.197 -2.161 1.00 . A A . 27 CYS SG 1 1 13 11214 1 1 28 PRO C C -6.448 1.294 -3.190 1.00 . A A . 28 PRO C 1 1 13 11215 1 1 28 PRO CA C -7.085 0.779 -4.474 1.00 . A A . 28 PRO CA 1 1 13 11216 1 1 28 PRO CB C -8.472 1.391 -4.666 1.00 . A A . 28 PRO CB 1 1 13 11217 1 1 28 PRO CD C -8.764 -0.920 -4.036 1.00 . A A . 28 PRO CD 1 1 13 11218 1 1 28 PRO CG C -9.403 0.447 -3.978 1.00 . A A . 28 PRO CG 1 1 13 11219 1 1 28 PRO HA H -6.458 1.035 -5.315 1.00 . A A . 28 PRO HA 1 1 13 11220 1 1 28 PRO HB2 H -8.498 2.374 -4.216 1.00 . A A . 28 PRO HB2 1 1 13 11221 1 1 28 PRO HB3 H -8.695 1.466 -5.720 1.00 . A A . 28 PRO HB3 1 1 13 11222 1 1 28 PRO HD2 H -8.787 -1.396 -3.066 1.00 . A A . 28 PRO HD2 1 1 13 11223 1 1 28 PRO HD3 H -9.260 -1.543 -4.768 1.00 . A A . 28 PRO HD3 1 1 13 11224 1 1 28 PRO HG2 H -9.537 0.749 -2.950 1.00 . A A . 28 PRO HG2 1 1 13 11225 1 1 28 PRO HG3 H -10.354 0.435 -4.490 1.00 . A A . 28 PRO HG3 1 1 13 11226 1 1 28 PRO N N -7.380 -0.651 -4.439 1.00 . A A . 28 PRO N 1 1 13 11227 1 1 28 PRO O O -6.963 2.211 -2.549 1.00 . A A . 28 PRO O 1 1 13 11228 1 1 29 SER C C -3.202 1.360 -1.794 1.00 . A A . 29 SER C 1 1 13 11229 1 1 29 SER CA C -4.680 1.073 -1.566 1.00 . A A . 29 SER CA 1 1 13 11230 1 1 29 SER CB C -4.863 -0.032 -0.538 1.00 . A A . 29 SER CB 1 1 13 11231 1 1 29 SER H H -4.980 -0.053 -3.330 1.00 . A A . 29 SER H 1 1 13 11232 1 1 29 SER HA H -5.156 1.971 -1.204 1.00 . A A . 29 SER HA 1 1 13 11233 1 1 29 SER HB2 H -4.152 -0.822 -0.730 1.00 . A A . 29 SER HB2 1 1 13 11234 1 1 29 SER HB3 H -4.703 0.368 0.451 1.00 . A A . 29 SER HB3 1 1 13 11235 1 1 29 SER HG H -6.234 -1.173 -1.364 1.00 . A A . 29 SER HG 1 1 13 11236 1 1 29 SER N N -5.343 0.691 -2.798 1.00 . A A . 29 SER N 1 1 13 11237 1 1 29 SER O O -2.488 0.567 -2.400 1.00 . A A . 29 SER O 1 1 13 11238 1 1 29 SER OG O -6.176 -0.568 -0.611 1.00 . A A . 29 SER OG 1 1 13 11239 1 1 30 SER C C -0.560 2.681 -0.296 1.00 . A A . 30 SER C 1 1 13 11240 1 1 30 SER CA C -1.393 2.960 -1.544 1.00 . A A . 30 SER CA 1 1 13 11241 1 1 30 SER CB C -1.384 4.449 -1.872 1.00 . A A . 30 SER CB 1 1 13 11242 1 1 30 SER H H -3.397 3.149 -0.936 1.00 . A A . 30 SER H 1 1 13 11243 1 1 30 SER HA H -0.980 2.411 -2.377 1.00 . A A . 30 SER HA 1 1 13 11244 1 1 30 SER HB2 H -0.749 4.968 -1.171 1.00 . A A . 30 SER HB2 1 1 13 11245 1 1 30 SER HB3 H -1.012 4.595 -2.875 1.00 . A A . 30 SER HB3 1 1 13 11246 1 1 30 SER HG H -2.777 5.739 -2.383 1.00 . A A . 30 SER HG 1 1 13 11247 1 1 30 SER N N -2.766 2.531 -1.356 1.00 . A A . 30 SER N 1 1 13 11248 1 1 30 SER O O -1.034 2.846 0.832 1.00 . A A . 30 SER O 1 1 13 11249 1 1 30 SER OG O -2.696 4.983 -1.787 1.00 . A A . 30 SER OG 1 1 13 11250 1 1 31 TYR C C 2.945 2.280 0.363 1.00 . A A . 31 TYR C 1 1 13 11251 1 1 31 TYR CA C 1.519 1.820 0.609 1.00 . A A . 31 TYR CA 1 1 13 11252 1 1 31 TYR CB C 1.520 0.304 0.803 1.00 . A A . 31 TYR CB 1 1 13 11253 1 1 31 TYR CD1 C -0.063 0.070 2.747 1.00 . A A . 31 TYR CD1 1 1 13 11254 1 1 31 TYR CD2 C -0.602 -1.043 0.712 1.00 . A A . 31 TYR CD2 1 1 13 11255 1 1 31 TYR CE1 C -1.214 -0.419 3.326 1.00 . A A . 31 TYR CE1 1 1 13 11256 1 1 31 TYR CE2 C -1.754 -1.536 1.283 1.00 . A A . 31 TYR CE2 1 1 13 11257 1 1 31 TYR CG C 0.262 -0.233 1.433 1.00 . A A . 31 TYR CG 1 1 13 11258 1 1 31 TYR CZ C -2.056 -1.221 2.591 1.00 . A A . 31 TYR CZ 1 1 13 11259 1 1 31 TYR H H 0.950 2.002 -1.419 1.00 . A A . 31 TYR H 1 1 13 11260 1 1 31 TYR HA H 1.143 2.293 1.505 1.00 . A A . 31 TYR HA 1 1 13 11261 1 1 31 TYR HB2 H 1.635 -0.174 -0.158 1.00 . A A . 31 TYR HB2 1 1 13 11262 1 1 31 TYR HB3 H 2.351 0.032 1.437 1.00 . A A . 31 TYR HB3 1 1 13 11263 1 1 31 TYR HD1 H 0.601 0.701 3.320 1.00 . A A . 31 TYR HD1 1 1 13 11264 1 1 31 TYR HD2 H -0.360 -1.288 -0.311 1.00 . A A . 31 TYR HD2 1 1 13 11265 1 1 31 TYR HE1 H -1.450 -0.175 4.351 1.00 . A A . 31 TYR HE1 1 1 13 11266 1 1 31 TYR HE2 H -2.415 -2.166 0.706 1.00 . A A . 31 TYR HE2 1 1 13 11267 1 1 31 TYR HH H -3.660 -2.287 2.518 1.00 . A A . 31 TYR HH 1 1 13 11268 1 1 31 TYR N N 0.652 2.188 -0.498 1.00 . A A . 31 TYR N 1 1 13 11269 1 1 31 TYR O O 3.308 2.649 -0.750 1.00 . A A . 31 TYR O 1 1 13 11270 1 1 31 TYR OH O -3.208 -1.706 3.161 1.00 . A A . 31 TYR OH 1 1 13 11271 1 1 32 HIS C C 5.823 0.842 1.244 1.00 . A A . 32 HIS C 1 1 13 11272 1 1 32 HIS CA C 5.210 2.226 1.202 1.00 . A A . 32 HIS CA 1 1 13 11273 1 1 32 HIS CB C 5.795 3.086 2.321 1.00 . A A . 32 HIS CB 1 1 13 11274 1 1 32 HIS CD2 C 6.132 5.324 1.081 1.00 . A A . 32 HIS CD2 1 1 13 11275 1 1 32 HIS CE1 C 5.117 6.592 2.537 1.00 . A A . 32 HIS CE1 1 1 13 11276 1 1 32 HIS CG C 5.672 4.557 2.101 1.00 . A A . 32 HIS CG 1 1 13 11277 1 1 32 HIS H H 3.449 1.626 2.167 1.00 . A A . 32 HIS H 1 1 13 11278 1 1 32 HIS HA H 5.405 2.683 0.242 1.00 . A A . 32 HIS HA 1 1 13 11279 1 1 32 HIS HB2 H 5.288 2.850 3.245 1.00 . A A . 32 HIS HB2 1 1 13 11280 1 1 32 HIS HB3 H 6.843 2.854 2.427 1.00 . A A . 32 HIS HB3 1 1 13 11281 1 1 32 HIS HD2 H 6.679 4.984 0.212 1.00 . A A . 32 HIS HD2 1 1 13 11282 1 1 32 HIS HE1 H 4.704 7.459 3.027 1.00 . A A . 32 HIS HE1 1 1 13 11283 1 1 32 HIS HE2 H 6.140 7.427 0.926 1.00 . A A . 32 HIS HE2 1 1 13 11284 1 1 32 HIS N N 3.780 2.069 1.361 1.00 . A A . 32 HIS N 1 1 13 11285 1 1 32 HIS ND1 N 5.035 5.365 3.008 1.00 . A A . 32 HIS ND1 1 1 13 11286 1 1 32 HIS NE2 N 5.776 6.621 1.365 1.00 . A A . 32 HIS NE2 1 1 13 11287 1 1 32 HIS O O 5.324 -0.022 1.969 1.00 . A A . 32 HIS O 1 1 13 11288 1 1 33 ILE C C 7.961 -1.171 1.728 1.00 . A A . 33 ILE C 1 1 13 11289 1 1 33 ILE CA C 7.448 -0.724 0.362 1.00 . A A . 33 ILE CA 1 1 13 11290 1 1 33 ILE CB C 8.598 -0.794 -0.670 1.00 . A A . 33 ILE CB 1 1 13 11291 1 1 33 ILE CD1 C 10.676 0.408 -1.534 1.00 . A A . 33 ILE CD1 1 1 13 11292 1 1 33 ILE CG1 C 9.487 0.451 -0.596 1.00 . A A . 33 ILE CG1 1 1 13 11293 1 1 33 ILE CG2 C 8.033 -0.971 -2.070 1.00 . A A . 33 ILE CG2 1 1 13 11294 1 1 33 ILE H H 7.163 1.316 -0.168 1.00 . A A . 33 ILE H 1 1 13 11295 1 1 33 ILE HA H 6.677 -1.413 0.046 1.00 . A A . 33 ILE HA 1 1 13 11296 1 1 33 ILE HB H 9.197 -1.665 -0.444 1.00 . A A . 33 ILE HB 1 1 13 11297 1 1 33 ILE HD11 H 11.162 1.371 -1.545 1.00 . A A . 33 ILE HD11 1 1 13 11298 1 1 33 ILE HD12 H 11.374 -0.344 -1.198 1.00 . A A . 33 ILE HD12 1 1 13 11299 1 1 33 ILE HD13 H 10.337 0.163 -2.531 1.00 . A A . 33 ILE HD13 1 1 13 11300 1 1 33 ILE HG12 H 8.899 1.320 -0.848 1.00 . A A . 33 ILE HG12 1 1 13 11301 1 1 33 ILE HG21 H 8.549 -0.315 -2.755 1.00 . A A . 33 ILE HG21 1 1 13 11302 1 1 33 ILE HG22 H 8.164 -1.995 -2.384 1.00 . A A . 33 ILE HG22 1 1 13 11303 1 1 33 ILE HG23 H 6.980 -0.728 -2.067 1.00 . A A . 33 ILE HG23 1 1 13 11304 1 1 33 ILE N N 6.842 0.601 0.434 1.00 . A A . 33 ILE N 1 1 13 11305 1 1 33 ILE O O 7.933 -2.357 2.049 1.00 . A A . 33 ILE O 1 1 13 11306 1 1 34 HIS C C 7.801 -0.333 4.956 1.00 . A A . 34 HIS C 1 1 13 11307 1 1 34 HIS CA C 8.877 -0.523 3.886 1.00 . A A . 34 HIS CA 1 1 13 11308 1 1 34 HIS CB C 10.090 0.349 4.213 1.00 . A A . 34 HIS CB 1 1 13 11309 1 1 34 HIS CD2 C 11.329 -0.675 6.226 1.00 . A A . 34 HIS CD2 1 1 13 11310 1 1 34 HIS CE1 C 13.004 -1.517 5.124 1.00 . A A . 34 HIS CE1 1 1 13 11311 1 1 34 HIS CG C 11.185 -0.394 4.911 1.00 . A A . 34 HIS CG 1 1 13 11312 1 1 34 HIS H H 8.358 0.724 2.249 1.00 . A A . 34 HIS H 1 1 13 11313 1 1 34 HIS HA H 9.182 -1.558 3.888 1.00 . A A . 34 HIS HA 1 1 13 11314 1 1 34 HIS HB2 H 10.496 0.750 3.296 1.00 . A A . 34 HIS HB2 1 1 13 11315 1 1 34 HIS HB3 H 9.780 1.163 4.851 1.00 . A A . 34 HIS HB3 1 1 13 11316 1 1 34 HIS HD2 H 10.664 -0.386 7.025 1.00 . A A . 34 HIS HD2 1 1 13 11317 1 1 34 HIS HE1 H 13.923 -2.037 4.899 1.00 . A A . 34 HIS HE1 1 1 13 11318 1 1 34 HIS HE2 H 12.733 -1.948 7.133 1.00 . A A . 34 HIS HE2 1 1 13 11319 1 1 34 HIS N N 8.376 -0.215 2.551 1.00 . A A . 34 HIS N 1 1 13 11320 1 1 34 HIS ND1 N 12.245 -0.926 4.221 1.00 . A A . 34 HIS ND1 1 1 13 11321 1 1 34 HIS NE2 N 12.490 -1.393 6.355 1.00 . A A . 34 HIS NE2 1 1 13 11322 1 1 34 HIS O O 8.050 -0.563 6.141 1.00 . A A . 34 HIS O 1 1 13 11323 1 1 35 CYS C C 4.646 -0.991 5.571 1.00 . A A . 35 CYS C 1 1 13 11324 1 1 35 CYS CA C 5.513 0.260 5.500 1.00 . A A . 35 CYS CA 1 1 13 11325 1 1 35 CYS CB C 4.673 1.479 5.123 1.00 . A A . 35 CYS CB 1 1 13 11326 1 1 35 CYS H H 6.447 0.225 3.595 1.00 . A A . 35 CYS H 1 1 13 11327 1 1 35 CYS HA H 5.953 0.428 6.474 1.00 . A A . 35 CYS HA 1 1 13 11328 1 1 35 CYS HB2 H 4.580 1.527 4.050 1.00 . A A . 35 CYS HB2 1 1 13 11329 1 1 35 CYS HB3 H 3.692 1.380 5.563 1.00 . A A . 35 CYS HB3 1 1 13 11330 1 1 35 CYS N N 6.605 0.075 4.551 1.00 . A A . 35 CYS N 1 1 13 11331 1 1 35 CYS O O 3.986 -1.250 6.580 1.00 . A A . 35 CYS O 1 1 13 11332 1 1 35 CYS SG S 5.385 3.058 5.691 1.00 . A A . 35 CYS SG 1 1 13 11333 1 1 36 LEU C C 4.647 -4.030 5.518 1.00 . A A . 36 LEU C 1 1 13 11334 1 1 36 LEU CA C 4.021 -3.078 4.510 1.00 . A A . 36 LEU CA 1 1 13 11335 1 1 36 LEU CB C 4.080 -3.691 3.113 1.00 . A A . 36 LEU CB 1 1 13 11336 1 1 36 LEU CD1 C 4.000 -3.004 0.710 1.00 . A A . 36 LEU CD1 1 1 13 11337 1 1 36 LEU CD2 C 1.882 -3.497 1.940 1.00 . A A . 36 LEU CD2 1 1 13 11338 1 1 36 LEU CG C 3.289 -2.935 2.050 1.00 . A A . 36 LEU CG 1 1 13 11339 1 1 36 LEU H H 5.294 -1.565 3.773 1.00 . A A . 36 LEU H 1 1 13 11340 1 1 36 LEU HA H 2.989 -2.905 4.779 1.00 . A A . 36 LEU HA 1 1 13 11341 1 1 36 LEU HB2 H 5.114 -3.734 2.802 1.00 . A A . 36 LEU HB2 1 1 13 11342 1 1 36 LEU HB3 H 3.696 -4.699 3.168 1.00 . A A . 36 LEU HB3 1 1 13 11343 1 1 36 LEU HD11 H 3.696 -3.900 0.191 1.00 . A A . 36 LEU HD11 1 1 13 11344 1 1 36 LEU HD12 H 3.737 -2.138 0.119 1.00 . A A . 36 LEU HD12 1 1 13 11345 1 1 36 LEU HD13 H 5.067 -3.022 0.868 1.00 . A A . 36 LEU HD13 1 1 13 11346 1 1 36 LEU HD21 H 1.523 -3.765 2.923 1.00 . A A . 36 LEU HD21 1 1 13 11347 1 1 36 LEU HD22 H 1.230 -2.752 1.509 1.00 . A A . 36 LEU HD22 1 1 13 11348 1 1 36 LEU HD23 H 1.894 -4.374 1.310 1.00 . A A . 36 LEU HD23 1 1 13 11349 1 1 36 LEU HG H 3.218 -1.898 2.338 1.00 . A A . 36 LEU HG 1 1 13 11350 1 1 36 LEU N N 4.714 -1.803 4.528 1.00 . A A . 36 LEU N 1 1 13 11351 1 1 36 LEU O O 5.811 -3.867 5.890 1.00 . A A . 36 LEU O 1 1 13 11352 1 1 37 ARG C C 5.609 -6.684 6.454 1.00 . A A . 37 ARG C 1 1 13 11353 1 1 37 ARG CA C 4.347 -5.972 6.953 1.00 . A A . 37 ARG CA 1 1 13 11354 1 1 37 ARG CB C 3.247 -6.977 7.299 1.00 . A A . 37 ARG CB 1 1 13 11355 1 1 37 ARG CD C 3.491 -8.679 9.129 1.00 . A A . 37 ARG CD 1 1 13 11356 1 1 37 ARG CG C 3.126 -7.246 8.787 1.00 . A A . 37 ARG CG 1 1 13 11357 1 1 37 ARG CZ C 5.165 -9.883 7.775 1.00 . A A . 37 ARG CZ 1 1 13 11358 1 1 37 ARG H H 2.940 -5.061 5.654 1.00 . A A . 37 ARG H 1 1 13 11359 1 1 37 ARG HA H 4.604 -5.424 7.848 1.00 . A A . 37 ARG HA 1 1 13 11360 1 1 37 ARG HB2 H 2.301 -6.597 6.944 1.00 . A A . 37 ARG HB2 1 1 13 11361 1 1 37 ARG HB3 H 3.459 -7.913 6.802 1.00 . A A . 37 ARG HB3 1 1 13 11362 1 1 37 ARG HD2 H 3.389 -8.816 10.195 1.00 . A A . 37 ARG HD2 1 1 13 11363 1 1 37 ARG HD3 H 2.808 -9.341 8.616 1.00 . A A . 37 ARG HD3 1 1 13 11364 1 1 37 ARG HE H 5.591 -8.560 9.221 1.00 . A A . 37 ARG HE 1 1 13 11365 1 1 37 ARG HG2 H 3.788 -6.579 9.320 1.00 . A A . 37 ARG HG2 1 1 13 11366 1 1 37 ARG HG3 H 2.106 -7.061 9.092 1.00 . A A . 37 ARG HG3 1 1 13 11367 1 1 37 ARG HH11 H 3.231 -10.335 7.331 1.00 . A A . 37 ARG HH11 1 1 13 11368 1 1 37 ARG HH12 H 4.438 -11.170 6.388 1.00 . A A . 37 ARG HH12 1 1 13 11369 1 1 37 ARG HH21 H 7.173 -9.648 7.964 1.00 . A A . 37 ARG HH21 1 1 13 11370 1 1 37 ARG HH22 H 6.659 -10.789 6.752 1.00 . A A . 37 ARG HH22 1 1 13 11371 1 1 37 ARG N N 3.869 -5.002 5.974 1.00 . A A . 37 ARG N 1 1 13 11372 1 1 37 ARG NE N 4.859 -9.012 8.736 1.00 . A A . 37 ARG NE 1 1 13 11373 1 1 37 ARG NH1 N 4.203 -10.512 7.112 1.00 . A A . 37 ARG NH1 1 1 13 11374 1 1 37 ARG NH2 N 6.433 -10.125 7.469 1.00 . A A . 37 ARG NH2 1 1 13 11375 1 1 37 ARG O O 6.668 -6.556 7.070 1.00 . A A . 37 ARG O 1 1 13 11376 1 1 38 PRO C C 7.506 -6.875 3.860 1.00 . A A . 38 PRO C 1 1 13 11377 1 1 38 PRO CA C 6.756 -7.922 4.677 1.00 . A A . 38 PRO CA 1 1 13 11378 1 1 38 PRO CB C 6.197 -9.032 3.783 1.00 . A A . 38 PRO CB 1 1 13 11379 1 1 38 PRO CD C 4.410 -7.488 4.377 1.00 . A A . 38 PRO CD 1 1 13 11380 1 1 38 PRO CG C 4.781 -8.645 3.477 1.00 . A A . 38 PRO CG 1 1 13 11381 1 1 38 PRO HA H 7.419 -8.344 5.420 1.00 . A A . 38 PRO HA 1 1 13 11382 1 1 38 PRO HB2 H 6.789 -9.098 2.881 1.00 . A A . 38 PRO HB2 1 1 13 11383 1 1 38 PRO HB3 H 6.238 -9.972 4.311 1.00 . A A . 38 PRO HB3 1 1 13 11384 1 1 38 PRO HD2 H 4.267 -6.590 3.795 1.00 . A A . 38 PRO HD2 1 1 13 11385 1 1 38 PRO HD3 H 3.515 -7.721 4.936 1.00 . A A . 38 PRO HD3 1 1 13 11386 1 1 38 PRO HG2 H 4.704 -8.343 2.444 1.00 . A A . 38 PRO HG2 1 1 13 11387 1 1 38 PRO HG3 H 4.128 -9.486 3.666 1.00 . A A . 38 PRO HG3 1 1 13 11388 1 1 38 PRO N N 5.567 -7.348 5.277 1.00 . A A . 38 PRO N 1 1 13 11389 1 1 38 PRO O O 7.351 -6.796 2.640 1.00 . A A . 38 PRO O 1 1 13 11390 1 1 39 ALA C C 9.704 -5.203 2.782 1.00 . A A . 39 ALA C 1 1 13 11391 1 1 39 ALA CA C 8.828 -4.815 3.967 1.00 . A A . 39 ALA CA 1 1 13 11392 1 1 39 ALA CB C 9.651 -4.069 5.005 1.00 . A A . 39 ALA CB 1 1 13 11393 1 1 39 ALA H H 8.146 -6.034 5.553 1.00 . A A . 39 ALA H 1 1 13 11394 1 1 39 ALA HA H 8.054 -4.149 3.619 1.00 . A A . 39 ALA HA 1 1 13 11395 1 1 39 ALA HB1 H 9.002 -3.706 5.788 1.00 . A A . 39 ALA HB1 1 1 13 11396 1 1 39 ALA HB2 H 10.389 -4.734 5.428 1.00 . A A . 39 ALA HB2 1 1 13 11397 1 1 39 ALA HB3 H 10.150 -3.234 4.535 1.00 . A A . 39 ALA HB3 1 1 13 11398 1 1 39 ALA N N 8.177 -5.972 4.574 1.00 . A A . 39 ALA N 1 1 13 11399 1 1 39 ALA O O 10.562 -6.085 2.883 1.00 . A A . 39 ALA O 1 1 13 11400 1 1 40 LEU C C 11.334 -3.706 0.309 1.00 . A A . 40 LEU C 1 1 13 11401 1 1 40 LEU CA C 10.246 -4.757 0.457 1.00 . A A . 40 LEU CA 1 1 13 11402 1 1 40 LEU CB C 9.321 -4.723 -0.762 1.00 . A A . 40 LEU CB 1 1 13 11403 1 1 40 LEU CD1 C 6.897 -5.336 -0.885 1.00 . A A . 40 LEU CD1 1 1 13 11404 1 1 40 LEU CD2 C 8.599 -6.726 -2.078 1.00 . A A . 40 LEU CD2 1 1 13 11405 1 1 40 LEU CG C 8.319 -5.872 -0.851 1.00 . A A . 40 LEU CG 1 1 13 11406 1 1 40 LEU H H 8.811 -3.804 1.676 1.00 . A A . 40 LEU H 1 1 13 11407 1 1 40 LEU HA H 10.704 -5.732 0.531 1.00 . A A . 40 LEU HA 1 1 13 11408 1 1 40 LEU HB2 H 8.771 -3.794 -0.741 1.00 . A A . 40 LEU HB2 1 1 13 11409 1 1 40 LEU HB3 H 9.934 -4.739 -1.651 1.00 . A A . 40 LEU HB3 1 1 13 11410 1 1 40 LEU HD11 H 6.914 -4.264 -0.758 1.00 . A A . 40 LEU HD11 1 1 13 11411 1 1 40 LEU HD12 H 6.445 -5.578 -1.835 1.00 . A A . 40 LEU HD12 1 1 13 11412 1 1 40 LEU HD13 H 6.323 -5.784 -0.087 1.00 . A A . 40 LEU HD13 1 1 13 11413 1 1 40 LEU HD21 H 9.657 -6.710 -2.294 1.00 . A A . 40 LEU HD21 1 1 13 11414 1 1 40 LEU HD22 H 8.285 -7.741 -1.888 1.00 . A A . 40 LEU HD22 1 1 13 11415 1 1 40 LEU HD23 H 8.053 -6.331 -2.923 1.00 . A A . 40 LEU HD23 1 1 13 11416 1 1 40 LEU HG H 8.420 -6.498 0.024 1.00 . A A . 40 LEU HG 1 1 13 11417 1 1 40 LEU N N 9.487 -4.522 1.670 1.00 . A A . 40 LEU N 1 1 13 11418 1 1 40 LEU O O 11.107 -2.524 0.564 1.00 . A A . 40 LEU O 1 1 13 11419 1 1 41 TYR C C 13.620 -2.632 -1.679 1.00 . A A . 41 TYR C 1 1 13 11420 1 1 41 TYR CA C 13.640 -3.230 -0.279 1.00 . A A . 41 TYR CA 1 1 13 11421 1 1 41 TYR CB C 14.959 -3.958 -0.029 1.00 . A A . 41 TYR CB 1 1 13 11422 1 1 41 TYR CD1 C 15.473 -3.111 2.290 1.00 . A A . 41 TYR CD1 1 1 13 11423 1 1 41 TYR CD2 C 15.305 -5.465 1.964 1.00 . A A . 41 TYR CD2 1 1 13 11424 1 1 41 TYR CE1 C 15.741 -3.310 3.629 1.00 . A A . 41 TYR CE1 1 1 13 11425 1 1 41 TYR CE2 C 15.572 -5.674 3.303 1.00 . A A . 41 TYR CE2 1 1 13 11426 1 1 41 TYR CG C 15.252 -4.183 1.435 1.00 . A A . 41 TYR CG 1 1 13 11427 1 1 41 TYR CZ C 15.789 -4.593 4.130 1.00 . A A . 41 TYR CZ 1 1 13 11428 1 1 41 TYR H H 12.641 -5.100 -0.269 1.00 . A A . 41 TYR H 1 1 13 11429 1 1 41 TYR HA H 13.539 -2.430 0.441 1.00 . A A . 41 TYR HA 1 1 13 11430 1 1 41 TYR HB2 H 14.929 -4.922 -0.515 1.00 . A A . 41 TYR HB2 1 1 13 11431 1 1 41 TYR HB3 H 15.769 -3.374 -0.445 1.00 . A A . 41 TYR HB3 1 1 13 11432 1 1 41 TYR HD1 H 15.432 -2.107 1.894 1.00 . A A . 41 TYR HD1 1 1 13 11433 1 1 41 TYR HD2 H 15.136 -6.311 1.312 1.00 . A A . 41 TYR HD2 1 1 13 11434 1 1 41 TYR HE1 H 15.912 -2.463 4.278 1.00 . A A . 41 TYR HE1 1 1 13 11435 1 1 41 TYR HE2 H 15.607 -6.677 3.697 1.00 . A A . 41 TYR HE2 1 1 13 11436 1 1 41 TYR HH H 15.822 -5.705 5.707 1.00 . A A . 41 TYR HH 1 1 13 11437 1 1 41 TYR N N 12.517 -4.139 -0.096 1.00 . A A . 41 TYR N 1 1 13 11438 1 1 41 TYR O O 14.201 -1.573 -1.925 1.00 . A A . 41 TYR O 1 1 13 11439 1 1 41 TYR OH O 16.054 -4.794 5.465 1.00 . A A . 41 TYR OH 1 1 13 11440 1 1 42 GLU C C 11.276 -2.802 -4.313 1.00 . A A . 42 GLU C 1 1 13 11441 1 1 42 GLU CA C 12.749 -2.808 -3.937 1.00 . A A . 42 GLU CA 1 1 13 11442 1 1 42 GLU CB C 13.535 -3.685 -4.911 1.00 . A A . 42 GLU CB 1 1 13 11443 1 1 42 GLU CD C 15.296 -2.821 -6.494 1.00 . A A . 42 GLU CD 1 1 13 11444 1 1 42 GLU CG C 14.983 -3.262 -5.081 1.00 . A A . 42 GLU CG 1 1 13 11445 1 1 42 GLU H H 12.442 -4.115 -2.308 1.00 . A A . 42 GLU H 1 1 13 11446 1 1 42 GLU HA H 13.128 -1.799 -3.980 1.00 . A A . 42 GLU HA 1 1 13 11447 1 1 42 GLU HB2 H 13.521 -4.703 -4.552 1.00 . A A . 42 GLU HB2 1 1 13 11448 1 1 42 GLU HB3 H 13.056 -3.648 -5.878 1.00 . A A . 42 GLU HB3 1 1 13 11449 1 1 42 GLU HG2 H 15.188 -2.441 -4.409 1.00 . A A . 42 GLU HG2 1 1 13 11450 1 1 42 GLU HG3 H 15.620 -4.098 -4.831 1.00 . A A . 42 GLU HG3 1 1 13 11451 1 1 42 GLU N N 12.909 -3.293 -2.577 1.00 . A A . 42 GLU N 1 1 13 11452 1 1 42 GLU O O 10.496 -3.604 -3.795 1.00 . A A . 42 GLU O 1 1 13 11453 1 1 42 GLU OE1 O 15.258 -3.670 -7.409 1.00 . A A . 42 GLU OE1 1 1 13 11454 1 1 42 GLU OE2 O 15.582 -1.619 -6.699 1.00 . A A . 42 GLU OE2 1 1 13 11455 1 1 43 VAL C C 9.133 -2.963 -6.517 1.00 . A A . 43 VAL C 1 1 13 11456 1 1 43 VAL CA C 9.508 -1.785 -5.620 1.00 . A A . 43 VAL CA 1 1 13 11457 1 1 43 VAL CB C 9.247 -0.459 -6.370 1.00 . A A . 43 VAL CB 1 1 13 11458 1 1 43 VAL CG1 C 7.777 -0.324 -6.745 1.00 . A A . 43 VAL CG1 1 1 13 11459 1 1 43 VAL CG2 C 9.696 0.729 -5.532 1.00 . A A . 43 VAL CG2 1 1 13 11460 1 1 43 VAL H H 11.565 -1.277 -5.574 1.00 . A A . 43 VAL H 1 1 13 11461 1 1 43 VAL HA H 8.887 -1.806 -4.737 1.00 . A A . 43 VAL HA 1 1 13 11462 1 1 43 VAL HB H 9.826 -0.467 -7.281 1.00 . A A . 43 VAL HB 1 1 13 11463 1 1 43 VAL HG11 H 7.164 -0.488 -5.871 1.00 . A A . 43 VAL HG11 1 1 13 11464 1 1 43 VAL HG12 H 7.595 0.666 -7.133 1.00 . A A . 43 VAL HG12 1 1 13 11465 1 1 43 VAL HG13 H 7.530 -1.057 -7.500 1.00 . A A . 43 VAL HG13 1 1 13 11466 1 1 43 VAL HG21 H 8.923 1.485 -5.535 1.00 . A A . 43 VAL HG21 1 1 13 11467 1 1 43 VAL HG22 H 9.881 0.408 -4.518 1.00 . A A . 43 VAL HG22 1 1 13 11468 1 1 43 VAL HG23 H 10.602 1.140 -5.951 1.00 . A A . 43 VAL HG23 1 1 13 11469 1 1 43 VAL N N 10.894 -1.892 -5.194 1.00 . A A . 43 VAL N 1 1 13 11470 1 1 43 VAL O O 9.782 -3.206 -7.536 1.00 . A A . 43 VAL O 1 1 13 11471 1 1 44 PRO C C 7.337 -4.684 -8.278 1.00 . A A . 44 PRO C 1 1 13 11472 1 1 44 PRO CA C 7.699 -4.960 -6.821 1.00 . A A . 44 PRO CA 1 1 13 11473 1 1 44 PRO CB C 6.460 -5.419 -6.050 1.00 . A A . 44 PRO CB 1 1 13 11474 1 1 44 PRO CD C 7.378 -3.571 -4.843 1.00 . A A . 44 PRO CD 1 1 13 11475 1 1 44 PRO CG C 6.639 -4.870 -4.679 1.00 . A A . 44 PRO CG 1 1 13 11476 1 1 44 PRO HA H 8.455 -5.729 -6.781 1.00 . A A . 44 PRO HA 1 1 13 11477 1 1 44 PRO HB2 H 5.574 -5.024 -6.522 1.00 . A A . 44 PRO HB2 1 1 13 11478 1 1 44 PRO HB3 H 6.420 -6.498 -6.038 1.00 . A A . 44 PRO HB3 1 1 13 11479 1 1 44 PRO HD2 H 6.682 -2.748 -4.925 1.00 . A A . 44 PRO HD2 1 1 13 11480 1 1 44 PRO HD3 H 8.050 -3.415 -4.012 1.00 . A A . 44 PRO HD3 1 1 13 11481 1 1 44 PRO HG2 H 5.674 -4.697 -4.225 1.00 . A A . 44 PRO HG2 1 1 13 11482 1 1 44 PRO HG3 H 7.218 -5.557 -4.080 1.00 . A A . 44 PRO HG3 1 1 13 11483 1 1 44 PRO N N 8.128 -3.754 -6.099 1.00 . A A . 44 PRO N 1 1 13 11484 1 1 44 PRO O O 6.864 -3.598 -8.624 1.00 . A A . 44 PRO O 1 1 13 11485 1 1 45 ASP C C 6.175 -6.420 -10.989 1.00 . A A . 45 ASP C 1 1 13 11486 1 1 45 ASP CA C 7.338 -5.534 -10.555 1.00 . A A . 45 ASP CA 1 1 13 11487 1 1 45 ASP CB C 8.598 -5.900 -11.351 1.00 . A A . 45 ASP CB 1 1 13 11488 1 1 45 ASP CG C 8.293 -6.398 -12.753 1.00 . A A . 45 ASP CG 1 1 13 11489 1 1 45 ASP H H 7.992 -6.500 -8.788 1.00 . A A . 45 ASP H 1 1 13 11490 1 1 45 ASP HA H 7.086 -4.502 -10.755 1.00 . A A . 45 ASP HA 1 1 13 11491 1 1 45 ASP HB2 H 9.227 -5.027 -11.432 1.00 . A A . 45 ASP HB2 1 1 13 11492 1 1 45 ASP HB3 H 9.132 -6.675 -10.821 1.00 . A A . 45 ASP HB3 1 1 13 11493 1 1 45 ASP N N 7.593 -5.665 -9.129 1.00 . A A . 45 ASP N 1 1 13 11494 1 1 45 ASP O O 6.117 -7.598 -10.631 1.00 . A A . 45 ASP O 1 1 13 11495 1 1 45 ASP OD1 O 8.105 -5.560 -13.658 1.00 . A A . 45 ASP OD1 1 1 13 11496 1 1 45 ASP OD2 O 8.235 -7.631 -12.955 1.00 . A A . 45 ASP OD2 1 1 13 11497 1 1 46 GLY C C 3.154 -7.021 -11.455 1.00 . A A . 46 GLY C 1 1 13 11498 1 1 46 GLY CA C 4.250 -6.653 -12.434 1.00 . A A . 46 GLY CA 1 1 13 11499 1 1 46 GLY H H 5.473 -4.949 -12.147 1.00 . A A . 46 GLY H 1 1 13 11500 1 1 46 GLY HA2 H 3.813 -6.082 -13.237 1.00 . A A . 46 GLY HA2 1 1 13 11501 1 1 46 GLY HA3 H 4.669 -7.561 -12.841 1.00 . A A . 46 GLY HA3 1 1 13 11502 1 1 46 GLY N N 5.319 -5.875 -11.842 1.00 . A A . 46 GLY N 1 1 13 11503 1 1 46 GLY O O 2.322 -6.187 -11.098 1.00 . A A . 46 GLY O 1 1 13 11504 1 1 47 GLU C C 2.280 -8.450 -8.790 1.00 . A A . 47 GLU C 1 1 13 11505 1 1 47 GLU CA C 2.026 -8.800 -10.249 1.00 . A A . 47 GLU CA 1 1 13 11506 1 1 47 GLU CB C 1.900 -10.317 -10.390 1.00 . A A . 47 GLU CB 1 1 13 11507 1 1 47 GLU CD C 3.719 -11.460 -11.683 1.00 . A A . 47 GLU CD 1 1 13 11508 1 1 47 GLU CG C 2.338 -10.849 -11.744 1.00 . A A . 47 GLU CG 1 1 13 11509 1 1 47 GLU H H 3.748 -8.928 -11.472 1.00 . A A . 47 GLU H 1 1 13 11510 1 1 47 GLU HA H 1.101 -8.339 -10.562 1.00 . A A . 47 GLU HA 1 1 13 11511 1 1 47 GLU HB2 H 2.506 -10.788 -9.631 1.00 . A A . 47 GLU HB2 1 1 13 11512 1 1 47 GLU HB3 H 0.867 -10.596 -10.237 1.00 . A A . 47 GLU HB3 1 1 13 11513 1 1 47 GLU HG2 H 1.637 -11.604 -12.065 1.00 . A A . 47 GLU HG2 1 1 13 11514 1 1 47 GLU HG3 H 2.346 -10.035 -12.454 1.00 . A A . 47 GLU HG3 1 1 13 11515 1 1 47 GLU N N 3.093 -8.295 -11.101 1.00 . A A . 47 GLU N 1 1 13 11516 1 1 47 GLU O O 3.362 -8.714 -8.261 1.00 . A A . 47 GLU O 1 1 13 11517 1 1 47 GLU OE1 O 3.838 -12.618 -11.234 1.00 . A A . 47 GLU OE1 1 1 13 11518 1 1 47 GLU OE2 O 4.697 -10.776 -12.057 1.00 . A A . 47 GLU OE2 1 1 13 11519 1 1 48 TRP C C -0.071 -7.498 -6.113 1.00 . A A . 48 TRP C 1 1 13 11520 1 1 48 TRP CA C 1.323 -7.676 -6.700 1.00 . A A . 48 TRP CA 1 1 13 11521 1 1 48 TRP CB C 2.176 -6.439 -6.400 1.00 . A A . 48 TRP CB 1 1 13 11522 1 1 48 TRP CD1 C 3.611 -6.973 -4.345 1.00 . A A . 48 TRP CD1 1 1 13 11523 1 1 48 TRP CD2 C 1.883 -5.614 -3.928 1.00 . A A . 48 TRP CD2 1 1 13 11524 1 1 48 TRP CE2 C 2.577 -5.836 -2.727 1.00 . A A . 48 TRP CE2 1 1 13 11525 1 1 48 TRP CE3 C 0.756 -4.789 -3.913 1.00 . A A . 48 TRP CE3 1 1 13 11526 1 1 48 TRP CG C 2.561 -6.349 -4.954 1.00 . A A . 48 TRP CG 1 1 13 11527 1 1 48 TRP CH2 C 1.076 -4.458 -1.536 1.00 . A A . 48 TRP CH2 1 1 13 11528 1 1 48 TRP CZ2 C 2.182 -5.262 -1.520 1.00 . A A . 48 TRP CZ2 1 1 13 11529 1 1 48 TRP CZ3 C 0.365 -4.218 -2.716 1.00 . A A . 48 TRP CZ3 1 1 13 11530 1 1 48 TRP H H 0.390 -7.839 -8.583 1.00 . A A . 48 TRP H 1 1 13 11531 1 1 48 TRP HA H 1.780 -8.533 -6.232 1.00 . A A . 48 TRP HA 1 1 13 11532 1 1 48 TRP HB2 H 3.082 -6.476 -6.988 1.00 . A A . 48 TRP HB2 1 1 13 11533 1 1 48 TRP HB3 H 1.619 -5.550 -6.655 1.00 . A A . 48 TRP HB3 1 1 13 11534 1 1 48 TRP HD1 H 4.317 -7.610 -4.853 1.00 . A A . 48 TRP HD1 1 1 13 11535 1 1 48 TRP HE1 H 4.287 -6.997 -2.353 1.00 . A A . 48 TRP HE1 1 1 13 11536 1 1 48 TRP HE3 H 0.196 -4.593 -4.815 1.00 . A A . 48 TRP HE3 1 1 13 11537 1 1 48 TRP HH2 H 0.731 -3.994 -0.623 1.00 . A A . 48 TRP HH2 1 1 13 11538 1 1 48 TRP HZ2 H 2.718 -5.436 -0.600 1.00 . A A . 48 TRP HZ2 1 1 13 11539 1 1 48 TRP HZ3 H -0.503 -3.575 -2.685 1.00 . A A . 48 TRP HZ3 1 1 13 11540 1 1 48 TRP N N 1.251 -7.947 -8.125 1.00 . A A . 48 TRP N 1 1 13 11541 1 1 48 TRP NE1 N 3.629 -6.667 -3.005 1.00 . A A . 48 TRP NE1 1 1 13 11542 1 1 48 TRP O O -0.835 -6.622 -6.532 1.00 . A A . 48 TRP O 1 1 13 11543 1 1 49 GLN C C -1.286 -8.108 -2.853 1.00 . A A . 49 GLN C 1 1 13 11544 1 1 49 GLN CA C -1.594 -8.128 -4.339 1.00 . A A . 49 GLN CA 1 1 13 11545 1 1 49 GLN CB C -2.575 -9.254 -4.678 1.00 . A A . 49 GLN CB 1 1 13 11546 1 1 49 GLN CD C -4.816 -8.119 -5.029 1.00 . A A . 49 GLN CD 1 1 13 11547 1 1 49 GLN CG C -3.646 -8.840 -5.678 1.00 . A A . 49 GLN CG 1 1 13 11548 1 1 49 GLN H H 0.333 -8.885 -4.740 1.00 . A A . 49 GLN H 1 1 13 11549 1 1 49 GLN HA H -2.036 -7.182 -4.614 1.00 . A A . 49 GLN HA 1 1 13 11550 1 1 49 GLN HB2 H -2.023 -10.084 -5.095 1.00 . A A . 49 GLN HB2 1 1 13 11551 1 1 49 GLN HB3 H -3.063 -9.576 -3.771 1.00 . A A . 49 GLN HB3 1 1 13 11552 1 1 49 GLN HE21 H -3.670 -6.546 -4.620 1.00 . A A . 49 GLN HE21 1 1 13 11553 1 1 49 GLN HE22 H -5.313 -6.432 -4.097 1.00 . A A . 49 GLN HE22 1 1 13 11554 1 1 49 GLN HG2 H -3.201 -8.183 -6.410 1.00 . A A . 49 GLN HG2 1 1 13 11555 1 1 49 GLN HG3 H -4.018 -9.728 -6.170 1.00 . A A . 49 GLN HG3 1 1 13 11556 1 1 49 GLN N N -0.356 -8.269 -5.080 1.00 . A A . 49 GLN N 1 1 13 11557 1 1 49 GLN NE2 N -4.577 -6.909 -4.538 1.00 . A A . 49 GLN NE2 1 1 13 11558 1 1 49 GLN O O -0.222 -8.564 -2.431 1.00 . A A . 49 GLN O 1 1 13 11559 1 1 49 GLN OE1 O -5.932 -8.641 -4.984 1.00 . A A . 49 GLN OE1 1 1 13 11560 1 1 50 CYS C C -1.923 -8.495 0.132 1.00 . A A . 50 CYS C 1 1 13 11561 1 1 50 CYS CA C -1.867 -7.209 -0.693 1.00 . A A . 50 CYS CA 1 1 13 11562 1 1 50 CYS CB C -2.887 -6.215 -0.181 1.00 . A A . 50 CYS CB 1 1 13 11563 1 1 50 CYS H H -2.907 -7.001 -2.503 1.00 . A A . 50 CYS H 1 1 13 11564 1 1 50 CYS HA H -0.881 -6.776 -0.605 1.00 . A A . 50 CYS HA 1 1 13 11565 1 1 50 CYS HB2 H -3.310 -6.585 0.742 1.00 . A A . 50 CYS HB2 1 1 13 11566 1 1 50 CYS HB3 H -2.394 -5.271 0.006 1.00 . A A . 50 CYS HB3 1 1 13 11567 1 1 50 CYS N N -2.132 -7.445 -2.092 1.00 . A A . 50 CYS N 1 1 13 11568 1 1 50 CYS O O -2.724 -9.394 -0.140 1.00 . A A . 50 CYS O 1 1 13 11569 1 1 50 CYS SG S -4.259 -5.899 -1.337 1.00 . A A . 50 CYS SG 1 1 13 11570 1 1 51 PRO C C -2.174 -9.735 3.071 1.00 . A A . 51 PRO C 1 1 13 11571 1 1 51 PRO CA C -1.035 -9.752 2.051 1.00 . A A . 51 PRO CA 1 1 13 11572 1 1 51 PRO CB C 0.318 -9.614 2.748 1.00 . A A . 51 PRO CB 1 1 13 11573 1 1 51 PRO CD C -0.054 -7.582 1.524 1.00 . A A . 51 PRO CD 1 1 13 11574 1 1 51 PRO CG C 0.592 -8.147 2.763 1.00 . A A . 51 PRO CG 1 1 13 11575 1 1 51 PRO HA H -1.065 -10.679 1.495 1.00 . A A . 51 PRO HA 1 1 13 11576 1 1 51 PRO HB2 H 0.252 -10.015 3.749 1.00 . A A . 51 PRO HB2 1 1 13 11577 1 1 51 PRO HB3 H 1.070 -10.149 2.188 1.00 . A A . 51 PRO HB3 1 1 13 11578 1 1 51 PRO HD2 H -0.517 -6.632 1.741 1.00 . A A . 51 PRO HD2 1 1 13 11579 1 1 51 PRO HD3 H 0.677 -7.476 0.735 1.00 . A A . 51 PRO HD3 1 1 13 11580 1 1 51 PRO HG2 H 0.157 -7.701 3.644 1.00 . A A . 51 PRO HG2 1 1 13 11581 1 1 51 PRO HG3 H 1.657 -7.975 2.741 1.00 . A A . 51 PRO HG3 1 1 13 11582 1 1 51 PRO N N -1.071 -8.592 1.164 1.00 . A A . 51 PRO N 1 1 13 11583 1 1 51 PRO O O -2.604 -10.782 3.557 1.00 . A A . 51 PRO O 1 1 13 11584 1 1 52 ARG C C -4.406 -6.995 4.168 1.00 . A A . 52 ARG C 1 1 13 11585 1 1 52 ARG CA C -3.765 -8.372 4.326 1.00 . A A . 52 ARG CA 1 1 13 11586 1 1 52 ARG CB C -3.274 -8.565 5.773 1.00 . A A . 52 ARG CB 1 1 13 11587 1 1 52 ARG CD C -2.247 -6.502 6.784 1.00 . A A . 52 ARG CD 1 1 13 11588 1 1 52 ARG CG C -1.978 -7.831 6.099 1.00 . A A . 52 ARG CG 1 1 13 11589 1 1 52 ARG CZ C -0.910 -4.948 8.151 1.00 . A A . 52 ARG CZ 1 1 13 11590 1 1 52 ARG H H -2.284 -7.746 2.946 1.00 . A A . 52 ARG H 1 1 13 11591 1 1 52 ARG HA H -4.504 -9.125 4.102 1.00 . A A . 52 ARG HA 1 1 13 11592 1 1 52 ARG HB2 H -4.040 -8.212 6.446 1.00 . A A . 52 ARG HB2 1 1 13 11593 1 1 52 ARG HB3 H -3.117 -9.620 5.947 1.00 . A A . 52 ARG HB3 1 1 13 11594 1 1 52 ARG HD2 H -2.232 -5.721 6.039 1.00 . A A . 52 ARG HD2 1 1 13 11595 1 1 52 ARG HD3 H -3.227 -6.542 7.240 1.00 . A A . 52 ARG HD3 1 1 13 11596 1 1 52 ARG HE H -0.841 -6.949 8.296 1.00 . A A . 52 ARG HE 1 1 13 11597 1 1 52 ARG HG2 H -1.380 -8.447 6.755 1.00 . A A . 52 ARG HG2 1 1 13 11598 1 1 52 ARG HG3 H -1.438 -7.649 5.181 1.00 . A A . 52 ARG HG3 1 1 13 11599 1 1 52 ARG HH11 H -2.117 -4.061 6.773 1.00 . A A . 52 ARG HH11 1 1 13 11600 1 1 52 ARG HH12 H -1.189 -2.974 7.762 1.00 . A A . 52 ARG HH12 1 1 13 11601 1 1 52 ARG HH21 H 0.375 -5.519 9.617 1.00 . A A . 52 ARG HH21 1 1 13 11602 1 1 52 ARG HH22 H 0.244 -3.801 9.370 1.00 . A A . 52 ARG HH22 1 1 13 11603 1 1 52 ARG N N -2.664 -8.537 3.378 1.00 . A A . 52 ARG N 1 1 13 11604 1 1 52 ARG NE N -1.259 -6.188 7.816 1.00 . A A . 52 ARG NE 1 1 13 11605 1 1 52 ARG NH1 N -1.445 -3.911 7.511 1.00 . A A . 52 ARG NH1 1 1 13 11606 1 1 52 ARG NH2 N -0.030 -4.739 9.124 1.00 . A A . 52 ARG NH2 1 1 13 11607 1 1 52 ARG O O -4.786 -6.357 5.148 1.00 . A A . 52 ARG O 1 1 13 11608 1 1 53 CYS C C -6.354 -5.352 1.842 1.00 . A A . 53 CYS C 1 1 13 11609 1 1 53 CYS CA C -5.082 -5.217 2.672 1.00 . A A . 53 CYS CA 1 1 13 11610 1 1 53 CYS CB C -4.033 -4.336 1.987 1.00 . A A . 53 CYS CB 1 1 13 11611 1 1 53 CYS H H -4.202 -7.075 2.180 1.00 . A A . 53 CYS H 1 1 13 11612 1 1 53 CYS HA H -5.339 -4.777 3.623 1.00 . A A . 53 CYS HA 1 1 13 11613 1 1 53 CYS HB2 H -3.394 -3.906 2.743 1.00 . A A . 53 CYS HB2 1 1 13 11614 1 1 53 CYS HB3 H -3.433 -4.958 1.340 1.00 . A A . 53 CYS HB3 1 1 13 11615 1 1 53 CYS N N -4.510 -6.527 2.933 1.00 . A A . 53 CYS N 1 1 13 11616 1 1 53 CYS O O -7.348 -4.675 2.105 1.00 . A A . 53 CYS O 1 1 13 11617 1 1 53 CYS SG S -4.677 -2.963 0.979 1.00 . A A . 53 CYS SG 1 1 13 11618 1 1 54 THR C C -8.663 -7.133 1.049 1.00 . A A . 54 THR C 1 1 13 11619 1 1 54 THR CA C -7.547 -6.623 0.146 1.00 . A A . 54 THR CA 1 1 13 11620 1 1 54 THR CB C -7.241 -7.686 -0.921 1.00 . A A . 54 THR CB 1 1 13 11621 1 1 54 THR CG2 C -7.465 -7.127 -2.316 1.00 . A A . 54 THR CG2 1 1 13 11622 1 1 54 THR H H -5.562 -6.872 0.817 1.00 . A A . 54 THR H 1 1 13 11623 1 1 54 THR HA H -7.872 -5.719 -0.350 1.00 . A A . 54 THR HA 1 1 13 11624 1 1 54 THR HB H -7.903 -8.527 -0.773 1.00 . A A . 54 THR HB 1 1 13 11625 1 1 54 THR HG1 H -5.277 -7.405 -1.037 1.00 . A A . 54 THR HG1 1 1 13 11626 1 1 54 THR HG21 H -6.750 -6.339 -2.504 1.00 . A A . 54 THR HG21 1 1 13 11627 1 1 54 THR HG22 H -8.465 -6.730 -2.388 1.00 . A A . 54 THR HG22 1 1 13 11628 1 1 54 THR HG23 H -7.335 -7.914 -3.044 1.00 . A A . 54 THR HG23 1 1 13 11629 1 1 54 THR N N -6.360 -6.317 0.930 1.00 . A A . 54 THR N 1 1 13 11630 1 1 54 THR O O -9.842 -6.823 0.852 1.00 . A A . 54 THR O 1 1 13 11631 1 1 54 THR OG1 O -5.882 -8.132 -0.788 1.00 . A A . 54 THR OG1 1 1 13 11632 1 1 55 CYS C C -8.692 -8.115 4.452 1.00 . A A . 55 CYS C 1 1 13 11633 1 1 55 CYS CA C -9.202 -8.405 3.045 1.00 . A A . 55 CYS CA 1 1 13 11634 1 1 55 CYS CB C -9.383 -9.909 2.846 1.00 . A A . 55 CYS CB 1 1 13 11635 1 1 55 CYS H H -7.309 -8.066 2.180 1.00 . A A . 55 CYS H 1 1 13 11636 1 1 55 CYS HA H -10.151 -7.910 2.901 1.00 . A A . 55 CYS HA 1 1 13 11637 1 1 55 CYS HB2 H -9.112 -10.419 3.758 1.00 . A A . 55 CYS HB2 1 1 13 11638 1 1 55 CYS HB3 H -10.421 -10.114 2.619 1.00 . A A . 55 CYS HB3 1 1 13 11639 1 1 55 CYS HG H -7.127 -10.203 1.690 1.00 . A A . 55 CYS HG 1 1 13 11640 1 1 55 CYS N N -8.269 -7.883 2.067 1.00 . A A . 55 CYS N 1 1 13 11641 1 1 55 CYS O O -7.893 -8.872 4.998 1.00 . A A . 55 CYS O 1 1 13 11642 1 1 55 CYS SG S -8.381 -10.601 1.507 1.00 . A A . 55 CYS SG 1 1 13 11643 1 1 56 PRO C C -9.295 -7.316 7.489 1.00 . A A . 56 PRO C 1 1 13 11644 1 1 56 PRO CA C -8.630 -6.538 6.352 1.00 . A A . 56 PRO CA 1 1 13 11645 1 1 56 PRO CB C -9.028 -5.052 6.415 1.00 . A A . 56 PRO CB 1 1 13 11646 1 1 56 PRO CD C -9.963 -5.965 4.413 1.00 . A A . 56 PRO CD 1 1 13 11647 1 1 56 PRO CG C -9.472 -4.693 5.034 1.00 . A A . 56 PRO CG 1 1 13 11648 1 1 56 PRO HA H -7.557 -6.628 6.440 1.00 . A A . 56 PRO HA 1 1 13 11649 1 1 56 PRO HB2 H -9.828 -4.927 7.128 1.00 . A A . 56 PRO HB2 1 1 13 11650 1 1 56 PRO HB3 H -8.175 -4.463 6.719 1.00 . A A . 56 PRO HB3 1 1 13 11651 1 1 56 PRO HD2 H -10.997 -6.135 4.669 1.00 . A A . 56 PRO HD2 1 1 13 11652 1 1 56 PRO HD3 H -9.831 -5.945 3.342 1.00 . A A . 56 PRO HD3 1 1 13 11653 1 1 56 PRO HG2 H -10.271 -3.968 5.082 1.00 . A A . 56 PRO HG2 1 1 13 11654 1 1 56 PRO HG3 H -8.639 -4.298 4.471 1.00 . A A . 56 PRO HG3 1 1 13 11655 1 1 56 PRO N N -9.093 -6.972 5.030 1.00 . A A . 56 PRO N 1 1 13 11656 1 1 56 PRO O O -9.658 -6.747 8.523 1.00 . A A . 56 PRO O 1 1 13 11657 1 1 57 ALA C C -9.014 -9.822 9.387 1.00 . A A . 57 ALA C 1 1 13 11658 1 1 57 ALA CA C -10.028 -9.486 8.303 1.00 . A A . 57 ALA CA 1 1 13 11659 1 1 57 ALA CB C -10.561 -10.755 7.656 1.00 . A A . 57 ALA CB 1 1 13 11660 1 1 57 ALA H H -9.086 -9.019 6.468 1.00 . A A . 57 ALA H 1 1 13 11661 1 1 57 ALA HA H -10.856 -8.958 8.746 1.00 . A A . 57 ALA HA 1 1 13 11662 1 1 57 ALA HB1 H -9.732 -11.373 7.342 1.00 . A A . 57 ALA HB1 1 1 13 11663 1 1 57 ALA HB2 H -11.162 -11.298 8.370 1.00 . A A . 57 ALA HB2 1 1 13 11664 1 1 57 ALA HB3 H -11.165 -10.499 6.798 1.00 . A A . 57 ALA HB3 1 1 13 11665 1 1 57 ALA N N -9.428 -8.623 7.301 1.00 . A A . 57 ALA N 1 1 13 11666 1 1 57 ALA O O -9.257 -9.587 10.570 1.00 . A A . 57 ALA O 1 1 13 11667 1 1 58 LEU C C -6.152 -9.405 10.453 1.00 . A A . 58 LEU C 1 1 13 11668 1 1 58 LEU CA C -6.800 -10.672 9.905 1.00 . A A . 58 LEU CA 1 1 13 11669 1 1 58 LEU CB C -5.747 -11.545 9.216 1.00 . A A . 58 LEU CB 1 1 13 11670 1 1 58 LEU CD1 C -4.388 -13.466 10.082 1.00 . A A . 58 LEU CD1 1 1 13 11671 1 1 58 LEU CD2 C -3.294 -11.267 9.641 1.00 . A A . 58 LEU CD2 1 1 13 11672 1 1 58 LEU CG C -4.568 -11.958 10.099 1.00 . A A . 58 LEU CG 1 1 13 11673 1 1 58 LEU H H -7.730 -10.495 8.011 1.00 . A A . 58 LEU H 1 1 13 11674 1 1 58 LEU HA H -7.235 -11.224 10.725 1.00 . A A . 58 LEU HA 1 1 13 11675 1 1 58 LEU HB2 H -6.234 -12.442 8.859 1.00 . A A . 58 LEU HB2 1 1 13 11676 1 1 58 LEU HB3 H -5.360 -11.002 8.365 1.00 . A A . 58 LEU HB3 1 1 13 11677 1 1 58 LEU HD11 H -3.611 -13.728 9.380 1.00 . A A . 58 LEU HD11 1 1 13 11678 1 1 58 LEU HD12 H -4.111 -13.806 11.070 1.00 . A A . 58 LEU HD12 1 1 13 11679 1 1 58 LEU HD13 H -5.314 -13.937 9.787 1.00 . A A . 58 LEU HD13 1 1 13 11680 1 1 58 LEU HD21 H -3.400 -10.199 9.758 1.00 . A A . 58 LEU HD21 1 1 13 11681 1 1 58 LEU HD22 H -2.462 -11.614 10.237 1.00 . A A . 58 LEU HD22 1 1 13 11682 1 1 58 LEU HD23 H -3.112 -11.499 8.603 1.00 . A A . 58 LEU HD23 1 1 13 11683 1 1 58 LEU HG H -4.765 -11.656 11.118 1.00 . A A . 58 LEU HG 1 1 13 11684 1 1 58 LEU N N -7.866 -10.337 8.973 1.00 . A A . 58 LEU N 1 1 13 11685 1 1 58 LEU O O -5.958 -9.266 11.662 1.00 . A A . 58 LEU O 1 1 13 11686 1 1 59 LYS C C -5.496 -6.157 8.901 1.00 . A A . 59 LYS C 1 1 13 11687 1 1 59 LYS CA C -5.196 -7.228 9.938 1.00 . A A . 59 LYS CA 1 1 13 11688 1 1 59 LYS CB C -3.683 -7.416 10.070 1.00 . A A . 59 LYS CB 1 1 13 11689 1 1 59 LYS CD C -2.554 -8.293 12.130 1.00 . A A . 59 LYS CD 1 1 13 11690 1 1 59 LYS CE C -3.268 -8.598 13.436 1.00 . A A . 59 LYS CE 1 1 13 11691 1 1 59 LYS CG C -3.142 -7.071 11.447 1.00 . A A . 59 LYS CG 1 1 13 11692 1 1 59 LYS H H -6.027 -8.645 8.611 1.00 . A A . 59 LYS H 1 1 13 11693 1 1 59 LYS HA H -5.602 -6.920 10.890 1.00 . A A . 59 LYS HA 1 1 13 11694 1 1 59 LYS HB2 H -3.442 -8.447 9.863 1.00 . A A . 59 LYS HB2 1 1 13 11695 1 1 59 LYS HB3 H -3.188 -6.788 9.344 1.00 . A A . 59 LYS HB3 1 1 13 11696 1 1 59 LYS HD2 H -2.651 -9.144 11.473 1.00 . A A . 59 LYS HD2 1 1 13 11697 1 1 59 LYS HD3 H -1.509 -8.111 12.336 1.00 . A A . 59 LYS HD3 1 1 13 11698 1 1 59 LYS HE2 H -4.333 -8.573 13.265 1.00 . A A . 59 LYS HE2 1 1 13 11699 1 1 59 LYS HE3 H -2.980 -9.585 13.767 1.00 . A A . 59 LYS HE3 1 1 13 11700 1 1 59 LYS HG2 H -2.373 -6.320 11.344 1.00 . A A . 59 LYS HG2 1 1 13 11701 1 1 59 LYS HG3 H -3.948 -6.685 12.052 1.00 . A A . 59 LYS HG3 1 1 13 11702 1 1 59 LYS HZ1 H -3.072 -8.037 15.437 1.00 . A A . 59 LYS HZ1 1 1 13 11703 1 1 59 LYS HZ2 H -3.531 -6.767 14.408 1.00 . A A . 59 LYS HZ2 1 1 13 11704 1 1 59 LYS HZ3 H -1.929 -7.321 14.406 1.00 . A A . 59 LYS HZ3 1 1 13 11705 1 1 59 LYS N N -5.829 -8.482 9.557 1.00 . A A . 59 LYS N 1 1 13 11706 1 1 59 LYS NZ N -2.927 -7.614 14.495 1.00 . A A . 59 LYS NZ 1 1 13 11707 1 1 59 LYS O O -6.020 -6.461 7.830 1.00 . A A . 59 LYS O 1 1 13 11708 1 1 60 GLY C C -4.802 -2.529 8.852 1.00 . A A . 60 GLY C 1 1 13 11709 1 1 60 GLY CA C -5.363 -3.821 8.299 1.00 . A A . 60 GLY CA 1 1 13 11710 1 1 60 GLY H H -4.725 -4.745 10.083 1.00 . A A . 60 GLY H 1 1 13 11711 1 1 60 GLY HA2 H -4.880 -4.043 7.359 1.00 . A A . 60 GLY HA2 1 1 13 11712 1 1 60 GLY HA3 H -6.424 -3.700 8.134 1.00 . A A . 60 GLY HA3 1 1 13 11713 1 1 60 GLY N N -5.146 -4.920 9.216 1.00 . A A . 60 GLY N 1 1 13 11714 1 1 60 GLY O O -3.654 -2.490 9.302 1.00 . A A . 60 GLY O 1 1 13 11715 1 1 61 LYS C C -5.738 -0.144 10.923 1.00 . A A . 61 LYS C 1 1 13 11716 1 1 61 LYS CA C -5.235 -0.229 9.484 1.00 . A A . 61 LYS CA 1 1 13 11717 1 1 61 LYS CB C -5.778 0.938 8.657 1.00 . A A . 61 LYS CB 1 1 13 11718 1 1 61 LYS CD C -5.080 3.322 9.021 1.00 . A A . 61 LYS CD 1 1 13 11719 1 1 61 LYS CE C -4.318 3.497 10.329 1.00 . A A . 61 LYS CE 1 1 13 11720 1 1 61 LYS CG C -4.739 2.002 8.351 1.00 . A A . 61 LYS CG 1 1 13 11721 1 1 61 LYS H H -6.544 -1.602 8.556 1.00 . A A . 61 LYS H 1 1 13 11722 1 1 61 LYS HA H -4.155 -0.184 9.491 1.00 . A A . 61 LYS HA 1 1 13 11723 1 1 61 LYS HB2 H -6.157 0.555 7.720 1.00 . A A . 61 LYS HB2 1 1 13 11724 1 1 61 LYS HB3 H -6.588 1.401 9.200 1.00 . A A . 61 LYS HB3 1 1 13 11725 1 1 61 LYS HD2 H -4.821 4.131 8.353 1.00 . A A . 61 LYS HD2 1 1 13 11726 1 1 61 LYS HD3 H -6.140 3.347 9.226 1.00 . A A . 61 LYS HD3 1 1 13 11727 1 1 61 LYS HE2 H -4.905 4.113 10.992 1.00 . A A . 61 LYS HE2 1 1 13 11728 1 1 61 LYS HE3 H -4.174 2.525 10.776 1.00 . A A . 61 LYS HE3 1 1 13 11729 1 1 61 LYS HG2 H -3.775 1.666 8.708 1.00 . A A . 61 LYS HG2 1 1 13 11730 1 1 61 LYS HG3 H -4.695 2.152 7.283 1.00 . A A . 61 LYS HG3 1 1 13 11731 1 1 61 LYS HZ1 H -2.291 3.723 10.774 1.00 . A A . 61 LYS HZ1 1 1 13 11732 1 1 61 LYS HZ2 H -3.055 5.164 10.305 1.00 . A A . 61 LYS HZ2 1 1 13 11733 1 1 61 LYS HZ3 H -2.669 3.991 9.143 1.00 . A A . 61 LYS HZ3 1 1 13 11734 1 1 61 LYS N N -5.626 -1.497 8.894 1.00 . A A . 61 LYS N 1 1 13 11735 1 1 61 LYS NZ N -2.992 4.136 10.124 1.00 . A A . 61 LYS NZ 1 1 13 11736 1 1 61 LYS O O -5.103 -0.757 11.808 1.00 . A A . 61 LYS O 1 1 13 11737 1 1 61 LYS OXT O -6.773 0.515 11.159 1.00 . A A . 61 LYS OXT 1 1 13 11738 2 2 1 ZN ZN ZN -4.683 -3.657 -1.227 1.00 . B A . 62 ZN ZN 1 1 13 11739 3 2 1 ZN ZN ZN 4.154 4.779 4.719 1.00 . C A . 63 ZN ZN 1 1 14 11740 1 1 1 GLY C C -18.498 -1.696 5.272 1.00 . A A . 1 GLY C 1 1 14 11741 1 1 1 GLY CA C -18.478 -0.913 6.570 1.00 . A A . 1 GLY CA 1 1 14 11742 1 1 1 GLY H1 H -17.205 0.341 7.649 1.00 . A A . 1 GLY H1 1 1 14 11743 1 1 1 GLY H2 H -17.067 0.506 5.971 1.00 . A A . 1 GLY H2 1 1 14 11744 1 1 1 GLY H3 H -16.397 -0.844 6.747 1.00 . A A . 1 GLY H3 1 1 14 11745 1 1 1 GLY HA2 H -18.609 -1.597 7.396 1.00 . A A . 1 GLY HA2 1 1 14 11746 1 1 1 GLY HA3 H -19.293 -0.204 6.568 1.00 . A A . 1 GLY HA3 1 1 14 11747 1 1 1 GLY N N -17.200 -0.176 6.749 1.00 . A A . 1 GLY N 1 1 14 11748 1 1 1 GLY O O -17.439 -2.027 4.736 1.00 . A A . 1 GLY O 1 1 14 11749 1 1 2 PRO C C -19.073 -2.059 2.323 1.00 . A A . 2 PRO C 1 1 14 11750 1 1 2 PRO CA C -19.825 -2.736 3.467 1.00 . A A . 2 PRO CA 1 1 14 11751 1 1 2 PRO CB C -21.333 -2.731 3.198 1.00 . A A . 2 PRO CB 1 1 14 11752 1 1 2 PRO CD C -21.006 -1.637 5.296 1.00 . A A . 2 PRO CD 1 1 14 11753 1 1 2 PRO CG C -21.960 -2.509 4.530 1.00 . A A . 2 PRO CG 1 1 14 11754 1 1 2 PRO HA H -19.480 -3.753 3.568 1.00 . A A . 2 PRO HA 1 1 14 11755 1 1 2 PRO HB2 H -21.575 -1.934 2.508 1.00 . A A . 2 PRO HB2 1 1 14 11756 1 1 2 PRO HB3 H -21.629 -3.681 2.777 1.00 . A A . 2 PRO HB3 1 1 14 11757 1 1 2 PRO HD2 H -21.226 -0.593 5.128 1.00 . A A . 2 PRO HD2 1 1 14 11758 1 1 2 PRO HD3 H -21.046 -1.868 6.350 1.00 . A A . 2 PRO HD3 1 1 14 11759 1 1 2 PRO HG2 H -22.911 -2.011 4.411 1.00 . A A . 2 PRO HG2 1 1 14 11760 1 1 2 PRO HG3 H -22.091 -3.453 5.036 1.00 . A A . 2 PRO HG3 1 1 14 11761 1 1 2 PRO N N -19.693 -1.996 4.728 1.00 . A A . 2 PRO N 1 1 14 11762 1 1 2 PRO O O -18.168 -2.649 1.729 1.00 . A A . 2 PRO O 1 1 14 11763 1 1 3 LEU C C -17.409 0.604 1.716 1.00 . A A . 3 LEU C 1 1 14 11764 1 1 3 LEU CA C -18.663 -0.002 1.097 1.00 . A A . 3 LEU CA 1 1 14 11765 1 1 3 LEU CB C -19.569 1.097 0.531 1.00 . A A . 3 LEU CB 1 1 14 11766 1 1 3 LEU CD1 C -21.013 -0.387 -0.892 1.00 . A A . 3 LEU CD1 1 1 14 11767 1 1 3 LEU CD2 C -20.840 2.054 -1.405 1.00 . A A . 3 LEU CD2 1 1 14 11768 1 1 3 LEU CG C -20.102 0.832 -0.879 1.00 . A A . 3 LEU CG 1 1 14 11769 1 1 3 LEU H H -20.047 -0.346 2.662 1.00 . A A . 3 LEU H 1 1 14 11770 1 1 3 LEU HA H -18.373 -0.667 0.297 1.00 . A A . 3 LEU HA 1 1 14 11771 1 1 3 LEU HB2 H -20.412 1.218 1.195 1.00 . A A . 3 LEU HB2 1 1 14 11772 1 1 3 LEU HB3 H -19.011 2.021 0.512 1.00 . A A . 3 LEU HB3 1 1 14 11773 1 1 3 LEU HD11 H -20.740 -1.031 -1.715 1.00 . A A . 3 LEU HD11 1 1 14 11774 1 1 3 LEU HD12 H -20.904 -0.925 0.037 1.00 . A A . 3 LEU HD12 1 1 14 11775 1 1 3 LEU HD13 H -22.039 -0.071 -1.007 1.00 . A A . 3 LEU HD13 1 1 14 11776 1 1 3 LEU HD21 H -20.283 2.945 -1.157 1.00 . A A . 3 LEU HD21 1 1 14 11777 1 1 3 LEU HD22 H -20.940 1.979 -2.478 1.00 . A A . 3 LEU HD22 1 1 14 11778 1 1 3 LEU HD23 H -21.820 2.104 -0.955 1.00 . A A . 3 LEU HD23 1 1 14 11779 1 1 3 LEU HG H -19.271 0.634 -1.539 1.00 . A A . 3 LEU HG 1 1 14 11780 1 1 3 LEU N N -19.374 -0.788 2.096 1.00 . A A . 3 LEU N 1 1 14 11781 1 1 3 LEU O O -17.429 1.731 2.226 1.00 . A A . 3 LEU O 1 1 14 11782 1 1 4 GLY C C -14.330 1.182 1.500 1.00 . A A . 4 GLY C 1 1 14 11783 1 1 4 GLY CA C -15.118 0.243 2.382 1.00 . A A . 4 GLY CA 1 1 14 11784 1 1 4 GLY H H -16.418 -1.100 1.394 1.00 . A A . 4 GLY H 1 1 14 11785 1 1 4 GLY HA2 H -15.355 0.748 3.308 1.00 . A A . 4 GLY HA2 1 1 14 11786 1 1 4 GLY HA3 H -14.511 -0.622 2.600 1.00 . A A . 4 GLY HA3 1 1 14 11787 1 1 4 GLY N N -16.350 -0.190 1.758 1.00 . A A . 4 GLY N 1 1 14 11788 1 1 4 GLY O O -13.853 2.223 1.954 1.00 . A A . 4 GLY O 1 1 14 11789 1 1 5 SER C C -14.395 2.823 -1.196 1.00 . A A . 5 SER C 1 1 14 11790 1 1 5 SER CA C -13.520 1.661 -0.733 1.00 . A A . 5 SER CA 1 1 14 11791 1 1 5 SER CB C -13.078 0.804 -1.915 1.00 . A A . 5 SER CB 1 1 14 11792 1 1 5 SER H H -14.663 0.012 -0.080 1.00 . A A . 5 SER H 1 1 14 11793 1 1 5 SER HA H -12.645 2.061 -0.242 1.00 . A A . 5 SER HA 1 1 14 11794 1 1 5 SER HB2 H -13.901 0.694 -2.607 1.00 . A A . 5 SER HB2 1 1 14 11795 1 1 5 SER HB3 H -12.247 1.278 -2.415 1.00 . A A . 5 SER HB3 1 1 14 11796 1 1 5 SER HG H -12.239 -0.410 -0.605 1.00 . A A . 5 SER HG 1 1 14 11797 1 1 5 SER N N -14.230 0.838 0.227 1.00 . A A . 5 SER N 1 1 14 11798 1 1 5 SER O O -14.868 2.858 -2.335 1.00 . A A . 5 SER O 1 1 14 11799 1 1 5 SER OG O -12.675 -0.486 -1.475 1.00 . A A . 5 SER OG 1 1 14 11800 1 1 6 ASP C C -14.743 5.832 -1.587 1.00 . A A . 6 ASP C 1 1 14 11801 1 1 6 ASP CA C -15.427 4.937 -0.564 1.00 . A A . 6 ASP CA 1 1 14 11802 1 1 6 ASP CB C -15.685 5.716 0.730 1.00 . A A . 6 ASP CB 1 1 14 11803 1 1 6 ASP CG C -16.260 7.095 0.479 1.00 . A A . 6 ASP CG 1 1 14 11804 1 1 6 ASP H H -14.200 3.663 0.601 1.00 . A A . 6 ASP H 1 1 14 11805 1 1 6 ASP HA H -16.371 4.600 -0.968 1.00 . A A . 6 ASP HA 1 1 14 11806 1 1 6 ASP HB2 H -16.382 5.164 1.340 1.00 . A A . 6 ASP HB2 1 1 14 11807 1 1 6 ASP HB3 H -14.754 5.827 1.265 1.00 . A A . 6 ASP HB3 1 1 14 11808 1 1 6 ASP N N -14.612 3.762 -0.288 1.00 . A A . 6 ASP N 1 1 14 11809 1 1 6 ASP O O -15.377 6.334 -2.513 1.00 . A A . 6 ASP O 1 1 14 11810 1 1 6 ASP OD1 O -17.412 7.183 0.011 1.00 . A A . 6 ASP OD1 1 1 14 11811 1 1 6 ASP OD2 O -15.569 8.096 0.764 1.00 . A A . 6 ASP OD2 1 1 14 11812 1 1 7 HIS C C -11.281 6.072 -2.597 1.00 . A A . 7 HIS C 1 1 14 11813 1 1 7 HIS CA C -12.637 6.738 -2.388 1.00 . A A . 7 HIS CA 1 1 14 11814 1 1 7 HIS CB C -12.459 8.176 -1.873 1.00 . A A . 7 HIS CB 1 1 14 11815 1 1 7 HIS CD2 C -10.523 9.779 -2.464 1.00 . A A . 7 HIS CD2 1 1 14 11816 1 1 7 HIS CE1 C -10.954 9.968 -4.588 1.00 . A A . 7 HIS CE1 1 1 14 11817 1 1 7 HIS CG C -11.622 9.047 -2.763 1.00 . A A . 7 HIS CG 1 1 14 11818 1 1 7 HIS H H -12.979 5.481 -0.720 1.00 . A A . 7 HIS H 1 1 14 11819 1 1 7 HIS HA H -13.165 6.763 -3.330 1.00 . A A . 7 HIS HA 1 1 14 11820 1 1 7 HIS HB2 H -13.429 8.638 -1.778 1.00 . A A . 7 HIS HB2 1 1 14 11821 1 1 7 HIS HB3 H -11.987 8.144 -0.901 1.00 . A A . 7 HIS HB3 1 1 14 11822 1 1 7 HIS HD2 H -10.054 9.876 -1.496 1.00 . A A . 7 HIS HD2 1 1 14 11823 1 1 7 HIS HE1 H -10.883 10.268 -5.623 1.00 . A A . 7 HIS HE1 1 1 14 11824 1 1 7 HIS HE2 H -9.426 11.069 -3.717 1.00 . A A . 7 HIS HE2 1 1 14 11825 1 1 7 HIS N N -13.434 5.962 -1.451 1.00 . A A . 7 HIS N 1 1 14 11826 1 1 7 HIS ND1 N -11.892 9.172 -4.105 1.00 . A A . 7 HIS ND1 1 1 14 11827 1 1 7 HIS NE2 N -10.105 10.359 -3.632 1.00 . A A . 7 HIS NE2 1 1 14 11828 1 1 7 HIS O O -10.815 5.318 -1.741 1.00 . A A . 7 HIS O 1 1 14 11829 1 1 8 HIS C C -8.319 6.387 -3.001 1.00 . A A . 8 HIS C 1 1 14 11830 1 1 8 HIS CA C -9.323 5.865 -4.018 1.00 . A A . 8 HIS CA 1 1 14 11831 1 1 8 HIS CB C -8.901 6.293 -5.422 1.00 . A A . 8 HIS CB 1 1 14 11832 1 1 8 HIS CD2 C -8.152 4.272 -6.837 1.00 . A A . 8 HIS CD2 1 1 14 11833 1 1 8 HIS CE1 C -6.006 4.586 -6.645 1.00 . A A . 8 HIS CE1 1 1 14 11834 1 1 8 HIS CG C -7.926 5.365 -6.070 1.00 . A A . 8 HIS CG 1 1 14 11835 1 1 8 HIS H H -11.061 7.014 -4.338 1.00 . A A . 8 HIS H 1 1 14 11836 1 1 8 HIS HA H -9.355 4.787 -3.965 1.00 . A A . 8 HIS HA 1 1 14 11837 1 1 8 HIS HB2 H -9.775 6.344 -6.054 1.00 . A A . 8 HIS HB2 1 1 14 11838 1 1 8 HIS HB3 H -8.444 7.270 -5.370 1.00 . A A . 8 HIS HB3 1 1 14 11839 1 1 8 HIS HD2 H -9.114 3.860 -7.109 1.00 . A A . 8 HIS HD2 1 1 14 11840 1 1 8 HIS HE1 H -4.940 4.457 -6.753 1.00 . A A . 8 HIS HE1 1 1 14 11841 1 1 8 HIS HE2 H -6.754 2.880 -7.564 1.00 . A A . 8 HIS HE2 1 1 14 11842 1 1 8 HIS N N -10.646 6.378 -3.718 1.00 . A A . 8 HIS N 1 1 14 11843 1 1 8 HIS ND1 N -6.573 5.557 -5.954 1.00 . A A . 8 HIS ND1 1 1 14 11844 1 1 8 HIS NE2 N -6.925 3.781 -7.199 1.00 . A A . 8 HIS NE2 1 1 14 11845 1 1 8 HIS O O -8.100 7.594 -2.898 1.00 . A A . 8 HIS O 1 1 14 11846 1 1 9 MET C C -5.361 5.928 -1.878 1.00 . A A . 9 MET C 1 1 14 11847 1 1 9 MET CA C -6.742 5.857 -1.248 1.00 . A A . 9 MET CA 1 1 14 11848 1 1 9 MET CB C -6.752 4.856 -0.090 1.00 . A A . 9 MET CB 1 1 14 11849 1 1 9 MET CE C -8.775 2.447 1.321 1.00 . A A . 9 MET CE 1 1 14 11850 1 1 9 MET CG C -7.925 5.039 0.857 1.00 . A A . 9 MET CG 1 1 14 11851 1 1 9 MET H H -7.926 4.532 -2.385 1.00 . A A . 9 MET H 1 1 14 11852 1 1 9 MET HA H -7.007 6.833 -0.873 1.00 . A A . 9 MET HA 1 1 14 11853 1 1 9 MET HB2 H -6.794 3.855 -0.492 1.00 . A A . 9 MET HB2 1 1 14 11854 1 1 9 MET HB3 H -5.839 4.970 0.477 1.00 . A A . 9 MET HB3 1 1 14 11855 1 1 9 MET HE1 H -8.508 1.513 1.794 1.00 . A A . 9 MET HE1 1 1 14 11856 1 1 9 MET HE2 H -9.847 2.581 1.372 1.00 . A A . 9 MET HE2 1 1 14 11857 1 1 9 MET HE3 H -8.463 2.430 0.288 1.00 . A A . 9 MET HE3 1 1 14 11858 1 1 9 MET HG2 H -7.856 6.016 1.308 1.00 . A A . 9 MET HG2 1 1 14 11859 1 1 9 MET HG3 H -8.843 4.971 0.290 1.00 . A A . 9 MET HG3 1 1 14 11860 1 1 9 MET N N -7.724 5.484 -2.248 1.00 . A A . 9 MET N 1 1 14 11861 1 1 9 MET O O -4.560 4.994 -1.768 1.00 . A A . 9 MET O 1 1 14 11862 1 1 9 MET SD S -7.964 3.802 2.167 1.00 . A A . 9 MET SD 1 1 14 11863 1 1 10 GLU C C -2.756 7.700 -2.144 1.00 . A A . 10 GLU C 1 1 14 11864 1 1 10 GLU CA C -3.790 7.262 -3.174 1.00 . A A . 10 GLU CA 1 1 14 11865 1 1 10 GLU CB C -3.902 8.305 -4.292 1.00 . A A . 10 GLU CB 1 1 14 11866 1 1 10 GLU CD C -5.481 10.187 -3.718 1.00 . A A . 10 GLU CD 1 1 14 11867 1 1 10 GLU CG C -5.297 8.883 -4.463 1.00 . A A . 10 GLU CG 1 1 14 11868 1 1 10 GLU H H -5.762 7.753 -2.584 1.00 . A A . 10 GLU H 1 1 14 11869 1 1 10 GLU HA H -3.474 6.323 -3.603 1.00 . A A . 10 GLU HA 1 1 14 11870 1 1 10 GLU HB2 H -3.224 9.121 -4.076 1.00 . A A . 10 GLU HB2 1 1 14 11871 1 1 10 GLU HB3 H -3.610 7.847 -5.224 1.00 . A A . 10 GLU HB3 1 1 14 11872 1 1 10 GLU HG2 H -5.476 9.057 -5.513 1.00 . A A . 10 GLU HG2 1 1 14 11873 1 1 10 GLU HG3 H -6.017 8.168 -4.091 1.00 . A A . 10 GLU HG3 1 1 14 11874 1 1 10 GLU N N -5.082 7.046 -2.535 1.00 . A A . 10 GLU N 1 1 14 11875 1 1 10 GLU O O -1.930 8.578 -2.396 1.00 . A A . 10 GLU O 1 1 14 11876 1 1 10 GLU OE1 O -5.825 10.148 -2.516 1.00 . A A . 10 GLU OE1 1 1 14 11877 1 1 10 GLU OE2 O -5.282 11.258 -4.330 1.00 . A A . 10 GLU OE2 1 1 14 11878 1 1 11 PHE C C -1.712 6.113 0.962 1.00 . A A . 11 PHE C 1 1 14 11879 1 1 11 PHE CA C -1.880 7.348 0.092 1.00 . A A . 11 PHE CA 1 1 14 11880 1 1 11 PHE CB C -2.371 8.541 0.933 1.00 . A A . 11 PHE CB 1 1 14 11881 1 1 11 PHE CD1 C -4.794 8.049 1.384 1.00 . A A . 11 PHE CD1 1 1 14 11882 1 1 11 PHE CD2 C -3.285 8.103 3.230 1.00 . A A . 11 PHE CD2 1 1 14 11883 1 1 11 PHE CE1 C -5.837 7.762 2.240 1.00 . A A . 11 PHE CE1 1 1 14 11884 1 1 11 PHE CE2 C -4.325 7.815 4.093 1.00 . A A . 11 PHE CE2 1 1 14 11885 1 1 11 PHE CG C -3.506 8.221 1.866 1.00 . A A . 11 PHE CG 1 1 14 11886 1 1 11 PHE CZ C -5.603 7.644 3.597 1.00 . A A . 11 PHE CZ 1 1 14 11887 1 1 11 PHE H H -3.468 6.356 -0.864 1.00 . A A . 11 PHE H 1 1 14 11888 1 1 11 PHE HA H -0.925 7.594 -0.345 1.00 . A A . 11 PHE HA 1 1 14 11889 1 1 11 PHE HB2 H -1.550 8.909 1.531 1.00 . A A . 11 PHE HB2 1 1 14 11890 1 1 11 PHE HB3 H -2.700 9.327 0.267 1.00 . A A . 11 PHE HB3 1 1 14 11891 1 1 11 PHE HD1 H -4.977 8.142 0.324 1.00 . A A . 11 PHE HD1 1 1 14 11892 1 1 11 PHE HD2 H -2.287 8.236 3.618 1.00 . A A . 11 PHE HD2 1 1 14 11893 1 1 11 PHE HE1 H -6.836 7.632 1.850 1.00 . A A . 11 PHE HE1 1 1 14 11894 1 1 11 PHE HE2 H -4.139 7.724 5.154 1.00 . A A . 11 PHE HE2 1 1 14 11895 1 1 11 PHE HZ H -6.418 7.420 4.269 1.00 . A A . 11 PHE HZ 1 1 14 11896 1 1 11 PHE N N -2.803 7.066 -0.986 1.00 . A A . 11 PHE N 1 1 14 11897 1 1 11 PHE O O -2.467 5.146 0.841 1.00 . A A . 11 PHE O 1 1 14 11898 1 1 12 CYS C C -1.469 4.949 3.801 1.00 . A A . 12 CYS C 1 1 14 11899 1 1 12 CYS CA C -0.414 5.049 2.713 1.00 . A A . 12 CYS CA 1 1 14 11900 1 1 12 CYS CB C 0.944 5.268 3.375 1.00 . A A . 12 CYS CB 1 1 14 11901 1 1 12 CYS H H -0.140 6.953 1.844 1.00 . A A . 12 CYS H 1 1 14 11902 1 1 12 CYS HA H -0.393 4.136 2.143 1.00 . A A . 12 CYS HA 1 1 14 11903 1 1 12 CYS HB2 H 1.289 6.267 3.147 1.00 . A A . 12 CYS HB2 1 1 14 11904 1 1 12 CYS HB3 H 0.829 5.173 4.444 1.00 . A A . 12 CYS HB3 1 1 14 11905 1 1 12 CYS HG H 3.371 4.817 2.865 1.00 . A A . 12 CYS HG 1 1 14 11906 1 1 12 CYS N N -0.707 6.149 1.815 1.00 . A A . 12 CYS N 1 1 14 11907 1 1 12 CYS O O -1.495 5.777 4.706 1.00 . A A . 12 CYS O 1 1 14 11908 1 1 12 CYS SG S 2.234 4.122 2.860 1.00 . A A . 12 CYS SG 1 1 14 11909 1 1 13 ARG C C -2.287 2.940 6.098 1.00 . A A . 13 ARG C 1 1 14 11910 1 1 13 ARG CA C -3.085 3.561 4.953 1.00 . A A . 13 ARG CA 1 1 14 11911 1 1 13 ARG CB C -4.246 2.643 4.536 1.00 . A A . 13 ARG CB 1 1 14 11912 1 1 13 ARG CD C -4.854 0.460 3.449 1.00 . A A . 13 ARG CD 1 1 14 11913 1 1 13 ARG CG C -3.901 1.649 3.440 1.00 . A A . 13 ARG CG 1 1 14 11914 1 1 13 ARG CZ C -4.381 -1.771 2.490 1.00 . A A . 13 ARG CZ 1 1 14 11915 1 1 13 ARG H H -2.027 3.140 3.162 1.00 . A A . 13 ARG H 1 1 14 11916 1 1 13 ARG HA H -3.488 4.506 5.289 1.00 . A A . 13 ARG HA 1 1 14 11917 1 1 13 ARG HB2 H -4.575 2.087 5.400 1.00 . A A . 13 ARG HB2 1 1 14 11918 1 1 13 ARG HB3 H -5.062 3.258 4.186 1.00 . A A . 13 ARG HB3 1 1 14 11919 1 1 13 ARG HD2 H -5.438 0.487 4.358 1.00 . A A . 13 ARG HD2 1 1 14 11920 1 1 13 ARG HD3 H -5.513 0.534 2.596 1.00 . A A . 13 ARG HD3 1 1 14 11921 1 1 13 ARG HE H -3.389 -0.934 4.026 1.00 . A A . 13 ARG HE 1 1 14 11922 1 1 13 ARG HG2 H -3.965 2.144 2.482 1.00 . A A . 13 ARG HG2 1 1 14 11923 1 1 13 ARG HG3 H -2.893 1.293 3.597 1.00 . A A . 13 ARG HG3 1 1 14 11924 1 1 13 ARG HH11 H -6.074 -0.918 1.777 1.00 . A A . 13 ARG HH11 1 1 14 11925 1 1 13 ARG HH12 H -5.619 -2.406 1.012 1.00 . A A . 13 ARG HH12 1 1 14 11926 1 1 13 ARG HH21 H -2.794 -2.901 3.049 1.00 . A A . 13 ARG HH21 1 1 14 11927 1 1 13 ARG HH22 H -3.732 -3.543 1.723 1.00 . A A . 13 ARG HH22 1 1 14 11928 1 1 13 ARG N N -2.190 3.837 3.832 1.00 . A A . 13 ARG N 1 1 14 11929 1 1 13 ARG NE N -4.135 -0.810 3.384 1.00 . A A . 13 ARG NE 1 1 14 11930 1 1 13 ARG NH1 N -5.444 -1.695 1.700 1.00 . A A . 13 ARG NH1 1 1 14 11931 1 1 13 ARG NH2 N -3.581 -2.824 2.422 1.00 . A A . 13 ARG NH2 1 1 14 11932 1 1 13 ARG O O -2.839 2.293 6.987 1.00 . A A . 13 ARG O 1 1 14 11933 1 1 14 VAL C C 0.653 3.806 7.778 1.00 . A A . 14 VAL C 1 1 14 11934 1 1 14 VAL CA C -0.062 2.655 7.070 1.00 . A A . 14 VAL CA 1 1 14 11935 1 1 14 VAL CB C 1.003 1.720 6.452 1.00 . A A . 14 VAL CB 1 1 14 11936 1 1 14 VAL CG1 C 1.564 0.787 7.512 1.00 . A A . 14 VAL CG1 1 1 14 11937 1 1 14 VAL CG2 C 0.431 0.926 5.280 1.00 . A A . 14 VAL CG2 1 1 14 11938 1 1 14 VAL H H -0.618 3.705 5.336 1.00 . A A . 14 VAL H 1 1 14 11939 1 1 14 VAL HA H -0.634 2.091 7.795 1.00 . A A . 14 VAL HA 1 1 14 11940 1 1 14 VAL HB H 1.814 2.330 6.081 1.00 . A A . 14 VAL HB 1 1 14 11941 1 1 14 VAL HG11 H 0.755 0.390 8.107 1.00 . A A . 14 VAL HG11 1 1 14 11942 1 1 14 VAL HG12 H 2.093 -0.025 7.033 1.00 . A A . 14 VAL HG12 1 1 14 11943 1 1 14 VAL HG13 H 2.244 1.334 8.148 1.00 . A A . 14 VAL HG13 1 1 14 11944 1 1 14 VAL HG21 H -0.647 0.929 5.335 1.00 . A A . 14 VAL HG21 1 1 14 11945 1 1 14 VAL HG22 H 0.744 1.378 4.349 1.00 . A A . 14 VAL HG22 1 1 14 11946 1 1 14 VAL HG23 H 0.791 -0.092 5.324 1.00 . A A . 14 VAL HG23 1 1 14 11947 1 1 14 VAL N N -0.975 3.162 6.061 1.00 . A A . 14 VAL N 1 1 14 11948 1 1 14 VAL O O 0.694 3.866 9.007 1.00 . A A . 14 VAL O 1 1 14 11949 1 1 15 CYS C C 1.393 7.141 7.242 1.00 . A A . 15 CYS C 1 1 14 11950 1 1 15 CYS CA C 2.044 5.790 7.550 1.00 . A A . 15 CYS CA 1 1 14 11951 1 1 15 CYS CB C 3.471 5.753 6.998 1.00 . A A . 15 CYS CB 1 1 14 11952 1 1 15 CYS H H 1.265 4.549 6.029 1.00 . A A . 15 CYS H 1 1 14 11953 1 1 15 CYS HA H 2.079 5.658 8.619 1.00 . A A . 15 CYS HA 1 1 14 11954 1 1 15 CYS HB2 H 4.118 6.307 7.660 1.00 . A A . 15 CYS HB2 1 1 14 11955 1 1 15 CYS HB3 H 3.803 4.727 6.953 1.00 . A A . 15 CYS HB3 1 1 14 11956 1 1 15 CYS N N 1.272 4.685 6.994 1.00 . A A . 15 CYS N 1 1 14 11957 1 1 15 CYS O O 1.908 8.190 7.632 1.00 . A A . 15 CYS O 1 1 14 11958 1 1 15 CYS SG S 3.653 6.467 5.332 1.00 . A A . 15 CYS SG 1 1 14 11959 1 1 16 LYS C C 0.241 9.152 5.139 1.00 . A A . 16 LYS C 1 1 14 11960 1 1 16 LYS CA C -0.497 8.288 6.163 1.00 . A A . 16 LYS CA 1 1 14 11961 1 1 16 LYS CB C -0.849 9.128 7.397 1.00 . A A . 16 LYS CB 1 1 14 11962 1 1 16 LYS CD C -3.357 9.122 7.430 1.00 . A A . 16 LYS CD 1 1 14 11963 1 1 16 LYS CE C -4.251 9.899 8.379 1.00 . A A . 16 LYS CE 1 1 14 11964 1 1 16 LYS CG C -2.092 8.651 8.123 1.00 . A A . 16 LYS CG 1 1 14 11965 1 1 16 LYS H H -0.093 6.218 6.286 1.00 . A A . 16 LYS H 1 1 14 11966 1 1 16 LYS HA H -1.417 7.949 5.712 1.00 . A A . 16 LYS HA 1 1 14 11967 1 1 16 LYS HB2 H -0.020 9.097 8.088 1.00 . A A . 16 LYS HB2 1 1 14 11968 1 1 16 LYS HB3 H -1.008 10.150 7.087 1.00 . A A . 16 LYS HB3 1 1 14 11969 1 1 16 LYS HD2 H -3.088 9.756 6.600 1.00 . A A . 16 LYS HD2 1 1 14 11970 1 1 16 LYS HD3 H -3.898 8.261 7.066 1.00 . A A . 16 LYS HD3 1 1 14 11971 1 1 16 LYS HE2 H -5.200 9.389 8.456 1.00 . A A . 16 LYS HE2 1 1 14 11972 1 1 16 LYS HE3 H -3.781 9.931 9.350 1.00 . A A . 16 LYS HE3 1 1 14 11973 1 1 16 LYS HG2 H -2.091 7.572 8.151 1.00 . A A . 16 LYS HG2 1 1 14 11974 1 1 16 LYS HG3 H -2.081 9.038 9.132 1.00 . A A . 16 LYS HG3 1 1 14 11975 1 1 16 LYS HZ1 H -5.161 11.772 8.543 1.00 . A A . 16 LYS HZ1 1 1 14 11976 1 1 16 LYS HZ2 H -4.880 11.282 6.943 1.00 . A A . 16 LYS HZ2 1 1 14 11977 1 1 16 LYS HZ3 H -3.591 11.824 7.903 1.00 . A A . 16 LYS HZ3 1 1 14 11978 1 1 16 LYS N N 0.265 7.093 6.537 1.00 . A A . 16 LYS N 1 1 14 11979 1 1 16 LYS NZ N -4.487 11.289 7.908 1.00 . A A . 16 LYS NZ 1 1 14 11980 1 1 16 LYS O O -0.161 10.285 4.881 1.00 . A A . 16 LYS O 1 1 14 11981 1 1 17 ASP C C 1.353 9.337 2.190 1.00 . A A . 17 ASP C 1 1 14 11982 1 1 17 ASP CA C 2.056 9.376 3.535 1.00 . A A . 17 ASP CA 1 1 14 11983 1 1 17 ASP CB C 3.468 8.832 3.367 1.00 . A A . 17 ASP CB 1 1 14 11984 1 1 17 ASP CG C 4.397 9.837 2.717 1.00 . A A . 17 ASP CG 1 1 14 11985 1 1 17 ASP H H 1.601 7.723 4.793 1.00 . A A . 17 ASP H 1 1 14 11986 1 1 17 ASP HA H 2.115 10.392 3.866 1.00 . A A . 17 ASP HA 1 1 14 11987 1 1 17 ASP HB2 H 3.867 8.567 4.334 1.00 . A A . 17 ASP HB2 1 1 14 11988 1 1 17 ASP HB3 H 3.432 7.950 2.745 1.00 . A A . 17 ASP HB3 1 1 14 11989 1 1 17 ASP N N 1.303 8.622 4.541 1.00 . A A . 17 ASP N 1 1 14 11990 1 1 17 ASP O O 0.882 8.283 1.764 1.00 . A A . 17 ASP O 1 1 14 11991 1 1 17 ASP OD1 O 4.386 9.936 1.475 1.00 . A A . 17 ASP OD1 1 1 14 11992 1 1 17 ASP OD2 O 5.144 10.524 3.444 1.00 . A A . 17 ASP OD2 1 1 14 11993 1 1 18 GLY C C 1.604 11.115 -0.843 1.00 . A A . 18 GLY C 1 1 14 11994 1 1 18 GLY CA C 0.684 10.541 0.212 1.00 . A A . 18 GLY CA 1 1 14 11995 1 1 18 GLY H H 1.725 11.282 1.897 1.00 . A A . 18 GLY H 1 1 14 11996 1 1 18 GLY HA2 H 0.390 9.544 -0.086 1.00 . A A . 18 GLY HA2 1 1 14 11997 1 1 18 GLY HA3 H -0.199 11.162 0.283 1.00 . A A . 18 GLY HA3 1 1 14 11998 1 1 18 GLY N N 1.314 10.475 1.513 1.00 . A A . 18 GLY N 1 1 14 11999 1 1 18 GLY O O 1.145 11.735 -1.803 1.00 . A A . 18 GLY O 1 1 14 12000 1 1 19 GLY C C 4.118 10.519 -2.759 1.00 . A A . 19 GLY C 1 1 14 12001 1 1 19 GLY CA C 3.870 11.459 -1.597 1.00 . A A . 19 GLY CA 1 1 14 12002 1 1 19 GLY H H 3.216 10.451 0.148 1.00 . A A . 19 GLY H 1 1 14 12003 1 1 19 GLY HA2 H 3.504 12.400 -1.981 1.00 . A A . 19 GLY HA2 1 1 14 12004 1 1 19 GLY HA3 H 4.803 11.631 -1.082 1.00 . A A . 19 GLY HA3 1 1 14 12005 1 1 19 GLY N N 2.904 10.933 -0.654 1.00 . A A . 19 GLY N 1 1 14 12006 1 1 19 GLY O O 3.337 10.484 -3.715 1.00 . A A . 19 GLY O 1 1 14 12007 1 1 20 GLU C C 5.268 7.341 -3.149 1.00 . A A . 20 GLU C 1 1 14 12008 1 1 20 GLU CA C 5.494 8.746 -3.684 1.00 . A A . 20 GLU CA 1 1 14 12009 1 1 20 GLU CB C 6.945 8.904 -4.151 1.00 . A A . 20 GLU CB 1 1 14 12010 1 1 20 GLU CD C 8.311 10.935 -3.539 1.00 . A A . 20 GLU CD 1 1 14 12011 1 1 20 GLU CG C 7.324 10.330 -4.516 1.00 . A A . 20 GLU CG 1 1 14 12012 1 1 20 GLU H H 5.722 9.757 -1.841 1.00 . A A . 20 GLU H 1 1 14 12013 1 1 20 GLU HA H 4.833 8.913 -4.522 1.00 . A A . 20 GLU HA 1 1 14 12014 1 1 20 GLU HB2 H 7.602 8.574 -3.359 1.00 . A A . 20 GLU HB2 1 1 14 12015 1 1 20 GLU HB3 H 7.099 8.280 -5.019 1.00 . A A . 20 GLU HB3 1 1 14 12016 1 1 20 GLU HG2 H 7.771 10.329 -5.500 1.00 . A A . 20 GLU HG2 1 1 14 12017 1 1 20 GLU HG3 H 6.431 10.937 -4.528 1.00 . A A . 20 GLU HG3 1 1 14 12018 1 1 20 GLU N N 5.172 9.723 -2.658 1.00 . A A . 20 GLU N 1 1 14 12019 1 1 20 GLU O O 5.907 6.925 -2.182 1.00 . A A . 20 GLU O 1 1 14 12020 1 1 20 GLU OE1 O 9.444 10.422 -3.435 1.00 . A A . 20 GLU OE1 1 1 14 12021 1 1 20 GLU OE2 O 7.961 11.931 -2.873 1.00 . A A . 20 GLU OE2 1 1 14 12022 1 1 21 LEU C C 3.662 4.383 -4.383 1.00 . A A . 21 LEU C 1 1 14 12023 1 1 21 LEU CA C 3.926 5.331 -3.225 1.00 . A A . 21 LEU CA 1 1 14 12024 1 1 21 LEU CB C 2.676 5.413 -2.343 1.00 . A A . 21 LEU CB 1 1 14 12025 1 1 21 LEU CD1 C 1.301 7.401 -1.693 1.00 . A A . 21 LEU CD1 1 1 14 12026 1 1 21 LEU CD2 C 2.694 6.229 0.022 1.00 . A A . 21 LEU CD2 1 1 14 12027 1 1 21 LEU CG C 2.591 6.640 -1.437 1.00 . A A . 21 LEU CG 1 1 14 12028 1 1 21 LEU H H 3.771 7.054 -4.441 1.00 . A A . 21 LEU H 1 1 14 12029 1 1 21 LEU HA H 4.749 4.949 -2.639 1.00 . A A . 21 LEU HA 1 1 14 12030 1 1 21 LEU HB2 H 1.809 5.408 -2.987 1.00 . A A . 21 LEU HB2 1 1 14 12031 1 1 21 LEU HB3 H 2.644 4.531 -1.721 1.00 . A A . 21 LEU HB3 1 1 14 12032 1 1 21 LEU HD11 H 1.125 7.466 -2.757 1.00 . A A . 21 LEU HD11 1 1 14 12033 1 1 21 LEU HD12 H 0.479 6.884 -1.224 1.00 . A A . 21 LEU HD12 1 1 14 12034 1 1 21 LEU HD13 H 1.382 8.397 -1.281 1.00 . A A . 21 LEU HD13 1 1 14 12035 1 1 21 LEU HD21 H 2.674 5.152 0.096 1.00 . A A . 21 LEU HD21 1 1 14 12036 1 1 21 LEU HD22 H 3.621 6.600 0.436 1.00 . A A . 21 LEU HD22 1 1 14 12037 1 1 21 LEU HD23 H 1.863 6.642 0.574 1.00 . A A . 21 LEU HD23 1 1 14 12038 1 1 21 LEU HG H 3.416 7.300 -1.658 1.00 . A A . 21 LEU HG 1 1 14 12039 1 1 21 LEU N N 4.292 6.649 -3.710 1.00 . A A . 21 LEU N 1 1 14 12040 1 1 21 LEU O O 3.615 4.794 -5.542 1.00 . A A . 21 LEU O 1 1 14 12041 1 1 22 LEU C C 1.700 1.496 -4.584 1.00 . A A . 22 LEU C 1 1 14 12042 1 1 22 LEU CA C 3.007 2.142 -5.029 1.00 . A A . 22 LEU CA 1 1 14 12043 1 1 22 LEU CB C 4.131 1.109 -5.211 1.00 . A A . 22 LEU CB 1 1 14 12044 1 1 22 LEU CD1 C 4.355 -1.352 -5.565 1.00 . A A . 22 LEU CD1 1 1 14 12045 1 1 22 LEU CD2 C 4.608 -0.405 -3.270 1.00 . A A . 22 LEU CD2 1 1 14 12046 1 1 22 LEU CG C 3.889 -0.273 -4.604 1.00 . A A . 22 LEU CG 1 1 14 12047 1 1 22 LEU H H 3.381 2.892 -3.095 1.00 . A A . 22 LEU H 1 1 14 12048 1 1 22 LEU HA H 2.838 2.652 -5.967 1.00 . A A . 22 LEU HA 1 1 14 12049 1 1 22 LEU HB2 H 4.300 0.982 -6.269 1.00 . A A . 22 LEU HB2 1 1 14 12050 1 1 22 LEU HB3 H 5.031 1.514 -4.770 1.00 . A A . 22 LEU HB3 1 1 14 12051 1 1 22 LEU HD11 H 4.963 -0.906 -6.339 1.00 . A A . 22 LEU HD11 1 1 14 12052 1 1 22 LEU HD12 H 4.938 -2.086 -5.027 1.00 . A A . 22 LEU HD12 1 1 14 12053 1 1 22 LEU HD13 H 3.498 -1.832 -6.012 1.00 . A A . 22 LEU HD13 1 1 14 12054 1 1 22 LEU HD21 H 4.962 -1.419 -3.151 1.00 . A A . 22 LEU HD21 1 1 14 12055 1 1 22 LEU HD22 H 5.448 0.274 -3.244 1.00 . A A . 22 LEU HD22 1 1 14 12056 1 1 22 LEU HD23 H 3.927 -0.165 -2.469 1.00 . A A . 22 LEU HD23 1 1 14 12057 1 1 22 LEU HG H 2.830 -0.408 -4.433 1.00 . A A . 22 LEU HG 1 1 14 12058 1 1 22 LEU N N 3.393 3.137 -4.047 1.00 . A A . 22 LEU N 1 1 14 12059 1 1 22 LEU O O 1.501 1.259 -3.392 1.00 . A A . 22 LEU O 1 1 14 12060 1 1 23 CYS C C -0.769 -0.511 -5.235 1.00 . A A . 23 CYS C 1 1 14 12061 1 1 23 CYS CA C -0.603 1.000 -5.133 1.00 . A A . 23 CYS CA 1 1 14 12062 1 1 23 CYS CB C -1.626 1.697 -6.028 1.00 . A A . 23 CYS CB 1 1 14 12063 1 1 23 CYS H H 0.912 1.756 -6.401 1.00 . A A . 23 CYS H 1 1 14 12064 1 1 23 CYS HA H -0.780 1.296 -4.109 1.00 . A A . 23 CYS HA 1 1 14 12065 1 1 23 CYS HB2 H -2.022 0.981 -6.732 1.00 . A A . 23 CYS HB2 1 1 14 12066 1 1 23 CYS HB3 H -2.432 2.072 -5.416 1.00 . A A . 23 CYS HB3 1 1 14 12067 1 1 23 CYS HG H -1.525 3.067 -8.176 1.00 . A A . 23 CYS HG 1 1 14 12068 1 1 23 CYS N N 0.743 1.420 -5.492 1.00 . A A . 23 CYS N 1 1 14 12069 1 1 23 CYS O O 0.087 -1.205 -5.787 1.00 . A A . 23 CYS O 1 1 14 12070 1 1 23 CYS SG S -0.957 3.085 -6.974 1.00 . A A . 23 CYS SG 1 1 14 12071 1 1 24 CYS C C -2.721 -2.810 -6.135 1.00 . A A . 24 CYS C 1 1 14 12072 1 1 24 CYS CA C -2.226 -2.410 -4.747 1.00 . A A . 24 CYS CA 1 1 14 12073 1 1 24 CYS CB C -3.304 -2.706 -3.697 1.00 . A A . 24 CYS CB 1 1 14 12074 1 1 24 CYS H H -2.520 -0.375 -4.287 1.00 . A A . 24 CYS H 1 1 14 12075 1 1 24 CYS HA H -1.337 -2.976 -4.512 1.00 . A A . 24 CYS HA 1 1 14 12076 1 1 24 CYS HB2 H -3.016 -2.244 -2.765 1.00 . A A . 24 CYS HB2 1 1 14 12077 1 1 24 CYS HB3 H -4.240 -2.278 -4.026 1.00 . A A . 24 CYS HB3 1 1 14 12078 1 1 24 CYS N N -1.890 -0.997 -4.712 1.00 . A A . 24 CYS N 1 1 14 12079 1 1 24 CYS O O -2.837 -1.975 -7.040 1.00 . A A . 24 CYS O 1 1 14 12080 1 1 24 CYS SG S -3.596 -4.474 -3.360 1.00 . A A . 24 CYS SG 1 1 14 12081 1 1 25 ASP C C -5.061 -5.000 -7.356 1.00 . A A . 25 ASP C 1 1 14 12082 1 1 25 ASP CA C -3.612 -4.583 -7.524 1.00 . A A . 25 ASP CA 1 1 14 12083 1 1 25 ASP CB C -2.795 -5.778 -8.017 1.00 . A A . 25 ASP CB 1 1 14 12084 1 1 25 ASP CG C -2.823 -5.908 -9.527 1.00 . A A . 25 ASP CG 1 1 14 12085 1 1 25 ASP H H -3.023 -4.669 -5.490 1.00 . A A . 25 ASP H 1 1 14 12086 1 1 25 ASP HA H -3.556 -3.791 -8.256 1.00 . A A . 25 ASP HA 1 1 14 12087 1 1 25 ASP HB2 H -1.772 -5.662 -7.699 1.00 . A A . 25 ASP HB2 1 1 14 12088 1 1 25 ASP HB3 H -3.198 -6.683 -7.590 1.00 . A A . 25 ASP HB3 1 1 14 12089 1 1 25 ASP N N -3.079 -4.074 -6.273 1.00 . A A . 25 ASP N 1 1 14 12090 1 1 25 ASP O O -5.727 -5.359 -8.324 1.00 . A A . 25 ASP O 1 1 14 12091 1 1 25 ASP OD1 O -2.509 -4.916 -10.221 1.00 . A A . 25 ASP OD1 1 1 14 12092 1 1 25 ASP OD2 O -3.167 -7.001 -10.029 1.00 . A A . 25 ASP OD2 1 1 14 12093 1 1 26 THR C C -7.677 -4.606 -5.012 1.00 . A A . 26 THR C 1 1 14 12094 1 1 26 THR CA C -6.845 -5.580 -5.846 1.00 . A A . 26 THR CA 1 1 14 12095 1 1 26 THR CB C -6.773 -6.950 -5.155 1.00 . A A . 26 THR CB 1 1 14 12096 1 1 26 THR CG2 C -6.783 -8.065 -6.188 1.00 . A A . 26 THR CG2 1 1 14 12097 1 1 26 THR H H -4.906 -4.882 -5.364 1.00 . A A . 26 THR H 1 1 14 12098 1 1 26 THR HA H -7.336 -5.718 -6.799 1.00 . A A . 26 THR HA 1 1 14 12099 1 1 26 THR HB H -7.631 -7.064 -4.510 1.00 . A A . 26 THR HB 1 1 14 12100 1 1 26 THR HG1 H -5.784 -6.864 -3.443 1.00 . A A . 26 THR HG1 1 1 14 12101 1 1 26 THR HG21 H -5.872 -8.021 -6.769 1.00 . A A . 26 THR HG21 1 1 14 12102 1 1 26 THR HG22 H -7.634 -7.947 -6.841 1.00 . A A . 26 THR HG22 1 1 14 12103 1 1 26 THR HG23 H -6.844 -9.019 -5.686 1.00 . A A . 26 THR HG23 1 1 14 12104 1 1 26 THR N N -5.512 -5.073 -6.114 1.00 . A A . 26 THR N 1 1 14 12105 1 1 26 THR O O -8.908 -4.613 -5.086 1.00 . A A . 26 THR O 1 1 14 12106 1 1 26 THR OG1 O -5.575 -7.041 -4.377 1.00 . A A . 26 THR OG1 1 1 14 12107 1 1 27 CYS C C -7.153 -1.274 -3.963 1.00 . A A . 27 CYS C 1 1 14 12108 1 1 27 CYS CA C -7.725 -2.641 -3.603 1.00 . A A . 27 CYS CA 1 1 14 12109 1 1 27 CYS CB C -7.675 -2.882 -2.087 1.00 . A A . 27 CYS CB 1 1 14 12110 1 1 27 CYS H H -6.035 -3.652 -4.373 1.00 . A A . 27 CYS H 1 1 14 12111 1 1 27 CYS HA H -8.756 -2.672 -3.925 1.00 . A A . 27 CYS HA 1 1 14 12112 1 1 27 CYS HB2 H -8.373 -2.214 -1.606 1.00 . A A . 27 CYS HB2 1 1 14 12113 1 1 27 CYS HB3 H -7.969 -3.902 -1.886 1.00 . A A . 27 CYS HB3 1 1 14 12114 1 1 27 CYS N N -7.014 -3.688 -4.319 1.00 . A A . 27 CYS N 1 1 14 12115 1 1 27 CYS O O -6.018 -1.172 -4.430 1.00 . A A . 27 CYS O 1 1 14 12116 1 1 27 CYS SG S -6.047 -2.616 -1.320 1.00 . A A . 27 CYS SG 1 1 14 12117 1 1 28 PRO C C -6.706 1.806 -3.089 1.00 . A A . 28 PRO C 1 1 14 12118 1 1 28 PRO CA C -7.534 1.145 -4.188 1.00 . A A . 28 PRO CA 1 1 14 12119 1 1 28 PRO CB C -8.862 1.876 -4.372 1.00 . A A . 28 PRO CB 1 1 14 12120 1 1 28 PRO CD C -9.358 -0.246 -3.369 1.00 . A A . 28 PRO CD 1 1 14 12121 1 1 28 PRO CG C -9.795 1.195 -3.432 1.00 . A A . 28 PRO CG 1 1 14 12122 1 1 28 PRO HA H -6.980 1.155 -5.115 1.00 . A A . 28 PRO HA 1 1 14 12123 1 1 28 PRO HB2 H -8.740 2.922 -4.124 1.00 . A A . 28 PRO HB2 1 1 14 12124 1 1 28 PRO HB3 H -9.193 1.779 -5.396 1.00 . A A . 28 PRO HB3 1 1 14 12125 1 1 28 PRO HD2 H -9.422 -0.614 -2.357 1.00 . A A . 28 PRO HD2 1 1 14 12126 1 1 28 PRO HD3 H -9.961 -0.851 -4.030 1.00 . A A . 28 PRO HD3 1 1 14 12127 1 1 28 PRO HG2 H -9.726 1.649 -2.455 1.00 . A A . 28 PRO HG2 1 1 14 12128 1 1 28 PRO HG3 H -10.803 1.262 -3.807 1.00 . A A . 28 PRO HG3 1 1 14 12129 1 1 28 PRO N N -7.954 -0.209 -3.827 1.00 . A A . 28 PRO N 1 1 14 12130 1 1 28 PRO O O -7.075 2.858 -2.572 1.00 . A A . 28 PRO O 1 1 14 12131 1 1 29 SER C C -3.318 1.780 -2.107 1.00 . A A . 29 SER C 1 1 14 12132 1 1 29 SER CA C -4.764 1.667 -1.635 1.00 . A A . 29 SER CA 1 1 14 12133 1 1 29 SER CB C -4.851 0.743 -0.423 1.00 . A A . 29 SER CB 1 1 14 12134 1 1 29 SER H H -5.405 0.293 -3.109 1.00 . A A . 29 SER H 1 1 14 12135 1 1 29 SER HA H -5.120 2.648 -1.357 1.00 . A A . 29 SER HA 1 1 14 12136 1 1 29 SER HB2 H -4.104 -0.032 -0.510 1.00 . A A . 29 SER HB2 1 1 14 12137 1 1 29 SER HB3 H -4.676 1.312 0.478 1.00 . A A . 29 SER HB3 1 1 14 12138 1 1 29 SER HG H -6.109 -0.720 -0.807 1.00 . A A . 29 SER HG 1 1 14 12139 1 1 29 SER N N -5.618 1.159 -2.699 1.00 . A A . 29 SER N 1 1 14 12140 1 1 29 SER O O -2.907 1.086 -3.035 1.00 . A A . 29 SER O 1 1 14 12141 1 1 29 SER OG O -6.132 0.137 -0.345 1.00 . A A . 29 SER OG 1 1 14 12142 1 1 30 SER C C -0.247 2.611 -0.625 1.00 . A A . 30 SER C 1 1 14 12143 1 1 30 SER CA C -1.152 2.846 -1.832 1.00 . A A . 30 SER CA 1 1 14 12144 1 1 30 SER CB C -0.933 4.248 -2.406 1.00 . A A . 30 SER CB 1 1 14 12145 1 1 30 SER H H -2.933 3.200 -0.745 1.00 . A A . 30 SER H 1 1 14 12146 1 1 30 SER HA H -0.911 2.116 -2.592 1.00 . A A . 30 SER HA 1 1 14 12147 1 1 30 SER HB2 H -0.855 4.958 -1.595 1.00 . A A . 30 SER HB2 1 1 14 12148 1 1 30 SER HB3 H -0.021 4.260 -2.985 1.00 . A A . 30 SER HB3 1 1 14 12149 1 1 30 SER HG H -2.845 4.391 -2.814 1.00 . A A . 30 SER HG 1 1 14 12150 1 1 30 SER N N -2.551 2.662 -1.474 1.00 . A A . 30 SER N 1 1 14 12151 1 1 30 SER O O -0.644 2.847 0.518 1.00 . A A . 30 SER O 1 1 14 12152 1 1 30 SER OG O -2.013 4.626 -3.244 1.00 . A A . 30 SER OG 1 1 14 12153 1 1 31 TYR C C 3.249 2.259 -0.091 1.00 . A A . 31 TYR C 1 1 14 12154 1 1 31 TYR CA C 1.858 1.698 0.183 1.00 . A A . 31 TYR CA 1 1 14 12155 1 1 31 TYR CB C 1.979 0.176 0.276 1.00 . A A . 31 TYR CB 1 1 14 12156 1 1 31 TYR CD1 C -0.285 -0.235 1.321 1.00 . A A . 31 TYR CD1 1 1 14 12157 1 1 31 TYR CD2 C 1.597 -1.392 2.210 1.00 . A A . 31 TYR CD2 1 1 14 12158 1 1 31 TYR CE1 C -1.106 -0.872 2.224 1.00 . A A . 31 TYR CE1 1 1 14 12159 1 1 31 TYR CE2 C 0.783 -2.027 3.124 1.00 . A A . 31 TYR CE2 1 1 14 12160 1 1 31 TYR CG C 1.079 -0.484 1.296 1.00 . A A . 31 TYR CG 1 1 14 12161 1 1 31 TYR CZ C -0.568 -1.767 3.126 1.00 . A A . 31 TYR CZ 1 1 14 12162 1 1 31 TYR H H 1.156 1.818 -1.809 1.00 . A A . 31 TYR H 1 1 14 12163 1 1 31 TYR HA H 1.487 2.089 1.116 1.00 . A A . 31 TYR HA 1 1 14 12164 1 1 31 TYR HB2 H 1.743 -0.250 -0.688 1.00 . A A . 31 TYR HB2 1 1 14 12165 1 1 31 TYR HB3 H 3.001 -0.074 0.526 1.00 . A A . 31 TYR HB3 1 1 14 12166 1 1 31 TYR HD1 H -0.702 0.472 0.620 1.00 . A A . 31 TYR HD1 1 1 14 12167 1 1 31 TYR HD2 H 2.656 -1.592 2.208 1.00 . A A . 31 TYR HD2 1 1 14 12168 1 1 31 TYR HE1 H -2.167 -0.665 2.227 1.00 . A A . 31 TYR HE1 1 1 14 12169 1 1 31 TYR HE2 H 1.205 -2.727 3.831 1.00 . A A . 31 TYR HE2 1 1 14 12170 1 1 31 TYR HH H -0.883 -2.632 4.823 1.00 . A A . 31 TYR HH 1 1 14 12171 1 1 31 TYR N N 0.930 2.058 -0.878 1.00 . A A . 31 TYR N 1 1 14 12172 1 1 31 TYR O O 3.590 2.544 -1.237 1.00 . A A . 31 TYR O 1 1 14 12173 1 1 31 TYR OH O -1.389 -2.414 4.023 1.00 . A A . 31 TYR OH 1 1 14 12174 1 1 32 HIS C C 6.131 0.876 0.634 1.00 . A A . 32 HIS C 1 1 14 12175 1 1 32 HIS CA C 5.546 2.279 0.700 1.00 . A A . 32 HIS CA 1 1 14 12176 1 1 32 HIS CB C 6.192 3.055 1.857 1.00 . A A . 32 HIS CB 1 1 14 12177 1 1 32 HIS CD2 C 6.922 5.324 0.852 1.00 . A A . 32 HIS CD2 1 1 14 12178 1 1 32 HIS CE1 C 5.683 6.592 2.122 1.00 . A A . 32 HIS CE1 1 1 14 12179 1 1 32 HIS CG C 6.195 4.545 1.692 1.00 . A A . 32 HIS CG 1 1 14 12180 1 1 32 HIS H H 3.813 1.665 1.717 1.00 . A A . 32 HIS H 1 1 14 12181 1 1 32 HIS HA H 5.713 2.793 -0.237 1.00 . A A . 32 HIS HA 1 1 14 12182 1 1 32 HIS HB2 H 5.658 2.829 2.770 1.00 . A A . 32 HIS HB2 1 1 14 12183 1 1 32 HIS HB3 H 7.218 2.734 1.964 1.00 . A A . 32 HIS HB3 1 1 14 12184 1 1 32 HIS HD2 H 7.623 4.987 0.101 1.00 . A A . 32 HIS HD2 1 1 14 12185 1 1 32 HIS HE1 H 5.227 7.464 2.566 1.00 . A A . 32 HIS HE1 1 1 14 12186 1 1 32 HIS HE2 H 6.772 7.407 0.548 1.00 . A A . 32 HIS HE2 1 1 14 12187 1 1 32 HIS N N 4.113 2.121 0.906 1.00 . A A . 32 HIS N 1 1 14 12188 1 1 32 HIS ND1 N 5.421 5.354 2.482 1.00 . A A . 32 HIS ND1 1 1 14 12189 1 1 32 HIS NE2 N 6.591 6.631 1.132 1.00 . A A . 32 HIS NE2 1 1 14 12190 1 1 32 HIS O O 5.476 -0.068 1.068 1.00 . A A . 32 HIS O 1 1 14 12191 1 1 33 ILE C C 8.423 -1.027 1.520 1.00 . A A . 33 ILE C 1 1 14 12192 1 1 33 ILE CA C 7.969 -0.603 0.127 1.00 . A A . 33 ILE CA 1 1 14 12193 1 1 33 ILE CB C 9.155 -0.675 -0.862 1.00 . A A . 33 ILE CB 1 1 14 12194 1 1 33 ILE CD1 C 11.672 -0.311 -0.946 1.00 . A A . 33 ILE CD1 1 1 14 12195 1 1 33 ILE CG1 C 10.353 0.121 -0.341 1.00 . A A . 33 ILE CG1 1 1 14 12196 1 1 33 ILE CG2 C 8.735 -0.166 -2.233 1.00 . A A . 33 ILE CG2 1 1 14 12197 1 1 33 ILE H H 7.883 1.513 -0.103 1.00 . A A . 33 ILE H 1 1 14 12198 1 1 33 ILE HA H 7.209 -1.297 -0.209 1.00 . A A . 33 ILE HA 1 1 14 12199 1 1 33 ILE HB H 9.441 -1.712 -0.964 1.00 . A A . 33 ILE HB 1 1 14 12200 1 1 33 ILE HD11 H 12.057 -1.160 -0.400 1.00 . A A . 33 ILE HD11 1 1 14 12201 1 1 33 ILE HD12 H 11.520 -0.585 -1.980 1.00 . A A . 33 ILE HD12 1 1 14 12202 1 1 33 ILE HD13 H 12.378 0.504 -0.891 1.00 . A A . 33 ILE HD13 1 1 14 12203 1 1 33 ILE HG12 H 10.209 1.167 -0.573 1.00 . A A . 33 ILE HG12 1 1 14 12204 1 1 33 ILE HG21 H 7.847 0.440 -2.136 1.00 . A A . 33 ILE HG21 1 1 14 12205 1 1 33 ILE HG22 H 9.533 0.429 -2.654 1.00 . A A . 33 ILE HG22 1 1 14 12206 1 1 33 ILE HG23 H 8.530 -1.005 -2.883 1.00 . A A . 33 ILE HG23 1 1 14 12207 1 1 33 ILE N N 7.360 0.724 0.171 1.00 . A A . 33 ILE N 1 1 14 12208 1 1 33 ILE O O 8.733 -2.197 1.761 1.00 . A A . 33 ILE O 1 1 14 12209 1 1 34 HIS C C 7.584 -0.136 4.758 1.00 . A A . 34 HIS C 1 1 14 12210 1 1 34 HIS CA C 8.777 -0.333 3.825 1.00 . A A . 34 HIS CA 1 1 14 12211 1 1 34 HIS CB C 9.913 0.602 4.238 1.00 . A A . 34 HIS CB 1 1 14 12212 1 1 34 HIS CD2 C 11.537 -1.282 4.909 1.00 . A A . 34 HIS CD2 1 1 14 12213 1 1 34 HIS CE1 C 13.358 -0.357 4.159 1.00 . A A . 34 HIS CE1 1 1 14 12214 1 1 34 HIS CG C 11.236 -0.081 4.363 1.00 . A A . 34 HIS CG 1 1 14 12215 1 1 34 HIS H H 8.114 0.825 2.190 1.00 . A A . 34 HIS H 1 1 14 12216 1 1 34 HIS HA H 9.116 -1.356 3.896 1.00 . A A . 34 HIS HA 1 1 14 12217 1 1 34 HIS HB2 H 10.012 1.383 3.499 1.00 . A A . 34 HIS HB2 1 1 14 12218 1 1 34 HIS HB3 H 9.677 1.046 5.193 1.00 . A A . 34 HIS HB3 1 1 14 12219 1 1 34 HIS HD2 H 10.847 -1.978 5.365 1.00 . A A . 34 HIS HD2 1 1 14 12220 1 1 34 HIS HE1 H 14.396 -0.195 3.911 1.00 . A A . 34 HIS HE1 1 1 14 12221 1 1 34 HIS HE2 H 13.433 -2.139 5.228 1.00 . A A . 34 HIS HE2 1 1 14 12222 1 1 34 HIS N N 8.402 -0.076 2.445 1.00 . A A . 34 HIS N 1 1 14 12223 1 1 34 HIS ND1 N 12.389 0.499 3.890 1.00 . A A . 34 HIS ND1 1 1 14 12224 1 1 34 HIS NE2 N 12.889 -1.450 4.775 1.00 . A A . 34 HIS NE2 1 1 14 12225 1 1 34 HIS O O 7.746 -0.063 5.977 1.00 . A A . 34 HIS O 1 1 14 12226 1 1 35 CYS C C 4.275 -1.023 4.968 1.00 . A A . 35 CYS C 1 1 14 12227 1 1 35 CYS CA C 5.185 0.203 4.965 1.00 . A A . 35 CYS CA 1 1 14 12228 1 1 35 CYS CB C 4.437 1.431 4.431 1.00 . A A . 35 CYS CB 1 1 14 12229 1 1 35 CYS H H 6.320 -0.086 3.205 1.00 . A A . 35 CYS H 1 1 14 12230 1 1 35 CYS HA H 5.493 0.401 5.980 1.00 . A A . 35 CYS HA 1 1 14 12231 1 1 35 CYS HB2 H 4.530 1.462 3.356 1.00 . A A . 35 CYS HB2 1 1 14 12232 1 1 35 CYS HB3 H 3.392 1.358 4.699 1.00 . A A . 35 CYS HB3 1 1 14 12233 1 1 35 CYS N N 6.390 -0.028 4.181 1.00 . A A . 35 CYS N 1 1 14 12234 1 1 35 CYS O O 3.063 -0.908 5.129 1.00 . A A . 35 CYS O 1 1 14 12235 1 1 35 CYS SG S 5.076 3.003 5.097 1.00 . A A . 35 CYS SG 1 1 14 12236 1 1 36 LEU C C 4.852 -4.420 5.902 1.00 . A A . 36 LEU C 1 1 14 12237 1 1 36 LEU CA C 4.120 -3.441 5.000 1.00 . A A . 36 LEU CA 1 1 14 12238 1 1 36 LEU CB C 3.885 -4.056 3.616 1.00 . A A . 36 LEU CB 1 1 14 12239 1 1 36 LEU CD1 C 5.079 -5.572 2.023 1.00 . A A . 36 LEU CD1 1 1 14 12240 1 1 36 LEU CD2 C 5.257 -3.098 1.753 1.00 . A A . 36 LEU CD2 1 1 14 12241 1 1 36 LEU CG C 5.132 -4.239 2.750 1.00 . A A . 36 LEU CG 1 1 14 12242 1 1 36 LEU H H 5.852 -2.238 4.875 1.00 . A A . 36 LEU H 1 1 14 12243 1 1 36 LEU HA H 3.165 -3.208 5.447 1.00 . A A . 36 LEU HA 1 1 14 12244 1 1 36 LEU HB2 H 3.426 -5.024 3.753 1.00 . A A . 36 LEU HB2 1 1 14 12245 1 1 36 LEU HB3 H 3.194 -3.423 3.081 1.00 . A A . 36 LEU HB3 1 1 14 12246 1 1 36 LEU HD11 H 4.418 -6.244 2.549 1.00 . A A . 36 LEU HD11 1 1 14 12247 1 1 36 LEU HD12 H 4.711 -5.419 1.019 1.00 . A A . 36 LEU HD12 1 1 14 12248 1 1 36 LEU HD13 H 6.070 -5.999 1.981 1.00 . A A . 36 LEU HD13 1 1 14 12249 1 1 36 LEU HD21 H 5.490 -2.184 2.280 1.00 . A A . 36 LEU HD21 1 1 14 12250 1 1 36 LEU HD22 H 6.046 -3.320 1.050 1.00 . A A . 36 LEU HD22 1 1 14 12251 1 1 36 LEU HD23 H 4.324 -2.981 1.223 1.00 . A A . 36 LEU HD23 1 1 14 12252 1 1 36 LEU HG H 6.009 -4.235 3.381 1.00 . A A . 36 LEU HG 1 1 14 12253 1 1 36 LEU N N 4.874 -2.201 4.903 1.00 . A A . 36 LEU N 1 1 14 12254 1 1 36 LEU O O 6.056 -4.273 6.128 1.00 . A A . 36 LEU O 1 1 14 12255 1 1 37 ARG C C 5.871 -7.082 6.801 1.00 . A A . 37 ARG C 1 1 14 12256 1 1 37 ARG CA C 4.677 -6.336 7.413 1.00 . A A . 37 ARG CA 1 1 14 12257 1 1 37 ARG CB C 3.601 -7.318 7.885 1.00 . A A . 37 ARG CB 1 1 14 12258 1 1 37 ARG CD C 4.585 -8.685 9.748 1.00 . A A . 37 ARG CD 1 1 14 12259 1 1 37 ARG CG C 3.621 -7.569 9.381 1.00 . A A . 37 ARG CG 1 1 14 12260 1 1 37 ARG CZ C 5.157 -10.879 8.775 1.00 . A A . 37 ARG CZ 1 1 14 12261 1 1 37 ARG H H 3.141 -5.384 6.295 1.00 . A A . 37 ARG H 1 1 14 12262 1 1 37 ARG HA H 5.031 -5.781 8.270 1.00 . A A . 37 ARG HA 1 1 14 12263 1 1 37 ARG HB2 H 2.631 -6.924 7.623 1.00 . A A . 37 ARG HB2 1 1 14 12264 1 1 37 ARG HB3 H 3.745 -8.262 7.380 1.00 . A A . 37 ARG HB3 1 1 14 12265 1 1 37 ARG HD2 H 5.586 -8.387 9.471 1.00 . A A . 37 ARG HD2 1 1 14 12266 1 1 37 ARG HD3 H 4.541 -8.842 10.816 1.00 . A A . 37 ARG HD3 1 1 14 12267 1 1 37 ARG HE H 3.308 -10.103 8.851 1.00 . A A . 37 ARG HE 1 1 14 12268 1 1 37 ARG HG2 H 3.926 -6.664 9.883 1.00 . A A . 37 ARG HG2 1 1 14 12269 1 1 37 ARG HG3 H 2.627 -7.845 9.703 1.00 . A A . 37 ARG HG3 1 1 14 12270 1 1 37 ARG HH11 H 6.756 -9.794 9.406 1.00 . A A . 37 ARG HH11 1 1 14 12271 1 1 37 ARG HH12 H 7.126 -11.384 8.796 1.00 . A A . 37 ARG HH12 1 1 14 12272 1 1 37 ARG HH21 H 3.784 -12.186 8.038 1.00 . A A . 37 ARG HH21 1 1 14 12273 1 1 37 ARG HH22 H 5.433 -12.746 8.022 1.00 . A A . 37 ARG HH22 1 1 14 12274 1 1 37 ARG N N 4.112 -5.366 6.475 1.00 . A A . 37 ARG N 1 1 14 12275 1 1 37 ARG NE N 4.261 -9.940 9.073 1.00 . A A . 37 ARG NE 1 1 14 12276 1 1 37 ARG NH1 N 6.447 -10.667 9.008 1.00 . A A . 37 ARG NH1 1 1 14 12277 1 1 37 ARG NH2 N 4.763 -12.025 8.231 1.00 . A A . 37 ARG NH2 1 1 14 12278 1 1 37 ARG O O 6.990 -6.960 7.305 1.00 . A A . 37 ARG O 1 1 14 12279 1 1 38 PRO C C 7.517 -7.454 4.040 1.00 . A A . 38 PRO C 1 1 14 12280 1 1 38 PRO CA C 6.800 -8.432 4.968 1.00 . A A . 38 PRO CA 1 1 14 12281 1 1 38 PRO CB C 6.103 -9.528 4.172 1.00 . A A . 38 PRO CB 1 1 14 12282 1 1 38 PRO CD C 4.427 -7.946 4.906 1.00 . A A . 38 PRO CD 1 1 14 12283 1 1 38 PRO CG C 4.756 -8.972 3.846 1.00 . A A . 38 PRO CG 1 1 14 12284 1 1 38 PRO HA H 7.508 -8.868 5.657 1.00 . A A . 38 PRO HA 1 1 14 12285 1 1 38 PRO HB2 H 6.670 -9.740 3.278 1.00 . A A . 38 PRO HB2 1 1 14 12286 1 1 38 PRO HB3 H 6.026 -10.419 4.776 1.00 . A A . 38 PRO HB3 1 1 14 12287 1 1 38 PRO HD2 H 4.135 -7.013 4.446 1.00 . A A . 38 PRO HD2 1 1 14 12288 1 1 38 PRO HD3 H 3.640 -8.313 5.548 1.00 . A A . 38 PRO HD3 1 1 14 12289 1 1 38 PRO HG2 H 4.782 -8.504 2.873 1.00 . A A . 38 PRO HG2 1 1 14 12290 1 1 38 PRO HG3 H 4.023 -9.765 3.856 1.00 . A A . 38 PRO HG3 1 1 14 12291 1 1 38 PRO N N 5.691 -7.786 5.661 1.00 . A A . 38 PRO N 1 1 14 12292 1 1 38 PRO O O 7.413 -7.554 2.814 1.00 . A A . 38 PRO O 1 1 14 12293 1 1 39 ALA C C 9.641 -5.850 2.774 1.00 . A A . 39 ALA C 1 1 14 12294 1 1 39 ALA CA C 8.772 -5.347 3.924 1.00 . A A . 39 ALA CA 1 1 14 12295 1 1 39 ALA CB C 9.598 -4.498 4.879 1.00 . A A . 39 ALA CB 1 1 14 12296 1 1 39 ALA H H 8.091 -6.396 5.629 1.00 . A A . 39 ALA H 1 1 14 12297 1 1 39 ALA HA H 7.989 -4.723 3.519 1.00 . A A . 39 ALA HA 1 1 14 12298 1 1 39 ALA HB1 H 8.943 -4.010 5.585 1.00 . A A . 39 ALA HB1 1 1 14 12299 1 1 39 ALA HB2 H 10.296 -5.128 5.411 1.00 . A A . 39 ALA HB2 1 1 14 12300 1 1 39 ALA HB3 H 10.143 -3.752 4.318 1.00 . A A . 39 ALA HB3 1 1 14 12301 1 1 39 ALA N N 8.134 -6.444 4.649 1.00 . A A . 39 ALA N 1 1 14 12302 1 1 39 ALA O O 10.353 -6.849 2.903 1.00 . A A . 39 ALA O 1 1 14 12303 1 1 40 LEU C C 11.718 -5.023 0.542 1.00 . A A . 40 LEU C 1 1 14 12304 1 1 40 LEU CA C 10.297 -5.556 0.462 1.00 . A A . 40 LEU CA 1 1 14 12305 1 1 40 LEU CB C 9.607 -5.029 -0.797 1.00 . A A . 40 LEU CB 1 1 14 12306 1 1 40 LEU CD1 C 7.264 -4.249 -1.216 1.00 . A A . 40 LEU CD1 1 1 14 12307 1 1 40 LEU CD2 C 8.020 -6.465 -2.093 1.00 . A A . 40 LEU CD2 1 1 14 12308 1 1 40 LEU CG C 8.150 -5.458 -0.962 1.00 . A A . 40 LEU CG 1 1 14 12309 1 1 40 LEU H H 8.952 -4.390 1.604 1.00 . A A . 40 LEU H 1 1 14 12310 1 1 40 LEU HA H 10.327 -6.634 0.424 1.00 . A A . 40 LEU HA 1 1 14 12311 1 1 40 LEU HB2 H 9.641 -3.949 -0.777 1.00 . A A . 40 LEU HB2 1 1 14 12312 1 1 40 LEU HB3 H 10.159 -5.373 -1.658 1.00 . A A . 40 LEU HB3 1 1 14 12313 1 1 40 LEU HD11 H 6.250 -4.577 -1.393 1.00 . A A . 40 LEU HD11 1 1 14 12314 1 1 40 LEU HD12 H 7.288 -3.598 -0.354 1.00 . A A . 40 LEU HD12 1 1 14 12315 1 1 40 LEU HD13 H 7.625 -3.713 -2.082 1.00 . A A . 40 LEU HD13 1 1 14 12316 1 1 40 LEU HD21 H 8.895 -6.413 -2.724 1.00 . A A . 40 LEU HD21 1 1 14 12317 1 1 40 LEU HD22 H 7.928 -7.458 -1.681 1.00 . A A . 40 LEU HD22 1 1 14 12318 1 1 40 LEU HD23 H 7.142 -6.235 -2.677 1.00 . A A . 40 LEU HD23 1 1 14 12319 1 1 40 LEU HG H 7.815 -5.933 -0.051 1.00 . A A . 40 LEU HG 1 1 14 12320 1 1 40 LEU N N 9.545 -5.173 1.645 1.00 . A A . 40 LEU N 1 1 14 12321 1 1 40 LEU O O 11.986 -4.050 1.248 1.00 . A A . 40 LEU O 1 1 14 12322 1 1 41 TYR C C 14.290 -4.378 -1.417 1.00 . A A . 41 TYR C 1 1 14 12323 1 1 41 TYR CA C 14.018 -5.238 -0.192 1.00 . A A . 41 TYR CA 1 1 14 12324 1 1 41 TYR CB C 14.941 -6.457 -0.166 1.00 . A A . 41 TYR CB 1 1 14 12325 1 1 41 TYR CD1 C 15.512 -6.677 2.281 1.00 . A A . 41 TYR CD1 1 1 14 12326 1 1 41 TYR CD2 C 14.249 -8.423 1.264 1.00 . A A . 41 TYR CD2 1 1 14 12327 1 1 41 TYR CE1 C 15.474 -7.346 3.488 1.00 . A A . 41 TYR CE1 1 1 14 12328 1 1 41 TYR CE2 C 14.210 -9.099 2.468 1.00 . A A . 41 TYR CE2 1 1 14 12329 1 1 41 TYR CG C 14.904 -7.203 1.149 1.00 . A A . 41 TYR CG 1 1 14 12330 1 1 41 TYR CZ C 14.822 -8.555 3.578 1.00 . A A . 41 TYR CZ 1 1 14 12331 1 1 41 TYR H H 12.353 -6.425 -0.736 1.00 . A A . 41 TYR H 1 1 14 12332 1 1 41 TYR HA H 14.192 -4.645 0.695 1.00 . A A . 41 TYR HA 1 1 14 12333 1 1 41 TYR HB2 H 14.644 -7.143 -0.948 1.00 . A A . 41 TYR HB2 1 1 14 12334 1 1 41 TYR HB3 H 15.958 -6.138 -0.339 1.00 . A A . 41 TYR HB3 1 1 14 12335 1 1 41 TYR HD1 H 16.026 -5.729 2.208 1.00 . A A . 41 TYR HD1 1 1 14 12336 1 1 41 TYR HD2 H 13.769 -8.845 0.394 1.00 . A A . 41 TYR HD2 1 1 14 12337 1 1 41 TYR HE1 H 15.955 -6.920 4.356 1.00 . A A . 41 TYR HE1 1 1 14 12338 1 1 41 TYR HE2 H 13.700 -10.048 2.536 1.00 . A A . 41 TYR HE2 1 1 14 12339 1 1 41 TYR HH H 14.744 -10.181 4.618 1.00 . A A . 41 TYR HH 1 1 14 12340 1 1 41 TYR N N 12.628 -5.658 -0.180 1.00 . A A . 41 TYR N 1 1 14 12341 1 1 41 TYR O O 15.315 -3.700 -1.507 1.00 . A A . 41 TYR O 1 1 14 12342 1 1 41 TYR OH O 14.783 -9.224 4.782 1.00 . A A . 41 TYR OH 1 1 14 12343 1 1 42 GLU C C 11.975 -3.004 -3.838 1.00 . A A . 42 GLU C 1 1 14 12344 1 1 42 GLU CA C 13.372 -3.496 -3.489 1.00 . A A . 42 GLU CA 1 1 14 12345 1 1 42 GLU CB C 13.975 -4.256 -4.674 1.00 . A A . 42 GLU CB 1 1 14 12346 1 1 42 GLU CD C 13.132 -5.901 -6.392 1.00 . A A . 42 GLU CD 1 1 14 12347 1 1 42 GLU CG C 13.348 -5.619 -4.921 1.00 . A A . 42 GLU CG 1 1 14 12348 1 1 42 GLU H H 12.494 -4.852 -2.137 1.00 . A A . 42 GLU H 1 1 14 12349 1 1 42 GLU HA H 13.995 -2.647 -3.258 1.00 . A A . 42 GLU HA 1 1 14 12350 1 1 42 GLU HB2 H 13.850 -3.663 -5.567 1.00 . A A . 42 GLU HB2 1 1 14 12351 1 1 42 GLU HB3 H 15.029 -4.398 -4.491 1.00 . A A . 42 GLU HB3 1 1 14 12352 1 1 42 GLU HG2 H 14.001 -6.380 -4.516 1.00 . A A . 42 GLU HG2 1 1 14 12353 1 1 42 GLU HG3 H 12.393 -5.660 -4.418 1.00 . A A . 42 GLU HG3 1 1 14 12354 1 1 42 GLU N N 13.314 -4.343 -2.310 1.00 . A A . 42 GLU N 1 1 14 12355 1 1 42 GLU O O 10.989 -3.464 -3.263 1.00 . A A . 42 GLU O 1 1 14 12356 1 1 42 GLU OE1 O 13.960 -5.455 -7.220 1.00 . A A . 42 GLU OE1 1 1 14 12357 1 1 42 GLU OE2 O 12.138 -6.578 -6.729 1.00 . A A . 42 GLU OE2 1 1 14 12358 1 1 43 VAL C C 10.030 -2.457 -6.322 1.00 . A A . 43 VAL C 1 1 14 12359 1 1 43 VAL CA C 10.615 -1.568 -5.231 1.00 . A A . 43 VAL CA 1 1 14 12360 1 1 43 VAL CB C 10.746 -0.125 -5.762 1.00 . A A . 43 VAL CB 1 1 14 12361 1 1 43 VAL CG1 C 9.382 0.442 -6.128 1.00 . A A . 43 VAL CG1 1 1 14 12362 1 1 43 VAL CG2 C 11.440 0.762 -4.739 1.00 . A A . 43 VAL CG2 1 1 14 12363 1 1 43 VAL H H 12.721 -1.783 -5.230 1.00 . A A . 43 VAL H 1 1 14 12364 1 1 43 VAL HA H 9.944 -1.562 -4.384 1.00 . A A . 43 VAL HA 1 1 14 12365 1 1 43 VAL HB H 11.351 -0.145 -6.655 1.00 . A A . 43 VAL HB 1 1 14 12366 1 1 43 VAL HG11 H 9.511 1.386 -6.635 1.00 . A A . 43 VAL HG11 1 1 14 12367 1 1 43 VAL HG12 H 8.867 -0.250 -6.778 1.00 . A A . 43 VAL HG12 1 1 14 12368 1 1 43 VAL HG13 H 8.802 0.593 -5.229 1.00 . A A . 43 VAL HG13 1 1 14 12369 1 1 43 VAL HG21 H 11.701 1.703 -5.197 1.00 . A A . 43 VAL HG21 1 1 14 12370 1 1 43 VAL HG22 H 10.775 0.940 -3.906 1.00 . A A . 43 VAL HG22 1 1 14 12371 1 1 43 VAL HG23 H 12.335 0.272 -4.385 1.00 . A A . 43 VAL HG23 1 1 14 12372 1 1 43 VAL N N 11.896 -2.092 -4.788 1.00 . A A . 43 VAL N 1 1 14 12373 1 1 43 VAL O O 10.662 -2.664 -7.361 1.00 . A A . 43 VAL O 1 1 14 12374 1 1 44 PRO C C 7.932 -3.282 -8.372 1.00 . A A . 44 PRO C 1 1 14 12375 1 1 44 PRO CA C 8.187 -3.941 -7.021 1.00 . A A . 44 PRO CA 1 1 14 12376 1 1 44 PRO CB C 6.859 -4.282 -6.337 1.00 . A A . 44 PRO CB 1 1 14 12377 1 1 44 PRO CD C 8.072 -2.894 -4.827 1.00 . A A . 44 PRO CD 1 1 14 12378 1 1 44 PRO CG C 7.104 -4.038 -4.891 1.00 . A A . 44 PRO CG 1 1 14 12379 1 1 44 PRO HA H 8.761 -4.842 -7.167 1.00 . A A . 44 PRO HA 1 1 14 12380 1 1 44 PRO HB2 H 6.077 -3.642 -6.718 1.00 . A A . 44 PRO HB2 1 1 14 12381 1 1 44 PRO HB3 H 6.610 -5.316 -6.526 1.00 . A A . 44 PRO HB3 1 1 14 12382 1 1 44 PRO HD2 H 7.542 -1.954 -4.806 1.00 . A A . 44 PRO HD2 1 1 14 12383 1 1 44 PRO HD3 H 8.713 -2.988 -3.962 1.00 . A A . 44 PRO HD3 1 1 14 12384 1 1 44 PRO HG2 H 6.177 -3.774 -4.400 1.00 . A A . 44 PRO HG2 1 1 14 12385 1 1 44 PRO HG3 H 7.531 -4.917 -4.436 1.00 . A A . 44 PRO HG3 1 1 14 12386 1 1 44 PRO N N 8.845 -3.038 -6.073 1.00 . A A . 44 PRO N 1 1 14 12387 1 1 44 PRO O O 7.016 -2.469 -8.521 1.00 . A A . 44 PRO O 1 1 14 12388 1 1 45 ASP C C 7.542 -3.866 -11.462 1.00 . A A . 45 ASP C 1 1 14 12389 1 1 45 ASP CA C 8.616 -3.105 -10.699 1.00 . A A . 45 ASP CA 1 1 14 12390 1 1 45 ASP CB C 9.950 -3.193 -11.445 1.00 . A A . 45 ASP CB 1 1 14 12391 1 1 45 ASP CG C 10.095 -2.120 -12.507 1.00 . A A . 45 ASP CG 1 1 14 12392 1 1 45 ASP H H 9.452 -4.302 -9.164 1.00 . A A . 45 ASP H 1 1 14 12393 1 1 45 ASP HA H 8.321 -2.069 -10.619 1.00 . A A . 45 ASP HA 1 1 14 12394 1 1 45 ASP HB2 H 10.759 -3.082 -10.739 1.00 . A A . 45 ASP HB2 1 1 14 12395 1 1 45 ASP HB3 H 10.026 -4.160 -11.923 1.00 . A A . 45 ASP HB3 1 1 14 12396 1 1 45 ASP N N 8.747 -3.641 -9.351 1.00 . A A . 45 ASP N 1 1 14 12397 1 1 45 ASP O O 7.823 -4.871 -12.121 1.00 . A A . 45 ASP O 1 1 14 12398 1 1 45 ASP OD1 O 9.152 -1.926 -13.306 1.00 . A A . 45 ASP OD1 1 1 14 12399 1 1 45 ASP OD2 O 11.152 -1.455 -12.545 1.00 . A A . 45 ASP OD2 1 1 14 12400 1 1 46 GLY C C 3.990 -4.191 -11.034 1.00 . A A . 46 GLY C 1 1 14 12401 1 1 46 GLY CA C 5.195 -4.106 -11.941 1.00 . A A . 46 GLY CA 1 1 14 12402 1 1 46 GLY H H 6.133 -2.670 -10.711 1.00 . A A . 46 GLY H 1 1 14 12403 1 1 46 GLY HA2 H 4.924 -3.566 -12.837 1.00 . A A . 46 GLY HA2 1 1 14 12404 1 1 46 GLY HA3 H 5.502 -5.105 -12.214 1.00 . A A . 46 GLY HA3 1 1 14 12405 1 1 46 GLY N N 6.304 -3.432 -11.305 1.00 . A A . 46 GLY N 1 1 14 12406 1 1 46 GLY O O 3.720 -3.270 -10.262 1.00 . A A . 46 GLY O 1 1 14 12407 1 1 47 GLU C C 2.394 -5.945 -8.948 1.00 . A A . 47 GLU C 1 1 14 12408 1 1 47 GLU CA C 2.045 -5.482 -10.355 1.00 . A A . 47 GLU CA 1 1 14 12409 1 1 47 GLU CB C 1.143 -6.529 -11.009 1.00 . A A . 47 GLU CB 1 1 14 12410 1 1 47 GLU CD C 2.305 -7.711 -12.888 1.00 . A A . 47 GLU CD 1 1 14 12411 1 1 47 GLU CG C 1.311 -6.634 -12.513 1.00 . A A . 47 GLU CG 1 1 14 12412 1 1 47 GLU H H 3.521 -5.981 -11.789 1.00 . A A . 47 GLU H 1 1 14 12413 1 1 47 GLU HA H 1.522 -4.539 -10.302 1.00 . A A . 47 GLU HA 1 1 14 12414 1 1 47 GLU HB2 H 1.366 -7.494 -10.580 1.00 . A A . 47 GLU HB2 1 1 14 12415 1 1 47 GLU HB3 H 0.113 -6.281 -10.800 1.00 . A A . 47 GLU HB3 1 1 14 12416 1 1 47 GLU HG2 H 0.355 -6.872 -12.956 1.00 . A A . 47 GLU HG2 1 1 14 12417 1 1 47 GLU HG3 H 1.662 -5.687 -12.897 1.00 . A A . 47 GLU HG3 1 1 14 12418 1 1 47 GLU N N 3.256 -5.288 -11.139 1.00 . A A . 47 GLU N 1 1 14 12419 1 1 47 GLU O O 3.108 -6.938 -8.769 1.00 . A A . 47 GLU O 1 1 14 12420 1 1 47 GLU OE1 O 3.525 -7.458 -12.797 1.00 . A A . 47 GLU OE1 1 1 14 12421 1 1 47 GLU OE2 O 1.873 -8.825 -13.244 1.00 . A A . 47 GLU OE2 1 1 14 12422 1 1 48 TRP C C 0.710 -5.658 -5.848 1.00 . A A . 48 TRP C 1 1 14 12423 1 1 48 TRP CA C 2.054 -5.633 -6.569 1.00 . A A . 48 TRP CA 1 1 14 12424 1 1 48 TRP CB C 3.012 -4.643 -5.901 1.00 . A A . 48 TRP CB 1 1 14 12425 1 1 48 TRP CD1 C 4.121 -5.904 -3.965 1.00 . A A . 48 TRP CD1 1 1 14 12426 1 1 48 TRP CD2 C 2.736 -4.265 -3.331 1.00 . A A . 48 TRP CD2 1 1 14 12427 1 1 48 TRP CE2 C 3.273 -4.868 -2.181 1.00 . A A . 48 TRP CE2 1 1 14 12428 1 1 48 TRP CE3 C 1.838 -3.205 -3.181 1.00 . A A . 48 TRP CE3 1 1 14 12429 1 1 48 TRP CG C 3.292 -4.940 -4.462 1.00 . A A . 48 TRP CG 1 1 14 12430 1 1 48 TRP CH2 C 2.058 -3.410 -0.779 1.00 . A A . 48 TRP CH2 1 1 14 12431 1 1 48 TRP CZ2 C 2.939 -4.450 -0.897 1.00 . A A . 48 TRP CZ2 1 1 14 12432 1 1 48 TRP CZ3 C 1.507 -2.791 -1.907 1.00 . A A . 48 TRP CZ3 1 1 14 12433 1 1 48 TRP H H 1.267 -4.499 -8.166 1.00 . A A . 48 TRP H 1 1 14 12434 1 1 48 TRP HA H 2.487 -6.622 -6.541 1.00 . A A . 48 TRP HA 1 1 14 12435 1 1 48 TRP HB2 H 3.954 -4.655 -6.429 1.00 . A A . 48 TRP HB2 1 1 14 12436 1 1 48 TRP HB3 H 2.588 -3.652 -5.961 1.00 . A A . 48 TRP HB3 1 1 14 12437 1 1 48 TRP HD1 H 4.691 -6.589 -4.574 1.00 . A A . 48 TRP HD1 1 1 14 12438 1 1 48 TRP HE1 H 4.634 -6.462 -2.002 1.00 . A A . 48 TRP HE1 1 1 14 12439 1 1 48 TRP HE3 H 1.403 -2.712 -4.037 1.00 . A A . 48 TRP HE3 1 1 14 12440 1 1 48 TRP HH2 H 1.770 -3.054 0.200 1.00 . A A . 48 TRP HH2 1 1 14 12441 1 1 48 TRP HZ2 H 3.356 -4.916 -0.018 1.00 . A A . 48 TRP HZ2 1 1 14 12442 1 1 48 TRP HZ3 H 0.813 -1.974 -1.769 1.00 . A A . 48 TRP HZ3 1 1 14 12443 1 1 48 TRP N N 1.852 -5.264 -7.959 1.00 . A A . 48 TRP N 1 1 14 12444 1 1 48 TRP NE1 N 4.116 -5.866 -2.594 1.00 . A A . 48 TRP NE1 1 1 14 12445 1 1 48 TRP O O -0.205 -4.923 -6.214 1.00 . A A . 48 TRP O 1 1 14 12446 1 1 49 GLN C C -0.368 -6.499 -2.613 1.00 . A A . 49 GLN C 1 1 14 12447 1 1 49 GLN CA C -0.650 -6.653 -4.102 1.00 . A A . 49 GLN CA 1 1 14 12448 1 1 49 GLN CB C -1.294 -8.011 -4.392 1.00 . A A . 49 GLN CB 1 1 14 12449 1 1 49 GLN CD C -3.181 -9.617 -3.967 1.00 . A A . 49 GLN CD 1 1 14 12450 1 1 49 GLN CG C -2.534 -8.308 -3.566 1.00 . A A . 49 GLN CG 1 1 14 12451 1 1 49 GLN H H 1.350 -7.088 -4.617 1.00 . A A . 49 GLN H 1 1 14 12452 1 1 49 GLN HA H -1.319 -5.867 -4.417 1.00 . A A . 49 GLN HA 1 1 14 12453 1 1 49 GLN HB2 H -1.570 -8.045 -5.434 1.00 . A A . 49 GLN HB2 1 1 14 12454 1 1 49 GLN HB3 H -0.569 -8.786 -4.198 1.00 . A A . 49 GLN HB3 1 1 14 12455 1 1 49 GLN HE21 H -4.717 -8.635 -4.754 1.00 . A A . 49 GLN HE21 1 1 14 12456 1 1 49 GLN HE22 H -4.767 -10.369 -4.907 1.00 . A A . 49 GLN HE22 1 1 14 12457 1 1 49 GLN HG2 H -2.258 -8.358 -2.524 1.00 . A A . 49 GLN HG2 1 1 14 12458 1 1 49 GLN HG3 H -3.248 -7.511 -3.712 1.00 . A A . 49 GLN HG3 1 1 14 12459 1 1 49 GLN N N 0.587 -6.524 -4.857 1.00 . A A . 49 GLN N 1 1 14 12460 1 1 49 GLN NE2 N -4.340 -9.534 -4.595 1.00 . A A . 49 GLN NE2 1 1 14 12461 1 1 49 GLN O O 0.621 -7.039 -2.104 1.00 . A A . 49 GLN O 1 1 14 12462 1 1 49 GLN OE1 O -2.639 -10.694 -3.715 1.00 . A A . 49 GLN OE1 1 1 14 12463 1 1 50 CYS C C -1.255 -6.708 0.314 1.00 . A A . 50 CYS C 1 1 14 12464 1 1 50 CYS CA C -1.021 -5.449 -0.519 1.00 . A A . 50 CYS CA 1 1 14 12465 1 1 50 CYS CB C -1.964 -4.324 -0.067 1.00 . A A . 50 CYS CB 1 1 14 12466 1 1 50 CYS H H -1.949 -5.285 -2.412 1.00 . A A . 50 CYS H 1 1 14 12467 1 1 50 CYS HA H 0.000 -5.127 -0.375 1.00 . A A . 50 CYS HA 1 1 14 12468 1 1 50 CYS HB2 H -1.554 -3.856 0.815 1.00 . A A . 50 CYS HB2 1 1 14 12469 1 1 50 CYS HB3 H -2.036 -3.587 -0.855 1.00 . A A . 50 CYS HB3 1 1 14 12470 1 1 50 CYS N N -1.203 -5.719 -1.935 1.00 . A A . 50 CYS N 1 1 14 12471 1 1 50 CYS O O -1.997 -7.614 -0.087 1.00 . A A . 50 CYS O 1 1 14 12472 1 1 50 CYS SG S -3.656 -4.867 0.337 1.00 . A A . 50 CYS SG 1 1 14 12473 1 1 51 PRO C C -2.060 -7.836 3.213 1.00 . A A . 51 PRO C 1 1 14 12474 1 1 51 PRO CA C -0.767 -7.913 2.405 1.00 . A A . 51 PRO CA 1 1 14 12475 1 1 51 PRO CB C 0.455 -7.796 3.336 1.00 . A A . 51 PRO CB 1 1 14 12476 1 1 51 PRO CD C 0.289 -5.779 2.044 1.00 . A A . 51 PRO CD 1 1 14 12477 1 1 51 PRO CG C 1.240 -6.622 2.842 1.00 . A A . 51 PRO CG 1 1 14 12478 1 1 51 PRO HA H -0.730 -8.854 1.875 1.00 . A A . 51 PRO HA 1 1 14 12479 1 1 51 PRO HB2 H 0.118 -7.640 4.351 1.00 . A A . 51 PRO HB2 1 1 14 12480 1 1 51 PRO HB3 H 1.034 -8.705 3.284 1.00 . A A . 51 PRO HB3 1 1 14 12481 1 1 51 PRO HD2 H -0.235 -5.083 2.684 1.00 . A A . 51 PRO HD2 1 1 14 12482 1 1 51 PRO HD3 H 0.810 -5.257 1.256 1.00 . A A . 51 PRO HD3 1 1 14 12483 1 1 51 PRO HG2 H 1.623 -6.060 3.681 1.00 . A A . 51 PRO HG2 1 1 14 12484 1 1 51 PRO HG3 H 2.054 -6.961 2.217 1.00 . A A . 51 PRO HG3 1 1 14 12485 1 1 51 PRO N N -0.626 -6.781 1.496 1.00 . A A . 51 PRO N 1 1 14 12486 1 1 51 PRO O O -2.257 -8.594 4.161 1.00 . A A . 51 PRO O 1 1 14 12487 1 1 52 ARG C C -5.380 -7.106 2.603 1.00 . A A . 52 ARG C 1 1 14 12488 1 1 52 ARG CA C -4.214 -6.765 3.521 1.00 . A A . 52 ARG CA 1 1 14 12489 1 1 52 ARG CB C -4.365 -5.345 4.064 1.00 . A A . 52 ARG CB 1 1 14 12490 1 1 52 ARG CD C -4.619 -6.116 6.442 1.00 . A A . 52 ARG CD 1 1 14 12491 1 1 52 ARG CG C -3.881 -5.184 5.496 1.00 . A A . 52 ARG CG 1 1 14 12492 1 1 52 ARG CZ C -3.433 -7.529 8.080 1.00 . A A . 52 ARG CZ 1 1 14 12493 1 1 52 ARG H H -2.740 -6.343 2.057 1.00 . A A . 52 ARG H 1 1 14 12494 1 1 52 ARG HA H -4.217 -7.455 4.351 1.00 . A A . 52 ARG HA 1 1 14 12495 1 1 52 ARG HB2 H -3.800 -4.673 3.438 1.00 . A A . 52 ARG HB2 1 1 14 12496 1 1 52 ARG HB3 H -5.409 -5.067 4.027 1.00 . A A . 52 ARG HB3 1 1 14 12497 1 1 52 ARG HD2 H -5.577 -5.680 6.680 1.00 . A A . 52 ARG HD2 1 1 14 12498 1 1 52 ARG HD3 H -4.768 -7.064 5.947 1.00 . A A . 52 ARG HD3 1 1 14 12499 1 1 52 ARG HE H -3.697 -5.546 8.244 1.00 . A A . 52 ARG HE 1 1 14 12500 1 1 52 ARG HG2 H -2.826 -5.408 5.535 1.00 . A A . 52 ARG HG2 1 1 14 12501 1 1 52 ARG HG3 H -4.044 -4.163 5.810 1.00 . A A . 52 ARG HG3 1 1 14 12502 1 1 52 ARG HH11 H -4.245 -8.548 6.522 1.00 . A A . 52 ARG HH11 1 1 14 12503 1 1 52 ARG HH12 H -3.350 -9.514 7.654 1.00 . A A . 52 ARG HH12 1 1 14 12504 1 1 52 ARG HH21 H -2.541 -6.815 9.757 1.00 . A A . 52 ARG HH21 1 1 14 12505 1 1 52 ARG HH22 H -2.394 -8.530 9.514 1.00 . A A . 52 ARG HH22 1 1 14 12506 1 1 52 ARG N N -2.944 -6.921 2.830 1.00 . A A . 52 ARG N 1 1 14 12507 1 1 52 ARG NE N -3.879 -6.339 7.681 1.00 . A A . 52 ARG NE 1 1 14 12508 1 1 52 ARG NH1 N -3.700 -8.617 7.365 1.00 . A A . 52 ARG NH1 1 1 14 12509 1 1 52 ARG NH2 N -2.735 -7.632 9.205 1.00 . A A . 52 ARG NH2 1 1 14 12510 1 1 52 ARG O O -6.540 -7.047 3.012 1.00 . A A . 52 ARG O 1 1 14 12511 1 1 53 CYS C C -6.337 -9.494 0.661 1.00 . A A . 53 CYS C 1 1 14 12512 1 1 53 CYS CA C -6.084 -8.004 0.463 1.00 . A A . 53 CYS CA 1 1 14 12513 1 1 53 CYS CB C -5.653 -7.735 -0.979 1.00 . A A . 53 CYS CB 1 1 14 12514 1 1 53 CYS H H -4.121 -7.611 1.139 1.00 . A A . 53 CYS H 1 1 14 12515 1 1 53 CYS HA H -6.995 -7.460 0.671 1.00 . A A . 53 CYS HA 1 1 14 12516 1 1 53 CYS HB2 H -4.585 -7.594 -1.007 1.00 . A A . 53 CYS HB2 1 1 14 12517 1 1 53 CYS HB3 H -5.914 -8.588 -1.589 1.00 . A A . 53 CYS HB3 1 1 14 12518 1 1 53 CYS N N -5.066 -7.548 1.395 1.00 . A A . 53 CYS N 1 1 14 12519 1 1 53 CYS O O -7.034 -10.130 -0.131 1.00 . A A . 53 CYS O 1 1 14 12520 1 1 53 CYS SG S -6.422 -6.265 -1.731 1.00 . A A . 53 CYS SG 1 1 14 12521 1 1 54 THR C C -7.256 -11.800 2.466 1.00 . A A . 54 THR C 1 1 14 12522 1 1 54 THR CA C -5.840 -11.454 2.022 1.00 . A A . 54 THR CA 1 1 14 12523 1 1 54 THR CB C -4.852 -11.829 3.137 1.00 . A A . 54 THR CB 1 1 14 12524 1 1 54 THR CG2 C -3.869 -12.885 2.662 1.00 . A A . 54 THR CG2 1 1 14 12525 1 1 54 THR H H -5.159 -9.477 2.264 1.00 . A A . 54 THR H 1 1 14 12526 1 1 54 THR HA H -5.594 -12.026 1.139 1.00 . A A . 54 THR HA 1 1 14 12527 1 1 54 THR HB H -5.409 -12.223 3.974 1.00 . A A . 54 THR HB 1 1 14 12528 1 1 54 THR HG1 H -3.298 -10.609 3.082 1.00 . A A . 54 THR HG1 1 1 14 12529 1 1 54 THR HG21 H -2.900 -12.433 2.514 1.00 . A A . 54 THR HG21 1 1 14 12530 1 1 54 THR HG22 H -4.216 -13.305 1.731 1.00 . A A . 54 THR HG22 1 1 14 12531 1 1 54 THR HG23 H -3.793 -13.667 3.405 1.00 . A A . 54 THR HG23 1 1 14 12532 1 1 54 THR N N -5.725 -10.042 1.700 1.00 . A A . 54 THR N 1 1 14 12533 1 1 54 THR O O -7.604 -11.660 3.641 1.00 . A A . 54 THR O 1 1 14 12534 1 1 54 THR OG1 O -4.135 -10.660 3.559 1.00 . A A . 54 THR OG1 1 1 14 12535 1 1 55 CYS C C -9.533 -13.861 2.608 1.00 . A A . 55 CYS C 1 1 14 12536 1 1 55 CYS CA C -9.456 -12.568 1.802 1.00 . A A . 55 CYS CA 1 1 14 12537 1 1 55 CYS CB C -10.240 -12.710 0.495 1.00 . A A . 55 CYS CB 1 1 14 12538 1 1 55 CYS H H -7.739 -12.310 0.598 1.00 . A A . 55 CYS H 1 1 14 12539 1 1 55 CYS HA H -9.883 -11.765 2.388 1.00 . A A . 55 CYS HA 1 1 14 12540 1 1 55 CYS HB2 H -10.153 -13.726 0.143 1.00 . A A . 55 CYS HB2 1 1 14 12541 1 1 55 CYS HB3 H -11.282 -12.489 0.682 1.00 . A A . 55 CYS HB3 1 1 14 12542 1 1 55 CYS HG H -8.763 -10.789 -0.313 1.00 . A A . 55 CYS HG 1 1 14 12543 1 1 55 CYS N N -8.075 -12.226 1.518 1.00 . A A . 55 CYS N 1 1 14 12544 1 1 55 CYS O O -8.770 -14.800 2.364 1.00 . A A . 55 CYS O 1 1 14 12545 1 1 55 CYS SG S -9.667 -11.617 -0.831 1.00 . A A . 55 CYS SG 1 1 14 12546 1 1 56 PRO C C -11.131 -16.268 3.742 1.00 . A A . 56 PRO C 1 1 14 12547 1 1 56 PRO CA C -10.547 -15.077 4.494 1.00 . A A . 56 PRO CA 1 1 14 12548 1 1 56 PRO CB C -11.501 -14.610 5.596 1.00 . A A . 56 PRO CB 1 1 14 12549 1 1 56 PRO CD C -11.252 -12.783 4.066 1.00 . A A . 56 PRO CD 1 1 14 12550 1 1 56 PRO CG C -12.211 -13.428 5.027 1.00 . A A . 56 PRO CG 1 1 14 12551 1 1 56 PRO HA H -9.601 -15.364 4.931 1.00 . A A . 56 PRO HA 1 1 14 12552 1 1 56 PRO HB2 H -12.191 -15.406 5.836 1.00 . A A . 56 PRO HB2 1 1 14 12553 1 1 56 PRO HB3 H -10.934 -14.342 6.475 1.00 . A A . 56 PRO HB3 1 1 14 12554 1 1 56 PRO HD2 H -11.786 -12.354 3.229 1.00 . A A . 56 PRO HD2 1 1 14 12555 1 1 56 PRO HD3 H -10.666 -12.028 4.569 1.00 . A A . 56 PRO HD3 1 1 14 12556 1 1 56 PRO HG2 H -13.102 -13.749 4.508 1.00 . A A . 56 PRO HG2 1 1 14 12557 1 1 56 PRO HG3 H -12.465 -12.740 5.819 1.00 . A A . 56 PRO HG3 1 1 14 12558 1 1 56 PRO N N -10.400 -13.902 3.630 1.00 . A A . 56 PRO N 1 1 14 12559 1 1 56 PRO O O -10.953 -17.418 4.143 1.00 . A A . 56 PRO O 1 1 14 12560 1 1 57 ALA C C -11.284 -17.341 0.655 1.00 . A A . 57 ALA C 1 1 14 12561 1 1 57 ALA CA C -12.297 -17.021 1.745 1.00 . A A . 57 ALA CA 1 1 14 12562 1 1 57 ALA CB C -13.619 -16.587 1.131 1.00 . A A . 57 ALA CB 1 1 14 12563 1 1 57 ALA H H -11.841 -15.047 2.333 1.00 . A A . 57 ALA H 1 1 14 12564 1 1 57 ALA HA H -12.471 -17.906 2.341 1.00 . A A . 57 ALA HA 1 1 14 12565 1 1 57 ALA HB1 H -14.388 -17.299 1.390 1.00 . A A . 57 ALA HB1 1 1 14 12566 1 1 57 ALA HB2 H -13.890 -15.612 1.508 1.00 . A A . 57 ALA HB2 1 1 14 12567 1 1 57 ALA HB3 H -13.520 -16.542 0.056 1.00 . A A . 57 ALA HB3 1 1 14 12568 1 1 57 ALA N N -11.773 -15.983 2.615 1.00 . A A . 57 ALA N 1 1 14 12569 1 1 57 ALA O O -10.528 -16.466 0.228 1.00 . A A . 57 ALA O 1 1 14 12570 1 1 58 LEU C C -10.797 -18.567 -2.189 1.00 . A A . 58 LEU C 1 1 14 12571 1 1 58 LEU CA C -10.320 -19.014 -0.811 1.00 . A A . 58 LEU CA 1 1 14 12572 1 1 58 LEU CB C -10.147 -20.535 -0.778 1.00 . A A . 58 LEU CB 1 1 14 12573 1 1 58 LEU CD1 C -9.046 -21.069 1.413 1.00 . A A . 58 LEU CD1 1 1 14 12574 1 1 58 LEU CD2 C -8.475 -22.398 -0.632 1.00 . A A . 58 LEU CD2 1 1 14 12575 1 1 58 LEU CG C -8.866 -21.027 -0.098 1.00 . A A . 58 LEU CG 1 1 14 12576 1 1 58 LEU H H -11.896 -19.242 0.587 1.00 . A A . 58 LEU H 1 1 14 12577 1 1 58 LEU HA H -9.370 -18.545 -0.605 1.00 . A A . 58 LEU HA 1 1 14 12578 1 1 58 LEU HB2 H -10.992 -20.963 -0.258 1.00 . A A . 58 LEU HB2 1 1 14 12579 1 1 58 LEU HB3 H -10.150 -20.898 -1.795 1.00 . A A . 58 LEU HB3 1 1 14 12580 1 1 58 LEU HD11 H -8.094 -20.893 1.892 1.00 . A A . 58 LEU HD11 1 1 14 12581 1 1 58 LEU HD12 H -9.748 -20.302 1.712 1.00 . A A . 58 LEU HD12 1 1 14 12582 1 1 58 LEU HD13 H -9.423 -22.038 1.706 1.00 . A A . 58 LEU HD13 1 1 14 12583 1 1 58 LEU HD21 H -7.934 -22.941 0.128 1.00 . A A . 58 LEU HD21 1 1 14 12584 1 1 58 LEU HD22 H -9.366 -22.947 -0.901 1.00 . A A . 58 LEU HD22 1 1 14 12585 1 1 58 LEU HD23 H -7.849 -22.280 -1.504 1.00 . A A . 58 LEU HD23 1 1 14 12586 1 1 58 LEU HG H -8.062 -20.339 -0.319 1.00 . A A . 58 LEU HG 1 1 14 12587 1 1 58 LEU N N -11.260 -18.589 0.217 1.00 . A A . 58 LEU N 1 1 14 12588 1 1 58 LEU O O -11.740 -19.133 -2.744 1.00 . A A . 58 LEU O 1 1 14 12589 1 1 59 LYS C C -9.566 -17.514 -5.103 1.00 . A A . 59 LYS C 1 1 14 12590 1 1 59 LYS CA C -10.522 -17.007 -4.031 1.00 . A A . 59 LYS CA 1 1 14 12591 1 1 59 LYS CB C -10.514 -15.476 -4.008 1.00 . A A . 59 LYS CB 1 1 14 12592 1 1 59 LYS CD C -12.161 -14.732 -5.757 1.00 . A A . 59 LYS CD 1 1 14 12593 1 1 59 LYS CE C -13.648 -14.845 -6.056 1.00 . A A . 59 LYS CE 1 1 14 12594 1 1 59 LYS CG C -11.879 -14.857 -4.269 1.00 . A A . 59 LYS CG 1 1 14 12595 1 1 59 LYS H H -9.415 -17.118 -2.231 1.00 . A A . 59 LYS H 1 1 14 12596 1 1 59 LYS HA H -11.520 -17.351 -4.264 1.00 . A A . 59 LYS HA 1 1 14 12597 1 1 59 LYS HB2 H -10.174 -15.146 -3.037 1.00 . A A . 59 LYS HB2 1 1 14 12598 1 1 59 LYS HB3 H -9.828 -15.117 -4.762 1.00 . A A . 59 LYS HB3 1 1 14 12599 1 1 59 LYS HD2 H -11.810 -13.771 -6.102 1.00 . A A . 59 LYS HD2 1 1 14 12600 1 1 59 LYS HD3 H -11.638 -15.519 -6.282 1.00 . A A . 59 LYS HD3 1 1 14 12601 1 1 59 LYS HE2 H -13.987 -15.824 -5.754 1.00 . A A . 59 LYS HE2 1 1 14 12602 1 1 59 LYS HE3 H -14.176 -14.090 -5.486 1.00 . A A . 59 LYS HE3 1 1 14 12603 1 1 59 LYS HG2 H -12.639 -15.480 -3.820 1.00 . A A . 59 LYS HG2 1 1 14 12604 1 1 59 LYS HG3 H -11.908 -13.874 -3.821 1.00 . A A . 59 LYS HG3 1 1 14 12605 1 1 59 LYS HZ1 H -14.453 -15.491 -7.874 1.00 . A A . 59 LYS HZ1 1 1 14 12606 1 1 59 LYS HZ2 H -13.060 -14.534 -8.039 1.00 . A A . 59 LYS HZ2 1 1 14 12607 1 1 59 LYS HZ3 H -14.542 -13.815 -7.634 1.00 . A A . 59 LYS HZ3 1 1 14 12608 1 1 59 LYS N N -10.156 -17.537 -2.727 1.00 . A A . 59 LYS N 1 1 14 12609 1 1 59 LYS NZ N -13.944 -14.658 -7.499 1.00 . A A . 59 LYS NZ 1 1 14 12610 1 1 59 LYS O O -9.991 -17.889 -6.197 1.00 . A A . 59 LYS O 1 1 14 12611 1 1 60 GLY C C -5.880 -17.829 -5.188 1.00 . A A . 60 GLY C 1 1 14 12612 1 1 60 GLY CA C -7.286 -18.040 -5.704 1.00 . A A . 60 GLY CA 1 1 14 12613 1 1 60 GLY H H -8.008 -17.265 -3.870 1.00 . A A . 60 GLY H 1 1 14 12614 1 1 60 GLY HA2 H -7.445 -19.095 -5.869 1.00 . A A . 60 GLY HA2 1 1 14 12615 1 1 60 GLY HA3 H -7.397 -17.516 -6.642 1.00 . A A . 60 GLY HA3 1 1 14 12616 1 1 60 GLY N N -8.282 -17.554 -4.771 1.00 . A A . 60 GLY N 1 1 14 12617 1 1 60 GLY O O -5.102 -18.774 -5.063 1.00 . A A . 60 GLY O 1 1 14 12618 1 1 61 LYS C C -4.475 -15.681 -2.857 1.00 . A A . 61 LYS C 1 1 14 12619 1 1 61 LYS CA C -4.286 -16.265 -4.245 1.00 . A A . 61 LYS CA 1 1 14 12620 1 1 61 LYS CB C -3.536 -15.274 -5.135 1.00 . A A . 61 LYS CB 1 1 14 12621 1 1 61 LYS CD C -2.273 -15.019 -7.292 1.00 . A A . 61 LYS CD 1 1 14 12622 1 1 61 LYS CE C -1.127 -15.564 -8.127 1.00 . A A . 61 LYS CE 1 1 14 12623 1 1 61 LYS CG C -2.597 -15.938 -6.127 1.00 . A A . 61 LYS CG 1 1 14 12624 1 1 61 LYS H H -6.262 -15.894 -4.891 1.00 . A A . 61 LYS H 1 1 14 12625 1 1 61 LYS HA H -3.712 -17.175 -4.168 1.00 . A A . 61 LYS HA 1 1 14 12626 1 1 61 LYS HB2 H -4.256 -14.692 -5.690 1.00 . A A . 61 LYS HB2 1 1 14 12627 1 1 61 LYS HB3 H -2.955 -14.614 -4.508 1.00 . A A . 61 LYS HB3 1 1 14 12628 1 1 61 LYS HD2 H -3.149 -14.924 -7.919 1.00 . A A . 61 LYS HD2 1 1 14 12629 1 1 61 LYS HD3 H -1.998 -14.050 -6.905 1.00 . A A . 61 LYS HD3 1 1 14 12630 1 1 61 LYS HE2 H -0.212 -15.084 -7.815 1.00 . A A . 61 LYS HE2 1 1 14 12631 1 1 61 LYS HE3 H -1.050 -16.628 -7.959 1.00 . A A . 61 LYS HE3 1 1 14 12632 1 1 61 LYS HG2 H -1.679 -16.198 -5.622 1.00 . A A . 61 LYS HG2 1 1 14 12633 1 1 61 LYS HG3 H -3.065 -16.835 -6.508 1.00 . A A . 61 LYS HG3 1 1 14 12634 1 1 61 LYS HZ1 H -0.632 -15.868 -10.134 1.00 . A A . 61 LYS HZ1 1 1 14 12635 1 1 61 LYS HZ2 H -1.196 -14.305 -9.792 1.00 . A A . 61 LYS HZ2 1 1 14 12636 1 1 61 LYS HZ3 H -2.287 -15.604 -9.866 1.00 . A A . 61 LYS HZ3 1 1 14 12637 1 1 61 LYS N N -5.579 -16.595 -4.821 1.00 . A A . 61 LYS N 1 1 14 12638 1 1 61 LYS NZ N -1.325 -15.319 -9.579 1.00 . A A . 61 LYS NZ 1 1 14 12639 1 1 61 LYS O O -3.678 -16.013 -1.957 1.00 . A A . 61 LYS O 1 1 14 12640 1 1 61 LYS OXT O -5.440 -14.909 -2.662 1.00 . A A . 61 LYS OXT 1 1 14 12641 2 2 1 ZN ZN ZN -4.920 -4.557 -1.521 1.00 . B A . 62 ZN ZN 1 1 14 12642 3 2 1 ZN ZN ZN 4.140 4.757 3.894 1.00 . C A . 63 ZN ZN 1 1 15 12643 1 1 1 GLY C C -10.177 10.213 -14.756 1.00 . A A . 1 GLY C 1 1 15 12644 1 1 1 GLY CA C -8.671 10.220 -14.902 1.00 . A A . 1 GLY CA 1 1 15 12645 1 1 1 GLY H1 H -8.298 11.182 -13.094 1.00 . A A . 1 GLY H1 1 1 15 12646 1 1 1 GLY H2 H -8.368 12.226 -14.431 1.00 . A A . 1 GLY H2 1 1 15 12647 1 1 1 GLY H3 H -7.007 11.248 -14.191 1.00 . A A . 1 GLY H3 1 1 15 12648 1 1 1 GLY HA2 H -8.421 10.368 -15.943 1.00 . A A . 1 GLY HA2 1 1 15 12649 1 1 1 GLY HA3 H -8.283 9.266 -14.579 1.00 . A A . 1 GLY HA3 1 1 15 12650 1 1 1 GLY N N -8.042 11.293 -14.100 1.00 . A A . 1 GLY N 1 1 15 12651 1 1 1 GLY O O -10.697 9.812 -13.714 1.00 . A A . 1 GLY O 1 1 15 12652 1 1 2 PRO C C -12.996 9.320 -15.876 1.00 . A A . 2 PRO C 1 1 15 12653 1 1 2 PRO CA C -12.377 10.712 -15.754 1.00 . A A . 2 PRO CA 1 1 15 12654 1 1 2 PRO CB C -12.730 11.578 -16.963 1.00 . A A . 2 PRO CB 1 1 15 12655 1 1 2 PRO CD C -10.371 11.179 -17.060 1.00 . A A . 2 PRO CD 1 1 15 12656 1 1 2 PRO CG C -11.594 11.396 -17.908 1.00 . A A . 2 PRO CG 1 1 15 12657 1 1 2 PRO HA H -12.737 11.183 -14.852 1.00 . A A . 2 PRO HA 1 1 15 12658 1 1 2 PRO HB2 H -13.661 11.239 -17.392 1.00 . A A . 2 PRO HB2 1 1 15 12659 1 1 2 PRO HB3 H -12.824 12.608 -16.653 1.00 . A A . 2 PRO HB3 1 1 15 12660 1 1 2 PRO HD2 H -9.718 10.451 -17.520 1.00 . A A . 2 PRO HD2 1 1 15 12661 1 1 2 PRO HD3 H -9.845 12.113 -16.910 1.00 . A A . 2 PRO HD3 1 1 15 12662 1 1 2 PRO HG2 H -11.772 10.534 -18.535 1.00 . A A . 2 PRO HG2 1 1 15 12663 1 1 2 PRO HG3 H -11.477 12.282 -18.515 1.00 . A A . 2 PRO HG3 1 1 15 12664 1 1 2 PRO N N -10.912 10.669 -15.784 1.00 . A A . 2 PRO N 1 1 15 12665 1 1 2 PRO O O -13.432 8.906 -16.952 1.00 . A A . 2 PRO O 1 1 15 12666 1 1 3 LEU C C -14.655 7.074 -13.828 1.00 . A A . 3 LEU C 1 1 15 12667 1 1 3 LEU CA C -13.462 7.210 -14.766 1.00 . A A . 3 LEU CA 1 1 15 12668 1 1 3 LEU CB C -12.342 6.261 -14.331 1.00 . A A . 3 LEU CB 1 1 15 12669 1 1 3 LEU CD1 C -10.674 6.606 -16.180 1.00 . A A . 3 LEU CD1 1 1 15 12670 1 1 3 LEU CD2 C -10.743 4.435 -14.945 1.00 . A A . 3 LEU CD2 1 1 15 12671 1 1 3 LEU CG C -11.568 5.598 -15.472 1.00 . A A . 3 LEU CG 1 1 15 12672 1 1 3 LEU H H -12.558 8.947 -13.968 1.00 . A A . 3 LEU H 1 1 15 12673 1 1 3 LEU HA H -13.773 6.956 -15.767 1.00 . A A . 3 LEU HA 1 1 15 12674 1 1 3 LEU HB2 H -11.641 6.821 -13.727 1.00 . A A . 3 LEU HB2 1 1 15 12675 1 1 3 LEU HB3 H -12.774 5.483 -13.722 1.00 . A A . 3 LEU HB3 1 1 15 12676 1 1 3 LEU HD11 H -9.649 6.268 -16.146 1.00 . A A . 3 LEU HD11 1 1 15 12677 1 1 3 LEU HD12 H -10.987 6.704 -17.209 1.00 . A A . 3 LEU HD12 1 1 15 12678 1 1 3 LEU HD13 H -10.752 7.565 -15.687 1.00 . A A . 3 LEU HD13 1 1 15 12679 1 1 3 LEU HD21 H -10.184 3.992 -15.757 1.00 . A A . 3 LEU HD21 1 1 15 12680 1 1 3 LEU HD22 H -10.059 4.789 -14.190 1.00 . A A . 3 LEU HD22 1 1 15 12681 1 1 3 LEU HD23 H -11.401 3.693 -14.515 1.00 . A A . 3 LEU HD23 1 1 15 12682 1 1 3 LEU HG H -12.269 5.211 -16.194 1.00 . A A . 3 LEU HG 1 1 15 12683 1 1 3 LEU N N -12.972 8.579 -14.780 1.00 . A A . 3 LEU N 1 1 15 12684 1 1 3 LEU O O -14.782 6.083 -13.104 1.00 . A A . 3 LEU O 1 1 15 12685 1 1 4 GLY C C -16.224 8.437 -11.496 1.00 . A A . 4 GLY C 1 1 15 12686 1 1 4 GLY CA C -16.637 8.096 -12.908 1.00 . A A . 4 GLY CA 1 1 15 12687 1 1 4 GLY H H -15.321 8.885 -14.366 1.00 . A A . 4 GLY H 1 1 15 12688 1 1 4 GLY HA2 H -17.358 8.824 -13.251 1.00 . A A . 4 GLY HA2 1 1 15 12689 1 1 4 GLY HA3 H -17.091 7.117 -12.914 1.00 . A A . 4 GLY HA3 1 1 15 12690 1 1 4 GLY N N -15.500 8.097 -13.804 1.00 . A A . 4 GLY N 1 1 15 12691 1 1 4 GLY O O -15.725 9.534 -11.241 1.00 . A A . 4 GLY O 1 1 15 12692 1 1 5 SER C C -14.431 7.044 -9.117 1.00 . A A . 5 SER C 1 1 15 12693 1 1 5 SER CA C -15.826 7.640 -9.247 1.00 . A A . 5 SER CA 1 1 15 12694 1 1 5 SER CB C -16.776 6.982 -8.243 1.00 . A A . 5 SER CB 1 1 15 12695 1 1 5 SER H H -16.631 6.581 -10.889 1.00 . A A . 5 SER H 1 1 15 12696 1 1 5 SER HA H -15.774 8.699 -9.046 1.00 . A A . 5 SER HA 1 1 15 12697 1 1 5 SER HB2 H -16.348 6.050 -7.903 1.00 . A A . 5 SER HB2 1 1 15 12698 1 1 5 SER HB3 H -16.916 7.644 -7.400 1.00 . A A . 5 SER HB3 1 1 15 12699 1 1 5 SER HG H -18.311 7.476 -9.377 1.00 . A A . 5 SER HG 1 1 15 12700 1 1 5 SER N N -16.312 7.464 -10.605 1.00 . A A . 5 SER N 1 1 15 12701 1 1 5 SER O O -13.452 7.775 -8.979 1.00 . A A . 5 SER O 1 1 15 12702 1 1 5 SER OG O -18.043 6.716 -8.829 1.00 . A A . 5 SER OG 1 1 15 12703 1 1 6 ASP C C -12.282 5.391 -7.960 1.00 . A A . 6 ASP C 1 1 15 12704 1 1 6 ASP CA C -13.099 4.977 -9.182 1.00 . A A . 6 ASP CA 1 1 15 12705 1 1 6 ASP CB C -12.283 5.171 -10.467 1.00 . A A . 6 ASP CB 1 1 15 12706 1 1 6 ASP CG C -11.146 4.174 -10.585 1.00 . A A . 6 ASP CG 1 1 15 12707 1 1 6 ASP H H -15.187 5.218 -9.428 1.00 . A A . 6 ASP H 1 1 15 12708 1 1 6 ASP HA H -13.344 3.929 -9.085 1.00 . A A . 6 ASP HA 1 1 15 12709 1 1 6 ASP HB2 H -12.933 5.050 -11.321 1.00 . A A . 6 ASP HB2 1 1 15 12710 1 1 6 ASP HB3 H -11.867 6.167 -10.474 1.00 . A A . 6 ASP HB3 1 1 15 12711 1 1 6 ASP N N -14.359 5.718 -9.250 1.00 . A A . 6 ASP N 1 1 15 12712 1 1 6 ASP O O -12.664 5.090 -6.826 1.00 . A A . 6 ASP O 1 1 15 12713 1 1 6 ASP OD1 O -11.303 3.024 -10.117 1.00 . A A . 6 ASP OD1 1 1 15 12714 1 1 6 ASP OD2 O -10.085 4.537 -11.137 1.00 . A A . 6 ASP OD2 1 1 15 12715 1 1 7 HIS C C -9.662 5.590 -6.342 1.00 . A A . 7 HIS C 1 1 15 12716 1 1 7 HIS CA C -10.361 6.684 -7.144 1.00 . A A . 7 HIS CA 1 1 15 12717 1 1 7 HIS CB C -11.174 7.587 -6.213 1.00 . A A . 7 HIS CB 1 1 15 12718 1 1 7 HIS CD2 C -9.225 9.137 -5.551 1.00 . A A . 7 HIS CD2 1 1 15 12719 1 1 7 HIS CE1 C -10.297 11.019 -5.716 1.00 . A A . 7 HIS CE1 1 1 15 12720 1 1 7 HIS CG C -10.503 8.894 -5.926 1.00 . A A . 7 HIS CG 1 1 15 12721 1 1 7 HIS H H -11.001 6.384 -9.130 1.00 . A A . 7 HIS H 1 1 15 12722 1 1 7 HIS HA H -9.602 7.286 -7.622 1.00 . A A . 7 HIS HA 1 1 15 12723 1 1 7 HIS HB2 H -12.131 7.798 -6.670 1.00 . A A . 7 HIS HB2 1 1 15 12724 1 1 7 HIS HB3 H -11.332 7.078 -5.274 1.00 . A A . 7 HIS HB3 1 1 15 12725 1 1 7 HIS HD2 H -8.451 8.404 -5.380 1.00 . A A . 7 HIS HD2 1 1 15 12726 1 1 7 HIS HE1 H -10.516 12.077 -5.701 1.00 . A A . 7 HIS HE1 1 1 15 12727 1 1 7 HIS HE2 H -8.378 10.953 -4.931 1.00 . A A . 7 HIS HE2 1 1 15 12728 1 1 7 HIS N N -11.206 6.141 -8.201 1.00 . A A . 7 HIS N 1 1 15 12729 1 1 7 HIS ND1 N -11.175 10.085 -6.029 1.00 . A A . 7 HIS ND1 1 1 15 12730 1 1 7 HIS NE2 N -9.101 10.493 -5.418 1.00 . A A . 7 HIS NE2 1 1 15 12731 1 1 7 HIS O O -9.955 4.397 -6.483 1.00 . A A . 7 HIS O 1 1 15 12732 1 1 8 HIS C C -7.414 5.852 -3.475 1.00 . A A . 8 HIS C 1 1 15 12733 1 1 8 HIS CA C -7.955 5.100 -4.687 1.00 . A A . 8 HIS CA 1 1 15 12734 1 1 8 HIS CB C -6.814 4.452 -5.490 1.00 . A A . 8 HIS CB 1 1 15 12735 1 1 8 HIS CD2 C -4.457 5.479 -5.235 1.00 . A A . 8 HIS CD2 1 1 15 12736 1 1 8 HIS CE1 C -4.593 6.908 -6.872 1.00 . A A . 8 HIS CE1 1 1 15 12737 1 1 8 HIS CG C -5.674 5.374 -5.821 1.00 . A A . 8 HIS CG 1 1 15 12738 1 1 8 HIS H H -8.515 6.965 -5.474 1.00 . A A . 8 HIS H 1 1 15 12739 1 1 8 HIS HA H -8.628 4.329 -4.344 1.00 . A A . 8 HIS HA 1 1 15 12740 1 1 8 HIS HB2 H -6.413 3.628 -4.921 1.00 . A A . 8 HIS HB2 1 1 15 12741 1 1 8 HIS HB3 H -7.214 4.075 -6.420 1.00 . A A . 8 HIS HB3 1 1 15 12742 1 1 8 HIS HD2 H -4.092 4.907 -4.392 1.00 . A A . 8 HIS HD2 1 1 15 12743 1 1 8 HIS HE1 H -4.337 7.687 -7.574 1.00 . A A . 8 HIS HE1 1 1 15 12744 1 1 8 HIS HE2 H -2.951 6.906 -5.600 1.00 . A A . 8 HIS HE2 1 1 15 12745 1 1 8 HIS N N -8.714 6.008 -5.521 1.00 . A A . 8 HIS N 1 1 15 12746 1 1 8 HIS ND1 N -5.755 6.277 -6.851 1.00 . A A . 8 HIS ND1 1 1 15 12747 1 1 8 HIS NE2 N -3.775 6.458 -5.912 1.00 . A A . 8 HIS NE2 1 1 15 12748 1 1 8 HIS O O -7.533 7.076 -3.394 1.00 . A A . 8 HIS O 1 1 15 12749 1 1 9 MET C C -4.872 6.339 -1.705 1.00 . A A . 9 MET C 1 1 15 12750 1 1 9 MET CA C -6.221 5.720 -1.366 1.00 . A A . 9 MET CA 1 1 15 12751 1 1 9 MET CB C -6.057 4.654 -0.281 1.00 . A A . 9 MET CB 1 1 15 12752 1 1 9 MET CE C -7.136 4.111 3.471 1.00 . A A . 9 MET CE 1 1 15 12753 1 1 9 MET CG C -6.107 5.196 1.138 1.00 . A A . 9 MET CG 1 1 15 12754 1 1 9 MET H H -6.708 4.157 -2.700 1.00 . A A . 9 MET H 1 1 15 12755 1 1 9 MET HA H -6.887 6.493 -1.012 1.00 . A A . 9 MET HA 1 1 15 12756 1 1 9 MET HB2 H -6.846 3.926 -0.390 1.00 . A A . 9 MET HB2 1 1 15 12757 1 1 9 MET HB3 H -5.106 4.162 -0.421 1.00 . A A . 9 MET HB3 1 1 15 12758 1 1 9 MET HE1 H -7.413 3.144 3.862 1.00 . A A . 9 MET HE1 1 1 15 12759 1 1 9 MET HE2 H -6.873 4.767 4.289 1.00 . A A . 9 MET HE2 1 1 15 12760 1 1 9 MET HE3 H -7.969 4.533 2.927 1.00 . A A . 9 MET HE3 1 1 15 12761 1 1 9 MET HG2 H -5.389 5.997 1.233 1.00 . A A . 9 MET HG2 1 1 15 12762 1 1 9 MET HG3 H -7.099 5.580 1.329 1.00 . A A . 9 MET HG3 1 1 15 12763 1 1 9 MET N N -6.807 5.125 -2.555 1.00 . A A . 9 MET N 1 1 15 12764 1 1 9 MET O O -3.877 5.629 -1.846 1.00 . A A . 9 MET O 1 1 15 12765 1 1 9 MET SD S -5.731 3.934 2.370 1.00 . A A . 9 MET SD 1 1 15 12766 1 1 10 GLU C C -2.718 8.605 -1.102 1.00 . A A . 10 GLU C 1 1 15 12767 1 1 10 GLU CA C -3.636 8.355 -2.297 1.00 . A A . 10 GLU CA 1 1 15 12768 1 1 10 GLU CB C -3.981 9.686 -2.978 1.00 . A A . 10 GLU CB 1 1 15 12769 1 1 10 GLU CD C -6.447 10.228 -2.938 1.00 . A A . 10 GLU CD 1 1 15 12770 1 1 10 GLU CG C -5.294 9.667 -3.745 1.00 . A A . 10 GLU CG 1 1 15 12771 1 1 10 GLU H H -5.693 8.161 -1.813 1.00 . A A . 10 GLU H 1 1 15 12772 1 1 10 GLU HA H -3.114 7.729 -3.005 1.00 . A A . 10 GLU HA 1 1 15 12773 1 1 10 GLU HB2 H -4.041 10.458 -2.224 1.00 . A A . 10 GLU HB2 1 1 15 12774 1 1 10 GLU HB3 H -3.189 9.936 -3.670 1.00 . A A . 10 GLU HB3 1 1 15 12775 1 1 10 GLU HG2 H -5.180 10.258 -4.641 1.00 . A A . 10 GLU HG2 1 1 15 12776 1 1 10 GLU HG3 H -5.525 8.647 -4.015 1.00 . A A . 10 GLU HG3 1 1 15 12777 1 1 10 GLU N N -4.853 7.652 -1.895 1.00 . A A . 10 GLU N 1 1 15 12778 1 1 10 GLU O O -2.067 9.652 -1.009 1.00 . A A . 10 GLU O 1 1 15 12779 1 1 10 GLU OE1 O -6.623 9.814 -1.775 1.00 . A A . 10 GLU OE1 1 1 15 12780 1 1 10 GLU OE2 O -7.184 11.089 -3.459 1.00 . A A . 10 GLU OE2 1 1 15 12781 1 1 11 PHE C C -1.610 6.304 1.572 1.00 . A A . 11 PHE C 1 1 15 12782 1 1 11 PHE CA C -1.729 7.676 0.917 1.00 . A A . 11 PHE CA 1 1 15 12783 1 1 11 PHE CB C -2.223 8.716 1.930 1.00 . A A . 11 PHE CB 1 1 15 12784 1 1 11 PHE CD1 C -4.739 8.724 1.899 1.00 . A A . 11 PHE CD1 1 1 15 12785 1 1 11 PHE CD2 C -3.628 7.794 3.791 1.00 . A A . 11 PHE CD2 1 1 15 12786 1 1 11 PHE CE1 C -5.963 8.444 2.476 1.00 . A A . 11 PHE CE1 1 1 15 12787 1 1 11 PHE CE2 C -4.848 7.509 4.373 1.00 . A A . 11 PHE CE2 1 1 15 12788 1 1 11 PHE CG C -3.558 8.401 2.549 1.00 . A A . 11 PHE CG 1 1 15 12789 1 1 11 PHE CZ C -6.018 7.834 3.713 1.00 . A A . 11 PHE CZ 1 1 15 12790 1 1 11 PHE H H -3.101 6.773 -0.406 1.00 . A A . 11 PHE H 1 1 15 12791 1 1 11 PHE HA H -0.752 7.971 0.562 1.00 . A A . 11 PHE HA 1 1 15 12792 1 1 11 PHE HB2 H -1.503 8.797 2.730 1.00 . A A . 11 PHE HB2 1 1 15 12793 1 1 11 PHE HB3 H -2.305 9.673 1.432 1.00 . A A . 11 PHE HB3 1 1 15 12794 1 1 11 PHE HD1 H -4.696 9.199 0.931 1.00 . A A . 11 PHE HD1 1 1 15 12795 1 1 11 PHE HD2 H -2.710 7.546 4.308 1.00 . A A . 11 PHE HD2 1 1 15 12796 1 1 11 PHE HE1 H -6.876 8.705 1.961 1.00 . A A . 11 PHE HE1 1 1 15 12797 1 1 11 PHE HE2 H -4.888 7.031 5.341 1.00 . A A . 11 PHE HE2 1 1 15 12798 1 1 11 PHE HZ H -6.975 7.614 4.168 1.00 . A A . 11 PHE HZ 1 1 15 12799 1 1 11 PHE N N -2.613 7.610 -0.232 1.00 . A A . 11 PHE N 1 1 15 12800 1 1 11 PHE O O -2.478 5.447 1.397 1.00 . A A . 11 PHE O 1 1 15 12801 1 1 12 CYS C C -1.289 4.512 3.980 1.00 . A A . 12 CYS C 1 1 15 12802 1 1 12 CYS CA C -0.233 4.817 2.927 1.00 . A A . 12 CYS CA 1 1 15 12803 1 1 12 CYS CB C 1.135 4.839 3.605 1.00 . A A . 12 CYS CB 1 1 15 12804 1 1 12 CYS H H 0.184 6.792 2.293 1.00 . A A . 12 CYS H 1 1 15 12805 1 1 12 CYS HA H -0.246 4.038 2.178 1.00 . A A . 12 CYS HA 1 1 15 12806 1 1 12 CYS HB2 H 1.171 5.663 4.300 1.00 . A A . 12 CYS HB2 1 1 15 12807 1 1 12 CYS HB3 H 1.268 3.915 4.149 1.00 . A A . 12 CYS HB3 1 1 15 12808 1 1 12 CYS HG H 3.240 6.080 2.867 1.00 . A A . 12 CYS HG 1 1 15 12809 1 1 12 CYS N N -0.499 6.088 2.264 1.00 . A A . 12 CYS N 1 1 15 12810 1 1 12 CYS O O -1.726 5.402 4.709 1.00 . A A . 12 CYS O 1 1 15 12811 1 1 12 CYS SG S 2.528 5.018 2.485 1.00 . A A . 12 CYS SG 1 1 15 12812 1 1 13 ARG C C -1.843 2.923 6.574 1.00 . A A . 13 ARG C 1 1 15 12813 1 1 13 ARG CA C -2.510 2.805 5.200 1.00 . A A . 13 ARG CA 1 1 15 12814 1 1 13 ARG CB C -2.973 1.367 4.962 1.00 . A A . 13 ARG CB 1 1 15 12815 1 1 13 ARG CD C -4.854 -0.123 4.210 1.00 . A A . 13 ARG CD 1 1 15 12816 1 1 13 ARG CG C -4.249 1.271 4.145 1.00 . A A . 13 ARG CG 1 1 15 12817 1 1 13 ARG CZ C -6.934 -0.084 2.879 1.00 . A A . 13 ARG CZ 1 1 15 12818 1 1 13 ARG H H -1.156 2.560 3.584 1.00 . A A . 13 ARG H 1 1 15 12819 1 1 13 ARG HA H -3.371 3.460 5.176 1.00 . A A . 13 ARG HA 1 1 15 12820 1 1 13 ARG HB2 H -2.194 0.833 4.439 1.00 . A A . 13 ARG HB2 1 1 15 12821 1 1 13 ARG HB3 H -3.147 0.893 5.915 1.00 . A A . 13 ARG HB3 1 1 15 12822 1 1 13 ARG HD2 H -4.055 -0.845 4.287 1.00 . A A . 13 ARG HD2 1 1 15 12823 1 1 13 ARG HD3 H -5.485 -0.192 5.084 1.00 . A A . 13 ARG HD3 1 1 15 12824 1 1 13 ARG HE H -5.192 -0.872 2.278 1.00 . A A . 13 ARG HE 1 1 15 12825 1 1 13 ARG HG2 H -4.965 1.980 4.530 1.00 . A A . 13 ARG HG2 1 1 15 12826 1 1 13 ARG HG3 H -4.023 1.507 3.116 1.00 . A A . 13 ARG HG3 1 1 15 12827 1 1 13 ARG HH11 H -7.160 0.566 4.793 1.00 . A A . 13 ARG HH11 1 1 15 12828 1 1 13 ARG HH12 H -8.578 0.699 3.792 1.00 . A A . 13 ARG HH12 1 1 15 12829 1 1 13 ARG HH21 H -7.043 -0.719 0.955 1.00 . A A . 13 ARG HH21 1 1 15 12830 1 1 13 ARG HH22 H -8.512 -0.034 1.599 1.00 . A A . 13 ARG HH22 1 1 15 12831 1 1 13 ARG N N -1.595 3.235 4.147 1.00 . A A . 13 ARG N 1 1 15 12832 1 1 13 ARG NE N -5.652 -0.423 3.024 1.00 . A A . 13 ARG NE 1 1 15 12833 1 1 13 ARG NH1 N -7.610 0.433 3.902 1.00 . A A . 13 ARG NH1 1 1 15 12834 1 1 13 ARG NH2 N -7.545 -0.300 1.721 1.00 . A A . 13 ARG NH2 1 1 15 12835 1 1 13 ARG O O -2.515 2.950 7.602 1.00 . A A . 13 ARG O 1 1 15 12836 1 1 14 VAL C C 0.829 4.578 7.924 1.00 . A A . 14 VAL C 1 1 15 12837 1 1 14 VAL CA C 0.241 3.172 7.819 1.00 . A A . 14 VAL CA 1 1 15 12838 1 1 14 VAL CB C 1.387 2.141 7.914 1.00 . A A . 14 VAL CB 1 1 15 12839 1 1 14 VAL CG1 C 1.893 2.041 9.341 1.00 . A A . 14 VAL CG1 1 1 15 12840 1 1 14 VAL CG2 C 0.936 0.778 7.409 1.00 . A A . 14 VAL CG2 1 1 15 12841 1 1 14 VAL H H -0.039 3.011 5.726 1.00 . A A . 14 VAL H 1 1 15 12842 1 1 14 VAL HA H -0.434 3.010 8.648 1.00 . A A . 14 VAL HA 1 1 15 12843 1 1 14 VAL HB H 2.202 2.482 7.290 1.00 . A A . 14 VAL HB 1 1 15 12844 1 1 14 VAL HG11 H 1.213 1.434 9.919 1.00 . A A . 14 VAL HG11 1 1 15 12845 1 1 14 VAL HG12 H 2.873 1.588 9.344 1.00 . A A . 14 VAL HG12 1 1 15 12846 1 1 14 VAL HG13 H 1.950 3.029 9.774 1.00 . A A . 14 VAL HG13 1 1 15 12847 1 1 14 VAL HG21 H 0.707 0.843 6.355 1.00 . A A . 14 VAL HG21 1 1 15 12848 1 1 14 VAL HG22 H 1.725 0.059 7.564 1.00 . A A . 14 VAL HG22 1 1 15 12849 1 1 14 VAL HG23 H 0.055 0.469 7.951 1.00 . A A . 14 VAL HG23 1 1 15 12850 1 1 14 VAL N N -0.517 3.021 6.578 1.00 . A A . 14 VAL N 1 1 15 12851 1 1 14 VAL O O 0.327 5.423 8.662 1.00 . A A . 14 VAL O 1 1 15 12852 1 1 15 CYS C C 1.843 7.208 6.312 1.00 . A A . 15 CYS C 1 1 15 12853 1 1 15 CYS CA C 2.562 6.105 7.095 1.00 . A A . 15 CYS CA 1 1 15 12854 1 1 15 CYS CB C 3.985 5.841 6.604 1.00 . A A . 15 CYS CB 1 1 15 12855 1 1 15 CYS H H 2.215 4.097 6.576 1.00 . A A . 15 CYS H 1 1 15 12856 1 1 15 CYS HA H 2.636 6.442 8.116 1.00 . A A . 15 CYS HA 1 1 15 12857 1 1 15 CYS HB2 H 4.239 6.561 5.844 1.00 . A A . 15 CYS HB2 1 1 15 12858 1 1 15 CYS HB3 H 4.673 5.933 7.432 1.00 . A A . 15 CYS HB3 1 1 15 12859 1 1 15 CYS N N 1.866 4.825 7.135 1.00 . A A . 15 CYS N 1 1 15 12860 1 1 15 CYS O O 2.335 8.333 6.270 1.00 . A A . 15 CYS O 1 1 15 12861 1 1 15 CYS SG S 4.182 4.167 5.896 1.00 . A A . 15 CYS SG 1 1 15 12862 1 1 16 LYS C C 0.247 8.979 4.527 1.00 . A A . 16 LYS C 1 1 15 12863 1 1 16 LYS CA C -0.369 7.989 5.520 1.00 . A A . 16 LYS CA 1 1 15 12864 1 1 16 LYS CB C -0.926 8.764 6.716 1.00 . A A . 16 LYS CB 1 1 15 12865 1 1 16 LYS CD C -2.934 9.423 8.051 1.00 . A A . 16 LYS CD 1 1 15 12866 1 1 16 LYS CE C -4.352 9.849 7.723 1.00 . A A . 16 LYS CE 1 1 15 12867 1 1 16 LYS CG C -2.388 8.480 7.000 1.00 . A A . 16 LYS CG 1 1 15 12868 1 1 16 LYS H H 0.193 6.100 6.284 1.00 . A A . 16 LYS H 1 1 15 12869 1 1 16 LYS HA H -1.188 7.482 5.032 1.00 . A A . 16 LYS HA 1 1 15 12870 1 1 16 LYS HB2 H -0.356 8.504 7.596 1.00 . A A . 16 LYS HB2 1 1 15 12871 1 1 16 LYS HB3 H -0.818 9.822 6.527 1.00 . A A . 16 LYS HB3 1 1 15 12872 1 1 16 LYS HD2 H -2.931 8.923 9.008 1.00 . A A . 16 LYS HD2 1 1 15 12873 1 1 16 LYS HD3 H -2.305 10.300 8.098 1.00 . A A . 16 LYS HD3 1 1 15 12874 1 1 16 LYS HE2 H -4.813 9.081 7.120 1.00 . A A . 16 LYS HE2 1 1 15 12875 1 1 16 LYS HE3 H -4.902 9.963 8.645 1.00 . A A . 16 LYS HE3 1 1 15 12876 1 1 16 LYS HG2 H -2.952 8.606 6.088 1.00 . A A . 16 LYS HG2 1 1 15 12877 1 1 16 LYS HG3 H -2.487 7.464 7.352 1.00 . A A . 16 LYS HG3 1 1 15 12878 1 1 16 LYS HZ1 H -3.525 11.689 7.170 1.00 . A A . 16 LYS HZ1 1 1 15 12879 1 1 16 LYS HZ2 H -5.218 11.693 7.264 1.00 . A A . 16 LYS HZ2 1 1 15 12880 1 1 16 LYS HZ3 H -4.442 10.952 5.949 1.00 . A A . 16 LYS HZ3 1 1 15 12881 1 1 16 LYS N N 0.569 6.956 5.998 1.00 . A A . 16 LYS N 1 1 15 12882 1 1 16 LYS NZ N -4.385 11.134 6.977 1.00 . A A . 16 LYS NZ 1 1 15 12883 1 1 16 LYS O O -0.093 10.164 4.534 1.00 . A A . 16 LYS O 1 1 15 12884 1 1 17 ASP C C 1.694 9.033 1.378 1.00 . A A . 17 ASP C 1 1 15 12885 1 1 17 ASP CA C 1.906 9.417 2.831 1.00 . A A . 17 ASP CA 1 1 15 12886 1 1 17 ASP CB C 3.399 9.403 3.150 1.00 . A A . 17 ASP CB 1 1 15 12887 1 1 17 ASP CG C 4.027 8.060 2.872 1.00 . A A . 17 ASP CG 1 1 15 12888 1 1 17 ASP H H 1.483 7.592 3.811 1.00 . A A . 17 ASP H 1 1 15 12889 1 1 17 ASP HA H 1.522 10.412 2.988 1.00 . A A . 17 ASP HA 1 1 15 12890 1 1 17 ASP HB2 H 3.897 10.136 2.541 1.00 . A A . 17 ASP HB2 1 1 15 12891 1 1 17 ASP HB3 H 3.545 9.643 4.192 1.00 . A A . 17 ASP HB3 1 1 15 12892 1 1 17 ASP N N 1.192 8.523 3.728 1.00 . A A . 17 ASP N 1 1 15 12893 1 1 17 ASP O O 1.291 7.911 1.078 1.00 . A A . 17 ASP O 1 1 15 12894 1 1 17 ASP OD1 O 3.850 7.133 3.693 1.00 . A A . 17 ASP OD1 1 1 15 12895 1 1 17 ASP OD2 O 4.687 7.913 1.825 1.00 . A A . 17 ASP OD2 1 1 15 12896 1 1 18 GLY C C 3.167 9.992 -1.664 1.00 . A A . 18 GLY C 1 1 15 12897 1 1 18 GLY CA C 1.868 9.723 -0.934 1.00 . A A . 18 GLY CA 1 1 15 12898 1 1 18 GLY H H 2.328 10.834 0.804 1.00 . A A . 18 GLY H 1 1 15 12899 1 1 18 GLY HA2 H 1.580 8.691 -1.092 1.00 . A A . 18 GLY HA2 1 1 15 12900 1 1 18 GLY HA3 H 1.101 10.370 -1.334 1.00 . A A . 18 GLY HA3 1 1 15 12901 1 1 18 GLY N N 1.992 9.966 0.488 1.00 . A A . 18 GLY N 1 1 15 12902 1 1 18 GLY O O 4.231 10.063 -1.044 1.00 . A A . 18 GLY O 1 1 15 12903 1 1 19 GLY C C 4.616 9.224 -4.667 1.00 . A A . 19 GLY C 1 1 15 12904 1 1 19 GLY CA C 4.285 10.392 -3.769 1.00 . A A . 19 GLY CA 1 1 15 12905 1 1 19 GLY H H 2.219 10.054 -3.427 1.00 . A A . 19 GLY H 1 1 15 12906 1 1 19 GLY HA2 H 4.128 11.271 -4.376 1.00 . A A . 19 GLY HA2 1 1 15 12907 1 1 19 GLY HA3 H 5.117 10.571 -3.102 1.00 . A A . 19 GLY HA3 1 1 15 12908 1 1 19 GLY N N 3.093 10.141 -2.979 1.00 . A A . 19 GLY N 1 1 15 12909 1 1 19 GLY O O 3.850 8.901 -5.576 1.00 . A A . 19 GLY O 1 1 15 12910 1 1 20 GLU C C 5.237 6.130 -4.436 1.00 . A A . 20 GLU C 1 1 15 12911 1 1 20 GLU CA C 6.028 7.284 -5.037 1.00 . A A . 20 GLU CA 1 1 15 12912 1 1 20 GLU CB C 7.531 7.007 -4.945 1.00 . A A . 20 GLU CB 1 1 15 12913 1 1 20 GLU CD C 8.437 6.405 -7.224 1.00 . A A . 20 GLU CD 1 1 15 12914 1 1 20 GLU CG C 8.003 5.895 -5.868 1.00 . A A . 20 GLU CG 1 1 15 12915 1 1 20 GLU H H 6.203 8.767 -3.537 1.00 . A A . 20 GLU H 1 1 15 12916 1 1 20 GLU HA H 5.747 7.401 -6.072 1.00 . A A . 20 GLU HA 1 1 15 12917 1 1 20 GLU HB2 H 8.068 7.908 -5.199 1.00 . A A . 20 GLU HB2 1 1 15 12918 1 1 20 GLU HB3 H 7.773 6.728 -3.929 1.00 . A A . 20 GLU HB3 1 1 15 12919 1 1 20 GLU HG2 H 8.838 5.390 -5.407 1.00 . A A . 20 GLU HG2 1 1 15 12920 1 1 20 GLU HG3 H 7.193 5.194 -6.007 1.00 . A A . 20 GLU HG3 1 1 15 12921 1 1 20 GLU N N 5.685 8.511 -4.336 1.00 . A A . 20 GLU N 1 1 15 12922 1 1 20 GLU O O 5.761 5.338 -3.653 1.00 . A A . 20 GLU O 1 1 15 12923 1 1 20 GLU OE1 O 7.565 6.672 -8.077 1.00 . A A . 20 GLU OE1 1 1 15 12924 1 1 20 GLU OE2 O 9.657 6.535 -7.447 1.00 . A A . 20 GLU OE2 1 1 15 12925 1 1 21 LEU C C 2.782 4.007 -4.879 1.00 . A A . 21 LEU C 1 1 15 12926 1 1 21 LEU CA C 3.035 5.231 -4.014 1.00 . A A . 21 LEU CA 1 1 15 12927 1 1 21 LEU CB C 1.714 5.930 -3.693 1.00 . A A . 21 LEU CB 1 1 15 12928 1 1 21 LEU CD1 C 2.434 5.996 -1.281 1.00 . A A . 21 LEU CD1 1 1 15 12929 1 1 21 LEU CD2 C 0.194 6.882 -1.955 1.00 . A A . 21 LEU CD2 1 1 15 12930 1 1 21 LEU CG C 1.258 5.836 -2.236 1.00 . A A . 21 LEU CG 1 1 15 12931 1 1 21 LEU H H 3.563 6.896 -5.192 1.00 . A A . 21 LEU H 1 1 15 12932 1 1 21 LEU HA H 3.495 4.914 -3.091 1.00 . A A . 21 LEU HA 1 1 15 12933 1 1 21 LEU HB2 H 1.813 6.975 -3.949 1.00 . A A . 21 LEU HB2 1 1 15 12934 1 1 21 LEU HB3 H 0.943 5.499 -4.315 1.00 . A A . 21 LEU HB3 1 1 15 12935 1 1 21 LEU HD11 H 2.523 5.109 -0.669 1.00 . A A . 21 LEU HD11 1 1 15 12936 1 1 21 LEU HD12 H 3.344 6.133 -1.848 1.00 . A A . 21 LEU HD12 1 1 15 12937 1 1 21 LEU HD13 H 2.270 6.854 -0.648 1.00 . A A . 21 LEU HD13 1 1 15 12938 1 1 21 LEU HD21 H 0.599 7.638 -1.298 1.00 . A A . 21 LEU HD21 1 1 15 12939 1 1 21 LEU HD22 H -0.116 7.340 -2.883 1.00 . A A . 21 LEU HD22 1 1 15 12940 1 1 21 LEU HD23 H -0.658 6.414 -1.484 1.00 . A A . 21 LEU HD23 1 1 15 12941 1 1 21 LEU HG H 0.820 4.862 -2.065 1.00 . A A . 21 LEU HG 1 1 15 12942 1 1 21 LEU N N 3.937 6.160 -4.661 1.00 . A A . 21 LEU N 1 1 15 12943 1 1 21 LEU O O 2.358 4.120 -6.031 1.00 . A A . 21 LEU O 1 1 15 12944 1 1 22 LEU C C 1.311 1.109 -4.523 1.00 . A A . 22 LEU C 1 1 15 12945 1 1 22 LEU CA C 2.687 1.588 -4.953 1.00 . A A . 22 LEU CA 1 1 15 12946 1 1 22 LEU CB C 3.746 0.540 -4.605 1.00 . A A . 22 LEU CB 1 1 15 12947 1 1 22 LEU CD1 C 6.115 1.233 -4.990 1.00 . A A . 22 LEU CD1 1 1 15 12948 1 1 22 LEU CD2 C 5.307 -0.970 -5.843 1.00 . A A . 22 LEU CD2 1 1 15 12949 1 1 22 LEU CG C 4.931 0.475 -5.564 1.00 . A A . 22 LEU CG 1 1 15 12950 1 1 22 LEU H H 3.275 2.827 -3.351 1.00 . A A . 22 LEU H 1 1 15 12951 1 1 22 LEU HA H 2.686 1.759 -6.019 1.00 . A A . 22 LEU HA 1 1 15 12952 1 1 22 LEU HB2 H 4.123 0.756 -3.617 1.00 . A A . 22 LEU HB2 1 1 15 12953 1 1 22 LEU HB3 H 3.273 -0.430 -4.588 1.00 . A A . 22 LEU HB3 1 1 15 12954 1 1 22 LEU HD11 H 6.981 1.077 -5.616 1.00 . A A . 22 LEU HD11 1 1 15 12955 1 1 22 LEU HD12 H 5.881 2.285 -4.951 1.00 . A A . 22 LEU HD12 1 1 15 12956 1 1 22 LEU HD13 H 6.320 0.872 -3.992 1.00 . A A . 22 LEU HD13 1 1 15 12957 1 1 22 LEU HD21 H 6.129 -0.997 -6.541 1.00 . A A . 22 LEU HD21 1 1 15 12958 1 1 22 LEU HD22 H 5.601 -1.451 -4.921 1.00 . A A . 22 LEU HD22 1 1 15 12959 1 1 22 LEU HD23 H 4.459 -1.489 -6.264 1.00 . A A . 22 LEU HD23 1 1 15 12960 1 1 22 LEU HG H 4.658 0.938 -6.501 1.00 . A A . 22 LEU HG 1 1 15 12961 1 1 22 LEU N N 2.981 2.842 -4.291 1.00 . A A . 22 LEU N 1 1 15 12962 1 1 22 LEU O O 1.055 0.934 -3.332 1.00 . A A . 22 LEU O 1 1 15 12963 1 1 23 CYS C C -1.236 -0.812 -5.487 1.00 . A A . 23 CYS C 1 1 15 12964 1 1 23 CYS CA C -0.979 0.654 -5.170 1.00 . A A . 23 CYS CA 1 1 15 12965 1 1 23 CYS CB C -1.946 1.528 -5.974 1.00 . A A . 23 CYS CB 1 1 15 12966 1 1 23 CYS H H 0.640 1.260 -6.394 1.00 . A A . 23 CYS H 1 1 15 12967 1 1 23 CYS HA H -1.146 0.820 -4.118 1.00 . A A . 23 CYS HA 1 1 15 12968 1 1 23 CYS HB2 H -1.978 1.171 -6.991 1.00 . A A . 23 CYS HB2 1 1 15 12969 1 1 23 CYS HB3 H -2.932 1.452 -5.539 1.00 . A A . 23 CYS HB3 1 1 15 12970 1 1 23 CYS HG H -1.873 3.820 -4.866 1.00 . A A . 23 CYS HG 1 1 15 12971 1 1 23 CYS N N 0.398 1.021 -5.471 1.00 . A A . 23 CYS N 1 1 15 12972 1 1 23 CYS O O -0.537 -1.409 -6.308 1.00 . A A . 23 CYS O 1 1 15 12973 1 1 23 CYS SG S -1.498 3.280 -6.022 1.00 . A A . 23 CYS SG 1 1 15 12974 1 1 24 CYS C C -3.072 -3.000 -6.496 1.00 . A A . 24 CYS C 1 1 15 12975 1 1 24 CYS CA C -2.638 -2.756 -5.053 1.00 . A A . 24 CYS CA 1 1 15 12976 1 1 24 CYS CB C -3.799 -3.097 -4.128 1.00 . A A . 24 CYS CB 1 1 15 12977 1 1 24 CYS H H -2.720 -0.855 -4.150 1.00 . A A . 24 CYS H 1 1 15 12978 1 1 24 CYS HA H -1.799 -3.393 -4.821 1.00 . A A . 24 CYS HA 1 1 15 12979 1 1 24 CYS HB2 H -3.543 -2.789 -3.125 1.00 . A A . 24 CYS HB2 1 1 15 12980 1 1 24 CYS HB3 H -4.671 -2.547 -4.450 1.00 . A A . 24 CYS HB3 1 1 15 12981 1 1 24 CYS N N -2.241 -1.379 -4.831 1.00 . A A . 24 CYS N 1 1 15 12982 1 1 24 CYS O O -3.245 -2.070 -7.289 1.00 . A A . 24 CYS O 1 1 15 12983 1 1 24 CYS SG S -4.255 -4.857 -4.055 1.00 . A A . 24 CYS SG 1 1 15 12984 1 1 25 ASP C C -5.432 -5.030 -7.832 1.00 . A A . 25 ASP C 1 1 15 12985 1 1 25 ASP CA C -3.974 -4.654 -8.029 1.00 . A A . 25 ASP CA 1 1 15 12986 1 1 25 ASP CB C -3.212 -5.851 -8.595 1.00 . A A . 25 ASP CB 1 1 15 12987 1 1 25 ASP CG C -3.180 -5.863 -10.108 1.00 . A A . 25 ASP CG 1 1 15 12988 1 1 25 ASP H H -3.374 -4.902 -6.023 1.00 . A A . 25 ASP H 1 1 15 12989 1 1 25 ASP HA H -3.908 -3.823 -8.715 1.00 . A A . 25 ASP HA 1 1 15 12990 1 1 25 ASP HB2 H -2.198 -5.827 -8.230 1.00 . A A . 25 ASP HB2 1 1 15 12991 1 1 25 ASP HB3 H -3.687 -6.761 -8.257 1.00 . A A . 25 ASP HB3 1 1 15 12992 1 1 25 ASP N N -3.405 -4.249 -6.759 1.00 . A A . 25 ASP N 1 1 15 12993 1 1 25 ASP O O -6.135 -5.371 -8.781 1.00 . A A . 25 ASP O 1 1 15 12994 1 1 25 ASP OD1 O -2.700 -4.878 -10.708 1.00 . A A . 25 ASP OD1 1 1 15 12995 1 1 25 ASP OD2 O -3.620 -6.873 -10.705 1.00 . A A . 25 ASP OD2 1 1 15 12996 1 1 26 THR C C -7.883 -4.342 -5.339 1.00 . A A . 26 THR C 1 1 15 12997 1 1 26 THR CA C -7.230 -5.388 -6.243 1.00 . A A . 26 THR CA 1 1 15 12998 1 1 26 THR CB C -7.280 -6.777 -5.570 1.00 . A A . 26 THR CB 1 1 15 12999 1 1 26 THR CG2 C -7.328 -7.877 -6.617 1.00 . A A . 26 THR CG2 1 1 15 13000 1 1 26 THR H H -5.249 -4.745 -5.857 1.00 . A A . 26 THR H 1 1 15 13001 1 1 26 THR HA H -7.791 -5.443 -7.165 1.00 . A A . 26 THR HA 1 1 15 13002 1 1 26 THR HB H -8.174 -6.838 -4.965 1.00 . A A . 26 THR HB 1 1 15 13003 1 1 26 THR HG1 H -5.518 -6.238 -4.831 1.00 . A A . 26 THR HG1 1 1 15 13004 1 1 26 THR HG21 H -6.361 -7.955 -7.099 1.00 . A A . 26 THR HG21 1 1 15 13005 1 1 26 THR HG22 H -8.080 -7.640 -7.356 1.00 . A A . 26 THR HG22 1 1 15 13006 1 1 26 THR HG23 H -7.572 -8.816 -6.143 1.00 . A A . 26 THR HG23 1 1 15 13007 1 1 26 THR N N -5.868 -5.012 -6.578 1.00 . A A . 26 THR N 1 1 15 13008 1 1 26 THR O O -8.933 -3.789 -5.682 1.00 . A A . 26 THR O 1 1 15 13009 1 1 26 THR OG1 O -6.130 -6.980 -4.731 1.00 . A A . 26 THR OG1 1 1 15 13010 1 1 27 CYS C C -7.183 -1.589 -3.832 1.00 . A A . 27 CYS C 1 1 15 13011 1 1 27 CYS CA C -7.697 -2.951 -3.356 1.00 . A A . 27 CYS CA 1 1 15 13012 1 1 27 CYS CB C -7.245 -3.215 -1.911 1.00 . A A . 27 CYS CB 1 1 15 13013 1 1 27 CYS H H -6.345 -4.415 -4.060 1.00 . A A . 27 CYS H 1 1 15 13014 1 1 27 CYS HA H -8.777 -2.950 -3.394 1.00 . A A . 27 CYS HA 1 1 15 13015 1 1 27 CYS HB2 H -6.364 -2.626 -1.708 1.00 . A A . 27 CYS HB2 1 1 15 13016 1 1 27 CYS HB3 H -8.034 -2.915 -1.236 1.00 . A A . 27 CYS HB3 1 1 15 13017 1 1 27 CYS N N -7.217 -4.003 -4.240 1.00 . A A . 27 CYS N 1 1 15 13018 1 1 27 CYS O O -6.291 -1.518 -4.675 1.00 . A A . 27 CYS O 1 1 15 13019 1 1 27 CYS SG S -6.838 -4.956 -1.546 1.00 . A A . 27 CYS SG 1 1 15 13020 1 1 28 PRO C C -6.272 1.434 -2.893 1.00 . A A . 28 PRO C 1 1 15 13021 1 1 28 PRO CA C -7.382 0.853 -3.769 1.00 . A A . 28 PRO CA 1 1 15 13022 1 1 28 PRO CB C -8.674 1.643 -3.597 1.00 . A A . 28 PRO CB 1 1 15 13023 1 1 28 PRO CD C -8.944 -0.458 -2.449 1.00 . A A . 28 PRO CD 1 1 15 13024 1 1 28 PRO CG C -9.364 0.991 -2.446 1.00 . A A . 28 PRO CG 1 1 15 13025 1 1 28 PRO HA H -7.076 0.878 -4.804 1.00 . A A . 28 PRO HA 1 1 15 13026 1 1 28 PRO HB2 H -8.443 2.677 -3.388 1.00 . A A . 28 PRO HB2 1 1 15 13027 1 1 28 PRO HB3 H -9.264 1.574 -4.498 1.00 . A A . 28 PRO HB3 1 1 15 13028 1 1 28 PRO HD2 H -8.666 -0.770 -1.454 1.00 . A A . 28 PRO HD2 1 1 15 13029 1 1 28 PRO HD3 H -9.742 -1.079 -2.830 1.00 . A A . 28 PRO HD3 1 1 15 13030 1 1 28 PRO HG2 H -9.062 1.464 -1.523 1.00 . A A . 28 PRO HG2 1 1 15 13031 1 1 28 PRO HG3 H -10.433 1.069 -2.573 1.00 . A A . 28 PRO HG3 1 1 15 13032 1 1 28 PRO N N -7.778 -0.488 -3.355 1.00 . A A . 28 PRO N 1 1 15 13033 1 1 28 PRO O O -5.979 2.626 -2.956 1.00 . A A . 28 PRO O 1 1 15 13034 1 1 29 SER C C -3.338 1.265 -1.793 1.00 . A A . 29 SER C 1 1 15 13035 1 1 29 SER CA C -4.677 1.039 -1.098 1.00 . A A . 29 SER CA 1 1 15 13036 1 1 29 SER CB C -4.518 -0.002 0.005 1.00 . A A . 29 SER CB 1 1 15 13037 1 1 29 SER H H -6.008 -0.330 -2.001 1.00 . A A . 29 SER H 1 1 15 13038 1 1 29 SER HA H -5.003 1.969 -0.657 1.00 . A A . 29 SER HA 1 1 15 13039 1 1 29 SER HB2 H -3.515 -0.403 -0.022 1.00 . A A . 29 SER HB2 1 1 15 13040 1 1 29 SER HB3 H -4.696 0.462 0.964 1.00 . A A . 29 SER HB3 1 1 15 13041 1 1 29 SER HG H -4.973 -1.836 -0.531 1.00 . A A . 29 SER HG 1 1 15 13042 1 1 29 SER N N -5.704 0.601 -2.035 1.00 . A A . 29 SER N 1 1 15 13043 1 1 29 SER O O -3.016 0.598 -2.778 1.00 . A A . 29 SER O 1 1 15 13044 1 1 29 SER OG O -5.442 -1.067 -0.167 1.00 . A A . 29 SER OG 1 1 15 13045 1 1 30 SER C C -0.213 2.594 -0.624 1.00 . A A . 30 SER C 1 1 15 13046 1 1 30 SER CA C -1.219 2.460 -1.763 1.00 . A A . 30 SER CA 1 1 15 13047 1 1 30 SER CB C -1.242 3.734 -2.602 1.00 . A A . 30 SER CB 1 1 15 13048 1 1 30 SER H H -2.847 2.652 -0.440 1.00 . A A . 30 SER H 1 1 15 13049 1 1 30 SER HA H -0.926 1.631 -2.389 1.00 . A A . 30 SER HA 1 1 15 13050 1 1 30 SER HB2 H -1.084 4.585 -1.958 1.00 . A A . 30 SER HB2 1 1 15 13051 1 1 30 SER HB3 H -0.452 3.691 -3.338 1.00 . A A . 30 SER HB3 1 1 15 13052 1 1 30 SER HG H -3.066 4.442 -2.729 1.00 . A A . 30 SER HG 1 1 15 13053 1 1 30 SER N N -2.546 2.178 -1.243 1.00 . A A . 30 SER N 1 1 15 13054 1 1 30 SER O O -0.592 2.875 0.518 1.00 . A A . 30 SER O 1 1 15 13055 1 1 30 SER OG O -2.482 3.892 -3.269 1.00 . A A . 30 SER OG 1 1 15 13056 1 1 31 TYR C C 3.424 2.710 -0.402 1.00 . A A . 31 TYR C 1 1 15 13057 1 1 31 TYR CA C 2.075 2.213 0.126 1.00 . A A . 31 TYR CA 1 1 15 13058 1 1 31 TYR CB C 2.254 0.773 0.627 1.00 . A A . 31 TYR CB 1 1 15 13059 1 1 31 TYR CD1 C 0.880 0.316 2.700 1.00 . A A . 31 TYR CD1 1 1 15 13060 1 1 31 TYR CD2 C 0.103 -0.553 0.622 1.00 . A A . 31 TYR CD2 1 1 15 13061 1 1 31 TYR CE1 C -0.204 -0.246 3.343 1.00 . A A . 31 TYR CE1 1 1 15 13062 1 1 31 TYR CE2 C -0.980 -1.122 1.259 1.00 . A A . 31 TYR CE2 1 1 15 13063 1 1 31 TYR CG C 1.050 0.176 1.329 1.00 . A A . 31 TYR CG 1 1 15 13064 1 1 31 TYR CZ C -1.130 -0.965 2.619 1.00 . A A . 31 TYR CZ 1 1 15 13065 1 1 31 TYR H H 1.254 1.917 -1.807 1.00 . A A . 31 TYR H 1 1 15 13066 1 1 31 TYR HA H 1.762 2.837 0.947 1.00 . A A . 31 TYR HA 1 1 15 13067 1 1 31 TYR HB2 H 2.485 0.140 -0.215 1.00 . A A . 31 TYR HB2 1 1 15 13068 1 1 31 TYR HB3 H 3.083 0.747 1.320 1.00 . A A . 31 TYR HB3 1 1 15 13069 1 1 31 TYR HD1 H 1.609 0.879 3.265 1.00 . A A . 31 TYR HD1 1 1 15 13070 1 1 31 TYR HD2 H 0.221 -0.670 -0.448 1.00 . A A . 31 TYR HD2 1 1 15 13071 1 1 31 TYR HE1 H -0.324 -0.121 4.408 1.00 . A A . 31 TYR HE1 1 1 15 13072 1 1 31 TYR HE2 H -1.703 -1.687 0.691 1.00 . A A . 31 TYR HE2 1 1 15 13073 1 1 31 TYR HH H -2.771 -1.990 2.620 1.00 . A A . 31 TYR HH 1 1 15 13074 1 1 31 TYR N N 1.042 2.254 -0.905 1.00 . A A . 31 TYR N 1 1 15 13075 1 1 31 TYR O O 3.585 2.946 -1.600 1.00 . A A . 31 TYR O 1 1 15 13076 1 1 31 TYR OH O -2.203 -1.537 3.265 1.00 . A A . 31 TYR OH 1 1 15 13077 1 1 32 HIS C C 6.263 1.437 -0.553 1.00 . A A . 32 HIS C 1 1 15 13078 1 1 32 HIS CA C 5.834 2.753 0.107 1.00 . A A . 32 HIS CA 1 1 15 13079 1 1 32 HIS CB C 6.699 2.957 1.377 1.00 . A A . 32 HIS CB 1 1 15 13080 1 1 32 HIS CD2 C 7.896 5.228 1.678 1.00 . A A . 32 HIS CD2 1 1 15 13081 1 1 32 HIS CE1 C 6.561 6.057 3.190 1.00 . A A . 32 HIS CE1 1 1 15 13082 1 1 32 HIS CG C 6.874 4.361 1.890 1.00 . A A . 32 HIS CG 1 1 15 13083 1 1 32 HIS H H 4.224 2.224 1.353 1.00 . A A . 32 HIS H 1 1 15 13084 1 1 32 HIS HA H 5.955 3.579 -0.576 1.00 . A A . 32 HIS HA 1 1 15 13085 1 1 32 HIS HB2 H 6.262 2.383 2.177 1.00 . A A . 32 HIS HB2 1 1 15 13086 1 1 32 HIS HB3 H 7.685 2.568 1.181 1.00 . A A . 32 HIS HB3 1 1 15 13087 1 1 32 HIS HD2 H 8.715 5.103 0.985 1.00 . A A . 32 HIS HD2 1 1 15 13088 1 1 32 HIS HE1 H 6.138 6.721 3.931 1.00 . A A . 32 HIS HE1 1 1 15 13089 1 1 32 HIS HE2 H 8.134 7.178 2.422 1.00 . A A . 32 HIS HE2 1 1 15 13090 1 1 32 HIS N N 4.425 2.614 0.471 1.00 . A A . 32 HIS N 1 1 15 13091 1 1 32 HIS ND1 N 6.034 4.899 2.841 1.00 . A A . 32 HIS ND1 1 1 15 13092 1 1 32 HIS NE2 N 7.694 6.301 2.511 1.00 . A A . 32 HIS NE2 1 1 15 13093 1 1 32 HIS O O 5.457 0.770 -1.204 1.00 . A A . 32 HIS O 1 1 15 13094 1 1 33 ILE C C 8.103 -1.202 0.796 1.00 . A A . 33 ILE C 1 1 15 13095 1 1 33 ILE CA C 7.813 -0.417 -0.488 1.00 . A A . 33 ILE CA 1 1 15 13096 1 1 33 ILE CB C 9.053 -0.461 -1.420 1.00 . A A . 33 ILE CB 1 1 15 13097 1 1 33 ILE CD1 C 11.582 -0.621 -1.191 1.00 . A A . 33 ILE CD1 1 1 15 13098 1 1 33 ILE CG1 C 10.307 0.028 -0.693 1.00 . A A . 33 ILE CG1 1 1 15 13099 1 1 33 ILE CG2 C 8.810 0.371 -2.671 1.00 . A A . 33 ILE CG2 1 1 15 13100 1 1 33 ILE H H 7.970 1.441 0.479 1.00 . A A . 33 ILE H 1 1 15 13101 1 1 33 ILE HA H 6.982 -0.882 -1.003 1.00 . A A . 33 ILE HA 1 1 15 13102 1 1 33 ILE HB H 9.203 -1.486 -1.726 1.00 . A A . 33 ILE HB 1 1 15 13103 1 1 33 ILE HD11 H 11.411 -1.675 -1.353 1.00 . A A . 33 ILE HD11 1 1 15 13104 1 1 33 ILE HD12 H 11.883 -0.159 -2.120 1.00 . A A . 33 ILE HD12 1 1 15 13105 1 1 33 ILE HD13 H 12.362 -0.492 -0.456 1.00 . A A . 33 ILE HD13 1 1 15 13106 1 1 33 ILE HG12 H 10.402 1.096 -0.828 1.00 . A A . 33 ILE HG12 1 1 15 13107 1 1 33 ILE HG21 H 9.467 0.036 -3.461 1.00 . A A . 33 ILE HG21 1 1 15 13108 1 1 33 ILE HG22 H 7.784 0.259 -2.983 1.00 . A A . 33 ILE HG22 1 1 15 13109 1 1 33 ILE HG23 H 9.009 1.411 -2.455 1.00 . A A . 33 ILE HG23 1 1 15 13110 1 1 33 ILE N N 7.425 0.939 -0.157 1.00 . A A . 33 ILE N 1 1 15 13111 1 1 33 ILE O O 8.677 -2.288 0.753 1.00 . A A . 33 ILE O 1 1 15 13112 1 1 34 HIS C C 7.255 -0.801 4.398 1.00 . A A . 34 HIS C 1 1 15 13113 1 1 34 HIS CA C 8.166 -1.211 3.231 1.00 . A A . 34 HIS CA 1 1 15 13114 1 1 34 HIS CB C 9.623 -0.841 3.564 1.00 . A A . 34 HIS CB 1 1 15 13115 1 1 34 HIS CD2 C 10.152 1.377 4.788 1.00 . A A . 34 HIS CD2 1 1 15 13116 1 1 34 HIS CE1 C 10.108 2.682 3.046 1.00 . A A . 34 HIS CE1 1 1 15 13117 1 1 34 HIS CG C 9.873 0.639 3.686 1.00 . A A . 34 HIS CG 1 1 15 13118 1 1 34 HIS H H 7.382 0.283 1.945 1.00 . A A . 34 HIS H 1 1 15 13119 1 1 34 HIS HA H 8.107 -2.283 3.114 1.00 . A A . 34 HIS HA 1 1 15 13120 1 1 34 HIS HB2 H 9.893 -1.298 4.505 1.00 . A A . 34 HIS HB2 1 1 15 13121 1 1 34 HIS HB3 H 10.270 -1.225 2.787 1.00 . A A . 34 HIS HB3 1 1 15 13122 1 1 34 HIS HD2 H 10.239 1.016 5.803 1.00 . A A . 34 HIS HD2 1 1 15 13123 1 1 34 HIS HE1 H 10.157 3.565 2.430 1.00 . A A . 34 HIS HE1 1 1 15 13124 1 1 34 HIS HE2 H 10.733 3.398 4.894 1.00 . A A . 34 HIS HE2 1 1 15 13125 1 1 34 HIS N N 7.784 -0.608 1.954 1.00 . A A . 34 HIS N 1 1 15 13126 1 1 34 HIS ND1 N 9.848 1.470 2.587 1.00 . A A . 34 HIS ND1 1 1 15 13127 1 1 34 HIS NE2 N 10.299 2.675 4.373 1.00 . A A . 34 HIS NE2 1 1 15 13128 1 1 34 HIS O O 7.631 -0.972 5.559 1.00 . A A . 34 HIS O 1 1 15 13129 1 1 35 CYS C C 4.643 -1.055 5.947 1.00 . A A . 35 CYS C 1 1 15 13130 1 1 35 CYS CA C 5.163 0.154 5.178 1.00 . A A . 35 CYS CA 1 1 15 13131 1 1 35 CYS CB C 3.982 0.918 4.595 1.00 . A A . 35 CYS CB 1 1 15 13132 1 1 35 CYS H H 5.813 -0.122 3.179 1.00 . A A . 35 CYS H 1 1 15 13133 1 1 35 CYS HA H 5.706 0.798 5.854 1.00 . A A . 35 CYS HA 1 1 15 13134 1 1 35 CYS HB2 H 3.183 0.223 4.375 1.00 . A A . 35 CYS HB2 1 1 15 13135 1 1 35 CYS HB3 H 3.637 1.642 5.316 1.00 . A A . 35 CYS HB3 1 1 15 13136 1 1 35 CYS N N 6.074 -0.260 4.112 1.00 . A A . 35 CYS N 1 1 15 13137 1 1 35 CYS O O 4.601 -1.062 7.180 1.00 . A A . 35 CYS O 1 1 15 13138 1 1 35 CYS SG S 4.381 1.804 3.065 1.00 . A A . 35 CYS SG 1 1 15 13139 1 1 36 LEU C C 4.565 -4.071 6.541 1.00 . A A . 36 LEU C 1 1 15 13140 1 1 36 LEU CA C 3.570 -3.240 5.735 1.00 . A A . 36 LEU CA 1 1 15 13141 1 1 36 LEU CB C 2.985 -4.085 4.598 1.00 . A A . 36 LEU CB 1 1 15 13142 1 1 36 LEU CD1 C 3.855 -5.137 2.493 1.00 . A A . 36 LEU CD1 1 1 15 13143 1 1 36 LEU CD2 C 2.681 -2.940 2.386 1.00 . A A . 36 LEU CD2 1 1 15 13144 1 1 36 LEU CG C 3.595 -3.828 3.216 1.00 . A A . 36 LEU CG 1 1 15 13145 1 1 36 LEU H H 4.211 -1.925 4.217 1.00 . A A . 36 LEU H 1 1 15 13146 1 1 36 LEU HA H 2.765 -2.933 6.387 1.00 . A A . 36 LEU HA 1 1 15 13147 1 1 36 LEU HB2 H 3.129 -5.127 4.844 1.00 . A A . 36 LEU HB2 1 1 15 13148 1 1 36 LEU HB3 H 1.925 -3.890 4.539 1.00 . A A . 36 LEU HB3 1 1 15 13149 1 1 36 LEU HD11 H 3.154 -5.243 1.678 1.00 . A A . 36 LEU HD11 1 1 15 13150 1 1 36 LEU HD12 H 4.863 -5.143 2.105 1.00 . A A . 36 LEU HD12 1 1 15 13151 1 1 36 LEU HD13 H 3.732 -5.958 3.184 1.00 . A A . 36 LEU HD13 1 1 15 13152 1 1 36 LEU HD21 H 3.253 -2.468 1.600 1.00 . A A . 36 LEU HD21 1 1 15 13153 1 1 36 LEU HD22 H 1.896 -3.539 1.950 1.00 . A A . 36 LEU HD22 1 1 15 13154 1 1 36 LEU HD23 H 2.244 -2.179 3.018 1.00 . A A . 36 LEU HD23 1 1 15 13155 1 1 36 LEU HG H 4.541 -3.318 3.335 1.00 . A A . 36 LEU HG 1 1 15 13156 1 1 36 LEU N N 4.184 -2.038 5.188 1.00 . A A . 36 LEU N 1 1 15 13157 1 1 36 LEU O O 5.778 -3.858 6.471 1.00 . A A . 36 LEU O 1 1 15 13158 1 1 37 ARG C C 5.849 -6.726 7.206 1.00 . A A . 37 ARG C 1 1 15 13159 1 1 37 ARG CA C 4.855 -5.948 8.079 1.00 . A A . 37 ARG CA 1 1 15 13160 1 1 37 ARG CB C 3.964 -6.906 8.877 1.00 . A A . 37 ARG CB 1 1 15 13161 1 1 37 ARG CD C 3.754 -5.060 10.582 1.00 . A A . 37 ARG CD 1 1 15 13162 1 1 37 ARG CG C 3.851 -6.560 10.355 1.00 . A A . 37 ARG CG 1 1 15 13163 1 1 37 ARG CZ C 1.931 -3.392 10.558 1.00 . A A . 37 ARG CZ 1 1 15 13164 1 1 37 ARG H H 3.057 -5.172 7.265 1.00 . A A . 37 ARG H 1 1 15 13165 1 1 37 ARG HA H 5.418 -5.340 8.774 1.00 . A A . 37 ARG HA 1 1 15 13166 1 1 37 ARG HB2 H 2.971 -6.892 8.452 1.00 . A A . 37 ARG HB2 1 1 15 13167 1 1 37 ARG HB3 H 4.367 -7.907 8.794 1.00 . A A . 37 ARG HB3 1 1 15 13168 1 1 37 ARG HD2 H 4.356 -4.801 11.440 1.00 . A A . 37 ARG HD2 1 1 15 13169 1 1 37 ARG HD3 H 4.138 -4.554 9.709 1.00 . A A . 37 ARG HD3 1 1 15 13170 1 1 37 ARG HE H 1.759 -5.279 11.207 1.00 . A A . 37 ARG HE 1 1 15 13171 1 1 37 ARG HG2 H 2.966 -7.030 10.755 1.00 . A A . 37 ARG HG2 1 1 15 13172 1 1 37 ARG HG3 H 4.724 -6.938 10.867 1.00 . A A . 37 ARG HG3 1 1 15 13173 1 1 37 ARG HH11 H 3.695 -2.729 9.791 1.00 . A A . 37 ARG HH11 1 1 15 13174 1 1 37 ARG HH12 H 2.401 -1.568 9.814 1.00 . A A . 37 ARG HH12 1 1 15 13175 1 1 37 ARG HH21 H 0.061 -3.757 11.260 1.00 . A A . 37 ARG HH21 1 1 15 13176 1 1 37 ARG HH22 H 0.330 -2.143 10.657 1.00 . A A . 37 ARG HH22 1 1 15 13177 1 1 37 ARG N N 4.036 -5.043 7.278 1.00 . A A . 37 ARG N 1 1 15 13178 1 1 37 ARG NE N 2.378 -4.622 10.818 1.00 . A A . 37 ARG NE 1 1 15 13179 1 1 37 ARG NH1 N 2.735 -2.492 10.008 1.00 . A A . 37 ARG NH1 1 1 15 13180 1 1 37 ARG NH2 N 0.676 -3.074 10.841 1.00 . A A . 37 ARG NH2 1 1 15 13181 1 1 37 ARG O O 7.054 -6.658 7.444 1.00 . A A . 37 ARG O 1 1 15 13182 1 1 38 PRO C C 6.906 -7.113 4.225 1.00 . A A . 38 PRO C 1 1 15 13183 1 1 38 PRO CA C 6.277 -8.104 5.205 1.00 . A A . 38 PRO CA 1 1 15 13184 1 1 38 PRO CB C 5.357 -9.094 4.463 1.00 . A A . 38 PRO CB 1 1 15 13185 1 1 38 PRO CD C 3.987 -7.563 5.711 1.00 . A A . 38 PRO CD 1 1 15 13186 1 1 38 PRO CG C 3.987 -8.904 5.036 1.00 . A A . 38 PRO CG 1 1 15 13187 1 1 38 PRO HA H 7.057 -8.643 5.723 1.00 . A A . 38 PRO HA 1 1 15 13188 1 1 38 PRO HB2 H 5.371 -8.874 3.406 1.00 . A A . 38 PRO HB2 1 1 15 13189 1 1 38 PRO HB3 H 5.710 -10.103 4.625 1.00 . A A . 38 PRO HB3 1 1 15 13190 1 1 38 PRO HD2 H 3.713 -6.785 5.012 1.00 . A A . 38 PRO HD2 1 1 15 13191 1 1 38 PRO HD3 H 3.321 -7.565 6.561 1.00 . A A . 38 PRO HD3 1 1 15 13192 1 1 38 PRO HG2 H 3.252 -8.921 4.244 1.00 . A A . 38 PRO HG2 1 1 15 13193 1 1 38 PRO HG3 H 3.778 -9.685 5.756 1.00 . A A . 38 PRO HG3 1 1 15 13194 1 1 38 PRO N N 5.385 -7.421 6.139 1.00 . A A . 38 PRO N 1 1 15 13195 1 1 38 PRO O O 6.560 -7.081 3.046 1.00 . A A . 38 PRO O 1 1 15 13196 1 1 39 ALA C C 9.246 -5.683 2.893 1.00 . A A . 39 ALA C 1 1 15 13197 1 1 39 ALA CA C 8.326 -5.150 3.983 1.00 . A A . 39 ALA CA 1 1 15 13198 1 1 39 ALA CB C 9.091 -4.212 4.900 1.00 . A A . 39 ALA CB 1 1 15 13199 1 1 39 ALA H H 7.887 -6.249 5.731 1.00 . A A . 39 ALA H 1 1 15 13200 1 1 39 ALA HA H 7.525 -4.589 3.524 1.00 . A A . 39 ALA HA 1 1 15 13201 1 1 39 ALA HB1 H 9.307 -3.294 4.375 1.00 . A A . 39 ALA HB1 1 1 15 13202 1 1 39 ALA HB2 H 8.494 -3.997 5.773 1.00 . A A . 39 ALA HB2 1 1 15 13203 1 1 39 ALA HB3 H 10.017 -4.681 5.202 1.00 . A A . 39 ALA HB3 1 1 15 13204 1 1 39 ALA N N 7.732 -6.225 4.761 1.00 . A A . 39 ALA N 1 1 15 13205 1 1 39 ALA O O 9.959 -6.672 3.089 1.00 . A A . 39 ALA O 1 1 15 13206 1 1 40 LEU C C 11.494 -4.541 0.866 1.00 . A A . 40 LEU C 1 1 15 13207 1 1 40 LEU CA C 10.195 -5.309 0.702 1.00 . A A . 40 LEU CA 1 1 15 13208 1 1 40 LEU CB C 9.564 -4.987 -0.656 1.00 . A A . 40 LEU CB 1 1 15 13209 1 1 40 LEU CD1 C 7.095 -4.907 -1.089 1.00 . A A . 40 LEU CD1 1 1 15 13210 1 1 40 LEU CD2 C 8.526 -6.556 -2.311 1.00 . A A . 40 LEU CD2 1 1 15 13211 1 1 40 LEU CG C 8.320 -5.806 -1.004 1.00 . A A . 40 LEU CG 1 1 15 13212 1 1 40 LEU H H 8.761 -4.149 1.714 1.00 . A A . 40 LEU H 1 1 15 13213 1 1 40 LEU HA H 10.404 -6.368 0.757 1.00 . A A . 40 LEU HA 1 1 15 13214 1 1 40 LEU HB2 H 9.294 -3.941 -0.664 1.00 . A A . 40 LEU HB2 1 1 15 13215 1 1 40 LEU HB3 H 10.305 -5.156 -1.424 1.00 . A A . 40 LEU HB3 1 1 15 13216 1 1 40 LEU HD11 H 7.174 -4.271 -1.957 1.00 . A A . 40 LEU HD11 1 1 15 13217 1 1 40 LEU HD12 H 6.207 -5.516 -1.168 1.00 . A A . 40 LEU HD12 1 1 15 13218 1 1 40 LEU HD13 H 7.034 -4.297 -0.199 1.00 . A A . 40 LEU HD13 1 1 15 13219 1 1 40 LEU HD21 H 8.856 -7.563 -2.100 1.00 . A A . 40 LEU HD21 1 1 15 13220 1 1 40 LEU HD22 H 7.596 -6.589 -2.859 1.00 . A A . 40 LEU HD22 1 1 15 13221 1 1 40 LEU HD23 H 9.274 -6.050 -2.903 1.00 . A A . 40 LEU HD23 1 1 15 13222 1 1 40 LEU HG H 8.146 -6.533 -0.223 1.00 . A A . 40 LEU HG 1 1 15 13223 1 1 40 LEU N N 9.292 -4.971 1.780 1.00 . A A . 40 LEU N 1 1 15 13224 1 1 40 LEU O O 11.497 -3.403 1.332 1.00 . A A . 40 LEU O 1 1 15 13225 1 1 41 TYR C C 14.352 -4.156 -0.843 1.00 . A A . 41 TYR C 1 1 15 13226 1 1 41 TYR CA C 13.892 -4.522 0.554 1.00 . A A . 41 TYR CA 1 1 15 13227 1 1 41 TYR CB C 14.901 -5.446 1.239 1.00 . A A . 41 TYR CB 1 1 15 13228 1 1 41 TYR CD1 C 14.721 -5.198 3.747 1.00 . A A . 41 TYR CD1 1 1 15 13229 1 1 41 TYR CD2 C 13.703 -7.098 2.726 1.00 . A A . 41 TYR CD2 1 1 15 13230 1 1 41 TYR CE1 C 14.278 -5.622 4.984 1.00 . A A . 41 TYR CE1 1 1 15 13231 1 1 41 TYR CE2 C 13.260 -7.529 3.960 1.00 . A A . 41 TYR CE2 1 1 15 13232 1 1 41 TYR CG C 14.439 -5.927 2.597 1.00 . A A . 41 TYR CG 1 1 15 13233 1 1 41 TYR CZ C 13.549 -6.788 5.084 1.00 . A A . 41 TYR CZ 1 1 15 13234 1 1 41 TYR H H 12.516 -6.057 0.079 1.00 . A A . 41 TYR H 1 1 15 13235 1 1 41 TYR HA H 13.786 -3.618 1.136 1.00 . A A . 41 TYR HA 1 1 15 13236 1 1 41 TYR HB2 H 15.068 -6.314 0.618 1.00 . A A . 41 TYR HB2 1 1 15 13237 1 1 41 TYR HB3 H 15.832 -4.917 1.373 1.00 . A A . 41 TYR HB3 1 1 15 13238 1 1 41 TYR HD1 H 15.292 -4.287 3.664 1.00 . A A . 41 TYR HD1 1 1 15 13239 1 1 41 TYR HD2 H 13.479 -7.677 1.843 1.00 . A A . 41 TYR HD2 1 1 15 13240 1 1 41 TYR HE1 H 14.503 -5.041 5.868 1.00 . A A . 41 TYR HE1 1 1 15 13241 1 1 41 TYR HE2 H 12.689 -8.442 4.040 1.00 . A A . 41 TYR HE2 1 1 15 13242 1 1 41 TYR HH H 13.848 -7.255 6.935 1.00 . A A . 41 TYR HH 1 1 15 13243 1 1 41 TYR N N 12.588 -5.159 0.476 1.00 . A A . 41 TYR N 1 1 15 13244 1 1 41 TYR O O 15.382 -3.508 -1.036 1.00 . A A . 41 TYR O 1 1 15 13245 1 1 41 TYR OH O 13.098 -7.213 6.316 1.00 . A A . 41 TYR OH 1 1 15 13246 1 1 42 GLU C C 12.521 -3.468 -3.755 1.00 . A A . 42 GLU C 1 1 15 13247 1 1 42 GLU CA C 13.749 -4.168 -3.191 1.00 . A A . 42 GLU CA 1 1 15 13248 1 1 42 GLU CB C 14.068 -5.427 -4.002 1.00 . A A . 42 GLU CB 1 1 15 13249 1 1 42 GLU CD C 15.488 -4.295 -5.741 1.00 . A A . 42 GLU CD 1 1 15 13250 1 1 42 GLU CG C 15.422 -5.375 -4.687 1.00 . A A . 42 GLU CG 1 1 15 13251 1 1 42 GLU H H 12.690 -4.971 -1.566 1.00 . A A . 42 GLU H 1 1 15 13252 1 1 42 GLU HA H 14.590 -3.493 -3.234 1.00 . A A . 42 GLU HA 1 1 15 13253 1 1 42 GLU HB2 H 14.053 -6.280 -3.341 1.00 . A A . 42 GLU HB2 1 1 15 13254 1 1 42 GLU HB3 H 13.310 -5.555 -4.760 1.00 . A A . 42 GLU HB3 1 1 15 13255 1 1 42 GLU HG2 H 16.183 -5.181 -3.944 1.00 . A A . 42 GLU HG2 1 1 15 13256 1 1 42 GLU HG3 H 15.612 -6.328 -5.155 1.00 . A A . 42 GLU HG3 1 1 15 13257 1 1 42 GLU N N 13.520 -4.510 -1.806 1.00 . A A . 42 GLU N 1 1 15 13258 1 1 42 GLU O O 11.406 -3.688 -3.283 1.00 . A A . 42 GLU O 1 1 15 13259 1 1 42 GLU OE1 O 15.684 -3.114 -5.380 1.00 . A A . 42 GLU OE1 1 1 15 13260 1 1 42 GLU OE2 O 15.338 -4.617 -6.936 1.00 . A A . 42 GLU OE2 1 1 15 13261 1 1 43 VAL C C 10.934 -2.708 -6.388 1.00 . A A . 43 VAL C 1 1 15 13262 1 1 43 VAL CA C 11.640 -1.856 -5.336 1.00 . A A . 43 VAL CA 1 1 15 13263 1 1 43 VAL CB C 12.133 -0.541 -5.975 1.00 . A A . 43 VAL CB 1 1 15 13264 1 1 43 VAL CG1 C 10.961 0.313 -6.430 1.00 . A A . 43 VAL CG1 1 1 15 13265 1 1 43 VAL CG2 C 13.004 0.236 -4.998 1.00 . A A . 43 VAL CG2 1 1 15 13266 1 1 43 VAL H H 13.649 -2.458 -5.056 1.00 . A A . 43 VAL H 1 1 15 13267 1 1 43 VAL HA H 10.932 -1.611 -4.556 1.00 . A A . 43 VAL HA 1 1 15 13268 1 1 43 VAL HB H 12.731 -0.782 -6.841 1.00 . A A . 43 VAL HB 1 1 15 13269 1 1 43 VAL HG11 H 11.331 1.194 -6.931 1.00 . A A . 43 VAL HG11 1 1 15 13270 1 1 43 VAL HG12 H 10.344 -0.257 -7.111 1.00 . A A . 43 VAL HG12 1 1 15 13271 1 1 43 VAL HG13 H 10.372 0.607 -5.572 1.00 . A A . 43 VAL HG13 1 1 15 13272 1 1 43 VAL HG21 H 12.565 1.207 -4.819 1.00 . A A . 43 VAL HG21 1 1 15 13273 1 1 43 VAL HG22 H 13.071 -0.306 -4.067 1.00 . A A . 43 VAL HG22 1 1 15 13274 1 1 43 VAL HG23 H 13.991 0.359 -5.417 1.00 . A A . 43 VAL HG23 1 1 15 13275 1 1 43 VAL N N 12.734 -2.602 -4.732 1.00 . A A . 43 VAL N 1 1 15 13276 1 1 43 VAL O O 11.553 -3.161 -7.353 1.00 . A A . 43 VAL O 1 1 15 13277 1 1 44 PRO C C 8.445 -3.206 -8.316 1.00 . A A . 44 PRO C 1 1 15 13278 1 1 44 PRO CA C 8.877 -3.904 -7.031 1.00 . A A . 44 PRO CA 1 1 15 13279 1 1 44 PRO CB C 7.646 -4.279 -6.187 1.00 . A A . 44 PRO CB 1 1 15 13280 1 1 44 PRO CD C 8.879 -2.628 -4.971 1.00 . A A . 44 PRO CD 1 1 15 13281 1 1 44 PRO CG C 7.920 -3.767 -4.811 1.00 . A A . 44 PRO CG 1 1 15 13282 1 1 44 PRO HA H 9.431 -4.798 -7.279 1.00 . A A . 44 PRO HA 1 1 15 13283 1 1 44 PRO HB2 H 6.767 -3.814 -6.608 1.00 . A A . 44 PRO HB2 1 1 15 13284 1 1 44 PRO HB3 H 7.525 -5.351 -6.189 1.00 . A A . 44 PRO HB3 1 1 15 13285 1 1 44 PRO HD2 H 8.346 -1.704 -5.144 1.00 . A A . 44 PRO HD2 1 1 15 13286 1 1 44 PRO HD3 H 9.517 -2.544 -4.104 1.00 . A A . 44 PRO HD3 1 1 15 13287 1 1 44 PRO HG2 H 7.001 -3.420 -4.361 1.00 . A A . 44 PRO HG2 1 1 15 13288 1 1 44 PRO HG3 H 8.361 -4.549 -4.208 1.00 . A A . 44 PRO HG3 1 1 15 13289 1 1 44 PRO N N 9.651 -3.022 -6.156 1.00 . A A . 44 PRO N 1 1 15 13290 1 1 44 PRO O O 7.536 -2.371 -8.310 1.00 . A A . 44 PRO O 1 1 15 13291 1 1 45 ASP C C 7.661 -3.920 -11.371 1.00 . A A . 45 ASP C 1 1 15 13292 1 1 45 ASP CA C 8.719 -3.040 -10.722 1.00 . A A . 45 ASP CA 1 1 15 13293 1 1 45 ASP CB C 9.960 -2.941 -11.614 1.00 . A A . 45 ASP CB 1 1 15 13294 1 1 45 ASP CG C 9.637 -3.036 -13.094 1.00 . A A . 45 ASP CG 1 1 15 13295 1 1 45 ASP H H 9.757 -4.291 -9.366 1.00 . A A . 45 ASP H 1 1 15 13296 1 1 45 ASP HA H 8.307 -2.053 -10.573 1.00 . A A . 45 ASP HA 1 1 15 13297 1 1 45 ASP HB2 H 10.449 -1.996 -11.435 1.00 . A A . 45 ASP HB2 1 1 15 13298 1 1 45 ASP HB3 H 10.637 -3.742 -11.363 1.00 . A A . 45 ASP HB3 1 1 15 13299 1 1 45 ASP N N 9.072 -3.582 -9.420 1.00 . A A . 45 ASP N 1 1 15 13300 1 1 45 ASP O O 7.695 -5.143 -11.235 1.00 . A A . 45 ASP O 1 1 15 13301 1 1 45 ASP OD1 O 9.029 -2.092 -13.642 1.00 . A A . 45 ASP OD1 1 1 15 13302 1 1 45 ASP OD2 O 10.002 -4.053 -13.722 1.00 . A A . 45 ASP OD2 1 1 15 13303 1 1 46 GLY C C 4.339 -3.976 -11.787 1.00 . A A . 46 GLY C 1 1 15 13304 1 1 46 GLY CA C 5.605 -4.043 -12.609 1.00 . A A . 46 GLY CA 1 1 15 13305 1 1 46 GLY H H 6.677 -2.317 -12.034 1.00 . A A . 46 GLY H 1 1 15 13306 1 1 46 GLY HA2 H 5.407 -3.640 -13.592 1.00 . A A . 46 GLY HA2 1 1 15 13307 1 1 46 GLY HA3 H 5.907 -5.076 -12.706 1.00 . A A . 46 GLY HA3 1 1 15 13308 1 1 46 GLY N N 6.685 -3.296 -12.005 1.00 . A A . 46 GLY N 1 1 15 13309 1 1 46 GLY O O 3.945 -2.900 -11.330 1.00 . A A . 46 GLY O 1 1 15 13310 1 1 47 GLU C C 2.798 -5.267 -9.311 1.00 . A A . 47 GLU C 1 1 15 13311 1 1 47 GLU CA C 2.480 -5.189 -10.800 1.00 . A A . 47 GLU CA 1 1 15 13312 1 1 47 GLU CB C 1.647 -6.402 -11.221 1.00 . A A . 47 GLU CB 1 1 15 13313 1 1 47 GLU CD C 2.437 -7.852 -13.125 1.00 . A A . 47 GLU CD 1 1 15 13314 1 1 47 GLU CG C 1.631 -6.638 -12.720 1.00 . A A . 47 GLU CG 1 1 15 13315 1 1 47 GLU H H 4.070 -5.947 -11.970 1.00 . A A . 47 GLU H 1 1 15 13316 1 1 47 GLU HA H 1.914 -4.288 -10.988 1.00 . A A . 47 GLU HA 1 1 15 13317 1 1 47 GLU HB2 H 2.051 -7.285 -10.745 1.00 . A A . 47 GLU HB2 1 1 15 13318 1 1 47 GLU HB3 H 0.630 -6.261 -10.890 1.00 . A A . 47 GLU HB3 1 1 15 13319 1 1 47 GLU HG2 H 0.610 -6.780 -13.038 1.00 . A A . 47 GLU HG2 1 1 15 13320 1 1 47 GLU HG3 H 2.043 -5.769 -13.213 1.00 . A A . 47 GLU HG3 1 1 15 13321 1 1 47 GLU N N 3.705 -5.120 -11.585 1.00 . A A . 47 GLU N 1 1 15 13322 1 1 47 GLU O O 3.907 -5.641 -8.926 1.00 . A A . 47 GLU O 1 1 15 13323 1 1 47 GLU OE1 O 3.673 -7.842 -12.937 1.00 . A A . 47 GLU OE1 1 1 15 13324 1 1 47 GLU OE2 O 1.837 -8.824 -13.630 1.00 . A A . 47 GLU OE2 1 1 15 13325 1 1 48 TRP C C 0.601 -4.970 -6.365 1.00 . A A . 48 TRP C 1 1 15 13326 1 1 48 TRP CA C 1.972 -4.988 -7.035 1.00 . A A . 48 TRP CA 1 1 15 13327 1 1 48 TRP CB C 2.826 -3.816 -6.526 1.00 . A A . 48 TRP CB 1 1 15 13328 1 1 48 TRP CD1 C 4.295 -4.784 -4.662 1.00 . A A . 48 TRP CD1 1 1 15 13329 1 1 48 TRP CD2 C 2.710 -3.374 -3.946 1.00 . A A . 48 TRP CD2 1 1 15 13330 1 1 48 TRP CE2 C 3.432 -3.839 -2.831 1.00 . A A . 48 TRP CE2 1 1 15 13331 1 1 48 TRP CE3 C 1.660 -2.473 -3.741 1.00 . A A . 48 TRP CE3 1 1 15 13332 1 1 48 TRP CG C 3.278 -3.992 -5.108 1.00 . A A . 48 TRP CG 1 1 15 13333 1 1 48 TRP CH2 C 2.104 -2.553 -1.363 1.00 . A A . 48 TRP CH2 1 1 15 13334 1 1 48 TRP CZ2 C 3.136 -3.434 -1.533 1.00 . A A . 48 TRP CZ2 1 1 15 13335 1 1 48 TRP CZ3 C 1.369 -2.073 -2.452 1.00 . A A . 48 TRP CZ3 1 1 15 13336 1 1 48 TRP H H 0.953 -4.643 -8.857 1.00 . A A . 48 TRP H 1 1 15 13337 1 1 48 TRP HA H 2.466 -5.916 -6.793 1.00 . A A . 48 TRP HA 1 1 15 13338 1 1 48 TRP HB2 H 3.705 -3.720 -7.145 1.00 . A A . 48 TRP HB2 1 1 15 13339 1 1 48 TRP HB3 H 2.250 -2.905 -6.583 1.00 . A A . 48 TRP HB3 1 1 15 13340 1 1 48 TRP HD1 H 4.921 -5.387 -5.302 1.00 . A A . 48 TRP HD1 1 1 15 13341 1 1 48 TRP HE1 H 5.047 -5.173 -2.741 1.00 . A A . 48 TRP HE1 1 1 15 13342 1 1 48 TRP HE3 H 1.080 -2.092 -4.570 1.00 . A A . 48 TRP HE3 1 1 15 13343 1 1 48 TRP HH2 H 1.839 -2.214 -0.373 1.00 . A A . 48 TRP HH2 1 1 15 13344 1 1 48 TRP HZ2 H 3.691 -3.794 -0.683 1.00 . A A . 48 TRP HZ2 1 1 15 13345 1 1 48 TRP HZ3 H 0.559 -1.379 -2.273 1.00 . A A . 48 TRP HZ3 1 1 15 13346 1 1 48 TRP N N 1.819 -4.928 -8.484 1.00 . A A . 48 TRP N 1 1 15 13347 1 1 48 TRP NE1 N 4.394 -4.698 -3.294 1.00 . A A . 48 TRP NE1 1 1 15 13348 1 1 48 TRP O O -0.383 -4.552 -6.975 1.00 . A A . 48 TRP O 1 1 15 13349 1 1 49 GLN C C -0.375 -5.582 -2.851 1.00 . A A . 49 GLN C 1 1 15 13350 1 1 49 GLN CA C -0.684 -5.401 -4.337 1.00 . A A . 49 GLN CA 1 1 15 13351 1 1 49 GLN CB C -1.624 -6.500 -4.839 1.00 . A A . 49 GLN CB 1 1 15 13352 1 1 49 GLN CD C -2.401 -8.881 -4.650 1.00 . A A . 49 GLN CD 1 1 15 13353 1 1 49 GLN CG C -1.330 -7.879 -4.283 1.00 . A A . 49 GLN CG 1 1 15 13354 1 1 49 GLN H H 1.379 -5.686 -4.670 1.00 . A A . 49 GLN H 1 1 15 13355 1 1 49 GLN HA H -1.158 -4.442 -4.477 1.00 . A A . 49 GLN HA 1 1 15 13356 1 1 49 GLN HB2 H -2.636 -6.240 -4.571 1.00 . A A . 49 GLN HB2 1 1 15 13357 1 1 49 GLN HB3 H -1.551 -6.550 -5.916 1.00 . A A . 49 GLN HB3 1 1 15 13358 1 1 49 GLN HE21 H -3.536 -8.254 -3.139 1.00 . A A . 49 GLN HE21 1 1 15 13359 1 1 49 GLN HE22 H -4.205 -9.519 -4.121 1.00 . A A . 49 GLN HE22 1 1 15 13360 1 1 49 GLN HG2 H -0.384 -8.220 -4.677 1.00 . A A . 49 GLN HG2 1 1 15 13361 1 1 49 GLN HG3 H -1.270 -7.813 -3.207 1.00 . A A . 49 GLN HG3 1 1 15 13362 1 1 49 GLN N N 0.550 -5.403 -5.109 1.00 . A A . 49 GLN N 1 1 15 13363 1 1 49 GLN NE2 N -3.485 -8.889 -3.895 1.00 . A A . 49 GLN NE2 1 1 15 13364 1 1 49 GLN O O 0.679 -6.123 -2.498 1.00 . A A . 49 GLN O 1 1 15 13365 1 1 49 GLN OE1 O -2.250 -9.646 -5.604 1.00 . A A . 49 GLN OE1 1 1 15 13366 1 1 50 CYS C C -0.937 -6.536 -0.018 1.00 . A A . 50 CYS C 1 1 15 13367 1 1 50 CYS CA C -1.017 -5.096 -0.545 1.00 . A A . 50 CYS CA 1 1 15 13368 1 1 50 CYS CB C -2.138 -4.355 0.212 1.00 . A A . 50 CYS CB 1 1 15 13369 1 1 50 CYS H H -2.012 -4.545 -2.329 1.00 . A A . 50 CYS H 1 1 15 13370 1 1 50 CYS HA H -0.076 -4.602 -0.342 1.00 . A A . 50 CYS HA 1 1 15 13371 1 1 50 CYS HB2 H -2.619 -5.047 0.884 1.00 . A A . 50 CYS HB2 1 1 15 13372 1 1 50 CYS HB3 H -1.690 -3.564 0.792 1.00 . A A . 50 CYS HB3 1 1 15 13373 1 1 50 CYS N N -1.243 -5.048 -1.986 1.00 . A A . 50 CYS N 1 1 15 13374 1 1 50 CYS O O -1.266 -7.488 -0.718 1.00 . A A . 50 CYS O 1 1 15 13375 1 1 50 CYS SG S -3.452 -3.593 -0.797 1.00 . A A . 50 CYS SG 1 1 15 13376 1 1 51 PRO C C -1.924 -8.176 2.661 1.00 . A A . 51 PRO C 1 1 15 13377 1 1 51 PRO CA C -0.596 -8.005 1.919 1.00 . A A . 51 PRO CA 1 1 15 13378 1 1 51 PRO CB C 0.561 -7.897 2.904 1.00 . A A . 51 PRO CB 1 1 15 13379 1 1 51 PRO CD C -0.048 -5.670 2.170 1.00 . A A . 51 PRO CD 1 1 15 13380 1 1 51 PRO CG C 0.576 -6.454 3.304 1.00 . A A . 51 PRO CG 1 1 15 13381 1 1 51 PRO HA H -0.439 -8.825 1.235 1.00 . A A . 51 PRO HA 1 1 15 13382 1 1 51 PRO HB2 H 0.379 -8.542 3.750 1.00 . A A . 51 PRO HB2 1 1 15 13383 1 1 51 PRO HB3 H 1.482 -8.180 2.416 1.00 . A A . 51 PRO HB3 1 1 15 13384 1 1 51 PRO HD2 H -0.860 -5.059 2.537 1.00 . A A . 51 PRO HD2 1 1 15 13385 1 1 51 PRO HD3 H 0.695 -5.057 1.683 1.00 . A A . 51 PRO HD3 1 1 15 13386 1 1 51 PRO HG2 H -0.001 -6.323 4.206 1.00 . A A . 51 PRO HG2 1 1 15 13387 1 1 51 PRO HG3 H 1.594 -6.131 3.462 1.00 . A A . 51 PRO HG3 1 1 15 13388 1 1 51 PRO N N -0.549 -6.713 1.256 1.00 . A A . 51 PRO N 1 1 15 13389 1 1 51 PRO O O -2.095 -9.091 3.469 1.00 . A A . 51 PRO O 1 1 15 13390 1 1 52 ARG C C -5.238 -7.657 2.362 1.00 . A A . 52 ARG C 1 1 15 13391 1 1 52 ARG CA C -4.073 -7.136 3.193 1.00 . A A . 52 ARG CA 1 1 15 13392 1 1 52 ARG CB C -4.344 -5.695 3.620 1.00 . A A . 52 ARG CB 1 1 15 13393 1 1 52 ARG CD C -3.384 -4.340 5.498 1.00 . A A . 52 ARG CD 1 1 15 13394 1 1 52 ARG CG C -4.303 -5.488 5.122 1.00 . A A . 52 ARG CG 1 1 15 13395 1 1 52 ARG CZ C -2.799 -4.011 7.874 1.00 . A A . 52 ARG CZ 1 1 15 13396 1 1 52 ARG H H -2.580 -6.472 1.851 1.00 . A A . 52 ARG H 1 1 15 13397 1 1 52 ARG HA H -3.974 -7.749 4.077 1.00 . A A . 52 ARG HA 1 1 15 13398 1 1 52 ARG HB2 H -3.600 -5.054 3.170 1.00 . A A . 52 ARG HB2 1 1 15 13399 1 1 52 ARG HB3 H -5.321 -5.402 3.264 1.00 . A A . 52 ARG HB3 1 1 15 13400 1 1 52 ARG HD2 H -2.700 -4.161 4.681 1.00 . A A . 52 ARG HD2 1 1 15 13401 1 1 52 ARG HD3 H -3.983 -3.457 5.667 1.00 . A A . 52 ARG HD3 1 1 15 13402 1 1 52 ARG HE H -1.926 -5.338 6.644 1.00 . A A . 52 ARG HE 1 1 15 13403 1 1 52 ARG HG2 H -5.299 -5.269 5.474 1.00 . A A . 52 ARG HG2 1 1 15 13404 1 1 52 ARG HG3 H -3.944 -6.394 5.592 1.00 . A A . 52 ARG HG3 1 1 15 13405 1 1 52 ARG HH11 H -4.328 -2.838 7.217 1.00 . A A . 52 ARG HH11 1 1 15 13406 1 1 52 ARG HH12 H -3.867 -2.598 8.877 1.00 . A A . 52 ARG HH12 1 1 15 13407 1 1 52 ARG HH21 H -1.362 -5.066 8.842 1.00 . A A . 52 ARG HH21 1 1 15 13408 1 1 52 ARG HH22 H -2.200 -3.882 9.810 1.00 . A A . 52 ARG HH22 1 1 15 13409 1 1 52 ARG N N -2.814 -7.207 2.458 1.00 . A A . 52 ARG N 1 1 15 13410 1 1 52 ARG NE N -2.617 -4.630 6.708 1.00 . A A . 52 ARG NE 1 1 15 13411 1 1 52 ARG NH1 N -3.742 -3.078 7.999 1.00 . A A . 52 ARG NH1 1 1 15 13412 1 1 52 ARG NH2 N -2.060 -4.344 8.922 1.00 . A A . 52 ARG NH2 1 1 15 13413 1 1 52 ARG O O -6.341 -7.853 2.877 1.00 . A A . 52 ARG O 1 1 15 13414 1 1 53 CYS C C -6.287 -9.869 0.545 1.00 . A A . 53 CYS C 1 1 15 13415 1 1 53 CYS CA C -6.011 -8.413 0.198 1.00 . A A . 53 CYS CA 1 1 15 13416 1 1 53 CYS CB C -5.517 -8.282 -1.232 1.00 . A A . 53 CYS CB 1 1 15 13417 1 1 53 CYS H H -4.102 -7.709 0.718 1.00 . A A . 53 CYS H 1 1 15 13418 1 1 53 CYS HA H -6.915 -7.835 0.325 1.00 . A A . 53 CYS HA 1 1 15 13419 1 1 53 CYS HB2 H -5.308 -9.264 -1.628 1.00 . A A . 53 CYS HB2 1 1 15 13420 1 1 53 CYS HB3 H -6.276 -7.804 -1.831 1.00 . A A . 53 CYS HB3 1 1 15 13421 1 1 53 CYS N N -4.996 -7.883 1.082 1.00 . A A . 53 CYS N 1 1 15 13422 1 1 53 CYS O O -7.431 -10.325 0.535 1.00 . A A . 53 CYS O 1 1 15 13423 1 1 53 CYS SG S -3.996 -7.292 -1.357 1.00 . A A . 53 CYS SG 1 1 15 13424 1 1 54 THR C C -4.518 -12.171 2.623 1.00 . A A . 54 THR C 1 1 15 13425 1 1 54 THR CA C -5.332 -11.949 1.350 1.00 . A A . 54 THR CA 1 1 15 13426 1 1 54 THR CB C -4.840 -12.907 0.249 1.00 . A A . 54 THR CB 1 1 15 13427 1 1 54 THR CG2 C -5.902 -13.079 -0.822 1.00 . A A . 54 THR CG2 1 1 15 13428 1 1 54 THR H H -4.352 -10.127 0.945 1.00 . A A . 54 THR H 1 1 15 13429 1 1 54 THR HA H -6.372 -12.163 1.551 1.00 . A A . 54 THR HA 1 1 15 13430 1 1 54 THR HB H -4.634 -13.870 0.694 1.00 . A A . 54 THR HB 1 1 15 13431 1 1 54 THR HG1 H -3.751 -11.453 -0.549 1.00 . A A . 54 THR HG1 1 1 15 13432 1 1 54 THR HG21 H -6.700 -13.700 -0.442 1.00 . A A . 54 THR HG21 1 1 15 13433 1 1 54 THR HG22 H -5.464 -13.544 -1.692 1.00 . A A . 54 THR HG22 1 1 15 13434 1 1 54 THR HG23 H -6.298 -12.109 -1.091 1.00 . A A . 54 THR HG23 1 1 15 13435 1 1 54 THR N N -5.229 -10.569 0.922 1.00 . A A . 54 THR N 1 1 15 13436 1 1 54 THR O O -5.059 -12.157 3.731 1.00 . A A . 54 THR O 1 1 15 13437 1 1 54 THR OG1 O -3.637 -12.395 -0.344 1.00 . A A . 54 THR OG1 1 1 15 13438 1 1 55 CYS C C -0.861 -12.559 3.001 1.00 . A A . 55 CYS C 1 1 15 13439 1 1 55 CYS CA C -2.285 -12.540 3.556 1.00 . A A . 55 CYS CA 1 1 15 13440 1 1 55 CYS CB C -2.595 -13.872 4.251 1.00 . A A . 55 CYS CB 1 1 15 13441 1 1 55 CYS H H -2.846 -12.296 1.536 1.00 . A A . 55 CYS H 1 1 15 13442 1 1 55 CYS HA H -2.391 -11.726 4.258 1.00 . A A . 55 CYS HA 1 1 15 13443 1 1 55 CYS HB2 H -3.312 -14.419 3.658 1.00 . A A . 55 CYS HB2 1 1 15 13444 1 1 55 CYS HB3 H -1.683 -14.449 4.325 1.00 . A A . 55 CYS HB3 1 1 15 13445 1 1 55 CYS HG H -4.025 -12.609 5.960 1.00 . A A . 55 CYS HG 1 1 15 13446 1 1 55 CYS N N -3.211 -12.327 2.451 1.00 . A A . 55 CYS N 1 1 15 13447 1 1 55 CYS O O -0.683 -12.546 1.784 1.00 . A A . 55 CYS O 1 1 15 13448 1 1 55 CYS SG S -3.280 -13.710 5.920 1.00 . A A . 55 CYS SG 1 1 15 13449 1 1 56 PRO C C 1.877 -13.968 2.682 1.00 . A A . 56 PRO C 1 1 15 13450 1 1 56 PRO CA C 1.572 -12.652 3.405 1.00 . A A . 56 PRO CA 1 1 15 13451 1 1 56 PRO CB C 2.385 -12.541 4.699 1.00 . A A . 56 PRO CB 1 1 15 13452 1 1 56 PRO CD C 0.081 -12.514 5.333 1.00 . A A . 56 PRO CD 1 1 15 13453 1 1 56 PRO CG C 1.446 -12.939 5.786 1.00 . A A . 56 PRO CG 1 1 15 13454 1 1 56 PRO HA H 1.813 -11.825 2.752 1.00 . A A . 56 PRO HA 1 1 15 13455 1 1 56 PRO HB2 H 3.236 -13.206 4.649 1.00 . A A . 56 PRO HB2 1 1 15 13456 1 1 56 PRO HB3 H 2.726 -11.524 4.825 1.00 . A A . 56 PRO HB3 1 1 15 13457 1 1 56 PRO HD2 H -0.670 -13.196 5.705 1.00 . A A . 56 PRO HD2 1 1 15 13458 1 1 56 PRO HD3 H -0.129 -11.505 5.658 1.00 . A A . 56 PRO HD3 1 1 15 13459 1 1 56 PRO HG2 H 1.478 -14.009 5.922 1.00 . A A . 56 PRO HG2 1 1 15 13460 1 1 56 PRO HG3 H 1.712 -12.434 6.702 1.00 . A A . 56 PRO HG3 1 1 15 13461 1 1 56 PRO N N 0.175 -12.585 3.862 1.00 . A A . 56 PRO N 1 1 15 13462 1 1 56 PRO O O 2.881 -14.088 1.973 1.00 . A A . 56 PRO O 1 1 15 13463 1 1 57 ALA C C -0.022 -16.230 0.976 1.00 . A A . 57 ALA C 1 1 15 13464 1 1 57 ALA CA C 1.048 -16.174 2.064 1.00 . A A . 57 ALA CA 1 1 15 13465 1 1 57 ALA CB C 0.905 -17.350 3.017 1.00 . A A . 57 ALA CB 1 1 15 13466 1 1 57 ALA H H 0.143 -14.725 3.300 1.00 . A A . 57 ALA H 1 1 15 13467 1 1 57 ALA HA H 2.024 -16.225 1.603 1.00 . A A . 57 ALA HA 1 1 15 13468 1 1 57 ALA HB1 H 1.013 -17.005 4.034 1.00 . A A . 57 ALA HB1 1 1 15 13469 1 1 57 ALA HB2 H -0.070 -17.798 2.890 1.00 . A A . 57 ALA HB2 1 1 15 13470 1 1 57 ALA HB3 H 1.669 -18.081 2.801 1.00 . A A . 57 ALA HB3 1 1 15 13471 1 1 57 ALA N N 0.955 -14.915 2.789 1.00 . A A . 57 ALA N 1 1 15 13472 1 1 57 ALA O O -0.642 -15.211 0.667 1.00 . A A . 57 ALA O 1 1 15 13473 1 1 58 LEU C C -0.930 -16.768 -1.867 1.00 . A A . 58 LEU C 1 1 15 13474 1 1 58 LEU CA C -1.248 -17.614 -0.635 1.00 . A A . 58 LEU CA 1 1 15 13475 1 1 58 LEU CB C -2.654 -17.286 -0.112 1.00 . A A . 58 LEU CB 1 1 15 13476 1 1 58 LEU CD1 C -4.680 -18.409 0.848 1.00 . A A . 58 LEU CD1 1 1 15 13477 1 1 58 LEU CD2 C -4.436 -18.196 -1.628 1.00 . A A . 58 LEU CD2 1 1 15 13478 1 1 58 LEU CG C -3.699 -18.389 -0.312 1.00 . A A . 58 LEU CG 1 1 15 13479 1 1 58 LEU H H 0.277 -18.194 0.718 1.00 . A A . 58 LEU H 1 1 15 13480 1 1 58 LEU HA H -1.222 -18.658 -0.919 1.00 . A A . 58 LEU HA 1 1 15 13481 1 1 58 LEU HB2 H -2.581 -17.074 0.946 1.00 . A A . 58 LEU HB2 1 1 15 13482 1 1 58 LEU HB3 H -3.002 -16.397 -0.615 1.00 . A A . 58 LEU HB3 1 1 15 13483 1 1 58 LEU HD11 H -4.540 -19.313 1.423 1.00 . A A . 58 LEU HD11 1 1 15 13484 1 1 58 LEU HD12 H -4.506 -17.551 1.479 1.00 . A A . 58 LEU HD12 1 1 15 13485 1 1 58 LEU HD13 H -5.691 -18.377 0.466 1.00 . A A . 58 LEU HD13 1 1 15 13486 1 1 58 LEU HD21 H -4.883 -17.213 -1.650 1.00 . A A . 58 LEU HD21 1 1 15 13487 1 1 58 LEU HD22 H -3.739 -18.293 -2.448 1.00 . A A . 58 LEU HD22 1 1 15 13488 1 1 58 LEU HD23 H -5.208 -18.945 -1.722 1.00 . A A . 58 LEU HD23 1 1 15 13489 1 1 58 LEU HG H -3.200 -19.347 -0.344 1.00 . A A . 58 LEU HG 1 1 15 13490 1 1 58 LEU N N -0.244 -17.419 0.413 1.00 . A A . 58 LEU N 1 1 15 13491 1 1 58 LEU O O -1.805 -16.109 -2.431 1.00 . A A . 58 LEU O 1 1 15 13492 1 1 59 LYS C C 1.511 -17.008 -4.414 1.00 . A A . 59 LYS C 1 1 15 13493 1 1 59 LYS CA C 0.756 -16.074 -3.474 1.00 . A A . 59 LYS CA 1 1 15 13494 1 1 59 LYS CB C 1.638 -14.886 -3.077 1.00 . A A . 59 LYS CB 1 1 15 13495 1 1 59 LYS CD C 0.030 -13.241 -4.099 1.00 . A A . 59 LYS CD 1 1 15 13496 1 1 59 LYS CE C -0.098 -11.727 -4.070 1.00 . A A . 59 LYS CE 1 1 15 13497 1 1 59 LYS CG C 1.483 -13.681 -3.992 1.00 . A A . 59 LYS CG 1 1 15 13498 1 1 59 LYS H H 0.975 -17.360 -1.809 1.00 . A A . 59 LYS H 1 1 15 13499 1 1 59 LYS HA H -0.126 -15.709 -3.978 1.00 . A A . 59 LYS HA 1 1 15 13500 1 1 59 LYS HB2 H 1.383 -14.585 -2.071 1.00 . A A . 59 LYS HB2 1 1 15 13501 1 1 59 LYS HB3 H 2.672 -15.194 -3.098 1.00 . A A . 59 LYS HB3 1 1 15 13502 1 1 59 LYS HD2 H -0.379 -13.608 -5.028 1.00 . A A . 59 LYS HD2 1 1 15 13503 1 1 59 LYS HD3 H -0.526 -13.655 -3.269 1.00 . A A . 59 LYS HD3 1 1 15 13504 1 1 59 LYS HE2 H 0.891 -11.298 -4.025 1.00 . A A . 59 LYS HE2 1 1 15 13505 1 1 59 LYS HE3 H -0.593 -11.400 -4.972 1.00 . A A . 59 LYS HE3 1 1 15 13506 1 1 59 LYS HG2 H 2.068 -12.863 -3.597 1.00 . A A . 59 LYS HG2 1 1 15 13507 1 1 59 LYS HG3 H 1.845 -13.942 -4.977 1.00 . A A . 59 LYS HG3 1 1 15 13508 1 1 59 LYS HZ1 H -0.736 -11.912 -2.090 1.00 . A A . 59 LYS HZ1 1 1 15 13509 1 1 59 LYS HZ2 H -1.895 -11.236 -3.126 1.00 . A A . 59 LYS HZ2 1 1 15 13510 1 1 59 LYS HZ3 H -0.569 -10.309 -2.615 1.00 . A A . 59 LYS HZ3 1 1 15 13511 1 1 59 LYS N N 0.325 -16.805 -2.291 1.00 . A A . 59 LYS N 1 1 15 13512 1 1 59 LYS NZ N -0.877 -11.262 -2.895 1.00 . A A . 59 LYS NZ 1 1 15 13513 1 1 59 LYS O O 2.525 -16.640 -5.012 1.00 . A A . 59 LYS O 1 1 15 13514 1 1 60 GLY C C 1.862 -20.536 -4.486 1.00 . A A . 60 GLY C 1 1 15 13515 1 1 60 GLY CA C 1.701 -19.259 -5.275 1.00 . A A . 60 GLY CA 1 1 15 13516 1 1 60 GLY H H 0.260 -18.489 -3.934 1.00 . A A . 60 GLY H 1 1 15 13517 1 1 60 GLY HA2 H 1.111 -19.456 -6.159 1.00 . A A . 60 GLY HA2 1 1 15 13518 1 1 60 GLY HA3 H 2.676 -18.902 -5.571 1.00 . A A . 60 GLY HA3 1 1 15 13519 1 1 60 GLY N N 1.042 -18.243 -4.481 1.00 . A A . 60 GLY N 1 1 15 13520 1 1 60 GLY O O 1.626 -21.635 -4.996 1.00 . A A . 60 GLY O 1 1 15 13521 1 1 61 LYS C C 1.741 -21.020 -0.905 1.00 . A A . 61 LYS C 1 1 15 13522 1 1 61 LYS CA C 2.224 -21.480 -2.272 1.00 . A A . 61 LYS CA 1 1 15 13523 1 1 61 LYS CB C 3.658 -22.008 -2.174 1.00 . A A . 61 LYS CB 1 1 15 13524 1 1 61 LYS CD C 4.352 -23.706 -0.452 1.00 . A A . 61 LYS CD 1 1 15 13525 1 1 61 LYS CE C 3.289 -23.989 0.599 1.00 . A A . 61 LYS CE 1 1 15 13526 1 1 61 LYS CG C 3.740 -23.487 -1.826 1.00 . A A . 61 LYS CG 1 1 15 13527 1 1 61 LYS H H 2.235 -19.457 -2.852 1.00 . A A . 61 LYS H 1 1 15 13528 1 1 61 LYS HA H 1.576 -22.267 -2.633 1.00 . A A . 61 LYS HA 1 1 15 13529 1 1 61 LYS HB2 H 4.152 -21.855 -3.124 1.00 . A A . 61 LYS HB2 1 1 15 13530 1 1 61 LYS HB3 H 4.182 -21.452 -1.412 1.00 . A A . 61 LYS HB3 1 1 15 13531 1 1 61 LYS HD2 H 5.027 -24.547 -0.499 1.00 . A A . 61 LYS HD2 1 1 15 13532 1 1 61 LYS HD3 H 4.899 -22.819 -0.166 1.00 . A A . 61 LYS HD3 1 1 15 13533 1 1 61 LYS HE2 H 3.633 -23.615 1.552 1.00 . A A . 61 LYS HE2 1 1 15 13534 1 1 61 LYS HE3 H 2.378 -23.479 0.320 1.00 . A A . 61 LYS HE3 1 1 15 13535 1 1 61 LYS HG2 H 2.745 -23.905 -1.837 1.00 . A A . 61 LYS HG2 1 1 15 13536 1 1 61 LYS HG3 H 4.350 -23.987 -2.565 1.00 . A A . 61 LYS HG3 1 1 15 13537 1 1 61 LYS HZ1 H 3.782 -25.910 1.252 1.00 . A A . 61 LYS HZ1 1 1 15 13538 1 1 61 LYS HZ2 H 2.940 -25.878 -0.222 1.00 . A A . 61 LYS HZ2 1 1 15 13539 1 1 61 LYS HZ3 H 2.113 -25.598 1.228 1.00 . A A . 61 LYS HZ3 1 1 15 13540 1 1 61 LYS N N 2.148 -20.370 -3.204 1.00 . A A . 61 LYS N 1 1 15 13541 1 1 61 LYS NZ N 3.013 -25.442 0.722 1.00 . A A . 61 LYS NZ 1 1 15 13542 1 1 61 LYS O O 2.111 -19.902 -0.493 1.00 . A A . 61 LYS O 1 1 15 13543 1 1 61 LYS OXT O 0.988 -21.767 -0.253 1.00 . A A . 61 LYS OXT 1 1 15 13544 2 2 1 ZN ZN ZN -4.625 -5.205 -1.923 1.00 . B A . 62 ZN ZN 1 1 15 13545 3 2 1 ZN ZN ZN 4.334 4.083 3.544 1.00 . C A . 63 ZN ZN 1 1 16 13546 1 1 1 GLY C C -17.621 9.660 6.969 1.00 . A A . 1 GLY C 1 1 16 13547 1 1 1 GLY CA C -18.983 9.160 7.413 1.00 . A A . 1 GLY CA 1 1 16 13548 1 1 1 GLY H1 H -20.822 9.162 6.423 1.00 . A A . 1 GLY H1 1 1 16 13549 1 1 1 GLY H2 H -19.875 7.796 6.109 1.00 . A A . 1 GLY H2 1 1 16 13550 1 1 1 GLY H3 H -19.484 9.281 5.390 1.00 . A A . 1 GLY H3 1 1 16 13551 1 1 1 GLY HA2 H -19.462 9.927 8.005 1.00 . A A . 1 GLY HA2 1 1 16 13552 1 1 1 GLY HA3 H -18.852 8.275 8.020 1.00 . A A . 1 GLY HA3 1 1 16 13553 1 1 1 GLY N N -19.851 8.827 6.257 1.00 . A A . 1 GLY N 1 1 16 13554 1 1 1 GLY O O -17.462 10.838 6.658 1.00 . A A . 1 GLY O 1 1 16 13555 1 1 2 PRO C C -15.184 9.373 4.992 1.00 . A A . 2 PRO C 1 1 16 13556 1 1 2 PRO CA C -15.257 9.146 6.500 1.00 . A A . 2 PRO CA 1 1 16 13557 1 1 2 PRO CB C -14.402 7.934 6.902 1.00 . A A . 2 PRO CB 1 1 16 13558 1 1 2 PRO CD C -16.688 7.366 7.300 1.00 . A A . 2 PRO CD 1 1 16 13559 1 1 2 PRO CG C -15.288 7.071 7.740 1.00 . A A . 2 PRO CG 1 1 16 13560 1 1 2 PRO HA H -14.905 10.028 7.015 1.00 . A A . 2 PRO HA 1 1 16 13561 1 1 2 PRO HB2 H -14.077 7.415 6.013 1.00 . A A . 2 PRO HB2 1 1 16 13562 1 1 2 PRO HB3 H -13.541 8.272 7.459 1.00 . A A . 2 PRO HB3 1 1 16 13563 1 1 2 PRO HD2 H -16.956 6.753 6.451 1.00 . A A . 2 PRO HD2 1 1 16 13564 1 1 2 PRO HD3 H -17.383 7.217 8.114 1.00 . A A . 2 PRO HD3 1 1 16 13565 1 1 2 PRO HG2 H -15.054 6.030 7.570 1.00 . A A . 2 PRO HG2 1 1 16 13566 1 1 2 PRO HG3 H -15.161 7.319 8.785 1.00 . A A . 2 PRO HG3 1 1 16 13567 1 1 2 PRO N N -16.608 8.781 6.928 1.00 . A A . 2 PRO N 1 1 16 13568 1 1 2 PRO O O -15.369 8.443 4.207 1.00 . A A . 2 PRO O 1 1 16 13569 1 1 3 LEU C C -13.502 11.432 2.799 1.00 . A A . 3 LEU C 1 1 16 13570 1 1 3 LEU CA C -14.898 10.963 3.181 1.00 . A A . 3 LEU CA 1 1 16 13571 1 1 3 LEU CB C -15.921 12.055 2.862 1.00 . A A . 3 LEU CB 1 1 16 13572 1 1 3 LEU CD1 C -15.549 14.410 3.637 1.00 . A A . 3 LEU CD1 1 1 16 13573 1 1 3 LEU CD2 C -17.662 13.222 4.234 1.00 . A A . 3 LEU CD2 1 1 16 13574 1 1 3 LEU CG C -16.171 13.067 3.982 1.00 . A A . 3 LEU CG 1 1 16 13575 1 1 3 LEU H H -14.830 11.320 5.267 1.00 . A A . 3 LEU H 1 1 16 13576 1 1 3 LEU HA H -15.137 10.078 2.610 1.00 . A A . 3 LEU HA 1 1 16 13577 1 1 3 LEU HB2 H -15.578 12.592 1.989 1.00 . A A . 3 LEU HB2 1 1 16 13578 1 1 3 LEU HB3 H -16.860 11.578 2.622 1.00 . A A . 3 LEU HB3 1 1 16 13579 1 1 3 LEU HD11 H -14.480 14.360 3.786 1.00 . A A . 3 LEU HD11 1 1 16 13580 1 1 3 LEU HD12 H -15.757 14.647 2.604 1.00 . A A . 3 LEU HD12 1 1 16 13581 1 1 3 LEU HD13 H -15.965 15.176 4.274 1.00 . A A . 3 LEU HD13 1 1 16 13582 1 1 3 LEU HD21 H -17.818 13.902 5.059 1.00 . A A . 3 LEU HD21 1 1 16 13583 1 1 3 LEU HD22 H -18.139 13.614 3.348 1.00 . A A . 3 LEU HD22 1 1 16 13584 1 1 3 LEU HD23 H -18.089 12.260 4.474 1.00 . A A . 3 LEU HD23 1 1 16 13585 1 1 3 LEU HG H -15.711 12.710 4.891 1.00 . A A . 3 LEU HG 1 1 16 13586 1 1 3 LEU N N -14.953 10.612 4.593 1.00 . A A . 3 LEU N 1 1 16 13587 1 1 3 LEU O O -12.688 11.766 3.665 1.00 . A A . 3 LEU O 1 1 16 13588 1 1 4 GLY C C -11.041 10.658 0.682 1.00 . A A . 4 GLY C 1 1 16 13589 1 1 4 GLY CA C -11.918 11.841 1.028 1.00 . A A . 4 GLY CA 1 1 16 13590 1 1 4 GLY H H -13.901 11.114 0.865 1.00 . A A . 4 GLY H 1 1 16 13591 1 1 4 GLY HA2 H -12.044 12.452 0.147 1.00 . A A . 4 GLY HA2 1 1 16 13592 1 1 4 GLY HA3 H -11.432 12.424 1.795 1.00 . A A . 4 GLY HA3 1 1 16 13593 1 1 4 GLY N N -13.221 11.429 1.506 1.00 . A A . 4 GLY N 1 1 16 13594 1 1 4 GLY O O -10.966 10.248 -0.476 1.00 . A A . 4 GLY O 1 1 16 13595 1 1 5 SER C C -9.902 7.815 2.481 1.00 . A A . 5 SER C 1 1 16 13596 1 1 5 SER CA C -9.555 8.924 1.488 1.00 . A A . 5 SER CA 1 1 16 13597 1 1 5 SER CB C -8.081 9.319 1.620 1.00 . A A . 5 SER CB 1 1 16 13598 1 1 5 SER H H -10.525 10.432 2.601 1.00 . A A . 5 SER H 1 1 16 13599 1 1 5 SER HA H -9.731 8.559 0.487 1.00 . A A . 5 SER HA 1 1 16 13600 1 1 5 SER HB2 H -7.881 9.616 2.638 1.00 . A A . 5 SER HB2 1 1 16 13601 1 1 5 SER HB3 H -7.461 8.471 1.365 1.00 . A A . 5 SER HB3 1 1 16 13602 1 1 5 SER HG H -7.074 10.108 0.119 1.00 . A A . 5 SER HG 1 1 16 13603 1 1 5 SER N N -10.406 10.081 1.692 1.00 . A A . 5 SER N 1 1 16 13604 1 1 5 SER O O -9.093 7.450 3.335 1.00 . A A . 5 SER O 1 1 16 13605 1 1 5 SER OG O -7.754 10.400 0.756 1.00 . A A . 5 SER OG 1 1 16 13606 1 1 6 ASP C C -11.461 4.857 2.356 1.00 . A A . 6 ASP C 1 1 16 13607 1 1 6 ASP CA C -11.513 6.141 3.171 1.00 . A A . 6 ASP CA 1 1 16 13608 1 1 6 ASP CB C -12.925 6.371 3.715 1.00 . A A . 6 ASP CB 1 1 16 13609 1 1 6 ASP CG C -13.566 5.097 4.231 1.00 . A A . 6 ASP CG 1 1 16 13610 1 1 6 ASP H H -11.686 7.570 1.618 1.00 . A A . 6 ASP H 1 1 16 13611 1 1 6 ASP HA H -10.822 6.061 3.995 1.00 . A A . 6 ASP HA 1 1 16 13612 1 1 6 ASP HB2 H -12.878 7.082 4.527 1.00 . A A . 6 ASP HB2 1 1 16 13613 1 1 6 ASP HB3 H -13.547 6.772 2.927 1.00 . A A . 6 ASP HB3 1 1 16 13614 1 1 6 ASP N N -11.093 7.259 2.337 1.00 . A A . 6 ASP N 1 1 16 13615 1 1 6 ASP O O -10.754 3.911 2.705 1.00 . A A . 6 ASP O 1 1 16 13616 1 1 6 ASP OD1 O -13.067 4.531 5.224 1.00 . A A . 6 ASP OD1 1 1 16 13617 1 1 6 ASP OD2 O -14.578 4.657 3.646 1.00 . A A . 6 ASP OD2 1 1 16 13618 1 1 7 HIS C C -11.094 4.219 -0.919 1.00 . A A . 7 HIS C 1 1 16 13619 1 1 7 HIS CA C -11.995 3.808 0.236 1.00 . A A . 7 HIS CA 1 1 16 13620 1 1 7 HIS CB C -13.386 3.429 -0.280 1.00 . A A . 7 HIS CB 1 1 16 13621 1 1 7 HIS CD2 C -13.070 1.658 -2.137 1.00 . A A . 7 HIS CD2 1 1 16 13622 1 1 7 HIS CE1 C -13.876 -0.042 -1.044 1.00 . A A . 7 HIS CE1 1 1 16 13623 1 1 7 HIS CG C -13.454 2.065 -0.902 1.00 . A A . 7 HIS CG 1 1 16 13624 1 1 7 HIS H H -12.526 5.734 0.915 1.00 . A A . 7 HIS H 1 1 16 13625 1 1 7 HIS HA H -11.556 2.958 0.739 1.00 . A A . 7 HIS HA 1 1 16 13626 1 1 7 HIS HB2 H -14.083 3.451 0.546 1.00 . A A . 7 HIS HB2 1 1 16 13627 1 1 7 HIS HB3 H -13.696 4.150 -1.023 1.00 . A A . 7 HIS HB3 1 1 16 13628 1 1 7 HIS HD2 H -12.635 2.271 -2.914 1.00 . A A . 7 HIS HD2 1 1 16 13629 1 1 7 HIS HE1 H -14.201 -1.045 -0.804 1.00 . A A . 7 HIS HE1 1 1 16 13630 1 1 7 HIS HE2 H -13.351 -0.221 -3.046 1.00 . A A . 7 HIS HE2 1 1 16 13631 1 1 7 HIS N N -12.082 4.900 1.188 1.00 . A A . 7 HIS N 1 1 16 13632 1 1 7 HIS ND1 N -13.961 0.986 -0.216 1.00 . A A . 7 HIS ND1 1 1 16 13633 1 1 7 HIS NE2 N -13.342 0.319 -2.217 1.00 . A A . 7 HIS NE2 1 1 16 13634 1 1 7 HIS O O -11.223 5.328 -1.440 1.00 . A A . 7 HIS O 1 1 16 13635 1 1 8 HIS C C -8.258 4.831 -1.862 1.00 . A A . 8 HIS C 1 1 16 13636 1 1 8 HIS CA C -9.135 3.651 -2.274 1.00 . A A . 8 HIS CA 1 1 16 13637 1 1 8 HIS CB C -9.795 3.918 -3.636 1.00 . A A . 8 HIS CB 1 1 16 13638 1 1 8 HIS CD2 C -7.596 3.302 -4.847 1.00 . A A . 8 HIS CD2 1 1 16 13639 1 1 8 HIS CE1 C -8.099 4.146 -6.789 1.00 . A A . 8 HIS CE1 1 1 16 13640 1 1 8 HIS CG C -8.838 3.841 -4.791 1.00 . A A . 8 HIS CG 1 1 16 13641 1 1 8 HIS H H -10.045 2.535 -0.724 1.00 . A A . 8 HIS H 1 1 16 13642 1 1 8 HIS HA H -8.503 2.778 -2.363 1.00 . A A . 8 HIS HA 1 1 16 13643 1 1 8 HIS HB2 H -10.571 3.186 -3.800 1.00 . A A . 8 HIS HB2 1 1 16 13644 1 1 8 HIS HB3 H -10.232 4.904 -3.629 1.00 . A A . 8 HIS HB3 1 1 16 13645 1 1 8 HIS HD2 H -7.068 2.811 -4.042 1.00 . A A . 8 HIS HD2 1 1 16 13646 1 1 8 HIS HE1 H -8.029 4.446 -7.824 1.00 . A A . 8 HIS HE1 1 1 16 13647 1 1 8 HIS HE2 H -6.191 3.439 -6.402 1.00 . A A . 8 HIS HE2 1 1 16 13648 1 1 8 HIS N N -10.131 3.363 -1.243 1.00 . A A . 8 HIS N 1 1 16 13649 1 1 8 HIS ND1 N -9.153 4.371 -6.020 1.00 . A A . 8 HIS ND1 1 1 16 13650 1 1 8 HIS NE2 N -7.132 3.502 -6.122 1.00 . A A . 8 HIS NE2 1 1 16 13651 1 1 8 HIS O O -8.347 5.924 -2.426 1.00 . A A . 8 HIS O 1 1 16 13652 1 1 9 MET C C -5.381 5.857 -1.400 1.00 . A A . 9 MET C 1 1 16 13653 1 1 9 MET CA C -6.492 5.613 -0.385 1.00 . A A . 9 MET CA 1 1 16 13654 1 1 9 MET CB C -5.871 5.177 0.945 1.00 . A A . 9 MET CB 1 1 16 13655 1 1 9 MET CE C -7.059 5.209 4.893 1.00 . A A . 9 MET CE 1 1 16 13656 1 1 9 MET CG C -6.748 5.444 2.157 1.00 . A A . 9 MET CG 1 1 16 13657 1 1 9 MET H H -7.394 3.700 -0.459 1.00 . A A . 9 MET H 1 1 16 13658 1 1 9 MET HA H -7.048 6.526 -0.239 1.00 . A A . 9 MET HA 1 1 16 13659 1 1 9 MET HB2 H -5.671 4.118 0.903 1.00 . A A . 9 MET HB2 1 1 16 13660 1 1 9 MET HB3 H -4.938 5.705 1.080 1.00 . A A . 9 MET HB3 1 1 16 13661 1 1 9 MET HE1 H -7.320 4.531 5.694 1.00 . A A . 9 MET HE1 1 1 16 13662 1 1 9 MET HE2 H -6.289 5.888 5.233 1.00 . A A . 9 MET HE2 1 1 16 13663 1 1 9 MET HE3 H -7.931 5.772 4.598 1.00 . A A . 9 MET HE3 1 1 16 13664 1 1 9 MET HG2 H -6.541 6.439 2.518 1.00 . A A . 9 MET HG2 1 1 16 13665 1 1 9 MET HG3 H -7.784 5.378 1.861 1.00 . A A . 9 MET HG3 1 1 16 13666 1 1 9 MET N N -7.410 4.594 -0.872 1.00 . A A . 9 MET N 1 1 16 13667 1 1 9 MET O O -4.705 4.921 -1.822 1.00 . A A . 9 MET O 1 1 16 13668 1 1 9 MET SD S -6.452 4.272 3.494 1.00 . A A . 9 MET SD 1 1 16 13669 1 1 10 GLU C C -2.785 7.742 -1.767 1.00 . A A . 10 GLU C 1 1 16 13670 1 1 10 GLU CA C -4.030 7.482 -2.602 1.00 . A A . 10 GLU CA 1 1 16 13671 1 1 10 GLU CB C -4.370 8.713 -3.441 1.00 . A A . 10 GLU CB 1 1 16 13672 1 1 10 GLU CD C -5.883 10.256 -2.160 1.00 . A A . 10 GLU CD 1 1 16 13673 1 1 10 GLU CG C -5.790 9.214 -3.248 1.00 . A A . 10 GLU CG 1 1 16 13674 1 1 10 GLU H H -5.672 7.836 -1.307 1.00 . A A . 10 GLU H 1 1 16 13675 1 1 10 GLU HA H -3.842 6.646 -3.259 1.00 . A A . 10 GLU HA 1 1 16 13676 1 1 10 GLU HB2 H -3.691 9.510 -3.178 1.00 . A A . 10 GLU HB2 1 1 16 13677 1 1 10 GLU HB3 H -4.237 8.470 -4.485 1.00 . A A . 10 GLU HB3 1 1 16 13678 1 1 10 GLU HG2 H -6.138 9.648 -4.174 1.00 . A A . 10 GLU HG2 1 1 16 13679 1 1 10 GLU HG3 H -6.419 8.378 -2.981 1.00 . A A . 10 GLU HG3 1 1 16 13680 1 1 10 GLU N N -5.137 7.120 -1.721 1.00 . A A . 10 GLU N 1 1 16 13681 1 1 10 GLU O O -1.707 8.030 -2.286 1.00 . A A . 10 GLU O 1 1 16 13682 1 1 10 GLU OE1 O -5.889 9.879 -0.971 1.00 . A A . 10 GLU OE1 1 1 16 13683 1 1 10 GLU OE2 O -5.937 11.459 -2.487 1.00 . A A . 10 GLU OE2 1 1 16 13684 1 1 11 PHE C C -1.755 6.339 1.259 1.00 . A A . 11 PHE C 1 1 16 13685 1 1 11 PHE CA C -1.832 7.631 0.456 1.00 . A A . 11 PHE CA 1 1 16 13686 1 1 11 PHE CB C -1.998 8.848 1.382 1.00 . A A . 11 PHE CB 1 1 16 13687 1 1 11 PHE CD1 C -4.363 8.689 2.228 1.00 . A A . 11 PHE CD1 1 1 16 13688 1 1 11 PHE CD2 C -2.585 8.449 3.792 1.00 . A A . 11 PHE CD2 1 1 16 13689 1 1 11 PHE CE1 C -5.282 8.515 3.247 1.00 . A A . 11 PHE CE1 1 1 16 13690 1 1 11 PHE CE2 C -3.500 8.275 4.813 1.00 . A A . 11 PHE CE2 1 1 16 13691 1 1 11 PHE CG C -3.004 8.657 2.489 1.00 . A A . 11 PHE CG 1 1 16 13692 1 1 11 PHE CZ C -4.850 8.308 4.541 1.00 . A A . 11 PHE CZ 1 1 16 13693 1 1 11 PHE H H -3.804 7.226 -0.144 1.00 . A A . 11 PHE H 1 1 16 13694 1 1 11 PHE HA H -0.923 7.742 -0.118 1.00 . A A . 11 PHE HA 1 1 16 13695 1 1 11 PHE HB2 H -1.045 9.074 1.837 1.00 . A A . 11 PHE HB2 1 1 16 13696 1 1 11 PHE HB3 H -2.314 9.697 0.791 1.00 . A A . 11 PHE HB3 1 1 16 13697 1 1 11 PHE HD1 H -4.706 8.847 1.216 1.00 . A A . 11 PHE HD1 1 1 16 13698 1 1 11 PHE HD2 H -1.526 8.425 4.010 1.00 . A A . 11 PHE HD2 1 1 16 13699 1 1 11 PHE HE1 H -6.340 8.542 3.029 1.00 . A A . 11 PHE HE1 1 1 16 13700 1 1 11 PHE HE2 H -3.157 8.112 5.824 1.00 . A A . 11 PHE HE2 1 1 16 13701 1 1 11 PHE HZ H -5.569 8.174 5.337 1.00 . A A . 11 PHE HZ 1 1 16 13702 1 1 11 PHE N N -2.936 7.539 -0.473 1.00 . A A . 11 PHE N 1 1 16 13703 1 1 11 PHE O O -2.633 5.482 1.144 1.00 . A A . 11 PHE O 1 1 16 13704 1 1 12 CYS C C -1.473 4.922 3.974 1.00 . A A . 12 CYS C 1 1 16 13705 1 1 12 CYS CA C -0.518 4.963 2.804 1.00 . A A . 12 CYS CA 1 1 16 13706 1 1 12 CYS CB C 0.900 4.868 3.335 1.00 . A A . 12 CYS CB 1 1 16 13707 1 1 12 CYS H H -0.001 6.867 2.052 1.00 . A A . 12 CYS H 1 1 16 13708 1 1 12 CYS HA H -0.710 4.119 2.159 1.00 . A A . 12 CYS HA 1 1 16 13709 1 1 12 CYS HB2 H 1.274 5.865 3.522 1.00 . A A . 12 CYS HB2 1 1 16 13710 1 1 12 CYS HB3 H 0.891 4.312 4.262 1.00 . A A . 12 CYS HB3 1 1 16 13711 1 1 12 CYS HG H 3.135 4.824 2.152 1.00 . A A . 12 CYS HG 1 1 16 13712 1 1 12 CYS N N -0.695 6.173 2.026 1.00 . A A . 12 CYS N 1 1 16 13713 1 1 12 CYS O O -1.432 5.787 4.844 1.00 . A A . 12 CYS O 1 1 16 13714 1 1 12 CYS SG S 2.048 4.058 2.222 1.00 . A A . 12 CYS SG 1 1 16 13715 1 1 13 ARG C C -2.242 3.410 6.484 1.00 . A A . 13 ARG C 1 1 16 13716 1 1 13 ARG CA C -3.079 3.599 5.219 1.00 . A A . 13 ARG CA 1 1 16 13717 1 1 13 ARG CB C -3.954 2.364 4.989 1.00 . A A . 13 ARG CB 1 1 16 13718 1 1 13 ARG CD C -4.655 0.502 3.457 1.00 . A A . 13 ARG CD 1 1 16 13719 1 1 13 ARG CG C -3.804 1.749 3.607 1.00 . A A . 13 ARG CG 1 1 16 13720 1 1 13 ARG CZ C -7.035 -0.127 3.592 1.00 . A A . 13 ARG CZ 1 1 16 13721 1 1 13 ARG H H -2.132 3.137 3.378 1.00 . A A . 13 ARG H 1 1 16 13722 1 1 13 ARG HA H -3.711 4.466 5.342 1.00 . A A . 13 ARG HA 1 1 16 13723 1 1 13 ARG HB2 H -3.694 1.614 5.722 1.00 . A A . 13 ARG HB2 1 1 16 13724 1 1 13 ARG HB3 H -4.990 2.642 5.127 1.00 . A A . 13 ARG HB3 1 1 16 13725 1 1 13 ARG HD2 H -4.581 0.152 2.438 1.00 . A A . 13 ARG HD2 1 1 16 13726 1 1 13 ARG HD3 H -4.280 -0.256 4.128 1.00 . A A . 13 ARG HD3 1 1 16 13727 1 1 13 ARG HE H -6.284 1.648 4.134 1.00 . A A . 13 ARG HE 1 1 16 13728 1 1 13 ARG HG2 H -4.110 2.472 2.867 1.00 . A A . 13 ARG HG2 1 1 16 13729 1 1 13 ARG HG3 H -2.768 1.486 3.451 1.00 . A A . 13 ARG HG3 1 1 16 13730 1 1 13 ARG HH11 H -5.812 -1.595 2.893 1.00 . A A . 13 ARG HH11 1 1 16 13731 1 1 13 ARG HH12 H -7.496 -2.014 3.001 1.00 . A A . 13 ARG HH12 1 1 16 13732 1 1 13 ARG HH21 H -8.498 1.117 4.261 1.00 . A A . 13 ARG HH21 1 1 16 13733 1 1 13 ARG HH22 H -9.032 -0.461 3.742 1.00 . A A . 13 ARG HH22 1 1 16 13734 1 1 13 ARG N N -2.214 3.834 4.070 1.00 . A A . 13 ARG N 1 1 16 13735 1 1 13 ARG NE N -6.060 0.761 3.766 1.00 . A A . 13 ARG NE 1 1 16 13736 1 1 13 ARG NH1 N -6.761 -1.338 3.120 1.00 . A A . 13 ARG NH1 1 1 16 13737 1 1 13 ARG NH2 N -8.285 0.199 3.891 1.00 . A A . 13 ARG NH2 1 1 16 13738 1 1 13 ARG O O -2.759 3.442 7.598 1.00 . A A . 13 ARG O 1 1 16 13739 1 1 14 VAL C C 0.811 4.168 7.716 1.00 . A A . 14 VAL C 1 1 16 13740 1 1 14 VAL CA C -0.038 2.932 7.398 1.00 . A A . 14 VAL CA 1 1 16 13741 1 1 14 VAL CB C 0.883 1.734 7.089 1.00 . A A . 14 VAL CB 1 1 16 13742 1 1 14 VAL CG1 C 1.842 1.467 8.242 1.00 . A A . 14 VAL CG1 1 1 16 13743 1 1 14 VAL CG2 C 0.053 0.497 6.780 1.00 . A A . 14 VAL CG2 1 1 16 13744 1 1 14 VAL H H -0.607 3.137 5.378 1.00 . A A . 14 VAL H 1 1 16 13745 1 1 14 VAL HA H -0.632 2.686 8.265 1.00 . A A . 14 VAL HA 1 1 16 13746 1 1 14 VAL HB H 1.469 1.973 6.214 1.00 . A A . 14 VAL HB 1 1 16 13747 1 1 14 VAL HG11 H 2.634 0.813 7.908 1.00 . A A . 14 VAL HG11 1 1 16 13748 1 1 14 VAL HG12 H 2.265 2.400 8.579 1.00 . A A . 14 VAL HG12 1 1 16 13749 1 1 14 VAL HG13 H 1.307 0.999 9.054 1.00 . A A . 14 VAL HG13 1 1 16 13750 1 1 14 VAL HG21 H -0.992 0.712 6.950 1.00 . A A . 14 VAL HG21 1 1 16 13751 1 1 14 VAL HG22 H 0.197 0.216 5.746 1.00 . A A . 14 VAL HG22 1 1 16 13752 1 1 14 VAL HG23 H 0.362 -0.316 7.420 1.00 . A A . 14 VAL HG23 1 1 16 13753 1 1 14 VAL N N -0.948 3.178 6.291 1.00 . A A . 14 VAL N 1 1 16 13754 1 1 14 VAL O O 0.692 4.741 8.801 1.00 . A A . 14 VAL O 1 1 16 13755 1 1 15 CYS C C 2.088 6.964 6.856 1.00 . A A . 15 CYS C 1 1 16 13756 1 1 15 CYS CA C 2.697 5.577 7.079 1.00 . A A . 15 CYS CA 1 1 16 13757 1 1 15 CYS CB C 3.939 5.387 6.198 1.00 . A A . 15 CYS CB 1 1 16 13758 1 1 15 CYS H H 1.850 3.954 6.023 1.00 . A A . 15 CYS H 1 1 16 13759 1 1 15 CYS HA H 2.994 5.500 8.114 1.00 . A A . 15 CYS HA 1 1 16 13760 1 1 15 CYS HB2 H 4.801 5.778 6.719 1.00 . A A . 15 CYS HB2 1 1 16 13761 1 1 15 CYS HB3 H 4.084 4.332 6.021 1.00 . A A . 15 CYS HB3 1 1 16 13762 1 1 15 CYS N N 1.735 4.508 6.818 1.00 . A A . 15 CYS N 1 1 16 13763 1 1 15 CYS O O 2.686 7.973 7.229 1.00 . A A . 15 CYS O 1 1 16 13764 1 1 15 CYS SG S 3.861 6.212 4.573 1.00 . A A . 15 CYS SG 1 1 16 13765 1 1 16 LYS C C 0.778 9.003 4.779 1.00 . A A . 16 LYS C 1 1 16 13766 1 1 16 LYS CA C 0.171 8.235 5.955 1.00 . A A . 16 LYS CA 1 1 16 13767 1 1 16 LYS CB C 0.094 9.139 7.189 1.00 . A A . 16 LYS CB 1 1 16 13768 1 1 16 LYS CD C -2.212 9.585 8.066 1.00 . A A . 16 LYS CD 1 1 16 13769 1 1 16 LYS CE C -3.322 9.095 8.979 1.00 . A A . 16 LYS CE 1 1 16 13770 1 1 16 LYS CG C -0.975 8.715 8.181 1.00 . A A . 16 LYS CG 1 1 16 13771 1 1 16 LYS H H 0.491 6.146 5.990 1.00 . A A . 16 LYS H 1 1 16 13772 1 1 16 LYS HA H -0.835 7.950 5.683 1.00 . A A . 16 LYS HA 1 1 16 13773 1 1 16 LYS HB2 H 1.049 9.127 7.693 1.00 . A A . 16 LYS HB2 1 1 16 13774 1 1 16 LYS HB3 H -0.121 10.148 6.870 1.00 . A A . 16 LYS HB3 1 1 16 13775 1 1 16 LYS HD2 H -1.955 10.598 8.340 1.00 . A A . 16 LYS HD2 1 1 16 13776 1 1 16 LYS HD3 H -2.562 9.565 7.044 1.00 . A A . 16 LYS HD3 1 1 16 13777 1 1 16 LYS HE2 H -4.127 8.713 8.369 1.00 . A A . 16 LYS HE2 1 1 16 13778 1 1 16 LYS HE3 H -2.936 8.301 9.602 1.00 . A A . 16 LYS HE3 1 1 16 13779 1 1 16 LYS HG2 H -1.248 7.690 7.981 1.00 . A A . 16 LYS HG2 1 1 16 13780 1 1 16 LYS HG3 H -0.578 8.796 9.181 1.00 . A A . 16 LYS HG3 1 1 16 13781 1 1 16 LYS HZ1 H -4.073 9.805 10.794 1.00 . A A . 16 LYS HZ1 1 1 16 13782 1 1 16 LYS HZ2 H -4.712 10.585 9.431 1.00 . A A . 16 LYS HZ2 1 1 16 13783 1 1 16 LYS HZ3 H -3.134 10.938 9.948 1.00 . A A . 16 LYS HZ3 1 1 16 13784 1 1 16 LYS N N 0.903 6.993 6.241 1.00 . A A . 16 LYS N 1 1 16 13785 1 1 16 LYS NZ N -3.847 10.180 9.848 1.00 . A A . 16 LYS NZ 1 1 16 13786 1 1 16 LYS O O 0.209 9.993 4.322 1.00 . A A . 16 LYS O 1 1 16 13787 1 1 17 ASP C C 2.025 8.524 1.820 1.00 . A A . 17 ASP C 1 1 16 13788 1 1 17 ASP CA C 2.531 9.152 3.106 1.00 . A A . 17 ASP CA 1 1 16 13789 1 1 17 ASP CB C 4.051 9.015 3.180 1.00 . A A . 17 ASP CB 1 1 16 13790 1 1 17 ASP CG C 4.740 10.313 3.546 1.00 . A A . 17 ASP CG 1 1 16 13791 1 1 17 ASP H H 2.299 7.709 4.644 1.00 . A A . 17 ASP H 1 1 16 13792 1 1 17 ASP HA H 2.269 10.199 3.115 1.00 . A A . 17 ASP HA 1 1 16 13793 1 1 17 ASP HB2 H 4.302 8.274 3.924 1.00 . A A . 17 ASP HB2 1 1 16 13794 1 1 17 ASP HB3 H 4.421 8.688 2.218 1.00 . A A . 17 ASP HB3 1 1 16 13795 1 1 17 ASP N N 1.897 8.520 4.257 1.00 . A A . 17 ASP N 1 1 16 13796 1 1 17 ASP O O 1.905 7.299 1.725 1.00 . A A . 17 ASP O 1 1 16 13797 1 1 17 ASP OD1 O 4.084 11.373 3.514 1.00 . A A . 17 ASP OD1 1 1 16 13798 1 1 17 ASP OD2 O 5.944 10.279 3.880 1.00 . A A . 17 ASP OD2 1 1 16 13799 1 1 18 GLY C C 1.491 9.804 -1.570 1.00 . A A . 18 GLY C 1 1 16 13800 1 1 18 GLY CA C 1.215 8.858 -0.423 1.00 . A A . 18 GLY CA 1 1 16 13801 1 1 18 GLY H H 1.845 10.326 0.970 1.00 . A A . 18 GLY H 1 1 16 13802 1 1 18 GLY HA2 H 1.683 7.907 -0.635 1.00 . A A . 18 GLY HA2 1 1 16 13803 1 1 18 GLY HA3 H 0.147 8.713 -0.339 1.00 . A A . 18 GLY HA3 1 1 16 13804 1 1 18 GLY N N 1.720 9.356 0.838 1.00 . A A . 18 GLY N 1 1 16 13805 1 1 18 GLY O O 2.554 10.426 -1.631 1.00 . A A . 18 GLY O 1 1 16 13806 1 1 19 GLY C C 0.985 9.858 -4.923 1.00 . A A . 19 GLY C 1 1 16 13807 1 1 19 GLY CA C 0.746 10.692 -3.684 1.00 . A A . 19 GLY CA 1 1 16 13808 1 1 19 GLY H H -0.234 9.291 -2.442 1.00 . A A . 19 GLY H 1 1 16 13809 1 1 19 GLY HA2 H -0.138 11.295 -3.831 1.00 . A A . 19 GLY HA2 1 1 16 13810 1 1 19 GLY HA3 H 1.595 11.342 -3.528 1.00 . A A . 19 GLY HA3 1 1 16 13811 1 1 19 GLY N N 0.563 9.864 -2.513 1.00 . A A . 19 GLY N 1 1 16 13812 1 1 19 GLY O O 0.126 9.069 -5.318 1.00 . A A . 19 GLY O 1 1 16 13813 1 1 20 GLU C C 3.508 8.021 -6.159 1.00 . A A . 20 GLU C 1 1 16 13814 1 1 20 GLU CA C 2.566 9.129 -6.611 1.00 . A A . 20 GLU CA 1 1 16 13815 1 1 20 GLU CB C 3.225 9.994 -7.686 1.00 . A A . 20 GLU CB 1 1 16 13816 1 1 20 GLU CD C 2.532 11.531 -9.558 1.00 . A A . 20 GLU CD 1 1 16 13817 1 1 20 GLU CG C 2.385 11.192 -8.093 1.00 . A A . 20 GLU CG 1 1 16 13818 1 1 20 GLU H H 2.864 10.526 -5.051 1.00 . A A . 20 GLU H 1 1 16 13819 1 1 20 GLU HA H 1.670 8.682 -7.014 1.00 . A A . 20 GLU HA 1 1 16 13820 1 1 20 GLU HB2 H 4.174 10.351 -7.313 1.00 . A A . 20 GLU HB2 1 1 16 13821 1 1 20 GLU HB3 H 3.397 9.388 -8.562 1.00 . A A . 20 GLU HB3 1 1 16 13822 1 1 20 GLU HG2 H 1.346 10.973 -7.894 1.00 . A A . 20 GLU HG2 1 1 16 13823 1 1 20 GLU HG3 H 2.691 12.048 -7.508 1.00 . A A . 20 GLU HG3 1 1 16 13824 1 1 20 GLU N N 2.186 9.946 -5.469 1.00 . A A . 20 GLU N 1 1 16 13825 1 1 20 GLU O O 4.731 8.177 -6.179 1.00 . A A . 20 GLU O 1 1 16 13826 1 1 20 GLU OE1 O 3.458 12.299 -9.902 1.00 . A A . 20 GLU OE1 1 1 16 13827 1 1 20 GLU OE2 O 1.731 11.025 -10.372 1.00 . A A . 20 GLU OE2 1 1 16 13828 1 1 21 LEU C C 3.166 4.523 -5.443 1.00 . A A . 21 LEU C 1 1 16 13829 1 1 21 LEU CA C 3.696 5.888 -5.010 1.00 . A A . 21 LEU CA 1 1 16 13830 1 1 21 LEU CB C 3.649 6.014 -3.481 1.00 . A A . 21 LEU CB 1 1 16 13831 1 1 21 LEU CD1 C 2.552 5.392 -1.313 1.00 . A A . 21 LEU CD1 1 1 16 13832 1 1 21 LEU CD2 C 1.210 6.486 -3.099 1.00 . A A . 21 LEU CD2 1 1 16 13833 1 1 21 LEU CG C 2.353 5.531 -2.812 1.00 . A A . 21 LEU CG 1 1 16 13834 1 1 21 LEU H H 1.948 6.947 -5.541 1.00 . A A . 21 LEU H 1 1 16 13835 1 1 21 LEU HA H 4.719 5.987 -5.338 1.00 . A A . 21 LEU HA 1 1 16 13836 1 1 21 LEU HB2 H 4.470 5.447 -3.073 1.00 . A A . 21 LEU HB2 1 1 16 13837 1 1 21 LEU HB3 H 3.791 7.053 -3.224 1.00 . A A . 21 LEU HB3 1 1 16 13838 1 1 21 LEU HD11 H 3.565 5.663 -1.057 1.00 . A A . 21 LEU HD11 1 1 16 13839 1 1 21 LEU HD12 H 1.863 6.045 -0.795 1.00 . A A . 21 LEU HD12 1 1 16 13840 1 1 21 LEU HD13 H 2.367 4.370 -1.017 1.00 . A A . 21 LEU HD13 1 1 16 13841 1 1 21 LEU HD21 H 0.619 6.623 -2.205 1.00 . A A . 21 LEU HD21 1 1 16 13842 1 1 21 LEU HD22 H 1.612 7.438 -3.413 1.00 . A A . 21 LEU HD22 1 1 16 13843 1 1 21 LEU HD23 H 0.589 6.080 -3.884 1.00 . A A . 21 LEU HD23 1 1 16 13844 1 1 21 LEU HG H 2.089 4.559 -3.207 1.00 . A A . 21 LEU HG 1 1 16 13845 1 1 21 LEU N N 2.926 6.964 -5.615 1.00 . A A . 21 LEU N 1 1 16 13846 1 1 21 LEU O O 2.229 4.438 -6.235 1.00 . A A . 21 LEU O 1 1 16 13847 1 1 22 LEU C C 1.929 1.855 -4.536 1.00 . A A . 22 LEU C 1 1 16 13848 1 1 22 LEU CA C 3.302 2.104 -5.162 1.00 . A A . 22 LEU CA 1 1 16 13849 1 1 22 LEU CB C 4.341 1.104 -4.631 1.00 . A A . 22 LEU CB 1 1 16 13850 1 1 22 LEU CD1 C 4.051 -1.285 -5.336 1.00 . A A . 22 LEU CD1 1 1 16 13851 1 1 22 LEU CD2 C 4.447 -0.736 -2.933 1.00 . A A . 22 LEU CD2 1 1 16 13852 1 1 22 LEU CG C 3.805 -0.273 -4.230 1.00 . A A . 22 LEU CG 1 1 16 13853 1 1 22 LEU H H 4.459 3.605 -4.229 1.00 . A A . 22 LEU H 1 1 16 13854 1 1 22 LEU HA H 3.220 1.994 -6.231 1.00 . A A . 22 LEU HA 1 1 16 13855 1 1 22 LEU HB2 H 5.089 0.961 -5.397 1.00 . A A . 22 LEU HB2 1 1 16 13856 1 1 22 LEU HB3 H 4.819 1.543 -3.767 1.00 . A A . 22 LEU HB3 1 1 16 13857 1 1 22 LEU HD11 H 4.451 -0.782 -6.203 1.00 . A A . 22 LEU HD11 1 1 16 13858 1 1 22 LEU HD12 H 4.758 -2.027 -4.993 1.00 . A A . 22 LEU HD12 1 1 16 13859 1 1 22 LEU HD13 H 3.120 -1.768 -5.596 1.00 . A A . 22 LEU HD13 1 1 16 13860 1 1 22 LEU HD21 H 4.826 0.119 -2.392 1.00 . A A . 22 LEU HD21 1 1 16 13861 1 1 22 LEU HD22 H 3.710 -1.245 -2.328 1.00 . A A . 22 LEU HD22 1 1 16 13862 1 1 22 LEU HD23 H 5.260 -1.411 -3.153 1.00 . A A . 22 LEU HD23 1 1 16 13863 1 1 22 LEU HG H 2.738 -0.206 -4.072 1.00 . A A . 22 LEU HG 1 1 16 13864 1 1 22 LEU N N 3.743 3.466 -4.883 1.00 . A A . 22 LEU N 1 1 16 13865 1 1 22 LEU O O 1.581 2.460 -3.521 1.00 . A A . 22 LEU O 1 1 16 13866 1 1 23 CYS C C -0.754 -0.536 -5.228 1.00 . A A . 23 CYS C 1 1 16 13867 1 1 23 CYS CA C -0.243 0.806 -4.726 1.00 . A A . 23 CYS CA 1 1 16 13868 1 1 23 CYS CB C -1.161 1.931 -5.216 1.00 . A A . 23 CYS CB 1 1 16 13869 1 1 23 CYS H H 1.410 0.640 -6.034 1.00 . A A . 23 CYS H 1 1 16 13870 1 1 23 CYS HA H -0.235 0.799 -3.646 1.00 . A A . 23 CYS HA 1 1 16 13871 1 1 23 CYS HB2 H -2.169 1.551 -5.299 1.00 . A A . 23 CYS HB2 1 1 16 13872 1 1 23 CYS HB3 H -1.144 2.737 -4.497 1.00 . A A . 23 CYS HB3 1 1 16 13873 1 1 23 CYS HG H -0.791 1.645 -7.725 1.00 . A A . 23 CYS HG 1 1 16 13874 1 1 23 CYS N N 1.114 1.045 -5.189 1.00 . A A . 23 CYS N 1 1 16 13875 1 1 23 CYS O O -0.409 -0.953 -6.340 1.00 . A A . 23 CYS O 1 1 16 13876 1 1 23 CYS SG S -0.702 2.619 -6.826 1.00 . A A . 23 CYS SG 1 1 16 13877 1 1 24 CYS C C -3.046 -2.190 -6.150 1.00 . A A . 24 CYS C 1 1 16 13878 1 1 24 CYS CA C -2.234 -2.426 -4.874 1.00 . A A . 24 CYS CA 1 1 16 13879 1 1 24 CYS CB C -3.134 -2.994 -3.770 1.00 . A A . 24 CYS CB 1 1 16 13880 1 1 24 CYS H H -1.894 -0.789 -3.589 1.00 . A A . 24 CYS H 1 1 16 13881 1 1 24 CYS HA H -1.444 -3.132 -5.087 1.00 . A A . 24 CYS HA 1 1 16 13882 1 1 24 CYS HB2 H -4.165 -2.885 -4.071 1.00 . A A . 24 CYS HB2 1 1 16 13883 1 1 24 CYS HB3 H -2.914 -4.043 -3.647 1.00 . A A . 24 CYS HB3 1 1 16 13884 1 1 24 CYS N N -1.619 -1.184 -4.447 1.00 . A A . 24 CYS N 1 1 16 13885 1 1 24 CYS O O -3.718 -1.165 -6.292 1.00 . A A . 24 CYS O 1 1 16 13886 1 1 24 CYS SG S -2.961 -2.197 -2.128 1.00 . A A . 24 CYS SG 1 1 16 13887 1 1 25 ASP C C -4.900 -3.602 -8.407 1.00 . A A . 25 ASP C 1 1 16 13888 1 1 25 ASP CA C -3.553 -2.913 -8.408 1.00 . A A . 25 ASP CA 1 1 16 13889 1 1 25 ASP CB C -2.696 -3.483 -9.534 1.00 . A A . 25 ASP CB 1 1 16 13890 1 1 25 ASP CG C -2.950 -2.782 -10.854 1.00 . A A . 25 ASP CG 1 1 16 13891 1 1 25 ASP H H -2.281 -3.837 -6.977 1.00 . A A . 25 ASP H 1 1 16 13892 1 1 25 ASP HA H -3.699 -1.857 -8.574 1.00 . A A . 25 ASP HA 1 1 16 13893 1 1 25 ASP HB2 H -1.654 -3.374 -9.280 1.00 . A A . 25 ASP HB2 1 1 16 13894 1 1 25 ASP HB3 H -2.925 -4.532 -9.656 1.00 . A A . 25 ASP HB3 1 1 16 13895 1 1 25 ASP N N -2.893 -3.079 -7.116 1.00 . A A . 25 ASP N 1 1 16 13896 1 1 25 ASP O O -5.825 -3.194 -9.104 1.00 . A A . 25 ASP O 1 1 16 13897 1 1 25 ASP OD1 O -2.466 -1.644 -11.031 1.00 . A A . 25 ASP OD1 1 1 16 13898 1 1 25 ASP OD2 O -3.642 -3.362 -11.720 1.00 . A A . 25 ASP OD2 1 1 16 13899 1 1 26 THR C C -6.871 -5.197 -6.179 1.00 . A A . 26 THR C 1 1 16 13900 1 1 26 THR CA C -6.203 -5.451 -7.530 1.00 . A A . 26 THR CA 1 1 16 13901 1 1 26 THR CB C -5.883 -6.950 -7.719 1.00 . A A . 26 THR CB 1 1 16 13902 1 1 26 THR CG2 C -4.856 -7.414 -6.699 1.00 . A A . 26 THR CG2 1 1 16 13903 1 1 26 THR H H -4.204 -4.937 -7.110 1.00 . A A . 26 THR H 1 1 16 13904 1 1 26 THR HA H -6.872 -5.139 -8.320 1.00 . A A . 26 THR HA 1 1 16 13905 1 1 26 THR HB H -5.459 -7.082 -8.704 1.00 . A A . 26 THR HB 1 1 16 13906 1 1 26 THR HG1 H -7.739 -7.386 -8.230 1.00 . A A . 26 THR HG1 1 1 16 13907 1 1 26 THR HG21 H -5.191 -7.154 -5.706 1.00 . A A . 26 THR HG21 1 1 16 13908 1 1 26 THR HG22 H -3.910 -6.930 -6.900 1.00 . A A . 26 THR HG22 1 1 16 13909 1 1 26 THR HG23 H -4.736 -8.485 -6.771 1.00 . A A . 26 THR HG23 1 1 16 13910 1 1 26 THR N N -4.988 -4.665 -7.631 1.00 . A A . 26 THR N 1 1 16 13911 1 1 26 THR O O -7.874 -5.821 -5.823 1.00 . A A . 26 THR O 1 1 16 13912 1 1 26 THR OG1 O -7.070 -7.743 -7.624 1.00 . A A . 26 THR OG1 1 1 16 13913 1 1 27 CYS C C -6.757 -2.262 -4.091 1.00 . A A . 27 CYS C 1 1 16 13914 1 1 27 CYS CA C -6.900 -3.779 -4.209 1.00 . A A . 27 CYS CA 1 1 16 13915 1 1 27 CYS CB C -6.195 -4.525 -3.067 1.00 . A A . 27 CYS CB 1 1 16 13916 1 1 27 CYS H H -5.601 -3.696 -5.858 1.00 . A A . 27 CYS H 1 1 16 13917 1 1 27 CYS HA H -7.949 -4.033 -4.204 1.00 . A A . 27 CYS HA 1 1 16 13918 1 1 27 CYS HB2 H -6.625 -5.511 -2.989 1.00 . A A . 27 CYS HB2 1 1 16 13919 1 1 27 CYS HB3 H -5.147 -4.615 -3.306 1.00 . A A . 27 CYS HB3 1 1 16 13920 1 1 27 CYS N N -6.348 -4.206 -5.475 1.00 . A A . 27 CYS N 1 1 16 13921 1 1 27 CYS O O -5.880 -1.668 -4.715 1.00 . A A . 27 CYS O 1 1 16 13922 1 1 27 CYS SG S -6.323 -3.754 -1.423 1.00 . A A . 27 CYS SG 1 1 16 13923 1 1 28 PRO C C -7.017 0.505 -2.324 1.00 . A A . 28 PRO C 1 1 16 13924 1 1 28 PRO CA C -7.802 -0.140 -3.469 1.00 . A A . 28 PRO CA 1 1 16 13925 1 1 28 PRO CB C -9.300 0.134 -3.325 1.00 . A A . 28 PRO CB 1 1 16 13926 1 1 28 PRO CD C -8.942 -2.218 -2.905 1.00 . A A . 28 PRO CD 1 1 16 13927 1 1 28 PRO CG C -9.852 -1.053 -2.604 1.00 . A A . 28 PRO CG 1 1 16 13928 1 1 28 PRO HA H -7.453 0.268 -4.406 1.00 . A A . 28 PRO HA 1 1 16 13929 1 1 28 PRO HB2 H -9.447 1.041 -2.757 1.00 . A A . 28 PRO HB2 1 1 16 13930 1 1 28 PRO HB3 H -9.743 0.241 -4.303 1.00 . A A . 28 PRO HB3 1 1 16 13931 1 1 28 PRO HD2 H -8.699 -2.748 -1.994 1.00 . A A . 28 PRO HD2 1 1 16 13932 1 1 28 PRO HD3 H -9.401 -2.888 -3.615 1.00 . A A . 28 PRO HD3 1 1 16 13933 1 1 28 PRO HG2 H -9.866 -0.860 -1.542 1.00 . A A . 28 PRO HG2 1 1 16 13934 1 1 28 PRO HG3 H -10.851 -1.261 -2.958 1.00 . A A . 28 PRO HG3 1 1 16 13935 1 1 28 PRO N N -7.737 -1.598 -3.478 1.00 . A A . 28 PRO N 1 1 16 13936 1 1 28 PRO O O -7.606 1.052 -1.394 1.00 . A A . 28 PRO O 1 1 16 13937 1 1 29 SER C C -3.497 1.546 -2.035 1.00 . A A . 29 SER C 1 1 16 13938 1 1 29 SER CA C -4.829 1.112 -1.422 1.00 . A A . 29 SER CA 1 1 16 13939 1 1 29 SER CB C -4.563 0.139 -0.278 1.00 . A A . 29 SER CB 1 1 16 13940 1 1 29 SER H H -5.274 0.046 -3.198 1.00 . A A . 29 SER H 1 1 16 13941 1 1 29 SER HA H -5.338 1.982 -1.036 1.00 . A A . 29 SER HA 1 1 16 13942 1 1 29 SER HB2 H -4.163 -0.780 -0.682 1.00 . A A . 29 SER HB2 1 1 16 13943 1 1 29 SER HB3 H -3.844 0.571 0.404 1.00 . A A . 29 SER HB3 1 1 16 13944 1 1 29 SER HG H -5.608 -0.974 0.945 1.00 . A A . 29 SER HG 1 1 16 13945 1 1 29 SER N N -5.690 0.487 -2.424 1.00 . A A . 29 SER N 1 1 16 13946 1 1 29 SER O O -3.195 1.200 -3.175 1.00 . A A . 29 SER O 1 1 16 13947 1 1 29 SER OG O -5.749 -0.162 0.437 1.00 . A A . 29 SER OG 1 1 16 13948 1 1 30 SER C C -0.333 2.401 -0.563 1.00 . A A . 30 SER C 1 1 16 13949 1 1 30 SER CA C -1.351 2.665 -1.678 1.00 . A A . 30 SER CA 1 1 16 13950 1 1 30 SER CB C -1.343 4.142 -2.078 1.00 . A A . 30 SER CB 1 1 16 13951 1 1 30 SER H H -2.979 2.480 -0.342 1.00 . A A . 30 SER H 1 1 16 13952 1 1 30 SER HA H -1.085 2.068 -2.532 1.00 . A A . 30 SER HA 1 1 16 13953 1 1 30 SER HB2 H -1.502 4.753 -1.201 1.00 . A A . 30 SER HB2 1 1 16 13954 1 1 30 SER HB3 H -0.390 4.387 -2.521 1.00 . A A . 30 SER HB3 1 1 16 13955 1 1 30 SER HG H -3.212 4.529 -2.551 1.00 . A A . 30 SER HG 1 1 16 13956 1 1 30 SER N N -2.687 2.259 -1.251 1.00 . A A . 30 SER N 1 1 16 13957 1 1 30 SER O O -0.678 2.462 0.621 1.00 . A A . 30 SER O 1 1 16 13958 1 1 30 SER OG O -2.370 4.424 -3.021 1.00 . A A . 30 SER OG 1 1 16 13959 1 1 31 TYR C C 3.320 2.055 -0.422 1.00 . A A . 31 TYR C 1 1 16 13960 1 1 31 TYR CA C 1.919 1.646 0.028 1.00 . A A . 31 TYR CA 1 1 16 13961 1 1 31 TYR CB C 1.909 0.132 0.240 1.00 . A A . 31 TYR CB 1 1 16 13962 1 1 31 TYR CD1 C 0.655 0.105 2.428 1.00 . A A . 31 TYR CD1 1 1 16 13963 1 1 31 TYR CD2 C -0.108 -1.303 0.664 1.00 . A A . 31 TYR CD2 1 1 16 13964 1 1 31 TYR CE1 C -0.362 -0.355 3.238 1.00 . A A . 31 TYR CE1 1 1 16 13965 1 1 31 TYR CE2 C -1.123 -1.767 1.468 1.00 . A A . 31 TYR CE2 1 1 16 13966 1 1 31 TYR CG C 0.796 -0.361 1.127 1.00 . A A . 31 TYR CG 1 1 16 13967 1 1 31 TYR CZ C -1.246 -1.293 2.753 1.00 . A A . 31 TYR CZ 1 1 16 13968 1 1 31 TYR H H 1.100 1.961 -1.905 1.00 . A A . 31 TYR H 1 1 16 13969 1 1 31 TYR HA H 1.693 2.133 0.964 1.00 . A A . 31 TYR HA 1 1 16 13970 1 1 31 TYR HB2 H 1.803 -0.354 -0.718 1.00 . A A . 31 TYR HB2 1 1 16 13971 1 1 31 TYR HB3 H 2.847 -0.166 0.686 1.00 . A A . 31 TYR HB3 1 1 16 13972 1 1 31 TYR HD1 H 1.350 0.840 2.802 1.00 . A A . 31 TYR HD1 1 1 16 13973 1 1 31 TYR HD2 H -0.009 -1.673 -0.346 1.00 . A A . 31 TYR HD2 1 1 16 13974 1 1 31 TYR HE1 H -0.458 0.016 4.247 1.00 . A A . 31 TYR HE1 1 1 16 13975 1 1 31 TYR HE2 H -1.816 -2.503 1.088 1.00 . A A . 31 TYR HE2 1 1 16 13976 1 1 31 TYR HH H -2.989 -2.075 2.997 1.00 . A A . 31 TYR HH 1 1 16 13977 1 1 31 TYR N N 0.893 2.027 -0.943 1.00 . A A . 31 TYR N 1 1 16 13978 1 1 31 TYR O O 3.565 2.280 -1.602 1.00 . A A . 31 TYR O 1 1 16 13979 1 1 31 TYR OH O -2.257 -1.759 3.558 1.00 . A A . 31 TYR OH 1 1 16 13980 1 1 32 HIS C C 6.331 0.702 0.470 1.00 . A A . 32 HIS C 1 1 16 13981 1 1 32 HIS CA C 5.678 2.045 0.173 1.00 . A A . 32 HIS CA 1 1 16 13982 1 1 32 HIS CB C 6.358 3.125 1.017 1.00 . A A . 32 HIS CB 1 1 16 13983 1 1 32 HIS CD2 C 6.503 5.338 -0.318 1.00 . A A . 32 HIS CD2 1 1 16 13984 1 1 32 HIS CE1 C 5.069 6.469 0.874 1.00 . A A . 32 HIS CE1 1 1 16 13985 1 1 32 HIS CG C 6.008 4.541 0.660 1.00 . A A . 32 HIS CG 1 1 16 13986 1 1 32 HIS H H 4.028 1.578 1.379 1.00 . A A . 32 HIS H 1 1 16 13987 1 1 32 HIS HA H 5.778 2.278 -0.876 1.00 . A A . 32 HIS HA 1 1 16 13988 1 1 32 HIS HB2 H 6.086 2.975 2.050 1.00 . A A . 32 HIS HB2 1 1 16 13989 1 1 32 HIS HB3 H 7.422 3.014 0.920 1.00 . A A . 32 HIS HB3 1 1 16 13990 1 1 32 HIS HD2 H 7.234 5.065 -1.065 1.00 . A A . 32 HIS HD2 1 1 16 13991 1 1 32 HIS HE1 H 4.450 7.274 1.241 1.00 . A A . 32 HIS HE1 1 1 16 13992 1 1 32 HIS HE2 H 5.880 7.278 -0.860 1.00 . A A . 32 HIS HE2 1 1 16 13993 1 1 32 HIS N N 4.268 1.932 0.498 1.00 . A A . 32 HIS N 1 1 16 13994 1 1 32 HIS ND1 N 5.110 5.261 1.401 1.00 . A A . 32 HIS ND1 1 1 16 13995 1 1 32 HIS NE2 N 5.900 6.566 -0.176 1.00 . A A . 32 HIS NE2 1 1 16 13996 1 1 32 HIS O O 5.700 -0.159 1.085 1.00 . A A . 32 HIS O 1 1 16 13997 1 1 33 ILE C C 8.777 -0.609 1.982 1.00 . A A . 33 ILE C 1 1 16 13998 1 1 33 ILE CA C 8.335 -0.663 0.521 1.00 . A A . 33 ILE CA 1 1 16 13999 1 1 33 ILE CB C 9.561 -0.909 -0.387 1.00 . A A . 33 ILE CB 1 1 16 14000 1 1 33 ILE CD1 C 11.828 0.164 -0.819 1.00 . A A . 33 ILE CD1 1 1 16 14001 1 1 33 ILE CG1 C 10.346 0.386 -0.620 1.00 . A A . 33 ILE CG1 1 1 16 14002 1 1 33 ILE CG2 C 9.122 -1.508 -1.710 1.00 . A A . 33 ILE CG2 1 1 16 14003 1 1 33 ILE H H 8.099 1.307 -0.252 1.00 . A A . 33 ILE H 1 1 16 14004 1 1 33 ILE HA H 7.655 -1.494 0.398 1.00 . A A . 33 ILE HA 1 1 16 14005 1 1 33 ILE HB H 10.203 -1.626 0.106 1.00 . A A . 33 ILE HB 1 1 16 14006 1 1 33 ILE HD11 H 11.992 -0.356 -1.752 1.00 . A A . 33 ILE HD11 1 1 16 14007 1 1 33 ILE HD12 H 12.334 1.118 -0.845 1.00 . A A . 33 ILE HD12 1 1 16 14008 1 1 33 ILE HD13 H 12.218 -0.429 -0.004 1.00 . A A . 33 ILE HD13 1 1 16 14009 1 1 33 ILE HG12 H 9.962 0.877 -1.502 1.00 . A A . 33 ILE HG12 1 1 16 14010 1 1 33 ILE HG21 H 9.852 -2.234 -2.036 1.00 . A A . 33 ILE HG21 1 1 16 14011 1 1 33 ILE HG22 H 8.163 -1.991 -1.587 1.00 . A A . 33 ILE HG22 1 1 16 14012 1 1 33 ILE HG23 H 9.038 -0.724 -2.447 1.00 . A A . 33 ILE HG23 1 1 16 14013 1 1 33 ILE N N 7.612 0.556 0.160 1.00 . A A . 33 ILE N 1 1 16 14014 1 1 33 ILE O O 9.969 -0.559 2.289 1.00 . A A . 33 ILE O 1 1 16 14015 1 1 34 HIS C C 6.728 -0.444 5.074 1.00 . A A . 34 HIS C 1 1 16 14016 1 1 34 HIS CA C 8.038 -0.401 4.303 1.00 . A A . 34 HIS CA 1 1 16 14017 1 1 34 HIS CB C 8.736 0.934 4.579 1.00 . A A . 34 HIS CB 1 1 16 14018 1 1 34 HIS CD2 C 10.322 -0.224 6.249 1.00 . A A . 34 HIS CD2 1 1 16 14019 1 1 34 HIS CE1 C 11.645 1.470 6.590 1.00 . A A . 34 HIS CE1 1 1 16 14020 1 1 34 HIS CG C 9.899 0.830 5.511 1.00 . A A . 34 HIS CG 1 1 16 14021 1 1 34 HIS H H 6.865 -0.556 2.546 1.00 . A A . 34 HIS H 1 1 16 14022 1 1 34 HIS HA H 8.672 -1.210 4.628 1.00 . A A . 34 HIS HA 1 1 16 14023 1 1 34 HIS HB2 H 9.099 1.340 3.647 1.00 . A A . 34 HIS HB2 1 1 16 14024 1 1 34 HIS HB3 H 8.023 1.623 5.010 1.00 . A A . 34 HIS HB3 1 1 16 14025 1 1 34 HIS HD2 H 9.875 -1.208 6.289 1.00 . A A . 34 HIS HD2 1 1 16 14026 1 1 34 HIS HE1 H 12.454 2.075 6.969 1.00 . A A . 34 HIS HE1 1 1 16 14027 1 1 34 HIS HE2 H 12.074 -0.396 7.398 1.00 . A A . 34 HIS HE2 1 1 16 14028 1 1 34 HIS N N 7.793 -0.548 2.872 1.00 . A A . 34 HIS N 1 1 16 14029 1 1 34 HIS ND1 N 10.736 1.897 5.729 1.00 . A A . 34 HIS ND1 1 1 16 14030 1 1 34 HIS NE2 N 11.433 0.191 6.933 1.00 . A A . 34 HIS NE2 1 1 16 14031 1 1 34 HIS O O 6.667 -0.939 6.200 1.00 . A A . 34 HIS O 1 1 16 14032 1 1 35 CYS C C 3.545 -0.794 5.130 1.00 . A A . 35 CYS C 1 1 16 14033 1 1 35 CYS CA C 4.456 0.436 5.183 1.00 . A A . 35 CYS CA 1 1 16 14034 1 1 35 CYS CB C 3.820 1.641 4.511 1.00 . A A . 35 CYS CB 1 1 16 14035 1 1 35 CYS H H 5.894 0.706 3.683 1.00 . A A . 35 CYS H 1 1 16 14036 1 1 35 CYS HA H 4.662 0.678 6.214 1.00 . A A . 35 CYS HA 1 1 16 14037 1 1 35 CYS HB2 H 3.197 1.312 3.691 1.00 . A A . 35 CYS HB2 1 1 16 14038 1 1 35 CYS HB3 H 3.226 2.189 5.227 1.00 . A A . 35 CYS HB3 1 1 16 14039 1 1 35 CYS N N 5.725 0.215 4.514 1.00 . A A . 35 CYS N 1 1 16 14040 1 1 35 CYS O O 2.323 -0.677 5.035 1.00 . A A . 35 CYS O 1 1 16 14041 1 1 35 CYS SG S 5.092 2.765 3.852 1.00 . A A . 35 CYS SG 1 1 16 14042 1 1 36 LEU C C 4.239 -4.200 6.227 1.00 . A A . 36 LEU C 1 1 16 14043 1 1 36 LEU CA C 3.395 -3.196 5.458 1.00 . A A . 36 LEU CA 1 1 16 14044 1 1 36 LEU CB C 2.987 -3.762 4.092 1.00 . A A . 36 LEU CB 1 1 16 14045 1 1 36 LEU CD1 C 4.231 -5.179 2.451 1.00 . A A . 36 LEU CD1 1 1 16 14046 1 1 36 LEU CD2 C 3.757 -2.797 1.914 1.00 . A A . 36 LEU CD2 1 1 16 14047 1 1 36 LEU CG C 4.082 -3.781 3.024 1.00 . A A . 36 LEU CG 1 1 16 14048 1 1 36 LEU H H 5.107 -1.969 5.495 1.00 . A A . 36 LEU H 1 1 16 14049 1 1 36 LEU HA H 2.503 -2.985 6.031 1.00 . A A . 36 LEU HA 1 1 16 14050 1 1 36 LEU HB2 H 2.642 -4.776 4.238 1.00 . A A . 36 LEU HB2 1 1 16 14051 1 1 36 LEU HB3 H 2.163 -3.175 3.716 1.00 . A A . 36 LEU HB3 1 1 16 14052 1 1 36 LEU HD11 H 4.951 -5.165 1.647 1.00 . A A . 36 LEU HD11 1 1 16 14053 1 1 36 LEU HD12 H 4.567 -5.854 3.226 1.00 . A A . 36 LEU HD12 1 1 16 14054 1 1 36 LEU HD13 H 3.275 -5.511 2.072 1.00 . A A . 36 LEU HD13 1 1 16 14055 1 1 36 LEU HD21 H 4.637 -2.220 1.674 1.00 . A A . 36 LEU HD21 1 1 16 14056 1 1 36 LEU HD22 H 3.432 -3.341 1.037 1.00 . A A . 36 LEU HD22 1 1 16 14057 1 1 36 LEU HD23 H 2.968 -2.134 2.240 1.00 . A A . 36 LEU HD23 1 1 16 14058 1 1 36 LEU HG H 5.023 -3.493 3.471 1.00 . A A . 36 LEU HG 1 1 16 14059 1 1 36 LEU N N 4.139 -1.956 5.325 1.00 . A A . 36 LEU N 1 1 16 14060 1 1 36 LEU O O 5.443 -3.988 6.406 1.00 . A A . 36 LEU O 1 1 16 14061 1 1 37 ARG C C 5.387 -6.933 6.858 1.00 . A A . 37 ARG C 1 1 16 14062 1 1 37 ARG CA C 4.275 -6.200 7.621 1.00 . A A . 37 ARG CA 1 1 16 14063 1 1 37 ARG CB C 3.270 -7.192 8.223 1.00 . A A . 37 ARG CB 1 1 16 14064 1 1 37 ARG CD C 2.898 -5.288 9.847 1.00 . A A . 37 ARG CD 1 1 16 14065 1 1 37 ARG CG C 2.707 -6.773 9.578 1.00 . A A . 37 ARG CG 1 1 16 14066 1 1 37 ARG CZ C 1.618 -3.190 9.673 1.00 . A A . 37 ARG CZ 1 1 16 14067 1 1 37 ARG H H 2.616 -5.288 6.655 1.00 . A A . 37 ARG H 1 1 16 14068 1 1 37 ARG HA H 4.735 -5.647 8.428 1.00 . A A . 37 ARG HA 1 1 16 14069 1 1 37 ARG HB2 H 2.444 -7.307 7.538 1.00 . A A . 37 ARG HB2 1 1 16 14070 1 1 37 ARG HB3 H 3.758 -8.149 8.344 1.00 . A A . 37 ARG HB3 1 1 16 14071 1 1 37 ARG HD2 H 3.064 -5.146 10.904 1.00 . A A . 37 ARG HD2 1 1 16 14072 1 1 37 ARG HD3 H 3.764 -4.946 9.300 1.00 . A A . 37 ARG HD3 1 1 16 14073 1 1 37 ARG HE H 1.001 -4.969 8.993 1.00 . A A . 37 ARG HE 1 1 16 14074 1 1 37 ARG HG2 H 1.652 -6.998 9.603 1.00 . A A . 37 ARG HG2 1 1 16 14075 1 1 37 ARG HG3 H 3.212 -7.333 10.351 1.00 . A A . 37 ARG HG3 1 1 16 14076 1 1 37 ARG HH11 H 3.479 -2.985 10.453 1.00 . A A . 37 ARG HH11 1 1 16 14077 1 1 37 ARG HH12 H 2.532 -1.525 10.390 1.00 . A A . 37 ARG HH12 1 1 16 14078 1 1 37 ARG HH21 H -0.251 -3.064 8.906 1.00 . A A . 37 ARG HH21 1 1 16 14079 1 1 37 ARG HH22 H 0.400 -1.575 9.536 1.00 . A A . 37 ARG HH22 1 1 16 14080 1 1 37 ARG N N 3.593 -5.224 6.770 1.00 . A A . 37 ARG N 1 1 16 14081 1 1 37 ARG NE N 1.739 -4.495 9.440 1.00 . A A . 37 ARG NE 1 1 16 14082 1 1 37 ARG NH1 N 2.621 -2.513 10.213 1.00 . A A . 37 ARG NH1 1 1 16 14083 1 1 37 ARG NH2 N 0.505 -2.558 9.337 1.00 . A A . 37 ARG NH2 1 1 16 14084 1 1 37 ARG O O 6.553 -6.836 7.238 1.00 . A A . 37 ARG O 1 1 16 14085 1 1 38 PRO C C 6.786 -7.308 3.988 1.00 . A A . 38 PRO C 1 1 16 14086 1 1 38 PRO CA C 6.091 -8.292 4.928 1.00 . A A . 38 PRO CA 1 1 16 14087 1 1 38 PRO CB C 5.292 -9.336 4.127 1.00 . A A . 38 PRO CB 1 1 16 14088 1 1 38 PRO CD C 3.751 -7.794 5.147 1.00 . A A . 38 PRO CD 1 1 16 14089 1 1 38 PRO CG C 3.854 -9.148 4.508 1.00 . A A . 38 PRO CG 1 1 16 14090 1 1 38 PRO HA H 6.829 -8.786 5.542 1.00 . A A . 38 PRO HA 1 1 16 14091 1 1 38 PRO HB2 H 5.442 -9.167 3.070 1.00 . A A . 38 PRO HB2 1 1 16 14092 1 1 38 PRO HB3 H 5.640 -10.325 4.386 1.00 . A A . 38 PRO HB3 1 1 16 14093 1 1 38 PRO HD2 H 3.555 -7.035 4.403 1.00 . A A . 38 PRO HD2 1 1 16 14094 1 1 38 PRO HD3 H 2.984 -7.791 5.907 1.00 . A A . 38 PRO HD3 1 1 16 14095 1 1 38 PRO HG2 H 3.234 -9.189 3.624 1.00 . A A . 38 PRO HG2 1 1 16 14096 1 1 38 PRO HG3 H 3.558 -9.916 5.208 1.00 . A A . 38 PRO HG3 1 1 16 14097 1 1 38 PRO N N 5.077 -7.625 5.741 1.00 . A A . 38 PRO N 1 1 16 14098 1 1 38 PRO O O 6.700 -7.433 2.763 1.00 . A A . 38 PRO O 1 1 16 14099 1 1 39 ALA C C 9.173 -5.744 2.973 1.00 . A A . 39 ALA C 1 1 16 14100 1 1 39 ALA CA C 8.024 -5.212 3.816 1.00 . A A . 39 ALA CA 1 1 16 14101 1 1 39 ALA CB C 8.517 -4.119 4.753 1.00 . A A . 39 ALA CB 1 1 16 14102 1 1 39 ALA H H 7.362 -6.215 5.557 1.00 . A A . 39 ALA H 1 1 16 14103 1 1 39 ALA HA H 7.282 -4.779 3.160 1.00 . A A . 39 ALA HA 1 1 16 14104 1 1 39 ALA HB1 H 7.692 -3.476 5.022 1.00 . A A . 39 ALA HB1 1 1 16 14105 1 1 39 ALA HB2 H 8.930 -4.568 5.644 1.00 . A A . 39 ALA HB2 1 1 16 14106 1 1 39 ALA HB3 H 9.280 -3.536 4.258 1.00 . A A . 39 ALA HB3 1 1 16 14107 1 1 39 ALA N N 7.387 -6.279 4.576 1.00 . A A . 39 ALA N 1 1 16 14108 1 1 39 ALA O O 9.940 -6.602 3.415 1.00 . A A . 39 ALA O 1 1 16 14109 1 1 40 LEU C C 11.402 -4.544 0.762 1.00 . A A . 40 LEU C 1 1 16 14110 1 1 40 LEU CA C 10.343 -5.632 0.848 1.00 . A A . 40 LEU CA 1 1 16 14111 1 1 40 LEU CB C 9.775 -5.909 -0.549 1.00 . A A . 40 LEU CB 1 1 16 14112 1 1 40 LEU CD1 C 7.318 -5.959 -1.034 1.00 . A A . 40 LEU CD1 1 1 16 14113 1 1 40 LEU CD2 C 8.728 -7.971 -1.500 1.00 . A A . 40 LEU CD2 1 1 16 14114 1 1 40 LEU CG C 8.518 -6.778 -0.582 1.00 . A A . 40 LEU CG 1 1 16 14115 1 1 40 LEU H H 8.647 -4.547 1.472 1.00 . A A . 40 LEU H 1 1 16 14116 1 1 40 LEU HA H 10.794 -6.534 1.233 1.00 . A A . 40 LEU HA 1 1 16 14117 1 1 40 LEU HB2 H 9.543 -4.962 -1.012 1.00 . A A . 40 LEU HB2 1 1 16 14118 1 1 40 LEU HB3 H 10.538 -6.399 -1.133 1.00 . A A . 40 LEU HB3 1 1 16 14119 1 1 40 LEU HD11 H 6.437 -6.585 -1.042 1.00 . A A . 40 LEU HD11 1 1 16 14120 1 1 40 LEU HD12 H 7.168 -5.134 -0.353 1.00 . A A . 40 LEU HD12 1 1 16 14121 1 1 40 LEU HD13 H 7.496 -5.576 -2.028 1.00 . A A . 40 LEU HD13 1 1 16 14122 1 1 40 LEU HD21 H 8.066 -7.893 -2.351 1.00 . A A . 40 LEU HD21 1 1 16 14123 1 1 40 LEU HD22 H 9.752 -7.989 -1.839 1.00 . A A . 40 LEU HD22 1 1 16 14124 1 1 40 LEU HD23 H 8.512 -8.882 -0.959 1.00 . A A . 40 LEU HD23 1 1 16 14125 1 1 40 LEU HG H 8.315 -7.148 0.411 1.00 . A A . 40 LEU HG 1 1 16 14126 1 1 40 LEU N N 9.286 -5.229 1.760 1.00 . A A . 40 LEU N 1 1 16 14127 1 1 40 LEU O O 11.163 -3.404 1.165 1.00 . A A . 40 LEU O 1 1 16 14128 1 1 41 TYR C C 13.561 -3.417 -1.472 1.00 . A A . 41 TYR C 1 1 16 14129 1 1 41 TYR CA C 13.603 -3.912 -0.032 1.00 . A A . 41 TYR CA 1 1 16 14130 1 1 41 TYR CB C 14.973 -4.532 0.275 1.00 . A A . 41 TYR CB 1 1 16 14131 1 1 41 TYR CD1 C 14.521 -4.340 2.759 1.00 . A A . 41 TYR CD1 1 1 16 14132 1 1 41 TYR CD2 C 16.780 -4.196 2.011 1.00 . A A . 41 TYR CD2 1 1 16 14133 1 1 41 TYR CE1 C 14.939 -4.179 4.065 1.00 . A A . 41 TYR CE1 1 1 16 14134 1 1 41 TYR CE2 C 17.206 -4.034 3.316 1.00 . A A . 41 TYR CE2 1 1 16 14135 1 1 41 TYR CG C 15.431 -4.353 1.709 1.00 . A A . 41 TYR CG 1 1 16 14136 1 1 41 TYR CZ C 16.283 -4.028 4.339 1.00 . A A . 41 TYR CZ 1 1 16 14137 1 1 41 TYR H H 12.647 -5.795 -0.166 1.00 . A A . 41 TYR H 1 1 16 14138 1 1 41 TYR HA H 13.434 -3.076 0.631 1.00 . A A . 41 TYR HA 1 1 16 14139 1 1 41 TYR HB2 H 14.928 -5.592 0.076 1.00 . A A . 41 TYR HB2 1 1 16 14140 1 1 41 TYR HB3 H 15.715 -4.083 -0.368 1.00 . A A . 41 TYR HB3 1 1 16 14141 1 1 41 TYR HD1 H 13.471 -4.464 2.543 1.00 . A A . 41 TYR HD1 1 1 16 14142 1 1 41 TYR HD2 H 17.502 -4.197 1.208 1.00 . A A . 41 TYR HD2 1 1 16 14143 1 1 41 TYR HE1 H 14.214 -4.168 4.866 1.00 . A A . 41 TYR HE1 1 1 16 14144 1 1 41 TYR HE2 H 18.258 -3.920 3.531 1.00 . A A . 41 TYR HE2 1 1 16 14145 1 1 41 TYR HH H 15.947 -3.940 6.244 1.00 . A A . 41 TYR HH 1 1 16 14146 1 1 41 TYR N N 12.541 -4.880 0.185 1.00 . A A . 41 TYR N 1 1 16 14147 1 1 41 TYR O O 14.000 -2.311 -1.779 1.00 . A A . 41 TYR O 1 1 16 14148 1 1 41 TYR OH O 16.707 -3.870 5.643 1.00 . A A . 41 TYR OH 1 1 16 14149 1 1 42 GLU C C 11.440 -3.450 -4.055 1.00 . A A . 42 GLU C 1 1 16 14150 1 1 42 GLU CA C 12.868 -3.887 -3.750 1.00 . A A . 42 GLU CA 1 1 16 14151 1 1 42 GLU CB C 13.264 -5.067 -4.638 1.00 . A A . 42 GLU CB 1 1 16 14152 1 1 42 GLU CD C 15.413 -6.344 -4.274 1.00 . A A . 42 GLU CD 1 1 16 14153 1 1 42 GLU CG C 14.756 -5.142 -4.919 1.00 . A A . 42 GLU CG 1 1 16 14154 1 1 42 GLU H H 12.658 -5.106 -2.039 1.00 . A A . 42 GLU H 1 1 16 14155 1 1 42 GLU HA H 13.534 -3.058 -3.947 1.00 . A A . 42 GLU HA 1 1 16 14156 1 1 42 GLU HB2 H 12.965 -5.984 -4.153 1.00 . A A . 42 GLU HB2 1 1 16 14157 1 1 42 GLU HB3 H 12.746 -4.983 -5.581 1.00 . A A . 42 GLU HB3 1 1 16 14158 1 1 42 GLU HG2 H 14.905 -5.202 -5.987 1.00 . A A . 42 GLU HG2 1 1 16 14159 1 1 42 GLU HG3 H 15.226 -4.247 -4.541 1.00 . A A . 42 GLU HG3 1 1 16 14160 1 1 42 GLU N N 13.003 -4.240 -2.348 1.00 . A A . 42 GLU N 1 1 16 14161 1 1 42 GLU O O 10.476 -4.080 -3.611 1.00 . A A . 42 GLU O 1 1 16 14162 1 1 42 GLU OE1 O 14.772 -7.411 -4.195 1.00 . A A . 42 GLU OE1 1 1 16 14163 1 1 42 GLU OE2 O 16.585 -6.232 -3.858 1.00 . A A . 42 GLU OE2 1 1 16 14164 1 1 43 VAL C C 9.345 -2.632 -6.237 1.00 . A A . 43 VAL C 1 1 16 14165 1 1 43 VAL CA C 10.016 -1.805 -5.147 1.00 . A A . 43 VAL CA 1 1 16 14166 1 1 43 VAL CB C 10.137 -0.342 -5.629 1.00 . A A . 43 VAL CB 1 1 16 14167 1 1 43 VAL CG1 C 8.781 0.342 -5.627 1.00 . A A . 43 VAL CG1 1 1 16 14168 1 1 43 VAL CG2 C 11.125 0.431 -4.768 1.00 . A A . 43 VAL CG2 1 1 16 14169 1 1 43 VAL H H 12.129 -1.909 -5.121 1.00 . A A . 43 VAL H 1 1 16 14170 1 1 43 VAL HA H 9.397 -1.822 -4.263 1.00 . A A . 43 VAL HA 1 1 16 14171 1 1 43 VAL HB H 10.509 -0.352 -6.643 1.00 . A A . 43 VAL HB 1 1 16 14172 1 1 43 VAL HG11 H 8.848 1.273 -5.082 1.00 . A A . 43 VAL HG11 1 1 16 14173 1 1 43 VAL HG12 H 8.478 0.543 -6.646 1.00 . A A . 43 VAL HG12 1 1 16 14174 1 1 43 VAL HG13 H 8.054 -0.301 -5.155 1.00 . A A . 43 VAL HG13 1 1 16 14175 1 1 43 VAL HG21 H 12.088 -0.056 -4.798 1.00 . A A . 43 VAL HG21 1 1 16 14176 1 1 43 VAL HG22 H 11.219 1.439 -5.145 1.00 . A A . 43 VAL HG22 1 1 16 14177 1 1 43 VAL HG23 H 10.767 0.461 -3.749 1.00 . A A . 43 VAL HG23 1 1 16 14178 1 1 43 VAL N N 11.315 -2.359 -4.797 1.00 . A A . 43 VAL N 1 1 16 14179 1 1 43 VAL O O 9.936 -2.885 -7.284 1.00 . A A . 43 VAL O 1 1 16 14180 1 1 44 PRO C C 6.797 -3.093 -8.087 1.00 . A A . 44 PRO C 1 1 16 14181 1 1 44 PRO CA C 7.360 -3.917 -6.931 1.00 . A A . 44 PRO CA 1 1 16 14182 1 1 44 PRO CB C 6.216 -4.500 -6.087 1.00 . A A . 44 PRO CB 1 1 16 14183 1 1 44 PRO CD C 7.378 -2.906 -4.734 1.00 . A A . 44 PRO CD 1 1 16 14184 1 1 44 PRO CG C 6.523 -4.135 -4.671 1.00 . A A . 44 PRO CG 1 1 16 14185 1 1 44 PRO HA H 7.965 -4.721 -7.325 1.00 . A A . 44 PRO HA 1 1 16 14186 1 1 44 PRO HB2 H 5.280 -4.067 -6.407 1.00 . A A . 44 PRO HB2 1 1 16 14187 1 1 44 PRO HB3 H 6.181 -5.572 -6.217 1.00 . A A . 44 PRO HB3 1 1 16 14188 1 1 44 PRO HD2 H 6.766 -2.017 -4.778 1.00 . A A . 44 PRO HD2 1 1 16 14189 1 1 44 PRO HD3 H 8.051 -2.866 -3.890 1.00 . A A . 44 PRO HD3 1 1 16 14190 1 1 44 PRO HG2 H 5.606 -3.927 -4.140 1.00 . A A . 44 PRO HG2 1 1 16 14191 1 1 44 PRO HG3 H 7.059 -4.943 -4.193 1.00 . A A . 44 PRO HG3 1 1 16 14192 1 1 44 PRO N N 8.116 -3.099 -5.982 1.00 . A A . 44 PRO N 1 1 16 14193 1 1 44 PRO O O 6.894 -1.862 -8.090 1.00 . A A . 44 PRO O 1 1 16 14194 1 1 45 ASP C C 4.246 -2.548 -9.907 1.00 . A A . 45 ASP C 1 1 16 14195 1 1 45 ASP CA C 5.634 -3.110 -10.228 1.00 . A A . 45 ASP CA 1 1 16 14196 1 1 45 ASP CB C 5.546 -4.098 -11.402 1.00 . A A . 45 ASP CB 1 1 16 14197 1 1 45 ASP CG C 5.509 -3.417 -12.762 1.00 . A A . 45 ASP CG 1 1 16 14198 1 1 45 ASP H H 6.157 -4.752 -8.994 1.00 . A A . 45 ASP H 1 1 16 14199 1 1 45 ASP HA H 6.287 -2.295 -10.500 1.00 . A A . 45 ASP HA 1 1 16 14200 1 1 45 ASP HB2 H 6.405 -4.752 -11.375 1.00 . A A . 45 ASP HB2 1 1 16 14201 1 1 45 ASP HB3 H 4.649 -4.690 -11.294 1.00 . A A . 45 ASP HB3 1 1 16 14202 1 1 45 ASP N N 6.209 -3.774 -9.061 1.00 . A A . 45 ASP N 1 1 16 14203 1 1 45 ASP O O 3.768 -2.650 -8.775 1.00 . A A . 45 ASP O 1 1 16 14204 1 1 45 ASP OD1 O 5.554 -2.176 -12.818 1.00 . A A . 45 ASP OD1 1 1 16 14205 1 1 45 ASP OD2 O 5.421 -4.131 -13.787 1.00 . A A . 45 ASP OD2 1 1 16 14206 1 1 46 GLY C C 1.256 -2.503 -10.439 1.00 . A A . 46 GLY C 1 1 16 14207 1 1 46 GLY CA C 2.272 -1.421 -10.741 1.00 . A A . 46 GLY CA 1 1 16 14208 1 1 46 GLY H H 4.049 -1.909 -11.791 1.00 . A A . 46 GLY H 1 1 16 14209 1 1 46 GLY HA2 H 2.284 -0.712 -9.925 1.00 . A A . 46 GLY HA2 1 1 16 14210 1 1 46 GLY HA3 H 1.982 -0.909 -11.647 1.00 . A A . 46 GLY HA3 1 1 16 14211 1 1 46 GLY N N 3.607 -1.964 -10.912 1.00 . A A . 46 GLY N 1 1 16 14212 1 1 46 GLY O O 0.419 -2.351 -9.546 1.00 . A A . 46 GLY O 1 1 16 14213 1 1 47 GLU C C 0.994 -5.486 -9.591 1.00 . A A . 47 GLU C 1 1 16 14214 1 1 47 GLU CA C 0.548 -4.792 -10.870 1.00 . A A . 47 GLU CA 1 1 16 14215 1 1 47 GLU CB C 0.614 -5.766 -12.044 1.00 . A A . 47 GLU CB 1 1 16 14216 1 1 47 GLU CD C -0.897 -6.770 -13.789 1.00 . A A . 47 GLU CD 1 1 16 14217 1 1 47 GLU CG C -0.433 -5.502 -13.110 1.00 . A A . 47 GLU CG 1 1 16 14218 1 1 47 GLU H H 2.119 -3.708 -11.773 1.00 . A A . 47 GLU H 1 1 16 14219 1 1 47 GLU HA H -0.469 -4.448 -10.750 1.00 . A A . 47 GLU HA 1 1 16 14220 1 1 47 GLU HB2 H 1.589 -5.697 -12.502 1.00 . A A . 47 GLU HB2 1 1 16 14221 1 1 47 GLU HB3 H 0.471 -6.771 -11.671 1.00 . A A . 47 GLU HB3 1 1 16 14222 1 1 47 GLU HG2 H -1.285 -5.026 -12.649 1.00 . A A . 47 GLU HG2 1 1 16 14223 1 1 47 GLU HG3 H -0.011 -4.843 -13.855 1.00 . A A . 47 GLU HG3 1 1 16 14224 1 1 47 GLU N N 1.391 -3.633 -11.123 1.00 . A A . 47 GLU N 1 1 16 14225 1 1 47 GLU O O 1.868 -6.352 -9.615 1.00 . A A . 47 GLU O 1 1 16 14226 1 1 47 GLU OE1 O -1.653 -7.546 -13.163 1.00 . A A . 47 GLU OE1 1 1 16 14227 1 1 47 GLU OE2 O -0.510 -7.002 -14.953 1.00 . A A . 47 GLU OE2 1 1 16 14228 1 1 48 TRP C C -0.244 -5.833 -6.292 1.00 . A A . 48 TRP C 1 1 16 14229 1 1 48 TRP CA C 0.943 -5.485 -7.177 1.00 . A A . 48 TRP CA 1 1 16 14230 1 1 48 TRP CB C 1.810 -4.421 -6.498 1.00 . A A . 48 TRP CB 1 1 16 14231 1 1 48 TRP CD1 C 3.288 -5.855 -4.974 1.00 . A A . 48 TRP CD1 1 1 16 14232 1 1 48 TRP CD2 C 2.097 -4.296 -3.899 1.00 . A A . 48 TRP CD2 1 1 16 14233 1 1 48 TRP CE2 C 2.864 -5.004 -2.953 1.00 . A A . 48 TRP CE2 1 1 16 14234 1 1 48 TRP CE3 C 1.264 -3.266 -3.455 1.00 . A A . 48 TRP CE3 1 1 16 14235 1 1 48 TRP CG C 2.387 -4.854 -5.185 1.00 . A A . 48 TRP CG 1 1 16 14236 1 1 48 TRP CH2 C 1.997 -3.695 -1.189 1.00 . A A . 48 TRP CH2 1 1 16 14237 1 1 48 TRP CZ2 C 2.822 -4.709 -1.592 1.00 . A A . 48 TRP CZ2 1 1 16 14238 1 1 48 TRP CZ3 C 1.222 -2.977 -2.107 1.00 . A A . 48 TRP CZ3 1 1 16 14239 1 1 48 TRP H H -0.102 -4.228 -8.509 1.00 . A A . 48 TRP H 1 1 16 14240 1 1 48 TRP HA H 1.537 -6.373 -7.337 1.00 . A A . 48 TRP HA 1 1 16 14241 1 1 48 TRP HB2 H 2.628 -4.165 -7.155 1.00 . A A . 48 TRP HB2 1 1 16 14242 1 1 48 TRP HB3 H 1.210 -3.540 -6.324 1.00 . A A . 48 TRP HB3 1 1 16 14243 1 1 48 TRP HD1 H 3.703 -6.472 -5.755 1.00 . A A . 48 TRP HD1 1 1 16 14244 1 1 48 TRP HE1 H 4.212 -6.593 -3.236 1.00 . A A . 48 TRP HE1 1 1 16 14245 1 1 48 TRP HE3 H 0.656 -2.701 -4.150 1.00 . A A . 48 TRP HE3 1 1 16 14246 1 1 48 TRP HH2 H 1.931 -3.435 -0.143 1.00 . A A . 48 TRP HH2 1 1 16 14247 1 1 48 TRP HZ2 H 3.414 -5.251 -0.870 1.00 . A A . 48 TRP HZ2 1 1 16 14248 1 1 48 TRP HZ3 H 0.583 -2.185 -1.746 1.00 . A A . 48 TRP HZ3 1 1 16 14249 1 1 48 TRP N N 0.501 -5.001 -8.470 1.00 . A A . 48 TRP N 1 1 16 14250 1 1 48 TRP NE1 N 3.585 -5.949 -3.637 1.00 . A A . 48 TRP NE1 1 1 16 14251 1 1 48 TRP O O -1.257 -5.132 -6.294 1.00 . A A . 48 TRP O 1 1 16 14252 1 1 49 GLN C C -0.462 -7.239 -3.141 1.00 . A A . 49 GLN C 1 1 16 14253 1 1 49 GLN CA C -1.083 -7.272 -4.530 1.00 . A A . 49 GLN CA 1 1 16 14254 1 1 49 GLN CB C -1.633 -8.673 -4.842 1.00 . A A . 49 GLN CB 1 1 16 14255 1 1 49 GLN CD C -3.769 -8.903 -3.492 1.00 . A A . 49 GLN CD 1 1 16 14256 1 1 49 GLN CG C -2.328 -9.346 -3.662 1.00 . A A . 49 GLN CG 1 1 16 14257 1 1 49 GLN H H 0.769 -7.372 -5.532 1.00 . A A . 49 GLN H 1 1 16 14258 1 1 49 GLN HA H -1.889 -6.553 -4.573 1.00 . A A . 49 GLN HA 1 1 16 14259 1 1 49 GLN HB2 H -2.344 -8.593 -5.650 1.00 . A A . 49 GLN HB2 1 1 16 14260 1 1 49 GLN HB3 H -0.814 -9.304 -5.156 1.00 . A A . 49 GLN HB3 1 1 16 14261 1 1 49 GLN HE21 H -3.233 -7.595 -2.094 1.00 . A A . 49 GLN HE21 1 1 16 14262 1 1 49 GLN HE22 H -4.920 -7.644 -2.475 1.00 . A A . 49 GLN HE22 1 1 16 14263 1 1 49 GLN HG2 H -2.315 -10.414 -3.814 1.00 . A A . 49 GLN HG2 1 1 16 14264 1 1 49 GLN HG3 H -1.787 -9.107 -2.759 1.00 . A A . 49 GLN HG3 1 1 16 14265 1 1 49 GLN N N -0.084 -6.883 -5.504 1.00 . A A . 49 GLN N 1 1 16 14266 1 1 49 GLN NE2 N -3.998 -7.954 -2.598 1.00 . A A . 49 GLN NE2 1 1 16 14267 1 1 49 GLN O O 0.590 -7.842 -2.908 1.00 . A A . 49 GLN O 1 1 16 14268 1 1 49 GLN OE1 O -4.672 -9.418 -4.150 1.00 . A A . 49 GLN OE1 1 1 16 14269 1 1 50 CYS C C -0.684 -7.683 -0.153 1.00 . A A . 50 CYS C 1 1 16 14270 1 1 50 CYS CA C -0.601 -6.348 -0.887 1.00 . A A . 50 CYS CA 1 1 16 14271 1 1 50 CYS CB C -1.461 -5.311 -0.169 1.00 . A A . 50 CYS CB 1 1 16 14272 1 1 50 CYS H H -1.886 -5.991 -2.516 1.00 . A A . 50 CYS H 1 1 16 14273 1 1 50 CYS HA H 0.423 -6.014 -0.913 1.00 . A A . 50 CYS HA 1 1 16 14274 1 1 50 CYS HB2 H -1.276 -5.369 0.894 1.00 . A A . 50 CYS HB2 1 1 16 14275 1 1 50 CYS HB3 H -1.200 -4.323 -0.524 1.00 . A A . 50 CYS HB3 1 1 16 14276 1 1 50 CYS N N -1.084 -6.487 -2.247 1.00 . A A . 50 CYS N 1 1 16 14277 1 1 50 CYS O O -1.399 -8.590 -0.595 1.00 . A A . 50 CYS O 1 1 16 14278 1 1 50 CYS SG S -3.246 -5.549 -0.441 1.00 . A A . 50 CYS SG 1 1 16 14279 1 1 51 PRO C C -1.649 -9.278 2.116 1.00 . A A . 51 PRO C 1 1 16 14280 1 1 51 PRO CA C -0.172 -8.983 1.875 1.00 . A A . 51 PRO CA 1 1 16 14281 1 1 51 PRO CB C 0.523 -8.583 3.186 1.00 . A A . 51 PRO CB 1 1 16 14282 1 1 51 PRO CD C 0.817 -6.774 1.644 1.00 . A A . 51 PRO CD 1 1 16 14283 1 1 51 PRO CG C 0.723 -7.102 3.103 1.00 . A A . 51 PRO CG 1 1 16 14284 1 1 51 PRO HA H 0.308 -9.847 1.447 1.00 . A A . 51 PRO HA 1 1 16 14285 1 1 51 PRO HB2 H -0.108 -8.847 4.022 1.00 . A A . 51 PRO HB2 1 1 16 14286 1 1 51 PRO HB3 H 1.466 -9.103 3.266 1.00 . A A . 51 PRO HB3 1 1 16 14287 1 1 51 PRO HD2 H 0.429 -5.784 1.452 1.00 . A A . 51 PRO HD2 1 1 16 14288 1 1 51 PRO HD3 H 1.837 -6.855 1.301 1.00 . A A . 51 PRO HD3 1 1 16 14289 1 1 51 PRO HG2 H -0.119 -6.592 3.546 1.00 . A A . 51 PRO HG2 1 1 16 14290 1 1 51 PRO HG3 H 1.638 -6.825 3.607 1.00 . A A . 51 PRO HG3 1 1 16 14291 1 1 51 PRO N N -0.030 -7.802 1.021 1.00 . A A . 51 PRO N 1 1 16 14292 1 1 51 PRO O O -2.160 -10.333 1.734 1.00 . A A . 51 PRO O 1 1 16 14293 1 1 52 ARG C C -4.223 -6.867 3.186 1.00 . A A . 52 ARG C 1 1 16 14294 1 1 52 ARG CA C -3.797 -8.215 2.633 1.00 . A A . 52 ARG CA 1 1 16 14295 1 1 52 ARG CB C -4.324 -9.350 3.522 1.00 . A A . 52 ARG CB 1 1 16 14296 1 1 52 ARG CD C -5.477 -9.995 1.373 1.00 . A A . 52 ARG CD 1 1 16 14297 1 1 52 ARG CG C -5.468 -10.134 2.891 1.00 . A A . 52 ARG CG 1 1 16 14298 1 1 52 ARG CZ C -7.176 -10.373 -0.377 1.00 . A A . 52 ARG CZ 1 1 16 14299 1 1 52 ARG H H -1.869 -7.389 2.672 1.00 . A A . 52 ARG H 1 1 16 14300 1 1 52 ARG HA H -4.197 -8.325 1.635 1.00 . A A . 52 ARG HA 1 1 16 14301 1 1 52 ARG HB2 H -3.517 -10.036 3.731 1.00 . A A . 52 ARG HB2 1 1 16 14302 1 1 52 ARG HB3 H -4.677 -8.928 4.454 1.00 . A A . 52 ARG HB3 1 1 16 14303 1 1 52 ARG HD2 H -5.576 -8.949 1.122 1.00 . A A . 52 ARG HD2 1 1 16 14304 1 1 52 ARG HD3 H -4.541 -10.369 0.986 1.00 . A A . 52 ARG HD3 1 1 16 14305 1 1 52 ARG HE H -6.877 -11.557 1.211 1.00 . A A . 52 ARG HE 1 1 16 14306 1 1 52 ARG HG2 H -5.363 -11.177 3.147 1.00 . A A . 52 ARG HG2 1 1 16 14307 1 1 52 ARG HG3 H -6.403 -9.761 3.282 1.00 . A A . 52 ARG HG3 1 1 16 14308 1 1 52 ARG HH11 H -6.111 -8.662 -0.614 1.00 . A A . 52 ARG HH11 1 1 16 14309 1 1 52 ARG HH12 H -7.290 -8.974 -1.847 1.00 . A A . 52 ARG HH12 1 1 16 14310 1 1 52 ARG HH21 H -8.430 -11.969 -0.413 1.00 . A A . 52 ARG HH21 1 1 16 14311 1 1 52 ARG HH22 H -8.597 -10.859 -1.743 1.00 . A A . 52 ARG HH22 1 1 16 14312 1 1 52 ARG N N -2.346 -8.232 2.539 1.00 . A A . 52 ARG N 1 1 16 14313 1 1 52 ARG NE N -6.575 -10.734 0.757 1.00 . A A . 52 ARG NE 1 1 16 14314 1 1 52 ARG NH1 N -6.829 -9.248 -0.995 1.00 . A A . 52 ARG NH1 1 1 16 14315 1 1 52 ARG NH2 N -8.145 -11.126 -0.881 1.00 . A A . 52 ARG NH2 1 1 16 14316 1 1 52 ARG O O -5.171 -6.778 3.967 1.00 . A A . 52 ARG O 1 1 16 14317 1 1 53 CYS C C -3.806 -4.499 4.830 1.00 . A A . 53 CYS C 1 1 16 14318 1 1 53 CYS CA C -3.636 -4.482 3.311 1.00 . A A . 53 CYS CA 1 1 16 14319 1 1 53 CYS CB C -4.812 -3.807 2.618 1.00 . A A . 53 CYS CB 1 1 16 14320 1 1 53 CYS H H -2.755 -5.993 2.150 1.00 . A A . 53 CYS H 1 1 16 14321 1 1 53 CYS HA H -2.735 -3.931 3.076 1.00 . A A . 53 CYS HA 1 1 16 14322 1 1 53 CYS HB2 H -5.362 -4.554 2.068 1.00 . A A . 53 CYS HB2 1 1 16 14323 1 1 53 CYS HB3 H -5.455 -3.358 3.361 1.00 . A A . 53 CYS HB3 1 1 16 14324 1 1 53 CYS N N -3.462 -5.833 2.803 1.00 . A A . 53 CYS N 1 1 16 14325 1 1 53 CYS O O -4.834 -4.082 5.371 1.00 . A A . 53 CYS O 1 1 16 14326 1 1 53 CYS SG S -4.313 -2.506 1.443 1.00 . A A . 53 CYS SG 1 1 16 14327 1 1 54 THR C C -2.468 -4.176 7.723 1.00 . A A . 54 THR C 1 1 16 14328 1 1 54 THR CA C -2.918 -5.387 6.905 1.00 . A A . 54 THR CA 1 1 16 14329 1 1 54 THR CB C -2.038 -6.596 7.254 1.00 . A A . 54 THR CB 1 1 16 14330 1 1 54 THR CG2 C -2.890 -7.806 7.604 1.00 . A A . 54 THR CG2 1 1 16 14331 1 1 54 THR H H -2.124 -5.555 4.970 1.00 . A A . 54 THR H 1 1 16 14332 1 1 54 THR HA H -3.939 -5.626 7.155 1.00 . A A . 54 THR HA 1 1 16 14333 1 1 54 THR HB H -1.420 -6.347 8.103 1.00 . A A . 54 THR HB 1 1 16 14334 1 1 54 THR HG1 H -0.602 -7.642 6.360 1.00 . A A . 54 THR HG1 1 1 16 14335 1 1 54 THR HG21 H -3.143 -7.778 8.653 1.00 . A A . 54 THR HG21 1 1 16 14336 1 1 54 THR HG22 H -2.337 -8.710 7.390 1.00 . A A . 54 THR HG22 1 1 16 14337 1 1 54 THR HG23 H -3.796 -7.793 7.015 1.00 . A A . 54 THR HG23 1 1 16 14338 1 1 54 THR N N -2.850 -5.136 5.482 1.00 . A A . 54 THR N 1 1 16 14339 1 1 54 THR O O -1.470 -4.240 8.445 1.00 . A A . 54 THR O 1 1 16 14340 1 1 54 THR OG1 O -1.196 -6.906 6.130 1.00 . A A . 54 THR OG1 1 1 16 14341 1 1 55 CYS C C -3.162 -2.232 9.968 1.00 . A A . 55 CYS C 1 1 16 14342 1 1 55 CYS CA C -2.964 -1.919 8.476 1.00 . A A . 55 CYS CA 1 1 16 14343 1 1 55 CYS CB C -3.846 -0.747 8.038 1.00 . A A . 55 CYS CB 1 1 16 14344 1 1 55 CYS H H -4.041 -3.111 7.092 1.00 . A A . 55 CYS H 1 1 16 14345 1 1 55 CYS HA H -1.931 -1.651 8.321 1.00 . A A . 55 CYS HA 1 1 16 14346 1 1 55 CYS HB2 H -4.541 -0.514 8.829 1.00 . A A . 55 CYS HB2 1 1 16 14347 1 1 55 CYS HB3 H -3.220 0.114 7.848 1.00 . A A . 55 CYS HB3 1 1 16 14348 1 1 55 CYS HG H -5.598 -0.031 6.329 1.00 . A A . 55 CYS HG 1 1 16 14349 1 1 55 CYS N N -3.239 -3.098 7.663 1.00 . A A . 55 CYS N 1 1 16 14350 1 1 55 CYS O O -2.230 -2.071 10.760 1.00 . A A . 55 CYS O 1 1 16 14351 1 1 55 CYS SG S -4.804 -1.076 6.540 1.00 . A A . 55 CYS SG 1 1 16 14352 1 1 56 PRO C C -4.009 -4.616 11.983 1.00 . A A . 56 PRO C 1 1 16 14353 1 1 56 PRO CA C -4.565 -3.211 11.743 1.00 . A A . 56 PRO CA 1 1 16 14354 1 1 56 PRO CB C -6.098 -3.206 11.869 1.00 . A A . 56 PRO CB 1 1 16 14355 1 1 56 PRO CD C -5.499 -3.086 9.540 1.00 . A A . 56 PRO CD 1 1 16 14356 1 1 56 PRO CG C -6.634 -2.903 10.504 1.00 . A A . 56 PRO CG 1 1 16 14357 1 1 56 PRO HA H -4.134 -2.523 12.458 1.00 . A A . 56 PRO HA 1 1 16 14358 1 1 56 PRO HB2 H -6.431 -4.175 12.211 1.00 . A A . 56 PRO HB2 1 1 16 14359 1 1 56 PRO HB3 H -6.397 -2.452 12.583 1.00 . A A . 56 PRO HB3 1 1 16 14360 1 1 56 PRO HD2 H -5.466 -4.103 9.181 1.00 . A A . 56 PRO HD2 1 1 16 14361 1 1 56 PRO HD3 H -5.582 -2.390 8.717 1.00 . A A . 56 PRO HD3 1 1 16 14362 1 1 56 PRO HG2 H -7.437 -3.583 10.266 1.00 . A A . 56 PRO HG2 1 1 16 14363 1 1 56 PRO HG3 H -6.987 -1.883 10.471 1.00 . A A . 56 PRO HG3 1 1 16 14364 1 1 56 PRO N N -4.330 -2.781 10.371 1.00 . A A . 56 PRO N 1 1 16 14365 1 1 56 PRO O O -4.741 -5.535 12.366 1.00 . A A . 56 PRO O 1 1 16 14366 1 1 57 ALA C C -1.850 -6.505 13.207 1.00 . A A . 57 ALA C 1 1 16 14367 1 1 57 ALA CA C -2.077 -6.089 11.761 1.00 . A A . 57 ALA CA 1 1 16 14368 1 1 57 ALA CB C -0.755 -6.069 11.011 1.00 . A A . 57 ALA CB 1 1 16 14369 1 1 57 ALA H H -2.219 -4.027 11.323 1.00 . A A . 57 ALA H 1 1 16 14370 1 1 57 ALA HA H -2.720 -6.815 11.287 1.00 . A A . 57 ALA HA 1 1 16 14371 1 1 57 ALA HB1 H -0.930 -5.800 9.980 1.00 . A A . 57 ALA HB1 1 1 16 14372 1 1 57 ALA HB2 H -0.093 -5.345 11.464 1.00 . A A . 57 ALA HB2 1 1 16 14373 1 1 57 ALA HB3 H -0.301 -7.048 11.056 1.00 . A A . 57 ALA HB3 1 1 16 14374 1 1 57 ALA N N -2.728 -4.790 11.673 1.00 . A A . 57 ALA N 1 1 16 14375 1 1 57 ALA O O -1.765 -7.693 13.508 1.00 . A A . 57 ALA O 1 1 16 14376 1 1 58 LEU C C -2.780 -6.303 16.170 1.00 . A A . 58 LEU C 1 1 16 14377 1 1 58 LEU CA C -1.497 -5.819 15.505 1.00 . A A . 58 LEU CA 1 1 16 14378 1 1 58 LEU CB C -0.959 -4.585 16.229 1.00 . A A . 58 LEU CB 1 1 16 14379 1 1 58 LEU CD1 C 1.499 -4.726 16.661 1.00 . A A . 58 LEU CD1 1 1 16 14380 1 1 58 LEU CD2 C -0.047 -3.969 18.478 1.00 . A A . 58 LEU CD2 1 1 16 14381 1 1 58 LEU CG C 0.116 -4.880 17.271 1.00 . A A . 58 LEU CG 1 1 16 14382 1 1 58 LEU H H -1.771 -4.593 13.796 1.00 . A A . 58 LEU H 1 1 16 14383 1 1 58 LEU HA H -0.760 -6.608 15.562 1.00 . A A . 58 LEU HA 1 1 16 14384 1 1 58 LEU HB2 H -0.545 -3.912 15.492 1.00 . A A . 58 LEU HB2 1 1 16 14385 1 1 58 LEU HB3 H -1.783 -4.094 16.722 1.00 . A A . 58 LEU HB3 1 1 16 14386 1 1 58 LEU HD11 H 1.422 -4.194 15.724 1.00 . A A . 58 LEU HD11 1 1 16 14387 1 1 58 LEU HD12 H 2.133 -4.173 17.338 1.00 . A A . 58 LEU HD12 1 1 16 14388 1 1 58 LEU HD13 H 1.925 -5.703 16.486 1.00 . A A . 58 LEU HD13 1 1 16 14389 1 1 58 LEU HD21 H 0.613 -3.121 18.378 1.00 . A A . 58 LEU HD21 1 1 16 14390 1 1 58 LEU HD22 H -1.070 -3.626 18.533 1.00 . A A . 58 LEU HD22 1 1 16 14391 1 1 58 LEU HD23 H 0.199 -4.515 19.377 1.00 . A A . 58 LEU HD23 1 1 16 14392 1 1 58 LEU HG H 0.011 -5.903 17.607 1.00 . A A . 58 LEU HG 1 1 16 14393 1 1 58 LEU N N -1.726 -5.530 14.097 1.00 . A A . 58 LEU N 1 1 16 14394 1 1 58 LEU O O -3.491 -5.530 16.815 1.00 . A A . 58 LEU O 1 1 16 14395 1 1 59 LYS C C -4.103 -9.569 16.931 1.00 . A A . 59 LYS C 1 1 16 14396 1 1 59 LYS CA C -4.338 -8.143 16.443 1.00 . A A . 59 LYS CA 1 1 16 14397 1 1 59 LYS CB C -5.408 -8.136 15.347 1.00 . A A . 59 LYS CB 1 1 16 14398 1 1 59 LYS CD C -7.528 -9.474 15.436 1.00 . A A . 59 LYS CD 1 1 16 14399 1 1 59 LYS CE C -8.733 -9.780 16.309 1.00 . A A . 59 LYS CE 1 1 16 14400 1 1 59 LYS CG C -6.829 -8.199 15.877 1.00 . A A . 59 LYS CG 1 1 16 14401 1 1 59 LYS H H -2.530 -8.099 15.351 1.00 . A A . 59 LYS H 1 1 16 14402 1 1 59 LYS HA H -4.678 -7.539 17.272 1.00 . A A . 59 LYS HA 1 1 16 14403 1 1 59 LYS HB2 H -5.304 -7.231 14.766 1.00 . A A . 59 LYS HB2 1 1 16 14404 1 1 59 LYS HB3 H -5.250 -8.987 14.699 1.00 . A A . 59 LYS HB3 1 1 16 14405 1 1 59 LYS HD2 H -7.859 -9.359 14.414 1.00 . A A . 59 LYS HD2 1 1 16 14406 1 1 59 LYS HD3 H -6.830 -10.296 15.499 1.00 . A A . 59 LYS HD3 1 1 16 14407 1 1 59 LYS HE2 H -9.287 -8.867 16.468 1.00 . A A . 59 LYS HE2 1 1 16 14408 1 1 59 LYS HE3 H -9.361 -10.495 15.796 1.00 . A A . 59 LYS HE3 1 1 16 14409 1 1 59 LYS HG2 H -6.802 -8.169 16.955 1.00 . A A . 59 LYS HG2 1 1 16 14410 1 1 59 LYS HG3 H -7.380 -7.347 15.503 1.00 . A A . 59 LYS HG3 1 1 16 14411 1 1 59 LYS HZ1 H -7.691 -11.151 17.500 1.00 . A A . 59 LYS HZ1 1 1 16 14412 1 1 59 LYS HZ2 H -9.189 -10.675 18.140 1.00 . A A . 59 LYS HZ2 1 1 16 14413 1 1 59 LYS HZ3 H -7.868 -9.614 18.207 1.00 . A A . 59 LYS HZ3 1 1 16 14414 1 1 59 LYS N N -3.108 -7.562 15.936 1.00 . A A . 59 LYS N 1 1 16 14415 1 1 59 LYS NZ N -8.343 -10.342 17.629 1.00 . A A . 59 LYS NZ 1 1 16 14416 1 1 59 LYS O O -4.932 -10.132 17.649 1.00 . A A . 59 LYS O 1 1 16 14417 1 1 60 GLY C C -3.566 -12.503 16.067 1.00 . A A . 60 GLY C 1 1 16 14418 1 1 60 GLY CA C -2.705 -11.541 16.857 1.00 . A A . 60 GLY CA 1 1 16 14419 1 1 60 GLY H H -2.379 -9.675 15.914 1.00 . A A . 60 GLY H 1 1 16 14420 1 1 60 GLY HA2 H -1.664 -11.748 16.652 1.00 . A A . 60 GLY HA2 1 1 16 14421 1 1 60 GLY HA3 H -2.894 -11.685 17.910 1.00 . A A . 60 GLY HA3 1 1 16 14422 1 1 60 GLY N N -2.992 -10.164 16.506 1.00 . A A . 60 GLY N 1 1 16 14423 1 1 60 GLY O O -3.360 -12.683 14.866 1.00 . A A . 60 GLY O 1 1 16 14424 1 1 61 LYS C C -6.994 -13.380 16.447 1.00 . A A . 61 LYS C 1 1 16 14425 1 1 61 LYS CA C -5.603 -13.810 16.017 1.00 . A A . 61 LYS CA 1 1 16 14426 1 1 61 LYS CB C -5.391 -15.298 16.324 1.00 . A A . 61 LYS CB 1 1 16 14427 1 1 61 LYS CD C -5.819 -16.219 14.012 1.00 . A A . 61 LYS CD 1 1 16 14428 1 1 61 LYS CE C -5.409 -15.375 12.813 1.00 . A A . 61 LYS CE 1 1 16 14429 1 1 61 LYS CG C -4.819 -16.092 15.154 1.00 . A A . 61 LYS CG 1 1 16 14430 1 1 61 LYS H H -4.798 -12.701 17.617 1.00 . A A . 61 LYS H 1 1 16 14431 1 1 61 LYS HA H -5.500 -13.647 14.955 1.00 . A A . 61 LYS HA 1 1 16 14432 1 1 61 LYS HB2 H -4.710 -15.388 17.159 1.00 . A A . 61 LYS HB2 1 1 16 14433 1 1 61 LYS HB3 H -6.340 -15.733 16.597 1.00 . A A . 61 LYS HB3 1 1 16 14434 1 1 61 LYS HD2 H -5.876 -17.255 13.710 1.00 . A A . 61 LYS HD2 1 1 16 14435 1 1 61 LYS HD3 H -6.788 -15.890 14.357 1.00 . A A . 61 LYS HD3 1 1 16 14436 1 1 61 LYS HE2 H -6.109 -14.560 12.708 1.00 . A A . 61 LYS HE2 1 1 16 14437 1 1 61 LYS HE3 H -4.420 -14.977 12.991 1.00 . A A . 61 LYS HE3 1 1 16 14438 1 1 61 LYS HG2 H -3.936 -15.588 14.791 1.00 . A A . 61 LYS HG2 1 1 16 14439 1 1 61 LYS HG3 H -4.554 -17.080 15.500 1.00 . A A . 61 LYS HG3 1 1 16 14440 1 1 61 LYS HZ1 H -4.720 -16.957 11.628 1.00 . A A . 61 LYS HZ1 1 1 16 14441 1 1 61 LYS HZ2 H -5.102 -15.553 10.752 1.00 . A A . 61 LYS HZ2 1 1 16 14442 1 1 61 LYS HZ3 H -6.343 -16.545 11.348 1.00 . A A . 61 LYS HZ3 1 1 16 14443 1 1 61 LYS N N -4.617 -12.991 16.697 1.00 . A A . 61 LYS N 1 1 16 14444 1 1 61 LYS NZ N -5.392 -16.161 11.550 1.00 . A A . 61 LYS NZ 1 1 16 14445 1 1 61 LYS O O -7.098 -12.656 17.455 1.00 . A A . 61 LYS O 1 1 16 14446 1 1 61 LYS OXT O -7.975 -13.756 15.777 1.00 . A A . 61 LYS OXT 1 1 16 14447 2 2 1 ZN ZN ZN -4.190 -3.486 -0.641 1.00 . B A . 62 ZN ZN 1 1 16 14448 3 2 1 ZN ZN ZN 4.060 4.597 2.955 1.00 . C A . 63 ZN ZN 1 1 17 14449 1 1 1 GLY C C -14.913 -6.289 7.636 1.00 . A A . 1 GLY C 1 1 17 14450 1 1 1 GLY CA C -14.650 -7.007 8.945 1.00 . A A . 1 GLY CA 1 1 17 14451 1 1 1 GLY H1 H -15.611 -8.594 9.903 1.00 . A A . 1 GLY H1 1 1 17 14452 1 1 1 GLY H2 H -16.522 -7.879 8.667 1.00 . A A . 1 GLY H2 1 1 17 14453 1 1 1 GLY H3 H -16.348 -7.087 10.155 1.00 . A A . 1 GLY H3 1 1 17 14454 1 1 1 GLY HA2 H -14.316 -6.289 9.679 1.00 . A A . 1 GLY HA2 1 1 17 14455 1 1 1 GLY HA3 H -13.872 -7.741 8.792 1.00 . A A . 1 GLY HA3 1 1 17 14456 1 1 1 GLY N N -15.864 -7.690 9.453 1.00 . A A . 1 GLY N 1 1 17 14457 1 1 1 GLY O O -15.299 -6.919 6.650 1.00 . A A . 1 GLY O 1 1 17 14458 1 1 2 PRO C C -14.023 -4.359 5.308 1.00 . A A . 2 PRO C 1 1 17 14459 1 1 2 PRO CA C -15.049 -4.147 6.421 1.00 . A A . 2 PRO CA 1 1 17 14460 1 1 2 PRO CB C -14.983 -2.709 6.940 1.00 . A A . 2 PRO CB 1 1 17 14461 1 1 2 PRO CD C -14.385 -4.124 8.769 1.00 . A A . 2 PRO CD 1 1 17 14462 1 1 2 PRO CG C -14.128 -2.777 8.157 1.00 . A A . 2 PRO CG 1 1 17 14463 1 1 2 PRO HA H -16.039 -4.345 6.036 1.00 . A A . 2 PRO HA 1 1 17 14464 1 1 2 PRO HB2 H -14.546 -2.071 6.183 1.00 . A A . 2 PRO HB2 1 1 17 14465 1 1 2 PRO HB3 H -15.978 -2.363 7.175 1.00 . A A . 2 PRO HB3 1 1 17 14466 1 1 2 PRO HD2 H -13.488 -4.504 9.235 1.00 . A A . 2 PRO HD2 1 1 17 14467 1 1 2 PRO HD3 H -15.190 -4.067 9.487 1.00 . A A . 2 PRO HD3 1 1 17 14468 1 1 2 PRO HG2 H -13.089 -2.683 7.881 1.00 . A A . 2 PRO HG2 1 1 17 14469 1 1 2 PRO HG3 H -14.407 -1.994 8.847 1.00 . A A . 2 PRO HG3 1 1 17 14470 1 1 2 PRO N N -14.771 -4.956 7.613 1.00 . A A . 2 PRO N 1 1 17 14471 1 1 2 PRO O O -12.882 -3.892 5.398 1.00 . A A . 2 PRO O 1 1 17 14472 1 1 3 LEU C C -13.453 -3.857 2.325 1.00 . A A . 3 LEU C 1 1 17 14473 1 1 3 LEU CA C -13.618 -5.182 3.059 1.00 . A A . 3 LEU CA 1 1 17 14474 1 1 3 LEU CB C -14.208 -6.252 2.128 1.00 . A A . 3 LEU CB 1 1 17 14475 1 1 3 LEU CD1 C -15.008 -5.880 -0.219 1.00 . A A . 3 LEU CD1 1 1 17 14476 1 1 3 LEU CD2 C -16.612 -6.655 1.534 1.00 . A A . 3 LEU CD2 1 1 17 14477 1 1 3 LEU CG C -15.383 -5.805 1.254 1.00 . A A . 3 LEU CG 1 1 17 14478 1 1 3 LEU H H -15.403 -5.270 4.189 1.00 . A A . 3 LEU H 1 1 17 14479 1 1 3 LEU HA H -12.647 -5.511 3.403 1.00 . A A . 3 LEU HA 1 1 17 14480 1 1 3 LEU HB2 H -13.420 -6.603 1.478 1.00 . A A . 3 LEU HB2 1 1 17 14481 1 1 3 LEU HB3 H -14.540 -7.081 2.736 1.00 . A A . 3 LEU HB3 1 1 17 14482 1 1 3 LEU HD11 H -14.053 -5.400 -0.372 1.00 . A A . 3 LEU HD11 1 1 17 14483 1 1 3 LEU HD12 H -14.943 -6.914 -0.522 1.00 . A A . 3 LEU HD12 1 1 17 14484 1 1 3 LEU HD13 H -15.761 -5.378 -0.810 1.00 . A A . 3 LEU HD13 1 1 17 14485 1 1 3 LEU HD21 H -17.191 -6.759 0.628 1.00 . A A . 3 LEU HD21 1 1 17 14486 1 1 3 LEU HD22 H -16.303 -7.630 1.879 1.00 . A A . 3 LEU HD22 1 1 17 14487 1 1 3 LEU HD23 H -17.213 -6.179 2.295 1.00 . A A . 3 LEU HD23 1 1 17 14488 1 1 3 LEU HG H -15.625 -4.778 1.486 1.00 . A A . 3 LEU HG 1 1 17 14489 1 1 3 LEU N N -14.462 -4.992 4.228 1.00 . A A . 3 LEU N 1 1 17 14490 1 1 3 LEU O O -12.361 -3.523 1.865 1.00 . A A . 3 LEU O 1 1 17 14491 1 1 4 GLY C C -13.943 -0.718 2.794 1.00 . A A . 4 GLY C 1 1 17 14492 1 1 4 GLY CA C -14.445 -1.722 1.778 1.00 . A A . 4 GLY CA 1 1 17 14493 1 1 4 GLY H H -15.320 -3.341 2.824 1.00 . A A . 4 GLY H 1 1 17 14494 1 1 4 GLY HA2 H -13.778 -1.731 0.927 1.00 . A A . 4 GLY HA2 1 1 17 14495 1 1 4 GLY HA3 H -15.432 -1.428 1.452 1.00 . A A . 4 GLY HA3 1 1 17 14496 1 1 4 GLY N N -14.508 -3.054 2.345 1.00 . A A . 4 GLY N 1 1 17 14497 1 1 4 GLY O O -14.712 0.092 3.315 1.00 . A A . 4 GLY O 1 1 17 14498 1 1 5 SER C C -11.817 1.370 3.724 1.00 . A A . 5 SER C 1 1 17 14499 1 1 5 SER CA C -12.085 -0.054 4.208 1.00 . A A . 5 SER CA 1 1 17 14500 1 1 5 SER CB C -10.793 -0.722 4.674 1.00 . A A . 5 SER CB 1 1 17 14501 1 1 5 SER H H -12.152 -1.590 2.768 1.00 . A A . 5 SER H 1 1 17 14502 1 1 5 SER HA H -12.778 -0.016 5.034 1.00 . A A . 5 SER HA 1 1 17 14503 1 1 5 SER HB2 H -9.949 -0.203 4.247 1.00 . A A . 5 SER HB2 1 1 17 14504 1 1 5 SER HB3 H -10.735 -0.682 5.752 1.00 . A A . 5 SER HB3 1 1 17 14505 1 1 5 SER HG H -11.449 -2.576 4.727 1.00 . A A . 5 SER HG 1 1 17 14506 1 1 5 SER N N -12.681 -0.864 3.163 1.00 . A A . 5 SER N 1 1 17 14507 1 1 5 SER O O -12.367 2.329 4.264 1.00 . A A . 5 SER O 1 1 17 14508 1 1 5 SER OG O -10.758 -2.084 4.261 1.00 . A A . 5 SER OG 1 1 17 14509 1 1 6 ASP C C -10.534 2.692 0.588 1.00 . A A . 6 ASP C 1 1 17 14510 1 1 6 ASP CA C -10.729 2.807 2.091 1.00 . A A . 6 ASP CA 1 1 17 14511 1 1 6 ASP CB C -9.479 3.418 2.736 1.00 . A A . 6 ASP CB 1 1 17 14512 1 1 6 ASP CG C -9.534 4.933 2.796 1.00 . A A . 6 ASP CG 1 1 17 14513 1 1 6 ASP H H -10.674 0.690 2.228 1.00 . A A . 6 ASP H 1 1 17 14514 1 1 6 ASP HA H -11.573 3.452 2.283 1.00 . A A . 6 ASP HA 1 1 17 14515 1 1 6 ASP HB2 H -9.380 3.040 3.742 1.00 . A A . 6 ASP HB2 1 1 17 14516 1 1 6 ASP HB3 H -8.611 3.130 2.161 1.00 . A A . 6 ASP HB3 1 1 17 14517 1 1 6 ASP N N -11.027 1.499 2.666 1.00 . A A . 6 ASP N 1 1 17 14518 1 1 6 ASP O O -9.471 2.281 0.117 1.00 . A A . 6 ASP O 1 1 17 14519 1 1 6 ASP OD1 O -10.638 5.501 2.646 1.00 . A A . 6 ASP OD1 1 1 17 14520 1 1 6 ASP OD2 O -8.473 5.566 3.003 1.00 . A A . 6 ASP OD2 1 1 17 14521 1 1 7 HIS C C -10.880 3.994 -2.264 1.00 . A A . 7 HIS C 1 1 17 14522 1 1 7 HIS CA C -11.590 2.817 -1.606 1.00 . A A . 7 HIS CA 1 1 17 14523 1 1 7 HIS CB C -13.018 2.696 -2.166 1.00 . A A . 7 HIS CB 1 1 17 14524 1 1 7 HIS CD2 C -14.871 3.955 -0.879 1.00 . A A . 7 HIS CD2 1 1 17 14525 1 1 7 HIS CE1 C -15.421 2.337 0.468 1.00 . A A . 7 HIS CE1 1 1 17 14526 1 1 7 HIS CG C -14.106 2.870 -1.147 1.00 . A A . 7 HIS CG 1 1 17 14527 1 1 7 HIS H H -12.436 3.214 0.294 1.00 . A A . 7 HIS H 1 1 17 14528 1 1 7 HIS HA H -11.046 1.912 -1.840 1.00 . A A . 7 HIS HA 1 1 17 14529 1 1 7 HIS HB2 H -13.161 3.447 -2.928 1.00 . A A . 7 HIS HB2 1 1 17 14530 1 1 7 HIS HB3 H -13.137 1.718 -2.610 1.00 . A A . 7 HIS HB3 1 1 17 14531 1 1 7 HIS HD2 H -14.833 4.912 -1.378 1.00 . A A . 7 HIS HD2 1 1 17 14532 1 1 7 HIS HE1 H -15.912 1.781 1.251 1.00 . A A . 7 HIS HE1 1 1 17 14533 1 1 7 HIS HE2 H -16.514 4.100 0.425 1.00 . A A . 7 HIS HE2 1 1 17 14534 1 1 7 HIS N N -11.599 2.963 -0.153 1.00 . A A . 7 HIS N 1 1 17 14535 1 1 7 HIS ND1 N -14.458 1.852 -0.295 1.00 . A A . 7 HIS ND1 1 1 17 14536 1 1 7 HIS NE2 N -15.706 3.607 0.151 1.00 . A A . 7 HIS NE2 1 1 17 14537 1 1 7 HIS O O -10.840 5.092 -1.702 1.00 . A A . 7 HIS O 1 1 17 14538 1 1 8 HIS C C -8.238 5.068 -3.555 1.00 . A A . 8 HIS C 1 1 17 14539 1 1 8 HIS CA C -9.573 4.741 -4.224 1.00 . A A . 8 HIS CA 1 1 17 14540 1 1 8 HIS CB C -10.400 6.016 -4.431 1.00 . A A . 8 HIS CB 1 1 17 14541 1 1 8 HIS CD2 C -9.974 6.331 -6.962 1.00 . A A . 8 HIS CD2 1 1 17 14542 1 1 8 HIS CE1 C -12.044 6.668 -7.554 1.00 . A A . 8 HIS CE1 1 1 17 14543 1 1 8 HIS CG C -10.770 6.265 -5.865 1.00 . A A . 8 HIS CG 1 1 17 14544 1 1 8 HIS H H -10.405 2.840 -3.824 1.00 . A A . 8 HIS H 1 1 17 14545 1 1 8 HIS HA H -9.365 4.307 -5.192 1.00 . A A . 8 HIS HA 1 1 17 14546 1 1 8 HIS HB2 H -11.315 5.941 -3.860 1.00 . A A . 8 HIS HB2 1 1 17 14547 1 1 8 HIS HB3 H -9.834 6.866 -4.078 1.00 . A A . 8 HIS HB3 1 1 17 14548 1 1 8 HIS HD2 H -8.900 6.206 -6.991 1.00 . A A . 8 HIS HD2 1 1 17 14549 1 1 8 HIS HE1 H -12.915 6.870 -8.159 1.00 . A A . 8 HIS HE1 1 1 17 14550 1 1 8 HIS HE2 H -10.545 6.509 -8.981 1.00 . A A . 8 HIS HE2 1 1 17 14551 1 1 8 HIS N N -10.319 3.742 -3.450 1.00 . A A . 8 HIS N 1 1 17 14552 1 1 8 HIS ND1 N -12.074 6.477 -6.243 1.00 . A A . 8 HIS ND1 1 1 17 14553 1 1 8 HIS NE2 N -10.795 6.588 -8.033 1.00 . A A . 8 HIS NE2 1 1 17 14554 1 1 8 HIS O O -7.175 4.694 -4.059 1.00 . A A . 8 HIS O 1 1 17 14555 1 1 9 MET C C -6.210 6.983 -2.313 1.00 . A A . 9 MET C 1 1 17 14556 1 1 9 MET CA C -7.145 6.030 -1.580 1.00 . A A . 9 MET CA 1 1 17 14557 1 1 9 MET CB C -6.392 4.766 -1.165 1.00 . A A . 9 MET CB 1 1 17 14558 1 1 9 MET CE C -5.115 4.364 2.475 1.00 . A A . 9 MET CE 1 1 17 14559 1 1 9 MET CG C -6.720 4.307 0.241 1.00 . A A . 9 MET CG 1 1 17 14560 1 1 9 MET H H -9.205 5.899 -2.024 1.00 . A A . 9 MET H 1 1 17 14561 1 1 9 MET HA H -7.500 6.523 -0.687 1.00 . A A . 9 MET HA 1 1 17 14562 1 1 9 MET HB2 H -6.642 3.968 -1.850 1.00 . A A . 9 MET HB2 1 1 17 14563 1 1 9 MET HB3 H -5.331 4.958 -1.219 1.00 . A A . 9 MET HB3 1 1 17 14564 1 1 9 MET HE1 H -5.973 4.998 2.643 1.00 . A A . 9 MET HE1 1 1 17 14565 1 1 9 MET HE2 H -4.979 3.710 3.326 1.00 . A A . 9 MET HE2 1 1 17 14566 1 1 9 MET HE3 H -4.235 4.978 2.349 1.00 . A A . 9 MET HE3 1 1 17 14567 1 1 9 MET HG2 H -6.925 5.177 0.848 1.00 . A A . 9 MET HG2 1 1 17 14568 1 1 9 MET HG3 H -7.599 3.680 0.207 1.00 . A A . 9 MET HG3 1 1 17 14569 1 1 9 MET N N -8.315 5.697 -2.386 1.00 . A A . 9 MET N 1 1 17 14570 1 1 9 MET O O -6.567 7.539 -3.354 1.00 . A A . 9 MET O 1 1 17 14571 1 1 9 MET SD S -5.376 3.382 1.002 1.00 . A A . 9 MET SD 1 1 17 14572 1 1 10 GLU C C -2.737 8.045 -1.491 1.00 . A A . 10 GLU C 1 1 17 14573 1 1 10 GLU CA C -4.007 8.053 -2.338 1.00 . A A . 10 GLU CA 1 1 17 14574 1 1 10 GLU CB C -4.541 9.488 -2.431 1.00 . A A . 10 GLU CB 1 1 17 14575 1 1 10 GLU CD C -5.295 10.243 -4.725 1.00 . A A . 10 GLU CD 1 1 17 14576 1 1 10 GLU CG C -4.160 10.198 -3.722 1.00 . A A . 10 GLU CG 1 1 17 14577 1 1 10 GLU H H -4.786 6.643 -0.962 1.00 . A A . 10 GLU H 1 1 17 14578 1 1 10 GLU HA H -3.771 7.698 -3.329 1.00 . A A . 10 GLU HA 1 1 17 14579 1 1 10 GLU HB2 H -5.618 9.463 -2.361 1.00 . A A . 10 GLU HB2 1 1 17 14580 1 1 10 GLU HB3 H -4.149 10.059 -1.602 1.00 . A A . 10 GLU HB3 1 1 17 14581 1 1 10 GLU HG2 H -3.867 11.210 -3.487 1.00 . A A . 10 GLU HG2 1 1 17 14582 1 1 10 GLU HG3 H -3.325 9.678 -4.170 1.00 . A A . 10 GLU HG3 1 1 17 14583 1 1 10 GLU N N -5.012 7.157 -1.765 1.00 . A A . 10 GLU N 1 1 17 14584 1 1 10 GLU O O -1.642 8.284 -2.000 1.00 . A A . 10 GLU O 1 1 17 14585 1 1 10 GLU OE1 O -6.399 10.698 -4.362 1.00 . A A . 10 GLU OE1 1 1 17 14586 1 1 10 GLU OE2 O -5.093 9.818 -5.883 1.00 . A A . 10 GLU OE2 1 1 17 14587 1 1 11 PHE C C -1.637 6.673 1.544 1.00 . A A . 11 PHE C 1 1 17 14588 1 1 11 PHE CA C -1.791 7.973 0.751 1.00 . A A . 11 PHE CA 1 1 17 14589 1 1 11 PHE CB C -1.996 9.158 1.706 1.00 . A A . 11 PHE CB 1 1 17 14590 1 1 11 PHE CD1 C -4.474 8.980 2.117 1.00 . A A . 11 PHE CD1 1 1 17 14591 1 1 11 PHE CD2 C -3.007 8.908 3.992 1.00 . A A . 11 PHE CD2 1 1 17 14592 1 1 11 PHE CE1 C -5.561 8.842 2.957 1.00 . A A . 11 PHE CE1 1 1 17 14593 1 1 11 PHE CE2 C -4.091 8.772 4.839 1.00 . A A . 11 PHE CE2 1 1 17 14594 1 1 11 PHE CG C -3.184 9.014 2.623 1.00 . A A . 11 PHE CG 1 1 17 14595 1 1 11 PHE CZ C -5.370 8.737 4.320 1.00 . A A . 11 PHE CZ 1 1 17 14596 1 1 11 PHE H H -3.810 7.808 0.176 1.00 . A A . 11 PHE H 1 1 17 14597 1 1 11 PHE HA H -0.893 8.138 0.176 1.00 . A A . 11 PHE HA 1 1 17 14598 1 1 11 PHE HB2 H -1.115 9.268 2.322 1.00 . A A . 11 PHE HB2 1 1 17 14599 1 1 11 PHE HB3 H -2.133 10.059 1.123 1.00 . A A . 11 PHE HB3 1 1 17 14600 1 1 11 PHE HD1 H -4.627 9.065 1.050 1.00 . A A . 11 PHE HD1 1 1 17 14601 1 1 11 PHE HD2 H -2.008 8.933 4.400 1.00 . A A . 11 PHE HD2 1 1 17 14602 1 1 11 PHE HE1 H -6.561 8.817 2.548 1.00 . A A . 11 PHE HE1 1 1 17 14603 1 1 11 PHE HE2 H -3.938 8.689 5.905 1.00 . A A . 11 PHE HE2 1 1 17 14604 1 1 11 PHE HZ H -6.217 8.627 4.979 1.00 . A A . 11 PHE HZ 1 1 17 14605 1 1 11 PHE N N -2.906 7.891 -0.183 1.00 . A A . 11 PHE N 1 1 17 14606 1 1 11 PHE O O -2.555 5.858 1.589 1.00 . A A . 11 PHE O 1 1 17 14607 1 1 12 CYS C C -1.118 5.203 4.153 1.00 . A A . 12 CYS C 1 1 17 14608 1 1 12 CYS CA C -0.184 5.298 2.953 1.00 . A A . 12 CYS CA 1 1 17 14609 1 1 12 CYS CB C 1.259 5.320 3.457 1.00 . A A . 12 CYS CB 1 1 17 14610 1 1 12 CYS H H 0.232 7.170 2.048 1.00 . A A . 12 CYS H 1 1 17 14611 1 1 12 CYS HA H -0.324 4.430 2.325 1.00 . A A . 12 CYS HA 1 1 17 14612 1 1 12 CYS HB2 H 1.520 6.336 3.717 1.00 . A A . 12 CYS HB2 1 1 17 14613 1 1 12 CYS HB3 H 1.333 4.700 4.339 1.00 . A A . 12 CYS HB3 1 1 17 14614 1 1 12 CYS HG H 3.434 5.667 2.182 1.00 . A A . 12 CYS HG 1 1 17 14615 1 1 12 CYS N N -0.468 6.489 2.155 1.00 . A A . 12 CYS N 1 1 17 14616 1 1 12 CYS O O -1.464 6.211 4.764 1.00 . A A . 12 CYS O 1 1 17 14617 1 1 12 CYS SG S 2.481 4.735 2.268 1.00 . A A . 12 CYS SG 1 1 17 14618 1 1 13 ARG C C -1.675 4.067 6.988 1.00 . A A . 13 ARG C 1 1 17 14619 1 1 13 ARG CA C -2.369 3.752 5.657 1.00 . A A . 13 ARG CA 1 1 17 14620 1 1 13 ARG CB C -2.869 2.306 5.656 1.00 . A A . 13 ARG CB 1 1 17 14621 1 1 13 ARG CD C -4.406 0.691 4.492 1.00 . A A . 13 ARG CD 1 1 17 14622 1 1 13 ARG CG C -4.195 2.128 4.937 1.00 . A A . 13 ARG CG 1 1 17 14623 1 1 13 ARG CZ C -5.339 -1.088 5.921 1.00 . A A . 13 ARG CZ 1 1 17 14624 1 1 13 ARG H H -1.165 3.214 3.995 1.00 . A A . 13 ARG H 1 1 17 14625 1 1 13 ARG HA H -3.216 4.413 5.548 1.00 . A A . 13 ARG HA 1 1 17 14626 1 1 13 ARG HB2 H -2.134 1.681 5.170 1.00 . A A . 13 ARG HB2 1 1 17 14627 1 1 13 ARG HB3 H -2.989 1.976 6.678 1.00 . A A . 13 ARG HB3 1 1 17 14628 1 1 13 ARG HD2 H -4.659 0.686 3.441 1.00 . A A . 13 ARG HD2 1 1 17 14629 1 1 13 ARG HD3 H -3.490 0.141 4.644 1.00 . A A . 13 ARG HD3 1 1 17 14630 1 1 13 ARG HE H -6.354 0.512 5.270 1.00 . A A . 13 ARG HE 1 1 17 14631 1 1 13 ARG HG2 H -4.998 2.408 5.605 1.00 . A A . 13 ARG HG2 1 1 17 14632 1 1 13 ARG HG3 H -4.209 2.769 4.069 1.00 . A A . 13 ARG HG3 1 1 17 14633 1 1 13 ARG HH11 H -3.474 -1.464 5.220 1.00 . A A . 13 ARG HH11 1 1 17 14634 1 1 13 ARG HH12 H -4.105 -2.648 6.335 1.00 . A A . 13 ARG HH12 1 1 17 14635 1 1 13 ARG HH21 H -7.204 -1.027 6.729 1.00 . A A . 13 ARG HH21 1 1 17 14636 1 1 13 ARG HH22 H -6.222 -2.386 7.202 1.00 . A A . 13 ARG HH22 1 1 17 14637 1 1 13 ARG N N -1.482 3.981 4.518 1.00 . A A . 13 ARG N 1 1 17 14638 1 1 13 ARG NE N -5.479 0.047 5.244 1.00 . A A . 13 ARG NE 1 1 17 14639 1 1 13 ARG NH1 N -4.218 -1.787 5.815 1.00 . A A . 13 ARG NH1 1 1 17 14640 1 1 13 ARG NH2 N -6.335 -1.542 6.669 1.00 . A A . 13 ARG NH2 1 1 17 14641 1 1 13 ARG O O -2.335 4.324 7.992 1.00 . A A . 13 ARG O 1 1 17 14642 1 1 14 VAL C C 1.227 5.557 8.111 1.00 . A A . 14 VAL C 1 1 17 14643 1 1 14 VAL CA C 0.430 4.258 8.218 1.00 . A A . 14 VAL CA 1 1 17 14644 1 1 14 VAL CB C 1.410 3.098 8.505 1.00 . A A . 14 VAL CB 1 1 17 14645 1 1 14 VAL CG1 C 1.643 2.958 10.001 1.00 . A A . 14 VAL CG1 1 1 17 14646 1 1 14 VAL CG2 C 0.900 1.790 7.907 1.00 . A A . 14 VAL CG2 1 1 17 14647 1 1 14 VAL H H 0.125 3.790 6.171 1.00 . A A . 14 VAL H 1 1 17 14648 1 1 14 VAL HA H -0.261 4.336 9.044 1.00 . A A . 14 VAL HA 1 1 17 14649 1 1 14 VAL HB H 2.356 3.335 8.042 1.00 . A A . 14 VAL HB 1 1 17 14650 1 1 14 VAL HG11 H 1.998 1.963 10.219 1.00 . A A . 14 VAL HG11 1 1 17 14651 1 1 14 VAL HG12 H 2.380 3.682 10.318 1.00 . A A . 14 VAL HG12 1 1 17 14652 1 1 14 VAL HG13 H 0.717 3.135 10.528 1.00 . A A . 14 VAL HG13 1 1 17 14653 1 1 14 VAL HG21 H -0.152 1.683 8.122 1.00 . A A . 14 VAL HG21 1 1 17 14654 1 1 14 VAL HG22 H 1.050 1.801 6.835 1.00 . A A . 14 VAL HG22 1 1 17 14655 1 1 14 VAL HG23 H 1.444 0.962 8.340 1.00 . A A . 14 VAL HG23 1 1 17 14656 1 1 14 VAL N N -0.344 4.018 6.995 1.00 . A A . 14 VAL N 1 1 17 14657 1 1 14 VAL O O 0.983 6.516 8.839 1.00 . A A . 14 VAL O 1 1 17 14658 1 1 15 CYS C C 2.379 7.808 6.079 1.00 . A A . 15 CYS C 1 1 17 14659 1 1 15 CYS CA C 3.040 6.705 6.919 1.00 . A A . 15 CYS CA 1 1 17 14660 1 1 15 CYS CB C 4.311 6.134 6.300 1.00 . A A . 15 CYS CB 1 1 17 14661 1 1 15 CYS H H 2.333 4.742 6.677 1.00 . A A . 15 CYS H 1 1 17 14662 1 1 15 CYS HA H 3.303 7.133 7.872 1.00 . A A . 15 CYS HA 1 1 17 14663 1 1 15 CYS HB2 H 4.588 6.725 5.442 1.00 . A A . 15 CYS HB2 1 1 17 14664 1 1 15 CYS HB3 H 5.108 6.149 7.026 1.00 . A A . 15 CYS HB3 1 1 17 14665 1 1 15 CYS N N 2.172 5.564 7.187 1.00 . A A . 15 CYS N 1 1 17 14666 1 1 15 CYS O O 2.959 8.877 5.904 1.00 . A A . 15 CYS O 1 1 17 14667 1 1 15 CYS SG S 4.059 4.406 5.759 1.00 . A A . 15 CYS SG 1 1 17 14668 1 1 16 LYS C C 0.866 9.500 4.136 1.00 . A A . 16 LYS C 1 1 17 14669 1 1 16 LYS CA C 0.210 8.686 5.254 1.00 . A A . 16 LYS CA 1 1 17 14670 1 1 16 LYS CB C -0.265 9.639 6.361 1.00 . A A . 16 LYS CB 1 1 17 14671 1 1 16 LYS CD C -1.994 8.394 7.705 1.00 . A A . 16 LYS CD 1 1 17 14672 1 1 16 LYS CE C -2.163 7.355 8.800 1.00 . A A . 16 LYS CE 1 1 17 14673 1 1 16 LYS CG C -0.580 8.950 7.683 1.00 . A A . 16 LYS CG 1 1 17 14674 1 1 16 LYS H H 0.652 6.831 6.172 1.00 . A A . 16 LYS H 1 1 17 14675 1 1 16 LYS HA H -0.657 8.192 4.842 1.00 . A A . 16 LYS HA 1 1 17 14676 1 1 16 LYS HB2 H 0.507 10.372 6.540 1.00 . A A . 16 LYS HB2 1 1 17 14677 1 1 16 LYS HB3 H -1.158 10.146 6.023 1.00 . A A . 16 LYS HB3 1 1 17 14678 1 1 16 LYS HD2 H -2.687 9.204 7.880 1.00 . A A . 16 LYS HD2 1 1 17 14679 1 1 16 LYS HD3 H -2.206 7.936 6.749 1.00 . A A . 16 LYS HD3 1 1 17 14680 1 1 16 LYS HE2 H -2.016 6.375 8.371 1.00 . A A . 16 LYS HE2 1 1 17 14681 1 1 16 LYS HE3 H -1.416 7.529 9.560 1.00 . A A . 16 LYS HE3 1 1 17 14682 1 1 16 LYS HG2 H 0.115 8.138 7.826 1.00 . A A . 16 LYS HG2 1 1 17 14683 1 1 16 LYS HG3 H -0.471 9.666 8.485 1.00 . A A . 16 LYS HG3 1 1 17 14684 1 1 16 LYS HZ1 H -3.796 6.461 9.749 1.00 . A A . 16 LYS HZ1 1 1 17 14685 1 1 16 LYS HZ2 H -4.214 7.755 8.735 1.00 . A A . 16 LYS HZ2 1 1 17 14686 1 1 16 LYS HZ3 H -3.500 8.059 10.241 1.00 . A A . 16 LYS HZ3 1 1 17 14687 1 1 16 LYS N N 1.081 7.634 5.819 1.00 . A A . 16 LYS N 1 1 17 14688 1 1 16 LYS NZ N -3.510 7.411 9.424 1.00 . A A . 16 LYS NZ 1 1 17 14689 1 1 16 LYS O O 0.576 10.683 3.973 1.00 . A A . 16 LYS O 1 1 17 14690 1 1 17 ASP C C 1.780 9.294 0.970 1.00 . A A . 17 ASP C 1 1 17 14691 1 1 17 ASP CA C 2.446 9.571 2.304 1.00 . A A . 17 ASP CA 1 1 17 14692 1 1 17 ASP CB C 3.896 9.108 2.250 1.00 . A A . 17 ASP CB 1 1 17 14693 1 1 17 ASP CG C 3.993 7.605 2.189 1.00 . A A . 17 ASP CG 1 1 17 14694 1 1 17 ASP H H 1.965 7.942 3.565 1.00 . A A . 17 ASP H 1 1 17 14695 1 1 17 ASP HA H 2.415 10.630 2.507 1.00 . A A . 17 ASP HA 1 1 17 14696 1 1 17 ASP HB2 H 4.370 9.518 1.373 1.00 . A A . 17 ASP HB2 1 1 17 14697 1 1 17 ASP HB3 H 4.415 9.449 3.133 1.00 . A A . 17 ASP HB3 1 1 17 14698 1 1 17 ASP N N 1.744 8.880 3.378 1.00 . A A . 17 ASP N 1 1 17 14699 1 1 17 ASP O O 1.168 8.245 0.785 1.00 . A A . 17 ASP O 1 1 17 14700 1 1 17 ASP OD1 O 3.793 6.949 3.233 1.00 . A A . 17 ASP OD1 1 1 17 14701 1 1 17 ASP OD2 O 4.255 7.062 1.102 1.00 . A A . 17 ASP OD2 1 1 17 14702 1 1 18 GLY C C 2.334 10.399 -2.377 1.00 . A A . 18 GLY C 1 1 17 14703 1 1 18 GLY CA C 1.352 10.040 -1.282 1.00 . A A . 18 GLY CA 1 1 17 14704 1 1 18 GLY H H 2.448 11.029 0.233 1.00 . A A . 18 GLY H 1 1 17 14705 1 1 18 GLY HA2 H 1.057 9.006 -1.400 1.00 . A A . 18 GLY HA2 1 1 17 14706 1 1 18 GLY HA3 H 0.478 10.670 -1.374 1.00 . A A . 18 GLY HA3 1 1 17 14707 1 1 18 GLY N N 1.925 10.219 0.035 1.00 . A A . 18 GLY N 1 1 17 14708 1 1 18 GLY O O 3.503 10.675 -2.102 1.00 . A A . 18 GLY O 1 1 17 14709 1 1 19 GLY C C 3.392 9.493 -5.325 1.00 . A A . 19 GLY C 1 1 17 14710 1 1 19 GLY CA C 2.728 10.721 -4.737 1.00 . A A . 19 GLY CA 1 1 17 14711 1 1 19 GLY H H 0.926 10.155 -3.779 1.00 . A A . 19 GLY H 1 1 17 14712 1 1 19 GLY HA2 H 2.139 11.204 -5.502 1.00 . A A . 19 GLY HA2 1 1 17 14713 1 1 19 GLY HA3 H 3.494 11.405 -4.402 1.00 . A A . 19 GLY HA3 1 1 17 14714 1 1 19 GLY N N 1.868 10.394 -3.617 1.00 . A A . 19 GLY N 1 1 17 14715 1 1 19 GLY O O 2.727 8.639 -5.913 1.00 . A A . 19 GLY O 1 1 17 14716 1 1 20 GLU C C 5.322 7.052 -4.685 1.00 . A A . 20 GLU C 1 1 17 14717 1 1 20 GLU CA C 5.454 8.240 -5.631 1.00 . A A . 20 GLU CA 1 1 17 14718 1 1 20 GLU CB C 6.927 8.615 -5.808 1.00 . A A . 20 GLU CB 1 1 17 14719 1 1 20 GLU CD C 6.415 8.404 -8.269 1.00 . A A . 20 GLU CD 1 1 17 14720 1 1 20 GLU CG C 7.270 9.075 -7.215 1.00 . A A . 20 GLU CG 1 1 17 14721 1 1 20 GLU H H 5.169 10.081 -4.630 1.00 . A A . 20 GLU H 1 1 17 14722 1 1 20 GLU HA H 5.043 7.966 -6.592 1.00 . A A . 20 GLU HA 1 1 17 14723 1 1 20 GLU HB2 H 7.167 9.415 -5.123 1.00 . A A . 20 GLU HB2 1 1 17 14724 1 1 20 GLU HB3 H 7.537 7.755 -5.573 1.00 . A A . 20 GLU HB3 1 1 17 14725 1 1 20 GLU HG2 H 7.120 10.143 -7.276 1.00 . A A . 20 GLU HG2 1 1 17 14726 1 1 20 GLU HG3 H 8.308 8.847 -7.412 1.00 . A A . 20 GLU HG3 1 1 17 14727 1 1 20 GLU N N 4.698 9.382 -5.134 1.00 . A A . 20 GLU N 1 1 17 14728 1 1 20 GLU O O 6.284 6.656 -4.019 1.00 . A A . 20 GLU O 1 1 17 14729 1 1 20 GLU OE1 O 6.624 7.203 -8.536 1.00 . A A . 20 GLU OE1 1 1 17 14730 1 1 20 GLU OE2 O 5.523 9.071 -8.830 1.00 . A A . 20 GLU OE2 1 1 17 14731 1 1 21 LEU C C 3.117 4.268 -4.546 1.00 . A A . 21 LEU C 1 1 17 14732 1 1 21 LEU CA C 3.861 5.351 -3.767 1.00 . A A . 21 LEU CA 1 1 17 14733 1 1 21 LEU CB C 3.086 5.802 -2.519 1.00 . A A . 21 LEU CB 1 1 17 14734 1 1 21 LEU CD1 C 1.010 5.644 -1.154 1.00 . A A . 21 LEU CD1 1 1 17 14735 1 1 21 LEU CD2 C 0.937 6.757 -3.380 1.00 . A A . 21 LEU CD2 1 1 17 14736 1 1 21 LEU CG C 1.569 5.644 -2.564 1.00 . A A . 21 LEU CG 1 1 17 14737 1 1 21 LEU H H 3.402 6.850 -5.184 1.00 . A A . 21 LEU H 1 1 17 14738 1 1 21 LEU HA H 4.815 4.950 -3.457 1.00 . A A . 21 LEU HA 1 1 17 14739 1 1 21 LEU HB2 H 3.454 5.237 -1.677 1.00 . A A . 21 LEU HB2 1 1 17 14740 1 1 21 LEU HB3 H 3.310 6.846 -2.348 1.00 . A A . 21 LEU HB3 1 1 17 14741 1 1 21 LEU HD11 H -0.034 5.915 -1.182 1.00 . A A . 21 LEU HD11 1 1 17 14742 1 1 21 LEU HD12 H 1.117 4.659 -0.724 1.00 . A A . 21 LEU HD12 1 1 17 14743 1 1 21 LEU HD13 H 1.552 6.358 -0.554 1.00 . A A . 21 LEU HD13 1 1 17 14744 1 1 21 LEU HD21 H 0.411 7.429 -2.718 1.00 . A A . 21 LEU HD21 1 1 17 14745 1 1 21 LEU HD22 H 1.709 7.298 -3.904 1.00 . A A . 21 LEU HD22 1 1 17 14746 1 1 21 LEU HD23 H 0.244 6.333 -4.092 1.00 . A A . 21 LEU HD23 1 1 17 14747 1 1 21 LEU HG H 1.320 4.701 -3.028 1.00 . A A . 21 LEU HG 1 1 17 14748 1 1 21 LEU N N 4.127 6.491 -4.625 1.00 . A A . 21 LEU N 1 1 17 14749 1 1 21 LEU O O 2.682 4.500 -5.678 1.00 . A A . 21 LEU O 1 1 17 14750 1 1 22 LEU C C 1.133 1.583 -4.212 1.00 . A A . 22 LEU C 1 1 17 14751 1 1 22 LEU CA C 2.530 1.923 -4.709 1.00 . A A . 22 LEU CA 1 1 17 14752 1 1 22 LEU CB C 3.447 0.711 -4.542 1.00 . A A . 22 LEU CB 1 1 17 14753 1 1 22 LEU CD1 C 5.861 0.770 -5.214 1.00 . A A . 22 LEU CD1 1 1 17 14754 1 1 22 LEU CD2 C 4.324 -0.919 -6.228 1.00 . A A . 22 LEU CD2 1 1 17 14755 1 1 22 LEU CG C 4.441 0.494 -5.683 1.00 . A A . 22 LEU CG 1 1 17 14756 1 1 22 LEU H H 3.506 2.923 -3.121 1.00 . A A . 22 LEU H 1 1 17 14757 1 1 22 LEU HA H 2.476 2.178 -5.756 1.00 . A A . 22 LEU HA 1 1 17 14758 1 1 22 LEU HB2 H 4.003 0.829 -3.623 1.00 . A A . 22 LEU HB2 1 1 17 14759 1 1 22 LEU HB3 H 2.829 -0.171 -4.458 1.00 . A A . 22 LEU HB3 1 1 17 14760 1 1 22 LEU HD11 H 5.907 0.689 -4.138 1.00 . A A . 22 LEU HD11 1 1 17 14761 1 1 22 LEU HD12 H 6.532 0.051 -5.659 1.00 . A A . 22 LEU HD12 1 1 17 14762 1 1 22 LEU HD13 H 6.151 1.767 -5.513 1.00 . A A . 22 LEU HD13 1 1 17 14763 1 1 22 LEU HD21 H 3.298 -1.111 -6.513 1.00 . A A . 22 LEU HD21 1 1 17 14764 1 1 22 LEU HD22 H 4.962 -1.024 -7.093 1.00 . A A . 22 LEU HD22 1 1 17 14765 1 1 22 LEU HD23 H 4.625 -1.624 -5.470 1.00 . A A . 22 LEU HD23 1 1 17 14766 1 1 22 LEU HG H 4.215 1.182 -6.484 1.00 . A A . 22 LEU HG 1 1 17 14767 1 1 22 LEU N N 3.088 3.064 -4.002 1.00 . A A . 22 LEU N 1 1 17 14768 1 1 22 LEU O O 0.849 1.663 -3.020 1.00 . A A . 22 LEU O 1 1 17 14769 1 1 23 CYS C C -1.199 -0.802 -5.197 1.00 . A A . 23 CYS C 1 1 17 14770 1 1 23 CYS CA C -1.039 0.654 -4.778 1.00 . A A . 23 CYS CA 1 1 17 14771 1 1 23 CYS CB C -2.099 1.523 -5.459 1.00 . A A . 23 CYS CB 1 1 17 14772 1 1 23 CYS H H 0.613 1.004 -6.050 1.00 . A A . 23 CYS H 1 1 17 14773 1 1 23 CYS HA H -1.151 0.728 -3.706 1.00 . A A . 23 CYS HA 1 1 17 14774 1 1 23 CYS HB2 H -2.202 1.211 -6.487 1.00 . A A . 23 CYS HB2 1 1 17 14775 1 1 23 CYS HB3 H -3.044 1.387 -4.950 1.00 . A A . 23 CYS HB3 1 1 17 14776 1 1 23 CYS HG H -2.781 3.934 -4.972 1.00 . A A . 23 CYS HG 1 1 17 14777 1 1 23 CYS N N 0.296 1.116 -5.125 1.00 . A A . 23 CYS N 1 1 17 14778 1 1 23 CYS O O -0.534 -1.256 -6.131 1.00 . A A . 23 CYS O 1 1 17 14779 1 1 23 CYS SG S -1.722 3.293 -5.458 1.00 . A A . 23 CYS SG 1 1 17 14780 1 1 24 CYS C C -2.742 -3.195 -6.152 1.00 . A A . 24 CYS C 1 1 17 14781 1 1 24 CYS CA C -2.229 -2.960 -4.732 1.00 . A A . 24 CYS CA 1 1 17 14782 1 1 24 CYS CB C -3.211 -3.548 -3.715 1.00 . A A . 24 CYS CB 1 1 17 14783 1 1 24 CYS H H -2.484 -1.132 -3.701 1.00 . A A . 24 CYS H 1 1 17 14784 1 1 24 CYS HA H -1.275 -3.454 -4.622 1.00 . A A . 24 CYS HA 1 1 17 14785 1 1 24 CYS HB2 H -2.941 -3.203 -2.727 1.00 . A A . 24 CYS HB2 1 1 17 14786 1 1 24 CYS HB3 H -4.209 -3.203 -3.948 1.00 . A A . 24 CYS HB3 1 1 17 14787 1 1 24 CYS N N -2.028 -1.541 -4.468 1.00 . A A . 24 CYS N 1 1 17 14788 1 1 24 CYS O O -3.271 -2.291 -6.803 1.00 . A A . 24 CYS O 1 1 17 14789 1 1 24 CYS SG S -3.253 -5.368 -3.667 1.00 . A A . 24 CYS SG 1 1 17 14790 1 1 25 ASP C C -4.588 -4.963 -7.936 1.00 . A A . 25 ASP C 1 1 17 14791 1 1 25 ASP CA C -3.075 -4.802 -7.939 1.00 . A A . 25 ASP CA 1 1 17 14792 1 1 25 ASP CB C -2.418 -6.108 -8.391 1.00 . A A . 25 ASP CB 1 1 17 14793 1 1 25 ASP CG C -2.729 -6.454 -9.839 1.00 . A A . 25 ASP CG 1 1 17 14794 1 1 25 ASP H H -2.204 -5.108 -6.032 1.00 . A A . 25 ASP H 1 1 17 14795 1 1 25 ASP HA H -2.807 -4.012 -8.626 1.00 . A A . 25 ASP HA 1 1 17 14796 1 1 25 ASP HB2 H -1.348 -6.021 -8.285 1.00 . A A . 25 ASP HB2 1 1 17 14797 1 1 25 ASP HB3 H -2.773 -6.914 -7.766 1.00 . A A . 25 ASP HB3 1 1 17 14798 1 1 25 ASP N N -2.604 -4.426 -6.613 1.00 . A A . 25 ASP N 1 1 17 14799 1 1 25 ASP O O -5.263 -4.630 -8.910 1.00 . A A . 25 ASP O 1 1 17 14800 1 1 25 ASP OD1 O -2.238 -5.746 -10.746 1.00 . A A . 25 ASP OD1 1 1 17 14801 1 1 25 ASP OD2 O -3.444 -7.450 -10.078 1.00 . A A . 25 ASP OD2 1 1 17 14802 1 1 26 THR C C -7.225 -4.624 -5.885 1.00 . A A . 26 THR C 1 1 17 14803 1 1 26 THR CA C -6.545 -5.707 -6.715 1.00 . A A . 26 THR CA 1 1 17 14804 1 1 26 THR CB C -6.825 -7.081 -6.072 1.00 . A A . 26 THR CB 1 1 17 14805 1 1 26 THR CG2 C -6.513 -8.206 -7.045 1.00 . A A . 26 THR CG2 1 1 17 14806 1 1 26 THR H H -4.526 -5.714 -6.086 1.00 . A A . 26 THR H 1 1 17 14807 1 1 26 THR HA H -6.967 -5.705 -7.709 1.00 . A A . 26 THR HA 1 1 17 14808 1 1 26 THR HB H -7.870 -7.134 -5.806 1.00 . A A . 26 THR HB 1 1 17 14809 1 1 26 THR HG1 H -6.450 -6.764 -4.155 1.00 . A A . 26 THR HG1 1 1 17 14810 1 1 26 THR HG21 H -6.641 -9.156 -6.548 1.00 . A A . 26 THR HG21 1 1 17 14811 1 1 26 THR HG22 H -5.493 -8.114 -7.387 1.00 . A A . 26 THR HG22 1 1 17 14812 1 1 26 THR HG23 H -7.184 -8.147 -7.890 1.00 . A A . 26 THR HG23 1 1 17 14813 1 1 26 THR N N -5.116 -5.472 -6.832 1.00 . A A . 26 THR N 1 1 17 14814 1 1 26 THR O O -8.366 -4.243 -6.154 1.00 . A A . 26 THR O 1 1 17 14815 1 1 26 THR OG1 O -6.030 -7.239 -4.889 1.00 . A A . 26 THR OG1 1 1 17 14816 1 1 27 CYS C C -6.502 -1.870 -4.006 1.00 . A A . 27 CYS C 1 1 17 14817 1 1 27 CYS CA C -7.145 -3.254 -3.890 1.00 . A A . 27 CYS CA 1 1 17 14818 1 1 27 CYS CB C -6.994 -3.809 -2.477 1.00 . A A . 27 CYS CB 1 1 17 14819 1 1 27 CYS H H -5.672 -4.570 -4.631 1.00 . A A . 27 CYS H 1 1 17 14820 1 1 27 CYS HA H -8.195 -3.170 -4.123 1.00 . A A . 27 CYS HA 1 1 17 14821 1 1 27 CYS HB2 H -6.144 -3.342 -2.000 1.00 . A A . 27 CYS HB2 1 1 17 14822 1 1 27 CYS HB3 H -7.887 -3.584 -1.910 1.00 . A A . 27 CYS HB3 1 1 17 14823 1 1 27 CYS N N -6.558 -4.194 -4.825 1.00 . A A . 27 CYS N 1 1 17 14824 1 1 27 CYS O O -5.482 -1.704 -4.672 1.00 . A A . 27 CYS O 1 1 17 14825 1 1 27 CYS SG S -6.741 -5.610 -2.424 1.00 . A A . 27 CYS SG 1 1 17 14826 1 1 28 PRO C C -5.712 0.919 -2.424 1.00 . A A . 28 PRO C 1 1 17 14827 1 1 28 PRO CA C -6.664 0.534 -3.554 1.00 . A A . 28 PRO CA 1 1 17 14828 1 1 28 PRO CB C -7.951 1.345 -3.474 1.00 . A A . 28 PRO CB 1 1 17 14829 1 1 28 PRO CD C -8.448 -0.905 -2.755 1.00 . A A . 28 PRO CD 1 1 17 14830 1 1 28 PRO CG C -8.864 0.538 -2.612 1.00 . A A . 28 PRO CG 1 1 17 14831 1 1 28 PRO HA H -6.182 0.710 -4.503 1.00 . A A . 28 PRO HA 1 1 17 14832 1 1 28 PRO HB2 H -7.742 2.310 -3.037 1.00 . A A . 28 PRO HB2 1 1 17 14833 1 1 28 PRO HB3 H -8.359 1.474 -4.467 1.00 . A A . 28 PRO HB3 1 1 17 14834 1 1 28 PRO HD2 H -8.341 -1.364 -1.784 1.00 . A A . 28 PRO HD2 1 1 17 14835 1 1 28 PRO HD3 H -9.170 -1.447 -3.349 1.00 . A A . 28 PRO HD3 1 1 17 14836 1 1 28 PRO HG2 H -8.766 0.853 -1.584 1.00 . A A . 28 PRO HG2 1 1 17 14837 1 1 28 PRO HG3 H -9.885 0.666 -2.944 1.00 . A A . 28 PRO HG3 1 1 17 14838 1 1 28 PRO N N -7.145 -0.838 -3.446 1.00 . A A . 28 PRO N 1 1 17 14839 1 1 28 PRO O O -5.267 2.066 -2.347 1.00 . A A . 28 PRO O 1 1 17 14840 1 1 29 SER C C -3.116 0.673 -0.991 1.00 . A A . 29 SER C 1 1 17 14841 1 1 29 SER CA C -4.467 0.196 -0.464 1.00 . A A . 29 SER CA 1 1 17 14842 1 1 29 SER CB C -4.296 -1.077 0.369 1.00 . A A . 29 SER CB 1 1 17 14843 1 1 29 SER H H -5.751 -0.942 -1.692 1.00 . A A . 29 SER H 1 1 17 14844 1 1 29 SER HA H -4.889 0.971 0.160 1.00 . A A . 29 SER HA 1 1 17 14845 1 1 29 SER HB2 H -3.301 -1.470 0.224 1.00 . A A . 29 SER HB2 1 1 17 14846 1 1 29 SER HB3 H -4.443 -0.841 1.413 1.00 . A A . 29 SER HB3 1 1 17 14847 1 1 29 SER HG H -4.769 -2.918 -0.141 1.00 . A A . 29 SER HG 1 1 17 14848 1 1 29 SER N N -5.386 -0.042 -1.565 1.00 . A A . 29 SER N 1 1 17 14849 1 1 29 SER O O -2.519 0.040 -1.860 1.00 . A A . 29 SER O 1 1 17 14850 1 1 29 SER OG O -5.237 -2.071 -0.011 1.00 . A A . 29 SER OG 1 1 17 14851 1 1 30 SER C C -0.416 2.521 0.021 1.00 . A A . 30 SER C 1 1 17 14852 1 1 30 SER CA C -1.497 2.474 -1.055 1.00 . A A . 30 SER CA 1 1 17 14853 1 1 30 SER CB C -1.823 3.877 -1.558 1.00 . A A . 30 SER CB 1 1 17 14854 1 1 30 SER H H -3.275 2.354 0.074 1.00 . A A . 30 SER H 1 1 17 14855 1 1 30 SER HA H -1.139 1.881 -1.882 1.00 . A A . 30 SER HA 1 1 17 14856 1 1 30 SER HB2 H -1.512 4.606 -0.823 1.00 . A A . 30 SER HB2 1 1 17 14857 1 1 30 SER HB3 H -1.302 4.054 -2.487 1.00 . A A . 30 SER HB3 1 1 17 14858 1 1 30 SER HG H -3.642 3.147 -1.695 1.00 . A A . 30 SER HG 1 1 17 14859 1 1 30 SER N N -2.709 1.855 -0.554 1.00 . A A . 30 SER N 1 1 17 14860 1 1 30 SER O O -0.701 2.806 1.188 1.00 . A A . 30 SER O 1 1 17 14861 1 1 30 SER OG O -3.219 4.014 -1.781 1.00 . A A . 30 SER OG 1 1 17 14862 1 1 31 TYR C C 3.226 2.639 -0.113 1.00 . A A . 31 TYR C 1 1 17 14863 1 1 31 TYR CA C 1.936 2.163 0.562 1.00 . A A . 31 TYR CA 1 1 17 14864 1 1 31 TYR CB C 2.151 0.741 1.095 1.00 . A A . 31 TYR CB 1 1 17 14865 1 1 31 TYR CD1 C 0.740 0.676 3.199 1.00 . A A . 31 TYR CD1 1 1 17 14866 1 1 31 TYR CD2 C 0.208 -0.825 1.424 1.00 . A A . 31 TYR CD2 1 1 17 14867 1 1 31 TYR CE1 C -0.291 0.152 3.954 1.00 . A A . 31 TYR CE1 1 1 17 14868 1 1 31 TYR CE2 C -0.826 -1.348 2.173 1.00 . A A . 31 TYR CE2 1 1 17 14869 1 1 31 TYR CG C 1.011 0.192 1.921 1.00 . A A . 31 TYR CG 1 1 17 14870 1 1 31 TYR CZ C -1.071 -0.856 3.434 1.00 . A A . 31 TYR CZ 1 1 17 14871 1 1 31 TYR H H 0.967 1.957 -1.313 1.00 . A A . 31 TYR H 1 1 17 14872 1 1 31 TYR HA H 1.707 2.819 1.387 1.00 . A A . 31 TYR HA 1 1 17 14873 1 1 31 TYR HB2 H 2.300 0.074 0.260 1.00 . A A . 31 TYR HB2 1 1 17 14874 1 1 31 TYR HB3 H 3.038 0.733 1.714 1.00 . A A . 31 TYR HB3 1 1 17 14875 1 1 31 TYR HD1 H 1.354 1.468 3.606 1.00 . A A . 31 TYR HD1 1 1 17 14876 1 1 31 TYR HD2 H 0.400 -1.210 0.435 1.00 . A A . 31 TYR HD2 1 1 17 14877 1 1 31 TYR HE1 H -0.487 0.540 4.942 1.00 . A A . 31 TYR HE1 1 1 17 14878 1 1 31 TYR HE2 H -1.438 -2.140 1.768 1.00 . A A . 31 TYR HE2 1 1 17 14879 1 1 31 TYR HH H -1.710 -1.981 4.858 1.00 . A A . 31 TYR HH 1 1 17 14880 1 1 31 TYR N N 0.811 2.195 -0.367 1.00 . A A . 31 TYR N 1 1 17 14881 1 1 31 TYR O O 3.252 2.880 -1.316 1.00 . A A . 31 TYR O 1 1 17 14882 1 1 31 TYR OH O -2.089 -1.388 4.185 1.00 . A A . 31 TYR OH 1 1 17 14883 1 1 32 HIS C C 6.065 1.422 -0.565 1.00 . A A . 32 HIS C 1 1 17 14884 1 1 32 HIS CA C 5.671 2.737 0.107 1.00 . A A . 32 HIS CA 1 1 17 14885 1 1 32 HIS CB C 6.686 3.018 1.239 1.00 . A A . 32 HIS CB 1 1 17 14886 1 1 32 HIS CD2 C 7.818 5.323 1.482 1.00 . A A . 32 HIS CD2 1 1 17 14887 1 1 32 HIS CE1 C 6.526 6.119 3.052 1.00 . A A . 32 HIS CE1 1 1 17 14888 1 1 32 HIS CG C 6.827 4.435 1.731 1.00 . A A . 32 HIS CG 1 1 17 14889 1 1 32 HIS H H 4.236 2.179 1.544 1.00 . A A . 32 HIS H 1 1 17 14890 1 1 32 HIS HA H 5.669 3.541 -0.613 1.00 . A A . 32 HIS HA 1 1 17 14891 1 1 32 HIS HB2 H 6.415 2.419 2.093 1.00 . A A . 32 HIS HB2 1 1 17 14892 1 1 32 HIS HB3 H 7.661 2.700 0.900 1.00 . A A . 32 HIS HB3 1 1 17 14893 1 1 32 HIS HD2 H 8.610 5.219 0.757 1.00 . A A . 32 HIS HD2 1 1 17 14894 1 1 32 HIS HE1 H 6.121 6.771 3.810 1.00 . A A . 32 HIS HE1 1 1 17 14895 1 1 32 HIS HE2 H 8.122 7.239 2.308 1.00 . A A . 32 HIS HE2 1 1 17 14896 1 1 32 HIS N N 4.323 2.561 0.641 1.00 . A A . 32 HIS N 1 1 17 14897 1 1 32 HIS ND1 N 6.008 4.953 2.715 1.00 . A A . 32 HIS ND1 1 1 17 14898 1 1 32 HIS NE2 N 7.627 6.387 2.328 1.00 . A A . 32 HIS NE2 1 1 17 14899 1 1 32 HIS O O 5.366 0.922 -1.446 1.00 . A A . 32 HIS O 1 1 17 14900 1 1 33 ILE C C 7.640 -1.482 0.841 1.00 . A A . 33 ILE C 1 1 17 14901 1 1 33 ILE CA C 7.428 -0.590 -0.390 1.00 . A A . 33 ILE CA 1 1 17 14902 1 1 33 ILE CB C 8.709 -0.612 -1.259 1.00 . A A . 33 ILE CB 1 1 17 14903 1 1 33 ILE CD1 C 11.130 -1.042 -0.604 1.00 . A A . 33 ILE CD1 1 1 17 14904 1 1 33 ILE CG1 C 9.923 -0.143 -0.451 1.00 . A A . 33 ILE CG1 1 1 17 14905 1 1 33 ILE CG2 C 8.534 0.253 -2.500 1.00 . A A . 33 ILE CG2 1 1 17 14906 1 1 33 ILE H H 7.533 1.174 0.765 1.00 . A A . 33 ILE H 1 1 17 14907 1 1 33 ILE HA H 6.612 -0.991 -0.975 1.00 . A A . 33 ILE HA 1 1 17 14908 1 1 33 ILE HB H 8.874 -1.628 -1.583 1.00 . A A . 33 ILE HB 1 1 17 14909 1 1 33 ILE HD11 H 11.057 -1.868 0.090 1.00 . A A . 33 ILE HD11 1 1 17 14910 1 1 33 ILE HD12 H 11.169 -1.424 -1.613 1.00 . A A . 33 ILE HD12 1 1 17 14911 1 1 33 ILE HD13 H 12.028 -0.477 -0.397 1.00 . A A . 33 ILE HD13 1 1 17 14912 1 1 33 ILE HG12 H 10.204 0.846 -0.775 1.00 . A A . 33 ILE HG12 1 1 17 14913 1 1 33 ILE HG21 H 7.759 0.982 -2.321 1.00 . A A . 33 ILE HG21 1 1 17 14914 1 1 33 ILE HG22 H 9.462 0.760 -2.717 1.00 . A A . 33 ILE HG22 1 1 17 14915 1 1 33 ILE HG23 H 8.257 -0.370 -3.338 1.00 . A A . 33 ILE HG23 1 1 17 14916 1 1 33 ILE N N 7.069 0.765 0.008 1.00 . A A . 33 ILE N 1 1 17 14917 1 1 33 ILE O O 8.201 -2.575 0.733 1.00 . A A . 33 ILE O 1 1 17 14918 1 1 34 HIS C C 6.637 -1.306 4.409 1.00 . A A . 34 HIS C 1 1 17 14919 1 1 34 HIS CA C 7.585 -1.684 3.269 1.00 . A A . 34 HIS CA 1 1 17 14920 1 1 34 HIS CB C 9.033 -1.389 3.689 1.00 . A A . 34 HIS CB 1 1 17 14921 1 1 34 HIS CD2 C 9.551 0.760 5.038 1.00 . A A . 34 HIS CD2 1 1 17 14922 1 1 34 HIS CE1 C 9.725 2.125 3.351 1.00 . A A . 34 HIS CE1 1 1 17 14923 1 1 34 HIS CG C 9.334 0.074 3.889 1.00 . A A . 34 HIS CG 1 1 17 14924 1 1 34 HIS H H 6.894 -0.077 2.068 1.00 . A A . 34 HIS H 1 1 17 14925 1 1 34 HIS HA H 7.488 -2.742 3.077 1.00 . A A . 34 HIS HA 1 1 17 14926 1 1 34 HIS HB2 H 9.239 -1.898 4.620 1.00 . A A . 34 HIS HB2 1 1 17 14927 1 1 34 HIS HB3 H 9.702 -1.765 2.928 1.00 . A A . 34 HIS HB3 1 1 17 14928 1 1 34 HIS HD2 H 9.525 0.363 6.041 1.00 . A A . 34 HIS HD2 1 1 17 14929 1 1 34 HIS HE1 H 9.876 3.025 2.771 1.00 . A A . 34 HIS HE1 1 1 17 14930 1 1 34 HIS HE2 H 10.236 2.739 5.265 1.00 . A A . 34 HIS HE2 1 1 17 14931 1 1 34 HIS N N 7.281 -0.976 2.025 1.00 . A A . 34 HIS N 1 1 17 14932 1 1 34 HIS ND1 N 9.444 0.942 2.827 1.00 . A A . 34 HIS ND1 1 1 17 14933 1 1 34 HIS NE2 N 9.803 2.065 4.686 1.00 . A A . 34 HIS NE2 1 1 17 14934 1 1 34 HIS O O 6.969 -1.483 5.580 1.00 . A A . 34 HIS O 1 1 17 14935 1 1 35 CYS C C 3.617 -1.388 5.541 1.00 . A A . 35 CYS C 1 1 17 14936 1 1 35 CYS CA C 4.555 -0.266 5.096 1.00 . A A . 35 CYS CA 1 1 17 14937 1 1 35 CYS CB C 3.754 0.887 4.515 1.00 . A A . 35 CYS CB 1 1 17 14938 1 1 35 CYS H H 5.293 -0.553 3.135 1.00 . A A . 35 CYS H 1 1 17 14939 1 1 35 CYS HA H 5.123 0.084 5.945 1.00 . A A . 35 CYS HA 1 1 17 14940 1 1 35 CYS HB2 H 2.843 0.506 4.075 1.00 . A A . 35 CYS HB2 1 1 17 14941 1 1 35 CYS HB3 H 3.515 1.590 5.296 1.00 . A A . 35 CYS HB3 1 1 17 14942 1 1 35 CYS N N 5.487 -0.739 4.078 1.00 . A A . 35 CYS N 1 1 17 14943 1 1 35 CYS O O 2.723 -1.182 6.364 1.00 . A A . 35 CYS O 1 1 17 14944 1 1 35 CYS SG S 4.676 1.772 3.226 1.00 . A A . 35 CYS SG 1 1 17 14945 1 1 36 LEU C C 3.775 -4.840 5.812 1.00 . A A . 36 LEU C 1 1 17 14946 1 1 36 LEU CA C 2.959 -3.707 5.202 1.00 . A A . 36 LEU CA 1 1 17 14947 1 1 36 LEU CB C 2.297 -4.169 3.899 1.00 . A A . 36 LEU CB 1 1 17 14948 1 1 36 LEU CD1 C 2.685 -5.386 1.741 1.00 . A A . 36 LEU CD1 1 1 17 14949 1 1 36 LEU CD2 C 3.429 -3.021 1.968 1.00 . A A . 36 LEU CD2 1 1 17 14950 1 1 36 LEU CG C 3.235 -4.340 2.697 1.00 . A A . 36 LEU CG 1 1 17 14951 1 1 36 LEU H H 4.527 -2.635 4.292 1.00 . A A . 36 LEU H 1 1 17 14952 1 1 36 LEU HA H 2.193 -3.412 5.902 1.00 . A A . 36 LEU HA 1 1 17 14953 1 1 36 LEU HB2 H 1.812 -5.118 4.085 1.00 . A A . 36 LEU HB2 1 1 17 14954 1 1 36 LEU HB3 H 1.539 -3.448 3.631 1.00 . A A . 36 LEU HB3 1 1 17 14955 1 1 36 LEU HD11 H 3.334 -6.248 1.740 1.00 . A A . 36 LEU HD11 1 1 17 14956 1 1 36 LEU HD12 H 1.695 -5.680 2.057 1.00 . A A . 36 LEU HD12 1 1 17 14957 1 1 36 LEU HD13 H 2.637 -4.972 0.745 1.00 . A A . 36 LEU HD13 1 1 17 14958 1 1 36 LEU HD21 H 2.560 -2.813 1.360 1.00 . A A . 36 LEU HD21 1 1 17 14959 1 1 36 LEU HD22 H 3.562 -2.227 2.689 1.00 . A A . 36 LEU HD22 1 1 17 14960 1 1 36 LEU HD23 H 4.303 -3.083 1.337 1.00 . A A . 36 LEU HD23 1 1 17 14961 1 1 36 LEU HG H 4.201 -4.680 3.046 1.00 . A A . 36 LEU HG 1 1 17 14962 1 1 36 LEU N N 3.805 -2.553 4.947 1.00 . A A . 36 LEU N 1 1 17 14963 1 1 36 LEU O O 4.959 -4.668 6.102 1.00 . A A . 36 LEU O 1 1 17 14964 1 1 37 ARG C C 5.012 -7.583 5.787 1.00 . A A . 37 ARG C 1 1 17 14965 1 1 37 ARG CA C 3.791 -7.154 6.609 1.00 . A A . 37 ARG CA 1 1 17 14966 1 1 37 ARG CB C 2.814 -8.329 6.766 1.00 . A A . 37 ARG CB 1 1 17 14967 1 1 37 ARG CD C 1.182 -9.047 8.524 1.00 . A A . 37 ARG CD 1 1 17 14968 1 1 37 ARG CG C 1.537 -7.978 7.505 1.00 . A A . 37 ARG CG 1 1 17 14969 1 1 37 ARG CZ C -0.826 -10.380 9.040 1.00 . A A . 37 ARG CZ 1 1 17 14970 1 1 37 ARG H H 2.181 -6.047 5.784 1.00 . A A . 37 ARG H 1 1 17 14971 1 1 37 ARG HA H 4.133 -6.861 7.592 1.00 . A A . 37 ARG HA 1 1 17 14972 1 1 37 ARG HB2 H 2.546 -8.691 5.785 1.00 . A A . 37 ARG HB2 1 1 17 14973 1 1 37 ARG HB3 H 3.311 -9.122 7.308 1.00 . A A . 37 ARG HB3 1 1 17 14974 1 1 37 ARG HD2 H 2.009 -9.734 8.608 1.00 . A A . 37 ARG HD2 1 1 17 14975 1 1 37 ARG HD3 H 1.015 -8.570 9.479 1.00 . A A . 37 ARG HD3 1 1 17 14976 1 1 37 ARG HE H -0.236 -9.853 7.191 1.00 . A A . 37 ARG HE 1 1 17 14977 1 1 37 ARG HG2 H 1.673 -7.038 8.017 1.00 . A A . 37 ARG HG2 1 1 17 14978 1 1 37 ARG HG3 H 0.730 -7.890 6.792 1.00 . A A . 37 ARG HG3 1 1 17 14979 1 1 37 ARG HH11 H 0.293 -9.862 10.656 1.00 . A A . 37 ARG HH11 1 1 17 14980 1 1 37 ARG HH12 H -1.136 -10.795 11.010 1.00 . A A . 37 ARG HH12 1 1 17 14981 1 1 37 ARG HH21 H -2.135 -11.064 7.644 1.00 . A A . 37 ARG HH21 1 1 17 14982 1 1 37 ARG HH22 H -2.533 -11.457 9.293 1.00 . A A . 37 ARG HH22 1 1 17 14983 1 1 37 ARG N N 3.131 -5.989 6.015 1.00 . A A . 37 ARG N 1 1 17 14984 1 1 37 ARG NE N -0.018 -9.793 8.154 1.00 . A A . 37 ARG NE 1 1 17 14985 1 1 37 ARG NH1 N -0.536 -10.339 10.338 1.00 . A A . 37 ARG NH1 1 1 17 14986 1 1 37 ARG NH2 N -1.915 -11.017 8.628 1.00 . A A . 37 ARG NH2 1 1 17 14987 1 1 37 ARG O O 6.137 -7.515 6.281 1.00 . A A . 37 ARG O 1 1 17 14988 1 1 38 PRO C C 6.655 -7.137 3.073 1.00 . A A . 38 PRO C 1 1 17 14989 1 1 38 PRO CA C 5.955 -8.362 3.650 1.00 . A A . 38 PRO CA 1 1 17 14990 1 1 38 PRO CB C 5.307 -9.192 2.530 1.00 . A A . 38 PRO CB 1 1 17 14991 1 1 38 PRO CD C 3.572 -8.082 3.771 1.00 . A A . 38 PRO CD 1 1 17 14992 1 1 38 PRO CG C 3.838 -9.209 2.814 1.00 . A A . 38 PRO CG 1 1 17 14993 1 1 38 PRO HA H 6.674 -8.968 4.181 1.00 . A A . 38 PRO HA 1 1 17 14994 1 1 38 PRO HB2 H 5.515 -8.730 1.576 1.00 . A A . 38 PRO HB2 1 1 17 14995 1 1 38 PRO HB3 H 5.717 -10.190 2.543 1.00 . A A . 38 PRO HB3 1 1 17 14996 1 1 38 PRO HD2 H 3.366 -7.167 3.234 1.00 . A A . 38 PRO HD2 1 1 17 14997 1 1 38 PRO HD3 H 2.756 -8.329 4.433 1.00 . A A . 38 PRO HD3 1 1 17 14998 1 1 38 PRO HG2 H 3.286 -9.060 1.899 1.00 . A A . 38 PRO HG2 1 1 17 14999 1 1 38 PRO HG3 H 3.566 -10.152 3.264 1.00 . A A . 38 PRO HG3 1 1 17 15000 1 1 38 PRO N N 4.837 -7.987 4.506 1.00 . A A . 38 PRO N 1 1 17 15001 1 1 38 PRO O O 6.219 -6.569 2.067 1.00 . A A . 38 PRO O 1 1 17 15002 1 1 39 ALA C C 9.469 -5.945 2.216 1.00 . A A . 39 ALA C 1 1 17 15003 1 1 39 ALA CA C 8.480 -5.553 3.302 1.00 . A A . 39 ALA CA 1 1 17 15004 1 1 39 ALA CB C 9.207 -4.927 4.481 1.00 . A A . 39 ALA CB 1 1 17 15005 1 1 39 ALA H H 8.007 -7.203 4.542 1.00 . A A . 39 ALA H 1 1 17 15006 1 1 39 ALA HA H 7.788 -4.824 2.905 1.00 . A A . 39 ALA HA 1 1 17 15007 1 1 39 ALA HB1 H 10.092 -5.504 4.705 1.00 . A A . 39 ALA HB1 1 1 17 15008 1 1 39 ALA HB2 H 9.491 -3.915 4.233 1.00 . A A . 39 ALA HB2 1 1 17 15009 1 1 39 ALA HB3 H 8.556 -4.918 5.341 1.00 . A A . 39 ALA HB3 1 1 17 15010 1 1 39 ALA N N 7.720 -6.713 3.736 1.00 . A A . 39 ALA N 1 1 17 15011 1 1 39 ALA O O 10.024 -7.045 2.237 1.00 . A A . 39 ALA O 1 1 17 15012 1 1 40 LEU C C 11.917 -4.652 0.385 1.00 . A A . 40 LEU C 1 1 17 15013 1 1 40 LEU CA C 10.576 -5.335 0.153 1.00 . A A . 40 LEU CA 1 1 17 15014 1 1 40 LEU CB C 9.961 -4.866 -1.167 1.00 . A A . 40 LEU CB 1 1 17 15015 1 1 40 LEU CD1 C 7.652 -5.846 -1.266 1.00 . A A . 40 LEU CD1 1 1 17 15016 1 1 40 LEU CD2 C 9.013 -5.635 -3.354 1.00 . A A . 40 LEU CD2 1 1 17 15017 1 1 40 LEU CG C 9.054 -5.888 -1.856 1.00 . A A . 40 LEU CG 1 1 17 15018 1 1 40 LEU H H 9.189 -4.201 1.279 1.00 . A A . 40 LEU H 1 1 17 15019 1 1 40 LEU HA H 10.731 -6.402 0.110 1.00 . A A . 40 LEU HA 1 1 17 15020 1 1 40 LEU HB2 H 9.383 -3.972 -0.975 1.00 . A A . 40 LEU HB2 1 1 17 15021 1 1 40 LEU HB3 H 10.764 -4.618 -1.844 1.00 . A A . 40 LEU HB3 1 1 17 15022 1 1 40 LEU HD11 H 7.610 -6.483 -0.394 1.00 . A A . 40 LEU HD11 1 1 17 15023 1 1 40 LEU HD12 H 7.408 -4.833 -0.984 1.00 . A A . 40 LEU HD12 1 1 17 15024 1 1 40 LEU HD13 H 6.942 -6.196 -2.001 1.00 . A A . 40 LEU HD13 1 1 17 15025 1 1 40 LEU HD21 H 10.015 -5.689 -3.756 1.00 . A A . 40 LEU HD21 1 1 17 15026 1 1 40 LEU HD22 H 8.394 -6.379 -3.831 1.00 . A A . 40 LEU HD22 1 1 17 15027 1 1 40 LEU HD23 H 8.604 -4.654 -3.542 1.00 . A A . 40 LEU HD23 1 1 17 15028 1 1 40 LEU HG H 9.453 -6.880 -1.695 1.00 . A A . 40 LEU HG 1 1 17 15029 1 1 40 LEU N N 9.670 -5.060 1.256 1.00 . A A . 40 LEU N 1 1 17 15030 1 1 40 LEU O O 12.034 -3.777 1.246 1.00 . A A . 40 LEU O 1 1 17 15031 1 1 41 TYR C C 14.375 -3.276 -1.197 1.00 . A A . 41 TYR C 1 1 17 15032 1 1 41 TYR CA C 14.251 -4.467 -0.259 1.00 . A A . 41 TYR CA 1 1 17 15033 1 1 41 TYR CB C 15.329 -5.505 -0.589 1.00 . A A . 41 TYR CB 1 1 17 15034 1 1 41 TYR CD1 C 15.070 -7.096 1.360 1.00 . A A . 41 TYR CD1 1 1 17 15035 1 1 41 TYR CD2 C 14.791 -7.962 -0.844 1.00 . A A . 41 TYR CD2 1 1 17 15036 1 1 41 TYR CE1 C 14.822 -8.351 1.888 1.00 . A A . 41 TYR CE1 1 1 17 15037 1 1 41 TYR CE2 C 14.541 -9.218 -0.324 1.00 . A A . 41 TYR CE2 1 1 17 15038 1 1 41 TYR CG C 15.061 -6.881 -0.013 1.00 . A A . 41 TYR CG 1 1 17 15039 1 1 41 TYR CZ C 14.555 -9.407 1.042 1.00 . A A . 41 TYR CZ 1 1 17 15040 1 1 41 TYR H H 12.764 -5.751 -1.060 1.00 . A A . 41 TYR H 1 1 17 15041 1 1 41 TYR HA H 14.379 -4.131 0.759 1.00 . A A . 41 TYR HA 1 1 17 15042 1 1 41 TYR HB2 H 15.401 -5.606 -1.662 1.00 . A A . 41 TYR HB2 1 1 17 15043 1 1 41 TYR HB3 H 16.278 -5.162 -0.202 1.00 . A A . 41 TYR HB3 1 1 17 15044 1 1 41 TYR HD1 H 15.276 -6.267 2.021 1.00 . A A . 41 TYR HD1 1 1 17 15045 1 1 41 TYR HD2 H 14.784 -7.813 -1.913 1.00 . A A . 41 TYR HD2 1 1 17 15046 1 1 41 TYR HE1 H 14.833 -8.498 2.957 1.00 . A A . 41 TYR HE1 1 1 17 15047 1 1 41 TYR HE2 H 14.334 -10.046 -0.987 1.00 . A A . 41 TYR HE2 1 1 17 15048 1 1 41 TYR HH H 13.342 -10.803 1.579 1.00 . A A . 41 TYR HH 1 1 17 15049 1 1 41 TYR N N 12.923 -5.053 -0.379 1.00 . A A . 41 TYR N 1 1 17 15050 1 1 41 TYR O O 14.903 -2.223 -0.828 1.00 . A A . 41 TYR O 1 1 17 15051 1 1 41 TYR OH O 14.300 -10.657 1.564 1.00 . A A . 41 TYR OH 1 1 17 15052 1 1 42 GLU C C 12.438 -2.192 -3.958 1.00 . A A . 42 GLU C 1 1 17 15053 1 1 42 GLU CA C 13.836 -2.380 -3.389 1.00 . A A . 42 GLU CA 1 1 17 15054 1 1 42 GLU CB C 14.808 -2.730 -4.513 1.00 . A A . 42 GLU CB 1 1 17 15055 1 1 42 GLU CD C 16.861 -1.910 -5.710 1.00 . A A . 42 GLU CD 1 1 17 15056 1 1 42 GLU CG C 16.156 -2.048 -4.381 1.00 . A A . 42 GLU CG 1 1 17 15057 1 1 42 GLU H H 13.377 -4.282 -2.599 1.00 . A A . 42 GLU H 1 1 17 15058 1 1 42 GLU HA H 14.154 -1.465 -2.912 1.00 . A A . 42 GLU HA 1 1 17 15059 1 1 42 GLU HB2 H 14.967 -3.799 -4.517 1.00 . A A . 42 GLU HB2 1 1 17 15060 1 1 42 GLU HB3 H 14.369 -2.437 -5.456 1.00 . A A . 42 GLU HB3 1 1 17 15061 1 1 42 GLU HG2 H 16.008 -1.064 -3.966 1.00 . A A . 42 GLU HG2 1 1 17 15062 1 1 42 GLU HG3 H 16.779 -2.628 -3.717 1.00 . A A . 42 GLU HG3 1 1 17 15063 1 1 42 GLU N N 13.830 -3.437 -2.393 1.00 . A A . 42 GLU N 1 1 17 15064 1 1 42 GLU O O 11.555 -3.021 -3.725 1.00 . A A . 42 GLU O 1 1 17 15065 1 1 42 GLU OE1 O 17.438 -2.908 -6.187 1.00 . A A . 42 GLU OE1 1 1 17 15066 1 1 42 GLU OE2 O 16.853 -0.801 -6.279 1.00 . A A . 42 GLU OE2 1 1 17 15067 1 1 43 VAL C C 10.700 -2.119 -6.385 1.00 . A A . 43 VAL C 1 1 17 15068 1 1 43 VAL CA C 11.004 -0.937 -5.470 1.00 . A A . 43 VAL CA 1 1 17 15069 1 1 43 VAL CB C 11.031 0.366 -6.298 1.00 . A A . 43 VAL CB 1 1 17 15070 1 1 43 VAL CG1 C 9.699 0.595 -7.000 1.00 . A A . 43 VAL CG1 1 1 17 15071 1 1 43 VAL CG2 C 11.383 1.553 -5.414 1.00 . A A . 43 VAL CG2 1 1 17 15072 1 1 43 VAL H H 13.038 -0.587 -4.993 1.00 . A A . 43 VAL H 1 1 17 15073 1 1 43 VAL HA H 10.223 -0.857 -4.727 1.00 . A A . 43 VAL HA 1 1 17 15074 1 1 43 VAL HB H 11.798 0.272 -7.054 1.00 . A A . 43 VAL HB 1 1 17 15075 1 1 43 VAL HG11 H 9.158 -0.337 -7.053 1.00 . A A . 43 VAL HG11 1 1 17 15076 1 1 43 VAL HG12 H 9.119 1.318 -6.446 1.00 . A A . 43 VAL HG12 1 1 17 15077 1 1 43 VAL HG13 H 9.879 0.965 -7.998 1.00 . A A . 43 VAL HG13 1 1 17 15078 1 1 43 VAL HG21 H 10.516 1.839 -4.835 1.00 . A A . 43 VAL HG21 1 1 17 15079 1 1 43 VAL HG22 H 12.186 1.277 -4.747 1.00 . A A . 43 VAL HG22 1 1 17 15080 1 1 43 VAL HG23 H 11.694 2.384 -6.030 1.00 . A A . 43 VAL HG23 1 1 17 15081 1 1 43 VAL N N 12.268 -1.163 -4.781 1.00 . A A . 43 VAL N 1 1 17 15082 1 1 43 VAL O O 11.569 -2.552 -7.139 1.00 . A A . 43 VAL O 1 1 17 15083 1 1 44 PRO C C 9.266 -3.775 -8.479 1.00 . A A . 44 PRO C 1 1 17 15084 1 1 44 PRO CA C 9.139 -3.944 -6.969 1.00 . A A . 44 PRO CA 1 1 17 15085 1 1 44 PRO CB C 7.671 -4.183 -6.579 1.00 . A A . 44 PRO CB 1 1 17 15086 1 1 44 PRO CD C 8.486 -2.369 -5.248 1.00 . A A . 44 PRO CD 1 1 17 15087 1 1 44 PRO CG C 7.241 -2.960 -5.840 1.00 . A A . 44 PRO CG 1 1 17 15088 1 1 44 PRO HA H 9.734 -4.791 -6.658 1.00 . A A . 44 PRO HA 1 1 17 15089 1 1 44 PRO HB2 H 7.081 -4.327 -7.472 1.00 . A A . 44 PRO HB2 1 1 17 15090 1 1 44 PRO HB3 H 7.602 -5.061 -5.954 1.00 . A A . 44 PRO HB3 1 1 17 15091 1 1 44 PRO HD2 H 8.395 -1.295 -5.166 1.00 . A A . 44 PRO HD2 1 1 17 15092 1 1 44 PRO HD3 H 8.694 -2.808 -4.285 1.00 . A A . 44 PRO HD3 1 1 17 15093 1 1 44 PRO HG2 H 6.783 -2.262 -6.524 1.00 . A A . 44 PRO HG2 1 1 17 15094 1 1 44 PRO HG3 H 6.547 -3.231 -5.058 1.00 . A A . 44 PRO HG3 1 1 17 15095 1 1 44 PRO N N 9.515 -2.737 -6.227 1.00 . A A . 44 PRO N 1 1 17 15096 1 1 44 PRO O O 8.967 -2.712 -9.029 1.00 . A A . 44 PRO O 1 1 17 15097 1 1 45 ASP C C 8.757 -5.670 -11.225 1.00 . A A . 45 ASP C 1 1 17 15098 1 1 45 ASP CA C 9.853 -4.831 -10.588 1.00 . A A . 45 ASP CA 1 1 17 15099 1 1 45 ASP CB C 11.233 -5.371 -10.988 1.00 . A A . 45 ASP CB 1 1 17 15100 1 1 45 ASP CG C 11.257 -5.952 -12.393 1.00 . A A . 45 ASP CG 1 1 17 15101 1 1 45 ASP H H 9.908 -5.659 -8.640 1.00 . A A . 45 ASP H 1 1 17 15102 1 1 45 ASP HA H 9.758 -3.811 -10.930 1.00 . A A . 45 ASP HA 1 1 17 15103 1 1 45 ASP HB2 H 11.953 -4.568 -10.941 1.00 . A A . 45 ASP HB2 1 1 17 15104 1 1 45 ASP HB3 H 11.521 -6.147 -10.294 1.00 . A A . 45 ASP HB3 1 1 17 15105 1 1 45 ASP N N 9.706 -4.833 -9.140 1.00 . A A . 45 ASP N 1 1 17 15106 1 1 45 ASP O O 8.220 -5.324 -12.278 1.00 . A A . 45 ASP O 1 1 17 15107 1 1 45 ASP OD1 O 11.470 -5.187 -13.354 1.00 . A A . 45 ASP OD1 1 1 17 15108 1 1 45 ASP OD2 O 11.067 -7.177 -12.541 1.00 . A A . 45 ASP OD2 1 1 17 15109 1 1 46 GLY C C 6.027 -7.301 -10.576 1.00 . A A . 46 GLY C 1 1 17 15110 1 1 46 GLY CA C 7.404 -7.661 -11.085 1.00 . A A . 46 GLY CA 1 1 17 15111 1 1 46 GLY H H 8.887 -6.997 -9.734 1.00 . A A . 46 GLY H 1 1 17 15112 1 1 46 GLY HA2 H 7.402 -7.608 -12.164 1.00 . A A . 46 GLY HA2 1 1 17 15113 1 1 46 GLY HA3 H 7.635 -8.673 -10.785 1.00 . A A . 46 GLY HA3 1 1 17 15114 1 1 46 GLY N N 8.428 -6.777 -10.575 1.00 . A A . 46 GLY N 1 1 17 15115 1 1 46 GLY O O 5.359 -6.429 -11.132 1.00 . A A . 46 GLY O 1 1 17 15116 1 1 47 GLU C C 4.342 -7.226 -7.555 1.00 . A A . 47 GLU C 1 1 17 15117 1 1 47 GLU CA C 4.263 -7.761 -8.978 1.00 . A A . 47 GLU CA 1 1 17 15118 1 1 47 GLU CB C 3.461 -9.062 -8.997 1.00 . A A . 47 GLU CB 1 1 17 15119 1 1 47 GLU CD C 3.791 -11.003 -10.576 1.00 . A A . 47 GLU CD 1 1 17 15120 1 1 47 GLU CG C 3.227 -9.610 -10.393 1.00 . A A . 47 GLU CG 1 1 17 15121 1 1 47 GLU H H 6.159 -8.682 -9.135 1.00 . A A . 47 GLU H 1 1 17 15122 1 1 47 GLU HA H 3.763 -7.031 -9.597 1.00 . A A . 47 GLU HA 1 1 17 15123 1 1 47 GLU HB2 H 3.994 -9.808 -8.426 1.00 . A A . 47 GLU HB2 1 1 17 15124 1 1 47 GLU HB3 H 2.500 -8.887 -8.535 1.00 . A A . 47 GLU HB3 1 1 17 15125 1 1 47 GLU HG2 H 2.164 -9.640 -10.580 1.00 . A A . 47 GLU HG2 1 1 17 15126 1 1 47 GLU HG3 H 3.698 -8.950 -11.108 1.00 . A A . 47 GLU HG3 1 1 17 15127 1 1 47 GLU N N 5.588 -7.985 -9.532 1.00 . A A . 47 GLU N 1 1 17 15128 1 1 47 GLU O O 5.385 -7.303 -6.903 1.00 . A A . 47 GLU O 1 1 17 15129 1 1 47 GLU OE1 O 4.994 -11.209 -10.304 1.00 . A A . 47 GLU OE1 1 1 17 15130 1 1 47 GLU OE2 O 3.033 -11.901 -11.001 1.00 . A A . 47 GLU OE2 1 1 17 15131 1 1 48 TRP C C 1.639 -6.249 -5.273 1.00 . A A . 48 TRP C 1 1 17 15132 1 1 48 TRP CA C 3.103 -6.258 -5.701 1.00 . A A . 48 TRP CA 1 1 17 15133 1 1 48 TRP CB C 3.706 -4.856 -5.561 1.00 . A A . 48 TRP CB 1 1 17 15134 1 1 48 TRP CD1 C 4.651 -4.765 -3.182 1.00 . A A . 48 TRP CD1 1 1 17 15135 1 1 48 TRP CD2 C 2.848 -3.481 -3.506 1.00 . A A . 48 TRP CD2 1 1 17 15136 1 1 48 TRP CE2 C 3.251 -3.353 -2.167 1.00 . A A . 48 TRP CE2 1 1 17 15137 1 1 48 TRP CE3 C 1.734 -2.763 -3.945 1.00 . A A . 48 TRP CE3 1 1 17 15138 1 1 48 TRP CG C 3.754 -4.389 -4.139 1.00 . A A . 48 TRP CG 1 1 17 15139 1 1 48 TRP CH2 C 1.488 -1.850 -1.718 1.00 . A A . 48 TRP CH2 1 1 17 15140 1 1 48 TRP CZ2 C 2.575 -2.539 -1.260 1.00 . A A . 48 TRP CZ2 1 1 17 15141 1 1 48 TRP CZ3 C 1.066 -1.956 -3.044 1.00 . A A . 48 TRP CZ3 1 1 17 15142 1 1 48 TRP H H 2.408 -6.749 -7.631 1.00 . A A . 48 TRP H 1 1 17 15143 1 1 48 TRP HA H 3.645 -6.942 -5.066 1.00 . A A . 48 TRP HA 1 1 17 15144 1 1 48 TRP HB2 H 4.715 -4.863 -5.946 1.00 . A A . 48 TRP HB2 1 1 17 15145 1 1 48 TRP HB3 H 3.111 -4.155 -6.126 1.00 . A A . 48 TRP HB3 1 1 17 15146 1 1 48 TRP HD1 H 5.468 -5.452 -3.353 1.00 . A A . 48 TRP HD1 1 1 17 15147 1 1 48 TRP HE1 H 4.858 -4.255 -1.157 1.00 . A A . 48 TRP HE1 1 1 17 15148 1 1 48 TRP HE3 H 1.398 -2.827 -4.968 1.00 . A A . 48 TRP HE3 1 1 17 15149 1 1 48 TRP HH2 H 0.933 -1.209 -1.049 1.00 . A A . 48 TRP HH2 1 1 17 15150 1 1 48 TRP HZ2 H 2.884 -2.450 -0.230 1.00 . A A . 48 TRP HZ2 1 1 17 15151 1 1 48 TRP HZ3 H 0.201 -1.397 -3.365 1.00 . A A . 48 TRP HZ3 1 1 17 15152 1 1 48 TRP N N 3.213 -6.739 -7.067 1.00 . A A . 48 TRP N 1 1 17 15153 1 1 48 TRP NE1 N 4.359 -4.146 -1.993 1.00 . A A . 48 TRP NE1 1 1 17 15154 1 1 48 TRP O O 0.756 -5.877 -6.054 1.00 . A A . 48 TRP O 1 1 17 15155 1 1 49 GLN C C 0.011 -6.284 -2.074 1.00 . A A . 49 GLN C 1 1 17 15156 1 1 49 GLN CA C 0.033 -6.757 -3.522 1.00 . A A . 49 GLN CA 1 1 17 15157 1 1 49 GLN CB C -0.508 -8.186 -3.607 1.00 . A A . 49 GLN CB 1 1 17 15158 1 1 49 GLN CD C -2.474 -8.996 -4.974 1.00 . A A . 49 GLN CD 1 1 17 15159 1 1 49 GLN CG C -1.020 -8.566 -4.987 1.00 . A A . 49 GLN CG 1 1 17 15160 1 1 49 GLN H H 2.133 -7.009 -3.493 1.00 . A A . 49 GLN H 1 1 17 15161 1 1 49 GLN HA H -0.590 -6.104 -4.115 1.00 . A A . 49 GLN HA 1 1 17 15162 1 1 49 GLN HB2 H 0.281 -8.873 -3.337 1.00 . A A . 49 GLN HB2 1 1 17 15163 1 1 49 GLN HB3 H -1.322 -8.293 -2.903 1.00 . A A . 49 GLN HB3 1 1 17 15164 1 1 49 GLN HE21 H -3.048 -7.137 -4.558 1.00 . A A . 49 GLN HE21 1 1 17 15165 1 1 49 GLN HE22 H -4.318 -8.308 -4.712 1.00 . A A . 49 GLN HE22 1 1 17 15166 1 1 49 GLN HG2 H -0.919 -7.713 -5.641 1.00 . A A . 49 GLN HG2 1 1 17 15167 1 1 49 GLN HG3 H -0.421 -9.381 -5.366 1.00 . A A . 49 GLN HG3 1 1 17 15168 1 1 49 GLN N N 1.385 -6.698 -4.053 1.00 . A A . 49 GLN N 1 1 17 15169 1 1 49 GLN NE2 N -3.368 -8.056 -4.726 1.00 . A A . 49 GLN NE2 1 1 17 15170 1 1 49 GLN O O 0.935 -6.568 -1.306 1.00 . A A . 49 GLN O 1 1 17 15171 1 1 49 GLN OE1 O -2.788 -10.168 -5.178 1.00 . A A . 49 GLN OE1 1 1 17 15172 1 1 50 CYS C C -1.531 -6.261 0.605 1.00 . A A . 50 CYS C 1 1 17 15173 1 1 50 CYS CA C -1.218 -5.097 -0.345 1.00 . A A . 50 CYS CA 1 1 17 15174 1 1 50 CYS CB C -2.335 -4.041 -0.315 1.00 . A A . 50 CYS CB 1 1 17 15175 1 1 50 CYS H H -1.757 -5.402 -2.368 1.00 . A A . 50 CYS H 1 1 17 15176 1 1 50 CYS HA H -0.287 -4.635 -0.040 1.00 . A A . 50 CYS HA 1 1 17 15177 1 1 50 CYS HB2 H -2.140 -3.350 0.491 1.00 . A A . 50 CYS HB2 1 1 17 15178 1 1 50 CYS HB3 H -2.327 -3.498 -1.250 1.00 . A A . 50 CYS HB3 1 1 17 15179 1 1 50 CYS N N -1.052 -5.586 -1.704 1.00 . A A . 50 CYS N 1 1 17 15180 1 1 50 CYS O O -1.803 -7.374 0.159 1.00 . A A . 50 CYS O 1 1 17 15181 1 1 50 CYS SG S -4.020 -4.700 -0.072 1.00 . A A . 50 CYS SG 1 1 17 15182 1 1 51 PRO C C -3.220 -7.177 3.262 1.00 . A A . 51 PRO C 1 1 17 15183 1 1 51 PRO CA C -1.737 -7.086 2.909 1.00 . A A . 51 PRO CA 1 1 17 15184 1 1 51 PRO CB C -0.930 -6.619 4.115 1.00 . A A . 51 PRO CB 1 1 17 15185 1 1 51 PRO CD C -1.066 -4.776 2.577 1.00 . A A . 51 PRO CD 1 1 17 15186 1 1 51 PRO CG C -0.990 -5.131 4.043 1.00 . A A . 51 PRO CG 1 1 17 15187 1 1 51 PRO HA H -1.381 -8.050 2.579 1.00 . A A . 51 PRO HA 1 1 17 15188 1 1 51 PRO HB2 H -1.381 -6.992 5.023 1.00 . A A . 51 PRO HB2 1 1 17 15189 1 1 51 PRO HB3 H 0.085 -6.977 4.034 1.00 . A A . 51 PRO HB3 1 1 17 15190 1 1 51 PRO HD2 H -1.811 -4.011 2.413 1.00 . A A . 51 PRO HD2 1 1 17 15191 1 1 51 PRO HD3 H -0.101 -4.446 2.221 1.00 . A A . 51 PRO HD3 1 1 17 15192 1 1 51 PRO HG2 H -1.868 -4.774 4.559 1.00 . A A . 51 PRO HG2 1 1 17 15193 1 1 51 PRO HG3 H -0.098 -4.708 4.483 1.00 . A A . 51 PRO HG3 1 1 17 15194 1 1 51 PRO N N -1.463 -6.041 1.927 1.00 . A A . 51 PRO N 1 1 17 15195 1 1 51 PRO O O -3.611 -7.890 4.190 1.00 . A A . 51 PRO O 1 1 17 15196 1 1 52 ARG C C -6.247 -7.395 2.116 1.00 . A A . 52 ARG C 1 1 17 15197 1 1 52 ARG CA C -5.459 -6.324 2.864 1.00 . A A . 52 ARG CA 1 1 17 15198 1 1 52 ARG CB C -5.994 -4.940 2.511 1.00 . A A . 52 ARG CB 1 1 17 15199 1 1 52 ARG CD C -7.364 -2.947 3.198 1.00 . A A . 52 ARG CD 1 1 17 15200 1 1 52 ARG CG C -6.700 -4.238 3.660 1.00 . A A . 52 ARG CG 1 1 17 15201 1 1 52 ARG CZ C -8.783 -3.436 1.234 1.00 . A A . 52 ARG CZ 1 1 17 15202 1 1 52 ARG H H -3.666 -5.823 1.854 1.00 . A A . 52 ARG H 1 1 17 15203 1 1 52 ARG HA H -5.579 -6.485 3.924 1.00 . A A . 52 ARG HA 1 1 17 15204 1 1 52 ARG HB2 H -5.169 -4.319 2.193 1.00 . A A . 52 ARG HB2 1 1 17 15205 1 1 52 ARG HB3 H -6.694 -5.037 1.693 1.00 . A A . 52 ARG HB3 1 1 17 15206 1 1 52 ARG HD2 H -7.526 -2.314 4.056 1.00 . A A . 52 ARG HD2 1 1 17 15207 1 1 52 ARG HD3 H -6.705 -2.450 2.503 1.00 . A A . 52 ARG HD3 1 1 17 15208 1 1 52 ARG HE H -9.453 -3.194 3.112 1.00 . A A . 52 ARG HE 1 1 17 15209 1 1 52 ARG HG2 H -7.454 -4.898 4.063 1.00 . A A . 52 ARG HG2 1 1 17 15210 1 1 52 ARG HG3 H -5.974 -4.005 4.427 1.00 . A A . 52 ARG HG3 1 1 17 15211 1 1 52 ARG HH11 H -6.839 -3.068 0.786 1.00 . A A . 52 ARG HH11 1 1 17 15212 1 1 52 ARG HH12 H -7.836 -3.534 -0.556 1.00 . A A . 52 ARG HH12 1 1 17 15213 1 1 52 ARG HH21 H -10.783 -3.782 1.333 1.00 . A A . 52 ARG HH21 1 1 17 15214 1 1 52 ARG HH22 H -10.076 -3.934 -0.254 1.00 . A A . 52 ARG HH22 1 1 17 15215 1 1 52 ARG N N -4.038 -6.401 2.563 1.00 . A A . 52 ARG N 1 1 17 15216 1 1 52 ARG NE N -8.648 -3.193 2.539 1.00 . A A . 52 ARG NE 1 1 17 15217 1 1 52 ARG NH1 N -7.739 -3.335 0.424 1.00 . A A . 52 ARG NH1 1 1 17 15218 1 1 52 ARG NH2 N -9.973 -3.737 0.733 1.00 . A A . 52 ARG NH2 1 1 17 15219 1 1 52 ARG O O -7.402 -7.665 2.445 1.00 . A A . 52 ARG O 1 1 17 15220 1 1 53 CYS C C -5.888 -10.406 0.811 1.00 . A A . 53 CYS C 1 1 17 15221 1 1 53 CYS CA C -6.295 -9.022 0.319 1.00 . A A . 53 CYS CA 1 1 17 15222 1 1 53 CYS CB C -5.927 -8.858 -1.149 1.00 . A A . 53 CYS CB 1 1 17 15223 1 1 53 CYS H H -4.726 -7.716 0.844 1.00 . A A . 53 CYS H 1 1 17 15224 1 1 53 CYS HA H -7.362 -8.904 0.434 1.00 . A A . 53 CYS HA 1 1 17 15225 1 1 53 CYS HB2 H -5.952 -9.823 -1.631 1.00 . A A . 53 CYS HB2 1 1 17 15226 1 1 53 CYS HB3 H -6.644 -8.205 -1.618 1.00 . A A . 53 CYS HB3 1 1 17 15227 1 1 53 CYS N N -5.635 -7.990 1.096 1.00 . A A . 53 CYS N 1 1 17 15228 1 1 53 CYS O O -6.487 -11.417 0.441 1.00 . A A . 53 CYS O 1 1 17 15229 1 1 53 CYS SG S -4.272 -8.146 -1.416 1.00 . A A . 53 CYS SG 1 1 17 15230 1 1 54 THR C C -4.940 -12.230 3.277 1.00 . A A . 54 THR C 1 1 17 15231 1 1 54 THR CA C -4.228 -11.693 2.036 1.00 . A A . 54 THR CA 1 1 17 15232 1 1 54 THR CB C -2.736 -11.498 2.337 1.00 . A A . 54 THR CB 1 1 17 15233 1 1 54 THR CG2 C -1.899 -12.505 1.568 1.00 . A A . 54 THR CG2 1 1 17 15234 1 1 54 THR H H -4.333 -9.606 1.765 1.00 . A A . 54 THR H 1 1 17 15235 1 1 54 THR HA H -4.319 -12.416 1.240 1.00 . A A . 54 THR HA 1 1 17 15236 1 1 54 THR HB H -2.570 -11.637 3.396 1.00 . A A . 54 THR HB 1 1 17 15237 1 1 54 THR HG1 H -2.330 -10.097 0.996 1.00 . A A . 54 THR HG1 1 1 17 15238 1 1 54 THR HG21 H -1.798 -12.178 0.543 1.00 . A A . 54 THR HG21 1 1 17 15239 1 1 54 THR HG22 H -2.385 -13.469 1.590 1.00 . A A . 54 THR HG22 1 1 17 15240 1 1 54 THR HG23 H -0.922 -12.583 2.019 1.00 . A A . 54 THR HG23 1 1 17 15241 1 1 54 THR N N -4.808 -10.443 1.575 1.00 . A A . 54 THR N 1 1 17 15242 1 1 54 THR O O -4.996 -13.442 3.493 1.00 . A A . 54 THR O 1 1 17 15243 1 1 54 THR OG1 O -2.347 -10.166 1.966 1.00 . A A . 54 THR OG1 1 1 17 15244 1 1 55 CYS C C -7.513 -12.454 4.966 1.00 . A A . 55 CYS C 1 1 17 15245 1 1 55 CYS CA C -6.198 -11.729 5.296 1.00 . A A . 55 CYS CA 1 1 17 15246 1 1 55 CYS CB C -6.449 -10.516 6.195 1.00 . A A . 55 CYS CB 1 1 17 15247 1 1 55 CYS H H -5.404 -10.380 3.867 1.00 . A A . 55 CYS H 1 1 17 15248 1 1 55 CYS HA H -5.559 -12.419 5.828 1.00 . A A . 55 CYS HA 1 1 17 15249 1 1 55 CYS HB2 H -7.042 -9.793 5.656 1.00 . A A . 55 CYS HB2 1 1 17 15250 1 1 55 CYS HB3 H -6.985 -10.832 7.077 1.00 . A A . 55 CYS HB3 1 1 17 15251 1 1 55 CYS HG H -3.904 -10.407 6.300 1.00 . A A . 55 CYS HG 1 1 17 15252 1 1 55 CYS N N -5.485 -11.332 4.086 1.00 . A A . 55 CYS N 1 1 17 15253 1 1 55 CYS O O -7.724 -13.577 5.426 1.00 . A A . 55 CYS O 1 1 17 15254 1 1 55 CYS SG S -4.937 -9.691 6.736 1.00 . A A . 55 CYS SG 1 1 17 15255 1 1 56 PRO C C -9.359 -13.665 2.738 1.00 . A A . 56 PRO C 1 1 17 15256 1 1 56 PRO CA C -9.635 -12.542 3.733 1.00 . A A . 56 PRO CA 1 1 17 15257 1 1 56 PRO CB C -10.450 -11.430 3.075 1.00 . A A . 56 PRO CB 1 1 17 15258 1 1 56 PRO CD C -8.274 -10.539 3.498 1.00 . A A . 56 PRO CD 1 1 17 15259 1 1 56 PRO CG C -9.432 -10.486 2.541 1.00 . A A . 56 PRO CG 1 1 17 15260 1 1 56 PRO HA H -10.172 -12.935 4.584 1.00 . A A . 56 PRO HA 1 1 17 15261 1 1 56 PRO HB2 H -11.060 -11.846 2.286 1.00 . A A . 56 PRO HB2 1 1 17 15262 1 1 56 PRO HB3 H -11.080 -10.955 3.814 1.00 . A A . 56 PRO HB3 1 1 17 15263 1 1 56 PRO HD2 H -7.339 -10.460 2.962 1.00 . A A . 56 PRO HD2 1 1 17 15264 1 1 56 PRO HD3 H -8.357 -9.749 4.231 1.00 . A A . 56 PRO HD3 1 1 17 15265 1 1 56 PRO HG2 H -9.118 -10.802 1.557 1.00 . A A . 56 PRO HG2 1 1 17 15266 1 1 56 PRO HG3 H -9.839 -9.487 2.502 1.00 . A A . 56 PRO HG3 1 1 17 15267 1 1 56 PRO N N -8.403 -11.867 4.138 1.00 . A A . 56 PRO N 1 1 17 15268 1 1 56 PRO O O -8.429 -13.578 1.933 1.00 . A A . 56 PRO O 1 1 17 15269 1 1 57 ALA C C -10.401 -15.447 0.464 1.00 . A A . 57 ALA C 1 1 17 15270 1 1 57 ALA CA C -10.013 -15.845 1.883 1.00 . A A . 57 ALA CA 1 1 17 15271 1 1 57 ALA CB C -10.858 -17.018 2.360 1.00 . A A . 57 ALA CB 1 1 17 15272 1 1 57 ALA H H -10.891 -14.729 3.452 1.00 . A A . 57 ALA H 1 1 17 15273 1 1 57 ALA HA H -8.976 -16.146 1.894 1.00 . A A . 57 ALA HA 1 1 17 15274 1 1 57 ALA HB1 H -11.841 -16.666 2.637 1.00 . A A . 57 ALA HB1 1 1 17 15275 1 1 57 ALA HB2 H -10.948 -17.745 1.565 1.00 . A A . 57 ALA HB2 1 1 17 15276 1 1 57 ALA HB3 H -10.387 -17.478 3.216 1.00 . A A . 57 ALA HB3 1 1 17 15277 1 1 57 ALA N N -10.166 -14.715 2.792 1.00 . A A . 57 ALA N 1 1 17 15278 1 1 57 ALA O O -10.880 -14.331 0.236 1.00 . A A . 57 ALA O 1 1 17 15279 1 1 58 LEU C C -12.093 -16.164 -2.052 1.00 . A A . 58 LEU C 1 1 17 15280 1 1 58 LEU CA C -10.578 -16.104 -1.877 1.00 . A A . 58 LEU CA 1 1 17 15281 1 1 58 LEU CB C -9.887 -17.099 -2.818 1.00 . A A . 58 LEU CB 1 1 17 15282 1 1 58 LEU CD1 C -10.175 -19.586 -2.838 1.00 . A A . 58 LEU CD1 1 1 17 15283 1 1 58 LEU CD2 C -7.941 -18.592 -2.291 1.00 . A A . 58 LEU CD2 1 1 17 15284 1 1 58 LEU CG C -9.451 -18.420 -2.184 1.00 . A A . 58 LEU CG 1 1 17 15285 1 1 58 LEU H H -9.845 -17.234 -0.237 1.00 . A A . 58 LEU H 1 1 17 15286 1 1 58 LEU HA H -10.245 -15.105 -2.121 1.00 . A A . 58 LEU HA 1 1 17 15287 1 1 58 LEU HB2 H -10.566 -17.322 -3.628 1.00 . A A . 58 LEU HB2 1 1 17 15288 1 1 58 LEU HB3 H -9.012 -16.618 -3.229 1.00 . A A . 58 LEU HB3 1 1 17 15289 1 1 58 LEU HD11 H -10.879 -20.011 -2.140 1.00 . A A . 58 LEU HD11 1 1 17 15290 1 1 58 LEU HD12 H -10.703 -19.235 -3.713 1.00 . A A . 58 LEU HD12 1 1 17 15291 1 1 58 LEU HD13 H -9.456 -20.339 -3.127 1.00 . A A . 58 LEU HD13 1 1 17 15292 1 1 58 LEU HD21 H -7.554 -17.925 -3.048 1.00 . A A . 58 LEU HD21 1 1 17 15293 1 1 58 LEU HD22 H -7.484 -18.360 -1.340 1.00 . A A . 58 LEU HD22 1 1 17 15294 1 1 58 LEU HD23 H -7.712 -19.613 -2.559 1.00 . A A . 58 LEU HD23 1 1 17 15295 1 1 58 LEU HG H -9.713 -18.412 -1.135 1.00 . A A . 58 LEU HG 1 1 17 15296 1 1 58 LEU N N -10.216 -16.361 -0.483 1.00 . A A . 58 LEU N 1 1 17 15297 1 1 58 LEU O O -12.630 -17.074 -2.684 1.00 . A A . 58 LEU O 1 1 17 15298 1 1 59 LYS C C -14.618 -13.852 -0.659 1.00 . A A . 59 LYS C 1 1 17 15299 1 1 59 LYS CA C -14.214 -15.096 -1.438 1.00 . A A . 59 LYS CA 1 1 17 15300 1 1 59 LYS CB C -14.848 -16.334 -0.793 1.00 . A A . 59 LYS CB 1 1 17 15301 1 1 59 LYS CD C -17.074 -16.338 0.382 1.00 . A A . 59 LYS CD 1 1 17 15302 1 1 59 LYS CE C -18.212 -17.342 0.462 1.00 . A A . 59 LYS CE 1 1 17 15303 1 1 59 LYS CG C -16.360 -16.411 -0.957 1.00 . A A . 59 LYS CG 1 1 17 15304 1 1 59 LYS H H -12.247 -14.526 -0.937 1.00 . A A . 59 LYS H 1 1 17 15305 1 1 59 LYS HA H -14.550 -15.006 -2.461 1.00 . A A . 59 LYS HA 1 1 17 15306 1 1 59 LYS HB2 H -14.413 -17.217 -1.238 1.00 . A A . 59 LYS HB2 1 1 17 15307 1 1 59 LYS HB3 H -14.622 -16.328 0.264 1.00 . A A . 59 LYS HB3 1 1 17 15308 1 1 59 LYS HD2 H -16.367 -16.551 1.170 1.00 . A A . 59 LYS HD2 1 1 17 15309 1 1 59 LYS HD3 H -17.474 -15.343 0.514 1.00 . A A . 59 LYS HD3 1 1 17 15310 1 1 59 LYS HE2 H -19.121 -16.819 0.725 1.00 . A A . 59 LYS HE2 1 1 17 15311 1 1 59 LYS HE3 H -18.333 -17.807 -0.505 1.00 . A A . 59 LYS HE3 1 1 17 15312 1 1 59 LYS HG2 H -16.687 -15.587 -1.572 1.00 . A A . 59 LYS HG2 1 1 17 15313 1 1 59 LYS HG3 H -16.611 -17.345 -1.439 1.00 . A A . 59 LYS HG3 1 1 17 15314 1 1 59 LYS HZ1 H -16.937 -18.414 1.722 1.00 . A A . 59 LYS HZ1 1 1 17 15315 1 1 59 LYS HZ2 H -18.224 -19.328 1.103 1.00 . A A . 59 LYS HZ2 1 1 17 15316 1 1 59 LYS HZ3 H -18.503 -18.204 2.341 1.00 . A A . 59 LYS HZ3 1 1 17 15317 1 1 59 LYS N N -12.761 -15.198 -1.437 1.00 . A A . 59 LYS N 1 1 17 15318 1 1 59 LYS NZ N -17.952 -18.395 1.476 1.00 . A A . 59 LYS NZ 1 1 17 15319 1 1 59 LYS O O -15.644 -13.225 -0.931 1.00 . A A . 59 LYS O 1 1 17 15320 1 1 60 GLY C C -13.943 -12.756 2.647 1.00 . A A . 60 GLY C 1 1 17 15321 1 1 60 GLY CA C -14.091 -12.397 1.188 1.00 . A A . 60 GLY CA 1 1 17 15322 1 1 60 GLY H H -13.035 -14.095 0.534 1.00 . A A . 60 GLY H 1 1 17 15323 1 1 60 GLY HA2 H -13.405 -11.598 0.946 1.00 . A A . 60 GLY HA2 1 1 17 15324 1 1 60 GLY HA3 H -15.101 -12.061 1.010 1.00 . A A . 60 GLY HA3 1 1 17 15325 1 1 60 GLY N N -13.811 -13.528 0.339 1.00 . A A . 60 GLY N 1 1 17 15326 1 1 60 GLY O O -13.274 -13.739 2.978 1.00 . A A . 60 GLY O 1 1 17 15327 1 1 61 LYS C C -15.902 -11.836 5.565 1.00 . A A . 61 LYS C 1 1 17 15328 1 1 61 LYS CA C -14.592 -12.284 4.938 1.00 . A A . 61 LYS CA 1 1 17 15329 1 1 61 LYS CB C -13.416 -11.581 5.615 1.00 . A A . 61 LYS CB 1 1 17 15330 1 1 61 LYS CD C -12.310 -12.831 7.500 1.00 . A A . 61 LYS CD 1 1 17 15331 1 1 61 LYS CE C -13.030 -14.139 7.796 1.00 . A A . 61 LYS CE 1 1 17 15332 1 1 61 LYS CG C -12.293 -12.526 6.012 1.00 . A A . 61 LYS CG 1 1 17 15333 1 1 61 LYS H H -15.154 -11.263 3.179 1.00 . A A . 61 LYS H 1 1 17 15334 1 1 61 LYS HA H -14.486 -13.353 5.069 1.00 . A A . 61 LYS HA 1 1 17 15335 1 1 61 LYS HB2 H -13.014 -10.843 4.936 1.00 . A A . 61 LYS HB2 1 1 17 15336 1 1 61 LYS HB3 H -13.772 -11.083 6.505 1.00 . A A . 61 LYS HB3 1 1 17 15337 1 1 61 LYS HD2 H -11.293 -12.905 7.853 1.00 . A A . 61 LYS HD2 1 1 17 15338 1 1 61 LYS HD3 H -12.815 -12.027 8.017 1.00 . A A . 61 LYS HD3 1 1 17 15339 1 1 61 LYS HE2 H -13.128 -14.249 8.865 1.00 . A A . 61 LYS HE2 1 1 17 15340 1 1 61 LYS HE3 H -14.013 -14.104 7.349 1.00 . A A . 61 LYS HE3 1 1 17 15341 1 1 61 LYS HG2 H -12.406 -13.451 5.466 1.00 . A A . 61 LYS HG2 1 1 17 15342 1 1 61 LYS HG3 H -11.347 -12.070 5.758 1.00 . A A . 61 LYS HG3 1 1 17 15343 1 1 61 LYS HZ1 H -12.030 -15.961 8.034 1.00 . A A . 61 LYS HZ1 1 1 17 15344 1 1 61 LYS HZ2 H -11.432 -15.011 6.765 1.00 . A A . 61 LYS HZ2 1 1 17 15345 1 1 61 LYS HZ3 H -12.901 -15.835 6.583 1.00 . A A . 61 LYS HZ3 1 1 17 15346 1 1 61 LYS N N -14.604 -12.005 3.512 1.00 . A A . 61 LYS N 1 1 17 15347 1 1 61 LYS NZ N -12.298 -15.316 7.258 1.00 . A A . 61 LYS NZ 1 1 17 15348 1 1 61 LYS O O -16.499 -10.860 5.057 1.00 . A A . 61 LYS O 1 1 17 15349 1 1 61 LYS OXT O -16.341 -12.467 6.542 1.00 . A A . 61 LYS OXT 1 1 17 15350 2 2 1 ZN ZN ZN -4.554 -5.957 -1.891 1.00 . B A . 62 ZN ZN 1 1 17 15351 3 2 1 ZN ZN ZN 4.351 4.085 3.465 1.00 . C A . 63 ZN ZN 1 1 18 15352 1 1 1 GLY C C -6.099 12.562 -14.789 1.00 . A A . 1 GLY C 1 1 18 15353 1 1 1 GLY CA C -6.705 13.880 -14.350 1.00 . A A . 1 GLY CA 1 1 18 15354 1 1 1 GLY H1 H -7.077 14.693 -12.467 1.00 . A A . 1 GLY H1 1 1 18 15355 1 1 1 GLY H2 H -6.785 13.024 -12.455 1.00 . A A . 1 GLY H2 1 1 18 15356 1 1 1 GLY H3 H -8.272 13.616 -13.004 1.00 . A A . 1 GLY H3 1 1 18 15357 1 1 1 GLY HA2 H -7.502 14.141 -15.029 1.00 . A A . 1 GLY HA2 1 1 18 15358 1 1 1 GLY HA3 H -5.946 14.649 -14.384 1.00 . A A . 1 GLY HA3 1 1 18 15359 1 1 1 GLY N N -7.247 13.800 -12.976 1.00 . A A . 1 GLY N 1 1 18 15360 1 1 1 GLY O O -6.335 11.535 -14.154 1.00 . A A . 1 GLY O 1 1 18 15361 1 1 2 PRO C C -3.746 10.705 -15.449 1.00 . A A . 2 PRO C 1 1 18 15362 1 1 2 PRO CA C -4.729 11.334 -16.433 1.00 . A A . 2 PRO CA 1 1 18 15363 1 1 2 PRO CB C -3.997 11.818 -17.691 1.00 . A A . 2 PRO CB 1 1 18 15364 1 1 2 PRO CD C -5.071 13.721 -16.745 1.00 . A A . 2 PRO CD 1 1 18 15365 1 1 2 PRO CG C -4.661 13.102 -18.047 1.00 . A A . 2 PRO CG 1 1 18 15366 1 1 2 PRO HA H -5.476 10.604 -16.706 1.00 . A A . 2 PRO HA 1 1 18 15367 1 1 2 PRO HB2 H -2.951 11.964 -17.464 1.00 . A A . 2 PRO HB2 1 1 18 15368 1 1 2 PRO HB3 H -4.101 11.088 -18.480 1.00 . A A . 2 PRO HB3 1 1 18 15369 1 1 2 PRO HD2 H -4.266 14.315 -16.337 1.00 . A A . 2 PRO HD2 1 1 18 15370 1 1 2 PRO HD3 H -5.961 14.321 -16.873 1.00 . A A . 2 PRO HD3 1 1 18 15371 1 1 2 PRO HG2 H -3.965 13.745 -18.567 1.00 . A A . 2 PRO HG2 1 1 18 15372 1 1 2 PRO HG3 H -5.528 12.909 -18.662 1.00 . A A . 2 PRO HG3 1 1 18 15373 1 1 2 PRO N N -5.345 12.552 -15.897 1.00 . A A . 2 PRO N 1 1 18 15374 1 1 2 PRO O O -3.872 9.531 -15.094 1.00 . A A . 2 PRO O 1 1 18 15375 1 1 3 LEU C C -2.398 11.028 -12.615 1.00 . A A . 3 LEU C 1 1 18 15376 1 1 3 LEU CA C -1.809 11.018 -14.020 1.00 . A A . 3 LEU CA 1 1 18 15377 1 1 3 LEU CB C -0.541 11.873 -14.072 1.00 . A A . 3 LEU CB 1 1 18 15378 1 1 3 LEU CD1 C 1.866 11.977 -14.763 1.00 . A A . 3 LEU CD1 1 1 18 15379 1 1 3 LEU CD2 C 1.180 10.506 -12.864 1.00 . A A . 3 LEU CD2 1 1 18 15380 1 1 3 LEU CG C 0.767 11.090 -14.207 1.00 . A A . 3 LEU CG 1 1 18 15381 1 1 3 LEU H H -2.749 12.436 -15.285 1.00 . A A . 3 LEU H 1 1 18 15382 1 1 3 LEU HA H -1.558 10.004 -14.284 1.00 . A A . 3 LEU HA 1 1 18 15383 1 1 3 LEU HB2 H -0.618 12.548 -14.914 1.00 . A A . 3 LEU HB2 1 1 18 15384 1 1 3 LEU HB3 H -0.489 12.461 -13.167 1.00 . A A . 3 LEU HB3 1 1 18 15385 1 1 3 LEU HD11 H 2.315 12.539 -13.958 1.00 . A A . 3 LEU HD11 1 1 18 15386 1 1 3 LEU HD12 H 2.620 11.366 -15.239 1.00 . A A . 3 LEU HD12 1 1 18 15387 1 1 3 LEU HD13 H 1.446 12.661 -15.488 1.00 . A A . 3 LEU HD13 1 1 18 15388 1 1 3 LEU HD21 H 1.669 11.269 -12.278 1.00 . A A . 3 LEU HD21 1 1 18 15389 1 1 3 LEU HD22 H 0.304 10.154 -12.341 1.00 . A A . 3 LEU HD22 1 1 18 15390 1 1 3 LEU HD23 H 1.860 9.682 -13.023 1.00 . A A . 3 LEU HD23 1 1 18 15391 1 1 3 LEU HG H 0.621 10.272 -14.897 1.00 . A A . 3 LEU HG 1 1 18 15392 1 1 3 LEU N N -2.788 11.498 -14.983 1.00 . A A . 3 LEU N 1 1 18 15393 1 1 3 LEU O O -2.386 10.011 -11.919 1.00 . A A . 3 LEU O 1 1 18 15394 1 1 4 GLY C C -4.942 11.540 -10.904 1.00 . A A . 4 GLY C 1 1 18 15395 1 1 4 GLY CA C -3.610 12.258 -10.934 1.00 . A A . 4 GLY CA 1 1 18 15396 1 1 4 GLY H H -3.001 12.922 -12.848 1.00 . A A . 4 GLY H 1 1 18 15397 1 1 4 GLY HA2 H -2.960 11.823 -10.188 1.00 . A A . 4 GLY HA2 1 1 18 15398 1 1 4 GLY HA3 H -3.768 13.300 -10.700 1.00 . A A . 4 GLY HA3 1 1 18 15399 1 1 4 GLY N N -2.972 12.158 -12.229 1.00 . A A . 4 GLY N 1 1 18 15400 1 1 4 GLY O O -5.948 12.069 -11.377 1.00 . A A . 4 GLY O 1 1 18 15401 1 1 5 SER C C -6.653 9.397 -8.882 1.00 . A A . 5 SER C 1 1 18 15402 1 1 5 SER CA C -6.157 9.530 -10.315 1.00 . A A . 5 SER CA 1 1 18 15403 1 1 5 SER CB C -5.886 8.148 -10.910 1.00 . A A . 5 SER CB 1 1 18 15404 1 1 5 SER H H -4.118 9.974 -9.976 1.00 . A A . 5 SER H 1 1 18 15405 1 1 5 SER HA H -6.912 10.026 -10.904 1.00 . A A . 5 SER HA 1 1 18 15406 1 1 5 SER HB2 H -6.000 7.399 -10.141 1.00 . A A . 5 SER HB2 1 1 18 15407 1 1 5 SER HB3 H -6.590 7.955 -11.707 1.00 . A A . 5 SER HB3 1 1 18 15408 1 1 5 SER HG H -4.200 8.961 -11.504 1.00 . A A . 5 SER HG 1 1 18 15409 1 1 5 SER N N -4.948 10.332 -10.369 1.00 . A A . 5 SER N 1 1 18 15410 1 1 5 SER O O -5.893 9.018 -7.987 1.00 . A A . 5 SER O 1 1 18 15411 1 1 5 SER OG O -4.567 8.069 -11.434 1.00 . A A . 5 SER OG 1 1 18 15412 1 1 6 ASP C C -8.580 8.196 -6.874 1.00 . A A . 6 ASP C 1 1 18 15413 1 1 6 ASP CA C -8.511 9.648 -7.331 1.00 . A A . 6 ASP CA 1 1 18 15414 1 1 6 ASP CB C -9.910 10.269 -7.311 1.00 . A A . 6 ASP CB 1 1 18 15415 1 1 6 ASP CG C -10.650 9.981 -6.018 1.00 . A A . 6 ASP CG 1 1 18 15416 1 1 6 ASP H H -8.472 10.045 -9.418 1.00 . A A . 6 ASP H 1 1 18 15417 1 1 6 ASP HA H -7.874 10.196 -6.651 1.00 . A A . 6 ASP HA 1 1 18 15418 1 1 6 ASP HB2 H -9.825 11.341 -7.425 1.00 . A A . 6 ASP HB2 1 1 18 15419 1 1 6 ASP HB3 H -10.487 9.870 -8.130 1.00 . A A . 6 ASP HB3 1 1 18 15420 1 1 6 ASP N N -7.919 9.735 -8.662 1.00 . A A . 6 ASP N 1 1 18 15421 1 1 6 ASP O O -9.099 7.333 -7.587 1.00 . A A . 6 ASP O 1 1 18 15422 1 1 6 ASP OD1 O -10.137 10.346 -4.939 1.00 . A A . 6 ASP OD1 1 1 18 15423 1 1 6 ASP OD2 O -11.753 9.399 -6.075 1.00 . A A . 6 ASP OD2 1 1 18 15424 1 1 7 HIS C C -8.554 6.533 -3.767 1.00 . A A . 7 HIS C 1 1 18 15425 1 1 7 HIS CA C -7.987 6.571 -5.177 1.00 . A A . 7 HIS CA 1 1 18 15426 1 1 7 HIS CB C -6.550 6.044 -5.180 1.00 . A A . 7 HIS CB 1 1 18 15427 1 1 7 HIS CD2 C -7.294 3.971 -6.529 1.00 . A A . 7 HIS CD2 1 1 18 15428 1 1 7 HIS CE1 C -5.307 3.196 -6.964 1.00 . A A . 7 HIS CE1 1 1 18 15429 1 1 7 HIS CG C -6.364 4.791 -5.982 1.00 . A A . 7 HIS CG 1 1 18 15430 1 1 7 HIS H H -7.620 8.654 -5.185 1.00 . A A . 7 HIS H 1 1 18 15431 1 1 7 HIS HA H -8.595 5.944 -5.815 1.00 . A A . 7 HIS HA 1 1 18 15432 1 1 7 HIS HB2 H -5.901 6.801 -5.595 1.00 . A A . 7 HIS HB2 1 1 18 15433 1 1 7 HIS HB3 H -6.249 5.837 -4.163 1.00 . A A . 7 HIS HB3 1 1 18 15434 1 1 7 HIS HD2 H -8.366 4.087 -6.481 1.00 . A A . 7 HIS HD2 1 1 18 15435 1 1 7 HIS HE1 H -4.513 2.569 -7.342 1.00 . A A . 7 HIS HE1 1 1 18 15436 1 1 7 HIS HE2 H -7.005 2.093 -7.429 1.00 . A A . 7 HIS HE2 1 1 18 15437 1 1 7 HIS N N -8.026 7.922 -5.707 1.00 . A A . 7 HIS N 1 1 18 15438 1 1 7 HIS ND1 N -5.113 4.298 -6.261 1.00 . A A . 7 HIS ND1 1 1 18 15439 1 1 7 HIS NE2 N -6.613 2.956 -7.151 1.00 . A A . 7 HIS NE2 1 1 18 15440 1 1 7 HIS O O -8.426 7.503 -3.018 1.00 . A A . 7 HIS O 1 1 18 15441 1 1 8 HIS C C -8.748 5.390 -1.008 1.00 . A A . 8 HIS C 1 1 18 15442 1 1 8 HIS CA C -9.804 5.253 -2.100 1.00 . A A . 8 HIS CA 1 1 18 15443 1 1 8 HIS CB C -10.482 3.887 -1.994 1.00 . A A . 8 HIS CB 1 1 18 15444 1 1 8 HIS CD2 C -13.000 4.220 -2.439 1.00 . A A . 8 HIS CD2 1 1 18 15445 1 1 8 HIS CE1 C -13.060 3.299 -4.411 1.00 . A A . 8 HIS CE1 1 1 18 15446 1 1 8 HIS CG C -11.761 3.790 -2.769 1.00 . A A . 8 HIS CG 1 1 18 15447 1 1 8 HIS H H -9.313 4.711 -4.087 1.00 . A A . 8 HIS H 1 1 18 15448 1 1 8 HIS HA H -10.546 6.028 -1.969 1.00 . A A . 8 HIS HA 1 1 18 15449 1 1 8 HIS HB2 H -9.810 3.129 -2.369 1.00 . A A . 8 HIS HB2 1 1 18 15450 1 1 8 HIS HB3 H -10.705 3.683 -0.958 1.00 . A A . 8 HIS HB3 1 1 18 15451 1 1 8 HIS HD2 H -13.290 4.721 -1.526 1.00 . A A . 8 HIS HD2 1 1 18 15452 1 1 8 HIS HE1 H -13.426 2.937 -5.360 1.00 . A A . 8 HIS HE1 1 1 18 15453 1 1 8 HIS HE2 H -14.743 4.227 -3.618 1.00 . A A . 8 HIS HE2 1 1 18 15454 1 1 8 HIS N N -9.202 5.422 -3.421 1.00 . A A . 8 HIS N 1 1 18 15455 1 1 8 HIS ND1 N -11.802 3.208 -4.013 1.00 . A A . 8 HIS ND1 1 1 18 15456 1 1 8 HIS NE2 N -13.821 3.905 -3.488 1.00 . A A . 8 HIS NE2 1 1 18 15457 1 1 8 HIS O O -8.984 6.009 0.031 1.00 . A A . 8 HIS O 1 1 18 15458 1 1 9 MET C C -5.236 5.594 -1.151 1.00 . A A . 9 MET C 1 1 18 15459 1 1 9 MET CA C -6.428 5.039 -0.390 1.00 . A A . 9 MET CA 1 1 18 15460 1 1 9 MET CB C -6.063 3.694 0.246 1.00 . A A . 9 MET CB 1 1 18 15461 1 1 9 MET CE C -8.110 1.416 0.893 1.00 . A A . 9 MET CE 1 1 18 15462 1 1 9 MET CG C -6.520 3.548 1.685 1.00 . A A . 9 MET CG 1 1 18 15463 1 1 9 MET H H -7.410 4.480 -2.171 1.00 . A A . 9 MET H 1 1 18 15464 1 1 9 MET HA H -6.706 5.736 0.386 1.00 . A A . 9 MET HA 1 1 18 15465 1 1 9 MET HB2 H -6.517 2.902 -0.333 1.00 . A A . 9 MET HB2 1 1 18 15466 1 1 9 MET HB3 H -4.990 3.574 0.218 1.00 . A A . 9 MET HB3 1 1 18 15467 1 1 9 MET HE1 H -7.989 2.052 0.029 1.00 . A A . 9 MET HE1 1 1 18 15468 1 1 9 MET HE2 H -7.992 0.384 0.600 1.00 . A A . 9 MET HE2 1 1 18 15469 1 1 9 MET HE3 H -9.096 1.561 1.311 1.00 . A A . 9 MET HE3 1 1 18 15470 1 1 9 MET HG2 H -5.742 3.920 2.336 1.00 . A A . 9 MET HG2 1 1 18 15471 1 1 9 MET HG3 H -7.416 4.133 1.825 1.00 . A A . 9 MET HG3 1 1 18 15472 1 1 9 MET N N -7.556 4.892 -1.293 1.00 . A A . 9 MET N 1 1 18 15473 1 1 9 MET O O -4.302 4.866 -1.472 1.00 . A A . 9 MET O 1 1 18 15474 1 1 9 MET SD S -6.873 1.833 2.123 1.00 . A A . 9 MET SD 1 1 18 15475 1 1 10 GLU C C -3.037 7.836 -1.387 1.00 . A A . 10 GLU C 1 1 18 15476 1 1 10 GLU CA C -4.245 7.524 -2.264 1.00 . A A . 10 GLU CA 1 1 18 15477 1 1 10 GLU CB C -4.764 8.813 -2.912 1.00 . A A . 10 GLU CB 1 1 18 15478 1 1 10 GLU CD C -4.564 10.969 -1.587 1.00 . A A . 10 GLU CD 1 1 18 15479 1 1 10 GLU CG C -5.426 9.768 -1.929 1.00 . A A . 10 GLU CG 1 1 18 15480 1 1 10 GLU H H -6.101 7.395 -1.243 1.00 . A A . 10 GLU H 1 1 18 15481 1 1 10 GLU HA H -3.940 6.841 -3.041 1.00 . A A . 10 GLU HA 1 1 18 15482 1 1 10 GLU HB2 H -3.936 9.328 -3.378 1.00 . A A . 10 GLU HB2 1 1 18 15483 1 1 10 GLU HB3 H -5.488 8.555 -3.671 1.00 . A A . 10 GLU HB3 1 1 18 15484 1 1 10 GLU HG2 H -6.349 10.123 -2.363 1.00 . A A . 10 GLU HG2 1 1 18 15485 1 1 10 GLU HG3 H -5.641 9.230 -1.020 1.00 . A A . 10 GLU HG3 1 1 18 15486 1 1 10 GLU N N -5.303 6.876 -1.489 1.00 . A A . 10 GLU N 1 1 18 15487 1 1 10 GLU O O -2.081 8.473 -1.829 1.00 . A A . 10 GLU O 1 1 18 15488 1 1 10 GLU OE1 O -3.692 11.343 -2.399 1.00 . A A . 10 GLU OE1 1 1 18 15489 1 1 10 GLU OE2 O -4.758 11.553 -0.502 1.00 . A A . 10 GLU OE2 1 1 18 15490 1 1 11 PHE C C -1.754 6.356 1.603 1.00 . A A . 11 PHE C 1 1 18 15491 1 1 11 PHE CA C -2.026 7.623 0.804 1.00 . A A . 11 PHE CA 1 1 18 15492 1 1 11 PHE CB C -2.399 8.783 1.738 1.00 . A A . 11 PHE CB 1 1 18 15493 1 1 11 PHE CD1 C -4.725 8.056 2.389 1.00 . A A . 11 PHE CD1 1 1 18 15494 1 1 11 PHE CD2 C -3.143 8.490 4.119 1.00 . A A . 11 PHE CD2 1 1 18 15495 1 1 11 PHE CE1 C -5.679 7.735 3.336 1.00 . A A . 11 PHE CE1 1 1 18 15496 1 1 11 PHE CE2 C -4.095 8.167 5.070 1.00 . A A . 11 PHE CE2 1 1 18 15497 1 1 11 PHE CG C -3.446 8.437 2.770 1.00 . A A . 11 PHE CG 1 1 18 15498 1 1 11 PHE CZ C -5.364 7.789 4.678 1.00 . A A . 11 PHE CZ 1 1 18 15499 1 1 11 PHE H H -3.875 6.882 0.140 1.00 . A A . 11 PHE H 1 1 18 15500 1 1 11 PHE HA H -1.136 7.887 0.251 1.00 . A A . 11 PHE HA 1 1 18 15501 1 1 11 PHE HB2 H -1.514 9.109 2.262 1.00 . A A . 11 PHE HB2 1 1 18 15502 1 1 11 PHE HB3 H -2.778 9.600 1.145 1.00 . A A . 11 PHE HB3 1 1 18 15503 1 1 11 PHE HD1 H -4.975 8.012 1.339 1.00 . A A . 11 PHE HD1 1 1 18 15504 1 1 11 PHE HD2 H -2.150 8.784 4.428 1.00 . A A . 11 PHE HD2 1 1 18 15505 1 1 11 PHE HE1 H -6.669 7.440 3.026 1.00 . A A . 11 PHE HE1 1 1 18 15506 1 1 11 PHE HE2 H -3.846 8.212 6.122 1.00 . A A . 11 PHE HE2 1 1 18 15507 1 1 11 PHE HZ H -6.105 7.534 5.420 1.00 . A A . 11 PHE HZ 1 1 18 15508 1 1 11 PHE N N -3.093 7.392 -0.145 1.00 . A A . 11 PHE N 1 1 18 15509 1 1 11 PHE O O -2.587 5.447 1.635 1.00 . A A . 11 PHE O 1 1 18 15510 1 1 12 CYS C C -1.139 5.008 4.234 1.00 . A A . 12 CYS C 1 1 18 15511 1 1 12 CYS CA C -0.213 5.147 3.040 1.00 . A A . 12 CYS CA 1 1 18 15512 1 1 12 CYS CB C 1.217 5.280 3.542 1.00 . A A . 12 CYS CB 1 1 18 15513 1 1 12 CYS H H 0.036 7.052 2.150 1.00 . A A . 12 CYS H 1 1 18 15514 1 1 12 CYS HA H -0.294 4.263 2.426 1.00 . A A . 12 CYS HA 1 1 18 15515 1 1 12 CYS HB2 H 1.418 6.319 3.763 1.00 . A A . 12 CYS HB2 1 1 18 15516 1 1 12 CYS HB3 H 1.326 4.700 4.447 1.00 . A A . 12 CYS HB3 1 1 18 15517 1 1 12 CYS HG H 3.409 5.671 2.323 1.00 . A A . 12 CYS HG 1 1 18 15518 1 1 12 CYS N N -0.590 6.297 2.233 1.00 . A A . 12 CYS N 1 1 18 15519 1 1 12 CYS O O -1.383 5.973 4.955 1.00 . A A . 12 CYS O 1 1 18 15520 1 1 12 CYS SG S 2.471 4.722 2.380 1.00 . A A . 12 CYS SG 1 1 18 15521 1 1 13 ARG C C -1.875 3.840 6.914 1.00 . A A . 13 ARG C 1 1 18 15522 1 1 13 ARG CA C -2.544 3.541 5.563 1.00 . A A . 13 ARG CA 1 1 18 15523 1 1 13 ARG CB C -3.030 2.091 5.526 1.00 . A A . 13 ARG CB 1 1 18 15524 1 1 13 ARG CD C -4.898 0.503 4.979 1.00 . A A . 13 ARG CD 1 1 18 15525 1 1 13 ARG CG C -4.383 1.928 4.857 1.00 . A A . 13 ARG CG 1 1 18 15526 1 1 13 ARG CZ C -7.119 0.426 6.061 1.00 . A A . 13 ARG CZ 1 1 18 15527 1 1 13 ARG H H -1.434 3.081 3.804 1.00 . A A . 13 ARG H 1 1 18 15528 1 1 13 ARG HA H -3.397 4.194 5.454 1.00 . A A . 13 ARG HA 1 1 18 15529 1 1 13 ARG HB2 H -2.310 1.495 4.986 1.00 . A A . 13 ARG HB2 1 1 18 15530 1 1 13 ARG HB3 H -3.105 1.720 6.539 1.00 . A A . 13 ARG HB3 1 1 18 15531 1 1 13 ARG HD2 H -5.436 0.253 4.076 1.00 . A A . 13 ARG HD2 1 1 18 15532 1 1 13 ARG HD3 H -4.055 -0.164 5.091 1.00 . A A . 13 ARG HD3 1 1 18 15533 1 1 13 ARG HE H -5.375 0.129 6.997 1.00 . A A . 13 ARG HE 1 1 18 15534 1 1 13 ARG HG2 H -5.091 2.597 5.324 1.00 . A A . 13 ARG HG2 1 1 18 15535 1 1 13 ARG HG3 H -4.288 2.176 3.810 1.00 . A A . 13 ARG HG3 1 1 18 15536 1 1 13 ARG HH11 H -7.174 0.840 4.075 1.00 . A A . 13 ARG HH11 1 1 18 15537 1 1 13 ARG HH12 H -8.720 0.750 4.855 1.00 . A A . 13 ARG HH12 1 1 18 15538 1 1 13 ARG HH21 H -7.388 0.044 8.033 1.00 . A A . 13 ARG HH21 1 1 18 15539 1 1 13 ARG HH22 H -8.844 0.316 7.123 1.00 . A A . 13 ARG HH22 1 1 18 15540 1 1 13 ARG N N -1.642 3.804 4.444 1.00 . A A . 13 ARG N 1 1 18 15541 1 1 13 ARG NE N -5.791 0.333 6.124 1.00 . A A . 13 ARG NE 1 1 18 15542 1 1 13 ARG NH1 N -7.717 0.696 4.905 1.00 . A A . 13 ARG NH1 1 1 18 15543 1 1 13 ARG NH2 N -7.840 0.247 7.156 1.00 . A A . 13 ARG NH2 1 1 18 15544 1 1 13 ARG O O -2.547 4.205 7.879 1.00 . A A . 13 ARG O 1 1 18 15545 1 1 14 VAL C C 0.931 5.252 8.182 1.00 . A A . 14 VAL C 1 1 18 15546 1 1 14 VAL CA C 0.183 3.918 8.225 1.00 . A A . 14 VAL CA 1 1 18 15547 1 1 14 VAL CB C 1.210 2.796 8.496 1.00 . A A . 14 VAL CB 1 1 18 15548 1 1 14 VAL CG1 C 1.385 2.576 9.991 1.00 . A A . 14 VAL CG1 1 1 18 15549 1 1 14 VAL CG2 C 0.814 1.502 7.797 1.00 . A A . 14 VAL CG2 1 1 18 15550 1 1 14 VAL H H -0.071 3.387 6.185 1.00 . A A . 14 VAL H 1 1 18 15551 1 1 14 VAL HA H -0.527 3.938 9.041 1.00 . A A . 14 VAL HA 1 1 18 15552 1 1 14 VAL HB H 2.161 3.114 8.096 1.00 . A A . 14 VAL HB 1 1 18 15553 1 1 14 VAL HG11 H 0.418 2.588 10.473 1.00 . A A . 14 VAL HG11 1 1 18 15554 1 1 14 VAL HG12 H 1.860 1.621 10.162 1.00 . A A . 14 VAL HG12 1 1 18 15555 1 1 14 VAL HG13 H 2.000 3.362 10.403 1.00 . A A . 14 VAL HG13 1 1 18 15556 1 1 14 VAL HG21 H 1.053 1.574 6.744 1.00 . A A . 14 VAL HG21 1 1 18 15557 1 1 14 VAL HG22 H 1.355 0.676 8.234 1.00 . A A . 14 VAL HG22 1 1 18 15558 1 1 14 VAL HG23 H -0.248 1.339 7.913 1.00 . A A . 14 VAL HG23 1 1 18 15559 1 1 14 VAL N N -0.555 3.685 6.980 1.00 . A A . 14 VAL N 1 1 18 15560 1 1 14 VAL O O 0.644 6.176 8.945 1.00 . A A . 14 VAL O 1 1 18 15561 1 1 15 CYS C C 2.187 7.627 6.343 1.00 . A A . 15 CYS C 1 1 18 15562 1 1 15 CYS CA C 2.798 6.464 7.132 1.00 . A A . 15 CYS CA 1 1 18 15563 1 1 15 CYS CB C 4.078 5.914 6.521 1.00 . A A . 15 CYS CB 1 1 18 15564 1 1 15 CYS H H 2.119 4.509 6.770 1.00 . A A . 15 CYS H 1 1 18 15565 1 1 15 CYS HA H 3.036 6.826 8.118 1.00 . A A . 15 CYS HA 1 1 18 15566 1 1 15 CYS HB2 H 4.382 6.540 5.698 1.00 . A A . 15 CYS HB2 1 1 18 15567 1 1 15 CYS HB3 H 4.857 5.881 7.267 1.00 . A A . 15 CYS HB3 1 1 18 15568 1 1 15 CYS N N 1.916 5.313 7.300 1.00 . A A . 15 CYS N 1 1 18 15569 1 1 15 CYS O O 2.778 8.704 6.285 1.00 . A A . 15 CYS O 1 1 18 15570 1 1 15 CYS SG S 3.815 4.218 5.898 1.00 . A A . 15 CYS SG 1 1 18 15571 1 1 16 LYS C C 0.697 9.409 4.368 1.00 . A A . 16 LYS C 1 1 18 15572 1 1 16 LYS CA C 0.073 8.591 5.503 1.00 . A A . 16 LYS CA 1 1 18 15573 1 1 16 LYS CB C -0.275 9.531 6.659 1.00 . A A . 16 LYS CB 1 1 18 15574 1 1 16 LYS CD C -2.431 10.195 7.759 1.00 . A A . 16 LYS CD 1 1 18 15575 1 1 16 LYS CE C -2.239 10.772 9.148 1.00 . A A . 16 LYS CE 1 1 18 15576 1 1 16 LYS CG C -1.458 9.063 7.489 1.00 . A A . 16 LYS CG 1 1 18 15577 1 1 16 LYS H H 0.457 6.653 6.258 1.00 . A A . 16 LYS H 1 1 18 15578 1 1 16 LYS HA H -0.845 8.160 5.137 1.00 . A A . 16 LYS HA 1 1 18 15579 1 1 16 LYS HB2 H 0.583 9.614 7.309 1.00 . A A . 16 LYS HB2 1 1 18 15580 1 1 16 LYS HB3 H -0.507 10.507 6.257 1.00 . A A . 16 LYS HB3 1 1 18 15581 1 1 16 LYS HD2 H -2.276 10.975 7.031 1.00 . A A . 16 LYS HD2 1 1 18 15582 1 1 16 LYS HD3 H -3.440 9.814 7.675 1.00 . A A . 16 LYS HD3 1 1 18 15583 1 1 16 LYS HE2 H -3.159 10.657 9.702 1.00 . A A . 16 LYS HE2 1 1 18 15584 1 1 16 LYS HE3 H -1.450 10.224 9.646 1.00 . A A . 16 LYS HE3 1 1 18 15585 1 1 16 LYS HG2 H -1.974 8.282 6.953 1.00 . A A . 16 LYS HG2 1 1 18 15586 1 1 16 LYS HG3 H -1.095 8.677 8.433 1.00 . A A . 16 LYS HG3 1 1 18 15587 1 1 16 LYS HZ1 H -2.142 12.669 10.009 1.00 . A A . 16 LYS HZ1 1 1 18 15588 1 1 16 LYS HZ2 H -2.383 12.688 8.329 1.00 . A A . 16 LYS HZ2 1 1 18 15589 1 1 16 LYS HZ3 H -0.852 12.319 8.962 1.00 . A A . 16 LYS HZ3 1 1 18 15590 1 1 16 LYS N N 0.908 7.482 5.998 1.00 . A A . 16 LYS N 1 1 18 15591 1 1 16 LYS NZ N -1.879 12.211 9.108 1.00 . A A . 16 LYS NZ 1 1 18 15592 1 1 16 LYS O O 0.229 10.510 4.075 1.00 . A A . 16 LYS O 1 1 18 15593 1 1 17 ASP C C 1.558 9.364 1.324 1.00 . A A . 17 ASP C 1 1 18 15594 1 1 17 ASP CA C 2.340 9.594 2.605 1.00 . A A . 17 ASP CA 1 1 18 15595 1 1 17 ASP CB C 3.789 9.147 2.419 1.00 . A A . 17 ASP CB 1 1 18 15596 1 1 17 ASP CG C 3.919 7.650 2.310 1.00 . A A . 17 ASP CG 1 1 18 15597 1 1 17 ASP H H 2.052 8.000 3.972 1.00 . A A . 17 ASP H 1 1 18 15598 1 1 17 ASP HA H 2.319 10.649 2.838 1.00 . A A . 17 ASP HA 1 1 18 15599 1 1 17 ASP HB2 H 4.182 9.583 1.516 1.00 . A A . 17 ASP HB2 1 1 18 15600 1 1 17 ASP HB3 H 4.375 9.480 3.263 1.00 . A A . 17 ASP HB3 1 1 18 15601 1 1 17 ASP N N 1.713 8.883 3.714 1.00 . A A . 17 ASP N 1 1 18 15602 1 1 17 ASP O O 0.841 8.374 1.203 1.00 . A A . 17 ASP O 1 1 18 15603 1 1 17 ASP OD1 O 3.696 6.958 3.323 1.00 . A A . 17 ASP OD1 1 1 18 15604 1 1 17 ASP OD2 O 4.264 7.153 1.220 1.00 . A A . 17 ASP OD2 1 1 18 15605 1 1 18 GLY C C 1.814 10.485 -2.061 1.00 . A A . 18 GLY C 1 1 18 15606 1 1 18 GLY CA C 0.946 10.177 -0.859 1.00 . A A . 18 GLY CA 1 1 18 15607 1 1 18 GLY H H 2.259 11.067 0.545 1.00 . A A . 18 GLY H 1 1 18 15608 1 1 18 GLY HA2 H 0.565 9.171 -0.953 1.00 . A A . 18 GLY HA2 1 1 18 15609 1 1 18 GLY HA3 H 0.114 10.870 -0.841 1.00 . A A . 18 GLY HA3 1 1 18 15610 1 1 18 GLY N N 1.674 10.291 0.388 1.00 . A A . 18 GLY N 1 1 18 15611 1 1 18 GLY O O 3.043 10.510 -1.955 1.00 . A A . 18 GLY O 1 1 18 15612 1 1 19 GLY C C 2.219 9.781 -5.239 1.00 . A A . 19 GLY C 1 1 18 15613 1 1 19 GLY CA C 1.906 11.014 -4.417 1.00 . A A . 19 GLY CA 1 1 18 15614 1 1 19 GLY H H 0.196 10.660 -3.227 1.00 . A A . 19 GLY H 1 1 18 15615 1 1 19 GLY HA2 H 1.314 11.691 -5.017 1.00 . A A . 19 GLY HA2 1 1 18 15616 1 1 19 GLY HA3 H 2.833 11.502 -4.153 1.00 . A A . 19 GLY HA3 1 1 18 15617 1 1 19 GLY N N 1.177 10.708 -3.204 1.00 . A A . 19 GLY N 1 1 18 15618 1 1 19 GLY O O 1.318 9.112 -5.747 1.00 . A A . 19 GLY O 1 1 18 15619 1 1 20 GLU C C 4.132 7.118 -5.043 1.00 . A A . 20 GLU C 1 1 18 15620 1 1 20 GLU CA C 3.926 8.254 -6.029 1.00 . A A . 20 GLU CA 1 1 18 15621 1 1 20 GLU CB C 5.222 8.526 -6.794 1.00 . A A . 20 GLU CB 1 1 18 15622 1 1 20 GLU CD C 5.378 10.725 -8.029 1.00 . A A . 20 GLU CD 1 1 18 15623 1 1 20 GLU CG C 5.013 9.259 -8.109 1.00 . A A . 20 GLU CG 1 1 18 15624 1 1 20 GLU H H 4.165 9.990 -4.845 1.00 . A A . 20 GLU H 1 1 18 15625 1 1 20 GLU HA H 3.151 7.979 -6.728 1.00 . A A . 20 GLU HA 1 1 18 15626 1 1 20 GLU HB2 H 5.873 9.124 -6.173 1.00 . A A . 20 GLU HB2 1 1 18 15627 1 1 20 GLU HB3 H 5.706 7.584 -7.005 1.00 . A A . 20 GLU HB3 1 1 18 15628 1 1 20 GLU HG2 H 5.628 8.794 -8.865 1.00 . A A . 20 GLU HG2 1 1 18 15629 1 1 20 GLU HG3 H 3.973 9.176 -8.390 1.00 . A A . 20 GLU HG3 1 1 18 15630 1 1 20 GLU N N 3.494 9.446 -5.322 1.00 . A A . 20 GLU N 1 1 18 15631 1 1 20 GLU O O 5.098 7.118 -4.276 1.00 . A A . 20 GLU O 1 1 18 15632 1 1 20 GLU OE1 O 6.586 11.045 -8.063 1.00 . A A . 20 GLU OE1 1 1 18 15633 1 1 20 GLU OE2 O 4.461 11.566 -7.937 1.00 . A A . 20 GLU OE2 1 1 18 15634 1 1 21 LEU C C 3.280 3.736 -4.774 1.00 . A A . 21 LEU C 1 1 18 15635 1 1 21 LEU CA C 3.266 5.081 -4.068 1.00 . A A . 21 LEU CA 1 1 18 15636 1 1 21 LEU CB C 2.069 5.129 -3.118 1.00 . A A . 21 LEU CB 1 1 18 15637 1 1 21 LEU CD1 C 0.624 7.159 -2.905 1.00 . A A . 21 LEU CD1 1 1 18 15638 1 1 21 LEU CD2 C 1.744 6.204 -0.891 1.00 . A A . 21 LEU CD2 1 1 18 15639 1 1 21 LEU CG C 1.862 6.450 -2.384 1.00 . A A . 21 LEU CG 1 1 18 15640 1 1 21 LEU H H 2.430 6.241 -5.630 1.00 . A A . 21 LEU H 1 1 18 15641 1 1 21 LEU HA H 4.174 5.188 -3.494 1.00 . A A . 21 LEU HA 1 1 18 15642 1 1 21 LEU HB2 H 1.177 4.918 -3.691 1.00 . A A . 21 LEU HB2 1 1 18 15643 1 1 21 LEU HB3 H 2.193 4.351 -2.381 1.00 . A A . 21 LEU HB3 1 1 18 15644 1 1 21 LEU HD11 H 0.459 6.885 -3.936 1.00 . A A . 21 LEU HD11 1 1 18 15645 1 1 21 LEU HD12 H -0.231 6.866 -2.314 1.00 . A A . 21 LEU HD12 1 1 18 15646 1 1 21 LEU HD13 H 0.763 8.227 -2.832 1.00 . A A . 21 LEU HD13 1 1 18 15647 1 1 21 LEU HD21 H 2.698 6.381 -0.419 1.00 . A A . 21 LEU HD21 1 1 18 15648 1 1 21 LEU HD22 H 1.004 6.870 -0.473 1.00 . A A . 21 LEU HD22 1 1 18 15649 1 1 21 LEU HD23 H 1.443 5.181 -0.719 1.00 . A A . 21 LEU HD23 1 1 18 15650 1 1 21 LEU HG H 2.715 7.091 -2.555 1.00 . A A . 21 LEU HG 1 1 18 15651 1 1 21 LEU N N 3.202 6.179 -5.017 1.00 . A A . 21 LEU N 1 1 18 15652 1 1 21 LEU O O 2.999 3.641 -5.971 1.00 . A A . 21 LEU O 1 1 18 15653 1 1 22 LEU C C 1.981 0.787 -4.024 1.00 . A A . 22 LEU C 1 1 18 15654 1 1 22 LEU CA C 3.329 1.335 -4.469 1.00 . A A . 22 LEU CA 1 1 18 15655 1 1 22 LEU CB C 4.471 0.471 -3.933 1.00 . A A . 22 LEU CB 1 1 18 15656 1 1 22 LEU CD1 C 4.904 -1.227 -5.722 1.00 . A A . 22 LEU CD1 1 1 18 15657 1 1 22 LEU CD2 C 5.211 -1.833 -3.311 1.00 . A A . 22 LEU CD2 1 1 18 15658 1 1 22 LEU CG C 4.404 -1.008 -4.302 1.00 . A A . 22 LEU CG 1 1 18 15659 1 1 22 LEU H H 3.566 2.841 -3.018 1.00 . A A . 22 LEU H 1 1 18 15660 1 1 22 LEU HA H 3.366 1.352 -5.549 1.00 . A A . 22 LEU HA 1 1 18 15661 1 1 22 LEU HB2 H 5.403 0.871 -4.308 1.00 . A A . 22 LEU HB2 1 1 18 15662 1 1 22 LEU HB3 H 4.475 0.550 -2.856 1.00 . A A . 22 LEU HB3 1 1 18 15663 1 1 22 LEU HD11 H 4.370 -2.053 -6.166 1.00 . A A . 22 LEU HD11 1 1 18 15664 1 1 22 LEU HD12 H 4.736 -0.333 -6.305 1.00 . A A . 22 LEU HD12 1 1 18 15665 1 1 22 LEU HD13 H 5.961 -1.450 -5.702 1.00 . A A . 22 LEU HD13 1 1 18 15666 1 1 22 LEU HD21 H 6.183 -1.382 -3.172 1.00 . A A . 22 LEU HD21 1 1 18 15667 1 1 22 LEU HD22 H 4.692 -1.868 -2.365 1.00 . A A . 22 LEU HD22 1 1 18 15668 1 1 22 LEU HD23 H 5.332 -2.837 -3.692 1.00 . A A . 22 LEU HD23 1 1 18 15669 1 1 22 LEU HG H 3.377 -1.339 -4.255 1.00 . A A . 22 LEU HG 1 1 18 15670 1 1 22 LEU N N 3.460 2.692 -3.987 1.00 . A A . 22 LEU N 1 1 18 15671 1 1 22 LEU O O 1.738 0.621 -2.827 1.00 . A A . 22 LEU O 1 1 18 15672 1 1 23 CYS C C -0.649 -1.061 -5.035 1.00 . A A . 23 CYS C 1 1 18 15673 1 1 23 CYS CA C -0.326 0.374 -4.634 1.00 . A A . 23 CYS CA 1 1 18 15674 1 1 23 CYS CB C -1.271 1.348 -5.340 1.00 . A A . 23 CYS CB 1 1 18 15675 1 1 23 CYS H H 1.267 0.999 -5.872 1.00 . A A . 23 CYS H 1 1 18 15676 1 1 23 CYS HA H -0.449 0.476 -3.566 1.00 . A A . 23 CYS HA 1 1 18 15677 1 1 23 CYS HB2 H -1.983 0.787 -5.929 1.00 . A A . 23 CYS HB2 1 1 18 15678 1 1 23 CYS HB3 H -1.802 1.924 -4.597 1.00 . A A . 23 CYS HB3 1 1 18 15679 1 1 23 CYS HG H 0.114 1.804 -7.433 1.00 . A A . 23 CYS HG 1 1 18 15680 1 1 23 CYS N N 1.051 0.713 -4.958 1.00 . A A . 23 CYS N 1 1 18 15681 1 1 23 CYS O O 0.075 -1.668 -5.827 1.00 . A A . 23 CYS O 1 1 18 15682 1 1 23 CYS SG S -0.433 2.510 -6.446 1.00 . A A . 23 CYS SG 1 1 18 15683 1 1 24 CYS C C -2.688 -3.009 -6.265 1.00 . A A . 24 CYS C 1 1 18 15684 1 1 24 CYS CA C -2.193 -2.938 -4.818 1.00 . A A . 24 CYS CA 1 1 18 15685 1 1 24 CYS CB C -3.311 -3.371 -3.854 1.00 . A A . 24 CYS CB 1 1 18 15686 1 1 24 CYS H H -2.277 -1.050 -3.871 1.00 . A A . 24 CYS H 1 1 18 15687 1 1 24 CYS HA H -1.352 -3.607 -4.704 1.00 . A A . 24 CYS HA 1 1 18 15688 1 1 24 CYS HB2 H -2.992 -3.187 -2.841 1.00 . A A . 24 CYS HB2 1 1 18 15689 1 1 24 CYS HB3 H -4.196 -2.784 -4.058 1.00 . A A . 24 CYS HB3 1 1 18 15690 1 1 24 CYS N N -1.746 -1.590 -4.496 1.00 . A A . 24 CYS N 1 1 18 15691 1 1 24 CYS O O -2.680 -2.013 -6.995 1.00 . A A . 24 CYS O 1 1 18 15692 1 1 24 CYS SG S -3.772 -5.135 -3.973 1.00 . A A . 24 CYS SG 1 1 18 15693 1 1 25 ASP C C -5.263 -4.519 -7.870 1.00 . A A . 25 ASP C 1 1 18 15694 1 1 25 ASP CA C -3.755 -4.368 -7.968 1.00 . A A . 25 ASP CA 1 1 18 15695 1 1 25 ASP CB C -3.159 -5.607 -8.640 1.00 . A A . 25 ASP CB 1 1 18 15696 1 1 25 ASP CG C -3.425 -5.634 -10.133 1.00 . A A . 25 ASP CG 1 1 18 15697 1 1 25 ASP H H -3.224 -4.902 -5.987 1.00 . A A . 25 ASP H 1 1 18 15698 1 1 25 ASP HA H -3.525 -3.497 -8.564 1.00 . A A . 25 ASP HA 1 1 18 15699 1 1 25 ASP HB2 H -2.095 -5.620 -8.479 1.00 . A A . 25 ASP HB2 1 1 18 15700 1 1 25 ASP HB3 H -3.595 -6.492 -8.201 1.00 . A A . 25 ASP HB3 1 1 18 15701 1 1 25 ASP N N -3.182 -4.172 -6.645 1.00 . A A . 25 ASP N 1 1 18 15702 1 1 25 ASP O O -6.010 -3.981 -8.686 1.00 . A A . 25 ASP O 1 1 18 15703 1 1 25 ASP OD1 O -2.767 -4.874 -10.875 1.00 . A A . 25 ASP OD1 1 1 18 15704 1 1 25 ASP OD2 O -4.293 -6.418 -10.575 1.00 . A A . 25 ASP OD2 1 1 18 15705 1 1 26 THR C C -7.764 -4.471 -5.769 1.00 . A A . 26 THR C 1 1 18 15706 1 1 26 THR CA C -7.124 -5.508 -6.683 1.00 . A A . 26 THR CA 1 1 18 15707 1 1 26 THR CB C -7.344 -6.915 -6.103 1.00 . A A . 26 THR CB 1 1 18 15708 1 1 26 THR CG2 C -7.248 -7.964 -7.196 1.00 . A A . 26 THR CG2 1 1 18 15709 1 1 26 THR H H -5.065 -5.652 -6.238 1.00 . A A . 26 THR H 1 1 18 15710 1 1 26 THR HA H -7.599 -5.460 -7.650 1.00 . A A . 26 THR HA 1 1 18 15711 1 1 26 THR HB H -8.329 -6.961 -5.661 1.00 . A A . 26 THR HB 1 1 18 15712 1 1 26 THR HG1 H -6.666 -6.843 -4.245 1.00 . A A . 26 THR HG1 1 1 18 15713 1 1 26 THR HG21 H -6.325 -7.824 -7.745 1.00 . A A . 26 THR HG21 1 1 18 15714 1 1 26 THR HG22 H -8.087 -7.862 -7.869 1.00 . A A . 26 THR HG22 1 1 18 15715 1 1 26 THR HG23 H -7.257 -8.948 -6.752 1.00 . A A . 26 THR HG23 1 1 18 15716 1 1 26 THR N N -5.707 -5.252 -6.864 1.00 . A A . 26 THR N 1 1 18 15717 1 1 26 THR O O -8.965 -4.204 -5.860 1.00 . A A . 26 THR O 1 1 18 15718 1 1 26 THR OG1 O -6.356 -7.187 -5.095 1.00 . A A . 26 THR OG1 1 1 18 15719 1 1 27 CYS C C -6.728 -1.573 -4.153 1.00 . A A . 27 CYS C 1 1 18 15720 1 1 27 CYS CA C -7.454 -2.902 -3.952 1.00 . A A . 27 CYS CA 1 1 18 15721 1 1 27 CYS CB C -7.269 -3.420 -2.526 1.00 . A A . 27 CYS CB 1 1 18 15722 1 1 27 CYS H H -6.017 -4.153 -4.858 1.00 . A A . 27 CYS H 1 1 18 15723 1 1 27 CYS HA H -8.507 -2.757 -4.142 1.00 . A A . 27 CYS HA 1 1 18 15724 1 1 27 CYS HB2 H -6.367 -2.998 -2.110 1.00 . A A . 27 CYS HB2 1 1 18 15725 1 1 27 CYS HB3 H -8.115 -3.118 -1.926 1.00 . A A . 27 CYS HB3 1 1 18 15726 1 1 27 CYS N N -6.964 -3.895 -4.888 1.00 . A A . 27 CYS N 1 1 18 15727 1 1 27 CYS O O -5.666 -1.529 -4.774 1.00 . A A . 27 CYS O 1 1 18 15728 1 1 27 CYS SG S -7.133 -5.235 -2.427 1.00 . A A . 27 CYS SG 1 1 18 15729 1 1 28 PRO C C -5.865 1.321 -2.874 1.00 . A A . 28 PRO C 1 1 18 15730 1 1 28 PRO CA C -6.817 0.881 -3.981 1.00 . A A . 28 PRO CA 1 1 18 15731 1 1 28 PRO CB C -8.068 1.780 -3.987 1.00 . A A . 28 PRO CB 1 1 18 15732 1 1 28 PRO CD C -8.697 -0.391 -3.179 1.00 . A A . 28 PRO CD 1 1 18 15733 1 1 28 PRO CG C -9.238 0.871 -3.782 1.00 . A A . 28 PRO CG 1 1 18 15734 1 1 28 PRO HA H -6.317 0.953 -4.934 1.00 . A A . 28 PRO HA 1 1 18 15735 1 1 28 PRO HB2 H -7.993 2.504 -3.188 1.00 . A A . 28 PRO HB2 1 1 18 15736 1 1 28 PRO HB3 H -8.134 2.294 -4.934 1.00 . A A . 28 PRO HB3 1 1 18 15737 1 1 28 PRO HD2 H -8.656 -0.311 -2.102 1.00 . A A . 28 PRO HD2 1 1 18 15738 1 1 28 PRO HD3 H -9.291 -1.242 -3.477 1.00 . A A . 28 PRO HD3 1 1 18 15739 1 1 28 PRO HG2 H -9.947 1.332 -3.111 1.00 . A A . 28 PRO HG2 1 1 18 15740 1 1 28 PRO HG3 H -9.709 0.660 -4.732 1.00 . A A . 28 PRO HG3 1 1 18 15741 1 1 28 PRO N N -7.356 -0.458 -3.756 1.00 . A A . 28 PRO N 1 1 18 15742 1 1 28 PRO O O -5.731 2.514 -2.600 1.00 . A A . 28 PRO O 1 1 18 15743 1 1 29 SER C C -2.969 1.051 -1.622 1.00 . A A . 29 SER C 1 1 18 15744 1 1 29 SER CA C -4.339 0.624 -1.108 1.00 . A A . 29 SER CA 1 1 18 15745 1 1 29 SER CB C -4.209 -0.631 -0.246 1.00 . A A . 29 SER CB 1 1 18 15746 1 1 29 SER H H -5.420 -0.582 -2.459 1.00 . A A . 29 SER H 1 1 18 15747 1 1 29 SER HA H -4.759 1.422 -0.513 1.00 . A A . 29 SER HA 1 1 18 15748 1 1 29 SER HB2 H -3.173 -0.937 -0.212 1.00 . A A . 29 SER HB2 1 1 18 15749 1 1 29 SER HB3 H -4.557 -0.418 0.755 1.00 . A A . 29 SER HB3 1 1 18 15750 1 1 29 SER HG H -4.462 -2.515 -0.773 1.00 . A A . 29 SER HG 1 1 18 15751 1 1 29 SER N N -5.247 0.351 -2.212 1.00 . A A . 29 SER N 1 1 18 15752 1 1 29 SER O O -2.390 0.380 -2.475 1.00 . A A . 29 SER O 1 1 18 15753 1 1 29 SER OG O -4.987 -1.695 -0.784 1.00 . A A . 29 SER OG 1 1 18 15754 1 1 30 SER C C -0.170 2.695 -0.343 1.00 . A A . 30 SER C 1 1 18 15755 1 1 30 SER CA C -1.142 2.651 -1.515 1.00 . A A . 30 SER CA 1 1 18 15756 1 1 30 SER CB C -1.269 4.040 -2.147 1.00 . A A . 30 SER CB 1 1 18 15757 1 1 30 SER H H -2.954 2.653 -0.425 1.00 . A A . 30 SER H 1 1 18 15758 1 1 30 SER HA H -0.755 1.968 -2.245 1.00 . A A . 30 SER HA 1 1 18 15759 1 1 30 SER HB2 H -1.476 4.767 -1.374 1.00 . A A . 30 SER HB2 1 1 18 15760 1 1 30 SER HB3 H -0.343 4.294 -2.640 1.00 . A A . 30 SER HB3 1 1 18 15761 1 1 30 SER HG H -3.167 4.164 -2.635 1.00 . A A . 30 SER HG 1 1 18 15762 1 1 30 SER N N -2.452 2.160 -1.103 1.00 . A A . 30 SER N 1 1 18 15763 1 1 30 SER O O -0.559 2.993 0.789 1.00 . A A . 30 SER O 1 1 18 15764 1 1 30 SER OG O -2.321 4.080 -3.099 1.00 . A A . 30 SER OG 1 1 18 15765 1 1 31 TYR C C 3.458 2.721 -0.105 1.00 . A A . 31 TYR C 1 1 18 15766 1 1 31 TYR CA C 2.098 2.249 0.428 1.00 . A A . 31 TYR CA 1 1 18 15767 1 1 31 TYR CB C 2.224 0.811 0.954 1.00 . A A . 31 TYR CB 1 1 18 15768 1 1 31 TYR CD1 C 0.705 0.602 2.972 1.00 . A A . 31 TYR CD1 1 1 18 15769 1 1 31 TYR CD2 C 0.095 -0.548 0.973 1.00 . A A . 31 TYR CD2 1 1 18 15770 1 1 31 TYR CE1 C -0.422 0.110 3.604 1.00 . A A . 31 TYR CE1 1 1 18 15771 1 1 31 TYR CE2 C -1.034 -1.042 1.600 1.00 . A A . 31 TYR CE2 1 1 18 15772 1 1 31 TYR CG C 0.983 0.281 1.647 1.00 . A A . 31 TYR CG 1 1 18 15773 1 1 31 TYR CZ C -1.288 -0.709 2.914 1.00 . A A . 31 TYR CZ 1 1 18 15774 1 1 31 TYR H H 1.304 2.015 -1.519 1.00 . A A . 31 TYR H 1 1 18 15775 1 1 31 TYR HA H 1.794 2.895 1.237 1.00 . A A . 31 TYR HA 1 1 18 15776 1 1 31 TYR HB2 H 2.442 0.154 0.128 1.00 . A A . 31 TYR HB2 1 1 18 15777 1 1 31 TYR HB3 H 3.039 0.768 1.663 1.00 . A A . 31 TYR HB3 1 1 18 15778 1 1 31 TYR HD1 H 1.385 1.243 3.516 1.00 . A A . 31 TYR HD1 1 1 18 15779 1 1 31 TYR HD2 H 0.295 -0.808 -0.055 1.00 . A A . 31 TYR HD2 1 1 18 15780 1 1 31 TYR HE1 H -0.621 0.370 4.632 1.00 . A A . 31 TYR HE1 1 1 18 15781 1 1 31 TYR HE2 H -1.711 -1.686 1.060 1.00 . A A . 31 TYR HE2 1 1 18 15782 1 1 31 TYR HH H -2.149 -1.731 4.308 1.00 . A A . 31 TYR HH 1 1 18 15783 1 1 31 TYR N N 1.077 2.314 -0.608 1.00 . A A . 31 TYR N 1 1 18 15784 1 1 31 TYR O O 3.605 3.013 -1.289 1.00 . A A . 31 TYR O 1 1 18 15785 1 1 31 TYR OH O -2.412 -1.197 3.541 1.00 . A A . 31 TYR OH 1 1 18 15786 1 1 32 HIS C C 6.312 1.417 -0.276 1.00 . A A . 32 HIS C 1 1 18 15787 1 1 32 HIS CA C 5.869 2.744 0.341 1.00 . A A . 32 HIS CA 1 1 18 15788 1 1 32 HIS CB C 6.769 3.016 1.569 1.00 . A A . 32 HIS CB 1 1 18 15789 1 1 32 HIS CD2 C 7.832 5.333 1.949 1.00 . A A . 32 HIS CD2 1 1 18 15790 1 1 32 HIS CE1 C 6.405 6.067 3.429 1.00 . A A . 32 HIS CE1 1 1 18 15791 1 1 32 HIS CG C 6.840 4.422 2.099 1.00 . A A . 32 HIS CG 1 1 18 15792 1 1 32 HIS H H 4.297 2.162 1.611 1.00 . A A . 32 HIS H 1 1 18 15793 1 1 32 HIS HA H 5.953 3.544 -0.380 1.00 . A A . 32 HIS HA 1 1 18 15794 1 1 32 HIS HB2 H 6.428 2.394 2.381 1.00 . A A . 32 HIS HB2 1 1 18 15795 1 1 32 HIS HB3 H 7.777 2.720 1.318 1.00 . A A . 32 HIS HB3 1 1 18 15796 1 1 32 HIS HD2 H 8.684 5.257 1.287 1.00 . A A . 32 HIS HD2 1 1 18 15797 1 1 32 HIS HE1 H 5.925 6.694 4.166 1.00 . A A . 32 HIS HE1 1 1 18 15798 1 1 32 HIS HE2 H 8.188 7.083 3.067 1.00 . A A . 32 HIS HE2 1 1 18 15799 1 1 32 HIS N N 4.475 2.587 0.741 1.00 . A A . 32 HIS N 1 1 18 15800 1 1 32 HIS ND1 N 5.938 4.899 3.026 1.00 . A A . 32 HIS ND1 1 1 18 15801 1 1 32 HIS NE2 N 7.555 6.372 2.801 1.00 . A A . 32 HIS NE2 1 1 18 15802 1 1 32 HIS O O 5.599 0.834 -1.086 1.00 . A A . 32 HIS O 1 1 18 15803 1 1 33 ILE C C 8.070 -1.295 1.254 1.00 . A A . 33 ILE C 1 1 18 15804 1 1 33 ILE CA C 7.762 -0.523 -0.031 1.00 . A A . 33 ILE CA 1 1 18 15805 1 1 33 ILE CB C 9.000 -0.551 -0.952 1.00 . A A . 33 ILE CB 1 1 18 15806 1 1 33 ILE CD1 C 11.523 -0.448 -0.601 1.00 . A A . 33 ILE CD1 1 1 18 15807 1 1 33 ILE CG1 C 10.179 0.177 -0.298 1.00 . A A . 33 ILE CG1 1 1 18 15808 1 1 33 ILE CG2 C 8.669 0.082 -2.292 1.00 . A A . 33 ILE CG2 1 1 18 15809 1 1 33 ILE H H 7.836 1.306 1.001 1.00 . A A . 33 ILE H 1 1 18 15810 1 1 33 ILE HA H 6.941 -1.004 -0.542 1.00 . A A . 33 ILE HA 1 1 18 15811 1 1 33 ILE HB H 9.272 -1.583 -1.124 1.00 . A A . 33 ILE HB 1 1 18 15812 1 1 33 ILE HD11 H 11.403 -1.210 -1.357 1.00 . A A . 33 ILE HD11 1 1 18 15813 1 1 33 ILE HD12 H 12.203 0.311 -0.961 1.00 . A A . 33 ILE HD12 1 1 18 15814 1 1 33 ILE HD13 H 11.925 -0.893 0.297 1.00 . A A . 33 ILE HD13 1 1 18 15815 1 1 33 ILE HG12 H 10.201 1.197 -0.651 1.00 . A A . 33 ILE HG12 1 1 18 15816 1 1 33 ILE HG21 H 8.090 -0.611 -2.884 1.00 . A A . 33 ILE HG21 1 1 18 15817 1 1 33 ILE HG22 H 8.095 0.983 -2.125 1.00 . A A . 33 ILE HG22 1 1 18 15818 1 1 33 ILE HG23 H 9.583 0.327 -2.812 1.00 . A A . 33 ILE HG23 1 1 18 15819 1 1 33 ILE N N 7.366 0.839 0.288 1.00 . A A . 33 ILE N 1 1 18 15820 1 1 33 ILE O O 8.752 -2.320 1.224 1.00 . A A . 33 ILE O 1 1 18 15821 1 1 34 HIS C C 7.028 -0.962 4.800 1.00 . A A . 34 HIS C 1 1 18 15822 1 1 34 HIS CA C 8.040 -1.295 3.696 1.00 . A A . 34 HIS CA 1 1 18 15823 1 1 34 HIS CB C 9.425 -0.764 4.098 1.00 . A A . 34 HIS CB 1 1 18 15824 1 1 34 HIS CD2 C 9.356 1.575 5.197 1.00 . A A . 34 HIS CD2 1 1 18 15825 1 1 34 HIS CE1 C 9.742 2.745 3.401 1.00 . A A . 34 HIS CE1 1 1 18 15826 1 1 34 HIS CG C 9.509 0.738 4.143 1.00 . A A . 34 HIS CG 1 1 18 15827 1 1 34 HIS H H 7.185 0.117 2.368 1.00 . A A . 34 HIS H 1 1 18 15828 1 1 34 HIS HA H 8.098 -2.368 3.589 1.00 . A A . 34 HIS HA 1 1 18 15829 1 1 34 HIS HB2 H 9.674 -1.140 5.080 1.00 . A A . 34 HIS HB2 1 1 18 15830 1 1 34 HIS HB3 H 10.158 -1.115 3.387 1.00 . A A . 34 HIS HB3 1 1 18 15831 1 1 34 HIS HD2 H 9.155 1.296 6.223 1.00 . A A . 34 HIS HD2 1 1 18 15832 1 1 34 HIS HE1 H 9.906 3.585 2.746 1.00 . A A . 34 HIS HE1 1 1 18 15833 1 1 34 HIS HE2 H 9.618 3.664 5.260 1.00 . A A . 34 HIS HE2 1 1 18 15834 1 1 34 HIS N N 7.659 -0.736 2.397 1.00 . A A . 34 HIS N 1 1 18 15835 1 1 34 HIS ND1 N 9.754 1.483 3.011 1.00 . A A . 34 HIS ND1 1 1 18 15836 1 1 34 HIS NE2 N 9.503 2.849 4.714 1.00 . A A . 34 HIS NE2 1 1 18 15837 1 1 34 HIS O O 7.351 -1.042 5.985 1.00 . A A . 34 HIS O 1 1 18 15838 1 1 35 CYS C C 4.147 -1.292 6.009 1.00 . A A . 35 CYS C 1 1 18 15839 1 1 35 CYS CA C 4.847 -0.083 5.402 1.00 . A A . 35 CYS CA 1 1 18 15840 1 1 35 CYS CB C 3.829 0.812 4.715 1.00 . A A . 35 CYS CB 1 1 18 15841 1 1 35 CYS H H 5.649 -0.380 3.470 1.00 . A A . 35 CYS H 1 1 18 15842 1 1 35 CYS HA H 5.348 0.471 6.181 1.00 . A A . 35 CYS HA 1 1 18 15843 1 1 35 CYS HB2 H 3.004 0.210 4.361 1.00 . A A . 35 CYS HB2 1 1 18 15844 1 1 35 CYS HB3 H 3.465 1.546 5.419 1.00 . A A . 35 CYS HB3 1 1 18 15845 1 1 35 CYS N N 5.840 -0.507 4.421 1.00 . A A . 35 CYS N 1 1 18 15846 1 1 35 CYS O O 3.618 -1.231 7.119 1.00 . A A . 35 CYS O 1 1 18 15847 1 1 35 CYS SG S 4.534 1.696 3.299 1.00 . A A . 35 CYS SG 1 1 18 15848 1 1 36 LEU C C 4.469 -4.560 6.299 1.00 . A A . 36 LEU C 1 1 18 15849 1 1 36 LEU CA C 3.469 -3.603 5.662 1.00 . A A . 36 LEU CA 1 1 18 15850 1 1 36 LEU CB C 2.800 -4.271 4.459 1.00 . A A . 36 LEU CB 1 1 18 15851 1 1 36 LEU CD1 C 3.537 -5.227 2.260 1.00 . A A . 36 LEU CD1 1 1 18 15852 1 1 36 LEU CD2 C 2.643 -2.897 2.370 1.00 . A A . 36 LEU CD2 1 1 18 15853 1 1 36 LEU CG C 3.438 -3.964 3.102 1.00 . A A . 36 LEU CG 1 1 18 15854 1 1 36 LEU H H 4.567 -2.343 4.376 1.00 . A A . 36 LEU H 1 1 18 15855 1 1 36 LEU HA H 2.713 -3.350 6.392 1.00 . A A . 36 LEU HA 1 1 18 15856 1 1 36 LEU HB2 H 2.822 -5.341 4.611 1.00 . A A . 36 LEU HB2 1 1 18 15857 1 1 36 LEU HB3 H 1.769 -3.952 4.426 1.00 . A A . 36 LEU HB3 1 1 18 15858 1 1 36 LEU HD11 H 4.188 -5.936 2.749 1.00 . A A . 36 LEU HD11 1 1 18 15859 1 1 36 LEU HD12 H 2.554 -5.660 2.145 1.00 . A A . 36 LEU HD12 1 1 18 15860 1 1 36 LEU HD13 H 3.939 -4.981 1.287 1.00 . A A . 36 LEU HD13 1 1 18 15861 1 1 36 LEU HD21 H 2.579 -2.012 2.986 1.00 . A A . 36 LEU HD21 1 1 18 15862 1 1 36 LEU HD22 H 3.136 -2.655 1.441 1.00 . A A . 36 LEU HD22 1 1 18 15863 1 1 36 LEU HD23 H 1.648 -3.266 2.166 1.00 . A A . 36 LEU HD23 1 1 18 15864 1 1 36 LEU HG H 4.440 -3.588 3.258 1.00 . A A . 36 LEU HG 1 1 18 15865 1 1 36 LEU N N 4.128 -2.374 5.249 1.00 . A A . 36 LEU N 1 1 18 15866 1 1 36 LEU O O 5.662 -4.261 6.376 1.00 . A A . 36 LEU O 1 1 18 15867 1 1 37 ARG C C 5.857 -7.273 6.359 1.00 . A A . 37 ARG C 1 1 18 15868 1 1 37 ARG CA C 4.819 -6.731 7.352 1.00 . A A . 37 ARG CA 1 1 18 15869 1 1 37 ARG CB C 3.957 -7.871 7.908 1.00 . A A . 37 ARG CB 1 1 18 15870 1 1 37 ARG CD C 3.761 -9.472 9.819 1.00 . A A . 37 ARG CD 1 1 18 15871 1 1 37 ARG CG C 4.704 -8.805 8.837 1.00 . A A . 37 ARG CG 1 1 18 15872 1 1 37 ARG CZ C 3.781 -10.206 12.168 1.00 . A A . 37 ARG CZ 1 1 18 15873 1 1 37 ARG H H 3.012 -5.890 6.634 1.00 . A A . 37 ARG H 1 1 18 15874 1 1 37 ARG HA H 5.343 -6.264 8.173 1.00 . A A . 37 ARG HA 1 1 18 15875 1 1 37 ARG HB2 H 3.127 -7.447 8.451 1.00 . A A . 37 ARG HB2 1 1 18 15876 1 1 37 ARG HB3 H 3.576 -8.451 7.080 1.00 . A A . 37 ARG HB3 1 1 18 15877 1 1 37 ARG HD2 H 2.945 -8.795 10.031 1.00 . A A . 37 ARG HD2 1 1 18 15878 1 1 37 ARG HD3 H 3.372 -10.374 9.371 1.00 . A A . 37 ARG HD3 1 1 18 15879 1 1 37 ARG HE H 5.413 -9.758 11.090 1.00 . A A . 37 ARG HE 1 1 18 15880 1 1 37 ARG HG2 H 5.196 -9.567 8.250 1.00 . A A . 37 ARG HG2 1 1 18 15881 1 1 37 ARG HG3 H 5.442 -8.239 9.388 1.00 . A A . 37 ARG HG3 1 1 18 15882 1 1 37 ARG HH11 H 1.940 -10.020 11.349 1.00 . A A . 37 ARG HH11 1 1 18 15883 1 1 37 ARG HH12 H 1.960 -10.567 13.000 1.00 . A A . 37 ARG HH12 1 1 18 15884 1 1 37 ARG HH21 H 5.467 -10.466 13.269 1.00 . A A . 37 ARG HH21 1 1 18 15885 1 1 37 ARG HH22 H 3.973 -10.830 14.092 1.00 . A A . 37 ARG HH22 1 1 18 15886 1 1 37 ARG N N 3.976 -5.712 6.737 1.00 . A A . 37 ARG N 1 1 18 15887 1 1 37 ARG NE N 4.428 -9.814 11.071 1.00 . A A . 37 ARG NE 1 1 18 15888 1 1 37 ARG NH1 N 2.455 -10.267 12.171 1.00 . A A . 37 ARG NH1 1 1 18 15889 1 1 37 ARG NH2 N 4.461 -10.523 13.263 1.00 . A A . 37 ARG NH2 1 1 18 15890 1 1 37 ARG O O 7.056 -7.239 6.647 1.00 . A A . 37 ARG O 1 1 18 15891 1 1 38 PRO C C 7.072 -7.108 3.431 1.00 . A A . 38 PRO C 1 1 18 15892 1 1 38 PRO CA C 6.367 -8.258 4.153 1.00 . A A . 38 PRO CA 1 1 18 15893 1 1 38 PRO CB C 5.475 -9.045 3.174 1.00 . A A . 38 PRO CB 1 1 18 15894 1 1 38 PRO CD C 4.045 -7.893 4.710 1.00 . A A . 38 PRO CD 1 1 18 15895 1 1 38 PRO CG C 4.115 -9.078 3.795 1.00 . A A . 38 PRO CG 1 1 18 15896 1 1 38 PRO HA H 7.108 -8.918 4.582 1.00 . A A . 38 PRO HA 1 1 18 15897 1 1 38 PRO HB2 H 5.457 -8.540 2.221 1.00 . A A . 38 PRO HB2 1 1 18 15898 1 1 38 PRO HB3 H 5.870 -10.042 3.048 1.00 . A A . 38 PRO HB3 1 1 18 15899 1 1 38 PRO HD2 H 3.730 -7.013 4.170 1.00 . A A . 38 PRO HD2 1 1 18 15900 1 1 38 PRO HD3 H 3.380 -8.091 5.538 1.00 . A A . 38 PRO HD3 1 1 18 15901 1 1 38 PRO HG2 H 3.360 -9.002 3.026 1.00 . A A . 38 PRO HG2 1 1 18 15902 1 1 38 PRO HG3 H 3.989 -9.994 4.356 1.00 . A A . 38 PRO HG3 1 1 18 15903 1 1 38 PRO N N 5.436 -7.765 5.168 1.00 . A A . 38 PRO N 1 1 18 15904 1 1 38 PRO O O 6.780 -6.814 2.271 1.00 . A A . 38 PRO O 1 1 18 15905 1 1 39 ALA C C 9.669 -5.726 2.545 1.00 . A A . 39 ALA C 1 1 18 15906 1 1 39 ALA CA C 8.675 -5.280 3.610 1.00 . A A . 39 ALA CA 1 1 18 15907 1 1 39 ALA CB C 9.391 -4.534 4.727 1.00 . A A . 39 ALA CB 1 1 18 15908 1 1 39 ALA H H 8.096 -6.676 5.089 1.00 . A A . 39 ALA H 1 1 18 15909 1 1 39 ALA HA H 7.959 -4.608 3.161 1.00 . A A . 39 ALA HA 1 1 18 15910 1 1 39 ALA HB1 H 9.393 -5.143 5.619 1.00 . A A . 39 ALA HB1 1 1 18 15911 1 1 39 ALA HB2 H 10.407 -4.328 4.428 1.00 . A A . 39 ALA HB2 1 1 18 15912 1 1 39 ALA HB3 H 8.876 -3.606 4.925 1.00 . A A . 39 ALA HB3 1 1 18 15913 1 1 39 ALA N N 7.954 -6.423 4.150 1.00 . A A . 39 ALA N 1 1 18 15914 1 1 39 ALA O O 10.257 -6.805 2.643 1.00 . A A . 39 ALA O 1 1 18 15915 1 1 40 LEU C C 11.981 -4.332 0.497 1.00 . A A . 40 LEU C 1 1 18 15916 1 1 40 LEU CA C 10.741 -5.214 0.431 1.00 . A A . 40 LEU CA 1 1 18 15917 1 1 40 LEU CB C 10.026 -5.024 -0.910 1.00 . A A . 40 LEU CB 1 1 18 15918 1 1 40 LEU CD1 C 7.559 -4.663 -1.210 1.00 . A A . 40 LEU CD1 1 1 18 15919 1 1 40 LEU CD2 C 8.651 -6.704 -2.168 1.00 . A A . 40 LEU CD2 1 1 18 15920 1 1 40 LEU CG C 8.656 -5.702 -1.022 1.00 . A A . 40 LEU CG 1 1 18 15921 1 1 40 LEU H H 9.348 -4.048 1.508 1.00 . A A . 40 LEU H 1 1 18 15922 1 1 40 LEU HA H 11.039 -6.248 0.530 1.00 . A A . 40 LEU HA 1 1 18 15923 1 1 40 LEU HB2 H 9.891 -3.963 -1.074 1.00 . A A . 40 LEU HB2 1 1 18 15924 1 1 40 LEU HB3 H 10.659 -5.413 -1.692 1.00 . A A . 40 LEU HB3 1 1 18 15925 1 1 40 LEU HD11 H 6.668 -4.983 -0.689 1.00 . A A . 40 LEU HD11 1 1 18 15926 1 1 40 LEU HD12 H 7.887 -3.714 -0.811 1.00 . A A . 40 LEU HD12 1 1 18 15927 1 1 40 LEU HD13 H 7.340 -4.555 -2.262 1.00 . A A . 40 LEU HD13 1 1 18 15928 1 1 40 LEU HD21 H 9.208 -6.302 -3.000 1.00 . A A . 40 LEU HD21 1 1 18 15929 1 1 40 LEU HD22 H 9.107 -7.626 -1.841 1.00 . A A . 40 LEU HD22 1 1 18 15930 1 1 40 LEU HD23 H 7.632 -6.895 -2.475 1.00 . A A . 40 LEU HD23 1 1 18 15931 1 1 40 LEU HG H 8.452 -6.240 -0.107 1.00 . A A . 40 LEU HG 1 1 18 15932 1 1 40 LEU N N 9.839 -4.901 1.526 1.00 . A A . 40 LEU N 1 1 18 15933 1 1 40 LEU O O 11.994 -3.317 1.196 1.00 . A A . 40 LEU O 1 1 18 15934 1 1 41 TYR C C 14.218 -2.970 -1.449 1.00 . A A . 41 TYR C 1 1 18 15935 1 1 41 TYR CA C 14.245 -3.940 -0.279 1.00 . A A . 41 TYR CA 1 1 18 15936 1 1 41 TYR CB C 15.459 -4.864 -0.394 1.00 . A A . 41 TYR CB 1 1 18 15937 1 1 41 TYR CD1 C 15.788 -5.364 2.060 1.00 . A A . 41 TYR CD1 1 1 18 15938 1 1 41 TYR CD2 C 15.563 -7.200 0.557 1.00 . A A . 41 TYR CD2 1 1 18 15939 1 1 41 TYR CE1 C 15.923 -6.243 3.120 1.00 . A A . 41 TYR CE1 1 1 18 15940 1 1 41 TYR CE2 C 15.696 -8.084 1.609 1.00 . A A . 41 TYR CE2 1 1 18 15941 1 1 41 TYR CG C 15.604 -5.827 0.764 1.00 . A A . 41 TYR CG 1 1 18 15942 1 1 41 TYR CZ C 15.876 -7.603 2.889 1.00 . A A . 41 TYR CZ 1 1 18 15943 1 1 41 TYR H H 12.938 -5.523 -0.790 1.00 . A A . 41 TYR H 1 1 18 15944 1 1 41 TYR HA H 14.317 -3.376 0.639 1.00 . A A . 41 TYR HA 1 1 18 15945 1 1 41 TYR HB2 H 15.374 -5.445 -1.299 1.00 . A A . 41 TYR HB2 1 1 18 15946 1 1 41 TYR HB3 H 16.354 -4.262 -0.441 1.00 . A A . 41 TYR HB3 1 1 18 15947 1 1 41 TYR HD1 H 15.819 -4.298 2.237 1.00 . A A . 41 TYR HD1 1 1 18 15948 1 1 41 TYR HD2 H 15.424 -7.574 -0.448 1.00 . A A . 41 TYR HD2 1 1 18 15949 1 1 41 TYR HE1 H 16.065 -5.865 4.121 1.00 . A A . 41 TYR HE1 1 1 18 15950 1 1 41 TYR HE2 H 15.655 -9.147 1.427 1.00 . A A . 41 TYR HE2 1 1 18 15951 1 1 41 TYR HH H 16.791 -8.248 4.469 1.00 . A A . 41 TYR HH 1 1 18 15952 1 1 41 TYR N N 13.014 -4.713 -0.238 1.00 . A A . 41 TYR N 1 1 18 15953 1 1 41 TYR O O 14.896 -1.944 -1.437 1.00 . A A . 41 TYR O 1 1 18 15954 1 1 41 TYR OH O 16.008 -8.487 3.941 1.00 . A A . 41 TYR OH 1 1 18 15955 1 1 42 GLU C C 11.771 -2.416 -4.036 1.00 . A A . 42 GLU C 1 1 18 15956 1 1 42 GLU CA C 13.230 -2.431 -3.604 1.00 . A A . 42 GLU CA 1 1 18 15957 1 1 42 GLU CB C 14.107 -2.929 -4.756 1.00 . A A . 42 GLU CB 1 1 18 15958 1 1 42 GLU CD C 14.969 -0.889 -5.978 1.00 . A A . 42 GLU CD 1 1 18 15959 1 1 42 GLU CG C 15.301 -2.033 -5.040 1.00 . A A . 42 GLU CG 1 1 18 15960 1 1 42 GLU H H 12.844 -4.092 -2.360 1.00 . A A . 42 GLU H 1 1 18 15961 1 1 42 GLU HA H 13.527 -1.427 -3.336 1.00 . A A . 42 GLU HA 1 1 18 15962 1 1 42 GLU HB2 H 14.473 -3.916 -4.516 1.00 . A A . 42 GLU HB2 1 1 18 15963 1 1 42 GLU HB3 H 13.506 -2.985 -5.651 1.00 . A A . 42 GLU HB3 1 1 18 15964 1 1 42 GLU HG2 H 15.654 -1.620 -4.107 1.00 . A A . 42 GLU HG2 1 1 18 15965 1 1 42 GLU HG3 H 16.083 -2.629 -5.486 1.00 . A A . 42 GLU HG3 1 1 18 15966 1 1 42 GLU N N 13.392 -3.282 -2.437 1.00 . A A . 42 GLU N 1 1 18 15967 1 1 42 GLU O O 10.965 -3.208 -3.544 1.00 . A A . 42 GLU O 1 1 18 15968 1 1 42 GLU OE1 O 13.773 -0.558 -6.138 1.00 . A A . 42 GLU OE1 1 1 18 15969 1 1 42 GLU OE2 O 15.907 -0.308 -6.559 1.00 . A A . 42 GLU OE2 1 1 18 15970 1 1 43 VAL C C 9.869 -2.660 -6.509 1.00 . A A . 43 VAL C 1 1 18 15971 1 1 43 VAL CA C 10.100 -1.504 -5.539 1.00 . A A . 43 VAL CA 1 1 18 15972 1 1 43 VAL CB C 9.835 -0.167 -6.267 1.00 . A A . 43 VAL CB 1 1 18 15973 1 1 43 VAL CG1 C 8.351 0.004 -6.551 1.00 . A A . 43 VAL CG1 1 1 18 15974 1 1 43 VAL CG2 C 10.363 1.007 -5.453 1.00 . A A . 43 VAL CG2 1 1 18 15975 1 1 43 VAL H H 12.154 -1.000 -5.392 1.00 . A A . 43 VAL H 1 1 18 15976 1 1 43 VAL HA H 9.404 -1.589 -4.715 1.00 . A A . 43 VAL HA 1 1 18 15977 1 1 43 VAL HB H 10.359 -0.186 -7.212 1.00 . A A . 43 VAL HB 1 1 18 15978 1 1 43 VAL HG11 H 8.206 0.190 -7.606 1.00 . A A . 43 VAL HG11 1 1 18 15979 1 1 43 VAL HG12 H 7.824 -0.895 -6.268 1.00 . A A . 43 VAL HG12 1 1 18 15980 1 1 43 VAL HG13 H 7.969 0.839 -5.983 1.00 . A A . 43 VAL HG13 1 1 18 15981 1 1 43 VAL HG21 H 10.586 0.679 -4.448 1.00 . A A . 43 VAL HG21 1 1 18 15982 1 1 43 VAL HG22 H 11.263 1.388 -5.914 1.00 . A A . 43 VAL HG22 1 1 18 15983 1 1 43 VAL HG23 H 9.616 1.785 -5.421 1.00 . A A . 43 VAL HG23 1 1 18 15984 1 1 43 VAL N N 11.449 -1.565 -4.997 1.00 . A A . 43 VAL N 1 1 18 15985 1 1 43 VAL O O 10.589 -2.802 -7.497 1.00 . A A . 43 VAL O 1 1 18 15986 1 1 44 PRO C C 8.237 -4.280 -8.487 1.00 . A A . 44 PRO C 1 1 18 15987 1 1 44 PRO CA C 8.569 -4.684 -7.053 1.00 . A A . 44 PRO CA 1 1 18 15988 1 1 44 PRO CB C 7.348 -5.311 -6.372 1.00 . A A . 44 PRO CB 1 1 18 15989 1 1 44 PRO CD C 8.023 -3.456 -5.031 1.00 . A A . 44 PRO CD 1 1 18 15990 1 1 44 PRO CG C 6.831 -4.265 -5.446 1.00 . A A . 44 PRO CG 1 1 18 15991 1 1 44 PRO HA H 9.380 -5.396 -7.066 1.00 . A A . 44 PRO HA 1 1 18 15992 1 1 44 PRO HB2 H 6.612 -5.575 -7.119 1.00 . A A . 44 PRO HB2 1 1 18 15993 1 1 44 PRO HB3 H 7.652 -6.194 -5.833 1.00 . A A . 44 PRO HB3 1 1 18 15994 1 1 44 PRO HD2 H 7.733 -2.437 -4.822 1.00 . A A . 44 PRO HD2 1 1 18 15995 1 1 44 PRO HD3 H 8.504 -3.900 -4.175 1.00 . A A . 44 PRO HD3 1 1 18 15996 1 1 44 PRO HG2 H 6.116 -3.640 -5.960 1.00 . A A . 44 PRO HG2 1 1 18 15997 1 1 44 PRO HG3 H 6.375 -4.729 -4.584 1.00 . A A . 44 PRO HG3 1 1 18 15998 1 1 44 PRO N N 8.888 -3.526 -6.214 1.00 . A A . 44 PRO N 1 1 18 15999 1 1 44 PRO O O 7.706 -3.193 -8.733 1.00 . A A . 44 PRO O 1 1 18 16000 1 1 45 ASP C C 6.958 -5.191 -11.264 1.00 . A A . 45 ASP C 1 1 18 16001 1 1 45 ASP CA C 8.379 -4.850 -10.836 1.00 . A A . 45 ASP CA 1 1 18 16002 1 1 45 ASP CB C 9.380 -5.620 -11.694 1.00 . A A . 45 ASP CB 1 1 18 16003 1 1 45 ASP CG C 9.359 -5.166 -13.138 1.00 . A A . 45 ASP CG 1 1 18 16004 1 1 45 ASP H H 9.022 -5.984 -9.168 1.00 . A A . 45 ASP H 1 1 18 16005 1 1 45 ASP HA H 8.539 -3.791 -10.981 1.00 . A A . 45 ASP HA 1 1 18 16006 1 1 45 ASP HB2 H 10.374 -5.471 -11.302 1.00 . A A . 45 ASP HB2 1 1 18 16007 1 1 45 ASP HB3 H 9.137 -6.672 -11.663 1.00 . A A . 45 ASP HB3 1 1 18 16008 1 1 45 ASP N N 8.587 -5.139 -9.428 1.00 . A A . 45 ASP N 1 1 18 16009 1 1 45 ASP O O 6.707 -6.260 -11.823 1.00 . A A . 45 ASP O 1 1 18 16010 1 1 45 ASP OD1 O 9.935 -4.100 -13.435 1.00 . A A . 45 ASP OD1 1 1 18 16011 1 1 45 ASP OD2 O 8.761 -5.868 -13.980 1.00 . A A . 45 ASP OD2 1 1 18 16012 1 1 46 GLY C C 3.891 -5.430 -10.523 1.00 . A A . 46 GLY C 1 1 18 16013 1 1 46 GLY CA C 4.651 -4.461 -11.409 1.00 . A A . 46 GLY CA 1 1 18 16014 1 1 46 GLY H H 6.297 -3.443 -10.554 1.00 . A A . 46 GLY H 1 1 18 16015 1 1 46 GLY HA2 H 4.151 -3.505 -11.386 1.00 . A A . 46 GLY HA2 1 1 18 16016 1 1 46 GLY HA3 H 4.635 -4.834 -12.423 1.00 . A A . 46 GLY HA3 1 1 18 16017 1 1 46 GLY N N 6.033 -4.274 -11.003 1.00 . A A . 46 GLY N 1 1 18 16018 1 1 46 GLY O O 2.894 -5.061 -9.903 1.00 . A A . 46 GLY O 1 1 18 16019 1 1 47 GLU C C 3.759 -7.474 -8.250 1.00 . A A . 47 GLU C 1 1 18 16020 1 1 47 GLU CA C 3.660 -7.729 -9.749 1.00 . A A . 47 GLU CA 1 1 18 16021 1 1 47 GLU CB C 4.252 -9.099 -10.090 1.00 . A A . 47 GLU CB 1 1 18 16022 1 1 47 GLU CD C 2.490 -9.422 -11.890 1.00 . A A . 47 GLU CD 1 1 18 16023 1 1 47 GLU CG C 3.955 -9.560 -11.510 1.00 . A A . 47 GLU CG 1 1 18 16024 1 1 47 GLU H H 5.118 -6.915 -11.051 1.00 . A A . 47 GLU H 1 1 18 16025 1 1 47 GLU HA H 2.618 -7.721 -10.032 1.00 . A A . 47 GLU HA 1 1 18 16026 1 1 47 GLU HB2 H 5.323 -9.056 -9.965 1.00 . A A . 47 GLU HB2 1 1 18 16027 1 1 47 GLU HB3 H 3.849 -9.834 -9.405 1.00 . A A . 47 GLU HB3 1 1 18 16028 1 1 47 GLU HG2 H 4.543 -8.969 -12.197 1.00 . A A . 47 GLU HG2 1 1 18 16029 1 1 47 GLU HG3 H 4.238 -10.599 -11.603 1.00 . A A . 47 GLU HG3 1 1 18 16030 1 1 47 GLU N N 4.330 -6.682 -10.509 1.00 . A A . 47 GLU N 1 1 18 16031 1 1 47 GLU O O 4.837 -7.584 -7.657 1.00 . A A . 47 GLU O 1 1 18 16032 1 1 47 GLU OE1 O 1.618 -9.558 -11.002 1.00 . A A . 47 GLU OE1 1 1 18 16033 1 1 47 GLU OE2 O 2.204 -9.188 -13.083 1.00 . A A . 47 GLU OE2 1 1 18 16034 1 1 48 TRP C C 1.067 -6.642 -5.829 1.00 . A A . 48 TRP C 1 1 18 16035 1 1 48 TRP CA C 2.524 -6.871 -6.224 1.00 . A A . 48 TRP CA 1 1 18 16036 1 1 48 TRP CB C 3.361 -5.644 -5.841 1.00 . A A . 48 TRP CB 1 1 18 16037 1 1 48 TRP CD1 C 4.378 -6.131 -3.542 1.00 . A A . 48 TRP CD1 1 1 18 16038 1 1 48 TRP CD2 C 2.772 -4.571 -3.525 1.00 . A A . 48 TRP CD2 1 1 18 16039 1 1 48 TRP CE2 C 3.242 -4.745 -2.210 1.00 . A A . 48 TRP CE2 1 1 18 16040 1 1 48 TRP CE3 C 1.755 -3.640 -3.759 1.00 . A A . 48 TRP CE3 1 1 18 16041 1 1 48 TRP CG C 3.513 -5.467 -4.361 1.00 . A A . 48 TRP CG 1 1 18 16042 1 1 48 TRP CH2 C 1.741 -3.113 -1.393 1.00 . A A . 48 TRP CH2 1 1 18 16043 1 1 48 TRP CZ2 C 2.733 -4.018 -1.135 1.00 . A A . 48 TRP CZ2 1 1 18 16044 1 1 48 TRP CZ3 C 1.251 -2.920 -2.692 1.00 . A A . 48 TRP CZ3 1 1 18 16045 1 1 48 TRP H H 1.798 -7.080 -8.198 1.00 . A A . 48 TRP H 1 1 18 16046 1 1 48 TRP HA H 2.899 -7.735 -5.697 1.00 . A A . 48 TRP HA 1 1 18 16047 1 1 48 TRP HB2 H 4.350 -5.743 -6.267 1.00 . A A . 48 TRP HB2 1 1 18 16048 1 1 48 TRP HB3 H 2.891 -4.757 -6.239 1.00 . A A . 48 TRP HB3 1 1 18 16049 1 1 48 TRP HD1 H 5.080 -6.882 -3.877 1.00 . A A . 48 TRP HD1 1 1 18 16050 1 1 48 TRP HE1 H 4.731 -6.027 -1.475 1.00 . A A . 48 TRP HE1 1 1 18 16051 1 1 48 TRP HE3 H 1.366 -3.480 -4.753 1.00 . A A . 48 TRP HE3 1 1 18 16052 1 1 48 TRP HH2 H 1.318 -2.529 -0.588 1.00 . A A . 48 TRP HH2 1 1 18 16053 1 1 48 TRP HZ2 H 3.101 -4.156 -0.129 1.00 . A A . 48 TRP HZ2 1 1 18 16054 1 1 48 TRP HZ3 H 0.466 -2.195 -2.855 1.00 . A A . 48 TRP HZ3 1 1 18 16055 1 1 48 TRP N N 2.617 -7.138 -7.654 1.00 . A A . 48 TRP N 1 1 18 16056 1 1 48 TRP NE1 N 4.223 -5.701 -2.247 1.00 . A A . 48 TRP NE1 1 1 18 16057 1 1 48 TRP O O 0.292 -6.071 -6.597 1.00 . A A . 48 TRP O 1 1 18 16058 1 1 49 GLN C C -0.548 -6.495 -2.608 1.00 . A A . 49 GLN C 1 1 18 16059 1 1 49 GLN CA C -0.625 -6.838 -4.090 1.00 . A A . 49 GLN CA 1 1 18 16060 1 1 49 GLN CB C -1.493 -8.078 -4.305 1.00 . A A . 49 GLN CB 1 1 18 16061 1 1 49 GLN CD C -3.115 -9.231 -5.862 1.00 . A A . 49 GLN CD 1 1 18 16062 1 1 49 GLN CG C -2.508 -7.917 -5.424 1.00 . A A . 49 GLN CG 1 1 18 16063 1 1 49 GLN H H 1.387 -7.480 -4.045 1.00 . A A . 49 GLN H 1 1 18 16064 1 1 49 GLN HA H -1.063 -6.003 -4.617 1.00 . A A . 49 GLN HA 1 1 18 16065 1 1 49 GLN HB2 H -0.853 -8.914 -4.546 1.00 . A A . 49 GLN HB2 1 1 18 16066 1 1 49 GLN HB3 H -2.025 -8.295 -3.391 1.00 . A A . 49 GLN HB3 1 1 18 16067 1 1 49 GLN HE21 H -4.947 -8.522 -5.539 1.00 . A A . 49 GLN HE21 1 1 18 16068 1 1 49 GLN HE22 H -4.860 -10.145 -6.148 1.00 . A A . 49 GLN HE22 1 1 18 16069 1 1 49 GLN HG2 H -3.302 -7.269 -5.081 1.00 . A A . 49 GLN HG2 1 1 18 16070 1 1 49 GLN HG3 H -2.018 -7.465 -6.273 1.00 . A A . 49 GLN HG3 1 1 18 16071 1 1 49 GLN N N 0.714 -7.055 -4.620 1.00 . A A . 49 GLN N 1 1 18 16072 1 1 49 GLN NE2 N -4.436 -9.311 -5.840 1.00 . A A . 49 GLN NE2 1 1 18 16073 1 1 49 GLN O O 0.384 -6.917 -1.918 1.00 . A A . 49 GLN O 1 1 18 16074 1 1 49 GLN OE1 O -2.404 -10.172 -6.217 1.00 . A A . 49 GLN OE1 1 1 18 16075 1 1 50 CYS C C -1.777 -6.357 0.195 1.00 . A A . 50 CYS C 1 1 18 16076 1 1 50 CYS CA C -1.470 -5.204 -0.766 1.00 . A A . 50 CYS CA 1 1 18 16077 1 1 50 CYS CB C -2.468 -4.046 -0.587 1.00 . A A . 50 CYS CB 1 1 18 16078 1 1 50 CYS H H -2.146 -5.299 -2.769 1.00 . A A . 50 CYS H 1 1 18 16079 1 1 50 CYS HA H -0.479 -4.839 -0.550 1.00 . A A . 50 CYS HA 1 1 18 16080 1 1 50 CYS HB2 H -2.153 -3.441 0.250 1.00 . A A . 50 CYS HB2 1 1 18 16081 1 1 50 CYS HB3 H -2.459 -3.439 -1.480 1.00 . A A . 50 CYS HB3 1 1 18 16082 1 1 50 CYS N N -1.475 -5.661 -2.146 1.00 . A A . 50 CYS N 1 1 18 16083 1 1 50 CYS O O -2.336 -7.374 -0.203 1.00 . A A . 50 CYS O 1 1 18 16084 1 1 50 CYS SG S -4.195 -4.542 -0.276 1.00 . A A . 50 CYS SG 1 1 18 16085 1 1 51 PRO C C -2.915 -7.363 3.062 1.00 . A A . 51 PRO C 1 1 18 16086 1 1 51 PRO CA C -1.518 -7.327 2.440 1.00 . A A . 51 PRO CA 1 1 18 16087 1 1 51 PRO CB C -0.477 -6.979 3.499 1.00 . A A . 51 PRO CB 1 1 18 16088 1 1 51 PRO CD C -0.593 -5.113 2.012 1.00 . A A . 51 PRO CD 1 1 18 16089 1 1 51 PRO CG C -0.390 -5.493 3.452 1.00 . A A . 51 PRO CG 1 1 18 16090 1 1 51 PRO HA H -1.291 -8.294 2.011 1.00 . A A . 51 PRO HA 1 1 18 16091 1 1 51 PRO HB2 H -0.811 -7.328 4.465 1.00 . A A . 51 PRO HB2 1 1 18 16092 1 1 51 PRO HB3 H 0.467 -7.440 3.247 1.00 . A A . 51 PRO HB3 1 1 18 16093 1 1 51 PRO HD2 H -1.161 -4.197 1.940 1.00 . A A . 51 PRO HD2 1 1 18 16094 1 1 51 PRO HD3 H 0.360 -5.007 1.513 1.00 . A A . 51 PRO HD3 1 1 18 16095 1 1 51 PRO HG2 H -1.165 -5.061 4.067 1.00 . A A . 51 PRO HG2 1 1 18 16096 1 1 51 PRO HG3 H 0.583 -5.172 3.791 1.00 . A A . 51 PRO HG3 1 1 18 16097 1 1 51 PRO N N -1.352 -6.250 1.459 1.00 . A A . 51 PRO N 1 1 18 16098 1 1 51 PRO O O -3.091 -7.845 4.185 1.00 . A A . 51 PRO O 1 1 18 16099 1 1 52 ARG C C -6.208 -7.636 2.108 1.00 . A A . 52 ARG C 1 1 18 16100 1 1 52 ARG CA C -5.253 -6.737 2.890 1.00 . A A . 52 ARG CA 1 1 18 16101 1 1 52 ARG CB C -5.757 -5.298 2.877 1.00 . A A . 52 ARG CB 1 1 18 16102 1 1 52 ARG CD C -5.176 -2.874 3.239 1.00 . A A . 52 ARG CD 1 1 18 16103 1 1 52 ARG CG C -4.796 -4.316 3.527 1.00 . A A . 52 ARG CG 1 1 18 16104 1 1 52 ARG CZ C -7.075 -2.237 1.803 1.00 . A A . 52 ARG CZ 1 1 18 16105 1 1 52 ARG H H -3.689 -6.387 1.495 1.00 . A A . 52 ARG H 1 1 18 16106 1 1 52 ARG HA H -5.220 -7.083 3.913 1.00 . A A . 52 ARG HA 1 1 18 16107 1 1 52 ARG HB2 H -5.914 -4.992 1.853 1.00 . A A . 52 ARG HB2 1 1 18 16108 1 1 52 ARG HB3 H -6.696 -5.253 3.406 1.00 . A A . 52 ARG HB3 1 1 18 16109 1 1 52 ARG HD2 H -5.841 -2.529 4.017 1.00 . A A . 52 ARG HD2 1 1 18 16110 1 1 52 ARG HD3 H -4.279 -2.272 3.242 1.00 . A A . 52 ARG HD3 1 1 18 16111 1 1 52 ARG HE H -5.334 -2.987 1.142 1.00 . A A . 52 ARG HE 1 1 18 16112 1 1 52 ARG HG2 H -4.807 -4.472 4.595 1.00 . A A . 52 ARG HG2 1 1 18 16113 1 1 52 ARG HG3 H -3.800 -4.499 3.148 1.00 . A A . 52 ARG HG3 1 1 18 16114 1 1 52 ARG HH11 H -7.421 -2.067 3.801 1.00 . A A . 52 ARG HH11 1 1 18 16115 1 1 52 ARG HH12 H -8.730 -1.562 2.771 1.00 . A A . 52 ARG HH12 1 1 18 16116 1 1 52 ARG HH21 H -7.046 -2.319 -0.221 1.00 . A A . 52 ARG HH21 1 1 18 16117 1 1 52 ARG HH22 H -8.529 -1.726 0.474 1.00 . A A . 52 ARG HH22 1 1 18 16118 1 1 52 ARG N N -3.894 -6.805 2.363 1.00 . A A . 52 ARG N 1 1 18 16119 1 1 52 ARG NE N -5.844 -2.722 1.948 1.00 . A A . 52 ARG NE 1 1 18 16120 1 1 52 ARG NH1 N -7.800 -1.930 2.875 1.00 . A A . 52 ARG NH1 1 1 18 16121 1 1 52 ARG NH2 N -7.590 -2.079 0.591 1.00 . A A . 52 ARG NH2 1 1 18 16122 1 1 52 ARG O O -7.234 -8.067 2.639 1.00 . A A . 52 ARG O 1 1 18 16123 1 1 53 CYS C C -6.292 -10.314 0.420 1.00 . A A . 53 CYS C 1 1 18 16124 1 1 53 CYS CA C -6.650 -8.875 0.073 1.00 . A A . 53 CYS CA 1 1 18 16125 1 1 53 CYS CB C -6.392 -8.599 -1.404 1.00 . A A . 53 CYS CB 1 1 18 16126 1 1 53 CYS H H -4.990 -7.656 0.516 1.00 . A A . 53 CYS H 1 1 18 16127 1 1 53 CYS HA H -7.690 -8.699 0.299 1.00 . A A . 53 CYS HA 1 1 18 16128 1 1 53 CYS HB2 H -6.505 -9.516 -1.962 1.00 . A A . 53 CYS HB2 1 1 18 16129 1 1 53 CYS HB3 H -7.110 -7.875 -1.756 1.00 . A A . 53 CYS HB3 1 1 18 16130 1 1 53 CYS N N -5.845 -7.973 0.875 1.00 . A A . 53 CYS N 1 1 18 16131 1 1 53 CYS O O -7.115 -11.227 0.325 1.00 . A A . 53 CYS O 1 1 18 16132 1 1 53 CYS SG S -4.730 -7.939 -1.740 1.00 . A A . 53 CYS SG 1 1 18 16133 1 1 54 THR C C -5.256 -12.297 2.486 1.00 . A A . 54 THR C 1 1 18 16134 1 1 54 THR CA C -4.545 -11.785 1.241 1.00 . A A . 54 THR CA 1 1 18 16135 1 1 54 THR CB C -3.037 -11.706 1.521 1.00 . A A . 54 THR CB 1 1 18 16136 1 1 54 THR CG2 C -2.262 -12.593 0.563 1.00 . A A . 54 THR CG2 1 1 18 16137 1 1 54 THR H H -4.457 -9.714 0.909 1.00 . A A . 54 THR H 1 1 18 16138 1 1 54 THR HA H -4.706 -12.477 0.428 1.00 . A A . 54 THR HA 1 1 18 16139 1 1 54 THR HB H -2.854 -12.041 2.534 1.00 . A A . 54 THR HB 1 1 18 16140 1 1 54 THR HG1 H -2.419 -10.161 0.450 1.00 . A A . 54 THR HG1 1 1 18 16141 1 1 54 THR HG21 H -1.913 -11.998 -0.268 1.00 . A A . 54 THR HG21 1 1 18 16142 1 1 54 THR HG22 H -2.907 -13.378 0.197 1.00 . A A . 54 THR HG22 1 1 18 16143 1 1 54 THR HG23 H -1.418 -13.029 1.075 1.00 . A A . 54 THR HG23 1 1 18 16144 1 1 54 THR N N -5.052 -10.490 0.847 1.00 . A A . 54 THR N 1 1 18 16145 1 1 54 THR O O -5.268 -11.633 3.525 1.00 . A A . 54 THR O 1 1 18 16146 1 1 54 THR OG1 O -2.594 -10.347 1.385 1.00 . A A . 54 THR OG1 1 1 18 16147 1 1 55 CYS C C -5.540 -15.371 3.923 1.00 . A A . 55 CYS C 1 1 18 16148 1 1 55 CYS CA C -6.388 -14.168 3.531 1.00 . A A . 55 CYS CA 1 1 18 16149 1 1 55 CYS CB C -7.815 -14.604 3.187 1.00 . A A . 55 CYS CB 1 1 18 16150 1 1 55 CYS H H -5.655 -14.018 1.557 1.00 . A A . 55 CYS H 1 1 18 16151 1 1 55 CYS HA H -6.414 -13.470 4.354 1.00 . A A . 55 CYS HA 1 1 18 16152 1 1 55 CYS HB2 H -7.821 -15.663 2.975 1.00 . A A . 55 CYS HB2 1 1 18 16153 1 1 55 CYS HB3 H -8.457 -14.407 4.034 1.00 . A A . 55 CYS HB3 1 1 18 16154 1 1 55 CYS HG H -7.801 -12.657 1.531 1.00 . A A . 55 CYS HG 1 1 18 16155 1 1 55 CYS N N -5.775 -13.509 2.394 1.00 . A A . 55 CYS N 1 1 18 16156 1 1 55 CYS O O -5.613 -16.425 3.290 1.00 . A A . 55 CYS O 1 1 18 16157 1 1 55 CYS SG S -8.519 -13.754 1.752 1.00 . A A . 55 CYS SG 1 1 18 16158 1 1 56 PRO C C -4.306 -17.414 5.899 1.00 . A A . 56 PRO C 1 1 18 16159 1 1 56 PRO CA C -3.643 -16.211 5.245 1.00 . A A . 56 PRO CA 1 1 18 16160 1 1 56 PRO CB C -2.722 -15.503 6.246 1.00 . A A . 56 PRO CB 1 1 18 16161 1 1 56 PRO CD C -4.360 -13.909 5.575 1.00 . A A . 56 PRO CD 1 1 18 16162 1 1 56 PRO CG C -3.501 -14.330 6.729 1.00 . A A . 56 PRO CG 1 1 18 16163 1 1 56 PRO HA H -3.066 -16.540 4.395 1.00 . A A . 56 PRO HA 1 1 18 16164 1 1 56 PRO HB2 H -2.483 -16.177 7.056 1.00 . A A . 56 PRO HB2 1 1 18 16165 1 1 56 PRO HB3 H -1.816 -15.194 5.749 1.00 . A A . 56 PRO HB3 1 1 18 16166 1 1 56 PRO HD2 H -5.284 -13.476 5.929 1.00 . A A . 56 PRO HD2 1 1 18 16167 1 1 56 PRO HD3 H -3.828 -13.211 4.946 1.00 . A A . 56 PRO HD3 1 1 18 16168 1 1 56 PRO HG2 H -4.117 -14.618 7.570 1.00 . A A . 56 PRO HG2 1 1 18 16169 1 1 56 PRO HG3 H -2.830 -13.532 7.009 1.00 . A A . 56 PRO HG3 1 1 18 16170 1 1 56 PRO N N -4.607 -15.176 4.866 1.00 . A A . 56 PRO N 1 1 18 16171 1 1 56 PRO O O -5.327 -17.284 6.579 1.00 . A A . 56 PRO O 1 1 18 16172 1 1 57 ALA C C -3.766 -19.849 7.799 1.00 . A A . 57 ALA C 1 1 18 16173 1 1 57 ALA CA C -4.185 -19.795 6.334 1.00 . A A . 57 ALA CA 1 1 18 16174 1 1 57 ALA CB C -3.651 -21.004 5.579 1.00 . A A . 57 ALA CB 1 1 18 16175 1 1 57 ALA H H -2.872 -18.603 5.184 1.00 . A A . 57 ALA H 1 1 18 16176 1 1 57 ALA HA H -5.265 -19.800 6.268 1.00 . A A . 57 ALA HA 1 1 18 16177 1 1 57 ALA HB1 H -3.813 -20.868 4.520 1.00 . A A . 57 ALA HB1 1 1 18 16178 1 1 57 ALA HB2 H -2.592 -21.107 5.769 1.00 . A A . 57 ALA HB2 1 1 18 16179 1 1 57 ALA HB3 H -4.166 -21.892 5.911 1.00 . A A . 57 ALA HB3 1 1 18 16180 1 1 57 ALA N N -3.698 -18.574 5.720 1.00 . A A . 57 ALA N 1 1 18 16181 1 1 57 ALA O O -3.242 -18.870 8.339 1.00 . A A . 57 ALA O 1 1 18 16182 1 1 58 LEU C C -2.101 -21.485 9.924 1.00 . A A . 58 LEU C 1 1 18 16183 1 1 58 LEU CA C -3.588 -21.159 9.830 1.00 . A A . 58 LEU CA 1 1 18 16184 1 1 58 LEU CB C -4.418 -22.258 10.490 1.00 . A A . 58 LEU CB 1 1 18 16185 1 1 58 LEU CD1 C -6.522 -21.383 11.535 1.00 . A A . 58 LEU CD1 1 1 18 16186 1 1 58 LEU CD2 C -5.088 -23.011 12.783 1.00 . A A . 58 LEU CD2 1 1 18 16187 1 1 58 LEU CG C -5.099 -21.853 11.797 1.00 . A A . 58 LEU CG 1 1 18 16188 1 1 58 LEU H H -4.394 -21.739 7.959 1.00 . A A . 58 LEU H 1 1 18 16189 1 1 58 LEU HA H -3.771 -20.225 10.341 1.00 . A A . 58 LEU HA 1 1 18 16190 1 1 58 LEU HB2 H -5.180 -22.572 9.792 1.00 . A A . 58 LEU HB2 1 1 18 16191 1 1 58 LEU HB3 H -3.770 -23.098 10.692 1.00 . A A . 58 LEU HB3 1 1 18 16192 1 1 58 LEU HD11 H -6.690 -20.443 12.039 1.00 . A A . 58 LEU HD11 1 1 18 16193 1 1 58 LEU HD12 H -6.670 -21.253 10.474 1.00 . A A . 58 LEU HD12 1 1 18 16194 1 1 58 LEU HD13 H -7.219 -22.120 11.908 1.00 . A A . 58 LEU HD13 1 1 18 16195 1 1 58 LEU HD21 H -4.657 -22.681 13.717 1.00 . A A . 58 LEU HD21 1 1 18 16196 1 1 58 LEU HD22 H -6.099 -23.348 12.952 1.00 . A A . 58 LEU HD22 1 1 18 16197 1 1 58 LEU HD23 H -4.499 -23.821 12.380 1.00 . A A . 58 LEU HD23 1 1 18 16198 1 1 58 LEU HG H -4.553 -21.032 12.239 1.00 . A A . 58 LEU HG 1 1 18 16199 1 1 58 LEU N N -3.979 -20.988 8.438 1.00 . A A . 58 LEU N 1 1 18 16200 1 1 58 LEU O O -1.709 -22.652 9.857 1.00 . A A . 58 LEU O 1 1 18 16201 1 1 59 LYS C C 0.719 -21.026 8.687 1.00 . A A . 59 LYS C 1 1 18 16202 1 1 59 LYS CA C 0.174 -20.536 10.026 1.00 . A A . 59 LYS CA 1 1 18 16203 1 1 59 LYS CB C 0.645 -21.448 11.164 1.00 . A A . 59 LYS CB 1 1 18 16204 1 1 59 LYS CD C 0.593 -19.629 12.895 1.00 . A A . 59 LYS CD 1 1 18 16205 1 1 59 LYS CE C 0.693 -19.682 14.410 1.00 . A A . 59 LYS CE 1 1 18 16206 1 1 59 LYS CG C 1.425 -20.720 12.245 1.00 . A A . 59 LYS CG 1 1 18 16207 1 1 59 LYS H H -1.687 -19.531 9.984 1.00 . A A . 59 LYS H 1 1 18 16208 1 1 59 LYS HA H 0.560 -19.542 10.200 1.00 . A A . 59 LYS HA 1 1 18 16209 1 1 59 LYS HB2 H -0.219 -21.905 11.622 1.00 . A A . 59 LYS HB2 1 1 18 16210 1 1 59 LYS HB3 H 1.275 -22.222 10.753 1.00 . A A . 59 LYS HB3 1 1 18 16211 1 1 59 LYS HD2 H 0.946 -18.667 12.555 1.00 . A A . 59 LYS HD2 1 1 18 16212 1 1 59 LYS HD3 H -0.440 -19.760 12.606 1.00 . A A . 59 LYS HD3 1 1 18 16213 1 1 59 LYS HE2 H -0.086 -19.065 14.831 1.00 . A A . 59 LYS HE2 1 1 18 16214 1 1 59 LYS HE3 H 0.555 -20.704 14.733 1.00 . A A . 59 LYS HE3 1 1 18 16215 1 1 59 LYS HG2 H 1.722 -21.432 13.000 1.00 . A A . 59 LYS HG2 1 1 18 16216 1 1 59 LYS HG3 H 2.305 -20.275 11.802 1.00 . A A . 59 LYS HG3 1 1 18 16217 1 1 59 LYS HZ1 H 2.136 -19.436 15.901 1.00 . A A . 59 LYS HZ1 1 1 18 16218 1 1 59 LYS HZ2 H 2.073 -18.160 14.783 1.00 . A A . 59 LYS HZ2 1 1 18 16219 1 1 59 LYS HZ3 H 2.780 -19.636 14.344 1.00 . A A . 59 LYS HZ3 1 1 18 16220 1 1 59 LYS N N -1.287 -20.431 9.996 1.00 . A A . 59 LYS N 1 1 18 16221 1 1 59 LYS NZ N 2.011 -19.195 14.893 1.00 . A A . 59 LYS NZ 1 1 18 16222 1 1 59 LYS O O 1.265 -20.245 7.908 1.00 . A A . 59 LYS O 1 1 18 16223 1 1 60 GLY C C 0.012 -23.918 6.644 1.00 . A A . 60 GLY C 1 1 18 16224 1 1 60 GLY CA C 0.958 -22.851 7.140 1.00 . A A . 60 GLY CA 1 1 18 16225 1 1 60 GLY H H 0.028 -22.863 9.033 1.00 . A A . 60 GLY H 1 1 18 16226 1 1 60 GLY HA2 H 1.012 -22.059 6.408 1.00 . A A . 60 GLY HA2 1 1 18 16227 1 1 60 GLY HA3 H 1.939 -23.282 7.265 1.00 . A A . 60 GLY HA3 1 1 18 16228 1 1 60 GLY N N 0.523 -22.299 8.400 1.00 . A A . 60 GLY N 1 1 18 16229 1 1 60 GLY O O -0.356 -24.821 7.395 1.00 . A A . 60 GLY O 1 1 18 16230 1 1 61 LYS C C -1.307 -24.561 3.277 1.00 . A A . 61 LYS C 1 1 18 16231 1 1 61 LYS CA C -1.326 -24.739 4.788 1.00 . A A . 61 LYS CA 1 1 18 16232 1 1 61 LYS CB C -2.746 -24.536 5.325 1.00 . A A . 61 LYS CB 1 1 18 16233 1 1 61 LYS CD C -4.625 -26.003 6.119 1.00 . A A . 61 LYS CD 1 1 18 16234 1 1 61 LYS CE C -6.088 -25.925 5.719 1.00 . A A . 61 LYS CE 1 1 18 16235 1 1 61 LYS CG C -3.705 -25.657 4.960 1.00 . A A . 61 LYS CG 1 1 18 16236 1 1 61 LYS H H -0.090 -23.033 4.862 1.00 . A A . 61 LYS H 1 1 18 16237 1 1 61 LYS HA H -0.991 -25.735 5.031 1.00 . A A . 61 LYS HA 1 1 18 16238 1 1 61 LYS HB2 H -2.704 -24.465 6.401 1.00 . A A . 61 LYS HB2 1 1 18 16239 1 1 61 LYS HB3 H -3.139 -23.612 4.928 1.00 . A A . 61 LYS HB3 1 1 18 16240 1 1 61 LYS HD2 H -4.407 -27.008 6.451 1.00 . A A . 61 LYS HD2 1 1 18 16241 1 1 61 LYS HD3 H -4.445 -25.309 6.927 1.00 . A A . 61 LYS HD3 1 1 18 16242 1 1 61 LYS HE2 H -6.205 -25.146 4.981 1.00 . A A . 61 LYS HE2 1 1 18 16243 1 1 61 LYS HE3 H -6.382 -26.873 5.291 1.00 . A A . 61 LYS HE3 1 1 18 16244 1 1 61 LYS HG2 H -4.305 -25.345 4.118 1.00 . A A . 61 LYS HG2 1 1 18 16245 1 1 61 LYS HG3 H -3.133 -26.532 4.691 1.00 . A A . 61 LYS HG3 1 1 18 16246 1 1 61 LYS HZ1 H -7.805 -25.094 6.563 1.00 . A A . 61 LYS HZ1 1 1 18 16247 1 1 61 LYS HZ2 H -6.449 -25.057 7.583 1.00 . A A . 61 LYS HZ2 1 1 18 16248 1 1 61 LYS HZ3 H -7.281 -26.513 7.328 1.00 . A A . 61 LYS HZ3 1 1 18 16249 1 1 61 LYS N N -0.408 -23.792 5.396 1.00 . A A . 61 LYS N 1 1 18 16250 1 1 61 LYS NZ N -6.966 -25.626 6.878 1.00 . A A . 61 LYS NZ 1 1 18 16251 1 1 61 LYS O O -1.337 -23.398 2.819 1.00 . A A . 61 LYS O 1 1 18 16252 1 1 61 LYS OXT O -1.230 -25.573 2.554 1.00 . A A . 61 LYS OXT 1 1 18 16253 2 2 1 ZN ZN ZN -4.947 -5.707 -2.098 1.00 . B A . 62 ZN ZN 1 1 18 16254 3 2 1 ZN ZN ZN 4.239 3.984 3.629 1.00 . C A . 63 ZN ZN 1 1 19 16255 1 1 1 GLY C C -17.313 -0.916 -6.849 1.00 . A A . 1 GLY C 1 1 19 16256 1 1 1 GLY CA C -17.138 -1.133 -8.338 1.00 . A A . 1 GLY CA 1 1 19 16257 1 1 1 GLY H1 H -15.573 0.237 -8.198 1.00 . A A . 1 GLY H1 1 1 19 16258 1 1 1 GLY H2 H -16.761 0.663 -9.329 1.00 . A A . 1 GLY H2 1 1 19 16259 1 1 1 GLY H3 H -15.652 -0.566 -9.691 1.00 . A A . 1 GLY H3 1 1 19 16260 1 1 1 GLY HA2 H -18.100 -1.057 -8.824 1.00 . A A . 1 GLY HA2 1 1 19 16261 1 1 1 GLY HA3 H -16.736 -2.120 -8.506 1.00 . A A . 1 GLY HA3 1 1 19 16262 1 1 1 GLY N N -16.218 -0.130 -8.930 1.00 . A A . 1 GLY N 1 1 19 16263 1 1 1 GLY O O -17.012 0.165 -6.345 1.00 . A A . 1 GLY O 1 1 19 16264 1 1 2 PRO C C -16.688 -1.720 -3.905 1.00 . A A . 2 PRO C 1 1 19 16265 1 1 2 PRO CA C -18.012 -1.815 -4.664 1.00 . A A . 2 PRO CA 1 1 19 16266 1 1 2 PRO CB C -18.754 -3.106 -4.301 1.00 . A A . 2 PRO CB 1 1 19 16267 1 1 2 PRO CD C -18.236 -3.233 -6.636 1.00 . A A . 2 PRO CD 1 1 19 16268 1 1 2 PRO CG C -18.435 -4.063 -5.399 1.00 . A A . 2 PRO CG 1 1 19 16269 1 1 2 PRO HA H -18.626 -0.963 -4.415 1.00 . A A . 2 PRO HA 1 1 19 16270 1 1 2 PRO HB2 H -18.401 -3.471 -3.348 1.00 . A A . 2 PRO HB2 1 1 19 16271 1 1 2 PRO HB3 H -19.813 -2.909 -4.247 1.00 . A A . 2 PRO HB3 1 1 19 16272 1 1 2 PRO HD2 H -17.468 -3.666 -7.260 1.00 . A A . 2 PRO HD2 1 1 19 16273 1 1 2 PRO HD3 H -19.163 -3.146 -7.183 1.00 . A A . 2 PRO HD3 1 1 19 16274 1 1 2 PRO HG2 H -17.531 -4.605 -5.161 1.00 . A A . 2 PRO HG2 1 1 19 16275 1 1 2 PRO HG3 H -19.258 -4.748 -5.538 1.00 . A A . 2 PRO HG3 1 1 19 16276 1 1 2 PRO N N -17.810 -1.923 -6.111 1.00 . A A . 2 PRO N 1 1 19 16277 1 1 2 PRO O O -16.528 -0.862 -3.033 1.00 . A A . 2 PRO O 1 1 19 16278 1 1 3 LEU C C -14.410 -3.147 -2.264 1.00 . A A . 3 LEU C 1 1 19 16279 1 1 3 LEU CA C -14.396 -2.627 -3.702 1.00 . A A . 3 LEU CA 1 1 19 16280 1 1 3 LEU CB C -13.724 -1.247 -3.766 1.00 . A A . 3 LEU CB 1 1 19 16281 1 1 3 LEU CD1 C -11.530 -1.436 -2.560 1.00 . A A . 3 LEU CD1 1 1 19 16282 1 1 3 LEU CD2 C -11.753 -2.348 -4.879 1.00 . A A . 3 LEU CD2 1 1 19 16283 1 1 3 LEU CG C -12.199 -1.258 -3.913 1.00 . A A . 3 LEU CG 1 1 19 16284 1 1 3 LEU H H -15.948 -3.215 -5.009 1.00 . A A . 3 LEU H 1 1 19 16285 1 1 3 LEU HA H -13.816 -3.314 -4.298 1.00 . A A . 3 LEU HA 1 1 19 16286 1 1 3 LEU HB2 H -14.139 -0.709 -4.606 1.00 . A A . 3 LEU HB2 1 1 19 16287 1 1 3 LEU HB3 H -13.971 -0.709 -2.862 1.00 . A A . 3 LEU HB3 1 1 19 16288 1 1 3 LEU HD11 H -12.266 -1.749 -1.834 1.00 . A A . 3 LEU HD11 1 1 19 16289 1 1 3 LEU HD12 H -10.757 -2.186 -2.635 1.00 . A A . 3 LEU HD12 1 1 19 16290 1 1 3 LEU HD13 H -11.094 -0.498 -2.248 1.00 . A A . 3 LEU HD13 1 1 19 16291 1 1 3 LEU HD21 H -11.622 -3.275 -4.340 1.00 . A A . 3 LEU HD21 1 1 19 16292 1 1 3 LEU HD22 H -12.503 -2.480 -5.645 1.00 . A A . 3 LEU HD22 1 1 19 16293 1 1 3 LEU HD23 H -10.817 -2.065 -5.336 1.00 . A A . 3 LEU HD23 1 1 19 16294 1 1 3 LEU HG H -11.881 -0.307 -4.316 1.00 . A A . 3 LEU HG 1 1 19 16295 1 1 3 LEU N N -15.741 -2.585 -4.283 1.00 . A A . 3 LEU N 1 1 19 16296 1 1 3 LEU O O -13.716 -4.112 -1.942 1.00 . A A . 3 LEU O 1 1 19 16297 1 1 4 GLY C C -14.156 -1.916 0.754 1.00 . A A . 4 GLY C 1 1 19 16298 1 1 4 GLY CA C -15.127 -2.803 0.010 1.00 . A A . 4 GLY CA 1 1 19 16299 1 1 4 GLY H H -15.637 -1.675 -1.704 1.00 . A A . 4 GLY H 1 1 19 16300 1 1 4 GLY HA2 H -16.119 -2.670 0.417 1.00 . A A . 4 GLY HA2 1 1 19 16301 1 1 4 GLY HA3 H -14.826 -3.833 0.127 1.00 . A A . 4 GLY HA3 1 1 19 16302 1 1 4 GLY N N -15.140 -2.466 -1.396 1.00 . A A . 4 GLY N 1 1 19 16303 1 1 4 GLY O O -12.943 -2.115 0.664 1.00 . A A . 4 GLY O 1 1 19 16304 1 1 5 SER C C -13.026 0.882 0.799 1.00 . A A . 5 SER C 1 1 19 16305 1 1 5 SER CA C -13.854 0.222 1.896 1.00 . A A . 5 SER CA 1 1 19 16306 1 1 5 SER CB C -12.953 -0.337 3.007 1.00 . A A . 5 SER CB 1 1 19 16307 1 1 5 SER H H -15.647 -0.666 1.205 1.00 . A A . 5 SER H 1 1 19 16308 1 1 5 SER HA H -14.518 0.962 2.320 1.00 . A A . 5 SER HA 1 1 19 16309 1 1 5 SER HB2 H -12.145 -0.900 2.563 1.00 . A A . 5 SER HB2 1 1 19 16310 1 1 5 SER HB3 H -12.547 0.480 3.583 1.00 . A A . 5 SER HB3 1 1 19 16311 1 1 5 SER HG H -14.594 -0.873 3.944 1.00 . A A . 5 SER HG 1 1 19 16312 1 1 5 SER N N -14.681 -0.829 1.310 1.00 . A A . 5 SER N 1 1 19 16313 1 1 5 SER O O -11.797 0.919 0.859 1.00 . A A . 5 SER O 1 1 19 16314 1 1 5 SER OG O -13.683 -1.193 3.873 1.00 . A A . 5 SER OG 1 1 19 16315 1 1 6 ASP C C -12.467 3.255 -1.072 1.00 . A A . 6 ASP C 1 1 19 16316 1 1 6 ASP CA C -13.075 1.902 -1.413 1.00 . A A . 6 ASP CA 1 1 19 16317 1 1 6 ASP CB C -14.080 2.038 -2.560 1.00 . A A . 6 ASP CB 1 1 19 16318 1 1 6 ASP CG C -13.533 2.835 -3.727 1.00 . A A . 6 ASP CG 1 1 19 16319 1 1 6 ASP H H -14.695 1.216 -0.242 1.00 . A A . 6 ASP H 1 1 19 16320 1 1 6 ASP HA H -12.284 1.233 -1.718 1.00 . A A . 6 ASP HA 1 1 19 16321 1 1 6 ASP HB2 H -14.346 1.054 -2.916 1.00 . A A . 6 ASP HB2 1 1 19 16322 1 1 6 ASP HB3 H -14.967 2.535 -2.193 1.00 . A A . 6 ASP HB3 1 1 19 16323 1 1 6 ASP N N -13.720 1.318 -0.245 1.00 . A A . 6 ASP N 1 1 19 16324 1 1 6 ASP O O -13.164 4.272 -1.012 1.00 . A A . 6 ASP O 1 1 19 16325 1 1 6 ASP OD1 O -12.456 2.482 -4.246 1.00 . A A . 6 ASP OD1 1 1 19 16326 1 1 6 ASP OD2 O -14.191 3.813 -4.142 1.00 . A A . 6 ASP OD2 1 1 19 16327 1 1 7 HIS C C -9.317 4.738 -1.305 1.00 . A A . 7 HIS C 1 1 19 16328 1 1 7 HIS CA C -10.488 4.456 -0.378 1.00 . A A . 7 HIS CA 1 1 19 16329 1 1 7 HIS CB C -10.003 4.341 1.067 1.00 . A A . 7 HIS CB 1 1 19 16330 1 1 7 HIS CD2 C -10.661 6.717 1.820 1.00 . A A . 7 HIS CD2 1 1 19 16331 1 1 7 HIS CE1 C -11.606 6.167 3.701 1.00 . A A . 7 HIS CE1 1 1 19 16332 1 1 7 HIS CG C -10.594 5.374 1.975 1.00 . A A . 7 HIS CG 1 1 19 16333 1 1 7 HIS H H -10.693 2.396 -0.779 1.00 . A A . 7 HIS H 1 1 19 16334 1 1 7 HIS HA H -11.188 5.274 -0.447 1.00 . A A . 7 HIS HA 1 1 19 16335 1 1 7 HIS HB2 H -10.268 3.368 1.450 1.00 . A A . 7 HIS HB2 1 1 19 16336 1 1 7 HIS HB3 H -8.929 4.452 1.089 1.00 . A A . 7 HIS HB3 1 1 19 16337 1 1 7 HIS HD2 H -10.283 7.291 0.987 1.00 . A A . 7 HIS HD2 1 1 19 16338 1 1 7 HIS HE1 H -12.121 6.240 4.648 1.00 . A A . 7 HIS HE1 1 1 19 16339 1 1 7 HIS HE2 H -11.300 8.157 3.208 1.00 . A A . 7 HIS HE2 1 1 19 16340 1 1 7 HIS N N -11.180 3.247 -0.776 1.00 . A A . 7 HIS N 1 1 19 16341 1 1 7 HIS ND1 N -11.191 5.030 3.164 1.00 . A A . 7 HIS ND1 1 1 19 16342 1 1 7 HIS NE2 N -11.306 7.215 2.922 1.00 . A A . 7 HIS NE2 1 1 19 16343 1 1 7 HIS O O -8.258 4.113 -1.197 1.00 . A A . 7 HIS O 1 1 19 16344 1 1 8 HIS C C -7.375 6.849 -2.311 1.00 . A A . 8 HIS C 1 1 19 16345 1 1 8 HIS CA C -8.457 6.127 -3.103 1.00 . A A . 8 HIS CA 1 1 19 16346 1 1 8 HIS CB C -9.031 7.039 -4.193 1.00 . A A . 8 HIS CB 1 1 19 16347 1 1 8 HIS CD2 C -7.054 6.996 -5.854 1.00 . A A . 8 HIS CD2 1 1 19 16348 1 1 8 HIS CE1 C -6.888 9.147 -6.136 1.00 . A A . 8 HIS CE1 1 1 19 16349 1 1 8 HIS CG C -7.997 7.621 -5.109 1.00 . A A . 8 HIS CG 1 1 19 16350 1 1 8 HIS H H -10.373 6.171 -2.210 1.00 . A A . 8 HIS H 1 1 19 16351 1 1 8 HIS HA H -8.032 5.245 -3.561 1.00 . A A . 8 HIS HA 1 1 19 16352 1 1 8 HIS HB2 H -9.723 6.473 -4.797 1.00 . A A . 8 HIS HB2 1 1 19 16353 1 1 8 HIS HB3 H -9.558 7.859 -3.725 1.00 . A A . 8 HIS HB3 1 1 19 16354 1 1 8 HIS HD2 H -6.883 5.932 -5.923 1.00 . A A . 8 HIS HD2 1 1 19 16355 1 1 8 HIS HE1 H -6.547 10.111 -6.485 1.00 . A A . 8 HIS HE1 1 1 19 16356 1 1 8 HIS HE2 H -5.476 7.857 -6.946 1.00 . A A . 8 HIS HE2 1 1 19 16357 1 1 8 HIS N N -9.508 5.700 -2.195 1.00 . A A . 8 HIS N 1 1 19 16358 1 1 8 HIS ND1 N -7.889 8.976 -5.291 1.00 . A A . 8 HIS ND1 1 1 19 16359 1 1 8 HIS NE2 N -6.351 7.976 -6.505 1.00 . A A . 8 HIS NE2 1 1 19 16360 1 1 8 HIS O O -7.614 7.918 -1.744 1.00 . A A . 8 HIS O 1 1 19 16361 1 1 9 MET C C -4.192 7.515 -2.006 1.00 . A A . 9 MET C 1 1 19 16362 1 1 9 MET CA C -5.218 6.688 -1.248 1.00 . A A . 9 MET CA 1 1 19 16363 1 1 9 MET CB C -4.527 5.527 -0.543 1.00 . A A . 9 MET CB 1 1 19 16364 1 1 9 MET CE C -6.254 3.296 1.368 1.00 . A A . 9 MET CE 1 1 19 16365 1 1 9 MET CG C -4.691 5.544 0.965 1.00 . A A . 9 MET CG 1 1 19 16366 1 1 9 MET H H -6.174 5.270 -2.488 1.00 . A A . 9 MET H 1 1 19 16367 1 1 9 MET HA H -5.690 7.315 -0.508 1.00 . A A . 9 MET HA 1 1 19 16368 1 1 9 MET HB2 H -4.936 4.599 -0.915 1.00 . A A . 9 MET HB2 1 1 19 16369 1 1 9 MET HB3 H -3.471 5.561 -0.770 1.00 . A A . 9 MET HB3 1 1 19 16370 1 1 9 MET HE1 H -6.783 3.189 2.304 1.00 . A A . 9 MET HE1 1 1 19 16371 1 1 9 MET HE2 H -6.778 4.003 0.741 1.00 . A A . 9 MET HE2 1 1 19 16372 1 1 9 MET HE3 H -6.205 2.338 0.871 1.00 . A A . 9 MET HE3 1 1 19 16373 1 1 9 MET HG2 H -3.912 6.157 1.393 1.00 . A A . 9 MET HG2 1 1 19 16374 1 1 9 MET HG3 H -5.655 5.970 1.204 1.00 . A A . 9 MET HG3 1 1 19 16375 1 1 9 MET N N -6.255 6.181 -2.124 1.00 . A A . 9 MET N 1 1 19 16376 1 1 9 MET O O -3.456 6.994 -2.843 1.00 . A A . 9 MET O 1 1 19 16377 1 1 9 MET SD S -4.593 3.893 1.682 1.00 . A A . 9 MET SD 1 1 19 16378 1 1 10 GLU C C -1.786 9.523 -1.364 1.00 . A A . 10 GLU C 1 1 19 16379 1 1 10 GLU CA C -3.057 9.651 -2.193 1.00 . A A . 10 GLU CA 1 1 19 16380 1 1 10 GLU CB C -3.538 11.102 -2.215 1.00 . A A . 10 GLU CB 1 1 19 16381 1 1 10 GLU CD C -4.578 12.019 -4.321 1.00 . A A . 10 GLU CD 1 1 19 16382 1 1 10 GLU CG C -4.818 11.300 -3.014 1.00 . A A . 10 GLU CG 1 1 19 16383 1 1 10 GLU H H -4.667 9.123 -0.920 1.00 . A A . 10 GLU H 1 1 19 16384 1 1 10 GLU HA H -2.853 9.325 -3.203 1.00 . A A . 10 GLU HA 1 1 19 16385 1 1 10 GLU HB2 H -3.715 11.425 -1.200 1.00 . A A . 10 GLU HB2 1 1 19 16386 1 1 10 GLU HB3 H -2.767 11.718 -2.653 1.00 . A A . 10 GLU HB3 1 1 19 16387 1 1 10 GLU HG2 H -5.245 10.332 -3.230 1.00 . A A . 10 GLU HG2 1 1 19 16388 1 1 10 GLU HG3 H -5.513 11.878 -2.421 1.00 . A A . 10 GLU HG3 1 1 19 16389 1 1 10 GLU N N -4.082 8.780 -1.637 1.00 . A A . 10 GLU N 1 1 19 16390 1 1 10 GLU O O -0.676 9.711 -1.860 1.00 . A A . 10 GLU O 1 1 19 16391 1 1 10 GLU OE1 O -4.164 11.364 -5.298 1.00 . A A . 10 GLU OE1 1 1 19 16392 1 1 10 GLU OE2 O -4.791 13.251 -4.374 1.00 . A A . 10 GLU OE2 1 1 19 16393 1 1 11 PHE C C -0.915 7.253 1.062 1.00 . A A . 11 PHE C 1 1 19 16394 1 1 11 PHE CA C -0.865 8.737 0.754 1.00 . A A . 11 PHE CA 1 1 19 16395 1 1 11 PHE CB C -0.931 9.563 2.047 1.00 . A A . 11 PHE CB 1 1 19 16396 1 1 11 PHE CD1 C -2.884 8.841 3.450 1.00 . A A . 11 PHE CD1 1 1 19 16397 1 1 11 PHE CD2 C -3.068 10.869 2.210 1.00 . A A . 11 PHE CD2 1 1 19 16398 1 1 11 PHE CE1 C -4.163 9.021 3.937 1.00 . A A . 11 PHE CE1 1 1 19 16399 1 1 11 PHE CE2 C -4.346 11.055 2.696 1.00 . A A . 11 PHE CE2 1 1 19 16400 1 1 11 PHE CG C -2.322 9.762 2.579 1.00 . A A . 11 PHE CG 1 1 19 16401 1 1 11 PHE CZ C -4.894 10.131 3.562 1.00 . A A . 11 PHE CZ 1 1 19 16402 1 1 11 PHE H H -2.876 8.844 0.151 1.00 . A A . 11 PHE H 1 1 19 16403 1 1 11 PHE HA H 0.065 8.949 0.248 1.00 . A A . 11 PHE HA 1 1 19 16404 1 1 11 PHE HB2 H -0.353 9.065 2.811 1.00 . A A . 11 PHE HB2 1 1 19 16405 1 1 11 PHE HB3 H -0.503 10.538 1.861 1.00 . A A . 11 PHE HB3 1 1 19 16406 1 1 11 PHE HD1 H -2.311 7.974 3.751 1.00 . A A . 11 PHE HD1 1 1 19 16407 1 1 11 PHE HD2 H -2.642 11.592 1.531 1.00 . A A . 11 PHE HD2 1 1 19 16408 1 1 11 PHE HE1 H -4.591 8.296 4.614 1.00 . A A . 11 PHE HE1 1 1 19 16409 1 1 11 PHE HE2 H -4.914 11.922 2.403 1.00 . A A . 11 PHE HE2 1 1 19 16410 1 1 11 PHE HZ H -5.896 10.273 3.946 1.00 . A A . 11 PHE HZ 1 1 19 16411 1 1 11 PHE N N -1.967 9.067 -0.134 1.00 . A A . 11 PHE N 1 1 19 16412 1 1 11 PHE O O -1.683 6.514 0.450 1.00 . A A . 11 PHE O 1 1 19 16413 1 1 12 CYS C C -0.971 5.062 3.450 1.00 . A A . 12 CYS C 1 1 19 16414 1 1 12 CYS CA C -0.020 5.397 2.302 1.00 . A A . 12 CYS CA 1 1 19 16415 1 1 12 CYS CB C 1.414 5.013 2.643 1.00 . A A . 12 CYS CB 1 1 19 16416 1 1 12 CYS H H 0.534 7.431 2.412 1.00 . A A . 12 CYS H 1 1 19 16417 1 1 12 CYS HA H -0.328 4.845 1.426 1.00 . A A . 12 CYS HA 1 1 19 16418 1 1 12 CYS HB2 H 1.713 4.169 2.042 1.00 . A A . 12 CYS HB2 1 1 19 16419 1 1 12 CYS HB3 H 2.053 5.853 2.425 1.00 . A A . 12 CYS HB3 1 1 19 16420 1 1 12 CYS HG H 2.415 5.568 4.878 1.00 . A A . 12 CYS HG 1 1 19 16421 1 1 12 CYS N N -0.078 6.806 1.974 1.00 . A A . 12 CYS N 1 1 19 16422 1 1 12 CYS O O -1.413 5.950 4.176 1.00 . A A . 12 CYS O 1 1 19 16423 1 1 12 CYS SG S 1.681 4.586 4.361 1.00 . A A . 12 CYS SG 1 1 19 16424 1 1 13 ARG C C -1.776 3.393 5.955 1.00 . A A . 13 ARG C 1 1 19 16425 1 1 13 ARG CA C -2.334 3.353 4.533 1.00 . A A . 13 ARG CA 1 1 19 16426 1 1 13 ARG CB C -2.828 1.940 4.211 1.00 . A A . 13 ARG CB 1 1 19 16427 1 1 13 ARG CD C -4.731 0.358 4.667 1.00 . A A . 13 ARG CD 1 1 19 16428 1 1 13 ARG CG C -4.334 1.785 4.330 1.00 . A A . 13 ARG CG 1 1 19 16429 1 1 13 ARG CZ C -6.221 -0.411 2.841 1.00 . A A . 13 ARG CZ 1 1 19 16430 1 1 13 ARG H H -1.033 3.153 2.868 1.00 . A A . 13 ARG H 1 1 19 16431 1 1 13 ARG HA H -3.171 4.032 4.480 1.00 . A A . 13 ARG HA 1 1 19 16432 1 1 13 ARG HB2 H -2.539 1.690 3.201 1.00 . A A . 13 ARG HB2 1 1 19 16433 1 1 13 ARG HB3 H -2.361 1.244 4.892 1.00 . A A . 13 ARG HB3 1 1 19 16434 1 1 13 ARG HD2 H -3.912 -0.114 5.191 1.00 . A A . 13 ARG HD2 1 1 19 16435 1 1 13 ARG HD3 H -5.599 0.383 5.308 1.00 . A A . 13 ARG HD3 1 1 19 16436 1 1 13 ARG HE H -4.327 -1.011 3.113 1.00 . A A . 13 ARG HE 1 1 19 16437 1 1 13 ARG HG2 H -4.693 2.442 5.108 1.00 . A A . 13 ARG HG2 1 1 19 16438 1 1 13 ARG HG3 H -4.787 2.061 3.389 1.00 . A A . 13 ARG HG3 1 1 19 16439 1 1 13 ARG HH11 H -7.091 0.935 4.090 1.00 . A A . 13 ARG HH11 1 1 19 16440 1 1 13 ARG HH12 H -8.103 0.355 2.799 1.00 . A A . 13 ARG HH12 1 1 19 16441 1 1 13 ARG HH21 H -5.661 -1.758 1.415 1.00 . A A . 13 ARG HH21 1 1 19 16442 1 1 13 ARG HH22 H -7.290 -1.161 1.286 1.00 . A A . 13 ARG HH22 1 1 19 16443 1 1 13 ARG N N -1.353 3.792 3.542 1.00 . A A . 13 ARG N 1 1 19 16444 1 1 13 ARG NE N -5.044 -0.428 3.470 1.00 . A A . 13 ARG NE 1 1 19 16445 1 1 13 ARG NH1 N -7.214 0.355 3.280 1.00 . A A . 13 ARG NH1 1 1 19 16446 1 1 13 ARG NH2 N -6.406 -1.165 1.763 1.00 . A A . 13 ARG NH2 1 1 19 16447 1 1 13 ARG O O -2.426 3.908 6.861 1.00 . A A . 13 ARG O 1 1 19 16448 1 1 14 VAL C C 0.595 3.892 7.979 1.00 . A A . 14 VAL C 1 1 19 16449 1 1 14 VAL CA C -0.104 2.606 7.529 1.00 . A A . 14 VAL CA 1 1 19 16450 1 1 14 VAL CB C 0.874 1.416 7.630 1.00 . A A . 14 VAL CB 1 1 19 16451 1 1 14 VAL CG1 C 1.253 1.150 9.078 1.00 . A A . 14 VAL CG1 1 1 19 16452 1 1 14 VAL CG2 C 0.264 0.171 6.999 1.00 . A A . 14 VAL CG2 1 1 19 16453 1 1 14 VAL H H -0.226 2.242 5.446 1.00 . A A . 14 VAL H 1 1 19 16454 1 1 14 VAL HA H -0.933 2.416 8.196 1.00 . A A . 14 VAL HA 1 1 19 16455 1 1 14 VAL HB H 1.774 1.666 7.085 1.00 . A A . 14 VAL HB 1 1 19 16456 1 1 14 VAL HG11 H 1.020 2.019 9.677 1.00 . A A . 14 VAL HG11 1 1 19 16457 1 1 14 VAL HG12 H 0.696 0.300 9.445 1.00 . A A . 14 VAL HG12 1 1 19 16458 1 1 14 VAL HG13 H 2.311 0.943 9.141 1.00 . A A . 14 VAL HG13 1 1 19 16459 1 1 14 VAL HG21 H 0.965 -0.648 7.071 1.00 . A A . 14 VAL HG21 1 1 19 16460 1 1 14 VAL HG22 H -0.647 -0.088 7.519 1.00 . A A . 14 VAL HG22 1 1 19 16461 1 1 14 VAL HG23 H 0.043 0.364 5.960 1.00 . A A . 14 VAL HG23 1 1 19 16462 1 1 14 VAL N N -0.647 2.734 6.179 1.00 . A A . 14 VAL N 1 1 19 16463 1 1 14 VAL O O 0.068 4.636 8.806 1.00 . A A . 14 VAL O 1 1 19 16464 1 1 15 CYS C C 2.081 6.518 6.679 1.00 . A A . 15 CYS C 1 1 19 16465 1 1 15 CYS CA C 2.448 5.420 7.661 1.00 . A A . 15 CYS CA 1 1 19 16466 1 1 15 CYS CB C 3.956 5.163 7.677 1.00 . A A . 15 CYS CB 1 1 19 16467 1 1 15 CYS H H 2.060 3.618 6.660 1.00 . A A . 15 CYS H 1 1 19 16468 1 1 15 CYS HA H 2.147 5.741 8.647 1.00 . A A . 15 CYS HA 1 1 19 16469 1 1 15 CYS HB2 H 4.460 6.027 7.271 1.00 . A A . 15 CYS HB2 1 1 19 16470 1 1 15 CYS HB3 H 4.271 5.025 8.700 1.00 . A A . 15 CYS HB3 1 1 19 16471 1 1 15 CYS N N 1.732 4.195 7.370 1.00 . A A . 15 CYS N 1 1 19 16472 1 1 15 CYS O O 2.826 6.756 5.734 1.00 . A A . 15 CYS O 1 1 19 16473 1 1 15 CYS SG S 4.527 3.706 6.724 1.00 . A A . 15 CYS SG 1 1 19 16474 1 1 16 LYS C C 1.075 9.041 5.433 1.00 . A A . 16 LYS C 1 1 19 16475 1 1 16 LYS CA C 0.157 7.941 5.935 1.00 . A A . 16 LYS CA 1 1 19 16476 1 1 16 LYS CB C -1.034 8.566 6.670 1.00 . A A . 16 LYS CB 1 1 19 16477 1 1 16 LYS CD C -2.304 7.441 8.529 1.00 . A A . 16 LYS CD 1 1 19 16478 1 1 16 LYS CE C -2.890 6.089 8.900 1.00 . A A . 16 LYS CE 1 1 19 16479 1 1 16 LYS CG C -2.127 7.569 7.025 1.00 . A A . 16 LYS CG 1 1 19 16480 1 1 16 LYS H H 0.281 6.542 7.469 1.00 . A A . 16 LYS H 1 1 19 16481 1 1 16 LYS HA H -0.217 7.393 5.087 1.00 . A A . 16 LYS HA 1 1 19 16482 1 1 16 LYS HB2 H -0.680 9.021 7.583 1.00 . A A . 16 LYS HB2 1 1 19 16483 1 1 16 LYS HB3 H -1.465 9.332 6.042 1.00 . A A . 16 LYS HB3 1 1 19 16484 1 1 16 LYS HD2 H -1.343 7.551 9.007 1.00 . A A . 16 LYS HD2 1 1 19 16485 1 1 16 LYS HD3 H -2.971 8.219 8.871 1.00 . A A . 16 LYS HD3 1 1 19 16486 1 1 16 LYS HE2 H -3.934 6.073 8.624 1.00 . A A . 16 LYS HE2 1 1 19 16487 1 1 16 LYS HE3 H -2.363 5.322 8.349 1.00 . A A . 16 LYS HE3 1 1 19 16488 1 1 16 LYS HG2 H -3.058 7.901 6.590 1.00 . A A . 16 LYS HG2 1 1 19 16489 1 1 16 LYS HG3 H -1.862 6.603 6.620 1.00 . A A . 16 LYS HG3 1 1 19 16490 1 1 16 LYS HZ1 H -1.871 6.173 10.725 1.00 . A A . 16 LYS HZ1 1 1 19 16491 1 1 16 LYS HZ2 H -2.815 4.778 10.524 1.00 . A A . 16 LYS HZ2 1 1 19 16492 1 1 16 LYS HZ3 H -3.561 6.264 10.870 1.00 . A A . 16 LYS HZ3 1 1 19 16493 1 1 16 LYS N N 0.828 6.975 6.812 1.00 . A A . 16 LYS N 1 1 19 16494 1 1 16 LYS NZ N -2.775 5.805 10.354 1.00 . A A . 16 LYS NZ 1 1 19 16495 1 1 16 LYS O O 1.108 10.153 5.967 1.00 . A A . 16 LYS O 1 1 19 16496 1 1 17 ASP C C 3.288 9.134 2.540 1.00 . A A . 17 ASP C 1 1 19 16497 1 1 17 ASP CA C 2.913 9.555 3.954 1.00 . A A . 17 ASP CA 1 1 19 16498 1 1 17 ASP CB C 4.149 9.522 4.851 1.00 . A A . 17 ASP CB 1 1 19 16499 1 1 17 ASP CG C 4.811 10.876 4.977 1.00 . A A . 17 ASP CG 1 1 19 16500 1 1 17 ASP H H 1.920 7.710 4.261 1.00 . A A . 17 ASP H 1 1 19 16501 1 1 17 ASP HA H 2.512 10.557 3.934 1.00 . A A . 17 ASP HA 1 1 19 16502 1 1 17 ASP HB2 H 3.857 9.191 5.837 1.00 . A A . 17 ASP HB2 1 1 19 16503 1 1 17 ASP HB3 H 4.863 8.822 4.441 1.00 . A A . 17 ASP HB3 1 1 19 16504 1 1 17 ASP N N 1.895 8.669 4.487 1.00 . A A . 17 ASP N 1 1 19 16505 1 1 17 ASP O O 2.817 8.102 2.054 1.00 . A A . 17 ASP O 1 1 19 16506 1 1 17 ASP OD1 O 5.128 11.492 3.940 1.00 . A A . 17 ASP OD1 1 1 19 16507 1 1 17 ASP OD2 O 5.007 11.340 6.119 1.00 . A A . 17 ASP OD2 1 1 19 16508 1 1 18 GLY C C 4.140 10.543 -0.462 1.00 . A A . 18 GLY C 1 1 19 16509 1 1 18 GLY CA C 4.647 9.580 0.589 1.00 . A A . 18 GLY CA 1 1 19 16510 1 1 18 GLY H H 4.534 10.691 2.386 1.00 . A A . 18 GLY H 1 1 19 16511 1 1 18 GLY HA2 H 5.727 9.606 0.591 1.00 . A A . 18 GLY HA2 1 1 19 16512 1 1 18 GLY HA3 H 4.319 8.581 0.334 1.00 . A A . 18 GLY HA3 1 1 19 16513 1 1 18 GLY N N 4.172 9.903 1.918 1.00 . A A . 18 GLY N 1 1 19 16514 1 1 18 GLY O O 3.007 11.032 -0.377 1.00 . A A . 18 GLY O 1 1 19 16515 1 1 19 GLY C C 3.898 10.768 -3.687 1.00 . A A . 19 GLY C 1 1 19 16516 1 1 19 GLY CA C 4.538 11.597 -2.596 1.00 . A A . 19 GLY CA 1 1 19 16517 1 1 19 GLY H H 5.815 10.300 -1.522 1.00 . A A . 19 GLY H 1 1 19 16518 1 1 19 GLY HA2 H 3.829 12.330 -2.241 1.00 . A A . 19 GLY HA2 1 1 19 16519 1 1 19 GLY HA3 H 5.403 12.104 -2.998 1.00 . A A . 19 GLY HA3 1 1 19 16520 1 1 19 GLY N N 4.950 10.763 -1.487 1.00 . A A . 19 GLY N 1 1 19 16521 1 1 19 GLY O O 2.707 10.912 -3.969 1.00 . A A . 19 GLY O 1 1 19 16522 1 1 20 GLU C C 4.229 7.420 -4.474 1.00 . A A . 20 GLU C 1 1 19 16523 1 1 20 GLU CA C 4.103 8.803 -5.094 1.00 . A A . 20 GLU CA 1 1 19 16524 1 1 20 GLU CB C 4.806 8.838 -6.458 1.00 . A A . 20 GLU CB 1 1 19 16525 1 1 20 GLU CD C 7.323 8.718 -6.402 1.00 . A A . 20 GLU CD 1 1 19 16526 1 1 20 GLU CG C 6.108 9.618 -6.476 1.00 . A A . 20 GLU CG 1 1 19 16527 1 1 20 GLU H H 5.548 9.655 -3.810 1.00 . A A . 20 GLU H 1 1 19 16528 1 1 20 GLU HA H 3.054 9.025 -5.233 1.00 . A A . 20 GLU HA 1 1 19 16529 1 1 20 GLU HB2 H 5.023 7.824 -6.761 1.00 . A A . 20 GLU HB2 1 1 19 16530 1 1 20 GLU HB3 H 4.139 9.283 -7.179 1.00 . A A . 20 GLU HB3 1 1 19 16531 1 1 20 GLU HG2 H 6.159 10.189 -7.391 1.00 . A A . 20 GLU HG2 1 1 19 16532 1 1 20 GLU HG3 H 6.124 10.292 -5.631 1.00 . A A . 20 GLU HG3 1 1 19 16533 1 1 20 GLU N N 4.645 9.790 -4.174 1.00 . A A . 20 GLU N 1 1 19 16534 1 1 20 GLU O O 5.331 6.976 -4.134 1.00 . A A . 20 GLU O 1 1 19 16535 1 1 20 GLU OE1 O 7.520 7.901 -7.326 1.00 . A A . 20 GLU OE1 1 1 19 16536 1 1 20 GLU OE2 O 8.080 8.823 -5.417 1.00 . A A . 20 GLU OE2 1 1 19 16537 1 1 21 LEU C C 2.776 4.401 -4.537 1.00 . A A . 21 LEU C 1 1 19 16538 1 1 21 LEU CA C 3.055 5.514 -3.538 1.00 . A A . 21 LEU CA 1 1 19 16539 1 1 21 LEU CB C 1.978 5.508 -2.447 1.00 . A A . 21 LEU CB 1 1 19 16540 1 1 21 LEU CD1 C 3.782 6.052 -0.775 1.00 . A A . 21 LEU CD1 1 1 19 16541 1 1 21 LEU CD2 C 2.000 7.730 -1.286 1.00 . A A . 21 LEU CD2 1 1 19 16542 1 1 21 LEU CG C 2.323 6.250 -1.152 1.00 . A A . 21 LEU CG 1 1 19 16543 1 1 21 LEU H H 2.242 7.254 -4.429 1.00 . A A . 21 LEU H 1 1 19 16544 1 1 21 LEU HA H 4.019 5.344 -3.085 1.00 . A A . 21 LEU HA 1 1 19 16545 1 1 21 LEU HB2 H 1.084 5.952 -2.860 1.00 . A A . 21 LEU HB2 1 1 19 16546 1 1 21 LEU HB3 H 1.762 4.481 -2.197 1.00 . A A . 21 LEU HB3 1 1 19 16547 1 1 21 LEU HD11 H 4.411 6.316 -1.614 1.00 . A A . 21 LEU HD11 1 1 19 16548 1 1 21 LEU HD12 H 4.024 6.682 0.068 1.00 . A A . 21 LEU HD12 1 1 19 16549 1 1 21 LEU HD13 H 3.948 5.018 -0.512 1.00 . A A . 21 LEU HD13 1 1 19 16550 1 1 21 LEU HD21 H 1.514 8.077 -0.387 1.00 . A A . 21 LEU HD21 1 1 19 16551 1 1 21 LEU HD22 H 2.913 8.285 -1.441 1.00 . A A . 21 LEU HD22 1 1 19 16552 1 1 21 LEU HD23 H 1.343 7.879 -2.131 1.00 . A A . 21 LEU HD23 1 1 19 16553 1 1 21 LEU HG H 1.718 5.852 -0.349 1.00 . A A . 21 LEU HG 1 1 19 16554 1 1 21 LEU N N 3.092 6.803 -4.209 1.00 . A A . 21 LEU N 1 1 19 16555 1 1 21 LEU O O 2.637 4.652 -5.737 1.00 . A A . 21 LEU O 1 1 19 16556 1 1 22 LEU C C 0.962 1.512 -4.534 1.00 . A A . 22 LEU C 1 1 19 16557 1 1 22 LEU CA C 2.346 2.046 -4.880 1.00 . A A . 22 LEU CA 1 1 19 16558 1 1 22 LEU CB C 3.415 0.956 -4.715 1.00 . A A . 22 LEU CB 1 1 19 16559 1 1 22 LEU CD1 C 3.176 -1.458 -5.340 1.00 . A A . 22 LEU CD1 1 1 19 16560 1 1 22 LEU CD2 C 3.545 -0.822 -2.951 1.00 . A A . 22 LEU CD2 1 1 19 16561 1 1 22 LEU CG C 2.904 -0.416 -4.269 1.00 . A A . 22 LEU CG 1 1 19 16562 1 1 22 LEU H H 2.754 3.050 -3.070 1.00 . A A . 22 LEU H 1 1 19 16563 1 1 22 LEU HA H 2.340 2.384 -5.905 1.00 . A A . 22 LEU HA 1 1 19 16564 1 1 22 LEU HB2 H 3.921 0.836 -5.661 1.00 . A A . 22 LEU HB2 1 1 19 16565 1 1 22 LEU HB3 H 4.134 1.299 -3.986 1.00 . A A . 22 LEU HB3 1 1 19 16566 1 1 22 LEU HD11 H 4.238 -1.523 -5.519 1.00 . A A . 22 LEU HD11 1 1 19 16567 1 1 22 LEU HD12 H 2.807 -2.417 -5.009 1.00 . A A . 22 LEU HD12 1 1 19 16568 1 1 22 LEU HD13 H 2.673 -1.176 -6.253 1.00 . A A . 22 LEU HD13 1 1 19 16569 1 1 22 LEU HD21 H 3.280 -0.106 -2.187 1.00 . A A . 22 LEU HD21 1 1 19 16570 1 1 22 LEU HD22 H 3.190 -1.802 -2.665 1.00 . A A . 22 LEU HD22 1 1 19 16571 1 1 22 LEU HD23 H 4.619 -0.847 -3.066 1.00 . A A . 22 LEU HD23 1 1 19 16572 1 1 22 LEU HG H 1.834 -0.363 -4.119 1.00 . A A . 22 LEU HG 1 1 19 16573 1 1 22 LEU N N 2.658 3.184 -4.038 1.00 . A A . 22 LEU N 1 1 19 16574 1 1 22 LEU O O 0.591 1.455 -3.360 1.00 . A A . 22 LEU O 1 1 19 16575 1 1 23 CYS C C -1.142 -0.887 -5.717 1.00 . A A . 23 CYS C 1 1 19 16576 1 1 23 CYS CA C -1.129 0.592 -5.359 1.00 . A A . 23 CYS CA 1 1 19 16577 1 1 23 CYS CB C -2.140 1.356 -6.219 1.00 . A A . 23 CYS CB 1 1 19 16578 1 1 23 CYS H H 0.574 1.191 -6.466 1.00 . A A . 23 CYS H 1 1 19 16579 1 1 23 CYS HA H -1.389 0.705 -4.316 1.00 . A A . 23 CYS HA 1 1 19 16580 1 1 23 CYS HB2 H -1.902 1.207 -7.262 1.00 . A A . 23 CYS HB2 1 1 19 16581 1 1 23 CYS HB3 H -3.130 0.969 -6.022 1.00 . A A . 23 CYS HB3 1 1 19 16582 1 1 23 CYS HG H -2.301 3.326 -4.602 1.00 . A A . 23 CYS HG 1 1 19 16583 1 1 23 CYS N N 0.208 1.134 -5.552 1.00 . A A . 23 CYS N 1 1 19 16584 1 1 23 CYS O O -0.320 -1.335 -6.522 1.00 . A A . 23 CYS O 1 1 19 16585 1 1 23 CYS SG S -2.175 3.141 -5.914 1.00 . A A . 23 CYS SG 1 1 19 16586 1 1 24 CYS C C -2.703 -3.436 -6.645 1.00 . A A . 24 CYS C 1 1 19 16587 1 1 24 CYS CA C -2.049 -3.093 -5.309 1.00 . A A . 24 CYS CA 1 1 19 16588 1 1 24 CYS CB C -2.794 -3.791 -4.178 1.00 . A A . 24 CYS CB 1 1 19 16589 1 1 24 CYS H H -2.606 -1.275 -4.394 1.00 . A A . 24 CYS H 1 1 19 16590 1 1 24 CYS HA H -1.029 -3.446 -5.324 1.00 . A A . 24 CYS HA 1 1 19 16591 1 1 24 CYS HB2 H -3.507 -4.482 -4.604 1.00 . A A . 24 CYS HB2 1 1 19 16592 1 1 24 CYS HB3 H -2.084 -4.344 -3.580 1.00 . A A . 24 CYS HB3 1 1 19 16593 1 1 24 CYS N N -2.015 -1.661 -5.078 1.00 . A A . 24 CYS N 1 1 19 16594 1 1 24 CYS O O -2.949 -2.566 -7.486 1.00 . A A . 24 CYS O 1 1 19 16595 1 1 24 CYS SG S -3.713 -2.682 -3.057 1.00 . A A . 24 CYS SG 1 1 19 16596 1 1 25 ASP C C -5.081 -5.328 -7.914 1.00 . A A . 25 ASP C 1 1 19 16597 1 1 25 ASP CA C -3.570 -5.222 -8.061 1.00 . A A . 25 ASP CA 1 1 19 16598 1 1 25 ASP CB C -2.987 -6.598 -8.407 1.00 . A A . 25 ASP CB 1 1 19 16599 1 1 25 ASP CG C -3.221 -6.998 -9.852 1.00 . A A . 25 ASP CG 1 1 19 16600 1 1 25 ASP H H -2.727 -5.356 -6.124 1.00 . A A . 25 ASP H 1 1 19 16601 1 1 25 ASP HA H -3.341 -4.529 -8.856 1.00 . A A . 25 ASP HA 1 1 19 16602 1 1 25 ASP HB2 H -1.923 -6.587 -8.227 1.00 . A A . 25 ASP HB2 1 1 19 16603 1 1 25 ASP HB3 H -3.443 -7.341 -7.770 1.00 . A A . 25 ASP HB3 1 1 19 16604 1 1 25 ASP N N -2.967 -4.720 -6.831 1.00 . A A . 25 ASP N 1 1 19 16605 1 1 25 ASP O O -5.789 -5.654 -8.868 1.00 . A A . 25 ASP O 1 1 19 16606 1 1 25 ASP OD1 O -3.037 -6.151 -10.750 1.00 . A A . 25 ASP OD1 1 1 19 16607 1 1 25 ASP OD2 O -3.577 -8.170 -10.095 1.00 . A A . 25 ASP OD2 1 1 19 16608 1 1 26 THR C C -7.631 -4.009 -5.937 1.00 . A A . 26 THR C 1 1 19 16609 1 1 26 THR CA C -6.984 -5.305 -6.418 1.00 . A A . 26 THR CA 1 1 19 16610 1 1 26 THR CB C -7.202 -6.397 -5.353 1.00 . A A . 26 THR CB 1 1 19 16611 1 1 26 THR CG2 C -7.090 -7.782 -5.972 1.00 . A A . 26 THR CG2 1 1 19 16612 1 1 26 THR H H -4.953 -4.938 -5.960 1.00 . A A . 26 THR H 1 1 19 16613 1 1 26 THR HA H -7.467 -5.622 -7.329 1.00 . A A . 26 THR HA 1 1 19 16614 1 1 26 THR HB H -8.193 -6.283 -4.938 1.00 . A A . 26 THR HB 1 1 19 16615 1 1 26 THR HG1 H -6.559 -5.612 -3.651 1.00 . A A . 26 THR HG1 1 1 19 16616 1 1 26 THR HG21 H -7.995 -8.006 -6.516 1.00 . A A . 26 THR HG21 1 1 19 16617 1 1 26 THR HG22 H -6.948 -8.515 -5.192 1.00 . A A . 26 THR HG22 1 1 19 16618 1 1 26 THR HG23 H -6.247 -7.807 -6.648 1.00 . A A . 26 THR HG23 1 1 19 16619 1 1 26 THR N N -5.567 -5.135 -6.698 1.00 . A A . 26 THR N 1 1 19 16620 1 1 26 THR O O -8.736 -3.665 -6.361 1.00 . A A . 26 THR O 1 1 19 16621 1 1 26 THR OG1 O -6.234 -6.258 -4.302 1.00 . A A . 26 THR OG1 1 1 19 16622 1 1 27 CYS C C -6.861 -0.917 -4.669 1.00 . A A . 27 CYS C 1 1 19 16623 1 1 27 CYS CA C -7.594 -2.215 -4.305 1.00 . A A . 27 CYS CA 1 1 19 16624 1 1 27 CYS CB C -7.556 -2.457 -2.797 1.00 . A A . 27 CYS CB 1 1 19 16625 1 1 27 CYS H H -6.175 -3.739 -4.603 1.00 . A A . 27 CYS H 1 1 19 16626 1 1 27 CYS HA H -8.621 -2.137 -4.622 1.00 . A A . 27 CYS HA 1 1 19 16627 1 1 27 CYS HB2 H -6.852 -1.775 -2.349 1.00 . A A . 27 CYS HB2 1 1 19 16628 1 1 27 CYS HB3 H -8.539 -2.279 -2.385 1.00 . A A . 27 CYS HB3 1 1 19 16629 1 1 27 CYS N N -7.005 -3.367 -4.963 1.00 . A A . 27 CYS N 1 1 19 16630 1 1 27 CYS O O -5.727 -0.950 -5.144 1.00 . A A . 27 CYS O 1 1 19 16631 1 1 27 CYS SG S -7.061 -4.158 -2.342 1.00 . A A . 27 CYS SG 1 1 19 16632 1 1 28 PRO C C -6.073 2.080 -3.599 1.00 . A A . 28 PRO C 1 1 19 16633 1 1 28 PRO CA C -6.917 1.553 -4.758 1.00 . A A . 28 PRO CA 1 1 19 16634 1 1 28 PRO CB C -8.145 2.431 -4.970 1.00 . A A . 28 PRO CB 1 1 19 16635 1 1 28 PRO CD C -8.875 0.386 -3.927 1.00 . A A . 28 PRO CD 1 1 19 16636 1 1 28 PRO CG C -9.171 1.861 -4.047 1.00 . A A . 28 PRO CG 1 1 19 16637 1 1 28 PRO HA H -6.325 1.526 -5.661 1.00 . A A . 28 PRO HA 1 1 19 16638 1 1 28 PRO HB2 H -7.906 3.454 -4.715 1.00 . A A . 28 PRO HB2 1 1 19 16639 1 1 28 PRO HB3 H -8.462 2.372 -5.999 1.00 . A A . 28 PRO HB3 1 1 19 16640 1 1 28 PRO HD2 H -8.917 0.079 -2.893 1.00 . A A . 28 PRO HD2 1 1 19 16641 1 1 28 PRO HD3 H -9.574 -0.185 -4.517 1.00 . A A . 28 PRO HD3 1 1 19 16642 1 1 28 PRO HG2 H -9.095 2.334 -3.080 1.00 . A A . 28 PRO HG2 1 1 19 16643 1 1 28 PRO HG3 H -10.157 2.011 -4.460 1.00 . A A . 28 PRO HG3 1 1 19 16644 1 1 28 PRO N N -7.507 0.247 -4.459 1.00 . A A . 28 PRO N 1 1 19 16645 1 1 28 PRO O O -5.877 3.292 -3.444 1.00 . A A . 28 PRO O 1 1 19 16646 1 1 29 SER C C -3.369 1.851 -2.076 1.00 . A A . 29 SER C 1 1 19 16647 1 1 29 SER CA C -4.776 1.484 -1.631 1.00 . A A . 29 SER CA 1 1 19 16648 1 1 29 SER CB C -4.726 0.284 -0.692 1.00 . A A . 29 SER CB 1 1 19 16649 1 1 29 SER H H -5.801 0.213 -2.956 1.00 . A A . 29 SER H 1 1 19 16650 1 1 29 SER HA H -5.222 2.322 -1.118 1.00 . A A . 29 SER HA 1 1 19 16651 1 1 29 SER HB2 H -3.701 0.088 -0.411 1.00 . A A . 29 SER HB2 1 1 19 16652 1 1 29 SER HB3 H -5.309 0.495 0.193 1.00 . A A . 29 SER HB3 1 1 19 16653 1 1 29 SER HG H -4.587 -1.251 -1.920 1.00 . A A . 29 SER HG 1 1 19 16654 1 1 29 SER N N -5.598 1.156 -2.778 1.00 . A A . 29 SER N 1 1 19 16655 1 1 29 SER O O -2.896 1.377 -3.105 1.00 . A A . 29 SER O 1 1 19 16656 1 1 29 SER OG O -5.259 -0.868 -1.328 1.00 . A A . 29 SER OG 1 1 19 16657 1 1 30 SER C C -0.424 2.824 -0.418 1.00 . A A . 30 SER C 1 1 19 16658 1 1 30 SER CA C -1.338 3.059 -1.611 1.00 . A A . 30 SER CA 1 1 19 16659 1 1 30 SER CB C -1.296 4.522 -2.045 1.00 . A A . 30 SER CB 1 1 19 16660 1 1 30 SER H H -3.108 3.004 -0.469 1.00 . A A . 30 SER H 1 1 19 16661 1 1 30 SER HA H -1.001 2.440 -2.429 1.00 . A A . 30 SER HA 1 1 19 16662 1 1 30 SER HB2 H -1.626 5.149 -1.230 1.00 . A A . 30 SER HB2 1 1 19 16663 1 1 30 SER HB3 H -0.283 4.785 -2.318 1.00 . A A . 30 SER HB3 1 1 19 16664 1 1 30 SER HG H -2.718 5.504 -2.985 1.00 . A A . 30 SER HG 1 1 19 16665 1 1 30 SER N N -2.696 2.671 -1.292 1.00 . A A . 30 SER N 1 1 19 16666 1 1 30 SER O O -0.814 3.039 0.733 1.00 . A A . 30 SER O 1 1 19 16667 1 1 30 SER OG O -2.143 4.742 -3.163 1.00 . A A . 30 SER OG 1 1 19 16668 1 1 31 TYR C C 3.090 2.448 0.011 1.00 . A A . 31 TYR C 1 1 19 16669 1 1 31 TYR CA C 1.699 1.939 0.356 1.00 . A A . 31 TYR CA 1 1 19 16670 1 1 31 TYR CB C 1.757 0.421 0.556 1.00 . A A . 31 TYR CB 1 1 19 16671 1 1 31 TYR CD1 C 0.103 -0.194 2.367 1.00 . A A . 31 TYR CD1 1 1 19 16672 1 1 31 TYR CD2 C -0.412 -0.798 0.118 1.00 . A A . 31 TYR CD2 1 1 19 16673 1 1 31 TYR CE1 C -1.079 -0.765 2.794 1.00 . A A . 31 TYR CE1 1 1 19 16674 1 1 31 TYR CE2 C -1.599 -1.371 0.540 1.00 . A A . 31 TYR CE2 1 1 19 16675 1 1 31 TYR CG C 0.457 -0.200 1.022 1.00 . A A . 31 TYR CG 1 1 19 16676 1 1 31 TYR CZ C -1.927 -1.353 1.878 1.00 . A A . 31 TYR CZ 1 1 19 16677 1 1 31 TYR H H 0.963 2.050 -1.624 1.00 . A A . 31 TYR H 1 1 19 16678 1 1 31 TYR HA H 1.371 2.404 1.273 1.00 . A A . 31 TYR HA 1 1 19 16679 1 1 31 TYR HB2 H 2.027 -0.044 -0.381 1.00 . A A . 31 TYR HB2 1 1 19 16680 1 1 31 TYR HB3 H 2.515 0.195 1.291 1.00 . A A . 31 TYR HB3 1 1 19 16681 1 1 31 TYR HD1 H 0.771 0.262 3.084 1.00 . A A . 31 TYR HD1 1 1 19 16682 1 1 31 TYR HD2 H -0.151 -0.811 -0.929 1.00 . A A . 31 TYR HD2 1 1 19 16683 1 1 31 TYR HE1 H -1.339 -0.748 3.843 1.00 . A A . 31 TYR HE1 1 1 19 16684 1 1 31 TYR HE2 H -2.260 -1.831 -0.178 1.00 . A A . 31 TYR HE2 1 1 19 16685 1 1 31 TYR HH H -3.477 -2.481 1.597 1.00 . A A . 31 TYR HH 1 1 19 16686 1 1 31 TYR N N 0.751 2.284 -0.690 1.00 . A A . 31 TYR N 1 1 19 16687 1 1 31 TYR O O 3.387 2.732 -1.151 1.00 . A A . 31 TYR O 1 1 19 16688 1 1 31 TYR OH O -3.106 -1.921 2.307 1.00 . A A . 31 TYR OH 1 1 19 16689 1 1 32 HIS C C 6.009 1.266 0.347 1.00 . A A . 32 HIS C 1 1 19 16690 1 1 32 HIS CA C 5.396 2.593 0.778 1.00 . A A . 32 HIS CA 1 1 19 16691 1 1 32 HIS CB C 6.072 3.071 2.076 1.00 . A A . 32 HIS CB 1 1 19 16692 1 1 32 HIS CD2 C 6.501 5.611 1.906 1.00 . A A . 32 HIS CD2 1 1 19 16693 1 1 32 HIS CE1 C 5.126 6.239 3.479 1.00 . A A . 32 HIS CE1 1 1 19 16694 1 1 32 HIS CG C 5.875 4.519 2.413 1.00 . A A . 32 HIS CG 1 1 19 16695 1 1 32 HIS H H 3.692 1.968 1.849 1.00 . A A . 32 HIS H 1 1 19 16696 1 1 32 HIS HA H 5.524 3.329 -0.003 1.00 . A A . 32 HIS HA 1 1 19 16697 1 1 32 HIS HB2 H 5.683 2.494 2.901 1.00 . A A . 32 HIS HB2 1 1 19 16698 1 1 32 HIS HB3 H 7.135 2.893 1.999 1.00 . A A . 32 HIS HB3 1 1 19 16699 1 1 32 HIS HD2 H 7.235 5.626 1.113 1.00 . A A . 32 HIS HD2 1 1 19 16700 1 1 32 HIS HE1 H 4.571 6.861 4.166 1.00 . A A . 32 HIS HE1 1 1 19 16701 1 1 32 HIS HE2 H 6.443 7.597 2.611 1.00 . A A . 32 HIS HE2 1 1 19 16702 1 1 32 HIS N N 3.975 2.370 0.992 1.00 . A A . 32 HIS N 1 1 19 16703 1 1 32 HIS ND1 N 5.008 4.930 3.402 1.00 . A A . 32 HIS ND1 1 1 19 16704 1 1 32 HIS NE2 N 6.021 6.702 2.592 1.00 . A A . 32 HIS NE2 1 1 19 16705 1 1 32 HIS O O 5.402 0.519 -0.420 1.00 . A A . 32 HIS O 1 1 19 16706 1 1 33 ILE C C 7.936 -1.106 2.114 1.00 . A A . 33 ILE C 1 1 19 16707 1 1 33 ILE CA C 7.687 -0.425 0.768 1.00 . A A . 33 ILE CA 1 1 19 16708 1 1 33 ILE CB C 9.004 -0.367 -0.034 1.00 . A A . 33 ILE CB 1 1 19 16709 1 1 33 ILE CD1 C 11.460 0.043 0.483 1.00 . A A . 33 ILE CD1 1 1 19 16710 1 1 33 ILE CG1 C 10.037 0.510 0.679 1.00 . A A . 33 ILE CG1 1 1 19 16711 1 1 33 ILE CG2 C 8.739 0.159 -1.433 1.00 . A A . 33 ILE CG2 1 1 19 16712 1 1 33 ILE H H 7.531 1.504 1.612 1.00 . A A . 33 ILE H 1 1 19 16713 1 1 33 ILE HA H 6.973 -1.013 0.210 1.00 . A A . 33 ILE HA 1 1 19 16714 1 1 33 ILE HB H 9.393 -1.371 -0.121 1.00 . A A . 33 ILE HB 1 1 19 16715 1 1 33 ILE HD11 H 11.480 -1.035 0.414 1.00 . A A . 33 ILE HD11 1 1 19 16716 1 1 33 ILE HD12 H 11.859 0.469 -0.425 1.00 . A A . 33 ILE HD12 1 1 19 16717 1 1 33 ILE HD13 H 12.061 0.359 1.323 1.00 . A A . 33 ILE HD13 1 1 19 16718 1 1 33 ILE HG12 H 9.965 1.518 0.301 1.00 . A A . 33 ILE HG12 1 1 19 16719 1 1 33 ILE HG21 H 8.207 -0.587 -2.003 1.00 . A A . 33 ILE HG21 1 1 19 16720 1 1 33 ILE HG22 H 8.140 1.057 -1.369 1.00 . A A . 33 ILE HG22 1 1 19 16721 1 1 33 ILE HG23 H 9.677 0.386 -1.919 1.00 . A A . 33 ILE HG23 1 1 19 16722 1 1 33 ILE N N 7.118 0.898 0.964 1.00 . A A . 33 ILE N 1 1 19 16723 1 1 33 ILE O O 8.607 -2.137 2.184 1.00 . A A . 33 ILE O 1 1 19 16724 1 1 34 HIS C C 6.545 -0.784 5.478 1.00 . A A . 34 HIS C 1 1 19 16725 1 1 34 HIS CA C 7.738 -0.966 4.536 1.00 . A A . 34 HIS CA 1 1 19 16726 1 1 34 HIS CB C 8.968 -0.247 5.109 1.00 . A A . 34 HIS CB 1 1 19 16727 1 1 34 HIS CD2 C 8.549 2.164 5.944 1.00 . A A . 34 HIS CD2 1 1 19 16728 1 1 34 HIS CE1 C 9.100 3.199 4.108 1.00 . A A . 34 HIS CE1 1 1 19 16729 1 1 34 HIS CG C 8.907 1.251 5.010 1.00 . A A . 34 HIS CG 1 1 19 16730 1 1 34 HIS H H 6.985 0.367 3.076 1.00 . A A . 34 HIS H 1 1 19 16731 1 1 34 HIS HA H 7.959 -2.021 4.462 1.00 . A A . 34 HIS HA 1 1 19 16732 1 1 34 HIS HB2 H 9.066 -0.502 6.153 1.00 . A A . 34 HIS HB2 1 1 19 16733 1 1 34 HIS HB3 H 9.848 -0.582 4.579 1.00 . A A . 34 HIS HB3 1 1 19 16734 1 1 34 HIS HD2 H 8.234 1.962 6.956 1.00 . A A . 34 HIS HD2 1 1 19 16735 1 1 34 HIS HE1 H 9.293 3.988 3.395 1.00 . A A . 34 HIS HE1 1 1 19 16736 1 1 34 HIS HE2 H 8.693 4.262 5.841 1.00 . A A . 34 HIS HE2 1 1 19 16737 1 1 34 HIS N N 7.458 -0.481 3.189 1.00 . A A . 34 HIS N 1 1 19 16738 1 1 34 HIS ND1 N 9.253 1.910 3.854 1.00 . A A . 34 HIS ND1 1 1 19 16739 1 1 34 HIS NE2 N 8.675 3.402 5.361 1.00 . A A . 34 HIS NE2 1 1 19 16740 1 1 34 HIS O O 6.674 -0.992 6.686 1.00 . A A . 34 HIS O 1 1 19 16741 1 1 35 CYS C C 3.663 -1.560 6.222 1.00 . A A . 35 CYS C 1 1 19 16742 1 1 35 CYS CA C 4.198 -0.210 5.754 1.00 . A A . 35 CYS CA 1 1 19 16743 1 1 35 CYS CB C 3.135 0.523 4.942 1.00 . A A . 35 CYS CB 1 1 19 16744 1 1 35 CYS H H 5.337 -0.237 3.974 1.00 . A A . 35 CYS H 1 1 19 16745 1 1 35 CYS HA H 4.465 0.385 6.614 1.00 . A A . 35 CYS HA 1 1 19 16746 1 1 35 CYS HB2 H 2.511 -0.199 4.440 1.00 . A A . 35 CYS HB2 1 1 19 16747 1 1 35 CYS HB3 H 2.528 1.120 5.607 1.00 . A A . 35 CYS HB3 1 1 19 16748 1 1 35 CYS N N 5.391 -0.399 4.937 1.00 . A A . 35 CYS N 1 1 19 16749 1 1 35 CYS O O 3.144 -1.695 7.331 1.00 . A A . 35 CYS O 1 1 19 16750 1 1 35 CYS SG S 3.828 1.629 3.679 1.00 . A A . 35 CYS SG 1 1 19 16751 1 1 36 LEU C C 4.509 -4.648 6.445 1.00 . A A . 36 LEU C 1 1 19 16752 1 1 36 LEU CA C 3.408 -3.915 5.683 1.00 . A A . 36 LEU CA 1 1 19 16753 1 1 36 LEU CB C 3.064 -4.674 4.397 1.00 . A A . 36 LEU CB 1 1 19 16754 1 1 36 LEU CD1 C 3.816 -4.423 2.019 1.00 . A A . 36 LEU CD1 1 1 19 16755 1 1 36 LEU CD2 C 1.543 -3.635 2.692 1.00 . A A . 36 LEU CD2 1 1 19 16756 1 1 36 LEU CG C 2.987 -3.811 3.135 1.00 . A A . 36 LEU CG 1 1 19 16757 1 1 36 LEU H H 4.274 -2.383 4.521 1.00 . A A . 36 LEU H 1 1 19 16758 1 1 36 LEU HA H 2.526 -3.855 6.305 1.00 . A A . 36 LEU HA 1 1 19 16759 1 1 36 LEU HB2 H 3.815 -5.435 4.242 1.00 . A A . 36 LEU HB2 1 1 19 16760 1 1 36 LEU HB3 H 2.109 -5.157 4.534 1.00 . A A . 36 LEU HB3 1 1 19 16761 1 1 36 LEU HD11 H 4.003 -5.464 2.238 1.00 . A A . 36 LEU HD11 1 1 19 16762 1 1 36 LEU HD12 H 3.279 -4.342 1.086 1.00 . A A . 36 LEU HD12 1 1 19 16763 1 1 36 LEU HD13 H 4.756 -3.897 1.939 1.00 . A A . 36 LEU HD13 1 1 19 16764 1 1 36 LEU HD21 H 0.884 -3.815 3.529 1.00 . A A . 36 LEU HD21 1 1 19 16765 1 1 36 LEU HD22 H 1.397 -2.628 2.330 1.00 . A A . 36 LEU HD22 1 1 19 16766 1 1 36 LEU HD23 H 1.319 -4.337 1.902 1.00 . A A . 36 LEU HD23 1 1 19 16767 1 1 36 LEU HG H 3.393 -2.833 3.350 1.00 . A A . 36 LEU HG 1 1 19 16768 1 1 36 LEU N N 3.828 -2.559 5.371 1.00 . A A . 36 LEU N 1 1 19 16769 1 1 36 LEU O O 5.640 -4.170 6.525 1.00 . A A . 36 LEU O 1 1 19 16770 1 1 37 ARG C C 6.270 -7.136 6.792 1.00 . A A . 37 ARG C 1 1 19 16771 1 1 37 ARG CA C 5.161 -6.615 7.716 1.00 . A A . 37 ARG CA 1 1 19 16772 1 1 37 ARG CB C 4.481 -7.772 8.442 1.00 . A A . 37 ARG CB 1 1 19 16773 1 1 37 ARG CD C 5.272 -8.655 10.655 1.00 . A A . 37 ARG CD 1 1 19 16774 1 1 37 ARG CG C 4.448 -7.594 9.948 1.00 . A A . 37 ARG CG 1 1 19 16775 1 1 37 ARG CZ C 4.261 -9.333 12.796 1.00 . A A . 37 ARG CZ 1 1 19 16776 1 1 37 ARG H H 3.270 -6.164 6.867 1.00 . A A . 37 ARG H 1 1 19 16777 1 1 37 ARG HA H 5.613 -5.968 8.453 1.00 . A A . 37 ARG HA 1 1 19 16778 1 1 37 ARG HB2 H 3.464 -7.858 8.087 1.00 . A A . 37 ARG HB2 1 1 19 16779 1 1 37 ARG HB3 H 5.009 -8.687 8.219 1.00 . A A . 37 ARG HB3 1 1 19 16780 1 1 37 ARG HD2 H 5.771 -9.263 9.916 1.00 . A A . 37 ARG HD2 1 1 19 16781 1 1 37 ARG HD3 H 6.007 -8.167 11.279 1.00 . A A . 37 ARG HD3 1 1 19 16782 1 1 37 ARG HE H 3.957 -10.246 11.040 1.00 . A A . 37 ARG HE 1 1 19 16783 1 1 37 ARG HG2 H 4.847 -6.621 10.194 1.00 . A A . 37 ARG HG2 1 1 19 16784 1 1 37 ARG HG3 H 3.424 -7.661 10.285 1.00 . A A . 37 ARG HG3 1 1 19 16785 1 1 37 ARG HH11 H 5.554 -7.769 12.945 1.00 . A A . 37 ARG HH11 1 1 19 16786 1 1 37 ARG HH12 H 4.750 -8.219 14.425 1.00 . A A . 37 ARG HH12 1 1 19 16787 1 1 37 ARG HH21 H 2.956 -10.870 12.970 1.00 . A A . 37 ARG HH21 1 1 19 16788 1 1 37 ARG HH22 H 3.294 -10.014 14.448 1.00 . A A . 37 ARG HH22 1 1 19 16789 1 1 37 ARG N N 4.185 -5.817 6.984 1.00 . A A . 37 ARG N 1 1 19 16790 1 1 37 ARG NE N 4.436 -9.509 11.488 1.00 . A A . 37 ARG NE 1 1 19 16791 1 1 37 ARG NH1 N 4.912 -8.369 13.440 1.00 . A A . 37 ARG NH1 1 1 19 16792 1 1 37 ARG NH2 N 3.440 -10.135 13.458 1.00 . A A . 37 ARG NH2 1 1 19 16793 1 1 37 ARG O O 7.451 -6.946 7.086 1.00 . A A . 37 ARG O 1 1 19 16794 1 1 38 PRO C C 7.513 -7.124 3.870 1.00 . A A . 38 PRO C 1 1 19 16795 1 1 38 PRO CA C 6.935 -8.265 4.703 1.00 . A A . 38 PRO CA 1 1 19 16796 1 1 38 PRO CB C 6.163 -9.245 3.804 1.00 . A A . 38 PRO CB 1 1 19 16797 1 1 38 PRO CD C 4.579 -8.098 5.181 1.00 . A A . 38 PRO CD 1 1 19 16798 1 1 38 PRO CG C 4.795 -9.353 4.393 1.00 . A A . 38 PRO CG 1 1 19 16799 1 1 38 PRO HA H 7.737 -8.786 5.207 1.00 . A A . 38 PRO HA 1 1 19 16800 1 1 38 PRO HB2 H 6.127 -8.856 2.798 1.00 . A A . 38 PRO HB2 1 1 19 16801 1 1 38 PRO HB3 H 6.666 -10.200 3.803 1.00 . A A . 38 PRO HB3 1 1 19 16802 1 1 38 PRO HD2 H 4.196 -7.312 4.547 1.00 . A A . 38 PRO HD2 1 1 19 16803 1 1 38 PRO HD3 H 3.913 -8.280 6.010 1.00 . A A . 38 PRO HD3 1 1 19 16804 1 1 38 PRO HG2 H 4.061 -9.431 3.605 1.00 . A A . 38 PRO HG2 1 1 19 16805 1 1 38 PRO HG3 H 4.742 -10.218 5.041 1.00 . A A . 38 PRO HG3 1 1 19 16806 1 1 38 PRO N N 5.933 -7.782 5.652 1.00 . A A . 38 PRO N 1 1 19 16807 1 1 38 PRO O O 7.170 -6.961 2.699 1.00 . A A . 38 PRO O 1 1 19 16808 1 1 39 ALA C C 9.789 -5.556 2.675 1.00 . A A . 39 ALA C 1 1 19 16809 1 1 39 ALA CA C 8.931 -5.135 3.861 1.00 . A A . 39 ALA CA 1 1 19 16810 1 1 39 ALA CB C 9.756 -4.334 4.858 1.00 . A A . 39 ALA CB 1 1 19 16811 1 1 39 ALA H H 8.515 -6.455 5.461 1.00 . A A . 39 ALA H 1 1 19 16812 1 1 39 ALA HA H 8.129 -4.504 3.504 1.00 . A A . 39 ALA HA 1 1 19 16813 1 1 39 ALA HB1 H 10.479 -4.982 5.327 1.00 . A A . 39 ALA HB1 1 1 19 16814 1 1 39 ALA HB2 H 10.269 -3.535 4.343 1.00 . A A . 39 ALA HB2 1 1 19 16815 1 1 39 ALA HB3 H 9.106 -3.915 5.613 1.00 . A A . 39 ALA HB3 1 1 19 16816 1 1 39 ALA N N 8.333 -6.296 4.510 1.00 . A A . 39 ALA N 1 1 19 16817 1 1 39 ALA O O 10.541 -6.528 2.758 1.00 . A A . 39 ALA O 1 1 19 16818 1 1 40 LEU C C 11.666 -4.360 0.291 1.00 . A A . 40 LEU C 1 1 19 16819 1 1 40 LEU CA C 10.375 -5.168 0.351 1.00 . A A . 40 LEU CA 1 1 19 16820 1 1 40 LEU CB C 9.514 -4.879 -0.881 1.00 . A A . 40 LEU CB 1 1 19 16821 1 1 40 LEU CD1 C 7.026 -5.206 -0.823 1.00 . A A . 40 LEU CD1 1 1 19 16822 1 1 40 LEU CD2 C 8.406 -6.390 -2.544 1.00 . A A . 40 LEU CD2 1 1 19 16823 1 1 40 LEU CG C 8.367 -5.864 -1.117 1.00 . A A . 40 LEU CG 1 1 19 16824 1 1 40 LEU H H 9.006 -4.099 1.561 1.00 . A A . 40 LEU H 1 1 19 16825 1 1 40 LEU HA H 10.623 -6.218 0.374 1.00 . A A . 40 LEU HA 1 1 19 16826 1 1 40 LEU HB2 H 9.095 -3.889 -0.777 1.00 . A A . 40 LEU HB2 1 1 19 16827 1 1 40 LEU HB3 H 10.154 -4.891 -1.751 1.00 . A A . 40 LEU HB3 1 1 19 16828 1 1 40 LEU HD11 H 7.082 -4.154 -1.057 1.00 . A A . 40 LEU HD11 1 1 19 16829 1 1 40 LEU HD12 H 6.259 -5.670 -1.427 1.00 . A A . 40 LEU HD12 1 1 19 16830 1 1 40 LEU HD13 H 6.784 -5.329 0.222 1.00 . A A . 40 LEU HD13 1 1 19 16831 1 1 40 LEU HD21 H 9.432 -6.505 -2.856 1.00 . A A . 40 LEU HD21 1 1 19 16832 1 1 40 LEU HD22 H 7.906 -7.345 -2.590 1.00 . A A . 40 LEU HD22 1 1 19 16833 1 1 40 LEU HD23 H 7.906 -5.690 -3.198 1.00 . A A . 40 LEU HD23 1 1 19 16834 1 1 40 LEU HG H 8.479 -6.705 -0.447 1.00 . A A . 40 LEU HG 1 1 19 16835 1 1 40 LEU N N 9.637 -4.852 1.566 1.00 . A A . 40 LEU N 1 1 19 16836 1 1 40 LEU O O 11.763 -3.290 0.892 1.00 . A A . 40 LEU O 1 1 19 16837 1 1 41 TYR C C 13.832 -3.110 -1.624 1.00 . A A . 41 TYR C 1 1 19 16838 1 1 41 TYR CA C 13.932 -4.179 -0.546 1.00 . A A . 41 TYR CA 1 1 19 16839 1 1 41 TYR CB C 15.063 -5.159 -0.874 1.00 . A A . 41 TYR CB 1 1 19 16840 1 1 41 TYR CD1 C 14.758 -6.521 1.239 1.00 . A A . 41 TYR CD1 1 1 19 16841 1 1 41 TYR CD2 C 15.119 -7.684 -0.811 1.00 . A A . 41 TYR CD2 1 1 19 16842 1 1 41 TYR CE1 C 14.684 -7.724 1.913 1.00 . A A . 41 TYR CE1 1 1 19 16843 1 1 41 TYR CE2 C 15.047 -8.890 -0.142 1.00 . A A . 41 TYR CE2 1 1 19 16844 1 1 41 TYR CG C 14.977 -6.478 -0.134 1.00 . A A . 41 TYR CG 1 1 19 16845 1 1 41 TYR CZ C 14.826 -8.906 1.218 1.00 . A A . 41 TYR CZ 1 1 19 16846 1 1 41 TYR H H 12.527 -5.728 -0.888 1.00 . A A . 41 TYR H 1 1 19 16847 1 1 41 TYR HA H 14.143 -3.702 0.401 1.00 . A A . 41 TYR HA 1 1 19 16848 1 1 41 TYR HB2 H 15.043 -5.373 -1.932 1.00 . A A . 41 TYR HB2 1 1 19 16849 1 1 41 TYR HB3 H 16.008 -4.700 -0.625 1.00 . A A . 41 TYR HB3 1 1 19 16850 1 1 41 TYR HD1 H 14.644 -5.593 1.781 1.00 . A A . 41 TYR HD1 1 1 19 16851 1 1 41 TYR HD2 H 15.289 -7.670 -1.878 1.00 . A A . 41 TYR HD2 1 1 19 16852 1 1 41 TYR HE1 H 14.513 -7.737 2.980 1.00 . A A . 41 TYR HE1 1 1 19 16853 1 1 41 TYR HE2 H 15.161 -9.815 -0.687 1.00 . A A . 41 TYR HE2 1 1 19 16854 1 1 41 TYR HH H 13.834 -10.420 1.880 1.00 . A A . 41 TYR HH 1 1 19 16855 1 1 41 TYR N N 12.658 -4.872 -0.421 1.00 . A A . 41 TYR N 1 1 19 16856 1 1 41 TYR O O 14.318 -1.991 -1.456 1.00 . A A . 41 TYR O 1 1 19 16857 1 1 41 TYR OH O 14.752 -10.106 1.886 1.00 . A A . 41 TYR OH 1 1 19 16858 1 1 42 GLU C C 11.373 -2.331 -3.965 1.00 . A A . 42 GLU C 1 1 19 16859 1 1 42 GLU CA C 12.873 -2.498 -3.770 1.00 . A A . 42 GLU CA 1 1 19 16860 1 1 42 GLU CB C 13.514 -2.984 -5.072 1.00 . A A . 42 GLU CB 1 1 19 16861 1 1 42 GLU CD C 16.003 -2.578 -5.035 1.00 . A A . 42 GLU CD 1 1 19 16862 1 1 42 GLU CG C 14.661 -2.109 -5.548 1.00 . A A . 42 GLU CG 1 1 19 16863 1 1 42 GLU H H 12.716 -4.336 -2.737 1.00 . A A . 42 GLU H 1 1 19 16864 1 1 42 GLU HA H 13.303 -1.548 -3.491 1.00 . A A . 42 GLU HA 1 1 19 16865 1 1 42 GLU HB2 H 13.889 -3.985 -4.924 1.00 . A A . 42 GLU HB2 1 1 19 16866 1 1 42 GLU HB3 H 12.760 -3.003 -5.846 1.00 . A A . 42 GLU HB3 1 1 19 16867 1 1 42 GLU HG2 H 14.682 -2.119 -6.628 1.00 . A A . 42 GLU HG2 1 1 19 16868 1 1 42 GLU HG3 H 14.493 -1.100 -5.202 1.00 . A A . 42 GLU HG3 1 1 19 16869 1 1 42 GLU N N 13.126 -3.441 -2.694 1.00 . A A . 42 GLU N 1 1 19 16870 1 1 42 GLU O O 10.593 -3.203 -3.577 1.00 . A A . 42 GLU O 1 1 19 16871 1 1 42 GLU OE1 O 16.278 -3.793 -5.098 1.00 . A A . 42 GLU OE1 1 1 19 16872 1 1 42 GLU OE2 O 16.797 -1.735 -4.569 1.00 . A A . 42 GLU OE2 1 1 19 16873 1 1 43 VAL C C 8.991 -2.025 -5.776 1.00 . A A . 43 VAL C 1 1 19 16874 1 1 43 VAL CA C 9.563 -0.968 -4.834 1.00 . A A . 43 VAL CA 1 1 19 16875 1 1 43 VAL CB C 9.336 0.435 -5.441 1.00 . A A . 43 VAL CB 1 1 19 16876 1 1 43 VAL CG1 C 7.852 0.772 -5.479 1.00 . A A . 43 VAL CG1 1 1 19 16877 1 1 43 VAL CG2 C 10.101 1.491 -4.657 1.00 . A A . 43 VAL CG2 1 1 19 16878 1 1 43 VAL H H 11.643 -0.578 -4.887 1.00 . A A . 43 VAL H 1 1 19 16879 1 1 43 VAL HA H 9.039 -1.018 -3.890 1.00 . A A . 43 VAL HA 1 1 19 16880 1 1 43 VAL HB H 9.707 0.431 -6.456 1.00 . A A . 43 VAL HB 1 1 19 16881 1 1 43 VAL HG11 H 7.701 1.777 -5.113 1.00 . A A . 43 VAL HG11 1 1 19 16882 1 1 43 VAL HG12 H 7.495 0.701 -6.496 1.00 . A A . 43 VAL HG12 1 1 19 16883 1 1 43 VAL HG13 H 7.310 0.074 -4.856 1.00 . A A . 43 VAL HG13 1 1 19 16884 1 1 43 VAL HG21 H 10.790 2.000 -5.316 1.00 . A A . 43 VAL HG21 1 1 19 16885 1 1 43 VAL HG22 H 9.408 2.206 -4.241 1.00 . A A . 43 VAL HG22 1 1 19 16886 1 1 43 VAL HG23 H 10.650 1.014 -3.858 1.00 . A A . 43 VAL HG23 1 1 19 16887 1 1 43 VAL N N 10.973 -1.226 -4.578 1.00 . A A . 43 VAL N 1 1 19 16888 1 1 43 VAL O O 9.548 -2.277 -6.845 1.00 . A A . 43 VAL O 1 1 19 16889 1 1 44 PRO C C 6.422 -3.095 -7.329 1.00 . A A . 44 PRO C 1 1 19 16890 1 1 44 PRO CA C 7.243 -3.702 -6.198 1.00 . A A . 44 PRO CA 1 1 19 16891 1 1 44 PRO CB C 6.357 -4.449 -5.202 1.00 . A A . 44 PRO CB 1 1 19 16892 1 1 44 PRO CD C 7.155 -2.428 -4.127 1.00 . A A . 44 PRO CD 1 1 19 16893 1 1 44 PRO CG C 6.066 -3.473 -4.109 1.00 . A A . 44 PRO CG 1 1 19 16894 1 1 44 PRO HA H 7.972 -4.381 -6.616 1.00 . A A . 44 PRO HA 1 1 19 16895 1 1 44 PRO HB2 H 5.451 -4.768 -5.695 1.00 . A A . 44 PRO HB2 1 1 19 16896 1 1 44 PRO HB3 H 6.887 -5.311 -4.825 1.00 . A A . 44 PRO HB3 1 1 19 16897 1 1 44 PRO HD2 H 6.722 -1.439 -4.126 1.00 . A A . 44 PRO HD2 1 1 19 16898 1 1 44 PRO HD3 H 7.807 -2.551 -3.276 1.00 . A A . 44 PRO HD3 1 1 19 16899 1 1 44 PRO HG2 H 5.109 -3.010 -4.284 1.00 . A A . 44 PRO HG2 1 1 19 16900 1 1 44 PRO HG3 H 6.061 -3.986 -3.157 1.00 . A A . 44 PRO HG3 1 1 19 16901 1 1 44 PRO N N 7.883 -2.672 -5.385 1.00 . A A . 44 PRO N 1 1 19 16902 1 1 44 PRO O O 5.198 -3.205 -7.362 1.00 . A A . 44 PRO O 1 1 19 16903 1 1 45 ASP C C 6.093 -2.702 -10.427 1.00 . A A . 45 ASP C 1 1 19 16904 1 1 45 ASP CA C 6.480 -1.717 -9.332 1.00 . A A . 45 ASP CA 1 1 19 16905 1 1 45 ASP CB C 7.423 -0.649 -9.888 1.00 . A A . 45 ASP CB 1 1 19 16906 1 1 45 ASP CG C 6.825 0.105 -11.056 1.00 . A A . 45 ASP CG 1 1 19 16907 1 1 45 ASP H H 8.087 -2.332 -8.110 1.00 . A A . 45 ASP H 1 1 19 16908 1 1 45 ASP HA H 5.586 -1.239 -8.960 1.00 . A A . 45 ASP HA 1 1 19 16909 1 1 45 ASP HB2 H 7.654 0.060 -9.107 1.00 . A A . 45 ASP HB2 1 1 19 16910 1 1 45 ASP HB3 H 8.336 -1.120 -10.219 1.00 . A A . 45 ASP HB3 1 1 19 16911 1 1 45 ASP N N 7.114 -2.406 -8.222 1.00 . A A . 45 ASP N 1 1 19 16912 1 1 45 ASP O O 6.953 -3.354 -11.021 1.00 . A A . 45 ASP O 1 1 19 16913 1 1 45 ASP OD1 O 5.801 0.794 -10.862 1.00 . A A . 45 ASP OD1 1 1 19 16914 1 1 45 ASP OD2 O 7.387 0.024 -12.172 1.00 . A A . 45 ASP OD2 1 1 19 16915 1 1 46 GLY C C 3.337 -4.801 -10.990 1.00 . A A . 46 GLY C 1 1 19 16916 1 1 46 GLY CA C 4.301 -3.806 -11.602 1.00 . A A . 46 GLY CA 1 1 19 16917 1 1 46 GLY H H 4.158 -2.368 -10.063 1.00 . A A . 46 GLY H 1 1 19 16918 1 1 46 GLY HA2 H 3.795 -3.267 -12.390 1.00 . A A . 46 GLY HA2 1 1 19 16919 1 1 46 GLY HA3 H 5.139 -4.344 -12.024 1.00 . A A . 46 GLY HA3 1 1 19 16920 1 1 46 GLY N N 4.795 -2.862 -10.629 1.00 . A A . 46 GLY N 1 1 19 16921 1 1 46 GLY O O 2.281 -4.423 -10.479 1.00 . A A . 46 GLY O 1 1 19 16922 1 1 47 GLU C C 3.090 -7.217 -8.960 1.00 . A A . 47 GLU C 1 1 19 16923 1 1 47 GLU CA C 2.897 -7.134 -10.469 1.00 . A A . 47 GLU CA 1 1 19 16924 1 1 47 GLU CB C 3.259 -8.474 -11.117 1.00 . A A . 47 GLU CB 1 1 19 16925 1 1 47 GLU CD C 5.230 -8.206 -12.680 1.00 . A A . 47 GLU CD 1 1 19 16926 1 1 47 GLU CG C 3.727 -8.356 -12.560 1.00 . A A . 47 GLU CG 1 1 19 16927 1 1 47 GLU H H 4.573 -6.297 -11.449 1.00 . A A . 47 GLU H 1 1 19 16928 1 1 47 GLU HA H 1.860 -6.909 -10.676 1.00 . A A . 47 GLU HA 1 1 19 16929 1 1 47 GLU HB2 H 4.048 -8.937 -10.544 1.00 . A A . 47 GLU HB2 1 1 19 16930 1 1 47 GLU HB3 H 2.390 -9.115 -11.096 1.00 . A A . 47 GLU HB3 1 1 19 16931 1 1 47 GLU HG2 H 3.427 -9.245 -13.095 1.00 . A A . 47 GLU HG2 1 1 19 16932 1 1 47 GLU HG3 H 3.256 -7.492 -13.008 1.00 . A A . 47 GLU HG3 1 1 19 16933 1 1 47 GLU N N 3.711 -6.066 -11.028 1.00 . A A . 47 GLU N 1 1 19 16934 1 1 47 GLU O O 4.218 -7.356 -8.478 1.00 . A A . 47 GLU O 1 1 19 16935 1 1 47 GLU OE1 O 5.762 -7.140 -12.302 1.00 . A A . 47 GLU OE1 1 1 19 16936 1 1 47 GLU OE2 O 5.889 -9.150 -13.157 1.00 . A A . 47 GLU OE2 1 1 19 16937 1 1 48 TRP C C 0.613 -7.200 -6.200 1.00 . A A . 48 TRP C 1 1 19 16938 1 1 48 TRP CA C 2.026 -7.145 -6.769 1.00 . A A . 48 TRP CA 1 1 19 16939 1 1 48 TRP CB C 2.762 -5.919 -6.215 1.00 . A A . 48 TRP CB 1 1 19 16940 1 1 48 TRP CD1 C 3.743 -6.710 -3.981 1.00 . A A . 48 TRP CD1 1 1 19 16941 1 1 48 TRP CD2 C 2.181 -5.117 -3.790 1.00 . A A . 48 TRP CD2 1 1 19 16942 1 1 48 TRP CE2 C 2.639 -5.456 -2.502 1.00 . A A . 48 TRP CE2 1 1 19 16943 1 1 48 TRP CE3 C 1.195 -4.134 -3.917 1.00 . A A . 48 TRP CE3 1 1 19 16944 1 1 48 TRP CG C 2.904 -5.928 -4.723 1.00 . A A . 48 TRP CG 1 1 19 16945 1 1 48 TRP CH2 C 1.178 -3.891 -1.508 1.00 . A A . 48 TRP CH2 1 1 19 16946 1 1 48 TRP CZ2 C 2.141 -4.851 -1.353 1.00 . A A . 48 TRP CZ2 1 1 19 16947 1 1 48 TRP CZ3 C 0.704 -3.533 -2.775 1.00 . A A . 48 TRP CZ3 1 1 19 16948 1 1 48 TRP H H 1.127 -6.971 -8.672 1.00 . A A . 48 TRP H 1 1 19 16949 1 1 48 TRP HA H 2.557 -8.037 -6.475 1.00 . A A . 48 TRP HA 1 1 19 16950 1 1 48 TRP HB2 H 3.752 -5.879 -6.643 1.00 . A A . 48 TRP HB2 1 1 19 16951 1 1 48 TRP HB3 H 2.220 -5.027 -6.492 1.00 . A A . 48 TRP HB3 1 1 19 16952 1 1 48 TRP HD1 H 4.423 -7.437 -4.397 1.00 . A A . 48 TRP HD1 1 1 19 16953 1 1 48 TRP HE1 H 4.093 -6.859 -1.909 1.00 . A A . 48 TRP HE1 1 1 19 16954 1 1 48 TRP HE3 H 0.816 -3.843 -4.887 1.00 . A A . 48 TRP HE3 1 1 19 16955 1 1 48 TRP HH2 H 0.766 -3.395 -0.644 1.00 . A A . 48 TRP HH2 1 1 19 16956 1 1 48 TRP HZ2 H 2.497 -5.115 -0.369 1.00 . A A . 48 TRP HZ2 1 1 19 16957 1 1 48 TRP HZ3 H -0.058 -2.772 -2.853 1.00 . A A . 48 TRP HZ3 1 1 19 16958 1 1 48 TRP N N 1.990 -7.102 -8.223 1.00 . A A . 48 TRP N 1 1 19 16959 1 1 48 TRP NE1 N 3.593 -6.428 -2.646 1.00 . A A . 48 TRP NE1 1 1 19 16960 1 1 48 TRP O O -0.238 -6.374 -6.540 1.00 . A A . 48 TRP O 1 1 19 16961 1 1 49 GLN C C -0.633 -8.011 -3.090 1.00 . A A . 49 GLN C 1 1 19 16962 1 1 49 GLN CA C -0.871 -8.214 -4.576 1.00 . A A . 49 GLN CA 1 1 19 16963 1 1 49 GLN CB C -1.557 -9.555 -4.836 1.00 . A A . 49 GLN CB 1 1 19 16964 1 1 49 GLN CD C -3.963 -9.838 -4.143 1.00 . A A . 49 GLN CD 1 1 19 16965 1 1 49 GLN CG C -3.014 -9.410 -5.242 1.00 . A A . 49 GLN CG 1 1 19 16966 1 1 49 GLN H H 1.134 -8.709 -5.003 1.00 . A A . 49 GLN H 1 1 19 16967 1 1 49 GLN HA H -1.505 -7.418 -4.937 1.00 . A A . 49 GLN HA 1 1 19 16968 1 1 49 GLN HB2 H -1.033 -10.069 -5.630 1.00 . A A . 49 GLN HB2 1 1 19 16969 1 1 49 GLN HB3 H -1.513 -10.154 -3.939 1.00 . A A . 49 GLN HB3 1 1 19 16970 1 1 49 GLN HE21 H -4.428 -7.942 -3.755 1.00 . A A . 49 GLN HE21 1 1 19 16971 1 1 49 GLN HE22 H -5.210 -9.129 -2.771 1.00 . A A . 49 GLN HE22 1 1 19 16972 1 1 49 GLN HG2 H -3.206 -8.375 -5.485 1.00 . A A . 49 GLN HG2 1 1 19 16973 1 1 49 GLN HG3 H -3.195 -10.023 -6.114 1.00 . A A . 49 GLN HG3 1 1 19 16974 1 1 49 GLN N N 0.394 -8.126 -5.281 1.00 . A A . 49 GLN N 1 1 19 16975 1 1 49 GLN NE2 N -4.598 -8.876 -3.495 1.00 . A A . 49 GLN NE2 1 1 19 16976 1 1 49 GLN O O 0.472 -8.247 -2.592 1.00 . A A . 49 GLN O 1 1 19 16977 1 1 49 GLN OE1 O -4.123 -11.026 -3.878 1.00 . A A . 49 GLN OE1 1 1 19 16978 1 1 50 CYS C C -1.375 -8.140 -0.058 1.00 . A A . 50 CYS C 1 1 19 16979 1 1 50 CYS CA C -1.445 -6.994 -1.054 1.00 . A A . 50 CYS CA 1 1 19 16980 1 1 50 CYS CB C -2.608 -6.102 -0.686 1.00 . A A . 50 CYS CB 1 1 19 16981 1 1 50 CYS H H -2.422 -7.154 -2.900 1.00 . A A . 50 CYS H 1 1 19 16982 1 1 50 CYS HA H -0.535 -6.419 -0.992 1.00 . A A . 50 CYS HA 1 1 19 16983 1 1 50 CYS HB2 H -3.027 -6.432 0.254 1.00 . A A . 50 CYS HB2 1 1 19 16984 1 1 50 CYS HB3 H -2.256 -5.086 -0.582 1.00 . A A . 50 CYS HB3 1 1 19 16985 1 1 50 CYS N N -1.610 -7.427 -2.423 1.00 . A A . 50 CYS N 1 1 19 16986 1 1 50 CYS O O -2.295 -8.953 0.044 1.00 . A A . 50 CYS O 1 1 19 16987 1 1 50 CYS SG S -3.942 -6.100 -1.921 1.00 . A A . 50 CYS SG 1 1 19 16988 1 1 51 PRO C C -1.145 -8.293 3.156 1.00 . A A . 51 PRO C 1 1 19 16989 1 1 51 PRO CA C -0.341 -8.912 2.014 1.00 . A A . 51 PRO CA 1 1 19 16990 1 1 51 PRO CB C 1.148 -8.912 2.342 1.00 . A A . 51 PRO CB 1 1 19 16991 1 1 51 PRO CD C 0.645 -7.031 0.892 1.00 . A A . 51 PRO CD 1 1 19 16992 1 1 51 PRO CG C 1.649 -7.576 1.886 1.00 . A A . 51 PRO CG 1 1 19 16993 1 1 51 PRO HA H -0.685 -9.916 1.814 1.00 . A A . 51 PRO HA 1 1 19 16994 1 1 51 PRO HB2 H 1.282 -9.042 3.407 1.00 . A A . 51 PRO HB2 1 1 19 16995 1 1 51 PRO HB3 H 1.635 -9.718 1.813 1.00 . A A . 51 PRO HB3 1 1 19 16996 1 1 51 PRO HD2 H 0.241 -6.093 1.242 1.00 . A A . 51 PRO HD2 1 1 19 16997 1 1 51 PRO HD3 H 1.107 -6.905 -0.077 1.00 . A A . 51 PRO HD3 1 1 19 16998 1 1 51 PRO HG2 H 1.730 -6.910 2.731 1.00 . A A . 51 PRO HG2 1 1 19 16999 1 1 51 PRO HG3 H 2.614 -7.693 1.412 1.00 . A A . 51 PRO HG3 1 1 19 17000 1 1 51 PRO N N -0.398 -8.065 0.844 1.00 . A A . 51 PRO N 1 1 19 17001 1 1 51 PRO O O -0.987 -8.667 4.318 1.00 . A A . 51 PRO O 1 1 19 17002 1 1 52 ARG C C -4.173 -6.439 3.446 1.00 . A A . 52 ARG C 1 1 19 17003 1 1 52 ARG CA C -2.690 -6.515 3.802 1.00 . A A . 52 ARG CA 1 1 19 17004 1 1 52 ARG CB C -2.114 -5.104 3.952 1.00 . A A . 52 ARG CB 1 1 19 17005 1 1 52 ARG CD C -2.237 -5.046 6.471 1.00 . A A . 52 ARG CD 1 1 19 17006 1 1 52 ARG CG C -2.640 -4.359 5.172 1.00 . A A . 52 ARG CG 1 1 19 17007 1 1 52 ARG CZ C -3.087 -7.238 7.239 1.00 . A A . 52 ARG CZ 1 1 19 17008 1 1 52 ARG H H -1.972 -6.995 1.873 1.00 . A A . 52 ARG H 1 1 19 17009 1 1 52 ARG HA H -2.592 -7.029 4.747 1.00 . A A . 52 ARG HA 1 1 19 17010 1 1 52 ARG HB2 H -1.040 -5.171 4.035 1.00 . A A . 52 ARG HB2 1 1 19 17011 1 1 52 ARG HB3 H -2.364 -4.531 3.071 1.00 . A A . 52 ARG HB3 1 1 19 17012 1 1 52 ARG HD2 H -1.336 -5.616 6.297 1.00 . A A . 52 ARG HD2 1 1 19 17013 1 1 52 ARG HD3 H -2.042 -4.290 7.216 1.00 . A A . 52 ARG HD3 1 1 19 17014 1 1 52 ARG HE H -4.180 -5.560 7.101 1.00 . A A . 52 ARG HE 1 1 19 17015 1 1 52 ARG HG2 H -2.239 -3.356 5.169 1.00 . A A . 52 ARG HG2 1 1 19 17016 1 1 52 ARG HG3 H -3.718 -4.318 5.118 1.00 . A A . 52 ARG HG3 1 1 19 17017 1 1 52 ARG HH11 H -1.128 -7.225 6.732 1.00 . A A . 52 ARG HH11 1 1 19 17018 1 1 52 ARG HH12 H -1.747 -8.759 7.259 1.00 . A A . 52 ARG HH12 1 1 19 17019 1 1 52 ARG HH21 H -5.012 -7.595 7.789 1.00 . A A . 52 ARG HH21 1 1 19 17020 1 1 52 ARG HH22 H -3.948 -8.967 7.876 1.00 . A A . 52 ARG HH22 1 1 19 17021 1 1 52 ARG N N -1.934 -7.271 2.815 1.00 . A A . 52 ARG N 1 1 19 17022 1 1 52 ARG NE N -3.281 -5.945 6.967 1.00 . A A . 52 ARG NE 1 1 19 17023 1 1 52 ARG NH1 N -1.890 -7.780 7.066 1.00 . A A . 52 ARG NH1 1 1 19 17024 1 1 52 ARG NH2 N -4.095 -7.993 7.669 1.00 . A A . 52 ARG NH2 1 1 19 17025 1 1 52 ARG O O -5.003 -7.040 4.129 1.00 . A A . 52 ARG O 1 1 19 17026 1 1 53 CYS C C -6.409 -6.657 1.169 1.00 . A A . 53 CYS C 1 1 19 17027 1 1 53 CYS CA C -5.916 -5.508 2.041 1.00 . A A . 53 CYS CA 1 1 19 17028 1 1 53 CYS CB C -6.130 -4.164 1.346 1.00 . A A . 53 CYS CB 1 1 19 17029 1 1 53 CYS H H -3.837 -5.211 1.884 1.00 . A A . 53 CYS H 1 1 19 17030 1 1 53 CYS HA H -6.487 -5.513 2.958 1.00 . A A . 53 CYS HA 1 1 19 17031 1 1 53 CYS HB2 H -6.906 -4.275 0.607 1.00 . A A . 53 CYS HB2 1 1 19 17032 1 1 53 CYS HB3 H -6.446 -3.444 2.084 1.00 . A A . 53 CYS HB3 1 1 19 17033 1 1 53 CYS N N -4.521 -5.681 2.403 1.00 . A A . 53 CYS N 1 1 19 17034 1 1 53 CYS O O -7.141 -6.455 0.200 1.00 . A A . 53 CYS O 1 1 19 17035 1 1 53 CYS SG S -4.664 -3.480 0.502 1.00 . A A . 53 CYS SG 1 1 19 17036 1 1 54 THR C C -7.878 -9.527 1.594 1.00 . A A . 54 THR C 1 1 19 17037 1 1 54 THR CA C -6.582 -9.061 0.936 1.00 . A A . 54 THR CA 1 1 19 17038 1 1 54 THR CB C -5.526 -10.174 1.004 1.00 . A A . 54 THR CB 1 1 19 17039 1 1 54 THR CG2 C -5.026 -10.520 -0.387 1.00 . A A . 54 THR CG2 1 1 19 17040 1 1 54 THR H H -5.580 -7.958 2.423 1.00 . A A . 54 THR H 1 1 19 17041 1 1 54 THR HA H -6.773 -8.825 -0.101 1.00 . A A . 54 THR HA 1 1 19 17042 1 1 54 THR HB H -5.971 -11.053 1.445 1.00 . A A . 54 THR HB 1 1 19 17043 1 1 54 THR HG1 H -3.734 -9.372 1.241 1.00 . A A . 54 THR HG1 1 1 19 17044 1 1 54 THR HG21 H -4.227 -9.842 -0.656 1.00 . A A . 54 THR HG21 1 1 19 17045 1 1 54 THR HG22 H -5.835 -10.423 -1.096 1.00 . A A . 54 THR HG22 1 1 19 17046 1 1 54 THR HG23 H -4.656 -11.534 -0.396 1.00 . A A . 54 THR HG23 1 1 19 17047 1 1 54 THR N N -6.101 -7.866 1.596 1.00 . A A . 54 THR N 1 1 19 17048 1 1 54 THR O O -8.071 -10.722 1.828 1.00 . A A . 54 THR O 1 1 19 17049 1 1 54 THR OG1 O -4.422 -9.738 1.815 1.00 . A A . 54 THR OG1 1 1 19 17050 1 1 55 CYS C C -9.875 -8.144 4.101 1.00 . A A . 55 CYS C 1 1 19 17051 1 1 55 CYS CA C -9.987 -8.658 2.655 1.00 . A A . 55 CYS CA 1 1 19 17052 1 1 55 CYS CB C -10.588 -10.072 2.597 1.00 . A A . 55 CYS CB 1 1 19 17053 1 1 55 CYS H H -8.399 -7.613 1.745 1.00 . A A . 55 CYS H 1 1 19 17054 1 1 55 CYS HA H -10.672 -7.993 2.144 1.00 . A A . 55 CYS HA 1 1 19 17055 1 1 55 CYS HB2 H -9.829 -10.790 2.868 1.00 . A A . 55 CYS HB2 1 1 19 17056 1 1 55 CYS HB3 H -11.409 -10.139 3.296 1.00 . A A . 55 CYS HB3 1 1 19 17057 1 1 55 CYS HG H -10.462 -9.916 0.050 1.00 . A A . 55 CYS HG 1 1 19 17058 1 1 55 CYS N N -8.699 -8.524 1.949 1.00 . A A . 55 CYS N 1 1 19 17059 1 1 55 CYS O O -10.446 -7.098 4.413 1.00 . A A . 55 CYS O 1 1 19 17060 1 1 55 CYS SG S -11.215 -10.526 0.961 1.00 . A A . 55 CYS SG 1 1 19 17061 1 1 56 PRO C C -7.802 -7.236 6.449 1.00 . A A . 56 PRO C 1 1 19 17062 1 1 56 PRO CA C -8.897 -8.297 6.359 1.00 . A A . 56 PRO CA 1 1 19 17063 1 1 56 PRO CB C -8.491 -9.557 7.116 1.00 . A A . 56 PRO CB 1 1 19 17064 1 1 56 PRO CD C -8.276 -10.005 4.760 1.00 . A A . 56 PRO CD 1 1 19 17065 1 1 56 PRO CG C -7.720 -10.355 6.121 1.00 . A A . 56 PRO CG 1 1 19 17066 1 1 56 PRO HA H -9.816 -7.903 6.768 1.00 . A A . 56 PRO HA 1 1 19 17067 1 1 56 PRO HB2 H -7.884 -9.290 7.968 1.00 . A A . 56 PRO HB2 1 1 19 17068 1 1 56 PRO HB3 H -9.374 -10.085 7.445 1.00 . A A . 56 PRO HB3 1 1 19 17069 1 1 56 PRO HD2 H -7.473 -9.805 4.068 1.00 . A A . 56 PRO HD2 1 1 19 17070 1 1 56 PRO HD3 H -8.896 -10.811 4.392 1.00 . A A . 56 PRO HD3 1 1 19 17071 1 1 56 PRO HG2 H -6.673 -10.095 6.177 1.00 . A A . 56 PRO HG2 1 1 19 17072 1 1 56 PRO HG3 H -7.854 -11.408 6.319 1.00 . A A . 56 PRO HG3 1 1 19 17073 1 1 56 PRO N N -9.081 -8.787 4.994 1.00 . A A . 56 PRO N 1 1 19 17074 1 1 56 PRO O O -6.753 -7.455 7.065 1.00 . A A . 56 PRO O 1 1 19 17075 1 1 57 ALA C C -6.741 -4.546 7.205 1.00 . A A . 57 ALA C 1 1 19 17076 1 1 57 ALA CA C -7.076 -5.004 5.788 1.00 . A A . 57 ALA CA 1 1 19 17077 1 1 57 ALA CB C -7.608 -3.840 4.965 1.00 . A A . 57 ALA CB 1 1 19 17078 1 1 57 ALA H H -8.889 -5.994 5.324 1.00 . A A . 57 ALA H 1 1 19 17079 1 1 57 ALA HA H -6.174 -5.364 5.316 1.00 . A A . 57 ALA HA 1 1 19 17080 1 1 57 ALA HB1 H -8.318 -4.208 4.239 1.00 . A A . 57 ALA HB1 1 1 19 17081 1 1 57 ALA HB2 H -8.096 -3.131 5.618 1.00 . A A . 57 ALA HB2 1 1 19 17082 1 1 57 ALA HB3 H -6.789 -3.355 4.455 1.00 . A A . 57 ALA HB3 1 1 19 17083 1 1 57 ALA N N -8.040 -6.097 5.805 1.00 . A A . 57 ALA N 1 1 19 17084 1 1 57 ALA O O -5.569 -4.470 7.583 1.00 . A A . 57 ALA O 1 1 19 17085 1 1 58 LEU C C -8.787 -4.413 10.224 1.00 . A A . 58 LEU C 1 1 19 17086 1 1 58 LEU CA C -7.601 -3.938 9.395 1.00 . A A . 58 LEU CA 1 1 19 17087 1 1 58 LEU CB C -7.459 -2.417 9.518 1.00 . A A . 58 LEU CB 1 1 19 17088 1 1 58 LEU CD1 C -5.735 -0.943 8.463 1.00 . A A . 58 LEU CD1 1 1 19 17089 1 1 58 LEU CD2 C -5.782 -1.228 10.945 1.00 . A A . 58 LEU CD2 1 1 19 17090 1 1 58 LEU CG C -6.022 -1.903 9.605 1.00 . A A . 58 LEU CG 1 1 19 17091 1 1 58 LEU H H -8.687 -4.471 7.658 1.00 . A A . 58 LEU H 1 1 19 17092 1 1 58 LEU HA H -6.703 -4.409 9.763 1.00 . A A . 58 LEU HA 1 1 19 17093 1 1 58 LEU HB2 H -7.931 -1.964 8.659 1.00 . A A . 58 LEU HB2 1 1 19 17094 1 1 58 LEU HB3 H -7.984 -2.099 10.406 1.00 . A A . 58 LEU HB3 1 1 19 17095 1 1 58 LEU HD11 H -5.365 -0.010 8.860 1.00 . A A . 58 LEU HD11 1 1 19 17096 1 1 58 LEU HD12 H -4.992 -1.376 7.808 1.00 . A A . 58 LEU HD12 1 1 19 17097 1 1 58 LEU HD13 H -6.643 -0.764 7.907 1.00 . A A . 58 LEU HD13 1 1 19 17098 1 1 58 LEU HD21 H -5.051 -1.790 11.507 1.00 . A A . 58 LEU HD21 1 1 19 17099 1 1 58 LEU HD22 H -5.419 -0.224 10.782 1.00 . A A . 58 LEU HD22 1 1 19 17100 1 1 58 LEU HD23 H -6.709 -1.190 11.499 1.00 . A A . 58 LEU HD23 1 1 19 17101 1 1 58 LEU HG H -5.338 -2.737 9.521 1.00 . A A . 58 LEU HG 1 1 19 17102 1 1 58 LEU N N -7.775 -4.322 8.002 1.00 . A A . 58 LEU N 1 1 19 17103 1 1 58 LEU O O -8.693 -5.395 10.963 1.00 . A A . 58 LEU O 1 1 19 17104 1 1 59 LYS C C -12.332 -4.004 9.751 1.00 . A A . 59 LYS C 1 1 19 17105 1 1 59 LYS CA C -11.153 -4.130 10.706 1.00 . A A . 59 LYS CA 1 1 19 17106 1 1 59 LYS CB C -11.376 -3.247 11.936 1.00 . A A . 59 LYS CB 1 1 19 17107 1 1 59 LYS CD C -11.036 -2.966 14.412 1.00 . A A . 59 LYS CD 1 1 19 17108 1 1 59 LYS CE C -9.639 -2.391 14.594 1.00 . A A . 59 LYS CE 1 1 19 17109 1 1 59 LYS CG C -11.085 -3.947 13.252 1.00 . A A . 59 LYS CG 1 1 19 17110 1 1 59 LYS H H -9.946 -3.034 9.358 1.00 . A A . 59 LYS H 1 1 19 17111 1 1 59 LYS HA H -11.065 -5.160 11.021 1.00 . A A . 59 LYS HA 1 1 19 17112 1 1 59 LYS HB2 H -10.735 -2.381 11.863 1.00 . A A . 59 LYS HB2 1 1 19 17113 1 1 59 LYS HB3 H -12.406 -2.920 11.947 1.00 . A A . 59 LYS HB3 1 1 19 17114 1 1 59 LYS HD2 H -11.724 -2.158 14.214 1.00 . A A . 59 LYS HD2 1 1 19 17115 1 1 59 LYS HD3 H -11.327 -3.478 15.318 1.00 . A A . 59 LYS HD3 1 1 19 17116 1 1 59 LYS HE2 H -9.348 -1.895 13.680 1.00 . A A . 59 LYS HE2 1 1 19 17117 1 1 59 LYS HE3 H -9.660 -1.673 15.399 1.00 . A A . 59 LYS HE3 1 1 19 17118 1 1 59 LYS HG2 H -11.862 -4.671 13.441 1.00 . A A . 59 LYS HG2 1 1 19 17119 1 1 59 LYS HG3 H -10.132 -4.450 13.177 1.00 . A A . 59 LYS HG3 1 1 19 17120 1 1 59 LYS HZ1 H -9.077 -4.386 14.882 1.00 . A A . 59 LYS HZ1 1 1 19 17121 1 1 59 LYS HZ2 H -8.240 -3.291 15.866 1.00 . A A . 59 LYS HZ2 1 1 19 17122 1 1 59 LYS HZ3 H -7.855 -3.415 14.219 1.00 . A A . 59 LYS HZ3 1 1 19 17123 1 1 59 LYS N N -9.922 -3.759 10.029 1.00 . A A . 59 LYS N 1 1 19 17124 1 1 59 LYS NZ N -8.635 -3.442 14.911 1.00 . A A . 59 LYS NZ 1 1 19 17125 1 1 59 LYS O O -12.841 -2.907 9.522 1.00 . A A . 59 LYS O 1 1 19 17126 1 1 60 GLY C C -15.168 -4.847 8.889 1.00 . A A . 60 GLY C 1 1 19 17127 1 1 60 GLY CA C -13.834 -5.111 8.226 1.00 . A A . 60 GLY CA 1 1 19 17128 1 1 60 GLY H H -12.292 -5.969 9.391 1.00 . A A . 60 GLY H 1 1 19 17129 1 1 60 GLY HA2 H -13.651 -4.342 7.491 1.00 . A A . 60 GLY HA2 1 1 19 17130 1 1 60 GLY HA3 H -13.876 -6.067 7.728 1.00 . A A . 60 GLY HA3 1 1 19 17131 1 1 60 GLY N N -12.739 -5.123 9.172 1.00 . A A . 60 GLY N 1 1 19 17132 1 1 60 GLY O O -15.576 -5.575 9.797 1.00 . A A . 60 GLY O 1 1 19 17133 1 1 61 LYS C C -17.914 -2.640 7.953 1.00 . A A . 61 LYS C 1 1 19 17134 1 1 61 LYS CA C -17.137 -3.431 8.993 1.00 . A A . 61 LYS CA 1 1 19 17135 1 1 61 LYS CB C -16.990 -2.619 10.280 1.00 . A A . 61 LYS CB 1 1 19 17136 1 1 61 LYS CD C -17.291 -3.219 12.696 1.00 . A A . 61 LYS CD 1 1 19 17137 1 1 61 LYS CE C -17.804 -4.461 13.404 1.00 . A A . 61 LYS CE 1 1 19 17138 1 1 61 LYS CG C -17.982 -3.012 11.361 1.00 . A A . 61 LYS CG 1 1 19 17139 1 1 61 LYS H H -15.443 -3.233 7.747 1.00 . A A . 61 LYS H 1 1 19 17140 1 1 61 LYS HA H -17.672 -4.344 9.211 1.00 . A A . 61 LYS HA 1 1 19 17141 1 1 61 LYS HB2 H -15.992 -2.758 10.669 1.00 . A A . 61 LYS HB2 1 1 19 17142 1 1 61 LYS HB3 H -17.136 -1.574 10.051 1.00 . A A . 61 LYS HB3 1 1 19 17143 1 1 61 LYS HD2 H -16.230 -3.324 12.528 1.00 . A A . 61 LYS HD2 1 1 19 17144 1 1 61 LYS HD3 H -17.475 -2.358 13.321 1.00 . A A . 61 LYS HD3 1 1 19 17145 1 1 61 LYS HE2 H -17.852 -5.273 12.692 1.00 . A A . 61 LYS HE2 1 1 19 17146 1 1 61 LYS HE3 H -17.117 -4.718 14.197 1.00 . A A . 61 LYS HE3 1 1 19 17147 1 1 61 LYS HG2 H -18.718 -2.228 11.465 1.00 . A A . 61 LYS HG2 1 1 19 17148 1 1 61 LYS HG3 H -18.471 -3.932 11.072 1.00 . A A . 61 LYS HG3 1 1 19 17149 1 1 61 LYS HZ1 H -19.280 -3.245 14.249 1.00 . A A . 61 LYS HZ1 1 1 19 17150 1 1 61 LYS HZ2 H -19.282 -4.839 14.828 1.00 . A A . 61 LYS HZ2 1 1 19 17151 1 1 61 LYS HZ3 H -19.889 -4.499 13.282 1.00 . A A . 61 LYS HZ3 1 1 19 17152 1 1 61 LYS N N -15.837 -3.791 8.457 1.00 . A A . 61 LYS N 1 1 19 17153 1 1 61 LYS NZ N -19.156 -4.247 13.981 1.00 . A A . 61 LYS NZ 1 1 19 17154 1 1 61 LYS O O -18.212 -3.208 6.884 1.00 . A A . 61 LYS O 1 1 19 17155 1 1 61 LYS OXT O -18.200 -1.450 8.191 1.00 . A A . 61 LYS OXT 1 1 19 17156 2 2 1 ZN ZN ZN -4.854 -4.087 -1.703 1.00 . B A . 62 ZN ZN 1 1 19 17157 3 2 1 ZN ZN ZN 3.787 3.780 4.514 1.00 . C A . 63 ZN ZN 1 1 20 17158 1 1 1 GLY C C -15.946 13.060 -4.738 1.00 . A A . 1 GLY C 1 1 20 17159 1 1 1 GLY CA C -17.024 13.413 -5.737 1.00 . A A . 1 GLY CA 1 1 20 17160 1 1 1 GLY H1 H -16.868 13.769 -7.786 1.00 . A A . 1 GLY H1 1 1 20 17161 1 1 1 GLY H2 H -17.180 12.149 -7.388 1.00 . A A . 1 GLY H2 1 1 20 17162 1 1 1 GLY H3 H -15.631 12.795 -7.158 1.00 . A A . 1 GLY H3 1 1 20 17163 1 1 1 GLY HA2 H -17.183 14.481 -5.718 1.00 . A A . 1 GLY HA2 1 1 20 17164 1 1 1 GLY HA3 H -17.941 12.915 -5.458 1.00 . A A . 1 GLY HA3 1 1 20 17165 1 1 1 GLY N N -16.652 13.004 -7.111 1.00 . A A . 1 GLY N 1 1 20 17166 1 1 1 GLY O O -14.855 12.652 -5.133 1.00 . A A . 1 GLY O 1 1 20 17167 1 1 2 PRO C C -14.880 11.447 -2.339 1.00 . A A . 2 PRO C 1 1 20 17168 1 1 2 PRO CA C -15.243 12.928 -2.374 1.00 . A A . 2 PRO CA 1 1 20 17169 1 1 2 PRO CB C -15.969 13.331 -1.084 1.00 . A A . 2 PRO CB 1 1 20 17170 1 1 2 PRO CD C -17.473 13.752 -2.884 1.00 . A A . 2 PRO CD 1 1 20 17171 1 1 2 PRO CG C -17.069 14.236 -1.523 1.00 . A A . 2 PRO CG 1 1 20 17172 1 1 2 PRO HA H -14.341 13.517 -2.483 1.00 . A A . 2 PRO HA 1 1 20 17173 1 1 2 PRO HB2 H -16.356 12.448 -0.599 1.00 . A A . 2 PRO HB2 1 1 20 17174 1 1 2 PRO HB3 H -15.281 13.839 -0.425 1.00 . A A . 2 PRO HB3 1 1 20 17175 1 1 2 PRO HD2 H -18.214 12.970 -2.801 1.00 . A A . 2 PRO HD2 1 1 20 17176 1 1 2 PRO HD3 H -17.847 14.568 -3.484 1.00 . A A . 2 PRO HD3 1 1 20 17177 1 1 2 PRO HG2 H -17.899 14.166 -0.837 1.00 . A A . 2 PRO HG2 1 1 20 17178 1 1 2 PRO HG3 H -16.710 15.254 -1.578 1.00 . A A . 2 PRO HG3 1 1 20 17179 1 1 2 PRO N N -16.214 13.229 -3.433 1.00 . A A . 2 PRO N 1 1 20 17180 1 1 2 PRO O O -15.628 10.622 -1.813 1.00 . A A . 2 PRO O 1 1 20 17181 1 1 3 LEU C C -12.431 9.402 -1.809 1.00 . A A . 3 LEU C 1 1 20 17182 1 1 3 LEU CA C -13.297 9.736 -3.016 1.00 . A A . 3 LEU CA 1 1 20 17183 1 1 3 LEU CB C -12.509 9.513 -4.310 1.00 . A A . 3 LEU CB 1 1 20 17184 1 1 3 LEU CD1 C -14.665 9.256 -5.578 1.00 . A A . 3 LEU CD1 1 1 20 17185 1 1 3 LEU CD2 C -12.488 8.818 -6.720 1.00 . A A . 3 LEU CD2 1 1 20 17186 1 1 3 LEU CG C -13.248 8.734 -5.405 1.00 . A A . 3 LEU CG 1 1 20 17187 1 1 3 LEU H H -13.212 11.818 -3.362 1.00 . A A . 3 LEU H 1 1 20 17188 1 1 3 LEU HA H -14.166 9.096 -3.013 1.00 . A A . 3 LEU HA 1 1 20 17189 1 1 3 LEU HB2 H -12.237 10.478 -4.708 1.00 . A A . 3 LEU HB2 1 1 20 17190 1 1 3 LEU HB3 H -11.603 8.976 -4.066 1.00 . A A . 3 LEU HB3 1 1 20 17191 1 1 3 LEU HD11 H -14.754 10.222 -5.104 1.00 . A A . 3 LEU HD11 1 1 20 17192 1 1 3 LEU HD12 H -14.887 9.350 -6.632 1.00 . A A . 3 LEU HD12 1 1 20 17193 1 1 3 LEU HD13 H -15.362 8.566 -5.124 1.00 . A A . 3 LEU HD13 1 1 20 17194 1 1 3 LEU HD21 H -11.909 7.917 -6.859 1.00 . A A . 3 LEU HD21 1 1 20 17195 1 1 3 LEU HD22 H -13.190 8.925 -7.535 1.00 . A A . 3 LEU HD22 1 1 20 17196 1 1 3 LEU HD23 H -11.827 9.672 -6.699 1.00 . A A . 3 LEU HD23 1 1 20 17197 1 1 3 LEU HG H -13.308 7.693 -5.119 1.00 . A A . 3 LEU HG 1 1 20 17198 1 1 3 LEU N N -13.752 11.114 -2.941 1.00 . A A . 3 LEU N 1 1 20 17199 1 1 3 LEU O O -11.805 10.286 -1.220 1.00 . A A . 3 LEU O 1 1 20 17200 1 1 4 GLY C C -12.522 7.623 0.969 1.00 . A A . 4 GLY C 1 1 20 17201 1 1 4 GLY CA C -11.661 7.718 -0.271 1.00 . A A . 4 GLY CA 1 1 20 17202 1 1 4 GLY H H -12.968 7.479 -1.924 1.00 . A A . 4 GLY H 1 1 20 17203 1 1 4 GLY HA2 H -11.222 6.751 -0.473 1.00 . A A . 4 GLY HA2 1 1 20 17204 1 1 4 GLY HA3 H -10.871 8.431 -0.095 1.00 . A A . 4 GLY HA3 1 1 20 17205 1 1 4 GLY N N -12.426 8.137 -1.426 1.00 . A A . 4 GLY N 1 1 20 17206 1 1 4 GLY O O -12.088 7.973 2.068 1.00 . A A . 4 GLY O 1 1 20 17207 1 1 5 SER C C -14.359 6.044 2.855 1.00 . A A . 5 SER C 1 1 20 17208 1 1 5 SER CA C -14.733 7.138 1.856 1.00 . A A . 5 SER CA 1 1 20 17209 1 1 5 SER CB C -16.122 6.883 1.274 1.00 . A A . 5 SER CB 1 1 20 17210 1 1 5 SER H H -14.064 7.017 -0.138 1.00 . A A . 5 SER H 1 1 20 17211 1 1 5 SER HA H -14.738 8.088 2.368 1.00 . A A . 5 SER HA 1 1 20 17212 1 1 5 SER HB2 H -16.485 5.925 1.618 1.00 . A A . 5 SER HB2 1 1 20 17213 1 1 5 SER HB3 H -16.796 7.663 1.598 1.00 . A A . 5 SER HB3 1 1 20 17214 1 1 5 SER HG H -16.542 7.656 -0.481 1.00 . A A . 5 SER HG 1 1 20 17215 1 1 5 SER N N -13.768 7.218 0.774 1.00 . A A . 5 SER N 1 1 20 17216 1 1 5 SER O O -13.931 6.333 3.975 1.00 . A A . 5 SER O 1 1 20 17217 1 1 5 SER OG O -16.078 6.876 -0.148 1.00 . A A . 5 SER OG 1 1 20 17218 1 1 6 ASP C C -13.265 2.674 2.643 1.00 . A A . 6 ASP C 1 1 20 17219 1 1 6 ASP CA C -14.201 3.665 3.324 1.00 . A A . 6 ASP CA 1 1 20 17220 1 1 6 ASP CB C -15.484 2.953 3.756 1.00 . A A . 6 ASP CB 1 1 20 17221 1 1 6 ASP CG C -15.209 1.663 4.504 1.00 . A A . 6 ASP CG 1 1 20 17222 1 1 6 ASP H H -14.836 4.614 1.535 1.00 . A A . 6 ASP H 1 1 20 17223 1 1 6 ASP HA H -13.709 4.056 4.200 1.00 . A A . 6 ASP HA 1 1 20 17224 1 1 6 ASP HB2 H -16.051 3.609 4.401 1.00 . A A . 6 ASP HB2 1 1 20 17225 1 1 6 ASP HB3 H -16.073 2.722 2.880 1.00 . A A . 6 ASP HB3 1 1 20 17226 1 1 6 ASP N N -14.509 4.790 2.446 1.00 . A A . 6 ASP N 1 1 20 17227 1 1 6 ASP O O -12.334 2.161 3.264 1.00 . A A . 6 ASP O 1 1 20 17228 1 1 6 ASP OD1 O -14.942 1.717 5.724 1.00 . A A . 6 ASP OD1 1 1 20 17229 1 1 6 ASP OD2 O -15.278 0.579 3.884 1.00 . A A . 6 ASP OD2 1 1 20 17230 1 1 7 HIS C C -11.906 2.213 -0.481 1.00 . A A . 7 HIS C 1 1 20 17231 1 1 7 HIS CA C -12.665 1.490 0.618 1.00 . A A . 7 HIS CA 1 1 20 17232 1 1 7 HIS CB C -13.499 0.353 0.024 1.00 . A A . 7 HIS CB 1 1 20 17233 1 1 7 HIS CD2 C -11.474 -1.176 -0.404 1.00 . A A . 7 HIS CD2 1 1 20 17234 1 1 7 HIS CE1 C -12.407 -3.053 0.177 1.00 . A A . 7 HIS CE1 1 1 20 17235 1 1 7 HIS CG C -12.755 -0.943 -0.043 1.00 . A A . 7 HIS CG 1 1 20 17236 1 1 7 HIS H H -14.244 2.870 0.908 1.00 . A A . 7 HIS H 1 1 20 17237 1 1 7 HIS HA H -11.947 1.068 1.310 1.00 . A A . 7 HIS HA 1 1 20 17238 1 1 7 HIS HB2 H -14.380 0.203 0.633 1.00 . A A . 7 HIS HB2 1 1 20 17239 1 1 7 HIS HB3 H -13.798 0.618 -0.978 1.00 . A A . 7 HIS HB3 1 1 20 17240 1 1 7 HIS HD2 H -10.759 -0.442 -0.746 1.00 . A A . 7 HIS HD2 1 1 20 17241 1 1 7 HIS HE1 H -12.554 -4.102 0.384 1.00 . A A . 7 HIS HE1 1 1 20 17242 1 1 7 HIS HE2 H -10.363 -2.946 -0.165 1.00 . A A . 7 HIS HE2 1 1 20 17243 1 1 7 HIS N N -13.500 2.416 1.366 1.00 . A A . 7 HIS N 1 1 20 17244 1 1 7 HIS ND1 N -13.342 -2.129 0.321 1.00 . A A . 7 HIS ND1 1 1 20 17245 1 1 7 HIS NE2 N -11.254 -2.524 -0.258 1.00 . A A . 7 HIS NE2 1 1 20 17246 1 1 7 HIS O O -12.157 1.996 -1.667 1.00 . A A . 7 HIS O 1 1 20 17247 1 1 8 HIS C C -9.096 4.603 -0.236 1.00 . A A . 8 HIS C 1 1 20 17248 1 1 8 HIS CA C -10.124 3.788 -1.006 1.00 . A A . 8 HIS CA 1 1 20 17249 1 1 8 HIS CB C -10.972 4.706 -1.891 1.00 . A A . 8 HIS CB 1 1 20 17250 1 1 8 HIS CD2 C -9.392 4.632 -3.933 1.00 . A A . 8 HIS CD2 1 1 20 17251 1 1 8 HIS CE1 C -9.599 6.719 -4.525 1.00 . A A . 8 HIS CE1 1 1 20 17252 1 1 8 HIS CG C -10.236 5.257 -3.077 1.00 . A A . 8 HIS CG 1 1 20 17253 1 1 8 HIS H H -10.806 3.158 0.892 1.00 . A A . 8 HIS H 1 1 20 17254 1 1 8 HIS HA H -9.607 3.071 -1.630 1.00 . A A . 8 HIS HA 1 1 20 17255 1 1 8 HIS HB2 H -11.822 4.147 -2.258 1.00 . A A . 8 HIS HB2 1 1 20 17256 1 1 8 HIS HB3 H -11.324 5.536 -1.299 1.00 . A A . 8 HIS HB3 1 1 20 17257 1 1 8 HIS HD2 H -9.082 3.599 -3.898 1.00 . A A . 8 HIS HD2 1 1 20 17258 1 1 8 HIS HE1 H -9.477 7.644 -5.066 1.00 . A A . 8 HIS HE1 1 1 20 17259 1 1 8 HIS HE2 H -8.478 5.393 -5.674 1.00 . A A . 8 HIS HE2 1 1 20 17260 1 1 8 HIS N N -10.964 3.050 -0.075 1.00 . A A . 8 HIS N 1 1 20 17261 1 1 8 HIS ND1 N -10.362 6.574 -3.453 1.00 . A A . 8 HIS ND1 1 1 20 17262 1 1 8 HIS NE2 N -8.995 5.569 -4.850 1.00 . A A . 8 HIS NE2 1 1 20 17263 1 1 8 HIS O O -9.434 5.584 0.432 1.00 . A A . 8 HIS O 1 1 20 17264 1 1 9 MET C C -5.627 5.158 -0.538 1.00 . A A . 9 MET C 1 1 20 17265 1 1 9 MET CA C -6.773 4.839 0.410 1.00 . A A . 9 MET CA 1 1 20 17266 1 1 9 MET CB C -6.275 3.959 1.558 1.00 . A A . 9 MET CB 1 1 20 17267 1 1 9 MET CE C -6.040 4.415 5.661 1.00 . A A . 9 MET CE 1 1 20 17268 1 1 9 MET CG C -6.438 4.595 2.927 1.00 . A A . 9 MET CG 1 1 20 17269 1 1 9 MET H H -7.644 3.371 -0.839 1.00 . A A . 9 MET H 1 1 20 17270 1 1 9 MET HA H -7.161 5.762 0.814 1.00 . A A . 9 MET HA 1 1 20 17271 1 1 9 MET HB2 H -6.825 3.030 1.548 1.00 . A A . 9 MET HB2 1 1 20 17272 1 1 9 MET HB3 H -5.225 3.749 1.405 1.00 . A A . 9 MET HB3 1 1 20 17273 1 1 9 MET HE1 H -6.745 3.639 5.924 1.00 . A A . 9 MET HE1 1 1 20 17274 1 1 9 MET HE2 H -5.300 4.510 6.442 1.00 . A A . 9 MET HE2 1 1 20 17275 1 1 9 MET HE3 H -6.565 5.353 5.546 1.00 . A A . 9 MET HE3 1 1 20 17276 1 1 9 MET HG2 H -6.322 5.664 2.829 1.00 . A A . 9 MET HG2 1 1 20 17277 1 1 9 MET HG3 H -7.430 4.375 3.295 1.00 . A A . 9 MET HG3 1 1 20 17278 1 1 9 MET N N -7.849 4.175 -0.302 1.00 . A A . 9 MET N 1 1 20 17279 1 1 9 MET O O -4.729 4.341 -0.738 1.00 . A A . 9 MET O 1 1 20 17280 1 1 9 MET SD S -5.231 3.989 4.121 1.00 . A A . 9 MET SD 1 1 20 17281 1 1 10 GLU C C -3.413 7.336 -1.247 1.00 . A A . 10 GLU C 1 1 20 17282 1 1 10 GLU CA C -4.609 6.792 -2.027 1.00 . A A . 10 GLU CA 1 1 20 17283 1 1 10 GLU CB C -5.149 7.860 -2.976 1.00 . A A . 10 GLU CB 1 1 20 17284 1 1 10 GLU CD C -5.710 7.723 -5.432 1.00 . A A . 10 GLU CD 1 1 20 17285 1 1 10 GLU CG C -6.097 7.312 -4.028 1.00 . A A . 10 GLU CG 1 1 20 17286 1 1 10 GLU H H -6.407 6.960 -0.915 1.00 . A A . 10 GLU H 1 1 20 17287 1 1 10 GLU HA H -4.290 5.935 -2.604 1.00 . A A . 10 GLU HA 1 1 20 17288 1 1 10 GLU HB2 H -5.680 8.604 -2.397 1.00 . A A . 10 GLU HB2 1 1 20 17289 1 1 10 GLU HB3 H -4.320 8.332 -3.479 1.00 . A A . 10 GLU HB3 1 1 20 17290 1 1 10 GLU HG2 H -6.093 6.233 -3.971 1.00 . A A . 10 GLU HG2 1 1 20 17291 1 1 10 GLU HG3 H -7.093 7.680 -3.823 1.00 . A A . 10 GLU HG3 1 1 20 17292 1 1 10 GLU N N -5.658 6.352 -1.114 1.00 . A A . 10 GLU N 1 1 20 17293 1 1 10 GLU O O -2.808 8.342 -1.623 1.00 . A A . 10 GLU O 1 1 20 17294 1 1 10 GLU OE1 O -5.680 8.940 -5.715 1.00 . A A . 10 GLU OE1 1 1 20 17295 1 1 10 GLU OE2 O -5.433 6.833 -6.262 1.00 . A A . 10 GLU OE2 1 1 20 17296 1 1 11 PHE C C -1.660 5.839 1.620 1.00 . A A . 11 PHE C 1 1 20 17297 1 1 11 PHE CA C -1.964 7.008 0.692 1.00 . A A . 11 PHE CA 1 1 20 17298 1 1 11 PHE CB C -2.263 8.281 1.500 1.00 . A A . 11 PHE CB 1 1 20 17299 1 1 11 PHE CD1 C -4.754 8.479 1.773 1.00 . A A . 11 PHE CD1 1 1 20 17300 1 1 11 PHE CD2 C -3.451 7.868 3.671 1.00 . A A . 11 PHE CD2 1 1 20 17301 1 1 11 PHE CE1 C -5.905 8.411 2.534 1.00 . A A . 11 PHE CE1 1 1 20 17302 1 1 11 PHE CE2 C -4.596 7.799 4.438 1.00 . A A . 11 PHE CE2 1 1 20 17303 1 1 11 PHE CG C -3.516 8.207 2.331 1.00 . A A . 11 PHE CG 1 1 20 17304 1 1 11 PHE CZ C -5.825 8.071 3.870 1.00 . A A . 11 PHE CZ 1 1 20 17305 1 1 11 PHE H H -3.599 5.844 0.058 1.00 . A A . 11 PHE H 1 1 20 17306 1 1 11 PHE HA H -1.105 7.184 0.060 1.00 . A A . 11 PHE HA 1 1 20 17307 1 1 11 PHE HB2 H -1.438 8.474 2.170 1.00 . A A . 11 PHE HB2 1 1 20 17308 1 1 11 PHE HB3 H -2.366 9.112 0.817 1.00 . A A . 11 PHE HB3 1 1 20 17309 1 1 11 PHE HD1 H -4.816 8.748 0.728 1.00 . A A . 11 PHE HD1 1 1 20 17310 1 1 11 PHE HD2 H -2.489 7.659 4.118 1.00 . A A . 11 PHE HD2 1 1 20 17311 1 1 11 PHE HE1 H -6.864 8.623 2.086 1.00 . A A . 11 PHE HE1 1 1 20 17312 1 1 11 PHE HE2 H -4.531 7.534 5.481 1.00 . A A . 11 PHE HE2 1 1 20 17313 1 1 11 PHE HZ H -6.723 8.018 4.470 1.00 . A A . 11 PHE HZ 1 1 20 17314 1 1 11 PHE N N -3.082 6.650 -0.163 1.00 . A A . 11 PHE N 1 1 20 17315 1 1 11 PHE O O -2.420 4.870 1.661 1.00 . A A . 11 PHE O 1 1 20 17316 1 1 12 CYS C C -1.059 4.581 4.306 1.00 . A A . 12 CYS C 1 1 20 17317 1 1 12 CYS CA C -0.091 4.797 3.151 1.00 . A A . 12 CYS CA 1 1 20 17318 1 1 12 CYS CB C 1.296 5.069 3.713 1.00 . A A . 12 CYS CB 1 1 20 17319 1 1 12 CYS H H 0.079 6.662 2.157 1.00 . A A . 12 CYS H 1 1 20 17320 1 1 12 CYS HA H -0.056 3.899 2.553 1.00 . A A . 12 CYS HA 1 1 20 17321 1 1 12 CYS HB2 H 1.333 6.082 4.081 1.00 . A A . 12 CYS HB2 1 1 20 17322 1 1 12 CYS HB3 H 1.485 4.387 4.528 1.00 . A A . 12 CYS HB3 1 1 20 17323 1 1 12 CYS HG H 3.475 5.893 2.694 1.00 . A A . 12 CYS HG 1 1 20 17324 1 1 12 CYS N N -0.517 5.891 2.289 1.00 . A A . 12 CYS N 1 1 20 17325 1 1 12 CYS O O -1.509 5.530 4.941 1.00 . A A . 12 CYS O 1 1 20 17326 1 1 12 CYS SG S 2.624 4.877 2.519 1.00 . A A . 12 CYS SG 1 1 20 17327 1 1 13 ARG C C -1.565 3.333 7.057 1.00 . A A . 13 ARG C 1 1 20 17328 1 1 13 ARG CA C -2.212 2.982 5.714 1.00 . A A . 13 ARG CA 1 1 20 17329 1 1 13 ARG CB C -2.560 1.496 5.675 1.00 . A A . 13 ARG CB 1 1 20 17330 1 1 13 ARG CD C -4.583 0.301 4.785 1.00 . A A . 13 ARG CD 1 1 20 17331 1 1 13 ARG CG C -3.334 1.091 4.433 1.00 . A A . 13 ARG CG 1 1 20 17332 1 1 13 ARG CZ C -6.783 0.463 3.679 1.00 . A A . 13 ARG CZ 1 1 20 17333 1 1 13 ARG H H -0.941 2.609 4.050 1.00 . A A . 13 ARG H 1 1 20 17334 1 1 13 ARG HA H -3.119 3.558 5.607 1.00 . A A . 13 ARG HA 1 1 20 17335 1 1 13 ARG HB2 H -1.645 0.924 5.707 1.00 . A A . 13 ARG HB2 1 1 20 17336 1 1 13 ARG HB3 H -3.157 1.255 6.543 1.00 . A A . 13 ARG HB3 1 1 20 17337 1 1 13 ARG HD2 H -4.290 -0.687 5.114 1.00 . A A . 13 ARG HD2 1 1 20 17338 1 1 13 ARG HD3 H -5.100 0.808 5.584 1.00 . A A . 13 ARG HD3 1 1 20 17339 1 1 13 ARG HE H -5.089 -0.131 2.793 1.00 . A A . 13 ARG HE 1 1 20 17340 1 1 13 ARG HG2 H -3.625 1.982 3.896 1.00 . A A . 13 ARG HG2 1 1 20 17341 1 1 13 ARG HG3 H -2.699 0.483 3.807 1.00 . A A . 13 ARG HG3 1 1 20 17342 1 1 13 ARG HH11 H -6.800 0.916 5.660 1.00 . A A . 13 ARG HH11 1 1 20 17343 1 1 13 ARG HH12 H -8.333 1.074 4.850 1.00 . A A . 13 ARG HH12 1 1 20 17344 1 1 13 ARG HH21 H -7.091 0.054 1.713 1.00 . A A . 13 ARG HH21 1 1 20 17345 1 1 13 ARG HH22 H -8.502 0.561 2.601 1.00 . A A . 13 ARG HH22 1 1 20 17346 1 1 13 ARG N N -1.331 3.324 4.602 1.00 . A A . 13 ARG N 1 1 20 17347 1 1 13 ARG NE N -5.484 0.173 3.641 1.00 . A A . 13 ARG NE 1 1 20 17348 1 1 13 ARG NH1 N -7.350 0.846 4.820 1.00 . A A . 13 ARG NH1 1 1 20 17349 1 1 13 ARG NH2 N -7.517 0.352 2.577 1.00 . A A . 13 ARG NH2 1 1 20 17350 1 1 13 ARG O O -2.251 3.679 8.018 1.00 . A A . 13 ARG O 1 1 20 17351 1 1 14 VAL C C 1.087 4.941 8.309 1.00 . A A . 14 VAL C 1 1 20 17352 1 1 14 VAL CA C 0.501 3.529 8.344 1.00 . A A . 14 VAL CA 1 1 20 17353 1 1 14 VAL CB C 1.652 2.520 8.561 1.00 . A A . 14 VAL CB 1 1 20 17354 1 1 14 VAL CG1 C 1.934 2.331 10.045 1.00 . A A . 14 VAL CG1 1 1 20 17355 1 1 14 VAL CG2 C 1.343 1.185 7.893 1.00 . A A . 14 VAL CG2 1 1 20 17356 1 1 14 VAL H H 0.253 2.959 6.319 1.00 . A A . 14 VAL H 1 1 20 17357 1 1 14 VAL HA H -0.184 3.452 9.176 1.00 . A A . 14 VAL HA 1 1 20 17358 1 1 14 VAL HB H 2.542 2.925 8.102 1.00 . A A . 14 VAL HB 1 1 20 17359 1 1 14 VAL HG11 H 2.297 1.329 10.219 1.00 . A A . 14 VAL HG11 1 1 20 17360 1 1 14 VAL HG12 H 2.680 3.044 10.362 1.00 . A A . 14 VAL HG12 1 1 20 17361 1 1 14 VAL HG13 H 1.026 2.488 10.609 1.00 . A A . 14 VAL HG13 1 1 20 17362 1 1 14 VAL HG21 H 1.554 1.254 6.835 1.00 . A A . 14 VAL HG21 1 1 20 17363 1 1 14 VAL HG22 H 1.956 0.410 8.331 1.00 . A A . 14 VAL HG22 1 1 20 17364 1 1 14 VAL HG23 H 0.299 0.943 8.036 1.00 . A A . 14 VAL HG23 1 1 20 17365 1 1 14 VAL N N -0.239 3.241 7.115 1.00 . A A . 14 VAL N 1 1 20 17366 1 1 14 VAL O O 0.659 5.829 9.044 1.00 . A A . 14 VAL O 1 1 20 17367 1 1 15 CYS C C 1.969 7.444 6.446 1.00 . A A . 15 CYS C 1 1 20 17368 1 1 15 CYS CA C 2.753 6.395 7.242 1.00 . A A . 15 CYS CA 1 1 20 17369 1 1 15 CYS CB C 4.120 6.064 6.640 1.00 . A A . 15 CYS CB 1 1 20 17370 1 1 15 CYS H H 2.350 4.364 6.883 1.00 . A A . 15 CYS H 1 1 20 17371 1 1 15 CYS HA H 2.924 6.799 8.226 1.00 . A A . 15 CYS HA 1 1 20 17372 1 1 15 CYS HB2 H 4.320 6.733 5.819 1.00 . A A . 15 CYS HB2 1 1 20 17373 1 1 15 CYS HB3 H 4.886 6.173 7.393 1.00 . A A . 15 CYS HB3 1 1 20 17374 1 1 15 CYS N N 2.053 5.129 7.422 1.00 . A A . 15 CYS N 1 1 20 17375 1 1 15 CYS O O 2.431 8.576 6.319 1.00 . A A . 15 CYS O 1 1 20 17376 1 1 15 CYS SG S 4.182 4.349 6.016 1.00 . A A . 15 CYS SG 1 1 20 17377 1 1 16 LYS C C 0.326 9.066 4.598 1.00 . A A . 16 LYS C 1 1 20 17378 1 1 16 LYS CA C -0.278 8.095 5.616 1.00 . A A . 16 LYS CA 1 1 20 17379 1 1 16 LYS CB C -0.911 8.893 6.760 1.00 . A A . 16 LYS CB 1 1 20 17380 1 1 16 LYS CD C -3.131 8.655 7.911 1.00 . A A . 16 LYS CD 1 1 20 17381 1 1 16 LYS CE C -3.684 8.356 9.297 1.00 . A A . 16 LYS CE 1 1 20 17382 1 1 16 LYS CG C -1.748 8.053 7.713 1.00 . A A . 16 LYS CG 1 1 20 17383 1 1 16 LYS H H 0.362 6.267 6.475 1.00 . A A . 16 LYS H 1 1 20 17384 1 1 16 LYS HA H -1.054 7.528 5.125 1.00 . A A . 16 LYS HA 1 1 20 17385 1 1 16 LYS HB2 H -0.124 9.362 7.332 1.00 . A A . 16 LYS HB2 1 1 20 17386 1 1 16 LYS HB3 H -1.544 9.660 6.340 1.00 . A A . 16 LYS HB3 1 1 20 17387 1 1 16 LYS HD2 H -3.067 9.726 7.787 1.00 . A A . 16 LYS HD2 1 1 20 17388 1 1 16 LYS HD3 H -3.801 8.245 7.171 1.00 . A A . 16 LYS HD3 1 1 20 17389 1 1 16 LYS HE2 H -2.947 7.796 9.851 1.00 . A A . 16 LYS HE2 1 1 20 17390 1 1 16 LYS HE3 H -3.882 9.291 9.802 1.00 . A A . 16 LYS HE3 1 1 20 17391 1 1 16 LYS HG2 H -1.854 7.057 7.306 1.00 . A A . 16 LYS HG2 1 1 20 17392 1 1 16 LYS HG3 H -1.246 8.003 8.668 1.00 . A A . 16 LYS HG3 1 1 20 17393 1 1 16 LYS HZ1 H -5.471 7.800 8.357 1.00 . A A . 16 LYS HZ1 1 1 20 17394 1 1 16 LYS HZ2 H -5.549 7.776 10.049 1.00 . A A . 16 LYS HZ2 1 1 20 17395 1 1 16 LYS HZ3 H -4.730 6.545 9.228 1.00 . A A . 16 LYS HZ3 1 1 20 17396 1 1 16 LYS N N 0.699 7.131 6.160 1.00 . A A . 16 LYS N 1 1 20 17397 1 1 16 LYS NZ N -4.944 7.566 9.229 1.00 . A A . 16 LYS NZ 1 1 20 17398 1 1 16 LYS O O 0.015 10.257 4.610 1.00 . A A . 16 LYS O 1 1 20 17399 1 1 17 ASP C C 1.678 9.141 1.440 1.00 . A A . 17 ASP C 1 1 20 17400 1 1 17 ASP CA C 1.994 9.451 2.892 1.00 . A A . 17 ASP CA 1 1 20 17401 1 1 17 ASP CB C 3.495 9.297 3.129 1.00 . A A . 17 ASP CB 1 1 20 17402 1 1 17 ASP CG C 3.983 7.903 2.818 1.00 . A A . 17 ASP CG 1 1 20 17403 1 1 17 ASP H H 1.538 7.651 3.897 1.00 . A A . 17 ASP H 1 1 20 17404 1 1 17 ASP HA H 1.708 10.468 3.103 1.00 . A A . 17 ASP HA 1 1 20 17405 1 1 17 ASP HB2 H 4.024 9.983 2.494 1.00 . A A . 17 ASP HB2 1 1 20 17406 1 1 17 ASP HB3 H 3.718 9.519 4.162 1.00 . A A . 17 ASP HB3 1 1 20 17407 1 1 17 ASP N N 1.258 8.584 3.798 1.00 . A A . 17 ASP N 1 1 20 17408 1 1 17 ASP O O 1.030 8.138 1.139 1.00 . A A . 17 ASP O 1 1 20 17409 1 1 17 ASP OD1 O 3.844 7.012 3.683 1.00 . A A . 17 ASP OD1 1 1 20 17410 1 1 17 ASP OD2 O 4.510 7.684 1.710 1.00 . A A . 17 ASP OD2 1 1 20 17411 1 1 18 GLY C C 3.335 9.983 -1.625 1.00 . A A . 18 GLY C 1 1 20 17412 1 1 18 GLY CA C 2.033 9.771 -0.874 1.00 . A A . 18 GLY CA 1 1 20 17413 1 1 18 GLY H H 2.748 10.727 0.866 1.00 . A A . 18 GLY H 1 1 20 17414 1 1 18 GLY HA2 H 1.688 8.759 -1.044 1.00 . A A . 18 GLY HA2 1 1 20 17415 1 1 18 GLY HA3 H 1.294 10.468 -1.248 1.00 . A A . 18 GLY HA3 1 1 20 17416 1 1 18 GLY N N 2.198 9.978 0.550 1.00 . A A . 18 GLY N 1 1 20 17417 1 1 18 GLY O O 4.409 9.976 -1.020 1.00 . A A . 18 GLY O 1 1 20 17418 1 1 19 GLY C C 4.914 9.144 -4.387 1.00 . A A . 19 GLY C 1 1 20 17419 1 1 19 GLY CA C 4.431 10.420 -3.733 1.00 . A A . 19 GLY CA 1 1 20 17420 1 1 19 GLY H H 2.356 10.213 -3.357 1.00 . A A . 19 GLY H 1 1 20 17421 1 1 19 GLY HA2 H 4.207 11.146 -4.500 1.00 . A A . 19 GLY HA2 1 1 20 17422 1 1 19 GLY HA3 H 5.215 10.806 -3.100 1.00 . A A . 19 GLY HA3 1 1 20 17423 1 1 19 GLY N N 3.243 10.199 -2.930 1.00 . A A . 19 GLY N 1 1 20 17424 1 1 19 GLY O O 4.250 8.609 -5.277 1.00 . A A . 19 GLY O 1 1 20 17425 1 1 20 GLU C C 5.667 6.184 -3.712 1.00 . A A . 20 GLU C 1 1 20 17426 1 1 20 GLU CA C 6.499 7.303 -4.328 1.00 . A A . 20 GLU CA 1 1 20 17427 1 1 20 GLU CB C 7.977 7.133 -3.962 1.00 . A A . 20 GLU CB 1 1 20 17428 1 1 20 GLU CD C 9.028 7.374 -6.245 1.00 . A A . 20 GLU CD 1 1 20 17429 1 1 20 GLU CG C 8.802 6.467 -5.053 1.00 . A A . 20 GLU CG 1 1 20 17430 1 1 20 GLU H H 6.432 9.019 -3.089 1.00 . A A . 20 GLU H 1 1 20 17431 1 1 20 GLU HA H 6.392 7.270 -5.403 1.00 . A A . 20 GLU HA 1 1 20 17432 1 1 20 GLU HB2 H 8.401 8.105 -3.762 1.00 . A A . 20 GLU HB2 1 1 20 17433 1 1 20 GLU HB3 H 8.047 6.529 -3.070 1.00 . A A . 20 GLU HB3 1 1 20 17434 1 1 20 GLU HG2 H 9.763 6.192 -4.642 1.00 . A A . 20 GLU HG2 1 1 20 17435 1 1 20 GLU HG3 H 8.285 5.580 -5.386 1.00 . A A . 20 GLU HG3 1 1 20 17436 1 1 20 GLU N N 6.000 8.589 -3.865 1.00 . A A . 20 GLU N 1 1 20 17437 1 1 20 GLU O O 6.078 5.541 -2.743 1.00 . A A . 20 GLU O 1 1 20 17438 1 1 20 GLU OE1 O 9.793 8.352 -6.116 1.00 . A A . 20 GLU OE1 1 1 20 17439 1 1 20 GLU OE2 O 8.434 7.119 -7.315 1.00 . A A . 20 GLU OE2 1 1 20 17440 1 1 21 LEU C C 3.175 4.007 -4.521 1.00 . A A . 21 LEU C 1 1 20 17441 1 1 21 LEU CA C 3.473 5.168 -3.588 1.00 . A A . 21 LEU CA 1 1 20 17442 1 1 21 LEU CB C 2.184 5.923 -3.272 1.00 . A A . 21 LEU CB 1 1 20 17443 1 1 21 LEU CD1 C 2.769 6.094 -0.838 1.00 . A A . 21 LEU CD1 1 1 20 17444 1 1 21 LEU CD2 C 0.481 6.688 -1.620 1.00 . A A . 21 LEU CD2 1 1 20 17445 1 1 21 LEU CG C 1.672 5.779 -1.841 1.00 . A A . 21 LEU CG 1 1 20 17446 1 1 21 LEU H H 4.135 6.700 -4.872 1.00 . A A . 21 LEU H 1 1 20 17447 1 1 21 LEU HA H 3.891 4.783 -2.669 1.00 . A A . 21 LEU HA 1 1 20 17448 1 1 21 LEU HB2 H 2.351 6.973 -3.468 1.00 . A A . 21 LEU HB2 1 1 20 17449 1 1 21 LEU HB3 H 1.412 5.570 -3.942 1.00 . A A . 21 LEU HB3 1 1 20 17450 1 1 21 LEU HD11 H 3.696 5.652 -1.170 1.00 . A A . 21 LEU HD11 1 1 20 17451 1 1 21 LEU HD12 H 2.886 7.165 -0.757 1.00 . A A . 21 LEU HD12 1 1 20 17452 1 1 21 LEU HD13 H 2.500 5.687 0.129 1.00 . A A . 21 LEU HD13 1 1 20 17453 1 1 21 LEU HD21 H 0.806 7.597 -1.135 1.00 . A A . 21 LEU HD21 1 1 20 17454 1 1 21 LEU HD22 H 0.032 6.929 -2.573 1.00 . A A . 21 LEU HD22 1 1 20 17455 1 1 21 LEU HD23 H -0.243 6.185 -0.998 1.00 . A A . 21 LEU HD23 1 1 20 17456 1 1 21 LEU HG H 1.353 4.760 -1.678 1.00 . A A . 21 LEU HG 1 1 20 17457 1 1 21 LEU N N 4.435 6.076 -4.175 1.00 . A A . 21 LEU N 1 1 20 17458 1 1 21 LEU O O 3.066 4.182 -5.736 1.00 . A A . 21 LEU O 1 1 20 17459 1 1 22 LEU C C 1.230 1.210 -4.323 1.00 . A A . 22 LEU C 1 1 20 17460 1 1 22 LEU CA C 2.639 1.650 -4.690 1.00 . A A . 22 LEU CA 1 1 20 17461 1 1 22 LEU CB C 3.630 0.520 -4.421 1.00 . A A . 22 LEU CB 1 1 20 17462 1 1 22 LEU CD1 C 5.963 0.208 -5.269 1.00 . A A . 22 LEU CD1 1 1 20 17463 1 1 22 LEU CD2 C 4.130 -1.275 -6.094 1.00 . A A . 22 LEU CD2 1 1 20 17464 1 1 22 LEU CG C 4.490 0.124 -5.622 1.00 . A A . 22 LEU CG 1 1 20 17465 1 1 22 LEU H H 3.074 2.773 -2.958 1.00 . A A . 22 LEU H 1 1 20 17466 1 1 22 LEU HA H 2.665 1.901 -5.740 1.00 . A A . 22 LEU HA 1 1 20 17467 1 1 22 LEU HB2 H 4.286 0.827 -3.618 1.00 . A A . 22 LEU HB2 1 1 20 17468 1 1 22 LEU HB3 H 3.078 -0.350 -4.100 1.00 . A A . 22 LEU HB3 1 1 20 17469 1 1 22 LEU HD11 H 6.369 1.139 -5.639 1.00 . A A . 22 LEU HD11 1 1 20 17470 1 1 22 LEU HD12 H 6.077 0.164 -4.197 1.00 . A A . 22 LEU HD12 1 1 20 17471 1 1 22 LEU HD13 H 6.488 -0.620 -5.723 1.00 . A A . 22 LEU HD13 1 1 20 17472 1 1 22 LEU HD21 H 4.204 -1.963 -5.265 1.00 . A A . 22 LEU HD21 1 1 20 17473 1 1 22 LEU HD22 H 3.121 -1.279 -6.477 1.00 . A A . 22 LEU HD22 1 1 20 17474 1 1 22 LEU HD23 H 4.813 -1.579 -6.874 1.00 . A A . 22 LEU HD23 1 1 20 17475 1 1 22 LEU HG H 4.303 0.812 -6.434 1.00 . A A . 22 LEU HG 1 1 20 17476 1 1 22 LEU N N 3.000 2.834 -3.937 1.00 . A A . 22 LEU N 1 1 20 17477 1 1 22 LEU O O 0.850 1.239 -3.152 1.00 . A A . 22 LEU O 1 1 20 17478 1 1 23 CYS C C -1.151 -0.938 -5.731 1.00 . A A . 23 CYS C 1 1 20 17479 1 1 23 CYS CA C -0.930 0.443 -5.126 1.00 . A A . 23 CYS CA 1 1 20 17480 1 1 23 CYS CB C -1.885 1.456 -5.757 1.00 . A A . 23 CYS CB 1 1 20 17481 1 1 23 CYS H H 0.800 0.899 -6.243 1.00 . A A . 23 CYS H 1 1 20 17482 1 1 23 CYS HA H -1.114 0.396 -4.061 1.00 . A A . 23 CYS HA 1 1 20 17483 1 1 23 CYS HB2 H -2.246 1.064 -6.696 1.00 . A A . 23 CYS HB2 1 1 20 17484 1 1 23 CYS HB3 H -2.722 1.612 -5.093 1.00 . A A . 23 CYS HB3 1 1 20 17485 1 1 23 CYS HG H -2.084 3.992 -5.955 1.00 . A A . 23 CYS HG 1 1 20 17486 1 1 23 CYS N N 0.448 0.859 -5.330 1.00 . A A . 23 CYS N 1 1 20 17487 1 1 23 CYS O O -0.576 -1.263 -6.777 1.00 . A A . 23 CYS O 1 1 20 17488 1 1 23 CYS SG S -1.138 3.071 -6.087 1.00 . A A . 23 CYS SG 1 1 20 17489 1 1 24 CYS C C -3.014 -3.171 -6.752 1.00 . A A . 24 CYS C 1 1 20 17490 1 1 24 CYS CA C -2.180 -3.126 -5.478 1.00 . A A . 24 CYS CA 1 1 20 17491 1 1 24 CYS CB C -2.905 -3.858 -4.358 1.00 . A A . 24 CYS CB 1 1 20 17492 1 1 24 CYS H H -2.325 -1.460 -4.200 1.00 . A A . 24 CYS H 1 1 20 17493 1 1 24 CYS HA H -1.229 -3.606 -5.659 1.00 . A A . 24 CYS HA 1 1 20 17494 1 1 24 CYS HB2 H -3.797 -4.326 -4.751 1.00 . A A . 24 CYS HB2 1 1 20 17495 1 1 24 CYS HB3 H -2.254 -4.610 -3.938 1.00 . A A . 24 CYS HB3 1 1 20 17496 1 1 24 CYS N N -1.929 -1.762 -5.048 1.00 . A A . 24 CYS N 1 1 20 17497 1 1 24 CYS O O -3.643 -2.187 -7.145 1.00 . A A . 24 CYS O 1 1 20 17498 1 1 24 CYS SG S -3.400 -2.739 -3.017 1.00 . A A . 24 CYS SG 1 1 20 17499 1 1 25 ASP C C -5.312 -5.027 -8.052 1.00 . A A . 25 ASP C 1 1 20 17500 1 1 25 ASP CA C -3.930 -4.582 -8.498 1.00 . A A . 25 ASP CA 1 1 20 17501 1 1 25 ASP CB C -3.317 -5.662 -9.392 1.00 . A A . 25 ASP CB 1 1 20 17502 1 1 25 ASP CG C -3.842 -5.619 -10.817 1.00 . A A . 25 ASP CG 1 1 20 17503 1 1 25 ASP H H -2.611 -5.110 -6.932 1.00 . A A . 25 ASP H 1 1 20 17504 1 1 25 ASP HA H -4.011 -3.659 -9.050 1.00 . A A . 25 ASP HA 1 1 20 17505 1 1 25 ASP HB2 H -2.250 -5.536 -9.418 1.00 . A A . 25 ASP HB2 1 1 20 17506 1 1 25 ASP HB3 H -3.547 -6.633 -8.977 1.00 . A A . 25 ASP HB3 1 1 20 17507 1 1 25 ASP N N -3.090 -4.353 -7.334 1.00 . A A . 25 ASP N 1 1 20 17508 1 1 25 ASP O O -6.203 -5.250 -8.872 1.00 . A A . 25 ASP O 1 1 20 17509 1 1 25 ASP OD1 O -3.769 -4.549 -11.458 1.00 . A A . 25 ASP OD1 1 1 20 17510 1 1 25 ASP OD2 O -4.328 -6.662 -11.306 1.00 . A A . 25 ASP OD2 1 1 20 17511 1 1 26 THR C C -7.481 -5.028 -5.417 1.00 . A A . 26 THR C 1 1 20 17512 1 1 26 THR CA C -6.609 -5.970 -6.248 1.00 . A A . 26 THR CA 1 1 20 17513 1 1 26 THR CB C -6.201 -7.188 -5.413 1.00 . A A . 26 THR CB 1 1 20 17514 1 1 26 THR CG2 C -6.194 -8.442 -6.271 1.00 . A A . 26 THR CG2 1 1 20 17515 1 1 26 THR H H -4.631 -5.256 -6.192 1.00 . A A . 26 THR H 1 1 20 17516 1 1 26 THR HA H -7.187 -6.322 -7.088 1.00 . A A . 26 THR HA 1 1 20 17517 1 1 26 THR HB H -6.905 -7.317 -4.603 1.00 . A A . 26 THR HB 1 1 20 17518 1 1 26 THR HG1 H -4.952 -6.697 -3.949 1.00 . A A . 26 THR HG1 1 1 20 17519 1 1 26 THR HG21 H -7.179 -8.603 -6.681 1.00 . A A . 26 THR HG21 1 1 20 17520 1 1 26 THR HG22 H -5.911 -9.291 -5.666 1.00 . A A . 26 THR HG22 1 1 20 17521 1 1 26 THR HG23 H -5.482 -8.318 -7.078 1.00 . A A . 26 THR HG23 1 1 20 17522 1 1 26 THR N N -5.423 -5.327 -6.769 1.00 . A A . 26 THR N 1 1 20 17523 1 1 26 THR O O -8.710 -5.100 -5.487 1.00 . A A . 26 THR O 1 1 20 17524 1 1 26 THR OG1 O -4.886 -6.978 -4.880 1.00 . A A . 26 THR OG1 1 1 20 17525 1 1 27 CYS C C -7.035 -1.794 -3.912 1.00 . A A . 27 CYS C 1 1 20 17526 1 1 27 CYS CA C -7.637 -3.196 -3.847 1.00 . A A . 27 CYS CA 1 1 20 17527 1 1 27 CYS CB C -7.760 -3.705 -2.400 1.00 . A A . 27 CYS CB 1 1 20 17528 1 1 27 CYS H H -5.888 -4.084 -4.644 1.00 . A A . 27 CYS H 1 1 20 17529 1 1 27 CYS HA H -8.625 -3.151 -4.278 1.00 . A A . 27 CYS HA 1 1 20 17530 1 1 27 CYS HB2 H -8.759 -3.506 -2.048 1.00 . A A . 27 CYS HB2 1 1 20 17531 1 1 27 CYS HB3 H -7.597 -4.771 -2.397 1.00 . A A . 27 CYS HB3 1 1 20 17532 1 1 27 CYS N N -6.867 -4.133 -4.650 1.00 . A A . 27 CYS N 1 1 20 17533 1 1 27 CYS O O -5.901 -1.614 -4.357 1.00 . A A . 27 CYS O 1 1 20 17534 1 1 27 CYS SG S -6.611 -2.973 -1.187 1.00 . A A . 27 CYS SG 1 1 20 17535 1 1 28 PRO C C -6.712 1.158 -2.544 1.00 . A A . 28 PRO C 1 1 20 17536 1 1 28 PRO CA C -7.438 0.625 -3.777 1.00 . A A . 28 PRO CA 1 1 20 17537 1 1 28 PRO CB C -8.764 1.349 -3.981 1.00 . A A . 28 PRO CB 1 1 20 17538 1 1 28 PRO CD C -9.282 -0.892 -3.310 1.00 . A A . 28 PRO CD 1 1 20 17539 1 1 28 PRO CG C -9.761 0.532 -3.235 1.00 . A A . 28 PRO CG 1 1 20 17540 1 1 28 PRO HA H -6.814 0.766 -4.647 1.00 . A A . 28 PRO HA 1 1 20 17541 1 1 28 PRO HB2 H -8.695 2.352 -3.584 1.00 . A A . 28 PRO HB2 1 1 20 17542 1 1 28 PRO HB3 H -8.997 1.389 -5.035 1.00 . A A . 28 PRO HB3 1 1 20 17543 1 1 28 PRO HD2 H -9.418 -1.388 -2.358 1.00 . A A . 28 PRO HD2 1 1 20 17544 1 1 28 PRO HD3 H -9.808 -1.425 -4.089 1.00 . A A . 28 PRO HD3 1 1 20 17545 1 1 28 PRO HG2 H -9.807 0.858 -2.207 1.00 . A A . 28 PRO HG2 1 1 20 17546 1 1 28 PRO HG3 H -10.731 0.625 -3.701 1.00 . A A . 28 PRO HG3 1 1 20 17547 1 1 28 PRO N N -7.850 -0.771 -3.636 1.00 . A A . 28 PRO N 1 1 20 17548 1 1 28 PRO O O -7.122 2.157 -1.950 1.00 . A A . 28 PRO O 1 1 20 17549 1 1 29 SER C C -3.368 1.329 -1.623 1.00 . A A . 29 SER C 1 1 20 17550 1 1 29 SER CA C -4.764 0.986 -1.103 1.00 . A A . 29 SER CA 1 1 20 17551 1 1 29 SER CB C -4.689 -0.085 -0.016 1.00 . A A . 29 SER CB 1 1 20 17552 1 1 29 SER H H -5.299 -0.238 -2.740 1.00 . A A . 29 SER H 1 1 20 17553 1 1 29 SER HA H -5.214 1.877 -0.692 1.00 . A A . 29 SER HA 1 1 20 17554 1 1 29 SER HB2 H -4.138 -0.937 -0.388 1.00 . A A . 29 SER HB2 1 1 20 17555 1 1 29 SER HB3 H -4.186 0.319 0.850 1.00 . A A . 29 SER HB3 1 1 20 17556 1 1 29 SER HG H -6.293 -1.211 -0.242 1.00 . A A . 29 SER HG 1 1 20 17557 1 1 29 SER N N -5.599 0.527 -2.202 1.00 . A A . 29 SER N 1 1 20 17558 1 1 29 SER O O -3.058 1.066 -2.785 1.00 . A A . 29 SER O 1 1 20 17559 1 1 29 SER OG O -5.988 -0.516 0.372 1.00 . A A . 29 SER OG 1 1 20 17560 1 1 30 SER C C -0.225 2.442 -0.111 1.00 . A A . 30 SER C 1 1 20 17561 1 1 30 SER CA C -1.242 2.444 -1.253 1.00 . A A . 30 SER CA 1 1 20 17562 1 1 30 SER CB C -1.330 3.840 -1.873 1.00 . A A . 30 SER CB 1 1 20 17563 1 1 30 SER H H -2.880 2.274 0.078 1.00 . A A . 30 SER H 1 1 20 17564 1 1 30 SER HA H -0.905 1.751 -2.004 1.00 . A A . 30 SER HA 1 1 20 17565 1 1 30 SER HB2 H -1.573 4.557 -1.104 1.00 . A A . 30 SER HB2 1 1 20 17566 1 1 30 SER HB3 H -0.376 4.095 -2.314 1.00 . A A . 30 SER HB3 1 1 20 17567 1 1 30 SER HG H -2.631 2.996 -3.072 1.00 . A A . 30 SER HG 1 1 20 17568 1 1 30 SER N N -2.561 2.008 -0.811 1.00 . A A . 30 SER N 1 1 20 17569 1 1 30 SER O O -0.588 2.587 1.059 1.00 . A A . 30 SER O 1 1 20 17570 1 1 30 SER OG O -2.328 3.895 -2.880 1.00 . A A . 30 SER OG 1 1 20 17571 1 1 31 TYR C C 3.431 2.703 -0.068 1.00 . A A . 31 TYR C 1 1 20 17572 1 1 31 TYR CA C 2.126 2.148 0.519 1.00 . A A . 31 TYR CA 1 1 20 17573 1 1 31 TYR CB C 2.363 0.692 0.952 1.00 . A A . 31 TYR CB 1 1 20 17574 1 1 31 TYR CD1 C 1.217 0.189 3.151 1.00 . A A . 31 TYR CD1 1 1 20 17575 1 1 31 TYR CD2 C 0.235 -0.654 1.153 1.00 . A A . 31 TYR CD2 1 1 20 17576 1 1 31 TYR CE1 C 0.213 -0.393 3.896 1.00 . A A . 31 TYR CE1 1 1 20 17577 1 1 31 TYR CE2 C -0.771 -1.244 1.893 1.00 . A A . 31 TYR CE2 1 1 20 17578 1 1 31 TYR CG C 1.246 0.072 1.768 1.00 . A A . 31 TYR CG 1 1 20 17579 1 1 31 TYR CZ C -0.777 -1.111 3.263 1.00 . A A . 31 TYR CZ 1 1 20 17580 1 1 31 TYR H H 1.251 2.058 -1.410 1.00 . A A . 31 TYR H 1 1 20 17581 1 1 31 TYR HA H 1.845 2.737 1.380 1.00 . A A . 31 TYR HA 1 1 20 17582 1 1 31 TYR HB2 H 2.497 0.084 0.071 1.00 . A A . 31 TYR HB2 1 1 20 17583 1 1 31 TYR HB3 H 3.264 0.650 1.547 1.00 . A A . 31 TYR HB3 1 1 20 17584 1 1 31 TYR HD1 H 1.994 0.753 3.649 1.00 . A A . 31 TYR HD1 1 1 20 17585 1 1 31 TYR HD2 H 0.239 -0.754 0.077 1.00 . A A . 31 TYR HD2 1 1 20 17586 1 1 31 TYR HE1 H 0.208 -0.287 4.971 1.00 . A A . 31 TYR HE1 1 1 20 17587 1 1 31 TYR HE2 H -1.550 -1.801 1.395 1.00 . A A . 31 TYR HE2 1 1 20 17588 1 1 31 TYR HH H -2.570 -1.797 3.456 1.00 . A A . 31 TYR HH 1 1 20 17589 1 1 31 TYR N N 1.043 2.219 -0.460 1.00 . A A . 31 TYR N 1 1 20 17590 1 1 31 TYR O O 3.514 2.956 -1.267 1.00 . A A . 31 TYR O 1 1 20 17591 1 1 31 TYR OH O -1.770 -1.709 4.003 1.00 . A A . 31 TYR OH 1 1 20 17592 1 1 32 HIS C C 6.320 1.564 -0.379 1.00 . A A . 32 HIS C 1 1 20 17593 1 1 32 HIS CA C 5.865 2.863 0.286 1.00 . A A . 32 HIS CA 1 1 20 17594 1 1 32 HIS CB C 6.816 3.129 1.480 1.00 . A A . 32 HIS CB 1 1 20 17595 1 1 32 HIS CD2 C 7.935 5.434 1.765 1.00 . A A . 32 HIS CD2 1 1 20 17596 1 1 32 HIS CE1 C 6.610 6.203 3.319 1.00 . A A . 32 HIS CE1 1 1 20 17597 1 1 32 HIS CG C 6.945 4.537 1.990 1.00 . A A . 32 HIS CG 1 1 20 17598 1 1 32 HIS H H 4.364 2.233 1.630 1.00 . A A . 32 HIS H 1 1 20 17599 1 1 32 HIS HA H 5.893 3.683 -0.416 1.00 . A A . 32 HIS HA 1 1 20 17600 1 1 32 HIS HB2 H 6.489 2.526 2.312 1.00 . A A . 32 HIS HB2 1 1 20 17601 1 1 32 HIS HB3 H 7.806 2.804 1.195 1.00 . A A . 32 HIS HB3 1 1 20 17602 1 1 32 HIS HD2 H 8.740 5.341 1.051 1.00 . A A . 32 HIS HD2 1 1 20 17603 1 1 32 HIS HE1 H 6.181 6.847 4.072 1.00 . A A . 32 HIS HE1 1 1 20 17604 1 1 32 HIS HE2 H 8.368 7.207 2.822 1.00 . A A . 32 HIS HE2 1 1 20 17605 1 1 32 HIS N N 4.489 2.647 0.743 1.00 . A A . 32 HIS N 1 1 20 17606 1 1 32 HIS ND1 N 6.110 5.037 2.965 1.00 . A A . 32 HIS ND1 1 1 20 17607 1 1 32 HIS NE2 N 7.720 6.489 2.617 1.00 . A A . 32 HIS NE2 1 1 20 17608 1 1 32 HIS O O 5.646 1.035 -1.260 1.00 . A A . 32 HIS O 1 1 20 17609 1 1 33 ILE C C 8.064 -1.214 1.112 1.00 . A A . 33 ILE C 1 1 20 17610 1 1 33 ILE CA C 7.759 -0.401 -0.151 1.00 . A A . 33 ILE CA 1 1 20 17611 1 1 33 ILE CB C 9.003 -0.390 -1.077 1.00 . A A . 33 ILE CB 1 1 20 17612 1 1 33 ILE CD1 C 11.545 -0.291 -0.972 1.00 . A A . 33 ILE CD1 1 1 20 17613 1 1 33 ILE CG1 C 10.239 0.130 -0.335 1.00 . A A . 33 ILE CG1 1 1 20 17614 1 1 33 ILE CG2 C 8.740 0.454 -2.316 1.00 . A A . 33 ILE CG2 1 1 20 17615 1 1 33 ILE H H 7.778 1.378 0.975 1.00 . A A . 33 ILE H 1 1 20 17616 1 1 33 ILE HA H 6.943 -0.873 -0.680 1.00 . A A . 33 ILE HA 1 1 20 17617 1 1 33 ILE HB H 9.187 -1.403 -1.399 1.00 . A A . 33 ILE HB 1 1 20 17618 1 1 33 ILE HD11 H 12.213 -0.663 -0.209 1.00 . A A . 33 ILE HD11 1 1 20 17619 1 1 33 ILE HD12 H 11.360 -1.068 -1.699 1.00 . A A . 33 ILE HD12 1 1 20 17620 1 1 33 ILE HD13 H 11.998 0.560 -1.461 1.00 . A A . 33 ILE HD13 1 1 20 17621 1 1 33 ILE HG12 H 10.213 1.210 -0.316 1.00 . A A . 33 ILE HG12 1 1 20 17622 1 1 33 ILE HG21 H 8.152 -0.116 -3.021 1.00 . A A . 33 ILE HG21 1 1 20 17623 1 1 33 ILE HG22 H 8.197 1.345 -2.035 1.00 . A A . 33 ILE HG22 1 1 20 17624 1 1 33 ILE HG23 H 9.678 0.732 -2.771 1.00 . A A . 33 ILE HG23 1 1 20 17625 1 1 33 ILE N N 7.344 0.946 0.213 1.00 . A A . 33 ILE N 1 1 20 17626 1 1 33 ILE O O 8.760 -2.231 1.056 1.00 . A A . 33 ILE O 1 1 20 17627 1 1 34 HIS C C 7.021 -0.920 4.680 1.00 . A A . 34 HIS C 1 1 20 17628 1 1 34 HIS CA C 7.964 -1.336 3.549 1.00 . A A . 34 HIS CA 1 1 20 17629 1 1 34 HIS CB C 9.408 -0.976 3.925 1.00 . A A . 34 HIS CB 1 1 20 17630 1 1 34 HIS CD2 C 9.901 1.310 5.017 1.00 . A A . 34 HIS CD2 1 1 20 17631 1 1 34 HIS CE1 C 10.076 2.468 3.180 1.00 . A A . 34 HIS CE1 1 1 20 17632 1 1 34 HIS CG C 9.697 0.497 3.955 1.00 . A A . 34 HIS CG 1 1 20 17633 1 1 34 HIS H H 7.119 0.128 2.271 1.00 . A A . 34 HIS H 1 1 20 17634 1 1 34 HIS HA H 7.898 -2.406 3.423 1.00 . A A . 34 HIS HA 1 1 20 17635 1 1 34 HIS HB2 H 9.623 -1.371 4.905 1.00 . A A . 34 HIS HB2 1 1 20 17636 1 1 34 HIS HB3 H 10.079 -1.430 3.208 1.00 . A A . 34 HIS HB3 1 1 20 17637 1 1 34 HIS HD2 H 9.875 1.032 6.059 1.00 . A A . 34 HIS HD2 1 1 20 17638 1 1 34 HIS HE1 H 10.217 3.296 2.504 1.00 . A A . 34 HIS HE1 1 1 20 17639 1 1 34 HIS HE2 H 10.196 3.397 5.038 1.00 . A A . 34 HIS HE2 1 1 20 17640 1 1 34 HIS N N 7.613 -0.717 2.270 1.00 . A A . 34 HIS N 1 1 20 17641 1 1 34 HIS ND1 N 9.809 1.233 2.799 1.00 . A A . 34 HIS ND1 1 1 20 17642 1 1 34 HIS NE2 N 10.143 2.562 4.515 1.00 . A A . 34 HIS NE2 1 1 20 17643 1 1 34 HIS O O 7.402 -0.943 5.853 1.00 . A A . 34 HIS O 1 1 20 17644 1 1 35 CYS C C 4.028 -1.242 5.848 1.00 . A A . 35 CYS C 1 1 20 17645 1 1 35 CYS CA C 4.854 -0.061 5.346 1.00 . A A . 35 CYS CA 1 1 20 17646 1 1 35 CYS CB C 3.935 0.973 4.716 1.00 . A A . 35 CYS CB 1 1 20 17647 1 1 35 CYS H H 5.562 -0.463 3.395 1.00 . A A . 35 CYS H 1 1 20 17648 1 1 35 CYS HA H 5.396 0.383 6.168 1.00 . A A . 35 CYS HA 1 1 20 17649 1 1 35 CYS HB2 H 3.048 0.483 4.338 1.00 . A A . 35 CYS HB2 1 1 20 17650 1 1 35 CYS HB3 H 3.652 1.702 5.461 1.00 . A A . 35 CYS HB3 1 1 20 17651 1 1 35 CYS N N 5.808 -0.513 4.341 1.00 . A A . 35 CYS N 1 1 20 17652 1 1 35 CYS O O 3.365 -1.174 6.881 1.00 . A A . 35 CYS O 1 1 20 17653 1 1 35 CYS SG S 4.716 1.860 3.339 1.00 . A A . 35 CYS SG 1 1 20 17654 1 1 36 LEU C C 4.048 -4.560 5.977 1.00 . A A . 36 LEU C 1 1 20 17655 1 1 36 LEU CA C 3.205 -3.467 5.317 1.00 . A A . 36 LEU CA 1 1 20 17656 1 1 36 LEU CB C 2.576 -3.954 3.998 1.00 . A A . 36 LEU CB 1 1 20 17657 1 1 36 LEU CD1 C 3.134 -5.662 2.240 1.00 . A A . 36 LEU CD1 1 1 20 17658 1 1 36 LEU CD2 C 3.720 -3.266 1.878 1.00 . A A . 36 LEU CD2 1 1 20 17659 1 1 36 LEU CG C 3.573 -4.370 2.910 1.00 . A A . 36 LEU CG 1 1 20 17660 1 1 36 LEU H H 4.534 -2.254 4.221 1.00 . A A . 36 LEU H 1 1 20 17661 1 1 36 LEU HA H 2.418 -3.192 5.994 1.00 . A A . 36 LEU HA 1 1 20 17662 1 1 36 LEU HB2 H 1.928 -4.790 4.212 1.00 . A A . 36 LEU HB2 1 1 20 17663 1 1 36 LEU HB3 H 1.971 -3.152 3.604 1.00 . A A . 36 LEU HB3 1 1 20 17664 1 1 36 LEU HD11 H 2.120 -5.556 1.884 1.00 . A A . 36 LEU HD11 1 1 20 17665 1 1 36 LEU HD12 H 3.787 -5.875 1.407 1.00 . A A . 36 LEU HD12 1 1 20 17666 1 1 36 LEU HD13 H 3.184 -6.472 2.951 1.00 . A A . 36 LEU HD13 1 1 20 17667 1 1 36 LEU HD21 H 4.562 -3.484 1.239 1.00 . A A . 36 LEU HD21 1 1 20 17668 1 1 36 LEU HD22 H 2.820 -3.211 1.283 1.00 . A A . 36 LEU HD22 1 1 20 17669 1 1 36 LEU HD23 H 3.881 -2.322 2.378 1.00 . A A . 36 LEU HD23 1 1 20 17670 1 1 36 LEU HG H 4.538 -4.538 3.361 1.00 . A A . 36 LEU HG 1 1 20 17671 1 1 36 LEU N N 4.013 -2.291 5.047 1.00 . A A . 36 LEU N 1 1 20 17672 1 1 36 LEU O O 4.929 -4.269 6.786 1.00 . A A . 36 LEU O 1 1 20 17673 1 1 37 ARG C C 6.019 -6.835 5.704 1.00 . A A . 37 ARG C 1 1 20 17674 1 1 37 ARG CA C 4.530 -6.963 6.076 1.00 . A A . 37 ARG CA 1 1 20 17675 1 1 37 ARG CB C 3.921 -8.227 5.457 1.00 . A A . 37 ARG CB 1 1 20 17676 1 1 37 ARG CD C 1.516 -8.806 5.905 1.00 . A A . 37 ARG CD 1 1 20 17677 1 1 37 ARG CG C 2.954 -8.952 6.378 1.00 . A A . 37 ARG CG 1 1 20 17678 1 1 37 ARG CZ C -0.345 -8.372 7.464 1.00 . A A . 37 ARG CZ 1 1 20 17679 1 1 37 ARG H H 3.064 -5.938 4.961 1.00 . A A . 37 ARG H 1 1 20 17680 1 1 37 ARG HA H 4.439 -7.010 7.151 1.00 . A A . 37 ARG HA 1 1 20 17681 1 1 37 ARG HB2 H 3.393 -7.956 4.555 1.00 . A A . 37 ARG HB2 1 1 20 17682 1 1 37 ARG HB3 H 4.720 -8.911 5.202 1.00 . A A . 37 ARG HB3 1 1 20 17683 1 1 37 ARG HD2 H 1.516 -8.368 4.918 1.00 . A A . 37 ARG HD2 1 1 20 17684 1 1 37 ARG HD3 H 1.063 -9.785 5.863 1.00 . A A . 37 ARG HD3 1 1 20 17685 1 1 37 ARG HE H 1.036 -7.027 6.922 1.00 . A A . 37 ARG HE 1 1 20 17686 1 1 37 ARG HG2 H 3.210 -10.001 6.399 1.00 . A A . 37 ARG HG2 1 1 20 17687 1 1 37 ARG HG3 H 3.040 -8.539 7.371 1.00 . A A . 37 ARG HG3 1 1 20 17688 1 1 37 ARG HH11 H -0.364 -10.220 6.632 1.00 . A A . 37 ARG HH11 1 1 20 17689 1 1 37 ARG HH12 H -1.627 -9.913 7.776 1.00 . A A . 37 ARG HH12 1 1 20 17690 1 1 37 ARG HH21 H -0.619 -6.617 8.447 1.00 . A A . 37 ARG HH21 1 1 20 17691 1 1 37 ARG HH22 H -1.765 -7.869 8.823 1.00 . A A . 37 ARG HH22 1 1 20 17692 1 1 37 ARG N N 3.779 -5.801 5.603 1.00 . A A . 37 ARG N 1 1 20 17693 1 1 37 ARG NE N 0.730 -7.957 6.798 1.00 . A A . 37 ARG NE 1 1 20 17694 1 1 37 ARG NH1 N -0.816 -9.600 7.275 1.00 . A A . 37 ARG NH1 1 1 20 17695 1 1 37 ARG NH2 N -0.961 -7.552 8.306 1.00 . A A . 37 ARG NH2 1 1 20 17696 1 1 37 ARG O O 6.389 -5.872 5.027 1.00 . A A . 37 ARG O 1 1 20 17697 1 1 38 PRO C C 8.785 -6.949 4.717 1.00 . A A . 38 PRO C 1 1 20 17698 1 1 38 PRO CA C 8.330 -7.814 5.890 1.00 . A A . 38 PRO CA 1 1 20 17699 1 1 38 PRO CB C 8.568 -9.292 5.614 1.00 . A A . 38 PRO CB 1 1 20 17700 1 1 38 PRO CD C 6.538 -8.994 6.921 1.00 . A A . 38 PRO CD 1 1 20 17701 1 1 38 PRO CG C 7.570 -10.011 6.476 1.00 . A A . 38 PRO CG 1 1 20 17702 1 1 38 PRO HA H 8.880 -7.526 6.772 1.00 . A A . 38 PRO HA 1 1 20 17703 1 1 38 PRO HB2 H 8.404 -9.495 4.566 1.00 . A A . 38 PRO HB2 1 1 20 17704 1 1 38 PRO HB3 H 9.580 -9.553 5.884 1.00 . A A . 38 PRO HB3 1 1 20 17705 1 1 38 PRO HD2 H 5.541 -9.334 6.682 1.00 . A A . 38 PRO HD2 1 1 20 17706 1 1 38 PRO HD3 H 6.628 -8.801 7.981 1.00 . A A . 38 PRO HD3 1 1 20 17707 1 1 38 PRO HG2 H 7.095 -10.794 5.904 1.00 . A A . 38 PRO HG2 1 1 20 17708 1 1 38 PRO HG3 H 8.071 -10.432 7.335 1.00 . A A . 38 PRO HG3 1 1 20 17709 1 1 38 PRO N N 6.886 -7.798 6.140 1.00 . A A . 38 PRO N 1 1 20 17710 1 1 38 PRO O O 8.438 -7.210 3.558 1.00 . A A . 38 PRO O 1 1 20 17711 1 1 39 ALA C C 10.498 -5.384 2.863 1.00 . A A . 39 ALA C 1 1 20 17712 1 1 39 ALA CA C 9.854 -4.814 4.122 1.00 . A A . 39 ALA CA 1 1 20 17713 1 1 39 ALA CB C 10.817 -3.859 4.807 1.00 . A A . 39 ALA CB 1 1 20 17714 1 1 39 ALA H H 9.586 -5.681 6.030 1.00 . A A . 39 ALA H 1 1 20 17715 1 1 39 ALA HA H 8.975 -4.253 3.841 1.00 . A A . 39 ALA HA 1 1 20 17716 1 1 39 ALA HB1 H 10.319 -2.919 4.993 1.00 . A A . 39 ALA HB1 1 1 20 17717 1 1 39 ALA HB2 H 11.143 -4.286 5.743 1.00 . A A . 39 ALA HB2 1 1 20 17718 1 1 39 ALA HB3 H 11.672 -3.695 4.169 1.00 . A A . 39 ALA HB3 1 1 20 17719 1 1 39 ALA N N 9.443 -5.847 5.069 1.00 . A A . 39 ALA N 1 1 20 17720 1 1 39 ALA O O 11.357 -6.266 2.935 1.00 . A A . 39 ALA O 1 1 20 17721 1 1 40 LEU C C 12.094 -4.471 0.303 1.00 . A A . 40 LEU C 1 1 20 17722 1 1 40 LEU CA C 10.752 -5.175 0.457 1.00 . A A . 40 LEU CA 1 1 20 17723 1 1 40 LEU CB C 9.826 -4.811 -0.708 1.00 . A A . 40 LEU CB 1 1 20 17724 1 1 40 LEU CD1 C 7.339 -4.972 -0.430 1.00 . A A . 40 LEU CD1 1 1 20 17725 1 1 40 LEU CD2 C 8.465 -6.180 -2.301 1.00 . A A . 40 LEU CD2 1 1 20 17726 1 1 40 LEU CG C 8.596 -5.707 -0.865 1.00 . A A . 40 LEU CG 1 1 20 17727 1 1 40 LEU H H 9.523 -4.042 1.743 1.00 . A A . 40 LEU H 1 1 20 17728 1 1 40 LEU HA H 10.916 -6.243 0.465 1.00 . A A . 40 LEU HA 1 1 20 17729 1 1 40 LEU HB2 H 9.487 -3.793 -0.566 1.00 . A A . 40 LEU HB2 1 1 20 17730 1 1 40 LEU HB3 H 10.396 -4.858 -1.623 1.00 . A A . 40 LEU HB3 1 1 20 17731 1 1 40 LEU HD11 H 6.627 -5.680 -0.036 1.00 . A A . 40 LEU HD11 1 1 20 17732 1 1 40 LEU HD12 H 7.589 -4.249 0.333 1.00 . A A . 40 LEU HD12 1 1 20 17733 1 1 40 LEU HD13 H 6.908 -4.462 -1.280 1.00 . A A . 40 LEU HD13 1 1 20 17734 1 1 40 LEU HD21 H 7.622 -6.850 -2.383 1.00 . A A . 40 LEU HD21 1 1 20 17735 1 1 40 LEU HD22 H 8.312 -5.328 -2.947 1.00 . A A . 40 LEU HD22 1 1 20 17736 1 1 40 LEU HD23 H 9.366 -6.695 -2.597 1.00 . A A . 40 LEU HD23 1 1 20 17737 1 1 40 LEU HG H 8.709 -6.575 -0.233 1.00 . A A . 40 LEU HG 1 1 20 17738 1 1 40 LEU N N 10.148 -4.801 1.722 1.00 . A A . 40 LEU N 1 1 20 17739 1 1 40 LEU O O 12.210 -3.272 0.571 1.00 . A A . 40 LEU O 1 1 20 17740 1 1 41 TYR C C 14.642 -3.932 -1.449 1.00 . A A . 41 TYR C 1 1 20 17741 1 1 41 TYR CA C 14.468 -4.688 -0.138 1.00 . A A . 41 TYR CA 1 1 20 17742 1 1 41 TYR CB C 15.497 -5.809 -0.005 1.00 . A A . 41 TYR CB 1 1 20 17743 1 1 41 TYR CD1 C 15.363 -5.819 2.512 1.00 . A A . 41 TYR CD1 1 1 20 17744 1 1 41 TYR CD2 C 15.315 -7.917 1.382 1.00 . A A . 41 TYR CD2 1 1 20 17745 1 1 41 TYR CE1 C 15.248 -6.464 3.727 1.00 . A A . 41 TYR CE1 1 1 20 17746 1 1 41 TYR CE2 C 15.203 -8.570 2.596 1.00 . A A . 41 TYR CE2 1 1 20 17747 1 1 41 TYR CG C 15.398 -6.531 1.321 1.00 . A A . 41 TYR CG 1 1 20 17748 1 1 41 TYR CZ C 15.168 -7.838 3.764 1.00 . A A . 41 TYR CZ 1 1 20 17749 1 1 41 TYR H H 12.980 -6.200 -0.167 1.00 . A A . 41 TYR H 1 1 20 17750 1 1 41 TYR HA H 14.602 -3.995 0.679 1.00 . A A . 41 TYR HA 1 1 20 17751 1 1 41 TYR HB2 H 15.344 -6.533 -0.793 1.00 . A A . 41 TYR HB2 1 1 20 17752 1 1 41 TYR HB3 H 16.490 -5.394 -0.086 1.00 . A A . 41 TYR HB3 1 1 20 17753 1 1 41 TYR HD1 H 15.427 -4.741 2.479 1.00 . A A . 41 TYR HD1 1 1 20 17754 1 1 41 TYR HD2 H 15.343 -8.485 0.467 1.00 . A A . 41 TYR HD2 1 1 20 17755 1 1 41 TYR HE1 H 15.220 -5.891 4.641 1.00 . A A . 41 TYR HE1 1 1 20 17756 1 1 41 TYR HE2 H 15.141 -9.648 2.624 1.00 . A A . 41 TYR HE2 1 1 20 17757 1 1 41 TYR HH H 15.922 -8.760 5.282 1.00 . A A . 41 TYR HH 1 1 20 17758 1 1 41 TYR N N 13.122 -5.231 -0.034 1.00 . A A . 41 TYR N 1 1 20 17759 1 1 41 TYR O O 15.460 -3.017 -1.549 1.00 . A A . 41 TYR O 1 1 20 17760 1 1 41 TYR OH O 15.044 -8.481 4.976 1.00 . A A . 41 TYR OH 1 1 20 17761 1 1 42 GLU C C 12.290 -3.024 -3.894 1.00 . A A . 42 GLU C 1 1 20 17762 1 1 42 GLU CA C 13.714 -3.488 -3.652 1.00 . A A . 42 GLU CA 1 1 20 17763 1 1 42 GLU CB C 14.174 -4.361 -4.818 1.00 . A A . 42 GLU CB 1 1 20 17764 1 1 42 GLU CD C 16.163 -5.860 -4.447 1.00 . A A . 42 GLU CD 1 1 20 17765 1 1 42 GLU CG C 15.680 -4.506 -4.916 1.00 . A A . 42 GLU CG 1 1 20 17766 1 1 42 GLU H H 13.079 -4.897 -2.218 1.00 . A A . 42 GLU H 1 1 20 17767 1 1 42 GLU HA H 14.362 -2.628 -3.568 1.00 . A A . 42 GLU HA 1 1 20 17768 1 1 42 GLU HB2 H 13.746 -5.345 -4.704 1.00 . A A . 42 GLU HB2 1 1 20 17769 1 1 42 GLU HB3 H 13.815 -3.928 -5.739 1.00 . A A . 42 GLU HB3 1 1 20 17770 1 1 42 GLU HG2 H 15.973 -4.374 -5.948 1.00 . A A . 42 GLU HG2 1 1 20 17771 1 1 42 GLU HG3 H 16.145 -3.743 -4.310 1.00 . A A . 42 GLU HG3 1 1 20 17772 1 1 42 GLU N N 13.771 -4.226 -2.401 1.00 . A A . 42 GLU N 1 1 20 17773 1 1 42 GLU O O 11.344 -3.670 -3.446 1.00 . A A . 42 GLU O 1 1 20 17774 1 1 42 GLU OE1 O 15.433 -6.856 -4.637 1.00 . A A . 42 GLU OE1 1 1 20 17775 1 1 42 GLU OE2 O 17.279 -5.937 -3.891 1.00 . A A . 42 GLU OE2 1 1 20 17776 1 1 43 VAL C C 10.064 -2.374 -5.833 1.00 . A A . 43 VAL C 1 1 20 17777 1 1 43 VAL CA C 10.817 -1.397 -4.927 1.00 . A A . 43 VAL CA 1 1 20 17778 1 1 43 VAL CB C 10.908 -0.006 -5.603 1.00 . A A . 43 VAL CB 1 1 20 17779 1 1 43 VAL CG1 C 11.901 -0.017 -6.761 1.00 . A A . 43 VAL CG1 1 1 20 17780 1 1 43 VAL CG2 C 9.537 0.454 -6.076 1.00 . A A . 43 VAL CG2 1 1 20 17781 1 1 43 VAL H H 12.932 -1.454 -4.946 1.00 . A A . 43 VAL H 1 1 20 17782 1 1 43 VAL HA H 10.270 -1.289 -4.001 1.00 . A A . 43 VAL HA 1 1 20 17783 1 1 43 VAL HB H 11.262 0.699 -4.867 1.00 . A A . 43 VAL HB 1 1 20 17784 1 1 43 VAL HG11 H 11.725 0.841 -7.394 1.00 . A A . 43 VAL HG11 1 1 20 17785 1 1 43 VAL HG12 H 12.910 0.024 -6.374 1.00 . A A . 43 VAL HG12 1 1 20 17786 1 1 43 VAL HG13 H 11.773 -0.921 -7.336 1.00 . A A . 43 VAL HG13 1 1 20 17787 1 1 43 VAL HG21 H 8.780 0.081 -5.401 1.00 . A A . 43 VAL HG21 1 1 20 17788 1 1 43 VAL HG22 H 9.505 1.533 -6.092 1.00 . A A . 43 VAL HG22 1 1 20 17789 1 1 43 VAL HG23 H 9.352 0.073 -7.069 1.00 . A A . 43 VAL HG23 1 1 20 17790 1 1 43 VAL N N 12.138 -1.920 -4.608 1.00 . A A . 43 VAL N 1 1 20 17791 1 1 43 VAL O O 10.576 -2.785 -6.874 1.00 . A A . 43 VAL O 1 1 20 17792 1 1 44 PRO C C 7.726 -3.393 -7.505 1.00 . A A . 44 PRO C 1 1 20 17793 1 1 44 PRO CA C 8.137 -3.869 -6.116 1.00 . A A . 44 PRO CA 1 1 20 17794 1 1 44 PRO CB C 6.905 -4.128 -5.244 1.00 . A A . 44 PRO CB 1 1 20 17795 1 1 44 PRO CD C 8.291 -2.546 -4.088 1.00 . A A . 44 PRO CD 1 1 20 17796 1 1 44 PRO CG C 6.879 -3.032 -4.234 1.00 . A A . 44 PRO CG 1 1 20 17797 1 1 44 PRO HA H 8.703 -4.784 -6.215 1.00 . A A . 44 PRO HA 1 1 20 17798 1 1 44 PRO HB2 H 6.019 -4.113 -5.858 1.00 . A A . 44 PRO HB2 1 1 20 17799 1 1 44 PRO HB3 H 7.000 -5.094 -4.769 1.00 . A A . 44 PRO HB3 1 1 20 17800 1 1 44 PRO HD2 H 8.305 -1.481 -3.906 1.00 . A A . 44 PRO HD2 1 1 20 17801 1 1 44 PRO HD3 H 8.794 -3.072 -3.292 1.00 . A A . 44 PRO HD3 1 1 20 17802 1 1 44 PRO HG2 H 6.242 -2.231 -4.581 1.00 . A A . 44 PRO HG2 1 1 20 17803 1 1 44 PRO HG3 H 6.519 -3.414 -3.291 1.00 . A A . 44 PRO HG3 1 1 20 17804 1 1 44 PRO N N 8.898 -2.859 -5.386 1.00 . A A . 44 PRO N 1 1 20 17805 1 1 44 PRO O O 7.229 -2.276 -7.676 1.00 . A A . 44 PRO O 1 1 20 17806 1 1 45 ASP C C 6.792 -4.990 -10.492 1.00 . A A . 45 ASP C 1 1 20 17807 1 1 45 ASP CA C 7.678 -3.911 -9.880 1.00 . A A . 45 ASP CA 1 1 20 17808 1 1 45 ASP CB C 8.977 -3.777 -10.678 1.00 . A A . 45 ASP CB 1 1 20 17809 1 1 45 ASP CG C 8.742 -3.656 -12.170 1.00 . A A . 45 ASP CG 1 1 20 17810 1 1 45 ASP H H 8.389 -5.102 -8.284 1.00 . A A . 45 ASP H 1 1 20 17811 1 1 45 ASP HA H 7.150 -2.969 -9.897 1.00 . A A . 45 ASP HA 1 1 20 17812 1 1 45 ASP HB2 H 9.507 -2.897 -10.347 1.00 . A A . 45 ASP HB2 1 1 20 17813 1 1 45 ASP HB3 H 9.591 -4.649 -10.502 1.00 . A A . 45 ASP HB3 1 1 20 17814 1 1 45 ASP N N 7.977 -4.235 -8.493 1.00 . A A . 45 ASP N 1 1 20 17815 1 1 45 ASP O O 7.028 -6.184 -10.287 1.00 . A A . 45 ASP O 1 1 20 17816 1 1 45 ASP OD1 O 8.142 -2.651 -12.601 1.00 . A A . 45 ASP OD1 1 1 20 17817 1 1 45 ASP OD2 O 9.175 -4.558 -12.916 1.00 . A A . 45 ASP OD2 1 1 20 17818 1 1 46 GLY C C 3.493 -5.544 -10.933 1.00 . A A . 46 GLY C 1 1 20 17819 1 1 46 GLY CA C 4.787 -5.515 -11.720 1.00 . A A . 46 GLY CA 1 1 20 17820 1 1 46 GLY H H 5.558 -3.605 -11.240 1.00 . A A . 46 GLY H 1 1 20 17821 1 1 46 GLY HA2 H 4.572 -5.235 -12.742 1.00 . A A . 46 GLY HA2 1 1 20 17822 1 1 46 GLY HA3 H 5.228 -6.500 -11.710 1.00 . A A . 46 GLY HA3 1 1 20 17823 1 1 46 GLY N N 5.732 -4.569 -11.164 1.00 . A A . 46 GLY N 1 1 20 17824 1 1 46 GLY O O 3.139 -4.562 -10.280 1.00 . A A . 46 GLY O 1 1 20 17825 1 1 47 GLU C C 1.791 -7.053 -8.776 1.00 . A A . 47 GLU C 1 1 20 17826 1 1 47 GLU CA C 1.539 -6.826 -10.262 1.00 . A A . 47 GLU CA 1 1 20 17827 1 1 47 GLU CB C 0.730 -7.993 -10.836 1.00 . A A . 47 GLU CB 1 1 20 17828 1 1 47 GLU CD C 1.880 -9.127 -12.772 1.00 . A A . 47 GLU CD 1 1 20 17829 1 1 47 GLU CG C 0.827 -8.128 -12.346 1.00 . A A . 47 GLU CG 1 1 20 17830 1 1 47 GLU H H 3.135 -7.422 -11.517 1.00 . A A . 47 GLU H 1 1 20 17831 1 1 47 GLU HA H 0.973 -5.913 -10.384 1.00 . A A . 47 GLU HA 1 1 20 17832 1 1 47 GLU HB2 H 1.086 -8.912 -10.391 1.00 . A A . 47 GLU HB2 1 1 20 17833 1 1 47 GLU HB3 H -0.308 -7.857 -10.574 1.00 . A A . 47 GLU HB3 1 1 20 17834 1 1 47 GLU HG2 H -0.130 -8.452 -12.726 1.00 . A A . 47 GLU HG2 1 1 20 17835 1 1 47 GLU HG3 H 1.072 -7.164 -12.767 1.00 . A A . 47 GLU HG3 1 1 20 17836 1 1 47 GLU N N 2.797 -6.670 -10.980 1.00 . A A . 47 GLU N 1 1 20 17837 1 1 47 GLU O O 1.928 -8.191 -8.322 1.00 . A A . 47 GLU O 1 1 20 17838 1 1 47 GLU OE1 O 3.078 -8.768 -12.778 1.00 . A A . 47 GLU OE1 1 1 20 17839 1 1 47 GLU OE2 O 1.518 -10.274 -13.102 1.00 . A A . 47 GLU OE2 1 1 20 17840 1 1 48 TRP C C 0.675 -5.922 -5.890 1.00 . A A . 48 TRP C 1 1 20 17841 1 1 48 TRP CA C 2.028 -6.033 -6.588 1.00 . A A . 48 TRP CA 1 1 20 17842 1 1 48 TRP CB C 2.968 -4.908 -6.129 1.00 . A A . 48 TRP CB 1 1 20 17843 1 1 48 TRP CD1 C 3.936 -5.573 -3.854 1.00 . A A . 48 TRP CD1 1 1 20 17844 1 1 48 TRP CD2 C 2.440 -3.909 -3.770 1.00 . A A . 48 TRP CD2 1 1 20 17845 1 1 48 TRP CE2 C 2.890 -4.174 -2.465 1.00 . A A . 48 TRP CE2 1 1 20 17846 1 1 48 TRP CE3 C 1.491 -2.898 -3.965 1.00 . A A . 48 TRP CE3 1 1 20 17847 1 1 48 TRP CG C 3.123 -4.815 -4.644 1.00 . A A . 48 TRP CG 1 1 20 17848 1 1 48 TRP CH2 C 1.498 -2.484 -1.583 1.00 . A A . 48 TRP CH2 1 1 20 17849 1 1 48 TRP CZ2 C 2.423 -3.467 -1.362 1.00 . A A . 48 TRP CZ2 1 1 20 17850 1 1 48 TRP CZ3 C 1.029 -2.199 -2.868 1.00 . A A . 48 TRP CZ3 1 1 20 17851 1 1 48 TRP H H 1.702 -5.088 -8.448 1.00 . A A . 48 TRP H 1 1 20 17852 1 1 48 TRP HA H 2.472 -6.987 -6.349 1.00 . A A . 48 TRP HA 1 1 20 17853 1 1 48 TRP HB2 H 3.946 -5.071 -6.554 1.00 . A A . 48 TRP HB2 1 1 20 17854 1 1 48 TRP HB3 H 2.583 -3.962 -6.484 1.00 . A A . 48 TRP HB3 1 1 20 17855 1 1 48 TRP HD1 H 4.584 -6.355 -4.221 1.00 . A A . 48 TRP HD1 1 1 20 17856 1 1 48 TRP HE1 H 4.280 -5.590 -1.783 1.00 . A A . 48 TRP HE1 1 1 20 17857 1 1 48 TRP HE3 H 1.117 -2.661 -4.951 1.00 . A A . 48 TRP HE3 1 1 20 17858 1 1 48 TRP HH2 H 1.110 -1.910 -0.754 1.00 . A A . 48 TRP HH2 1 1 20 17859 1 1 48 TRP HZ2 H 2.774 -3.672 -0.362 1.00 . A A . 48 TRP HZ2 1 1 20 17860 1 1 48 TRP HZ3 H 0.295 -1.418 -2.997 1.00 . A A . 48 TRP HZ3 1 1 20 17861 1 1 48 TRP N N 1.839 -5.966 -8.026 1.00 . A A . 48 TRP N 1 1 20 17862 1 1 48 TRP NE1 N 3.802 -5.194 -2.541 1.00 . A A . 48 TRP NE1 1 1 20 17863 1 1 48 TRP O O -0.246 -5.292 -6.416 1.00 . A A . 48 TRP O 1 1 20 17864 1 1 49 GLN C C -0.436 -6.370 -2.498 1.00 . A A . 49 GLN C 1 1 20 17865 1 1 49 GLN CA C -0.707 -6.546 -3.989 1.00 . A A . 49 GLN CA 1 1 20 17866 1 1 49 GLN CB C -1.488 -7.839 -4.223 1.00 . A A . 49 GLN CB 1 1 20 17867 1 1 49 GLN CD C -2.265 -9.474 -5.986 1.00 . A A . 49 GLN CD 1 1 20 17868 1 1 49 GLN CG C -1.931 -8.033 -5.667 1.00 . A A . 49 GLN CG 1 1 20 17869 1 1 49 GLN H H 1.305 -7.071 -4.381 1.00 . A A . 49 GLN H 1 1 20 17870 1 1 49 GLN HA H -1.293 -5.710 -4.342 1.00 . A A . 49 GLN HA 1 1 20 17871 1 1 49 GLN HB2 H -0.868 -8.678 -3.944 1.00 . A A . 49 GLN HB2 1 1 20 17872 1 1 49 GLN HB3 H -2.368 -7.831 -3.597 1.00 . A A . 49 GLN HB3 1 1 20 17873 1 1 49 GLN HE21 H -3.000 -9.722 -4.161 1.00 . A A . 49 GLN HE21 1 1 20 17874 1 1 49 GLN HE22 H -3.064 -11.112 -5.192 1.00 . A A . 49 GLN HE22 1 1 20 17875 1 1 49 GLN HG2 H -2.810 -7.431 -5.844 1.00 . A A . 49 GLN HG2 1 1 20 17876 1 1 49 GLN HG3 H -1.136 -7.708 -6.322 1.00 . A A . 49 GLN HG3 1 1 20 17877 1 1 49 GLN N N 0.543 -6.564 -4.737 1.00 . A A . 49 GLN N 1 1 20 17878 1 1 49 GLN NE2 N -2.832 -10.173 -5.018 1.00 . A A . 49 GLN NE2 1 1 20 17879 1 1 49 GLN O O 0.479 -6.993 -1.948 1.00 . A A . 49 GLN O 1 1 20 17880 1 1 49 GLN OE1 O -2.023 -9.953 -7.093 1.00 . A A . 49 GLN OE1 1 1 20 17881 1 1 50 CYS C C -1.789 -6.409 0.376 1.00 . A A . 50 CYS C 1 1 20 17882 1 1 50 CYS CA C -1.092 -5.299 -0.414 1.00 . A A . 50 CYS CA 1 1 20 17883 1 1 50 CYS CB C -1.650 -3.915 -0.041 1.00 . A A . 50 CYS CB 1 1 20 17884 1 1 50 CYS H H -1.944 -5.065 -2.336 1.00 . A A . 50 CYS H 1 1 20 17885 1 1 50 CYS HA H -0.037 -5.323 -0.181 1.00 . A A . 50 CYS HA 1 1 20 17886 1 1 50 CYS HB2 H -1.086 -3.528 0.794 1.00 . A A . 50 CYS HB2 1 1 20 17887 1 1 50 CYS HB3 H -1.526 -3.254 -0.886 1.00 . A A . 50 CYS HB3 1 1 20 17888 1 1 50 CYS N N -1.233 -5.530 -1.845 1.00 . A A . 50 CYS N 1 1 20 17889 1 1 50 CYS O O -2.514 -7.222 -0.193 1.00 . A A . 50 CYS O 1 1 20 17890 1 1 50 CYS SG S -3.412 -3.882 0.426 1.00 . A A . 50 CYS SG 1 1 20 17891 1 1 51 PRO C C -3.555 -7.247 2.940 1.00 . A A . 51 PRO C 1 1 20 17892 1 1 51 PRO CA C -2.117 -7.549 2.524 1.00 . A A . 51 PRO CA 1 1 20 17893 1 1 51 PRO CB C -1.202 -7.575 3.762 1.00 . A A . 51 PRO CB 1 1 20 17894 1 1 51 PRO CD C -0.654 -5.632 2.463 1.00 . A A . 51 PRO CD 1 1 20 17895 1 1 51 PRO CG C -0.125 -6.567 3.506 1.00 . A A . 51 PRO CG 1 1 20 17896 1 1 51 PRO HA H -2.082 -8.508 2.029 1.00 . A A . 51 PRO HA 1 1 20 17897 1 1 51 PRO HB2 H -1.778 -7.316 4.637 1.00 . A A . 51 PRO HB2 1 1 20 17898 1 1 51 PRO HB3 H -0.790 -8.566 3.879 1.00 . A A . 51 PRO HB3 1 1 20 17899 1 1 51 PRO HD2 H -1.201 -4.821 2.921 1.00 . A A . 51 PRO HD2 1 1 20 17900 1 1 51 PRO HD3 H 0.150 -5.254 1.848 1.00 . A A . 51 PRO HD3 1 1 20 17901 1 1 51 PRO HG2 H 0.093 -6.026 4.414 1.00 . A A . 51 PRO HG2 1 1 20 17902 1 1 51 PRO HG3 H 0.763 -7.062 3.144 1.00 . A A . 51 PRO HG3 1 1 20 17903 1 1 51 PRO N N -1.544 -6.498 1.690 1.00 . A A . 51 PRO N 1 1 20 17904 1 1 51 PRO O O -4.066 -7.838 3.892 1.00 . A A . 51 PRO O 1 1 20 17905 1 1 52 ARG C C -6.557 -6.191 1.594 1.00 . A A . 52 ARG C 1 1 20 17906 1 1 52 ARG CA C -5.522 -5.867 2.668 1.00 . A A . 52 ARG CA 1 1 20 17907 1 1 52 ARG CB C -5.564 -4.374 2.997 1.00 . A A . 52 ARG CB 1 1 20 17908 1 1 52 ARG CD C -6.329 -4.865 5.344 1.00 . A A . 52 ARG CD 1 1 20 17909 1 1 52 ARG CG C -5.372 -4.066 4.475 1.00 . A A . 52 ARG CG 1 1 20 17910 1 1 52 ARG CZ C -7.792 -4.188 7.215 1.00 . A A . 52 ARG CZ 1 1 20 17911 1 1 52 ARG H H -3.703 -5.777 1.581 1.00 . A A . 52 ARG H 1 1 20 17912 1 1 52 ARG HA H -5.780 -6.419 3.560 1.00 . A A . 52 ARG HA 1 1 20 17913 1 1 52 ARG HB2 H -4.782 -3.874 2.444 1.00 . A A . 52 ARG HB2 1 1 20 17914 1 1 52 ARG HB3 H -6.520 -3.977 2.690 1.00 . A A . 52 ARG HB3 1 1 20 17915 1 1 52 ARG HD2 H -7.259 -4.991 4.811 1.00 . A A . 52 ARG HD2 1 1 20 17916 1 1 52 ARG HD3 H -5.895 -5.835 5.540 1.00 . A A . 52 ARG HD3 1 1 20 17917 1 1 52 ARG HE H -5.842 -3.747 7.062 1.00 . A A . 52 ARG HE 1 1 20 17918 1 1 52 ARG HG2 H -4.359 -4.313 4.753 1.00 . A A . 52 ARG HG2 1 1 20 17919 1 1 52 ARG HG3 H -5.544 -3.012 4.639 1.00 . A A . 52 ARG HG3 1 1 20 17920 1 1 52 ARG HH11 H -8.747 -5.185 5.725 1.00 . A A . 52 ARG HH11 1 1 20 17921 1 1 52 ARG HH12 H -9.736 -4.754 7.088 1.00 . A A . 52 ARG HH12 1 1 20 17922 1 1 52 ARG HH21 H -7.142 -3.169 8.843 1.00 . A A . 52 ARG HH21 1 1 20 17923 1 1 52 ARG HH22 H -8.830 -3.578 8.849 1.00 . A A . 52 ARG HH22 1 1 20 17924 1 1 52 ARG N N -4.180 -6.275 2.287 1.00 . A A . 52 ARG N 1 1 20 17925 1 1 52 ARG NE N -6.602 -4.203 6.619 1.00 . A A . 52 ARG NE 1 1 20 17926 1 1 52 ARG NH1 N -8.844 -4.752 6.629 1.00 . A A . 52 ARG NH1 1 1 20 17927 1 1 52 ARG NH2 N -7.930 -3.602 8.398 1.00 . A A . 52 ARG NH2 1 1 20 17928 1 1 52 ARG O O -7.741 -6.318 1.911 1.00 . A A . 52 ARG O 1 1 20 17929 1 1 53 CYS C C -7.562 -8.178 -0.465 1.00 . A A . 53 CYS C 1 1 20 17930 1 1 53 CYS CA C -7.082 -6.753 -0.692 1.00 . A A . 53 CYS CA 1 1 20 17931 1 1 53 CYS CB C -6.466 -6.625 -2.084 1.00 . A A . 53 CYS CB 1 1 20 17932 1 1 53 CYS H H -5.177 -6.354 0.130 1.00 . A A . 53 CYS H 1 1 20 17933 1 1 53 CYS HA H -7.927 -6.085 -0.616 1.00 . A A . 53 CYS HA 1 1 20 17934 1 1 53 CYS HB2 H -6.534 -7.579 -2.576 1.00 . A A . 53 CYS HB2 1 1 20 17935 1 1 53 CYS HB3 H -7.031 -5.898 -2.646 1.00 . A A . 53 CYS HB3 1 1 20 17936 1 1 53 CYS N N -6.134 -6.387 0.343 1.00 . A A . 53 CYS N 1 1 20 17937 1 1 53 CYS O O -8.747 -8.415 -0.225 1.00 . A A . 53 CYS O 1 1 20 17938 1 1 53 CYS SG S -4.719 -6.118 -2.127 1.00 . A A . 53 CYS SG 1 1 20 17939 1 1 54 THR C C -7.970 -11.070 -0.979 1.00 . A A . 54 THR C 1 1 20 17940 1 1 54 THR CA C -6.854 -10.501 -0.104 1.00 . A A . 54 THR CA 1 1 20 17941 1 1 54 THR CB C -7.202 -10.719 1.387 1.00 . A A . 54 THR CB 1 1 20 17942 1 1 54 THR CG2 C -6.191 -11.646 2.040 1.00 . A A . 54 THR CG2 1 1 20 17943 1 1 54 THR H H -5.670 -8.801 -0.521 1.00 . A A . 54 THR H 1 1 20 17944 1 1 54 THR HA H -5.944 -11.045 -0.316 1.00 . A A . 54 THR HA 1 1 20 17945 1 1 54 THR HB H -8.181 -11.174 1.451 1.00 . A A . 54 THR HB 1 1 20 17946 1 1 54 THR HG1 H -7.740 -8.830 1.584 1.00 . A A . 54 THR HG1 1 1 20 17947 1 1 54 THR HG21 H -6.702 -12.323 2.709 1.00 . A A . 54 THR HG21 1 1 20 17948 1 1 54 THR HG22 H -5.474 -11.060 2.598 1.00 . A A . 54 THR HG22 1 1 20 17949 1 1 54 THR HG23 H -5.677 -12.213 1.278 1.00 . A A . 54 THR HG23 1 1 20 17950 1 1 54 THR N N -6.599 -9.093 -0.404 1.00 . A A . 54 THR N 1 1 20 17951 1 1 54 THR O O -8.997 -11.533 -0.481 1.00 . A A . 54 THR O 1 1 20 17952 1 1 54 THR OG1 O -7.220 -9.467 2.088 1.00 . A A . 54 THR OG1 1 1 20 17953 1 1 55 CYS C C -8.418 -13.111 -3.418 1.00 . A A . 55 CYS C 1 1 20 17954 1 1 55 CYS CA C -8.690 -11.627 -3.226 1.00 . A A . 55 CYS CA 1 1 20 17955 1 1 55 CYS CB C -8.599 -10.900 -4.569 1.00 . A A . 55 CYS CB 1 1 20 17956 1 1 55 CYS H H -6.869 -10.746 -2.616 1.00 . A A . 55 CYS H 1 1 20 17957 1 1 55 CYS HA H -9.682 -11.501 -2.818 1.00 . A A . 55 CYS HA 1 1 20 17958 1 1 55 CYS HB2 H -8.858 -9.862 -4.425 1.00 . A A . 55 CYS HB2 1 1 20 17959 1 1 55 CYS HB3 H -7.585 -10.965 -4.935 1.00 . A A . 55 CYS HB3 1 1 20 17960 1 1 55 CYS HG H -10.385 -10.552 -6.357 1.00 . A A . 55 CYS HG 1 1 20 17961 1 1 55 CYS N N -7.738 -11.072 -2.283 1.00 . A A . 55 CYS N 1 1 20 17962 1 1 55 CYS O O -7.348 -13.497 -3.887 1.00 . A A . 55 CYS O 1 1 20 17963 1 1 55 CYS SG S -9.690 -11.565 -5.848 1.00 . A A . 55 CYS SG 1 1 20 17964 1 1 56 PRO C C -9.517 -15.955 -4.492 1.00 . A A . 56 PRO C 1 1 20 17965 1 1 56 PRO CA C -9.207 -15.419 -3.096 1.00 . A A . 56 PRO CA 1 1 20 17966 1 1 56 PRO CB C -10.226 -15.927 -2.082 1.00 . A A . 56 PRO CB 1 1 20 17967 1 1 56 PRO CD C -10.645 -13.586 -2.382 1.00 . A A . 56 PRO CD 1 1 20 17968 1 1 56 PRO CG C -11.310 -14.906 -2.093 1.00 . A A . 56 PRO CG 1 1 20 17969 1 1 56 PRO HA H -8.215 -15.730 -2.803 1.00 . A A . 56 PRO HA 1 1 20 17970 1 1 56 PRO HB2 H -10.594 -16.897 -2.389 1.00 . A A . 56 PRO HB2 1 1 20 17971 1 1 56 PRO HB3 H -9.766 -16.003 -1.109 1.00 . A A . 56 PRO HB3 1 1 20 17972 1 1 56 PRO HD2 H -11.247 -13.004 -3.063 1.00 . A A . 56 PRO HD2 1 1 20 17973 1 1 56 PRO HD3 H -10.476 -13.038 -1.465 1.00 . A A . 56 PRO HD3 1 1 20 17974 1 1 56 PRO HG2 H -12.024 -15.141 -2.868 1.00 . A A . 56 PRO HG2 1 1 20 17975 1 1 56 PRO HG3 H -11.797 -14.877 -1.130 1.00 . A A . 56 PRO HG3 1 1 20 17976 1 1 56 PRO N N -9.362 -13.967 -3.008 1.00 . A A . 56 PRO N 1 1 20 17977 1 1 56 PRO O O -10.236 -16.945 -4.641 1.00 . A A . 56 PRO O 1 1 20 17978 1 1 57 ALA C C -10.673 -15.771 -7.221 1.00 . A A . 57 ALA C 1 1 20 17979 1 1 57 ALA CA C -9.186 -15.661 -6.901 1.00 . A A . 57 ALA CA 1 1 20 17980 1 1 57 ALA CB C -8.467 -16.968 -7.210 1.00 . A A . 57 ALA CB 1 1 20 17981 1 1 57 ALA H H -8.414 -14.502 -5.307 1.00 . A A . 57 ALA H 1 1 20 17982 1 1 57 ALA HA H -8.753 -14.889 -7.521 1.00 . A A . 57 ALA HA 1 1 20 17983 1 1 57 ALA HB1 H -9.162 -17.790 -7.122 1.00 . A A . 57 ALA HB1 1 1 20 17984 1 1 57 ALA HB2 H -8.075 -16.934 -8.216 1.00 . A A . 57 ALA HB2 1 1 20 17985 1 1 57 ALA HB3 H -7.656 -17.106 -6.512 1.00 . A A . 57 ALA HB3 1 1 20 17986 1 1 57 ALA N N -8.975 -15.282 -5.507 1.00 . A A . 57 ALA N 1 1 20 17987 1 1 57 ALA O O -11.199 -16.868 -7.414 1.00 . A A . 57 ALA O 1 1 20 17988 1 1 58 LEU C C -13.113 -15.080 -8.884 1.00 . A A . 58 LEU C 1 1 20 17989 1 1 58 LEU CA C -12.793 -14.598 -7.471 1.00 . A A . 58 LEU CA 1 1 20 17990 1 1 58 LEU CB C -13.340 -13.183 -7.262 1.00 . A A . 58 LEU CB 1 1 20 17991 1 1 58 LEU CD1 C -13.921 -11.287 -5.729 1.00 . A A . 58 LEU CD1 1 1 20 17992 1 1 58 LEU CD2 C -14.030 -13.640 -4.894 1.00 . A A . 58 LEU CD2 1 1 20 17993 1 1 58 LEU CG C -13.304 -12.674 -5.817 1.00 . A A . 58 LEU CG 1 1 20 17994 1 1 58 LEU H H -10.885 -13.794 -7.020 1.00 . A A . 58 LEU H 1 1 20 17995 1 1 58 LEU HA H -13.265 -15.264 -6.764 1.00 . A A . 58 LEU HA 1 1 20 17996 1 1 58 LEU HB2 H -12.766 -12.503 -7.876 1.00 . A A . 58 LEU HB2 1 1 20 17997 1 1 58 LEU HB3 H -14.366 -13.164 -7.599 1.00 . A A . 58 LEU HB3 1 1 20 17998 1 1 58 LEU HD11 H -14.717 -11.293 -4.999 1.00 . A A . 58 LEU HD11 1 1 20 17999 1 1 58 LEU HD12 H -13.166 -10.574 -5.431 1.00 . A A . 58 LEU HD12 1 1 20 18000 1 1 58 LEU HD13 H -14.319 -11.008 -6.694 1.00 . A A . 58 LEU HD13 1 1 20 18001 1 1 58 LEU HD21 H -14.017 -14.631 -5.326 1.00 . A A . 58 LEU HD21 1 1 20 18002 1 1 58 LEU HD22 H -13.537 -13.660 -3.933 1.00 . A A . 58 LEU HD22 1 1 20 18003 1 1 58 LEU HD23 H -15.052 -13.316 -4.766 1.00 . A A . 58 LEU HD23 1 1 20 18004 1 1 58 LEU HG H -12.277 -12.605 -5.491 1.00 . A A . 58 LEU HG 1 1 20 18005 1 1 58 LEU N N -11.354 -14.631 -7.223 1.00 . A A . 58 LEU N 1 1 20 18006 1 1 58 LEU O O -14.128 -15.737 -9.113 1.00 . A A . 58 LEU O 1 1 20 18007 1 1 59 LYS C C -11.118 -15.914 -11.690 1.00 . A A . 59 LYS C 1 1 20 18008 1 1 59 LYS CA C -12.383 -15.221 -11.194 1.00 . A A . 59 LYS CA 1 1 20 18009 1 1 59 LYS CB C -12.720 -14.027 -12.090 1.00 . A A . 59 LYS CB 1 1 20 18010 1 1 59 LYS CD C -14.611 -12.845 -13.241 1.00 . A A . 59 LYS CD 1 1 20 18011 1 1 59 LYS CE C -15.760 -13.559 -13.935 1.00 . A A . 59 LYS CE 1 1 20 18012 1 1 59 LYS CG C -14.169 -13.584 -11.991 1.00 . A A . 59 LYS CG 1 1 20 18013 1 1 59 LYS H H -11.411 -14.285 -9.568 1.00 . A A . 59 LYS H 1 1 20 18014 1 1 59 LYS HA H -13.201 -15.927 -11.224 1.00 . A A . 59 LYS HA 1 1 20 18015 1 1 59 LYS HB2 H -12.094 -13.194 -11.811 1.00 . A A . 59 LYS HB2 1 1 20 18016 1 1 59 LYS HB3 H -12.518 -14.291 -13.117 1.00 . A A . 59 LYS HB3 1 1 20 18017 1 1 59 LYS HD2 H -14.931 -11.851 -12.965 1.00 . A A . 59 LYS HD2 1 1 20 18018 1 1 59 LYS HD3 H -13.775 -12.781 -13.922 1.00 . A A . 59 LYS HD3 1 1 20 18019 1 1 59 LYS HE2 H -15.911 -14.517 -13.461 1.00 . A A . 59 LYS HE2 1 1 20 18020 1 1 59 LYS HE3 H -16.653 -12.962 -13.831 1.00 . A A . 59 LYS HE3 1 1 20 18021 1 1 59 LYS HG2 H -14.795 -14.455 -11.859 1.00 . A A . 59 LYS HG2 1 1 20 18022 1 1 59 LYS HG3 H -14.278 -12.929 -11.138 1.00 . A A . 59 LYS HG3 1 1 20 18023 1 1 59 LYS HZ1 H -14.509 -14.109 -15.514 1.00 . A A . 59 LYS HZ1 1 1 20 18024 1 1 59 LYS HZ2 H -15.611 -12.882 -15.904 1.00 . A A . 59 LYS HZ2 1 1 20 18025 1 1 59 LYS HZ3 H -16.145 -14.491 -15.763 1.00 . A A . 59 LYS HZ3 1 1 20 18026 1 1 59 LYS N N -12.217 -14.786 -9.818 1.00 . A A . 59 LYS N 1 1 20 18027 1 1 59 LYS NZ N -15.487 -13.776 -15.378 1.00 . A A . 59 LYS NZ 1 1 20 18028 1 1 59 LYS O O -11.168 -17.045 -12.183 1.00 . A A . 59 LYS O 1 1 20 18029 1 1 60 GLY C C -7.535 -15.047 -11.422 1.00 . A A . 60 GLY C 1 1 20 18030 1 1 60 GLY CA C -8.723 -15.807 -11.974 1.00 . A A . 60 GLY CA 1 1 20 18031 1 1 60 GLY H H -10.000 -14.348 -11.122 1.00 . A A . 60 GLY H 1 1 20 18032 1 1 60 GLY HA2 H -8.668 -16.834 -11.646 1.00 . A A . 60 GLY HA2 1 1 20 18033 1 1 60 GLY HA3 H -8.683 -15.780 -13.054 1.00 . A A . 60 GLY HA3 1 1 20 18034 1 1 60 GLY N N -9.984 -15.243 -11.540 1.00 . A A . 60 GLY N 1 1 20 18035 1 1 60 GLY O O -7.261 -13.921 -11.838 1.00 . A A . 60 GLY O 1 1 20 18036 1 1 61 LYS C C -4.499 -16.047 -9.875 1.00 . A A . 61 LYS C 1 1 20 18037 1 1 61 LYS CA C -5.653 -15.050 -9.886 1.00 . A A . 61 LYS CA 1 1 20 18038 1 1 61 LYS CB C -5.956 -14.584 -8.459 1.00 . A A . 61 LYS CB 1 1 20 18039 1 1 61 LYS CD C -5.602 -12.158 -9.046 1.00 . A A . 61 LYS CD 1 1 20 18040 1 1 61 LYS CE C -4.415 -11.798 -8.168 1.00 . A A . 61 LYS CE 1 1 20 18041 1 1 61 LYS CG C -6.517 -13.171 -8.375 1.00 . A A . 61 LYS CG 1 1 20 18042 1 1 61 LYS H H -7.085 -16.571 -10.211 1.00 . A A . 61 LYS H 1 1 20 18043 1 1 61 LYS HA H -5.375 -14.197 -10.488 1.00 . A A . 61 LYS HA 1 1 20 18044 1 1 61 LYS HB2 H -6.674 -15.258 -8.017 1.00 . A A . 61 LYS HB2 1 1 20 18045 1 1 61 LYS HB3 H -5.044 -14.618 -7.881 1.00 . A A . 61 LYS HB3 1 1 20 18046 1 1 61 LYS HD2 H -5.236 -12.577 -9.971 1.00 . A A . 61 LYS HD2 1 1 20 18047 1 1 61 LYS HD3 H -6.168 -11.261 -9.256 1.00 . A A . 61 LYS HD3 1 1 20 18048 1 1 61 LYS HE2 H -4.457 -10.743 -7.945 1.00 . A A . 61 LYS HE2 1 1 20 18049 1 1 61 LYS HE3 H -4.479 -12.362 -7.250 1.00 . A A . 61 LYS HE3 1 1 20 18050 1 1 61 LYS HG2 H -7.480 -13.149 -8.865 1.00 . A A . 61 LYS HG2 1 1 20 18051 1 1 61 LYS HG3 H -6.635 -12.903 -7.336 1.00 . A A . 61 LYS HG3 1 1 20 18052 1 1 61 LYS HZ1 H -2.599 -12.829 -8.295 1.00 . A A . 61 LYS HZ1 1 1 20 18053 1 1 61 LYS HZ2 H -2.533 -11.241 -8.887 1.00 . A A . 61 LYS HZ2 1 1 20 18054 1 1 61 LYS HZ3 H -3.286 -12.454 -9.801 1.00 . A A . 61 LYS HZ3 1 1 20 18055 1 1 61 LYS N N -6.829 -15.662 -10.485 1.00 . A A . 61 LYS N 1 1 20 18056 1 1 61 LYS NZ N -3.119 -12.100 -8.832 1.00 . A A . 61 LYS NZ 1 1 20 18057 1 1 61 LYS O O -4.530 -16.990 -10.693 1.00 . A A . 61 LYS O 1 1 20 18058 1 1 61 LYS OXT O -3.579 -15.897 -9.043 1.00 . A A . 61 LYS OXT 1 1 20 18059 2 2 1 ZN ZN ZN -4.553 -3.931 -1.488 1.00 . B A . 62 ZN ZN 1 1 20 18060 3 2 1 ZN ZN ZN 4.451 4.148 3.684 1.00 . C A . 63 ZN ZN 1 1 stop_ save_
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